#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ht1 s THR 2 N 0.00 -0.55 -0.12 1.09 2.01 -1.26 -1.93 115.64 114.88 1ht1 s THR 2 Ca 0.00 0.08 0.02 0.00 0.31 0.00 0.00 61.69 62.10 1ht1 s THR 2 Cb 0.00 -0.67 -0.01 0.00 0.01 0.00 0.00 72.50 71.84 1ht1 s THR 2 CO 0.00 -0.02 -0.19 -0.63 -0.69 0.00 0.00 174.62 173.09 1ht1 s ILE 3 N 2.51 2.51 -0.04 1.82 1.01 -0.58 -3.38 121.20 125.06 1ht1 s ILE 3 Ca 0.05 -0.86 0.04 0.00 0.00 0.00 0.00 60.65 59.88 1ht1 s ILE 3 Cb -0.14 -2.01 -0.00 0.00 0.01 0.00 0.00 42.46 40.32 1ht1 s ILE 3 CO -0.13 0.54 -0.16 -0.69 0.00 0.00 0.00 174.94 174.50 1ht1 s VAL 4 N 0.37 1.34 -0.11 2.92 1.01 -0.84 -1.60 120.40 123.48 1ht1 s VAL 4 Ca -0.15 -0.67 -0.01 0.00 0.00 0.00 0.00 61.98 61.16 1ht1 s VAL 4 Cb -0.17 -1.16 0.03 0.00 0.00 0.00 0.00 36.38 35.08 1ht1 s VAL 4 CO 0.07 0.39 -0.07 -0.55 0.00 0.00 0.00 175.10 174.94 1ht1 s SER 5 N 0.06 2.13 -0.04 3.32 0.15 -0.11 -0.76 113.70 118.44 1ht1 s SER 5 Ca -0.04 -0.29 0.05 0.00 0.70 0.00 0.00 55.95 56.38 1ht1 s SER 5 Cb -0.11 -0.80 -0.01 0.00 -1.71 0.00 0.00 66.02 63.39 1ht1 s SER 5 CO 0.02 -0.13 -0.20 -0.69 1.20 0.00 0.00 173.24 173.44 1ht1 s VAL 6 N 1.74 1.65 -0.13 4.45 1.01 -0.68 -0.95 120.40 127.48 1ht1 s VAL 6 Ca 0.05 -0.85 0.02 0.00 0.00 0.00 0.00 61.98 61.20 1ht1 s VAL 6 Cb -0.13 -1.41 0.01 0.00 0.00 0.00 0.00 36.38 34.86 1ht1 s VAL 6 CO -0.08 0.47 -0.21 -0.60 0.00 0.00 0.00 175.10 174.68 1ht1 s ARG 7 N -0.09 2.89 -0.28 2.72 3.52 -1.26 -2.03 118.95 124.41 1ht1 s ARG 7 Ca -0.02 -0.81 -0.17 0.00 -0.13 0.00 0.00 55.73 54.60 1ht1 s ARG 7 Cb -0.12 -2.34 0.12 0.00 -1.56 0.00 0.00 34.95 31.05 1ht1 s ARG 7 CO 0.02 -0.01 0.86 0.50 -0.81 0.00 0.00 175.30 175.86 1ht1 s ARG 8 N 0.82 0.53 -1.12 5.12 3.52 -0.15 -4.96 118.95 122.71 1ht1 s ARG 8 Ca -0.08 0.89 -0.10 0.00 -0.13 0.00 0.00 55.73 56.32 1ht1 s ARG 8 Cb -0.16 0.12 -0.04 0.00 -1.56 0.00 0.00 34.95 33.32 1ht1 s ARG 8 CO -0.01 -0.11 0.86 0.09 -0.81 0.00 0.00 175.30 175.32 1ht1 n ASN 9 N 3.82 -5.27 -3.13 -2.12 3.02 -1.26 -3.04 115.26 107.28 1ht1 n ASN 9 Ca -0.19 -0.81 -0.22 0.00 -0.03 0.00 0.00 54.58 53.33 1ht1 n ASN 9 Cb 0.58 -4.50 0.05 0.00 -0.61 0.00 0.00 39.78 35.31 1ht1 n ASN 9 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1ht1 n GLY 10 N -1.41 -0.47 3.30 7.41 0.00 -1.26 -4.69 105.19 108.07 1ht1 n GLY 10 Ca -0.12 0.14 -0.13 0.00 0.00 0.00 0.00 46.02 45.92 1ht1 n GLY 10 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1ht1 s HIS 11 N -3.22 -0.49 -0.05 1.61 3.76 -1.17 -2.03 115.29 113.71 1ht1 s HIS 11 Ca 0.41 1.15 -0.03 0.00 -0.15 0.00 0.00 55.06 56.45 1ht1 s HIS 11 Cb -0.18 0.18 0.03 0.00 1.11 0.00 0.00 32.58 33.72 1ht1 s HIS 11 CO 0.51 -0.24 0.11 0.54 -0.85 0.00 0.00 174.74 174.81 1ht1 s VAL 12 N 0.44 -0.04 0.08 -0.90 0.11 -0.91 -0.98 120.40 118.21 1ht1 s VAL 12 Ca -0.02 0.13 0.02 0.00 -2.93 0.00 0.00 61.98 59.18 1ht1 s VAL 12 Cb -0.04 -0.19 -0.04 0.00 -1.53 0.00 0.00 36.38 34.59 1ht1 s VAL 12 CO -0.02 0.05 -0.06 0.68 -3.33 0.00 0.00 175.10 172.42 1ht1 s VAL 13 N 0.81 0.59 -0.08 2.04 -7.23 -0.86 -1.86 120.40 113.81 1ht1 s VAL 13 Ca -0.06 -1.69 0.01 0.00 -1.81 0.00 0.00 61.98 58.43 1ht1 s VAL 13 Cb -0.08 -1.37 0.02 0.00 0.56 0.00 0.00 36.38 35.51 1ht1 s VAL 13 CO -0.04 -0.76 -0.09 -0.63 -0.31 0.00 0.00 175.10 173.27 1ht1 s ILE 14 N -3.05 1.02 -0.05 -0.62 1.01 -1.24 -1.69 121.20 116.58 1ht1 s ILE 14 Ca 0.05 -0.35 0.02 0.00 0.00 0.00 0.00 60.65 60.37 1ht1 s ILE 14 Cb 0.01 -0.98 0.02 0.00 0.01 0.00 0.00 42.46 41.52 1ht1 s ILE 14 CO -0.04 0.35 -0.08 0.00 0.00 0.00 0.00 174.94 175.17 1ht1 s ALA 15 N 1.15 0.90 0.36 9.38 0.00 0.06 -1.40 121.76 132.20 1ht1 s ALA 15 Ca -0.06 -0.21 0.04 0.00 0.00 0.00 0.00 51.96 51.73 1ht1 s ALA 15 Cb -0.14 -0.45 -0.06 0.00 0.00 0.00 0.00 23.12 22.47 1ht1 s ALA 15 CO -0.02 0.06 0.06 0.20 0.00 0.00 0.00 175.76 176.06 1ht1 s GLY 16 N 0.71 2.29 0.36 0.00 0.00 -1.15 -1.99 107.32 107.54 1ht1 s GLY 16 Ca -0.12 -1.84 0.05 0.00 0.00 0.00 0.00 44.72 42.82 1ht1 s GLY 16 CO 0.02 -1.89 0.45 2.09 0.00 0.00 0.00 173.10 173.77 1ht1 n ASP 17 N -0.87 1.47 -0.16 1.64 5.75 -1.22 -2.05 116.55 121.11 1ht1 n ASP 17 Ca -0.04 -2.00 0.09 0.00 -0.01 0.00 0.00 54.79 52.82 1ht1 n ASP 17 Cb 0.66 -0.22 0.14 0.00 -1.03 0.00 0.00 41.12 40.68 1ht1 n ASP 17 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1ht1 n GLY 18 N 0.66 4.69 3.76 6.12 0.00 -0.95 -4.36 105.19 115.10 1ht1 n GLY 18 Ca 0.08 -1.10 -0.39 0.00 0.00 0.00 0.00 46.02 44.61 1ht1 n GLY 18 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1ht1 s GLN 19 N -2.77 4.28 -0.10 1.61 0.74 -1.26 -0.93 119.66 121.23 1ht1 s GLN 19 Ca 0.31 0.64 0.03 0.00 0.05 0.00 0.00 55.36 56.39 1ht1 s GLN 19 Cb 0.28 -3.35 0.01 0.00 1.10 0.00 0.00 33.01 31.05 1ht1 s GLN 19 CO 0.02 0.35 -0.19 0.00 -0.55 0.00 0.00 175.29 174.91 1ht1 s ALA 20 N -0.09 1.91 0.23 1.58 0.00 -0.71 -4.50 121.76 120.17 1ht1 s ALA 20 Ca 0.29 -0.84 0.11 0.00 0.00 0.00 0.00 51.96 51.52 1ht1 s ALA 20 Cb -0.17 -0.81 -0.05 0.00 0.00 0.00 0.00 23.12 22.09 1ht1 s ALA 20 CO 0.15 0.09 -0.19 0.99 0.00 0.00 0.00 175.76 176.81 1ht1 s THR 21 N 0.67 2.59 -0.18 0.00 2.01 -1.26 -1.25 115.64 118.21 1ht1 s THR 21 Ca -0.12 -2.11 -0.04 0.00 0.31 0.00 0.00 61.69 59.73 1ht1 s THR 21 Cb -0.16 -2.30 0.09 0.00 0.01 0.00 0.00 72.50 70.14 1ht1 s THR 21 CO 0.03 -0.23 0.27 -0.22 -0.69 0.00 0.00 174.62 173.78 1ht1 s LEU 22 N -3.05 -0.30 0.00 4.42 0.20 -0.75 -4.86 118.68 114.34 1ht1 s LEU 22 Ca 0.25 0.22 0.00 0.00 0.69 0.00 0.00 54.13 55.29 1ht1 s LEU 22 Cb -0.07 0.67 0.00 0.00 -0.43 0.00 0.00 46.19 46.36 1ht1 s LEU 22 CO 0.13 -0.28 0.00 0.61 -0.29 0.00 0.00 176.35 176.52 1ht1 n GLY 23 N 5.34 2.72 0.48 7.98 0.00 -1.26 -1.89 105.19 118.56 1ht1 n GLY 23 Ca -0.05 0.01 0.07 0.00 0.00 0.00 0.00 46.02 46.04 1ht1 n GLY 23 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1ht1 n ASN 24 N 9.90 2.12 -3.99 1.61 3.02 -1.26 -5.04 115.26 121.62 1ht1 n ASN 24 Ca 0.00 -3.56 -0.09 0.00 -0.03 0.00 0.00 54.58 50.91 1ht1 n ASN 24 Cb 0.00 -0.50 -0.10 0.00 -0.61 0.00 0.00 39.78 38.56 1ht1 n ASN 24 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 1ht1 s THR 25 N -3.09 0.15 -0.20 3.41 -4.23 -0.79 -5.14 115.64 105.75 1ht1 s THR 25 Ca 0.37 -1.24 -0.26 0.00 -1.18 0.00 0.00 61.69 59.38 1ht1 s THR 25 Cb 0.34 -0.87 -0.01 0.00 1.34 0.00 0.00 72.50 73.30 1ht1 s THR 25 CO -0.02 -0.68 0.88 -0.69 -0.54 0.00 0.00 174.62 173.57 1ht1 s VAL 26 N -2.62 4.82 -0.05 2.29 1.01 -1.26 -1.81 120.40 122.77 1ht1 s VAL 26 Ca -0.05 1.72 -0.06 0.00 0.00 0.00 0.00 61.98 63.59 1ht1 s VAL 26 Cb -0.01 -4.18 -0.03 0.00 0.00 0.00 0.00 36.38 32.16 1ht1 s VAL 26 CO -0.05 -0.05 0.29 -0.03 0.00 0.00 0.00 175.10 175.26 1ht1 h MET 27 N 7.46 -0.21 -5.31 2.72 -1.53 -1.51 -3.47 114.93 113.08 1ht1 h MET 27 Ca -0.25 0.01 -0.40 0.00 -3.44 0.00 0.00 59.70 55.62 1ht1 h MET 27 Cb 1.10 0.05 -0.20 0.00 -0.55 0.00 0.00 31.60 32.01 1ht1 h MET 27 CO 0.88 -0.14 -0.76 0.21 0.14 0.00 0.00 176.91 177.24 1ht1 s LYS 28 N -2.22 0.90 0.00 0.39 2.20 -1.23 -5.02 119.74 114.77 1ht1 s LYS 28 Ca -0.03 -1.09 0.05 0.00 -0.36 0.00 0.00 55.97 54.53 1ht1 s LYS 28 Cb 0.00 -0.81 0.05 0.00 -1.51 0.00 0.00 37.83 35.56 1ht1 s LYS 28 CO 0.09 0.16 0.70 0.41 -0.36 0.00 0.00 175.35 176.36 1ht1 n GLY 29 N 0.88 -0.58 2.41 5.54 0.00 -1.24 -1.74 105.19 110.45 1ht1 n GLY 29 Ca -0.18 -0.14 -0.21 0.00 0.00 0.00 0.00 46.02 45.49 1ht1 n GLY 29 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1ht1 n ASN 30 N 0.23 1.90 -4.65 1.61 2.04 -0.42 -4.17 115.26 111.80 1ht1 n ASN 30 Ca 0.03 -3.19 -0.41 0.00 -0.44 0.00 0.00 54.58 50.57 1ht1 n ASN 30 Cb 0.14 -0.61 -0.05 0.00 -2.53 0.00 0.00 39.78 36.73 1ht1 n ASN 30 CO 0.00 0.00 0.00 -0.69 -0.44 0.00 0.00 177.26 176.13 1ht1 s VAL 31 N -2.88 4.90 -0.75 3.53 1.01 -0.11 -4.97 120.40 121.13 1ht1 s VAL 31 Ca 0.42 1.43 -0.26 0.00 0.00 0.00 0.00 61.98 63.58 1ht1 s VAL 31 Cb 0.31 -4.06 -0.04 0.00 0.00 0.00 0.00 36.38 32.59 1ht1 s VAL 31 CO -0.10 -0.01 1.93 -0.75 0.00 0.00 0.00 175.10 176.17 1ht1 s LYS 32 N 2.54 2.55 0.10 2.72 2.20 -1.26 -4.25 119.74 124.34 1ht1 s LYS 32 Ca 0.33 0.21 0.18 0.00 -0.36 0.00 0.00 55.97 56.33 1ht1 s LYS 32 Cb -0.16 -4.72 -0.10 0.00 -1.51 0.00 0.00 37.83 31.35 1ht1 s LYS 32 CO 0.09 -3.09 0.89 0.87 -0.36 0.00 0.00 175.35 173.75 1ht1 h LYS 33 N 13.34 0.00 -6.28 4.03 1.57 -1.91 -3.46 116.57 123.85 1ht1 h LYS 33 Ca -0.09 0.00 -0.69 0.00 -1.87 0.00 0.00 60.65 58.01 1ht1 h LYS 33 Cb 1.09 0.00 -0.21 0.00 0.08 0.00 0.00 32.23 33.19 1ht1 h LYS 33 CO 1.21 0.21 -0.74 0.08 -0.57 0.00 0.00 179.45 179.64 1ht1 s VAL 34 N -3.04 3.30 0.00 0.50 1.01 -1.26 -2.05 120.40 118.85 1ht1 s VAL 34 Ca -0.02 -0.68 0.00 0.00 0.00 0.00 0.00 61.98 61.28 1ht1 s VAL 34 Cb 0.09 -2.33 0.00 0.00 0.00 0.00 0.00 36.38 34.14 1ht1 s VAL 34 CO 0.80 0.56 0.00 -2.11 0.00 0.00 0.00 175.10 174.35 1ht1 n ARG 35 N 2.16 0.00 -4.34 2.72 1.85 0.29 -4.95 116.66 114.39 1ht1 n ARG 35 Ca -0.17 0.00 -0.18 0.00 -1.00 0.00 0.00 57.85 56.50 1ht1 n ARG 35 Cb 0.52 0.00 -0.10 0.00 -1.05 0.00 0.00 32.46 31.84 1ht1 n ARG 35 CO 0.00 0.00 0.00 1.03 -0.01 0.00 0.00 177.63 178.65 1ht1 s ARG 36 N 0.35 1.53 -0.09 2.89 0.52 -1.26 -0.96 118.95 121.93 1ht1 s ARG 36 Ca 0.00 -1.86 -0.32 0.00 -0.52 0.00 0.00 55.73 53.03 1ht1 s ARG 36 Cb 0.00 -0.25 0.13 0.00 0.52 0.00 0.00 34.95 35.35 1ht1 s ARG 36 CO 0.00 -0.37 1.31 -0.48 0.02 0.00 0.00 175.30 175.78 1ht1 s LEU 37 N -3.37 -0.06 -1.15 2.53 2.34 0.21 -4.86 118.68 114.32 1ht1 s LEU 37 Ca 0.36 -0.08 -0.00 0.00 0.06 0.00 0.00 54.13 54.47 1ht1 s LEU 37 Cb 0.06 1.29 -0.00 0.00 -0.56 0.00 0.00 46.19 46.98 1ht1 s LEU 37 CO 0.15 -0.21 0.96 0.00 -1.06 0.00 0.00 176.35 176.19 1ht1 n TYR 38 N -0.38 -2.10 -2.81 3.48 9.36 -1.26 -0.31 117.16 123.14 1ht1 n TYR 38 Ca -0.06 0.90 -0.11 0.00 3.32 0.00 0.00 57.90 61.96 1ht1 n TYR 38 Cb 0.62 -4.96 0.05 0.00 -0.63 0.00 0.00 39.34 34.42 1ht1 n TYR 38 CO 0.00 0.00 0.00 0.09 0.22 0.00 0.00 176.86 177.17 1ht1 n ASN 39 N -3.04 -5.58 -0.91 2.98 4.13 -1.26 -2.90 115.26 108.67 1ht1 n ASN 39 Ca -0.28 -0.50 -0.02 0.00 1.68 0.00 0.00 54.58 55.46 1ht1 n ASN 39 Cb 0.66 -4.08 -0.01 0.00 -1.54 0.00 0.00 39.78 34.81 1ht1 n ASN 39 CO 0.00 0.00 0.00 0.47 0.28 0.00 0.00 177.26 178.01 1ht1 n ASP 40 N -2.73 -0.70 -0.02 6.41 9.92 -1.23 -4.65 116.55 123.55 1ht1 n ASP 40 Ca -0.05 0.05 -0.22 0.00 -0.53 0.00 0.00 54.79 54.05 1ht1 n ASP 40 Cb 0.58 -1.02 -0.13 0.00 -0.64 0.00 0.00 41.12 39.91 1ht1 n ASP 40 CO 0.00 0.00 0.00 0.11 0.13 0.00 0.00 177.20 177.44 1ht1 h LYS 41 N 0.00 0.19 -4.91 -1.24 1.57 -1.39 -3.45 116.57 107.34 1ht1 h LYS 41 Ca -0.05 -0.32 -0.67 0.00 -1.87 0.00 0.00 60.65 57.74 1ht1 h LYS 41 Cb 0.16 0.12 -0.18 0.00 0.08 0.00 0.00 32.23 32.42 1ht1 h LYS 41 CO 0.07 1.15 -0.29 0.08 -0.57 0.00 0.00 179.45 179.89 1ht1 s VAL 42 N -2.47 5.16 0.28 0.50 1.01 0.57 -4.59 120.40 120.86 1ht1 s VAL 42 Ca -0.23 -0.06 -0.06 0.00 0.00 0.00 0.00 61.98 61.63 1ht1 s VAL 42 Cb 0.05 -3.86 -0.06 0.00 0.00 0.00 0.00 36.38 32.52 1ht1 s VAL 42 CO 0.72 -0.16 0.56 0.27 0.00 0.00 0.00 175.10 176.50 1ht1 s ILE 43 N 2.01 5.00 0.20 2.22 -4.36 -0.71 0.66 121.20 126.22 1ht1 s ILE 43 Ca 0.11 0.15 -0.21 0.00 -0.26 0.00 0.00 60.65 60.44 1ht1 s ILE 43 Cb -0.17 -3.71 0.05 0.00 1.25 0.00 0.00 42.46 39.88 1ht1 s ILE 43 CO 0.12 -0.28 0.61 0.00 0.24 0.00 0.00 174.94 175.62 1ht1 s ALA 44 N -2.05 -1.32 0.16 2.27 0.00 -0.14 -2.06 121.76 118.63 1ht1 s ALA 44 Ca 0.45 0.08 -0.08 0.00 0.00 0.00 0.00 51.96 52.41 1ht1 s ALA 44 Cb -0.11 0.86 -0.01 0.00 0.00 0.00 0.00 23.12 23.86 1ht1 s ALA 44 CO 0.29 -0.85 0.25 0.20 0.00 0.00 0.00 175.76 175.64 1ht1 s GLY 45 N -2.83 0.57 0.33 0.00 0.00 -0.08 0.10 107.32 105.41 1ht1 s GLY 45 Ca 0.06 -0.98 -0.18 0.00 0.00 0.00 0.00 44.72 43.61 1ht1 s GLY 45 CO -0.05 -0.92 0.84 -0.11 0.00 0.00 0.00 173.10 172.86 1ht1 s PHE 46 N -3.98 0.06 -0.18 1.90 -0.71 -0.87 -0.16 117.98 114.04 1ht1 s PHE 46 Ca 0.19 -0.65 -0.05 0.00 -1.04 0.00 0.00 56.93 55.38 1ht1 s PHE 46 Cb 0.04 0.79 0.07 0.00 -1.21 0.00 0.00 43.02 42.71 1ht1 s PHE 46 CO 0.01 -1.38 0.12 0.00 -1.34 0.00 0.00 175.22 172.63 1ht1 s ALA 47 N -2.52 0.24 0.00 1.99 0.00 -1.15 -4.89 121.76 115.43 1ht1 s ALA 47 Ca 0.16 -0.15 0.00 0.00 0.00 0.00 0.00 51.96 51.97 1ht1 s ALA 47 Cb -0.05 -1.10 0.00 0.00 0.00 0.00 0.00 23.12 21.98 1ht1 s ALA 47 CO 0.09 -1.17 0.00 0.41 0.00 0.00 0.00 175.76 175.09 1ht1 n GLY 48 N 5.29 -0.45 3.65 0.00 0.00 -1.26 -2.25 105.19 110.17 1ht1 n GLY 48 Ca -0.07 -1.38 -0.45 0.00 0.00 0.00 0.00 46.02 44.12 1ht1 n GLY 48 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ht1 n GLY 49 N 0.00 0.53 0.00 -0.02 0.00 -1.26 -4.78 105.19 99.66 1ht1 n GLY 49 Ca 0.00 0.46 0.07 0.00 0.00 0.00 0.00 46.02 46.56 1ht1 n GLY 49 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1ht1 n THR 50 N 1.48 0.01 -0.10 2.61 -1.04 -1.26 -1.61 114.28 114.38 1ht1 n THR 50 Ca 0.11 0.00 -0.14 0.00 -2.04 0.00 0.00 64.05 61.99 1ht1 n THR 50 Cb 0.31 -0.77 -0.09 0.00 -1.82 0.00 0.00 70.33 67.96 1ht1 n THR 50 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1ht1 n ALA 51 N -1.01 1.60 -0.26 2.41 0.00 -1.26 -3.49 120.51 118.50 1ht1 n ALA 51 Ca 0.11 -0.81 0.05 0.00 0.00 0.00 0.00 53.44 52.79 1ht1 n ALA 51 Cb 0.05 0.07 0.18 0.00 0.00 0.00 0.00 19.45 19.76 1ht1 n ALA 51 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 1ht1 h ASP 52 N -0.05 0.29 -0.17 0.00 3.45 -1.65 0.30 116.42 118.59 1ht1 h ASP 52 Ca -0.43 0.11 -0.00 0.00 0.43 0.00 0.00 57.03 57.13 1ht1 h ASP 52 Cb 1.64 0.08 -0.01 0.00 -0.56 0.00 0.00 39.33 40.48 1ht1 h ASP 52 CO -0.08 0.12 0.09 0.00 -1.57 0.00 0.00 179.24 177.79 1ht1 h ALA 53 N 1.54 0.21 -0.98 3.45 0.00 -1.52 0.47 119.26 122.43 1ht1 h ALA 53 Ca 0.41 -0.07 0.21 0.00 0.00 0.00 0.00 54.91 55.47 1ht1 h ALA 53 Cb 0.61 -0.07 -0.09 0.00 0.00 0.00 0.00 17.79 18.24 1ht1 h ALA 53 CO -0.39 -0.24 0.62 0.35 0.00 0.00 0.00 179.25 179.59 1ht1 h PHE 54 N 0.16 0.78 0.17 0.00 -0.00 -0.62 0.29 116.94 117.72 1ht1 h PHE 54 Ca 0.06 0.03 -0.35 0.00 -0.00 0.00 0.00 57.97 57.70 1ht1 h PHE 54 Cb 0.09 -0.24 0.00 0.00 -0.00 0.00 0.00 35.95 35.81 1ht1 h PHE 54 CO -0.03 0.16 -1.76 1.15 -0.00 0.00 0.00 178.31 177.83 1ht1 h THR 55 N 0.55 0.92 0.68 4.41 2.02 -0.01 -3.00 112.91 118.48 1ht1 h THR 55 Ca 0.54 -2.53 -0.03 0.00 0.77 0.00 0.00 66.41 65.16 1ht1 h THR 55 Cb 1.14 2.73 0.01 0.00 -1.74 0.00 0.00 68.15 70.29 1ht1 h THR 55 CO -0.29 0.85 -0.33 -0.07 0.37 0.00 0.00 175.52 176.06 1ht1 h LEU 56 N 0.10 -0.78 -1.35 2.58 3.38 0.81 -2.39 115.31 117.66 1ht1 h LEU 56 Ca -0.34 0.03 0.10 0.00 0.09 0.00 0.00 57.88 57.75 1ht1 h LEU 56 Cb 2.09 0.20 -0.05 0.00 0.09 0.00 0.00 40.66 42.98 1ht1 h LEU 56 CO 0.17 -0.41 0.52 -0.26 0.09 0.00 0.00 178.44 178.55 1ht1 h PHE 57 N -1.22 0.77 -0.16 1.13 0.04 -0.67 -1.07 116.94 115.76 1ht1 h PHE 57 Ca -0.09 0.02 0.03 0.00 2.80 0.00 0.00 57.97 60.73 1ht1 h PHE 57 Cb 0.70 -0.25 -0.06 0.00 2.20 0.00 0.00 35.95 38.54 1ht1 h PHE 57 CO 0.00 0.36 -0.47 1.49 -0.60 0.00 0.00 178.31 179.09 1ht1 h GLU 58 N 0.72 -0.46 -0.33 1.51 4.57 -1.43 0.62 114.58 119.79 1ht1 h GLU 58 Ca 0.37 0.03 -0.01 0.00 -1.18 0.00 0.00 59.36 58.56 1ht1 h GLU 58 Cb 0.45 0.10 -0.02 0.00 -0.16 0.00 0.00 28.75 29.13 1ht1 h GLU 58 CO -0.14 -0.30 0.15 1.25 -1.18 0.00 0.00 179.01 178.79 1ht1 h LEU 59 N -0.47 0.40 -1.48 1.64 5.85 -0.86 -0.35 115.31 120.04 1ht1 h LEU 59 Ca 0.03 -0.03 -0.04 0.00 0.84 0.00 0.00 57.88 58.69 1ht1 h LEU 59 Cb 0.57 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.50 1ht1 h LEU 59 CO -0.41 0.35 -0.18 0.15 -0.34 0.00 0.00 178.44 178.02 1ht1 h PHE 60 N 0.46 0.00 -0.17 1.25 3.57 0.32 -0.43 116.94 121.94 1ht1 h PHE 60 Ca 0.12 0.00 -0.05 0.00 3.53 0.00 0.00 57.97 61.56 1ht1 h PHE 60 Cb 0.06 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 38.80 1ht1 h PHE 60 CO 0.00 0.18 -0.11 0.93 -2.23 0.00 0.00 178.31 177.08 1ht1 h GLU 61 N 0.00 0.38 0.55 1.11 4.39 0.19 -3.21 114.58 117.99 1ht1 h GLU 61 Ca -0.00 -0.17 -0.03 0.00 0.34 0.00 0.00 59.36 59.50 1ht1 h GLU 61 Cb 0.56 -0.01 0.01 0.00 -0.10 0.00 0.00 28.75 29.21 1ht1 h GLU 61 CO 0.02 0.70 -0.26 0.00 -1.16 0.00 0.00 179.01 178.31 1ht1 h ARG 62 N 0.05 -0.71 -0.89 2.33 3.08 -1.26 -3.29 114.38 113.70 1ht1 h ARG 62 Ca 0.04 0.05 0.25 0.00 0.07 0.00 0.00 59.98 60.39 1ht1 h ARG 62 Cb 0.60 0.16 -0.16 0.00 0.08 0.00 0.00 29.97 30.65 1ht1 h ARG 62 CO 0.03 -0.47 0.05 1.63 -1.07 0.00 0.00 179.97 180.13 1ht1 n LYS 63 N -4.63 -0.07 -0.14 0.04 4.76 -0.22 0.12 118.16 118.03 1ht1 n LYS 63 Ca -0.09 1.32 -0.04 0.00 -2.87 0.00 0.00 58.31 56.63 1ht1 n LYS 63 Cb 0.29 -2.11 0.05 0.00 -1.84 0.00 0.00 35.03 31.41 1ht1 n LYS 63 CO 0.00 0.00 0.00 -0.07 -1.37 0.00 0.00 177.40 175.96 1ht1 h LEU 64 N 0.00 0.02 -0.45 -0.35 3.38 -1.63 0.25 115.31 116.54 1ht1 h LEU 64 Ca 0.55 0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.60 1ht1 h LEU 64 Cb 1.16 0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.99 1ht1 h LEU 64 CO -0.82 0.05 0.29 -0.33 0.09 0.00 0.00 178.44 177.71 1ht1 h GLU 65 N 0.23 0.59 0.00 1.13 5.08 0.86 0.13 114.58 122.60 1ht1 h GLU 65 Ca 0.22 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.54 1ht1 h GLU 65 Cb 0.27 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.39 1ht1 h GLU 65 CO -0.28 0.40 0.00 -1.33 -1.00 0.00 0.00 179.01 176.81 1ht1 n MET 66 N -4.77 0.12 -3.20 2.33 2.81 -0.37 -3.67 117.12 110.37 1ht1 n MET 66 Ca 0.01 0.38 -0.23 0.00 -1.81 0.00 0.00 57.70 56.06 1ht1 n MET 66 Cb 0.03 -1.74 -0.06 0.00 -0.71 0.00 0.00 33.22 30.74 1ht1 n MET 66 CO 0.00 0.00 0.00 0.72 1.51 0.00 0.00 175.97 178.20 1ht1 n HIS 67 N -1.97 0.46 -1.83 2.03 8.25 0.78 -5.02 115.22 117.91 1ht1 n HIS 67 Ca 0.02 -3.72 0.00 0.00 -0.26 0.00 0.00 57.72 53.76 1ht1 n HIS 67 Cb 0.19 -0.40 0.00 0.00 1.12 0.00 0.00 29.99 30.90 1ht1 n HIS 67 CO 0.00 0.00 0.00 1.04 0.64 0.00 0.00 176.34 178.02 1ht1 n GLN 68 N 0.95 -0.14 -0.11 -0.41 6.02 -1.01 0.11 117.38 122.80 1ht1 n GLN 68 Ca 0.24 -0.07 0.00 0.00 -0.01 0.00 0.00 57.00 57.16 1ht1 n GLN 68 Cb 0.54 0.12 0.00 0.00 1.02 0.00 0.00 30.24 31.92 1ht1 n GLN 68 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1ht1 n GLY 69 N -0.39 0.00 3.57 1.08 0.00 0.33 -4.77 105.19 105.02 1ht1 n GLY 69 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 1ht1 n GLY 69 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1ht1 s HIS 70 N -0.12 1.64 0.20 1.61 5.04 0.12 -4.74 115.29 119.03 1ht1 s HIS 70 Ca 0.00 1.16 -0.05 0.00 -1.54 0.00 0.00 55.06 54.63 1ht1 s HIS 70 Cb 0.00 -3.77 0.35 0.00 0.04 0.00 0.00 32.58 29.20 1ht1 s HIS 70 CO 0.00 -1.21 1.08 -0.11 -2.34 0.00 0.00 174.74 172.16 1ht1 n LEU 71 N 16.20 -0.23 -0.16 8.88 -0.00 -1.26 0.90 117.00 141.33 1ht1 n LEU 71 Ca 0.43 1.19 -0.06 0.00 -0.00 0.00 0.00 56.01 57.57 1ht1 n LEU 71 Cb 0.46 -0.37 0.04 0.00 -0.00 0.00 0.00 43.42 43.55 1ht1 n LEU 71 CO 0.62 -1.15 1.04 0.58 -0.00 0.00 0.00 177.39 178.49 1ht1 h VAL 72 N 0.00 1.03 0.12 1.96 2.07 -1.94 -0.13 116.25 119.35 1ht1 h VAL 72 Ca 0.34 -0.19 -0.30 0.00 0.82 0.00 0.00 66.70 67.38 1ht1 h VAL 72 Cb 0.55 0.42 -0.00 0.00 -1.52 0.00 0.00 31.29 30.74 1ht1 h VAL 72 CO -0.70 0.10 -1.45 0.11 0.02 0.00 0.00 177.57 175.65 1ht1 h LYS 73 N 0.56 0.25 0.00 1.57 1.79 -0.19 0.89 116.57 121.44 1ht1 h LYS 73 Ca 0.20 -0.42 -0.01 0.00 -2.18 0.00 0.00 60.65 58.24 1ht1 h LYS 73 Cb 0.05 0.16 -0.00 0.00 -1.58 0.00 0.00 32.23 30.85 1ht1 h LYS 73 CO -0.11 1.13 -0.04 0.00 -1.08 0.00 0.00 179.45 179.35 1ht1 h ALA 74 N 0.53 1.41 0.08 3.86 0.00 0.60 -0.03 119.26 125.71 1ht1 h ALA 74 Ca -0.21 -0.04 -0.33 0.00 0.00 0.00 0.00 54.91 54.33 1ht1 h ALA 74 Cb 2.00 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 19.76 1ht1 h ALA 74 CO 0.17 0.05 -1.81 0.00 0.00 0.00 0.00 179.25 177.66 1ht1 n ALA 75 N -2.29 0.89 -0.06 0.00 0.00 -0.07 -3.36 120.51 115.62 1ht1 n ALA 75 Ca -0.03 -0.59 0.08 0.00 0.00 0.00 0.00 53.44 52.90 1ht1 n ALA 75 Cb 0.13 -0.59 0.46 0.00 0.00 0.00 0.00 19.45 19.45 1ht1 n ALA 75 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 177.50 177.26 1ht1 h VAL 76 N -0.30 1.00 0.01 0.00 3.04 -0.22 0.63 116.25 120.40 1ht1 h VAL 76 Ca -0.42 -0.17 -0.21 0.00 -1.01 0.00 0.00 66.70 64.89 1ht1 h VAL 76 Cb 1.79 0.45 -0.00 0.00 -2.01 0.00 0.00 31.29 31.51 1ht1 h VAL 76 CO -0.03 0.09 -0.93 -0.33 -1.01 0.00 0.00 177.57 175.37 1ht1 h GLU 77 N 0.50 0.29 0.64 4.17 4.39 -1.18 -3.11 114.58 120.29 1ht1 h GLU 77 Ca 0.23 -0.33 -0.03 0.00 0.34 0.00 0.00 59.36 59.57 1ht1 h GLU 77 Cb 0.26 0.10 -0.01 0.00 -0.10 0.00 0.00 28.75 29.00 1ht1 h GLU 77 CO -0.06 1.03 -0.41 1.25 -1.16 0.00 0.00 179.01 179.66 1ht1 h LEU 78 N 0.16 -1.04 -2.54 1.33 5.85 -0.93 -1.83 115.31 116.32 1ht1 h LEU 78 Ca -0.06 0.06 0.01 0.00 0.84 0.00 0.00 57.88 58.73 1ht1 h LEU 78 Cb 1.56 0.31 -0.00 0.00 0.37 0.00 0.00 40.66 42.90 1ht1 h LEU 78 CO 0.15 -0.63 0.11 0.00 -0.34 0.00 0.00 178.44 177.73 1ht1 h ALA 79 N -0.75 1.36 -0.37 1.25 0.00 -1.34 -1.71 119.26 117.70 1ht1 h ALA 79 Ca -0.08 -0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.77 1ht1 h ALA 79 Cb 0.81 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.59 1ht1 h ALA 79 CO 0.07 -0.13 0.01 -0.22 0.00 0.00 0.00 179.25 178.98 1ht1 h LYS 80 N 0.00 0.64 0.06 0.00 3.11 -1.26 -2.28 116.57 116.84 1ht1 h LYS 80 Ca 0.02 -0.20 -0.00 0.00 -2.81 0.00 0.00 60.65 57.66 1ht1 h LYS 80 Cb 0.23 -0.06 0.00 0.00 -1.00 0.00 0.00 32.23 31.40 1ht1 h LYS 80 CO -0.00 0.74 -0.03 -0.44 -2.81 0.00 0.00 179.45 176.91 1ht1 h ASP 81 N 0.46 -0.07 -0.95 4.20 3.45 -1.11 -1.87 116.42 120.53 1ht1 h ASP 81 Ca 0.11 -0.36 0.30 0.00 0.43 0.00 0.00 57.03 57.50 1ht1 h ASP 81 Cb 0.45 0.02 -0.15 0.00 -0.56 0.00 0.00 39.33 39.08 1ht1 h ASP 81 CO 0.02 0.33 0.38 -0.25 -1.57 0.00 0.00 179.24 178.15 1ht1 h TRP 82 N -0.48 0.59 0.06 4.55 2.91 -1.33 0.40 115.95 122.65 1ht1 h TRP 82 Ca -0.01 0.05 -0.33 0.00 1.13 0.00 0.00 58.89 59.73 1ht1 h TRP 82 Cb 0.42 -0.10 -0.04 0.00 -0.51 0.00 0.00 29.16 28.93 1ht1 h TRP 82 CO 0.06 -0.26 -1.89 -2.13 -1.03 0.00 0.00 178.44 173.19 1ht1 n ARG 83 N -5.19 0.69 0.07 2.65 0.00 -0.87 -3.50 116.66 110.51 1ht1 n ARG 83 Ca 0.28 0.27 -0.21 0.00 -0.00 0.00 0.00 57.85 58.18 1ht1 n ARG 83 Cb 0.89 -1.74 -0.15 0.00 0.00 0.00 0.00 32.46 31.46 1ht1 n ARG 83 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.63 178.78 1ht1 h THR 84 N 0.03 1.40 -4.01 5.15 2.02 -0.69 -3.47 112.91 113.35 1ht1 h THR 84 Ca -0.37 -2.56 -0.51 0.00 0.77 0.00 0.00 66.41 63.74 1ht1 h THR 84 Cb 2.03 3.11 0.08 0.00 -1.74 0.00 0.00 68.15 71.63 1ht1 h THR 84 CO 0.08 0.74 0.50 -0.62 0.37 0.00 0.00 175.52 176.59 1ht1 s ASP 85 N -7.11 6.01 -0.11 4.18 -1.08 0.13 -4.98 116.67 113.72 1ht1 s ASP 85 Ca -0.13 2.38 -0.05 0.00 -0.52 0.00 0.00 52.55 54.22 1ht1 s ASP 85 Cb 0.02 -2.61 -0.04 0.00 -1.46 0.00 0.00 42.92 38.83 1ht1 s ASP 85 CO 0.85 -1.03 0.13 -0.09 0.52 0.00 0.00 175.17 175.55 1ht1 h ARG 86 N 1.93 -0.01 -0.39 4.34 2.43 -1.90 -2.19 114.38 118.59 1ht1 h ARG 86 Ca -0.50 0.00 0.04 0.00 -0.81 0.00 0.00 59.98 58.72 1ht1 h ARG 86 Cb 1.26 0.00 -0.07 0.00 -0.42 0.00 0.00 29.97 30.74 1ht1 h ARG 86 CO 0.60 0.15 -0.43 0.52 -1.51 0.00 0.00 179.97 179.30 1ht1 h MET 87 N -1.00 -0.24 -0.95 0.20 2.86 -1.97 -0.84 114.93 113.00 1ht1 h MET 87 Ca -0.00 0.02 0.12 0.00 -2.06 0.00 0.00 59.70 57.78 1ht1 h MET 87 Cb 0.16 0.05 -0.08 0.00 0.06 0.00 0.00 31.60 31.79 1ht1 h MET 87 CO 0.00 -0.16 0.57 -0.07 1.06 0.00 0.00 176.91 178.32 1ht1 h LEU 88 N -0.25 0.82 -1.00 1.22 3.38 -1.89 -2.54 115.31 115.05 1ht1 h LEU 88 Ca 0.07 0.06 0.00 0.00 0.09 0.00 0.00 57.88 58.09 1ht1 h LEU 88 Cb 0.43 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.07 1ht1 h LEU 88 CO -0.50 0.43 0.24 -1.14 0.09 0.00 0.00 178.44 177.56 1ht1 n ARG 89 N -4.68 0.10 0.08 1.13 0.63 -0.32 -1.99 116.66 111.60 1ht1 n ARG 89 Ca 0.18 0.59 -0.13 0.00 -0.92 0.00 0.00 57.85 57.56 1ht1 n ARG 89 Cb 0.36 -2.07 -0.06 0.00 0.45 0.00 0.00 32.46 31.14 1ht1 n ARG 89 CO 0.00 0.00 0.00 0.87 -2.51 0.00 0.00 177.63 175.99 1ht1 h LYS 90 N 0.00 0.36 -6.11 -0.14 1.79 -1.43 -3.44 116.57 107.59 1ht1 h LYS 90 Ca 0.00 -0.42 -0.56 0.00 -2.18 0.00 0.00 60.65 57.49 1ht1 h LYS 90 Cb 0.48 0.13 -0.05 0.00 -1.58 0.00 0.00 32.23 31.21 1ht1 h LYS 90 CO 0.00 1.11 0.29 -0.48 -1.08 0.00 0.00 179.45 179.30 1ht1 s LEU 91 N -7.58 4.28 -0.08 2.94 0.05 -0.84 -5.06 118.68 112.40 1ht1 s LEU 91 Ca -0.05 1.33 0.03 0.00 0.05 0.00 0.00 54.13 55.49 1ht1 s LEU 91 Cb 0.09 -3.29 -0.02 0.00 -2.05 0.00 0.00 46.19 40.92 1ht1 s LEU 91 CO 0.87 -0.27 -0.18 -1.83 -0.55 0.00 0.00 176.35 174.39 1ht1 s GLU 92 N 1.39 2.79 0.07 1.48 -1.05 -1.26 -4.93 118.70 117.19 1ht1 s GLU 92 Ca 0.42 -0.77 -0.05 0.00 -0.15 0.00 0.00 54.97 54.42 1ht1 s GLU 92 Cb -0.18 -2.37 0.02 0.00 -0.44 0.00 0.00 34.13 31.15 1ht1 s GLU 92 CO 0.19 0.41 0.26 0.00 0.95 0.00 0.00 175.26 177.07 1ht1 n ALA 93 N 2.91 -0.66 -3.56 -0.84 0.00 -1.26 -4.52 120.51 112.58 1ht1 n ALA 93 Ca -0.18 -0.30 -0.29 0.00 0.00 0.00 0.00 53.44 52.68 1ht1 n ALA 93 Cb 0.52 0.19 -0.12 0.00 0.00 0.00 0.00 19.45 20.04 1ht1 n ALA 93 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1ht1 s LEU 94 N 0.00 1.82 -0.05 0.00 1.43 -0.95 -4.36 118.68 116.57 1ht1 s LEU 94 Ca 0.06 -2.54 -0.30 0.00 -1.03 0.00 0.00 54.13 50.32 1ht1 s LEU 94 Cb -0.01 -0.69 -0.03 0.00 0.03 0.00 0.00 46.19 45.49 1ht1 s LEU 94 CO 0.02 -0.27 1.18 -0.76 0.23 0.00 0.00 176.35 176.75 1ht1 s LEU 95 N 0.56 4.29 -0.26 1.79 1.02 -1.22 -2.95 118.68 121.92 1ht1 s LEU 95 Ca 0.20 1.80 -0.03 0.00 0.02 0.00 0.00 54.13 56.12 1ht1 s LEU 95 Cb -0.19 -3.56 0.02 0.00 0.02 0.00 0.00 46.19 42.48 1ht1 s LEU 95 CO -0.03 -0.55 -0.02 0.00 0.02 0.00 0.00 176.35 175.77 1ht1 s ALA 96 N 2.06 2.83 -0.01 4.21 0.00 0.77 -1.28 121.76 130.33 1ht1 s ALA 96 Ca 0.55 -1.41 0.06 0.00 0.00 0.00 0.00 51.96 51.17 1ht1 s ALA 96 Cb -0.24 -1.82 -0.02 0.00 0.00 0.00 0.00 23.12 21.04 1ht1 s ALA 96 CO 0.22 -0.78 -0.20 0.08 0.00 0.00 0.00 175.76 175.08 1ht1 s VAL 97 N 1.40 1.58 0.11 0.00 1.01 0.21 -0.90 120.40 123.81 1ht1 s VAL 97 Ca 0.02 -0.86 -0.12 0.00 0.00 0.00 0.00 61.98 61.02 1ht1 s VAL 97 Cb -0.16 -1.31 0.01 0.00 0.00 0.00 0.00 36.38 34.92 1ht1 s VAL 97 CO -0.02 0.44 0.30 0.00 0.00 0.00 0.00 175.10 175.82 1ht1 s ALA 98 N -0.47 -0.53 0.00 5.51 0.00 -0.88 0.16 121.76 125.55 1ht1 s ALA 98 Ca 0.08 -0.38 0.00 0.00 0.00 0.00 0.00 51.96 51.65 1ht1 s ALA 98 Cb -0.08 0.62 0.00 0.00 0.00 0.00 0.00 23.12 23.66 1ht1 s ALA 98 CO -0.01 -0.59 0.00 -0.40 0.00 0.00 0.00 175.76 174.76 1ht1 n ASP 99 N -0.15 0.00 -0.33 0.00 5.75 -1.00 -1.74 116.55 119.07 1ht1 n ASP 99 Ca -0.15 -0.72 -0.02 0.00 -0.01 0.00 0.00 54.79 53.90 1ht1 n ASP 99 Cb 0.63 0.00 0.02 0.00 -1.03 0.00 0.00 41.12 40.74 1ht1 n ASP 99 CO 0.00 0.00 0.00 1.21 -0.11 0.00 0.00 177.20 178.30 1ht1 n GLU 100 N 0.00 -0.22 -0.07 0.11 4.07 -1.26 -3.27 120.64 120.00 1ht1 n GLU 100 Ca 0.00 1.30 -0.09 0.00 -0.06 0.00 0.00 57.16 58.31 1ht1 n GLU 100 Cb 0.00 -1.93 -0.06 0.00 -0.06 0.00 0.00 31.44 29.40 1ht1 n GLU 100 CO 0.00 0.00 0.00 1.79 -0.06 0.00 0.00 177.13 178.86 1ht1 h THR 101 N 0.00 0.62 -3.85 6.31 1.35 -1.98 -3.50 112.91 111.85 1ht1 h THR 101 Ca 0.28 -1.56 -0.09 0.00 -0.55 0.00 0.00 66.41 64.49 1ht1 h THR 101 Cb 0.49 1.26 -0.14 0.00 -1.73 0.00 0.00 68.15 68.03 1ht1 h THR 101 CO -0.84 0.21 -0.39 0.00 -0.25 0.00 0.00 175.52 174.26 1ht1 s ALA 102 N -2.48 -0.14 0.31 6.62 0.00 -1.20 -5.16 121.76 119.72 1ht1 s ALA 102 Ca -0.14 -0.70 0.07 0.00 0.00 0.00 0.00 51.96 51.19 1ht1 s ALA 102 Cb 0.01 0.52 -0.02 0.00 0.00 0.00 0.00 23.12 23.63 1ht1 s ALA 102 CO 0.33 -0.52 0.38 -1.12 0.00 0.00 0.00 175.76 174.83 1ht1 s SER 103 N -2.88 5.78 0.00 0.00 0.01 -1.26 -2.38 113.70 112.98 1ht1 s SER 103 Ca 0.07 -0.25 0.00 0.00 1.31 0.00 0.00 55.95 57.08 1ht1 s SER 103 Cb 0.05 -1.26 0.00 0.00 0.21 0.00 0.00 66.02 65.02 1ht1 s SER 103 CO -0.10 -0.32 0.00 0.00 0.41 0.00 0.00 173.24 173.24 1ht1 n LEU 104 N -1.49 0.00 -4.48 2.44 -0.00 0.12 -4.79 117.00 108.81 1ht1 n LEU 104 Ca -0.03 0.00 -0.32 0.00 -0.00 0.00 0.00 56.01 55.66 1ht1 n LEU 104 Cb 0.58 0.00 -0.13 0.00 -0.00 0.00 0.00 43.42 43.88 1ht1 n LEU 104 CO 0.43 0.00 -0.46 -0.63 -0.00 0.00 0.00 177.39 176.73 1ht1 s ILE 105 N -2.00 3.04 0.16 1.47 -1.09 -0.29 -0.62 121.20 121.87 1ht1 s ILE 105 Ca 0.00 -0.84 0.09 0.00 -2.23 0.00 0.00 60.65 57.67 1ht1 s ILE 105 Cb 0.00 -2.22 -0.04 0.00 -1.58 0.00 0.00 42.46 38.62 1ht1 s ILE 105 CO 0.00 0.51 -0.19 -0.63 -1.23 0.00 0.00 174.94 173.40 1ht1 s ILE 106 N -0.80 1.89 0.09 2.92 1.01 -0.41 -2.90 121.20 123.00 1ht1 s ILE 106 Ca 0.13 -1.90 0.02 0.00 0.00 0.00 0.00 60.65 58.90 1ht1 s ILE 106 Cb -0.11 -1.86 -0.01 0.00 0.01 0.00 0.00 42.46 40.50 1ht1 s ILE 106 CO 0.02 -0.26 0.07 0.35 0.00 0.00 0.00 174.94 175.13 1ht1 n THR 107 N 0.37 0.00 0.09 2.92 -2.24 -1.23 -3.38 114.28 110.81 1ht1 n THR 107 Ca -0.14 -0.62 -0.08 0.00 -2.27 0.00 0.00 64.05 60.94 1ht1 n THR 107 Cb 0.56 0.31 0.00 0.00 -2.10 0.00 0.00 70.33 69.11 1ht1 n THR 107 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 1ht1 h GLY 108 N 0.52 0.20 2.00 3.38 0.00 -1.92 -3.12 103.07 104.14 1ht1 h GLY 108 Ca -0.06 -0.35 0.00 0.00 0.00 0.00 0.00 47.33 46.92 1ht1 h GLY 108 CO 0.09 0.31 0.00 0.70 0.00 0.00 0.00 176.54 177.64 1ht1 n ASN 109 N -3.67 0.62 0.00 0.19 4.13 -1.26 -3.92 115.26 111.35 1ht1 n ASN 109 Ca -0.03 0.70 0.00 0.00 1.68 0.00 0.00 54.58 56.93 1ht1 n ASN 109 Cb 0.79 -0.81 0.00 0.00 -1.54 0.00 0.00 39.78 38.22 1ht1 n ASN 109 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1ht1 n GLY 110 N -0.52 0.76 3.74 7.41 0.00 -1.18 -4.83 105.19 110.56 1ht1 n GLY 110 Ca 0.01 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.69 1ht1 n GLY 110 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1ht1 s ASP 111 N -2.47 4.48 -0.11 1.61 1.11 -1.26 -4.70 116.67 115.32 1ht1 s ASP 111 Ca 0.00 2.20 0.14 0.00 0.18 0.00 0.00 52.55 55.08 1ht1 s ASP 111 Cb 0.00 -2.57 0.29 0.00 1.07 0.00 0.00 42.92 41.71 1ht1 s ASP 111 CO 0.00 -2.06 1.14 0.52 1.18 0.00 0.00 175.17 175.95 1ht1 n VAL 112 N -2.69 1.40 -0.54 -1.27 0.31 -1.26 -3.49 118.33 110.79 1ht1 n VAL 112 Ca 0.12 -1.97 -0.21 0.00 -0.01 0.00 0.00 64.34 62.27 1ht1 n VAL 112 Cb 0.51 0.05 -0.03 0.00 -0.91 0.00 0.00 33.84 33.46 1ht1 n VAL 112 CO 0.00 0.00 0.00 0.52 -1.32 0.00 0.00 176.83 176.03 1ht1 n VAL 113 N -0.85 0.16 -3.93 2.52 0.31 -1.14 -4.46 118.33 110.93 1ht1 n VAL 113 Ca 0.13 -0.04 -0.33 0.00 -0.01 0.00 0.00 64.34 64.09 1ht1 n VAL 113 Cb 0.73 0.00 -0.14 0.00 -0.91 0.00 0.00 33.84 33.52 1ht1 n VAL 113 CO 0.00 0.00 0.00 -1.58 -1.32 0.00 0.00 176.83 173.93 1ht1 s GLN 114 N -0.08 1.72 0.18 5.55 0.74 -1.26 -1.14 119.66 125.37 1ht1 s GLN 114 Ca 0.31 -1.98 -0.33 0.00 0.05 0.00 0.00 55.36 53.41 1ht1 s GLN 114 Cb -0.43 -3.35 -0.15 0.00 1.10 0.00 0.00 33.01 30.18 1ht1 s GLN 114 CO 0.21 -1.01 1.23 -0.35 -0.55 0.00 0.00 175.29 174.82 1ht1 n PRO 115 N 4.18 1.34 0.00 1.67 -0.04 -1.26 -4.89 135.00 135.99 1ht1 n PRO 115 Ca 0.03 0.48 0.00 0.00 -0.04 0.00 0.00 63.50 63.96 1ht1 n PRO 115 Cb 0.41 -2.02 0.00 0.00 -0.04 0.00 0.00 33.50 31.84 1ht1 n PRO 115 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 1ht1 n GLU 116 N 1.90 0.00 -1.39 0.54 4.07 -1.26 -0.51 120.64 123.98 1ht1 n GLU 116 Ca 0.15 0.02 -0.30 0.00 -0.06 0.00 0.00 57.16 56.97 1ht1 n GLU 116 Cb 0.25 -0.06 0.03 0.00 -0.06 0.00 0.00 31.44 31.60 1ht1 n GLU 116 CO 0.00 0.00 0.00 0.09 -0.06 0.00 0.00 177.13 177.16 1ht1 n ASN 117 N -0.28 7.12 -1.52 4.31 3.02 -1.26 -4.75 115.26 121.90 1ht1 n ASN 117 Ca 0.00 -3.51 -0.16 0.00 -0.03 0.00 0.00 54.58 50.88 1ht1 n ASN 117 Cb 0.00 -1.07 -0.07 0.00 -0.61 0.00 0.00 39.78 38.03 1ht1 n ASN 117 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1ht1 n ASP 118 N -0.16 -4.29 -4.71 6.41 9.92 0.33 -4.67 116.55 119.38 1ht1 n ASP 118 Ca 0.50 0.38 -0.38 0.00 -0.53 0.00 0.00 54.79 54.76 1ht1 n ASP 118 Cb 0.52 -3.88 -0.06 0.00 -0.64 0.00 0.00 41.12 37.06 1ht1 n ASP 118 CO 0.00 0.00 0.00 -0.22 0.13 0.00 0.00 177.20 177.11 1ht1 s LEU 119 N -4.23 4.26 -0.01 0.64 2.96 -1.25 -4.25 118.68 116.79 1ht1 s LEU 119 Ca 0.00 0.83 0.06 0.00 -0.22 0.00 0.00 54.13 54.80 1ht1 s LEU 119 Cb 0.00 -2.73 -0.02 0.00 0.50 0.00 0.00 46.19 43.94 1ht1 s LEU 119 CO 0.00 -0.04 -0.20 -0.63 -1.32 0.00 0.00 176.35 174.15 1ht1 s ILE 120 N 0.81 1.61 -0.47 6.68 1.01 -0.13 -4.53 121.20 126.18 1ht1 s ILE 120 Ca 0.27 -0.88 0.06 0.00 0.00 0.00 0.00 60.65 60.10 1ht1 s ILE 120 Cb -0.15 -1.34 0.23 0.00 0.01 0.00 0.00 42.46 41.21 1ht1 s ILE 120 CO 0.11 0.45 0.75 0.00 0.00 0.00 0.00 174.94 176.24 1ht1 n ALA 121 N 2.55 -0.46 -2.15 9.38 0.00 -1.23 -0.93 120.51 127.67 1ht1 n ALA 121 Ca -0.15 -1.84 -0.27 0.00 0.00 0.00 0.00 53.44 51.18 1ht1 n ALA 121 Cb 0.53 -1.23 0.02 0.00 0.00 0.00 0.00 19.45 18.77 1ht1 n ALA 121 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.50 178.46 1ht1 s ILE 122 N 0.32 4.06 0.00 0.00 -4.36 -0.63 -4.00 121.20 116.60 1ht1 s ILE 122 Ca 0.32 0.03 0.00 0.00 -0.26 0.00 0.00 60.65 60.75 1ht1 s ILE 122 Cb 0.16 -3.58 0.00 0.00 1.25 0.00 0.00 42.46 40.29 1ht1 s ILE 122 CO -0.18 -0.58 0.00 0.61 0.24 0.00 0.00 174.94 175.03 1ht1 n GLY 123 N -2.45 1.37 0.58 6.27 0.00 -1.26 -1.53 105.19 108.16 1ht1 n GLY 123 Ca 0.03 -1.75 0.41 0.00 0.00 0.00 0.00 46.02 44.72 1ht1 n GLY 123 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1ht1 h SER 124 N 0.00 0.08 -0.00 1.61 4.64 -1.88 2.07 113.55 120.07 1ht1 h SER 124 Ca 0.00 0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.35 1ht1 h SER 124 Cb 0.00 0.03 0.00 0.00 -0.31 0.00 0.00 62.40 62.12 1ht1 h SER 124 CO 0.00 -0.03 -0.13 0.61 -0.87 0.00 0.00 176.83 176.41 1ht1 n GLY 125 N -1.75 0.45 0.41 -0.77 0.00 -0.81 -4.59 105.19 98.12 1ht1 n GLY 125 Ca 0.35 -0.61 -0.10 0.00 0.00 0.00 0.00 46.02 45.65 1ht1 n GLY 125 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1ht1 h GLY 126 N 4.79 -0.65 2.00 -0.02 0.00 0.33 -1.08 103.07 108.44 1ht1 h GLY 126 Ca 0.00 0.60 -0.00 0.00 0.00 0.00 0.00 47.33 47.93 1ht1 h GLY 126 CO 0.00 -0.16 -0.00 -2.55 0.00 0.00 0.00 176.54 173.83 1ht1 h PRO 127 N -0.31 0.00 -0.04 4.80 0.11 -1.74 0.89 132.00 135.70 1ht1 h PRO 127 Ca 0.13 0.00 -0.22 0.00 0.11 0.00 0.00 66.00 66.02 1ht1 h PRO 127 Cb 0.58 0.00 0.02 0.00 0.11 0.00 0.00 31.00 31.71 1ht1 h PRO 127 CO -0.62 0.00 -0.85 1.88 -0.21 0.00 0.00 178.00 178.20 1ht1 h TYR 128 N 0.00 0.94 -0.70 0.65 0.05 -1.69 -1.48 116.97 114.75 1ht1 h TYR 128 Ca -0.00 -0.48 0.04 0.00 0.05 0.00 0.00 58.73 58.34 1ht1 h TYR 128 Cb 0.00 -0.12 -0.05 0.00 1.01 0.00 0.00 36.73 37.58 1ht1 h TYR 128 CO 0.00 1.31 0.42 0.00 -1.05 0.00 0.00 178.16 178.84 1ht1 h ALA 129 N 0.42 0.92 0.56 3.88 0.00 0.03 -1.54 119.26 123.54 1ht1 h ALA 129 Ca -0.09 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.78 1ht1 h ALA 129 Cb 1.51 -0.19 0.01 0.00 0.00 0.00 0.00 17.79 19.11 1ht1 h ALA 129 CO 0.17 0.16 -0.27 0.37 0.00 0.00 0.00 179.25 179.68 1ht1 h GLN 130 N 0.80 -0.72 -0.80 0.00 4.15 -0.76 0.25 115.11 118.03 1ht1 h GLN 130 Ca 0.29 0.05 0.16 0.00 0.77 0.00 0.00 58.65 59.92 1ht1 h GLN 130 Cb 0.08 0.16 -0.10 0.00 0.21 0.00 0.00 27.48 27.84 1ht1 h GLN 130 CO -0.14 -0.46 0.33 0.00 -1.93 0.00 0.00 178.83 176.63 1ht1 h ALA 131 N -0.37 1.16 -0.00 3.38 0.00 -1.00 0.54 119.26 122.96 1ht1 h ALA 131 Ca -0.08 0.12 -0.20 0.00 0.00 0.00 0.00 54.91 54.76 1ht1 h ALA 131 Cb 0.59 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.47 1ht1 h ALA 131 CO 0.13 -0.22 -0.86 0.00 0.00 0.00 0.00 179.25 178.30 1ht1 h ALA 132 N 1.58 0.53 -0.04 0.00 0.00 -1.15 -2.66 119.26 117.52 1ht1 h ALA 132 Ca 0.45 -0.71 -0.02 0.00 0.00 0.00 0.00 54.91 54.63 1ht1 h ALA 132 Cb 0.71 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.43 1ht1 h ALA 132 CO -0.43 0.89 -0.05 0.00 0.00 0.00 0.00 179.25 179.66 1ht1 h ALA 133 N 0.96 0.07 0.38 0.00 0.00 0.12 -2.79 119.26 118.00 1ht1 h ALA 133 Ca -0.04 -0.28 -0.00 0.00 0.00 0.00 0.00 54.91 54.58 1ht1 h ALA 133 Cb 1.48 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 19.24 1ht1 h ALA 133 CO 0.13 -0.13 -0.38 -0.09 0.00 0.00 0.00 179.25 178.79 1ht1 h ARG 134 N -0.36 -0.75 -0.98 0.00 9.65 -0.09 0.15 114.38 122.01 1ht1 h ARG 134 Ca 0.01 0.05 0.30 0.00 -1.10 0.00 0.00 59.98 59.24 1ht1 h ARG 134 Cb 0.58 0.17 -0.15 0.00 -1.39 0.00 0.00 29.97 29.18 1ht1 h ARG 134 CO 0.01 -0.50 0.49 0.00 2.80 0.00 0.00 179.97 182.77 1ht1 h ALA 135 N -0.37 1.80 0.05 2.80 0.00 -1.53 -0.99 119.26 121.01 1ht1 h ALA 135 Ca -0.03 0.20 -0.14 0.00 0.00 0.00 0.00 54.91 54.93 1ht1 h ALA 135 Cb 0.70 0.19 0.01 0.00 0.00 0.00 0.00 17.79 18.69 1ht1 h ALA 135 CO -0.06 -0.53 -0.60 -0.07 0.00 0.00 0.00 179.25 177.99 1ht1 h LEU 136 N 0.31 0.44 -1.82 0.00 4.07 -1.13 -2.73 115.31 114.46 1ht1 h LEU 136 Ca 0.69 -0.84 0.00 0.00 0.08 0.00 0.00 57.88 57.81 1ht1 h LEU 136 Cb 1.53 -0.14 0.00 0.00 1.08 0.00 0.00 40.66 43.13 1ht1 h LEU 136 CO -0.61 1.23 0.00 0.25 -1.08 0.00 0.00 178.44 178.23 1ht1 h LEU 137 N -0.29 0.00 0.00 1.67 5.85 0.46 -1.42 115.31 121.57 1ht1 h LEU 137 Ca -0.09 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.63 1ht1 h LEU 137 Cb 1.37 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.40 1ht1 h LEU 137 CO 0.11 0.00 -0.72 -0.62 -0.34 0.00 0.00 178.44 176.87 1ht1 n GLU 138 N -2.66 2.76 -0.10 1.25 1.02 -0.49 -4.67 120.64 117.75 1ht1 n GLU 138 Ca -0.01 -0.02 0.02 0.00 -0.02 0.00 0.00 57.16 57.13 1ht1 n GLU 138 Cb 0.12 -1.07 0.03 0.00 -0.02 0.00 0.00 31.44 30.51 1ht1 n GLU 138 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1ht1 n ASN 139 N -1.39 1.16 -3.65 1.62 3.02 -1.03 -5.08 115.26 109.91 1ht1 n ASN 139 Ca 0.01 -1.95 -0.10 0.00 -0.03 0.00 0.00 54.58 52.51 1ht1 n ASN 139 Cb 0.20 -0.12 -0.04 0.00 -0.61 0.00 0.00 39.78 39.20 1ht1 n ASN 139 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 1ht1 s THR 140 N -0.94 0.06 -2.08 3.41 -4.23 -0.56 -5.00 115.64 106.30 1ht1 s THR 140 Ca 0.07 -0.61 0.18 0.00 -1.18 0.00 0.00 61.69 60.15 1ht1 s THR 140 Cb 0.06 -1.26 0.48 0.00 1.34 0.00 0.00 72.50 73.11 1ht1 s THR 140 CO 0.01 -0.26 1.42 -0.62 -0.54 0.00 0.00 174.62 174.63 1ht1 n GLU 141 N -0.26 2.25 -1.17 3.99 -0.58 -1.26 -4.72 120.64 118.89 1ht1 n GLU 141 Ca -0.15 -1.93 -0.35 0.00 -0.42 0.00 0.00 57.16 54.31 1ht1 n GLU 141 Cb 0.64 -1.43 0.08 0.00 -0.57 0.00 0.00 31.44 30.16 1ht1 n GLU 141 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 1ht1 n LEU 142 N 1.08 1.11 -4.89 -4.62 4.77 -1.26 -4.98 117.00 108.21 1ht1 n LEU 142 Ca 0.18 0.55 -0.29 0.00 -0.03 0.00 0.00 56.01 56.42 1ht1 n LEU 142 Cb 0.47 -1.25 -0.02 0.00 -2.33 0.00 0.00 43.42 40.28 1ht1 n LEU 142 CO 0.13 -3.02 0.40 -0.94 -1.33 0.00 0.00 177.39 172.63 1ht1 s SER 143 N -1.63 6.44 0.19 -1.43 1.04 -1.26 -4.88 113.70 112.17 1ht1 s SER 143 Ca 0.65 1.01 -0.14 0.00 0.48 0.00 0.00 55.95 57.95 1ht1 s SER 143 Cb -0.32 -2.27 0.21 0.00 0.10 0.00 0.00 66.02 63.74 1ht1 s SER 143 CO 0.59 -0.41 1.28 0.00 0.98 0.00 0.00 173.24 175.67 1ht1 n ALA 144 N -1.50 -0.08 -0.11 5.32 0.00 -1.26 -0.41 120.51 122.47 1ht1 n ALA 144 Ca 0.01 0.83 -0.13 0.00 0.00 0.00 0.00 53.44 54.15 1ht1 n ALA 144 Cb 0.54 -0.38 -0.03 0.00 0.00 0.00 0.00 19.45 19.58 1ht1 n ALA 144 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 1ht1 h ARG 145 N 0.00 0.83 -0.09 0.00 2.43 -1.92 -2.83 114.38 112.80 1ht1 h ARG 145 Ca 0.29 -0.44 0.02 0.00 -0.81 0.00 0.00 59.98 59.04 1ht1 h ARG 145 Cb 0.50 0.02 -0.00 0.00 -0.42 0.00 0.00 29.97 30.06 1ht1 h ARG 145 CO -0.82 1.07 0.06 0.93 -1.51 0.00 0.00 179.97 179.71 1ht1 h GLU 146 N 0.61 0.05 0.38 0.20 5.08 -1.11 -2.31 114.58 117.48 1ht1 h GLU 146 Ca 0.05 -0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.39 1ht1 h GLU 146 Cb 0.92 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.16 1ht1 h GLU 146 CO 0.08 0.03 -0.18 0.82 -1.00 0.00 0.00 179.01 178.76 1ht1 h ILE 147 N 0.05 0.00 -0.96 3.13 1.08 -0.90 -1.20 117.51 118.71 1ht1 h ILE 147 Ca 0.04 -0.19 0.25 0.00 -0.39 0.00 0.00 64.86 64.56 1ht1 h ILE 147 Cb 0.10 0.00 -0.06 0.00 -3.07 0.00 0.00 36.82 33.79 1ht1 h ILE 147 CO -0.00 0.00 0.65 0.00 -0.69 0.00 0.00 178.15 178.11 1ht1 h ALA 148 N -1.58 2.49 0.01 1.87 0.00 -1.42 0.77 119.26 121.41 1ht1 h ALA 148 Ca -0.05 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.86 1ht1 h ALA 148 Cb 0.39 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.20 1ht1 h ALA 148 CO 0.08 -0.80 -0.01 0.93 0.00 0.00 0.00 179.25 179.46 1ht1 h GLU 149 N 0.24 -0.02 -0.96 0.00 4.39 -1.44 -0.81 114.58 115.98 1ht1 h GLU 149 Ca 0.49 0.00 0.25 0.00 0.34 0.00 0.00 59.36 60.45 1ht1 h GLU 149 Cb 1.51 0.00 -0.13 0.00 -0.10 0.00 0.00 28.75 30.04 1ht1 h GLU 149 CO -0.14 -0.01 0.50 0.87 -1.16 0.00 0.00 179.01 179.07 1ht1 h LYS 150 N -0.05 0.43 -0.80 2.33 1.57 -0.88 0.65 116.57 119.82 1ht1 h LYS 150 Ca -0.00 -0.03 -0.03 0.00 -1.87 0.00 0.00 60.65 58.72 1ht1 h LYS 150 Cb 0.01 -0.10 -0.04 0.00 0.08 0.00 0.00 32.23 32.19 1ht1 h LYS 150 CO 0.00 0.28 0.38 0.00 -0.57 0.00 0.00 179.45 179.54 1ht1 h ALA 151 N 1.75 1.15 -0.26 3.86 0.00 0.46 -2.00 119.26 124.23 1ht1 h ALA 151 Ca 0.63 -0.16 -0.16 0.00 0.00 0.00 0.00 54.91 55.22 1ht1 h ALA 151 Cb 1.26 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.72 1ht1 h ALA 151 CO -0.53 0.64 -0.49 1.25 0.00 0.00 0.00 179.25 180.11 1ht1 h LEU 152 N 1.14 0.77 -0.70 0.00 6.46 0.18 -2.22 115.31 120.95 1ht1 h LEU 152 Ca 0.27 -0.39 -0.04 0.00 -0.12 0.00 0.00 57.88 57.61 1ht1 h LEU 152 Cb 0.13 -0.22 -0.03 0.00 -0.73 0.00 0.00 40.66 39.81 1ht1 h LEU 152 CO -0.03 1.13 0.28 0.44 -0.62 0.00 0.00 178.44 179.64 1ht1 h ASP 153 N 0.56 0.96 0.17 1.25 3.45 -0.80 -1.54 116.42 120.47 1ht1 h ASP 153 Ca 0.03 -0.17 0.01 0.00 0.43 0.00 0.00 57.03 57.33 1ht1 h ASP 153 Cb 1.05 -0.25 -0.03 0.00 -0.56 0.00 0.00 39.33 39.54 1ht1 h ASP 153 CO 0.10 0.87 -0.30 0.40 -1.57 0.00 0.00 179.24 178.74 1ht1 h ILE 154 N 1.00 0.35 0.27 0.35 5.03 -1.21 -1.89 117.51 121.41 1ht1 h ILE 154 Ca 0.23 0.00 -0.00 0.00 -0.12 0.00 0.00 64.86 64.97 1ht1 h ILE 154 Cb 0.20 0.35 -0.03 0.00 -3.03 0.00 0.00 36.82 34.32 1ht1 h ILE 154 CO -0.02 0.00 -0.43 0.00 -0.68 0.00 0.00 178.15 177.02 1ht1 h ALA 155 N 0.09 -1.01 -0.65 1.87 0.00 -1.15 -1.82 119.26 116.59 1ht1 h ALA 155 Ca 0.02 -0.13 0.19 0.00 0.00 0.00 0.00 54.91 54.99 1ht1 h ALA 155 Cb 0.56 0.74 -0.03 0.00 0.00 0.00 0.00 17.79 19.06 1ht1 h ALA 155 CO -0.15 -1.08 0.68 0.78 0.00 0.00 0.00 179.25 179.49 1ht1 h GLY 156 N -0.74 0.00 2.00 0.00 0.00 -1.20 0.71 103.07 103.84 1ht1 h GLY 156 Ca -0.03 0.00 -0.07 0.00 0.00 0.00 0.00 47.33 47.23 1ht1 h GLY 156 CO -0.14 0.00 -0.35 -0.55 0.00 0.00 0.00 176.54 175.50 1ht1 h ASP 157 N 0.00 0.00 0.00 0.19 3.45 -0.48 -3.36 116.42 116.22 1ht1 h ASP 157 Ca 0.31 0.00 -0.28 0.00 0.43 0.00 0.00 57.03 57.49 1ht1 h ASP 157 Cb 1.67 0.00 -0.05 0.00 -0.56 0.00 0.00 39.33 40.39 1ht1 h ASP 157 CO -0.00 0.35 -2.07 -0.38 -1.57 0.00 0.00 179.24 175.56 1ht1 n ILE 158 N -3.27 1.08 -2.60 0.35 5.41 0.17 -4.96 119.36 115.54 1ht1 n ILE 158 Ca 0.02 -0.41 -0.43 0.00 1.00 0.00 0.00 62.75 62.92 1ht1 n ILE 158 Cb 0.61 -1.16 -0.02 0.00 -0.71 0.00 0.00 39.64 38.36 1ht1 n ILE 158 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1ht1 h ILE 160 N 5.37 0.40 -0.64 0.00 1.08 -1.88 -2.28 117.51 119.56 1ht1 h ILE 160 Ca -0.24 -0.47 0.00 0.00 -0.39 0.00 0.00 64.86 63.76 1ht1 h ILE 160 Cb 1.09 1.33 0.00 0.00 -3.07 0.00 0.00 36.82 36.17 1ht1 h ILE 160 CO 0.95 0.09 0.00 -1.22 -0.69 0.00 0.00 178.15 177.28 1ht1 n TYR 161 N -3.47 1.29 -4.54 1.37 4.01 -1.26 -4.91 117.16 109.64 1ht1 n TYR 161 Ca -0.02 -0.59 -0.23 0.00 -0.16 0.00 0.00 57.90 56.90 1ht1 n TYR 161 Cb 0.23 -0.18 -0.16 0.00 -0.31 0.00 0.00 39.34 38.92 1ht1 n TYR 161 CO 0.00 0.00 0.00 0.99 -0.46 0.00 0.00 176.86 177.39 1ht1 s THR 162 N -1.63 1.04 0.22 -0.72 2.01 -0.86 -0.93 115.64 114.77 1ht1 s THR 162 Ca 0.49 -0.45 0.02 0.00 0.31 0.00 0.00 61.69 62.06 1ht1 s THR 162 Cb 0.30 -0.94 0.02 0.00 0.01 0.00 0.00 72.50 71.89 1ht1 s THR 162 CO 0.26 0.33 0.19 -0.46 -0.69 0.00 0.00 174.62 174.24 1ht1 n ASN 163 N 3.60 1.56 -1.51 3.53 0.23 -1.26 -4.49 115.26 116.92 1ht1 n ASN 163 Ca -0.21 -1.73 0.08 0.00 -0.53 0.00 0.00 54.58 52.19 1ht1 n ASN 163 Cb 0.52 -0.04 0.35 0.00 -2.08 0.00 0.00 39.78 38.54 1ht1 n ASN 163 CO 0.00 0.00 0.00 1.41 -0.93 0.00 0.00 177.26 177.74 1ht1 n HIS 164 N -1.09 1.64 -3.19 -2.53 8.25 -1.26 -4.58 115.22 112.47 1ht1 n HIS 164 Ca 0.00 -0.78 -0.39 0.00 -0.26 0.00 0.00 57.72 56.29 1ht1 n HIS 164 Cb 0.25 -0.43 -0.05 0.00 1.12 0.00 0.00 29.99 30.87 1ht1 n HIS 164 CO 0.00 0.00 0.00 0.12 0.64 0.00 0.00 176.34 177.10 1ht1 s PHE 165 N -2.76 3.59 0.51 4.41 5.36 -1.26 -5.00 117.98 122.83 1ht1 s PHE 165 Ca 0.50 1.11 0.03 0.00 -0.96 0.00 0.00 56.93 57.61 1ht1 s PHE 165 Cb 0.39 -2.66 -0.00 0.00 -0.34 0.00 0.00 43.02 40.41 1ht1 s PHE 165 CO 0.14 0.20 0.12 -1.01 -1.46 0.00 0.00 175.22 173.21 1ht1 s HIS 166 N 0.42 1.86 -0.39 10.12 3.76 -1.26 -2.25 115.29 127.55 1ht1 s HIS 166 Ca 0.32 -0.89 0.02 0.00 -0.15 0.00 0.00 55.06 54.36 1ht1 s HIS 166 Cb -0.17 -1.72 0.18 0.00 1.11 0.00 0.00 32.58 31.99 1ht1 s HIS 166 CO 0.15 0.04 0.77 0.99 -0.85 0.00 0.00 174.74 175.85 1ht1 s THR 167 N -2.83 -0.75 0.49 1.30 2.01 -0.87 -4.90 115.64 110.09 1ht1 s THR 167 Ca 0.16 -0.09 -0.08 0.00 0.31 0.00 0.00 61.69 61.99 1ht1 s THR 167 Cb 0.01 0.00 -0.05 0.00 0.01 0.00 0.00 72.50 72.47 1ht1 s THR 167 CO 0.09 0.00 0.84 -0.63 -0.69 0.00 0.00 174.62 174.24 1ht1 s ILE 168 N 1.77 4.82 -0.43 1.82 1.09 -1.26 -2.94 121.20 126.06 1ht1 s ILE 168 Ca 0.17 0.50 0.07 0.00 -1.10 0.00 0.00 60.65 60.29 1ht1 s ILE 168 Cb -0.01 -3.82 0.24 0.00 -1.06 0.00 0.00 42.46 37.80 1ht1 s ILE 168 CO -0.09 -0.81 0.64 -0.62 -0.10 0.00 0.00 174.94 173.95 1ht1 n GLU 169 N -2.07 0.68 -0.31 2.79 -0.58 -0.50 -4.94 120.64 115.71 1ht1 n GLU 169 Ca 0.02 -2.67 -0.30 0.00 -0.42 0.00 0.00 57.16 53.80 1ht1 n GLU 169 Cb 0.55 -1.35 0.29 0.00 -0.57 0.00 0.00 31.44 30.36 1ht1 n GLU 169 CO 0.00 0.00 0.00 -2.00 -0.48 0.00 0.00 177.13 174.65 1ht1 s GLU 170 N -0.36 -2.75 -0.29 3.49 2.12 -1.26 -3.62 118.70 116.03 1ht1 s GLU 170 Ca 0.34 0.33 -0.16 0.00 0.36 0.00 0.00 54.97 55.83 1ht1 s GLU 170 Cb 0.17 -1.38 0.14 0.00 0.26 0.00 0.00 34.13 33.32 1ht1 s GLU 170 CO -0.16 -4.80 0.97 -1.17 -0.54 0.00 0.00 175.26 169.56 1ht1 s LEU 171 N -7.84 -0.53 0.05 2.70 2.96 -0.78 -4.89 118.68 110.35 1ht1 s LEU 171 Ca 0.68 0.83 0.06 0.00 -0.22 0.00 0.00 54.13 55.49 1ht1 s LEU 171 Cb -0.17 1.76 -0.03 0.00 0.50 0.00 0.00 46.19 48.24 1ht1 s LEU 171 CO 0.60 -0.13 -0.13 -0.55 -1.32 0.00 0.00 176.35 174.82 1ht1 s SER 172 N 1.42 4.15 0.00 3.68 0.15 -1.26 -2.14 113.70 119.71 1ht1 s SER 172 Ca -0.09 -0.35 0.00 0.00 0.70 0.00 0.00 55.95 56.22 1ht1 s SER 172 Cb -0.04 -0.78 0.00 0.00 -1.71 0.00 0.00 66.02 63.49 1ht1 s SER 172 CO -0.15 0.24 0.00 0.00 1.20 0.00 0.00 173.24 174.53 1ht1 n TYR 173 N 1.35 0.00 -0.41 3.44 -0.00 -0.86 -5.00 117.16 115.69 1ht1 n TYR 173 Ca -0.15 0.00 0.00 0.00 -0.00 0.00 0.00 57.90 57.75 1ht1 n TYR 173 Cb 0.52 0.00 0.00 0.00 -0.00 0.00 0.00 39.34 39.86 1ht1 n TYR 173 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 176.86 178.49