#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ht2 s THR 2 N 0.00 1.48 -0.11 1.09 2.01 -1.26 -1.76 115.64 117.08 1ht2 s THR 2 Ca 0.00 -0.94 -0.01 0.00 0.31 0.00 0.00 61.69 61.05 1ht2 s THR 2 Cb 0.00 -1.26 0.03 0.00 0.01 0.00 0.00 72.50 71.28 1ht2 s THR 2 CO 0.00 0.29 -0.07 -0.63 -0.69 0.00 0.00 174.62 173.53 1ht2 s ILE 3 N -0.60 0.96 0.02 1.82 -1.09 -1.03 -2.52 121.20 118.77 1ht2 s ILE 3 Ca 0.07 -0.27 0.09 0.00 -2.23 0.00 0.00 60.65 58.31 1ht2 s ILE 3 Cb -0.08 -1.01 -0.03 0.00 -1.58 0.00 0.00 42.46 39.77 1ht2 s ILE 3 CO 0.00 0.34 -0.26 -0.69 -1.23 0.00 0.00 174.94 173.11 1ht2 s VAL 4 N 1.73 2.16 -0.17 2.92 1.01 0.19 -2.14 120.40 126.09 1ht2 s VAL 4 Ca 0.05 -1.29 -0.05 0.00 0.00 0.00 0.00 61.98 60.69 1ht2 s VAL 4 Cb -0.13 -1.81 0.06 0.00 0.00 0.00 0.00 36.38 34.50 1ht2 s VAL 4 CO -0.08 0.43 0.11 -0.55 0.00 0.00 0.00 175.10 175.01 1ht2 s SER 5 N -1.06 2.24 0.20 3.32 0.15 0.34 0.38 113.70 119.27 1ht2 s SER 5 Ca 0.11 -0.57 0.06 0.00 0.70 0.00 0.00 55.95 56.25 1ht2 s SER 5 Cb -0.10 -0.17 -0.04 0.00 -1.71 0.00 0.00 66.02 64.00 1ht2 s SER 5 CO 0.01 -0.35 0.17 -0.69 1.20 0.00 0.00 173.24 173.58 1ht2 s VAL 6 N 2.16 4.52 -0.02 4.45 1.01 -1.20 -1.78 120.40 129.53 1ht2 s VAL 6 Ca 0.03 -1.19 -0.00 0.00 0.00 0.00 0.00 61.98 60.81 1ht2 s VAL 6 Cb -0.16 -3.36 0.03 0.00 0.00 0.00 0.00 36.38 32.89 1ht2 s VAL 6 CO -0.10 -0.21 0.03 -0.60 0.00 0.00 0.00 175.10 174.23 1ht2 s ARG 7 N -3.41 -0.04 -0.30 2.72 3.52 -1.26 -1.42 118.95 118.76 1ht2 s ARG 7 Ca 0.32 0.20 -0.16 0.00 -0.13 0.00 0.00 55.73 55.96 1ht2 s ARG 7 Cb -0.09 -0.26 0.16 0.00 -1.56 0.00 0.00 34.95 33.20 1ht2 s ARG 7 CO 0.24 -0.18 1.03 0.50 -0.81 0.00 0.00 175.30 176.09 1ht2 s ARG 8 N 1.12 0.29 -0.68 5.12 3.52 0.26 -4.91 118.95 123.67 1ht2 s ARG 8 Ca -0.08 0.59 -0.00 0.00 -0.13 0.00 0.00 55.73 56.10 1ht2 s ARG 8 Cb -0.13 0.22 -0.00 0.00 -1.56 0.00 0.00 34.95 33.47 1ht2 s ARG 8 CO -0.03 -0.08 0.64 0.09 -0.81 0.00 0.00 175.30 175.11 1ht2 n ASN 9 N 4.22 -7.10 -2.28 -2.12 3.02 -1.26 -2.94 115.26 106.80 1ht2 n ASN 9 Ca -0.14 -0.11 -0.08 0.00 -0.03 0.00 0.00 54.58 54.23 1ht2 n ASN 9 Cb 0.55 -4.84 -0.01 0.00 -0.61 0.00 0.00 39.78 34.88 1ht2 n ASN 9 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1ht2 n GLY 10 N -1.65 -0.32 2.75 7.41 0.00 -1.26 -4.88 105.19 107.23 1ht2 n GLY 10 Ca -0.00 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.83 1ht2 n GLY 10 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1ht2 s HIS 11 N -2.28 0.24 -0.07 1.61 3.76 -1.15 -0.77 115.29 116.63 1ht2 s HIS 11 Ca 0.00 0.09 -0.01 0.00 -0.15 0.00 0.00 55.06 54.99 1ht2 s HIS 11 Cb 0.00 -0.48 0.03 0.00 1.11 0.00 0.00 32.58 33.24 1ht2 s HIS 11 CO 0.00 -0.18 -0.01 0.54 -0.85 0.00 0.00 174.74 174.23 1ht2 s VAL 12 N 1.62 0.46 0.47 -0.90 0.11 -1.01 0.89 120.40 122.05 1ht2 s VAL 12 Ca -0.02 0.04 0.06 0.00 -2.93 0.00 0.00 61.98 59.13 1ht2 s VAL 12 Cb -0.13 -0.58 -0.01 0.00 -1.53 0.00 0.00 36.38 34.14 1ht2 s VAL 12 CO -0.03 0.26 0.32 0.68 -3.33 0.00 0.00 175.10 173.00 1ht2 s VAL 13 N 1.72 2.09 -0.23 2.04 -7.23 -0.51 -2.28 120.40 116.00 1ht2 s VAL 13 Ca 0.02 -1.53 -0.04 0.00 -1.81 0.00 0.00 61.98 58.61 1ht2 s VAL 13 Cb -0.13 -2.62 0.12 0.00 0.56 0.00 0.00 36.38 34.31 1ht2 s VAL 13 CO -0.04 0.00 0.39 -0.63 -0.31 0.00 0.00 175.10 174.50 1ht2 s ILE 14 N -2.65 -0.61 -0.08 -0.62 1.01 -1.06 -3.25 121.20 113.93 1ht2 s ILE 14 Ca 0.39 0.01 0.03 0.00 0.00 0.00 0.00 60.65 61.08 1ht2 s ILE 14 Cb -0.00 -0.76 -0.02 0.00 0.01 0.00 0.00 42.46 41.69 1ht2 s ILE 14 CO 0.23 -0.06 -0.18 0.00 0.00 0.00 0.00 174.94 174.93 1ht2 s ALA 15 N 2.56 2.46 0.18 9.38 0.00 0.16 -2.34 121.76 134.16 1ht2 s ALA 15 Ca 0.09 -0.97 0.04 0.00 0.00 0.00 0.00 51.96 51.12 1ht2 s ALA 15 Cb -0.14 -0.95 -0.05 0.00 0.00 0.00 0.00 23.12 21.97 1ht2 s ALA 15 CO -0.15 0.39 -0.07 0.20 0.00 0.00 0.00 175.76 176.13 1ht2 s GLY 16 N -0.11 1.25 0.00 0.00 0.00 -0.99 0.55 107.32 108.03 1ht2 s GLY 16 Ca -0.03 -1.60 0.00 0.00 0.00 0.00 0.00 44.72 43.09 1ht2 s GLY 16 CO 0.04 -1.62 0.00 2.09 0.00 0.00 0.00 173.10 173.61 1ht2 n ASP 17 N -0.28 0.00 -1.27 1.64 5.75 -1.05 -2.67 116.55 118.68 1ht2 n ASP 17 Ca -0.08 -0.10 0.03 0.00 -0.01 0.00 0.00 54.79 54.62 1ht2 n ASP 17 Cb 0.62 0.00 0.01 0.00 -1.03 0.00 0.00 41.12 40.72 1ht2 n ASP 17 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1ht2 n GLY 18 N 5.00 0.88 3.86 6.12 0.00 -0.95 -4.39 105.19 115.72 1ht2 n GLY 18 Ca 0.00 -0.63 -0.35 0.00 0.00 0.00 0.00 46.02 45.03 1ht2 n GLY 18 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1ht2 s GLN 19 N 0.00 3.77 -0.05 1.61 0.74 -1.26 -1.56 119.66 122.91 1ht2 s GLN 19 Ca 0.25 0.19 0.02 0.00 0.05 0.00 0.00 55.36 55.87 1ht2 s GLN 19 Cb 0.29 -3.03 0.01 0.00 1.10 0.00 0.00 33.01 31.38 1ht2 s GLN 19 CO -0.13 0.58 -0.10 0.00 -0.55 0.00 0.00 175.29 175.10 1ht2 s ALA 20 N -1.35 1.05 -0.04 1.58 0.00 -0.77 -4.74 121.76 117.48 1ht2 s ALA 20 Ca 0.31 -0.31 0.05 0.00 0.00 0.00 0.00 51.96 52.01 1ht2 s ALA 20 Cb -0.14 -0.49 -0.01 0.00 0.00 0.00 0.00 23.12 22.49 1ht2 s ALA 20 CO 0.17 0.09 -0.18 0.99 0.00 0.00 0.00 175.76 176.83 1ht2 s THR 21 N 0.64 1.50 -0.29 0.00 2.01 -1.26 -0.58 115.64 117.66 1ht2 s THR 21 Ca -0.12 -0.76 0.02 0.00 0.31 0.00 0.00 61.69 61.14 1ht2 s THR 21 Cb -0.14 -1.28 0.08 0.00 0.01 0.00 0.00 72.50 71.16 1ht2 s THR 21 CO 0.02 0.43 -0.01 -0.22 -0.69 0.00 0.00 174.62 174.16 1ht2 s LEU 22 N -0.03 3.58 0.00 4.42 0.20 -0.34 -4.90 118.68 121.60 1ht2 s LEU 22 Ca -0.03 -1.67 0.00 0.00 0.69 0.00 0.00 54.13 53.12 1ht2 s LEU 22 Cb -0.11 -1.40 0.00 0.00 -0.43 0.00 0.00 46.19 44.25 1ht2 s LEU 22 CO 0.02 -0.30 0.00 0.61 -0.29 0.00 0.00 176.35 176.39 1ht2 n GLY 23 N 4.48 2.36 0.42 7.98 0.00 -1.26 -2.56 105.19 116.61 1ht2 n GLY 23 Ca -0.05 -0.34 0.09 0.00 0.00 0.00 0.00 46.02 45.71 1ht2 n GLY 23 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1ht2 n ASN 24 N 9.25 2.97 -4.28 1.61 3.02 -1.26 -5.01 115.26 121.57 1ht2 n ASN 24 Ca 0.00 -2.97 -0.25 0.00 -0.03 0.00 0.00 54.58 51.33 1ht2 n ASN 24 Cb 0.00 -0.45 -0.13 0.00 -0.61 0.00 0.00 39.78 38.59 1ht2 n ASN 24 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 1ht2 s THR 25 N -2.70 1.71 -0.28 3.41 -4.23 -1.06 -5.11 115.64 107.39 1ht2 s THR 25 Ca 0.34 -1.44 -0.26 0.00 -1.18 0.00 0.00 61.69 59.15 1ht2 s THR 25 Cb 0.29 -1.54 0.00 0.00 1.34 0.00 0.00 72.50 72.60 1ht2 s THR 25 CO 0.06 0.03 0.91 -0.69 -0.54 0.00 0.00 174.62 174.39 1ht2 s VAL 26 N -1.04 4.72 -0.11 2.29 1.01 -1.26 -1.20 120.40 124.80 1ht2 s VAL 26 Ca 0.07 1.59 -0.05 0.00 0.00 0.00 0.00 61.98 63.59 1ht2 s VAL 26 Cb -0.10 -4.23 -0.03 0.00 0.00 0.00 0.00 36.38 32.02 1ht2 s VAL 26 CO 0.03 -0.24 0.02 -0.03 0.00 0.00 0.00 175.10 174.89 1ht2 h MET 27 N 7.85 0.00 -6.23 2.72 4.05 -1.19 -3.48 114.93 118.65 1ht2 h MET 27 Ca -0.22 0.00 -0.58 0.00 -0.28 0.00 0.00 59.70 58.62 1ht2 h MET 27 Cb 1.08 0.00 -0.18 0.00 -0.80 0.00 0.00 31.60 31.70 1ht2 h MET 27 CO 0.93 0.09 -0.80 0.21 0.23 0.00 0.00 176.91 177.58 1ht2 s LYS 28 N -1.77 1.38 0.00 0.39 2.20 -1.20 -4.99 119.74 115.75 1ht2 s LYS 28 Ca -0.05 -1.45 0.00 0.00 -0.36 0.00 0.00 55.97 54.10 1ht2 s LYS 28 Cb 0.00 -1.56 0.00 0.00 -1.51 0.00 0.00 37.83 34.77 1ht2 s LYS 28 CO 0.11 0.33 0.00 0.41 -0.36 0.00 0.00 175.35 175.84 1ht2 n GLY 29 N 0.29 0.69 2.27 5.54 0.00 -1.24 -1.84 105.19 110.90 1ht2 n GLY 29 Ca -0.13 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.63 1ht2 n GLY 29 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1ht2 n ASN 30 N -1.14 4.89 -4.72 1.61 2.04 -0.94 -4.22 115.26 112.78 1ht2 n ASN 30 Ca 0.00 -3.74 -0.42 0.00 -0.44 0.00 0.00 54.58 49.99 1ht2 n ASN 30 Cb 0.00 -0.42 -0.03 0.00 -2.53 0.00 0.00 39.78 36.80 1ht2 n ASN 30 CO 0.00 0.00 0.00 -0.69 -0.44 0.00 0.00 177.26 176.13 1ht2 s VAL 31 N -5.08 4.03 -0.80 3.53 1.01 -0.60 -4.97 120.40 117.52 1ht2 s VAL 31 Ca 0.50 1.54 -0.22 0.00 0.00 0.00 0.00 61.98 63.79 1ht2 s VAL 31 Cb 0.41 -3.98 0.08 0.00 0.00 0.00 0.00 36.38 32.88 1ht2 s VAL 31 CO -0.08 0.17 1.12 -0.75 0.00 0.00 0.00 175.10 175.56 1ht2 s LYS 32 N 0.60 3.33 0.00 2.72 2.20 -1.26 -4.27 119.74 123.06 1ht2 s LYS 32 Ca 0.55 -1.06 0.21 0.00 -0.36 0.00 0.00 55.97 55.31 1ht2 s LYS 32 Cb -0.29 -4.58 0.54 0.00 -1.51 0.00 0.00 37.83 31.99 1ht2 s LYS 32 CO 0.31 -1.91 1.46 1.63 -0.36 0.00 0.00 175.35 176.48 1ht2 n LYS 33 N 7.78 2.41 -4.04 4.03 5.02 -1.26 -4.87 118.16 127.22 1ht2 n LYS 33 Ca 0.10 -2.17 -0.15 0.00 -2.02 0.00 0.00 58.31 54.07 1ht2 n LYS 33 Cb 0.48 -1.49 -0.15 0.00 -0.02 0.00 0.00 35.03 33.85 1ht2 n LYS 33 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1ht2 s VAL 34 N -1.31 0.27 0.35 -0.18 1.01 -1.26 -1.44 120.40 117.83 1ht2 s VAL 34 Ca 0.40 -0.10 -0.13 0.00 0.00 0.00 0.00 61.98 62.15 1ht2 s VAL 34 Cb 0.22 -0.26 0.03 0.00 0.00 0.00 0.00 36.38 36.37 1ht2 s VAL 34 CO 0.29 0.10 0.68 0.00 0.00 0.00 0.00 175.10 176.17 1ht2 s ARG 35 N 0.16 2.03 0.07 2.72 1.70 -0.21 -4.95 118.95 120.48 1ht2 s ARG 35 Ca -0.01 -1.43 0.07 0.00 -0.47 0.00 0.00 55.73 53.89 1ht2 s ARG 35 Cb -0.04 0.57 -0.04 0.00 -0.57 0.00 0.00 34.95 34.87 1ht2 s ARG 35 CO -0.00 -0.92 -0.16 1.03 -1.08 0.00 0.00 175.30 174.17 1ht2 s ARG 36 N -2.88 2.04 0.10 3.89 0.52 -1.26 -1.01 118.95 120.35 1ht2 s ARG 36 Ca 0.19 -1.02 -0.09 0.00 -0.52 0.00 0.00 55.73 54.29 1ht2 s ARG 36 Cb -0.04 -2.22 -0.00 0.00 0.52 0.00 0.00 34.95 33.21 1ht2 s ARG 36 CO 0.13 0.52 0.20 -0.48 0.02 0.00 0.00 175.30 175.69 1ht2 s LEU 37 N -1.77 1.36 -0.45 2.53 2.34 -0.24 -4.87 118.68 117.57 1ht2 s LEU 37 Ca 0.17 -0.68 -0.07 0.00 0.06 0.00 0.00 54.13 53.61 1ht2 s LEU 37 Cb -0.11 1.06 0.01 0.00 -0.56 0.00 0.00 46.19 46.59 1ht2 s LEU 37 CO 0.08 -0.75 0.51 0.00 -1.06 0.00 0.00 176.35 175.13 1ht2 n TYR 38 N -0.08 -2.57 -3.97 3.48 9.36 -1.26 -2.66 117.16 119.45 1ht2 n TYR 38 Ca -0.14 1.01 -0.32 0.00 3.32 0.00 0.00 57.90 61.77 1ht2 n TYR 38 Cb 0.62 -3.55 -0.03 0.00 -0.63 0.00 0.00 39.34 35.75 1ht2 n TYR 38 CO 0.00 0.00 0.00 -1.71 0.22 0.00 0.00 176.86 175.37 1ht2 n ASN 39 N -0.91 -3.02 -0.97 2.98 5.15 -1.26 -1.50 115.26 115.73 1ht2 n ASN 39 Ca 0.05 -0.81 -0.13 0.00 -0.60 0.00 0.00 54.58 53.10 1ht2 n ASN 39 Cb 0.42 -2.51 -0.05 0.00 -0.53 0.00 0.00 39.78 37.11 1ht2 n ASN 39 CO 0.00 0.00 0.00 0.47 1.40 0.00 0.00 177.26 179.13 1ht2 n ASP 40 N -2.45 -5.68 0.02 1.20 9.92 -1.25 -4.83 116.55 113.48 1ht2 n ASP 40 Ca 0.06 0.31 -0.19 0.00 -0.53 0.00 0.00 54.79 54.45 1ht2 n ASP 40 Cb 0.49 -4.29 -0.14 0.00 -0.64 0.00 0.00 41.12 36.54 1ht2 n ASP 40 CO 0.00 0.00 0.00 0.11 0.13 0.00 0.00 177.20 177.44 1ht2 h LYS 41 N 0.00 0.24 -5.36 -1.24 1.57 -1.37 -3.46 116.57 106.94 1ht2 h LYS 41 Ca -0.26 -0.41 -0.62 0.00 -1.87 0.00 0.00 60.65 57.50 1ht2 h LYS 41 Cb 1.21 0.15 -0.11 0.00 0.08 0.00 0.00 32.23 33.56 1ht2 h LYS 41 CO 0.38 1.09 -0.49 0.08 -0.57 0.00 0.00 179.45 179.93 1ht2 s VAL 42 N -2.58 5.38 -0.18 0.50 1.01 -1.09 -4.62 120.40 118.82 1ht2 s VAL 42 Ca -0.16 0.17 -0.01 0.00 0.00 0.00 0.00 61.98 61.99 1ht2 s VAL 42 Cb 0.07 -3.42 0.00 0.00 0.00 0.00 0.00 36.38 33.02 1ht2 s VAL 42 CO 0.81 0.48 -0.14 0.27 0.00 0.00 0.00 175.10 176.52 1ht2 s ILE 43 N 0.03 2.68 0.09 2.22 -0.00 -0.71 -1.07 121.20 124.43 1ht2 s ILE 43 Ca 0.09 -0.75 0.10 0.00 -0.00 0.00 0.00 60.65 60.09 1ht2 s ILE 43 Cb -0.11 -2.16 -0.03 0.00 -0.00 0.00 0.00 42.46 40.16 1ht2 s ILE 43 CO -0.00 0.50 -0.25 0.00 -0.00 0.00 0.00 174.94 175.18 1ht2 s ALA 44 N 1.11 2.18 0.17 2.27 0.00 -0.18 -2.01 121.76 125.30 1ht2 s ALA 44 Ca 0.00 -1.32 0.07 0.00 0.00 0.00 0.00 51.96 50.72 1ht2 s ALA 44 Cb -0.14 -0.39 -0.04 0.00 0.00 0.00 0.00 23.12 22.55 1ht2 s ALA 44 CO -0.04 0.49 -0.15 0.20 0.00 0.00 0.00 175.76 176.26 1ht2 s GLY 45 N -1.66 1.31 0.24 0.00 0.00 0.66 -1.04 107.32 106.83 1ht2 s GLY 45 Ca 0.11 -1.50 -0.06 0.00 0.00 0.00 0.00 44.72 43.27 1ht2 s GLY 45 CO 0.04 -1.58 0.33 -0.11 0.00 0.00 0.00 173.10 171.79 1ht2 s PHE 46 N -2.49 0.80 -0.16 1.90 -0.71 -0.52 -0.54 117.98 116.26 1ht2 s PHE 46 Ca 0.17 -1.08 -0.03 0.00 -1.04 0.00 0.00 56.93 54.94 1ht2 s PHE 46 Cb -0.03 -0.17 0.05 0.00 -1.21 0.00 0.00 43.02 41.66 1ht2 s PHE 46 CO 0.05 -0.86 0.05 0.00 -1.34 0.00 0.00 175.22 173.12 1ht2 s ALA 47 N -3.95 0.69 0.00 1.99 0.00 -0.48 -4.90 121.76 115.11 1ht2 s ALA 47 Ca 0.31 -0.42 0.00 0.00 0.00 0.00 0.00 51.96 51.85 1ht2 s ALA 47 Cb 0.03 -1.04 0.00 0.00 0.00 0.00 0.00 23.12 22.11 1ht2 s ALA 47 CO 0.12 -1.05 0.00 0.41 0.00 0.00 0.00 175.76 175.24 1ht2 n GLY 48 N 5.17 0.78 3.76 0.00 0.00 -1.26 -1.19 105.19 112.44 1ht2 n GLY 48 Ca -0.08 -1.73 -0.41 0.00 0.00 0.00 0.00 46.02 43.81 1ht2 n GLY 48 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1ht2 s GLY 49 N 0.00 2.82 0.08 -0.02 0.00 -1.26 -4.94 107.32 104.00 1ht2 s GLY 49 Ca 0.00 1.25 -0.31 0.00 0.00 0.00 0.00 44.72 45.66 1ht2 s GLY 49 CO 0.00 1.99 1.65 -0.84 0.00 0.00 0.00 173.10 175.89 1ht2 h THR 50 N 3.21 0.45 0.00 0.90 2.02 -1.98 -1.38 112.91 116.13 1ht2 h THR 50 Ca -0.48 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 66.70 1ht2 h THR 50 Cb 1.22 0.45 -0.00 0.00 -1.74 0.00 0.00 68.15 68.09 1ht2 h THR 50 CO 0.69 0.00 -0.01 0.00 0.37 0.00 0.00 175.52 176.57 1ht2 h ALA 51 N -0.24 1.96 0.13 6.16 0.00 -1.98 0.41 119.26 125.71 1ht2 h ALA 51 Ca -0.07 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 1ht2 h ALA 51 Cb 0.56 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.35 1ht2 h ALA 51 CO 0.10 0.02 -0.06 -0.44 0.00 0.00 0.00 179.25 178.87 1ht2 h ASP 52 N 0.00 -0.15 -0.18 0.00 3.45 -1.83 0.11 116.42 117.82 1ht2 h ASP 52 Ca -0.00 -0.22 0.01 0.00 0.43 0.00 0.00 57.03 57.25 1ht2 h ASP 52 Cb 0.02 0.04 -0.01 0.00 -0.56 0.00 0.00 39.33 38.82 1ht2 h ASP 52 CO 0.00 0.14 0.09 0.00 -1.57 0.00 0.00 179.24 177.90 1ht2 h ALA 53 N 0.38 0.21 -0.40 3.45 0.00 -0.44 0.21 119.26 122.67 1ht2 h ALA 53 Ca -0.02 0.00 0.04 0.00 0.00 0.00 0.00 54.91 54.94 1ht2 h ALA 53 Cb 0.36 -0.04 -0.06 0.00 0.00 0.00 0.00 17.79 18.04 1ht2 h ALA 53 CO 0.03 -0.33 -0.39 0.35 0.00 0.00 0.00 179.25 178.91 1ht2 h PHE 54 N 0.20 -1.20 -0.29 0.00 -0.00 -0.03 0.78 116.94 116.41 1ht2 h PHE 54 Ca 0.07 0.07 0.07 0.00 -0.00 0.00 0.00 57.97 58.17 1ht2 h PHE 54 Cb 0.01 0.58 -0.08 0.00 -0.00 0.00 0.00 35.95 36.46 1ht2 h PHE 54 CO -0.09 -0.31 -0.26 1.15 -0.00 0.00 0.00 178.31 178.81 1ht2 h THR 55 N -0.19 0.35 0.77 4.41 2.02 -0.33 0.78 112.91 120.73 1ht2 h THR 55 Ca 0.07 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.21 1ht2 h THR 55 Cb 0.36 0.35 -0.00 0.00 -1.74 0.00 0.00 68.15 67.12 1ht2 h THR 55 CO -0.48 0.00 -0.45 -0.07 0.37 0.00 0.00 175.52 174.89 1ht2 h LEU 56 N -0.25 -1.14 -2.19 2.58 3.38 0.10 -1.47 115.31 116.34 1ht2 h LEU 56 Ca 0.15 0.06 0.06 0.00 0.09 0.00 0.00 57.88 58.24 1ht2 h LEU 56 Cb 0.48 0.33 -0.01 0.00 0.09 0.00 0.00 40.66 41.55 1ht2 h LEU 56 CO -0.43 -0.71 0.21 -0.26 0.09 0.00 0.00 178.44 177.34 1ht2 h PHE 57 N -1.14 0.00 -0.18 1.13 0.04 0.60 0.23 116.94 117.61 1ht2 h PHE 57 Ca -0.10 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.65 1ht2 h PHE 57 Cb 0.91 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 39.05 1ht2 h PHE 57 CO -0.07 0.00 0.07 1.49 -0.60 0.00 0.00 178.31 179.20 1ht2 h GLU 58 N 0.00 0.28 -0.28 1.51 4.57 -0.15 -0.70 114.58 119.80 1ht2 h GLU 58 Ca 0.10 -0.05 -0.11 0.00 -1.18 0.00 0.00 59.36 58.12 1ht2 h GLU 58 Cb 0.52 -0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 29.06 1ht2 h GLU 58 CO -0.00 0.36 -0.25 1.25 -1.18 0.00 0.00 179.01 179.19 1ht2 h LEU 59 N 0.14 0.71 -1.81 1.64 5.85 -0.03 -2.56 115.31 119.26 1ht2 h LEU 59 Ca 0.06 -0.46 0.21 0.00 0.84 0.00 0.00 57.88 58.53 1ht2 h LEU 59 Cb 0.19 -0.20 -0.04 0.00 0.37 0.00 0.00 40.66 40.97 1ht2 h LEU 59 CO -0.00 1.02 0.55 0.15 -0.34 0.00 0.00 178.44 179.82 1ht2 h PHE 60 N 0.41 0.22 0.03 1.25 3.57 -0.87 -0.54 116.94 121.01 1ht2 h PHE 60 Ca 0.05 0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.56 1ht2 h PHE 60 Cb 0.81 -0.07 -0.00 0.00 2.79 0.00 0.00 35.95 39.48 1ht2 h PHE 60 CO 0.07 0.06 -0.03 0.93 -2.23 0.00 0.00 178.31 177.11 1ht2 h GLU 61 N 0.17 -0.06 0.00 1.11 4.39 -0.69 -2.63 114.58 116.87 1ht2 h GLU 61 Ca 0.39 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 60.10 1ht2 h GLU 61 Cb 1.29 0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 29.96 1ht2 h GLU 61 CO -0.07 -0.04 -0.01 0.00 -1.16 0.00 0.00 179.01 177.73 1ht2 h ARG 62 N -0.06 0.00 0.00 2.33 3.08 -1.44 -1.93 114.38 116.35 1ht2 h ARG 62 Ca -0.00 0.00 -0.07 0.00 0.07 0.00 0.00 59.98 59.97 1ht2 h ARG 62 Cb 0.06 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.09 1ht2 h ARG 62 CO -0.00 0.01 -0.36 0.87 -1.07 0.00 0.00 179.97 179.42 1ht2 h LYS 63 N 0.00 0.00 0.00 0.04 1.79 -0.81 -1.25 116.57 116.34 1ht2 h LYS 63 Ca -0.00 0.00 -0.03 0.00 -2.18 0.00 0.00 60.65 58.44 1ht2 h LYS 63 Cb 0.03 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 30.67 1ht2 h LYS 63 CO 0.00 0.36 -0.21 -0.07 -1.08 0.00 0.00 179.45 178.45 1ht2 h LEU 64 N 0.00 0.00 -2.50 2.94 3.38 -1.00 -2.65 115.31 115.48 1ht2 h LEU 64 Ca -0.00 -0.48 0.00 0.00 0.09 0.00 0.00 57.88 57.48 1ht2 h LEU 64 Cb 0.72 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.47 1ht2 h LEU 64 CO 0.05 0.86 0.00 1.05 0.09 0.00 0.00 178.44 180.49 1ht2 h GLU 65 N -1.00 0.00 0.22 1.13 4.11 -1.59 3.06 114.58 120.50 1ht2 h GLU 65 Ca -0.04 0.00 -0.29 0.00 0.07 0.00 0.00 59.36 59.10 1ht2 h GLU 65 Cb 0.63 0.00 0.03 0.00 0.50 0.00 0.00 28.75 29.92 1ht2 h GLU 65 CO -0.03 0.00 -1.26 1.98 0.07 0.00 0.00 179.01 179.77 1ht2 h MET 66 N 0.00 0.46 -2.29 1.06 4.05 -1.28 -3.37 114.93 113.56 1ht2 h MET 66 Ca 0.00 -0.79 -0.63 0.00 -0.28 0.00 0.00 59.70 58.00 1ht2 h MET 66 Cb 0.00 0.29 -0.40 0.00 -0.80 0.00 0.00 31.60 30.70 1ht2 h MET 66 CO 0.00 1.38 -0.37 0.72 0.23 0.00 0.00 176.91 178.87 1ht2 n HIS 67 N -3.86 3.82 -3.93 1.39 8.25 0.09 -4.93 115.22 116.05 1ht2 n HIS 67 Ca -0.16 -3.79 -0.30 0.00 -0.26 0.00 0.00 57.72 53.22 1ht2 n HIS 67 Cb 1.01 -0.61 0.01 0.00 1.12 0.00 0.00 29.99 31.52 1ht2 n HIS 67 CO 0.00 0.00 0.00 1.04 0.64 0.00 0.00 176.34 178.02 1ht2 n GLN 68 N -0.09 -0.53 -1.57 -0.41 6.02 -0.60 0.10 117.38 120.29 1ht2 n GLN 68 Ca 0.33 -0.12 0.00 0.00 -0.01 0.00 0.00 57.00 57.20 1ht2 n GLN 68 Cb 0.37 -1.22 0.00 0.00 1.02 0.00 0.00 30.24 30.41 1ht2 n GLN 68 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1ht2 n GLY 69 N -1.66 -0.26 3.58 1.08 0.00 1.00 -4.75 105.19 104.18 1ht2 n GLY 69 Ca -0.08 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.53 1ht2 n GLY 69 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1ht2 s HIS 70 N -1.15 1.98 0.07 1.61 2.46 0.11 -4.88 115.29 115.49 1ht2 s HIS 70 Ca 0.00 0.64 -0.16 0.00 0.47 0.00 0.00 55.06 56.02 1ht2 s HIS 70 Cb 0.00 -4.21 -0.05 0.00 -0.13 0.00 0.00 32.58 28.20 1ht2 s HIS 70 CO 0.00 -2.40 1.26 1.25 -2.47 0.00 0.00 174.74 172.38 1ht2 h LEU 71 N 14.00 -0.94 -0.22 8.88 7.12 -1.88 -1.39 115.31 140.89 1ht2 h LEU 71 Ca -0.29 0.13 0.02 0.00 0.13 0.00 0.00 57.88 57.87 1ht2 h LEU 71 Cb 1.14 0.39 -0.02 0.00 -0.53 0.00 0.00 40.66 41.64 1ht2 h LEU 71 CO 1.12 -0.17 0.08 0.58 -0.13 0.00 0.00 178.44 179.92 1ht2 h VAL 72 N -0.14 0.95 -0.30 1.05 2.07 -1.94 -1.50 116.25 116.45 1ht2 h VAL 72 Ca 0.05 -0.06 -0.01 0.00 0.82 0.00 0.00 66.70 67.49 1ht2 h VAL 72 Cb 0.26 0.75 -0.01 0.00 -1.52 0.00 0.00 31.29 30.77 1ht2 h VAL 72 CO -0.33 0.03 0.15 0.50 0.02 0.00 0.00 177.57 177.95 1ht2 h LYS 73 N 0.18 0.42 0.00 1.57 3.11 -1.93 0.06 116.57 119.98 1ht2 h LYS 73 Ca 0.09 -0.06 0.00 0.00 -2.81 0.00 0.00 60.65 57.88 1ht2 h LYS 73 Cb 0.06 -0.08 0.00 0.00 -1.00 0.00 0.00 32.23 31.21 1ht2 h LYS 73 CO -0.09 0.38 0.00 0.00 -2.81 0.00 0.00 179.45 176.93 1ht2 n ALA 74 N -2.23 2.01 -0.04 5.00 0.00 -0.53 -2.23 120.51 122.49 1ht2 n ALA 74 Ca -0.02 -0.05 -0.20 0.00 0.00 0.00 0.00 53.44 53.17 1ht2 n ALA 74 Cb 0.09 -1.37 -0.13 0.00 0.00 0.00 0.00 19.45 18.04 1ht2 n ALA 74 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ht2 h ALA 75 N 2.69 0.17 0.00 0.00 0.00 -0.55 -3.06 119.26 118.51 1ht2 h ALA 75 Ca 0.00 -1.02 0.00 0.00 0.00 0.00 0.00 54.91 53.89 1ht2 h ALA 75 Cb 0.42 0.47 0.00 0.00 0.00 0.00 0.00 17.79 18.68 1ht2 h ALA 75 CO 0.00 0.64 0.00 1.55 0.00 0.00 0.00 179.25 181.44 1ht2 n VAL 76 N -4.19 0.76 0.00 0.00 3.14 -0.06 -1.92 118.33 116.06 1ht2 n VAL 76 Ca -0.24 0.19 -0.09 0.00 -2.96 0.00 0.00 64.34 61.23 1ht2 n VAL 76 Cb 0.76 -0.89 -0.14 0.00 -1.06 0.00 0.00 33.84 32.51 1ht2 n VAL 76 CO 0.00 0.00 0.00 -0.33 -6.46 0.00 0.00 176.83 170.04 1ht2 h GLU 77 N 0.00 0.03 0.08 1.45 4.39 -1.52 -3.25 114.58 115.77 1ht2 h GLU 77 Ca 0.00 -0.06 -0.26 0.00 0.34 0.00 0.00 59.36 59.38 1ht2 h GLU 77 Cb 0.28 0.02 0.01 0.00 -0.10 0.00 0.00 28.75 28.96 1ht2 h GLU 77 CO 0.00 0.69 -1.13 1.25 -1.16 0.00 0.00 179.01 178.66 1ht2 h LEU 78 N 0.01 0.54 -1.95 1.33 5.85 -1.27 -2.98 115.31 116.85 1ht2 h LEU 78 Ca -0.23 -0.51 -0.01 0.00 0.84 0.00 0.00 57.88 57.97 1ht2 h LEU 78 Cb 1.96 -0.17 -0.00 0.00 0.37 0.00 0.00 40.66 42.82 1ht2 h LEU 78 CO 0.10 1.35 -0.05 0.00 -0.34 0.00 0.00 178.44 179.50 1ht2 h ALA 79 N 0.59 1.08 -0.06 1.25 0.00 -1.53 0.78 119.26 121.36 1ht2 h ALA 79 Ca -0.12 -0.05 -0.06 0.00 0.00 0.00 0.00 54.91 54.68 1ht2 h ALA 79 Cb 1.81 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.60 1ht2 h ALA 79 CO 0.20 0.06 -0.18 -0.22 0.00 0.00 0.00 179.25 179.10 1ht2 h LYS 80 N 0.00 0.24 0.04 0.00 3.11 -1.55 -3.11 116.57 115.30 1ht2 h LYS 80 Ca -0.00 -0.17 -0.22 0.00 -2.81 0.00 0.00 60.65 57.45 1ht2 h LYS 80 Cb 0.35 0.03 -0.01 0.00 -1.00 0.00 0.00 32.23 31.60 1ht2 h LYS 80 CO 0.01 0.79 -1.01 -0.44 -2.81 0.00 0.00 179.45 175.98 1ht2 h ASP 81 N -0.27 0.25 -0.59 4.20 3.32 -1.36 -2.68 116.42 119.29 1ht2 h ASP 81 Ca -0.00 -0.23 0.05 0.00 0.02 0.00 0.00 57.03 56.86 1ht2 h ASP 81 Cb 0.80 -0.08 -0.05 0.00 0.22 0.00 0.00 39.33 40.22 1ht2 h ASP 81 CO 0.04 1.11 0.32 -0.25 -1.72 0.00 0.00 179.24 178.74 1ht2 h TRP 82 N 0.07 0.59 0.00 4.55 2.91 -0.93 -0.26 115.95 122.89 1ht2 h TRP 82 Ca -0.06 0.02 -0.12 0.00 1.13 0.00 0.00 58.89 59.86 1ht2 h TRP 82 Cb 1.70 -0.18 -0.02 0.00 -0.51 0.00 0.00 29.16 30.16 1ht2 h TRP 82 CO 0.03 0.29 -1.02 -0.09 -1.03 0.00 0.00 178.44 176.62 1ht2 h ARG 83 N 0.61 0.00 0.00 2.65 2.43 -1.63 -2.78 114.38 115.66 1ht2 h ARG 83 Ca 0.26 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.43 1ht2 h ARG 83 Cb 0.14 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.69 1ht2 h ARG 83 CO -0.16 0.31 -0.09 1.15 -1.51 0.00 0.00 179.97 179.67 1ht2 h THR 84 N 0.00 0.00 -1.55 0.20 2.02 -1.27 -3.47 112.91 108.85 1ht2 h THR 84 Ca -0.09 -0.39 -0.72 0.00 0.77 0.00 0.00 66.41 65.98 1ht2 h THR 84 Cb 1.43 0.00 0.04 0.00 -1.74 0.00 0.00 68.15 67.88 1ht2 h THR 84 CO 0.04 0.00 0.55 -0.67 0.37 0.00 0.00 175.52 175.82 1ht2 n ASP 85 N -3.14 1.68 -0.07 4.18 -0.08 -0.13 -4.85 116.55 114.14 1ht2 n ASP 85 Ca -0.01 1.11 -0.10 0.00 -1.51 0.00 0.00 54.79 54.28 1ht2 n ASP 85 Cb 0.05 -1.14 -0.03 0.00 2.34 0.00 0.00 41.12 42.34 1ht2 n ASP 85 CO 0.00 0.00 0.00 0.03 0.12 0.00 0.00 177.20 177.35 1ht2 h ARG 86 N 5.18 0.36 0.52 -0.67 3.08 -1.92 0.21 114.38 121.15 1ht2 h ARG 86 Ca -0.48 -0.04 -0.03 0.00 0.07 0.00 0.00 59.98 59.51 1ht2 h ARG 86 Cb 1.34 -0.07 0.01 0.00 0.08 0.00 0.00 29.97 31.33 1ht2 h ARG 86 CO 0.83 0.33 -0.25 0.52 -1.07 0.00 0.00 179.97 180.32 1ht2 h MET 87 N 0.30 -0.68 -0.01 0.04 2.86 -1.96 -3.27 114.93 112.21 1ht2 h MET 87 Ca 0.09 0.05 0.02 0.00 -2.06 0.00 0.00 59.70 57.80 1ht2 h MET 87 Cb 0.07 0.15 -0.02 0.00 0.06 0.00 0.00 31.60 31.86 1ht2 h MET 87 CO -0.01 -0.38 -0.10 -0.07 1.06 0.00 0.00 176.91 177.40 1ht2 h LEU 88 N -0.89 -0.30 -0.52 1.22 3.38 -1.86 -2.58 115.31 113.75 1ht2 h LEU 88 Ca -0.07 0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.95 1ht2 h LEU 88 Cb 0.61 0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.49 1ht2 h LEU 88 CO 0.12 -0.15 0.30 -1.14 0.09 0.00 0.00 178.44 177.65 1ht2 n ARG 89 N -5.23 0.05 -0.02 1.13 0.63 0.73 -1.83 116.66 112.12 1ht2 n ARG 89 Ca -0.05 0.46 -0.16 0.00 -0.92 0.00 0.00 57.85 57.18 1ht2 n ARG 89 Cb 0.16 -1.97 -0.10 0.00 0.45 0.00 0.00 32.46 31.00 1ht2 n ARG 89 CO 0.00 0.00 0.00 0.87 -2.51 0.00 0.00 177.63 175.99 1ht2 h LYS 90 N 0.00 0.40 -6.28 -0.14 1.79 -1.51 -3.45 116.57 107.39 1ht2 h LYS 90 Ca 0.00 -0.35 -0.56 0.00 -2.18 0.00 0.00 60.65 57.56 1ht2 h LYS 90 Cb 0.59 0.08 -0.03 0.00 -1.58 0.00 0.00 32.23 31.29 1ht2 h LYS 90 CO 0.00 1.00 0.57 -0.48 -1.08 0.00 0.00 179.45 179.46 1ht2 s LEU 91 N -8.58 4.26 -0.05 2.94 0.05 -0.76 -5.05 118.68 111.49 1ht2 s LEU 91 Ca -0.14 1.58 -0.02 0.00 0.05 0.00 0.00 54.13 55.61 1ht2 s LEU 91 Cb 0.04 -3.56 -0.04 0.00 -2.05 0.00 0.00 46.19 40.59 1ht2 s LEU 91 CO 0.80 -0.45 0.04 -1.83 -0.55 0.00 0.00 176.35 174.36 1ht2 s GLU 92 N 1.95 3.04 -0.04 1.48 -1.05 -1.26 -5.03 118.70 117.79 1ht2 s GLU 92 Ca 0.50 -0.42 -0.31 0.00 -0.15 0.00 0.00 54.97 54.58 1ht2 s GLU 92 Cb -0.19 -2.84 0.13 0.00 -0.44 0.00 0.00 34.13 30.78 1ht2 s GLU 92 CO 0.19 0.69 1.33 0.00 0.95 0.00 0.00 175.26 178.42 1ht2 s ALA 93 N -1.02 -2.32 -0.12 -0.84 0.00 -1.26 -4.03 121.76 112.16 1ht2 s ALA 93 Ca 0.17 0.73 0.01 0.00 0.00 0.00 0.00 51.96 52.88 1ht2 s ALA 93 Cb -0.12 0.35 0.02 0.00 0.00 0.00 0.00 23.12 23.37 1ht2 s ALA 93 CO 0.07 -1.06 -0.15 -0.51 0.00 0.00 0.00 175.76 174.11 1ht2 s LEU 94 N -3.03 1.72 -0.11 0.00 1.43 -0.34 -4.37 118.68 113.98 1ht2 s LEU 94 Ca 0.15 -0.44 -0.05 0.00 -1.03 0.00 0.00 54.13 52.76 1ht2 s LEU 94 Cb 0.05 -1.11 -0.04 0.00 0.03 0.00 0.00 46.19 45.12 1ht2 s LEU 94 CO -0.05 0.00 0.07 -0.76 0.23 0.00 0.00 176.35 175.85 1ht2 s LEU 95 N 1.08 3.97 -0.28 1.79 1.02 -0.65 -1.38 118.68 124.25 1ht2 s LEU 95 Ca -0.04 0.28 0.03 0.00 0.02 0.00 0.00 54.13 54.41 1ht2 s LEU 95 Cb -0.14 -1.95 0.07 0.00 0.02 0.00 0.00 46.19 44.19 1ht2 s LEU 95 CO -0.03 0.36 -0.05 0.00 0.02 0.00 0.00 176.35 176.65 1ht2 s ALA 96 N -0.78 2.50 0.02 4.21 0.00 0.30 -1.27 121.76 126.75 1ht2 s ALA 96 Ca 0.13 -1.89 0.05 0.00 0.00 0.00 0.00 51.96 50.25 1ht2 s ALA 96 Cb -0.12 -1.66 -0.03 0.00 0.00 0.00 0.00 23.12 21.31 1ht2 s ALA 96 CO 0.03 -1.34 -0.14 0.08 0.00 0.00 0.00 175.76 174.38 1ht2 s VAL 97 N 1.12 3.08 0.19 0.00 1.01 -0.79 -0.24 120.40 124.78 1ht2 s VAL 97 Ca -0.03 -1.00 -0.15 0.00 0.00 0.00 0.00 61.98 60.81 1ht2 s VAL 97 Cb -0.19 -2.30 0.02 0.00 0.00 0.00 0.00 36.38 33.90 1ht2 s VAL 97 CO -0.07 0.39 0.47 0.00 0.00 0.00 0.00 175.10 175.89 1ht2 s ALA 98 N -0.92 -0.68 0.00 5.51 0.00 -0.85 -0.55 121.76 124.27 1ht2 s ALA 98 Ca 0.15 -0.42 0.00 0.00 0.00 0.00 0.00 51.96 51.69 1ht2 s ALA 98 Cb -0.11 0.86 0.00 0.00 0.00 0.00 0.00 23.12 23.88 1ht2 s ALA 98 CO 0.05 -0.77 0.00 -0.40 0.00 0.00 0.00 175.76 174.64 1ht2 n ASP 99 N -0.31 0.54 0.13 0.00 3.85 -1.22 -1.74 116.55 117.80 1ht2 n ASP 99 Ca -0.09 0.00 0.02 0.00 -0.71 0.00 0.00 54.79 54.01 1ht2 n ASP 99 Cb 0.62 0.00 0.01 0.00 -1.35 0.00 0.00 41.12 40.41 1ht2 n ASP 99 CO 0.00 0.00 0.00 -0.08 -1.01 0.00 0.00 177.20 176.11 1ht2 h GLU 100 N 0.00 0.00 0.08 0.11 4.81 -1.99 -3.38 114.58 114.21 1ht2 h GLU 100 Ca 0.00 0.00 -0.23 0.00 -0.13 0.00 0.00 59.36 59.00 1ht2 h GLU 100 Cb 0.00 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.37 1ht2 h GLU 100 CO 0.00 0.55 -1.17 1.79 -0.73 0.00 0.00 179.01 179.45 1ht2 h THR 101 N 0.00 1.13 -1.81 0.32 1.35 -1.99 -3.50 112.91 108.41 1ht2 h THR 101 Ca -0.01 -2.36 0.20 0.00 -0.55 0.00 0.00 66.41 63.69 1ht2 h THR 101 Cb 1.42 2.74 -0.17 0.00 -1.73 0.00 0.00 68.15 70.40 1ht2 h THR 101 CO 0.07 0.62 0.68 0.00 -0.25 0.00 0.00 175.52 176.64 1ht2 s ALA 102 N -2.42 -1.97 -0.13 6.62 0.00 -1.26 -5.16 121.76 117.45 1ht2 s ALA 102 Ca -0.21 1.33 0.02 0.00 0.00 0.00 0.00 51.96 53.10 1ht2 s ALA 102 Cb 0.03 0.12 -0.00 0.00 0.00 0.00 0.00 23.12 23.27 1ht2 s ALA 102 CO 0.73 -0.65 -0.19 -1.54 0.00 0.00 0.00 175.76 174.11 1ht2 s SER 103 N -2.32 3.42 0.33 0.00 1.04 -1.26 -3.40 113.70 111.52 1ht2 s SER 103 Ca 0.08 -0.50 0.04 0.00 0.48 0.00 0.00 55.95 56.05 1ht2 s SER 103 Cb -0.01 -1.50 -0.02 0.00 0.10 0.00 0.00 66.02 64.60 1ht2 s SER 103 CO -0.06 0.13 0.15 0.00 0.98 0.00 0.00 173.24 174.43 1ht2 n LEU 104 N 3.76 0.00 -4.63 2.42 -0.00 0.28 -4.61 117.00 114.23 1ht2 n LEU 104 Ca -0.19 -2.68 -0.28 0.00 -0.00 0.00 0.00 56.01 52.87 1ht2 n LEU 104 Cb 0.52 1.01 -0.08 0.00 -0.00 0.00 0.00 43.42 44.86 1ht2 n LEU 104 CO 0.28 -0.42 -0.37 -0.63 -0.00 0.00 0.00 177.39 176.26 1ht2 s ILE 105 N -2.93 3.58 -0.17 1.47 -1.09 0.96 -1.88 121.20 121.13 1ht2 s ILE 105 Ca 0.21 -1.38 -0.04 0.00 -2.23 0.00 0.00 60.65 57.21 1ht2 s ILE 105 Cb 0.01 -2.76 0.07 0.00 -1.58 0.00 0.00 42.46 38.20 1ht2 s ILE 105 CO 0.15 -0.03 0.14 -0.63 -1.23 0.00 0.00 174.94 173.33 1ht2 s ILE 106 N -1.56 -0.18 0.34 2.92 1.01 -0.39 -3.34 121.20 120.00 1ht2 s ILE 106 Ca 0.25 -0.09 0.08 0.00 0.00 0.00 0.00 60.65 60.90 1ht2 s ILE 106 Cb -0.10 -0.57 -0.04 0.00 0.01 0.00 0.00 42.46 41.75 1ht2 s ILE 106 CO 0.17 -0.21 0.12 0.42 0.00 0.00 0.00 174.94 175.43 1ht2 s THR 107 N 2.21 2.92 -1.02 2.92 -4.23 -0.88 -1.63 115.64 115.93 1ht2 s THR 107 Ca 0.04 -1.75 0.09 0.00 -1.18 0.00 0.00 61.69 58.88 1ht2 s THR 107 Cb -0.16 -2.94 0.08 0.00 1.34 0.00 0.00 72.50 70.82 1ht2 s THR 107 CO -0.10 -0.18 1.28 0.61 -0.54 0.00 0.00 174.62 175.70 1ht2 n GLY 108 N -1.11 -0.80 2.70 3.99 0.00 -1.26 -3.40 105.19 105.31 1ht2 n GLY 108 Ca -0.03 -0.03 -0.41 0.00 0.00 0.00 0.00 46.02 45.55 1ht2 n GLY 108 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1ht2 n ASN 109 N -1.49 7.42 -3.15 1.61 4.13 -1.26 -4.07 115.26 118.46 1ht2 n ASN 109 Ca 0.02 -3.70 -0.10 0.00 1.68 0.00 0.00 54.58 52.48 1ht2 n ASN 109 Cb 0.10 -1.15 -0.02 0.00 -1.54 0.00 0.00 39.78 37.17 1ht2 n ASN 109 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1ht2 n GLY 110 N -0.11 -0.07 3.24 7.41 0.00 -1.22 -4.84 105.19 109.60 1ht2 n GLY 110 Ca 0.49 0.06 -0.30 0.00 0.00 0.00 0.00 46.02 46.27 1ht2 n GLY 110 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1ht2 s ASP 111 N -3.58 2.85 -0.49 1.61 2.15 -1.25 -4.96 116.67 113.01 1ht2 s ASP 111 Ca 0.02 -0.47 0.08 0.00 0.43 0.00 0.00 52.55 52.61 1ht2 s ASP 111 Cb -0.01 -0.71 0.33 0.00 -0.30 0.00 0.00 42.92 42.22 1ht2 s ASP 111 CO 0.29 0.23 0.81 0.52 -0.17 0.00 0.00 175.17 176.85 1ht2 n VAL 112 N 2.91 1.44 -1.83 1.11 0.31 -1.26 -2.07 118.33 118.94 1ht2 n VAL 112 Ca -0.17 -5.03 -0.41 0.00 -0.01 0.00 0.00 64.34 58.71 1ht2 n VAL 112 Cb 0.52 -1.10 -0.01 0.00 -0.91 0.00 0.00 33.84 32.34 1ht2 n VAL 112 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 1ht2 s VAL 113 N -3.20 2.17 -0.70 2.52 1.01 -1.21 -4.70 120.40 116.29 1ht2 s VAL 113 Ca 0.43 0.15 0.05 0.00 0.00 0.00 0.00 61.98 62.62 1ht2 s VAL 113 Cb 0.28 -3.10 0.17 0.00 0.00 0.00 0.00 36.38 33.74 1ht2 s VAL 113 CO -0.10 0.03 0.50 1.67 0.00 0.00 0.00 175.10 177.20 1ht2 n GLN 114 N 1.53 1.79 -0.84 2.72 7.27 -1.26 -0.03 117.38 128.55 1ht2 n GLN 114 Ca 0.05 -4.45 -0.30 0.00 0.07 0.00 0.00 57.00 52.37 1ht2 n GLN 114 Cb 0.39 -2.26 0.03 0.00 2.41 0.00 0.00 30.24 30.81 1ht2 n GLN 114 CO 0.00 0.00 0.00 -0.35 0.07 0.00 0.00 177.06 176.78 1ht2 n PRO 115 N 1.96 0.00 0.00 3.69 -0.04 -1.26 -4.82 135.00 134.52 1ht2 n PRO 115 Ca 0.21 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.67 1ht2 n PRO 115 Cb 0.36 -0.84 0.00 0.00 -0.04 0.00 0.00 33.50 32.97 1ht2 n PRO 115 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1ht2 n GLU 116 N 2.11 0.00 0.00 0.54 4.71 -1.26 -2.76 120.64 123.98 1ht2 n GLU 116 Ca -0.02 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.13 1ht2 n GLU 116 Cb 0.48 0.00 0.00 0.00 -1.01 0.00 0.00 31.44 30.91 1ht2 n GLU 116 CO 0.00 0.00 0.00 0.09 0.09 0.00 0.00 177.13 177.31 1ht2 n ASN 117 N 0.00 1.20 -0.63 1.62 3.02 -1.26 -4.53 115.26 114.67 1ht2 n ASN 117 Ca 0.00 -0.83 -0.08 0.00 -0.03 0.00 0.00 54.58 53.64 1ht2 n ASN 117 Cb 0.00 -0.21 -0.04 0.00 -0.61 0.00 0.00 39.78 38.93 1ht2 n ASN 117 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1ht2 n ASP 118 N 0.77 -4.06 -4.56 6.41 9.92 -1.11 -4.70 116.55 119.22 1ht2 n ASP 118 Ca 0.00 0.20 -0.43 0.00 -0.53 0.00 0.00 54.79 54.04 1ht2 n ASP 118 Cb 0.20 -2.29 -0.05 0.00 -0.64 0.00 0.00 41.12 38.34 1ht2 n ASP 118 CO 0.00 0.00 0.00 -0.22 0.13 0.00 0.00 177.20 177.11 1ht2 s LEU 119 N -1.88 4.21 -0.17 0.64 2.96 -1.26 -4.57 118.68 118.60 1ht2 s LEU 119 Ca 0.00 0.06 -0.04 0.00 -0.22 0.00 0.00 54.13 53.92 1ht2 s LEU 119 Cb 0.00 -2.98 -0.03 0.00 0.50 0.00 0.00 46.19 43.69 1ht2 s LEU 119 CO 0.00 -0.84 -0.02 -0.63 -1.32 0.00 0.00 176.35 173.54 1ht2 s ILE 120 N 3.20 4.00 -0.38 6.68 1.01 -0.73 -4.61 121.20 130.38 1ht2 s ILE 120 Ca 0.30 -0.31 0.02 0.00 0.00 0.00 0.00 60.65 60.66 1ht2 s ILE 120 Cb -0.13 -2.77 0.15 0.00 0.01 0.00 0.00 42.46 39.72 1ht2 s ILE 120 CO 0.20 0.47 0.31 0.00 0.00 0.00 0.00 174.94 175.92 1ht2 s ALA 121 N 0.56 0.55 0.57 9.38 0.00 -1.26 -0.51 121.76 131.06 1ht2 s ALA 121 Ca -0.02 -1.71 0.09 0.00 0.00 0.00 0.00 51.96 50.32 1ht2 s ALA 121 Cb -0.14 -1.76 0.08 0.00 0.00 0.00 0.00 23.12 21.29 1ht2 s ALA 121 CO 0.02 -2.09 0.73 0.96 0.00 0.00 0.00 175.76 175.38 1ht2 s ILE 122 N 0.91 2.09 0.00 0.00 -4.36 -0.91 -4.19 121.20 114.74 1ht2 s ILE 122 Ca 0.22 -1.07 0.00 0.00 -0.26 0.00 0.00 60.65 59.54 1ht2 s ILE 122 Cb -0.14 -2.16 0.00 0.00 1.25 0.00 0.00 42.46 41.41 1ht2 s ILE 122 CO -0.05 0.00 0.00 0.61 0.24 0.00 0.00 174.94 175.74 1ht2 n GLY 123 N -2.17 -0.38 0.38 6.27 0.00 -1.26 -2.46 105.19 105.56 1ht2 n GLY 123 Ca 0.13 -1.68 0.19 0.00 0.00 0.00 0.00 46.02 44.66 1ht2 n GLY 123 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1ht2 h SER 124 N 0.00 0.06 0.23 1.61 4.64 -1.76 0.44 113.55 118.77 1ht2 h SER 124 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1ht2 h SER 124 Cb 0.00 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 62.08 1ht2 h SER 124 CO 0.00 0.03 -0.42 0.61 -0.87 0.00 0.00 176.83 176.18 1ht2 n GLY 125 N -1.62 -0.67 0.28 -0.77 0.00 -1.21 -4.61 105.19 96.59 1ht2 n GLY 125 Ca 0.10 -0.45 -0.07 0.00 0.00 0.00 0.00 46.02 45.59 1ht2 n GLY 125 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ht2 n GLY 126 N 1.40 -1.95 0.27 -0.02 0.00 0.15 -1.57 105.19 103.49 1ht2 n GLY 126 Ca 0.09 0.84 -0.07 0.00 0.00 0.00 0.00 46.02 46.88 1ht2 n GLY 126 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1ht2 h PRO 127 N 0.00 -0.20 -0.49 1.61 0.11 -1.78 -0.36 132.00 130.90 1ht2 h PRO 127 Ca 0.11 0.01 0.10 0.00 0.11 0.00 0.00 66.00 66.33 1ht2 h PRO 127 Cb 0.28 0.05 -0.09 0.00 0.11 0.00 0.00 31.00 31.35 1ht2 h PRO 127 CO -0.64 -0.13 -0.06 1.88 -0.21 0.00 0.00 178.00 178.84 1ht2 h TYR 128 N -0.21 -0.14 -0.99 0.65 0.05 -1.62 0.52 116.97 115.23 1ht2 h TYR 128 Ca 0.16 0.04 0.01 0.00 0.05 0.00 0.00 58.73 58.99 1ht2 h TYR 128 Cb 0.46 0.14 -0.05 0.00 1.01 0.00 0.00 36.73 38.29 1ht2 h TYR 128 CO -0.43 -0.16 0.66 0.00 -1.05 0.00 0.00 178.16 177.18 1ht2 h ALA 129 N 1.46 1.30 -0.45 3.88 0.00 -0.92 -1.52 119.26 123.00 1ht2 h ALA 129 Ca 0.24 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 55.06 1ht2 h ALA 129 Cb 0.37 -0.40 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 1ht2 h ALA 129 CO -0.45 0.65 0.19 0.37 0.00 0.00 0.00 179.25 180.01 1ht2 h GLN 130 N 1.34 0.67 -0.71 0.00 4.15 0.11 0.24 115.11 120.91 1ht2 h GLN 130 Ca 0.36 -0.11 0.06 0.00 0.77 0.00 0.00 58.65 59.73 1ht2 h GLN 130 Cb -0.15 -0.11 -0.06 0.00 0.21 0.00 0.00 27.48 27.37 1ht2 h GLN 130 CO -0.08 0.60 0.40 0.00 -1.93 0.00 0.00 178.83 177.82 1ht2 h ALA 131 N 1.04 0.96 0.12 3.38 0.00 0.73 -0.30 119.26 125.18 1ht2 h ALA 131 Ca 0.15 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.07 1ht2 h ALA 131 Cb 0.17 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.82 1ht2 h ALA 131 CO -0.01 0.08 -0.06 0.00 0.00 0.00 0.00 179.25 179.26 1ht2 h ALA 132 N 1.37 -0.15 -0.39 0.00 0.00 -1.04 -2.74 119.26 116.29 1ht2 h ALA 132 Ca 0.32 -0.25 0.11 0.00 0.00 0.00 0.00 54.91 55.09 1ht2 h ALA 132 Cb 0.20 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 1ht2 h ALA 132 CO -0.19 -0.25 0.39 0.00 0.00 0.00 0.00 179.25 179.20 1ht2 h ALA 133 N -0.18 2.13 0.30 0.00 0.00 -0.43 -0.91 119.26 120.17 1ht2 h ALA 133 Ca -0.02 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 1ht2 h ALA 133 Cb 0.56 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.38 1ht2 h ALA 133 CO 0.03 -0.59 -0.14 -0.09 0.00 0.00 0.00 179.25 178.45 1ht2 h ARG 134 N 0.00 -0.39 -0.76 0.00 9.65 -1.04 -0.91 114.38 120.94 1ht2 h ARG 134 Ca 0.19 0.03 0.17 0.00 -1.10 0.00 0.00 59.98 59.26 1ht2 h ARG 134 Cb 0.96 0.09 -0.12 0.00 -1.39 0.00 0.00 29.97 29.52 1ht2 h ARG 134 CO -0.00 -0.09 0.17 0.00 2.80 0.00 0.00 179.97 182.84 1ht2 h ALA 135 N -0.73 0.98 -0.00 2.80 0.00 -0.89 -2.02 119.26 119.41 1ht2 h ALA 135 Ca -0.04 0.18 -0.00 0.00 0.00 0.00 0.00 54.91 55.05 1ht2 h ALA 135 Cb 0.47 0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.52 1ht2 h ALA 135 CO 0.07 -0.36 -0.00 -0.07 0.00 0.00 0.00 179.25 178.89 1ht2 h LEU 136 N 0.25 0.00 -0.97 0.00 4.07 -1.39 -1.57 115.31 115.70 1ht2 h LEU 136 Ca 0.43 -0.67 0.00 0.00 0.08 0.00 0.00 57.88 57.73 1ht2 h LEU 136 Cb 0.76 -0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.50 1ht2 h LEU 136 CO -0.54 0.67 0.11 -0.11 -1.08 0.00 0.00 178.44 177.49 1ht2 n LEU 137 N -4.77 0.38 -0.00 1.67 7.94 -0.35 -1.87 117.00 120.00 1ht2 n LEU 137 Ca -0.09 0.63 0.02 0.00 -1.11 0.00 0.00 56.01 55.45 1ht2 n LEU 137 Cb 0.33 -0.65 -0.02 0.00 0.53 0.00 0.00 43.42 43.61 1ht2 n LEU 137 CO 0.34 -0.76 -0.07 -0.62 -1.11 0.00 0.00 177.39 175.16 1ht2 n GLU 138 N -2.02 5.20 -0.57 1.96 1.02 -0.79 -4.74 120.64 120.69 1ht2 n GLU 138 Ca -0.01 -0.00 0.04 0.00 -0.02 0.00 0.00 57.16 57.17 1ht2 n GLU 138 Cb 0.13 -0.71 0.07 0.00 -0.02 0.00 0.00 31.44 30.91 1ht2 n GLU 138 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1ht2 n ASN 139 N -1.14 1.02 -3.63 1.62 5.03 -0.60 -5.08 115.26 112.48 1ht2 n ASN 139 Ca 0.00 -2.52 -0.10 0.00 0.87 0.00 0.00 54.58 52.83 1ht2 n ASN 139 Cb 0.06 -0.32 -0.04 0.00 -1.02 0.00 0.00 39.78 38.46 1ht2 n ASN 139 CO 0.00 0.00 0.00 0.42 -1.83 0.00 0.00 177.26 175.85 1ht2 s THR 140 N -1.17 0.05 -2.19 3.41 -4.23 -0.78 -4.96 115.64 105.77 1ht2 s THR 140 Ca 0.19 -0.55 0.23 0.00 -1.18 0.00 0.00 61.69 60.38 1ht2 s THR 140 Cb 0.19 -1.26 0.55 0.00 1.34 0.00 0.00 72.50 73.33 1ht2 s THR 140 CO -0.03 -0.21 1.48 -0.62 -0.54 0.00 0.00 174.62 174.70 1ht2 n GLU 141 N -0.28 2.60 -1.45 3.99 -0.58 -1.26 -4.76 120.64 118.89 1ht2 n GLU 141 Ca -0.14 -2.46 -0.38 0.00 -0.42 0.00 0.00 57.16 53.76 1ht2 n GLU 141 Cb 0.64 -1.54 0.04 0.00 -0.57 0.00 0.00 31.44 30.01 1ht2 n GLU 141 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 1ht2 n LEU 142 N 1.55 1.13 -4.92 -4.62 4.77 -1.26 -4.97 117.00 108.68 1ht2 n LEU 142 Ca 0.22 0.72 -0.28 0.00 -0.03 0.00 0.00 56.01 56.64 1ht2 n LEU 142 Cb 0.60 -1.20 0.10 0.00 -2.33 0.00 0.00 43.42 40.59 1ht2 n LEU 142 CO 0.16 -2.93 0.76 -0.94 -1.33 0.00 0.00 177.39 173.11 1ht2 s SER 143 N -1.23 4.34 0.25 -1.43 1.04 -1.26 -4.83 113.70 110.58 1ht2 s SER 143 Ca 0.69 0.58 -0.04 0.00 0.48 0.00 0.00 55.95 57.67 1ht2 s SER 143 Cb -0.42 -1.04 0.40 0.00 0.10 0.00 0.00 66.02 65.06 1ht2 s SER 143 CO 0.54 -1.97 1.83 0.00 0.98 0.00 0.00 173.24 174.62 1ht2 h ALA 144 N -1.03 1.25 -0.31 5.32 0.00 -1.86 -0.54 119.26 122.09 1ht2 h ALA 144 Ca -0.45 0.01 -0.14 0.00 0.00 0.00 0.00 54.91 54.33 1ht2 h ALA 144 Cb 1.31 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.90 1ht2 h ALA 144 CO 0.59 0.21 -0.34 -0.09 0.00 0.00 0.00 179.25 179.62 1ht2 h ARG 145 N 0.92 0.78 -0.68 0.00 2.43 -1.92 -1.70 114.38 114.22 1ht2 h ARG 145 Ca 0.41 -0.42 -0.06 0.00 -0.81 0.00 0.00 59.98 59.09 1ht2 h ARG 145 Cb 0.30 0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 29.84 1ht2 h ARG 145 CO -0.22 1.05 0.18 0.93 -1.51 0.00 0.00 179.97 180.41 1ht2 h GLU 146 N 0.55 1.06 0.28 0.20 5.08 -1.80 -1.79 114.58 118.15 1ht2 h GLU 146 Ca 0.05 -0.23 -0.01 0.00 -1.00 0.00 0.00 59.36 58.16 1ht2 h GLU 146 Cb 0.92 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 30.03 1ht2 h GLU 146 CO 0.08 0.92 -0.14 0.82 -1.00 0.00 0.00 179.01 179.70 1ht2 h ILE 147 N 1.01 0.75 -0.70 3.13 2.04 -1.06 -1.88 117.51 120.80 1ht2 h ILE 147 Ca 0.22 -0.56 0.12 0.00 1.00 0.00 0.00 64.86 65.64 1ht2 h ILE 147 Cb 0.33 1.04 -0.08 0.00 -0.74 0.00 0.00 36.82 37.37 1ht2 h ILE 147 CO -0.00 0.11 0.29 0.00 0.00 0.00 0.00 178.15 178.55 1ht2 h ALA 148 N -0.08 0.95 0.62 1.87 0.00 -1.25 0.22 119.26 121.58 1ht2 h ALA 148 Ca -0.04 0.09 -0.03 0.00 0.00 0.00 0.00 54.91 54.93 1ht2 h ALA 148 Cb 0.47 0.05 0.01 0.00 0.00 0.00 0.00 17.79 18.32 1ht2 h ALA 148 CO 0.06 -0.17 -0.30 0.93 0.00 0.00 0.00 179.25 179.78 1ht2 h GLU 149 N 0.47 -0.80 -0.77 0.00 4.39 -1.31 0.06 114.58 116.61 1ht2 h GLU 149 Ca 0.36 0.05 0.01 0.00 0.34 0.00 0.00 59.36 60.13 1ht2 h GLU 149 Cb 0.49 0.18 -0.04 0.00 -0.10 0.00 0.00 28.75 29.28 1ht2 h GLU 149 CO -0.34 -0.49 0.50 0.87 -1.16 0.00 0.00 179.01 178.39 1ht2 h LYS 150 N -1.01 1.01 -0.16 2.33 1.57 -1.11 0.52 116.57 119.72 1ht2 h LYS 150 Ca -0.08 -0.06 -0.01 0.00 -1.87 0.00 0.00 60.65 58.62 1ht2 h LYS 150 Cb 0.68 -0.23 -0.01 0.00 0.08 0.00 0.00 32.23 32.76 1ht2 h LYS 150 CO 0.14 0.68 0.05 0.00 -0.57 0.00 0.00 179.45 179.75 1ht2 h ALA 151 N 1.51 0.21 -0.11 3.86 0.00 -0.53 -1.82 119.26 122.37 1ht2 h ALA 151 Ca 0.28 -0.13 -0.05 0.00 0.00 0.00 0.00 54.91 55.02 1ht2 h ALA 151 Cb -0.11 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 1ht2 h ALA 151 CO -0.06 -0.18 -0.15 1.25 0.00 0.00 0.00 179.25 180.12 1ht2 h LEU 152 N 0.08 0.17 -0.26 0.00 6.46 -0.41 -0.56 115.31 120.78 1ht2 h LEU 152 Ca 0.05 -0.03 -0.20 0.00 -0.12 0.00 0.00 57.88 57.58 1ht2 h LEU 152 Cb 0.22 -0.04 0.00 0.00 -0.73 0.00 0.00 40.66 40.11 1ht2 h LEU 152 CO -0.00 0.33 -0.68 0.44 -0.62 0.00 0.00 178.44 177.91 1ht2 h ASP 153 N 0.17 0.88 -0.58 1.25 3.45 -0.72 -1.70 116.42 119.17 1ht2 h ASP 153 Ca 0.03 -0.53 -0.11 0.00 0.43 0.00 0.00 57.03 56.86 1ht2 h ASP 153 Cb 0.37 -0.26 -0.02 0.00 -0.56 0.00 0.00 39.33 38.86 1ht2 h ASP 153 CO 0.02 1.32 -0.05 0.40 -1.57 0.00 0.00 179.24 179.36 1ht2 h ILE 154 N 0.54 1.27 -0.91 0.35 2.04 -0.96 -2.14 117.51 117.70 1ht2 h ILE 154 Ca -0.02 -1.21 -0.01 0.00 1.00 0.00 0.00 64.86 64.62 1ht2 h ILE 154 Cb 1.29 0.87 -0.04 0.00 -0.74 0.00 0.00 36.82 38.20 1ht2 h ILE 154 CO 0.14 0.43 0.54 0.00 0.00 0.00 0.00 178.15 179.27 1ht2 h ALA 155 N 0.96 1.16 0.00 1.87 0.00 -1.01 -1.44 119.26 120.80 1ht2 h ALA 155 Ca 0.16 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1ht2 h ALA 155 Cb 0.62 -0.36 0.00 0.00 0.00 0.00 0.00 17.79 18.04 1ht2 h ALA 155 CO 0.04 0.62 0.00 0.78 0.00 0.00 0.00 179.25 180.69 1ht2 h GLY 156 N 1.25 0.00 1.35 0.00 0.00 -0.91 0.44 103.07 105.20 1ht2 h GLY 156 Ca 0.32 0.00 -0.14 0.00 0.00 0.00 0.00 47.33 47.52 1ht2 h GLY 156 CO -0.06 0.00 -1.07 -0.55 0.00 0.00 0.00 176.54 174.86 1ht2 h ASP 157 N 0.00 0.00 0.00 0.19 3.45 -0.64 -3.39 116.42 116.03 1ht2 h ASP 157 Ca 0.00 0.00 -0.38 0.00 0.43 0.00 0.00 57.03 57.08 1ht2 h ASP 157 Cb 0.52 0.00 -0.06 0.00 -0.56 0.00 0.00 39.33 39.23 1ht2 h ASP 157 CO 0.00 0.52 -2.10 -0.38 -1.57 0.00 0.00 179.24 175.71 1ht2 n ILE 158 N -3.00 1.53 -2.21 0.35 5.41 -0.84 -4.95 119.36 115.64 1ht2 n ILE 158 Ca -0.05 -0.26 -0.42 0.00 1.00 0.00 0.00 62.75 63.02 1ht2 n ILE 158 Cb 0.79 -1.95 -0.03 0.00 -0.71 0.00 0.00 39.64 37.74 1ht2 n ILE 158 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1ht2 h ILE 160 N 4.40 0.13 -0.25 0.00 1.08 -1.88 -3.10 117.51 117.89 1ht2 h ILE 160 Ca -0.41 -0.80 0.00 0.00 -0.39 0.00 0.00 64.86 63.25 1ht2 h ILE 160 Cb 1.21 1.71 0.00 0.00 -3.07 0.00 0.00 36.82 36.66 1ht2 h ILE 160 CO 0.86 0.06 0.00 -1.22 -0.69 0.00 0.00 178.15 177.16 1ht2 n TYR 161 N -3.15 0.31 -5.23 1.37 4.01 -1.26 -4.93 117.16 108.28 1ht2 n TYR 161 Ca 0.01 -0.20 -0.31 0.00 -0.16 0.00 0.00 57.90 57.24 1ht2 n TYR 161 Cb 0.40 -0.00 -0.16 0.00 -0.31 0.00 0.00 39.34 39.26 1ht2 n TYR 161 CO 0.00 0.00 0.00 0.99 -0.46 0.00 0.00 176.86 177.39 1ht2 s THR 162 N -1.34 2.18 0.18 -0.72 2.01 -1.17 0.85 115.64 117.63 1ht2 s THR 162 Ca 0.29 -1.04 0.01 0.00 0.31 0.00 0.00 61.69 61.26 1ht2 s THR 162 Cb 0.18 -1.79 0.01 0.00 0.01 0.00 0.00 72.50 70.91 1ht2 s THR 162 CO 0.25 0.57 0.06 -0.46 -0.69 0.00 0.00 174.62 174.35 1ht2 n ASN 163 N 2.71 2.09 -1.80 3.53 0.23 -1.26 -4.56 115.26 116.20 1ht2 n ASN 163 Ca -0.17 -1.70 0.08 0.00 -0.53 0.00 0.00 54.58 52.25 1ht2 n ASN 163 Cb 0.52 0.06 0.39 0.00 -2.08 0.00 0.00 39.78 38.67 1ht2 n ASN 163 CO 0.00 0.00 0.00 1.41 -0.93 0.00 0.00 177.26 177.74 1ht2 n HIS 164 N -0.65 1.91 -2.92 -2.53 8.25 -1.26 -4.58 115.22 113.44 1ht2 n HIS 164 Ca -0.04 -0.70 -0.41 0.00 -0.26 0.00 0.00 57.72 56.31 1ht2 n HIS 164 Cb 0.21 -0.44 -0.04 0.00 1.12 0.00 0.00 29.99 30.84 1ht2 n HIS 164 CO 0.00 0.00 0.00 0.12 0.64 0.00 0.00 176.34 177.10 1ht2 s PHE 165 N -2.53 3.62 0.36 4.41 5.36 -1.26 -4.99 117.98 122.95 1ht2 s PHE 165 Ca 0.54 1.43 0.09 0.00 -0.96 0.00 0.00 56.93 58.02 1ht2 s PHE 165 Cb 0.39 -2.92 -0.07 0.00 -0.34 0.00 0.00 43.02 40.09 1ht2 s PHE 165 CO 0.18 0.07 -0.05 -1.01 -1.46 0.00 0.00 175.22 172.95 1ht2 s HIS 166 N 0.82 2.45 -0.29 10.12 3.76 -1.26 -2.23 115.29 128.66 1ht2 s HIS 166 Ca 0.43 -0.53 -0.06 0.00 -0.15 0.00 0.00 55.06 54.74 1ht2 s HIS 166 Cb -0.19 -1.50 0.15 0.00 1.11 0.00 0.00 32.58 32.15 1ht2 s HIS 166 CO 0.22 0.53 0.61 0.99 -0.85 0.00 0.00 174.74 176.24 1ht2 s THR 167 N -2.62 -0.96 0.23 1.30 2.01 -1.09 -4.97 115.64 109.54 1ht2 s THR 167 Ca 0.34 0.01 0.11 0.00 0.31 0.00 0.00 61.69 62.45 1ht2 s THR 167 Cb 0.04 -0.97 -0.05 0.00 0.01 0.00 0.00 72.50 71.53 1ht2 s THR 167 CO 0.17 -0.00 -0.19 -0.63 -0.69 0.00 0.00 174.62 173.29 1ht2 s ILE 168 N 2.85 2.60 -0.18 1.82 1.01 -1.26 -2.36 121.20 125.69 1ht2 s ILE 168 Ca 0.05 -2.13 -0.04 0.00 0.00 0.00 0.00 60.65 58.54 1ht2 s ILE 168 Cb -0.13 -2.31 0.08 0.00 0.01 0.00 0.00 42.46 40.11 1ht2 s ILE 168 CO -0.19 -0.25 0.20 -1.61 0.00 0.00 0.00 174.94 173.09 1ht2 s GLU 169 N -3.11 0.15 0.47 2.79 0.41 -0.99 -4.98 118.70 113.44 1ht2 s GLU 169 Ca 0.26 0.28 0.07 0.00 -0.41 0.00 0.00 54.97 55.17 1ht2 s GLU 169 Cb -0.07 -1.01 0.03 0.00 -1.78 0.00 0.00 34.13 31.30 1ht2 s GLU 169 CO 0.13 -0.57 0.65 -2.00 -0.49 0.00 0.00 175.26 172.98 1ht2 s GLU 170 N 2.31 2.69 -0.16 1.61 2.12 -1.26 -2.56 118.70 123.45 1ht2 s GLU 170 Ca 0.05 -1.19 -0.12 0.00 0.36 0.00 0.00 54.97 54.07 1ht2 s GLU 170 Cb -0.15 -2.68 0.05 0.00 0.26 0.00 0.00 34.13 31.61 1ht2 s GLU 170 CO -0.11 -0.45 0.41 -1.17 -0.54 0.00 0.00 175.26 173.41 1ht2 s LEU 171 N -4.49 0.23 -0.07 2.70 2.96 -0.97 -4.97 118.68 114.07 1ht2 s LEU 171 Ca 0.56 0.86 0.04 0.00 -0.22 0.00 0.00 54.13 55.37 1ht2 s LEU 171 Cb -0.10 1.39 0.00 0.00 0.50 0.00 0.00 46.19 47.99 1ht2 s LEU 171 CO 0.35 -0.16 -0.19 -0.44 -1.32 0.00 0.00 176.35 174.59 1ht2 s SER 172 N 0.66 2.47 0.02 3.68 0.01 -1.26 -2.40 113.70 116.87 1ht2 s SER 172 Ca -0.04 -0.42 0.00 0.00 1.31 0.00 0.00 55.95 56.80 1ht2 s SER 172 Cb -0.05 -0.91 -0.00 0.00 0.21 0.00 0.00 66.02 65.27 1ht2 s SER 172 CO -0.04 0.14 0.02 0.00 0.41 0.00 0.00 173.24 173.77 1ht2 n TYR 173 N 3.37 -0.34 0.21 2.43 0.18 0.05 -5.01 117.16 118.06 1ht2 n TYR 173 Ca -0.19 -0.11 0.02 0.00 1.88 0.00 0.00 57.90 59.49 1ht2 n TYR 173 Cb 0.53 0.02 0.10 0.00 -0.38 0.00 0.00 39.34 39.61 1ht2 n TYR 173 CO 0.00 0.00 0.00 1.63 -2.08 0.00 0.00 176.86 176.41