#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 -0.54 -0.17 4.28 2.01 -1.26 -1.78 115.64 118.18 1ht1 s THR 2 Ca 0.00 -0.11 -0.05 0.00 0.31 0.00 0.00 61.69 61.84 1ht1 s THR 2 Cb 0.00 -0.80 -0.03 0.00 0.01 0.00 0.00 72.50 71.68 1ht1 s THR 2 CO 0.00 -0.17 -0.00 -0.63 -0.69 0.00 0.00 174.62 173.13 1ht1 s ILE 3 N 2.49 4.10 -0.03 1.82 1.01 -0.68 -3.25 121.20 126.67 1ht1 s ILE 3 Ca 0.11 -0.27 0.06 0.00 0.00 0.00 0.00 60.65 60.54 1ht1 s ILE 3 Cb -0.15 -2.83 -0.01 0.00 0.01 0.00 0.00 42.46 39.48 1ht1 s ILE 3 CO -0.17 0.47 -0.20 -0.69 0.00 0.00 0.00 174.94 174.35 1ht1 s VAL 4 N 0.56 1.59 -0.05 2.92 1.01 -0.74 -1.57 120.40 124.13 1ht1 s VAL 4 Ca -0.01 -0.84 0.02 0.00 0.00 0.00 0.00 61.98 61.15 1ht1 s VAL 4 Cb -0.14 -1.34 0.01 0.00 0.00 0.00 0.00 36.38 34.92 1ht1 s VAL 4 CO 0.02 0.45 -0.10 -0.55 0.00 0.00 0.00 175.10 174.92 1ht1 s SER 5 N -0.29 1.42 0.07 3.32 0.15 0.45 -0.18 113.70 118.64 1ht1 s SER 5 Ca 0.03 -0.23 0.04 0.00 0.70 0.00 0.00 55.95 56.50 1ht1 s SER 5 Cb -0.09 -0.56 -0.03 0.00 -1.71 0.00 0.00 66.02 63.62 1ht1 s SER 5 CO 0.01 0.03 -0.11 -0.69 1.20 0.00 0.00 173.24 173.67 1ht1 s VAL 6 N 0.52 0.92 -0.04 4.45 1.01 -0.87 -1.55 120.40 124.84 1ht1 s VAL 6 Ca -0.10 -1.35 -0.00 0.00 0.00 0.00 0.00 61.98 60.53 1ht1 s VAL 6 Cb -0.13 -1.04 0.03 0.00 0.00 0.00 0.00 36.38 35.24 1ht1 s VAL 6 CO 0.02 -0.36 0.01 -0.60 0.00 0.00 0.00 175.10 174.17 1ht1 s ARG 7 N -2.01 0.28 -0.29 2.72 3.52 -1.26 -0.78 118.95 121.12 1ht1 s ARG 7 Ca -0.02 0.13 -0.16 0.00 -0.13 0.00 0.00 55.73 55.56 1ht1 s ARG 7 Cb -0.08 -0.56 0.16 0.00 -1.56 0.00 0.00 34.95 32.92 1ht1 s ARG 7 CO 0.01 -0.19 1.02 0.50 -0.81 0.00 0.00 175.30 175.83 1ht1 s ARG 8 N 1.36 0.30 -0.83 5.12 3.52 0.02 -4.94 118.95 123.51 1ht1 s ARG 8 Ca -0.05 0.59 -0.03 0.00 -0.13 0.00 0.00 55.73 56.11 1ht1 s ARG 8 Cb -0.13 0.17 -0.03 0.00 -1.56 0.00 0.00 34.95 33.40 1ht1 s ARG 8 CO -0.02 -0.08 0.75 0.09 -0.81 0.00 0.00 175.30 175.23 1ht1 n ASN 9 N 4.03 -7.00 -4.06 -2.12 3.02 -1.26 -3.32 115.26 104.55 1ht1 n ASN 9 Ca -0.15 -0.34 -0.30 0.00 -0.03 0.00 0.00 54.58 53.76 1ht1 n ASN 9 Cb 0.56 -5.02 -0.02 0.00 -0.61 0.00 0.00 39.78 34.69 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 -1.51 -0.32 3.37 7.41 0.00 -1.26 -4.72 105.19 108.16 1ht1 n GLY 10 Ca -0.03 0.15 -0.12 0.00 0.00 0.00 0.00 46.02 46.02 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 -3.67 -0.59 -0.02 1.61 3.76 -1.21 -2.41 115.29 112.76 1ht1 s HIS 11 Ca 0.33 1.36 -0.01 0.00 -0.15 0.00 0.00 55.06 56.59 1ht1 s HIS 11 Cb -0.18 0.24 0.01 0.00 1.11 0.00 0.00 32.58 33.76 1ht1 s HIS 11 CO 0.90 -0.30 0.04 0.54 -0.85 0.00 0.00 174.74 175.07 1ht1 s VAL 12 N 0.69 -0.01 0.23 -0.90 0.11 -1.04 -0.80 120.40 118.69 1ht1 s VAL 12 Ca -0.04 0.03 0.02 0.00 -2.93 0.00 0.00 61.98 59.06 1ht1 s VAL 12 Cb -0.05 -0.07 -0.05 0.00 -1.53 0.00 0.00 36.38 34.68 1ht1 s VAL 12 CO -0.05 0.01 0.06 0.68 -3.33 0.00 0.00 175.10 172.47 1ht1 s VAL 13 N 0.16 0.65 -0.08 2.04 -7.23 0.04 -1.66 120.40 114.31 1ht1 s VAL 13 Ca -0.01 -2.00 -0.03 0.00 -1.81 0.00 0.00 61.98 58.13 1ht1 s VAL 13 Cb -0.02 -2.48 0.05 0.00 0.56 0.00 0.00 36.38 34.49 1ht1 s VAL 13 CO -0.00 -0.16 0.17 -0.63 -0.31 0.00 0.00 175.10 174.17 1ht1 s ILE 14 N -3.68 -0.20 -0.06 -0.62 1.01 -1.26 -2.05 121.20 114.34 1ht1 s ILE 14 Ca 0.33 0.29 -0.01 0.00 0.00 0.00 0.00 60.65 61.26 1ht1 s ILE 14 Cb 0.07 -0.29 0.03 0.00 0.01 0.00 0.00 42.46 42.28 1ht1 s ILE 14 CO 0.11 0.12 0.00 0.00 0.00 0.00 0.00 174.94 175.17 1ht1 s ALA 15 N 1.90 0.63 0.34 9.38 0.00 0.74 -1.70 121.76 133.05 1ht1 s ALA 15 Ca -0.02 -0.07 0.10 0.00 0.00 0.00 0.00 51.96 51.97 1ht1 s ALA 15 Cb -0.12 -0.68 -0.06 0.00 0.00 0.00 0.00 23.12 22.26 1ht1 s ALA 15 CO -0.06 -0.40 -0.09 0.20 0.00 0.00 0.00 175.76 175.41 1ht1 s GLY 16 N 1.84 2.17 0.00 0.00 0.00 -1.09 -1.79 107.32 108.45 1ht1 s GLY 16 Ca 0.03 -2.07 0.00 0.00 0.00 0.00 0.00 44.72 42.68 1ht1 s GLY 16 CO -0.04 -2.02 0.00 2.09 0.00 0.00 0.00 173.10 173.13 1ht1 n ASP 17 N -0.80 0.00 0.00 1.64 5.75 -1.20 -1.91 116.55 120.03 1ht1 n ASP 17 Ca -0.05 -0.44 0.00 0.00 -0.01 0.00 0.00 54.79 54.29 1ht1 n ASP 17 Cb 0.63 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.72 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 5.00 -0.14 3.73 6.12 0.00 -1.11 -4.33 105.19 114.46 1ht1 n GLY 18 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 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 -0.23 4.59 -0.11 1.61 0.74 -1.24 -1.41 119.66 123.62 1ht1 s GLN 19 Ca 0.00 1.66 0.03 0.00 0.05 0.00 0.00 55.36 57.10 1ht1 s GLN 19 Cb 0.00 -3.31 0.01 0.00 1.10 0.00 0.00 33.01 30.80 1ht1 s GLN 19 CO 0.00 0.05 -0.21 0.00 -0.55 0.00 0.00 175.29 174.58 1ht1 s ALA 20 N 0.04 2.01 0.27 1.58 0.00 -0.55 -4.50 121.76 120.62 1ht1 s ALA 20 Ca 0.50 -0.90 0.11 0.00 0.00 0.00 0.00 51.96 51.67 1ht1 s ALA 20 Cb -0.28 -0.84 -0.05 0.00 0.00 0.00 0.00 23.12 21.95 1ht1 s ALA 20 CO 0.33 0.12 -0.14 0.99 0.00 0.00 0.00 175.76 177.06 1ht1 s THR 21 N 0.61 2.81 -0.24 0.00 2.01 -1.26 -1.22 115.64 118.35 1ht1 s THR 21 Ca -0.13 -2.21 -0.04 0.00 0.31 0.00 0.00 61.69 59.62 1ht1 s THR 21 Cb -0.17 -2.47 0.13 0.00 0.01 0.00 0.00 72.50 70.00 1ht1 s THR 21 CO 0.04 -0.37 0.44 -0.22 -0.69 0.00 0.00 174.62 173.81 1ht1 s LEU 22 N -3.50 -0.78 0.00 4.42 0.20 -0.92 -4.84 118.68 113.25 1ht1 s LEU 22 Ca 0.30 0.62 0.00 0.00 0.69 0.00 0.00 54.13 55.74 1ht1 s LEU 22 Cb -0.06 1.41 0.00 0.00 -0.43 0.00 0.00 46.19 47.11 1ht1 s LEU 22 CO 0.16 -0.27 0.00 0.61 -0.29 0.00 0.00 176.35 176.56 1ht1 n GLY 23 N 5.39 1.92 0.52 7.98 0.00 -1.26 -2.07 105.19 117.65 1ht1 n GLY 23 Ca -0.05 0.06 0.06 0.00 0.00 0.00 0.00 46.02 46.09 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 10.64 1.66 -4.07 1.61 3.02 -1.26 -5.06 115.26 121.81 1ht1 n ASN 24 Ca 0.00 -3.16 -0.08 0.00 -0.03 0.00 0.00 54.58 51.30 1ht1 n ASN 24 Cb 0.00 -0.43 -0.10 0.00 -0.61 0.00 0.00 39.78 38.64 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 -2.34 0.26 -0.26 3.41 -4.23 -0.88 -5.13 115.64 106.47 1ht1 s THR 25 Ca 0.31 -1.51 -0.23 0.00 -1.18 0.00 0.00 61.69 59.08 1ht1 s THR 25 Cb 0.30 -1.11 -0.01 0.00 1.34 0.00 0.00 72.50 73.02 1ht1 s THR 25 CO -0.04 -0.80 0.76 -0.69 -0.54 0.00 0.00 174.62 173.31 1ht1 s VAL 26 N -3.00 4.88 -0.05 2.29 1.01 -1.26 -2.15 120.40 122.12 1ht1 s VAL 26 Ca -0.00 1.36 -0.21 0.00 0.00 0.00 0.00 61.98 63.13 1ht1 s VAL 26 Cb 0.01 -4.06 -0.15 0.00 0.00 0.00 0.00 36.38 32.18 1ht1 s VAL 26 CO -0.06 -0.07 0.87 -0.03 0.00 0.00 0.00 175.10 175.80 1ht1 h MET 27 N 7.82 -0.24 -4.20 2.72 4.05 -1.49 -3.47 114.93 120.11 1ht1 h MET 27 Ca -0.24 0.02 -0.13 0.00 -0.28 0.00 0.00 59.70 59.06 1ht1 h MET 27 Cb 1.10 0.06 -0.16 0.00 -0.80 0.00 0.00 31.60 31.80 1ht1 h MET 27 CO 0.84 0.16 -0.69 0.21 0.23 0.00 0.00 176.91 177.66 1ht1 s LYS 28 N -3.46 0.55 -0.01 0.39 2.20 -1.22 -5.02 119.74 113.17 1ht1 s LYS 28 Ca -0.12 -1.10 0.04 0.00 -0.36 0.00 0.00 55.97 54.43 1ht1 s LYS 28 Cb 0.01 0.17 -0.06 0.00 -1.51 0.00 0.00 37.83 36.44 1ht1 s LYS 28 CO 0.46 -0.09 0.07 0.41 -0.36 0.00 0.00 175.35 175.83 1ht1 n GLY 29 N 0.42 -0.19 2.75 5.54 0.00 -1.25 -1.48 105.19 110.98 1ht1 n GLY 29 Ca -0.16 -0.09 -0.36 0.00 0.00 0.00 0.00 46.02 45.41 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 -1.79 6.32 -4.60 1.61 2.04 -1.20 -3.59 115.26 114.04 1ht1 n ASN 30 Ca -0.02 -3.70 -0.42 0.00 -0.44 0.00 0.00 54.58 50.00 1ht1 n ASN 30 Cb 0.26 -0.94 -0.04 0.00 -2.53 0.00 0.00 39.78 36.53 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 -4.46 4.69 -0.65 3.53 1.01 -0.50 -4.96 120.40 119.07 1ht1 s VAL 31 Ca 0.43 1.13 -0.26 0.00 0.00 0.00 0.00 61.98 63.28 1ht1 s VAL 31 Cb 0.24 -4.24 -0.06 0.00 0.00 0.00 0.00 36.38 32.31 1ht1 s VAL 31 CO -0.15 -0.41 2.17 -0.75 0.00 0.00 0.00 175.10 175.96 1ht1 s LYS 32 N 3.21 2.23 0.07 2.72 2.20 -1.26 -4.37 119.74 124.54 1ht1 s LYS 32 Ca 0.35 0.73 0.23 0.00 -0.36 0.00 0.00 55.97 56.91 1ht1 s LYS 32 Cb -0.13 -4.64 0.03 0.00 -1.51 0.00 0.00 37.83 31.58 1ht1 s LYS 32 CO 0.16 -3.35 1.00 1.63 -0.36 0.00 0.00 175.35 174.43 1ht1 n LYS 33 N 9.01 0.37 -4.91 4.03 5.02 -1.26 -4.89 118.16 125.53 1ht1 n LYS 33 Ca 0.34 0.01 -0.27 0.00 -2.02 0.00 0.00 58.31 56.36 1ht1 n LYS 33 Cb 0.51 -1.63 -0.16 0.00 -0.02 0.00 0.00 35.03 33.72 1ht1 n LYS 33 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1ht1 s VAL 34 N -3.25 1.56 0.00 -0.18 1.01 -1.26 -1.52 120.40 116.75 1ht1 s VAL 34 Ca 0.02 -0.77 0.00 0.00 0.00 0.00 0.00 61.98 61.23 1ht1 s VAL 34 Cb 0.13 -1.34 0.00 0.00 0.00 0.00 0.00 36.38 35.17 1ht1 s VAL 34 CO 0.80 0.45 0.00 -2.11 0.00 0.00 0.00 175.10 174.24 1ht1 n ARG 35 N 3.28 0.88 -3.84 2.72 1.85 0.12 -4.91 116.66 116.77 1ht1 n ARG 35 Ca -0.19 0.00 -0.10 0.00 -1.00 0.00 0.00 57.85 56.57 1ht1 n ARG 35 Cb 0.53 0.00 -0.06 0.00 -1.05 0.00 0.00 32.46 31.88 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 2.73 1.18 0.01 2.89 0.52 -1.26 -2.75 118.95 122.27 1ht1 s ARG 36 Ca 0.00 -1.00 -0.29 0.00 -0.52 0.00 0.00 55.73 53.92 1ht1 s ARG 36 Cb 0.00 0.43 0.10 0.00 0.52 0.00 0.00 34.95 36.00 1ht1 s ARG 36 CO 0.00 -0.45 1.07 -0.48 0.02 0.00 0.00 175.30 175.46 1ht1 s LEU 37 N -2.91 -0.18 -0.91 2.53 2.34 0.22 -4.91 118.68 114.86 1ht1 s LEU 37 Ca 0.12 -0.17 -0.05 0.00 0.06 0.00 0.00 54.13 54.09 1ht1 s LEU 37 Cb 0.02 1.79 -0.06 0.00 -0.56 0.00 0.00 46.19 47.38 1ht1 s LEU 37 CO -0.03 -0.56 0.80 0.00 -1.06 0.00 0.00 176.35 175.49 1ht1 n TYR 38 N -0.36 -2.18 -3.33 3.48 9.36 -1.26 -0.69 117.16 122.18 1ht1 n TYR 38 Ca -0.06 0.76 -0.17 0.00 3.32 0.00 0.00 57.90 61.75 1ht1 n TYR 38 Cb 0.61 -3.92 0.07 0.00 -0.63 0.00 0.00 39.34 35.47 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 -2.96 -5.56 -2.59 2.98 3.02 -1.26 -2.83 115.26 106.05 1ht1 n ASN 39 Ca -0.06 -0.72 -0.03 0.00 -0.03 0.00 0.00 54.58 53.74 1ht1 n ASN 39 Cb 0.60 -5.03 -0.00 0.00 -0.61 0.00 0.00 39.78 34.74 1ht1 n ASN 39 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1ht1 n ASP 40 N -3.17 -1.29 -0.13 6.41 8.00 -1.25 -4.73 116.55 120.40 1ht1 n ASP 40 Ca -0.12 0.39 -0.23 0.00 0.71 0.00 0.00 54.79 55.54 1ht1 n ASP 40 Cb 0.63 -1.23 -0.11 0.00 -0.02 0.00 0.00 41.12 40.40 1ht1 n ASP 40 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1ht1 n LYS 41 N -2.60 0.60 -3.20 -1.24 5.02 -1.13 -4.92 118.16 110.68 1ht1 n LYS 41 Ca -0.01 0.20 -0.40 0.00 -2.02 0.00 0.00 58.31 56.08 1ht1 n LYS 41 Cb 0.51 -1.48 -0.07 0.00 -0.02 0.00 0.00 35.03 33.97 1ht1 n LYS 41 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1ht1 s VAL 42 N -2.50 5.03 0.17 -0.18 1.01 0.13 -4.57 120.40 119.49 1ht1 s VAL 42 Ca -0.36 0.82 -0.01 0.00 0.00 0.00 0.00 61.98 62.43 1ht1 s VAL 42 Cb 0.12 -3.89 -0.04 0.00 0.00 0.00 0.00 36.38 32.57 1ht1 s VAL 42 CO 0.52 -0.00 0.36 0.27 0.00 0.00 0.00 175.10 176.25 1ht1 s ILE 43 N 2.40 5.23 0.16 2.22 -4.36 -0.20 0.70 121.20 127.34 1ht1 s ILE 43 Ca 0.22 -0.32 -0.21 0.00 -0.26 0.00 0.00 60.65 60.08 1ht1 s ILE 43 Cb -0.15 -3.70 0.06 0.00 1.25 0.00 0.00 42.46 39.91 1ht1 s ILE 43 CO 0.10 -0.09 0.56 0.00 0.24 0.00 0.00 174.94 175.75 1ht1 s ALA 44 N -1.78 -1.43 0.01 2.27 0.00 -1.11 -1.67 121.76 118.03 1ht1 s ALA 44 Ca 0.38 0.33 -0.00 0.00 0.00 0.00 0.00 51.96 52.67 1ht1 s ALA 44 Cb -0.11 0.85 -0.01 0.00 0.00 0.00 0.00 23.12 23.85 1ht1 s ALA 44 CO 0.28 -0.76 -0.00 0.20 0.00 0.00 0.00 175.76 175.48 1ht1 s GLY 45 N -2.77 0.10 0.29 0.00 0.00 0.30 0.16 107.32 105.40 1ht1 s GLY 45 Ca 0.02 -0.24 0.03 0.00 0.00 0.00 0.00 44.72 44.54 1ht1 s GLY 45 CO -0.12 -0.27 0.06 -0.11 0.00 0.00 0.00 173.10 172.67 1ht1 s PHE 46 N -0.65 1.80 -0.28 1.90 -0.71 -0.58 0.52 117.98 119.97 1ht1 s PHE 46 Ca -0.07 -1.02 -0.03 0.00 -1.04 0.00 0.00 56.93 54.77 1ht1 s PHE 46 Cb -0.04 -1.13 0.10 0.00 -1.21 0.00 0.00 43.02 40.73 1ht1 s PHE 46 CO -0.00 -0.10 0.11 0.00 -1.34 0.00 0.00 175.22 173.89 1ht1 s ALA 47 N -3.44 1.00 0.00 1.99 0.00 -1.19 -4.87 121.76 115.25 1ht1 s ALA 47 Ca 0.36 -1.25 0.00 0.00 0.00 0.00 0.00 51.96 51.07 1ht1 s ALA 47 Cb 0.08 -1.45 0.00 0.00 0.00 0.00 0.00 23.12 21.75 1ht1 s ALA 47 CO 0.14 -1.60 0.00 0.41 0.00 0.00 0.00 175.76 174.72 1ht1 n GLY 48 N 5.08 0.41 3.69 0.00 0.00 -1.26 -2.57 105.19 110.54 1ht1 n GLY 48 Ca -0.05 -1.56 -0.44 0.00 0.00 0.00 0.00 46.02 43.97 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 0.94 0.00 -0.02 0.00 -1.26 -4.83 105.19 100.02 1ht1 n GLY 49 Ca 0.00 0.49 0.06 0.00 0.00 0.00 0.00 46.02 46.57 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 1.98 0.80 -0.12 2.61 -1.04 -1.26 -1.38 114.28 115.87 1ht1 n THR 50 Ca 0.11 0.20 -0.21 0.00 -2.04 0.00 0.00 64.05 62.10 1ht1 n THR 50 Cb 0.33 -1.00 -0.12 0.00 -1.82 0.00 0.00 70.33 67.73 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 -1.34 1.29 -0.22 2.41 0.00 -1.26 -2.99 120.51 118.40 1ht1 n ALA 51 Ca 0.05 -1.02 0.17 0.00 0.00 0.00 0.00 53.44 52.64 1ht1 n ALA 51 Cb 0.11 -0.13 0.49 0.00 0.00 0.00 0.00 19.45 19.92 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 -0.27 0.44 0.51 0.00 3.45 -1.77 0.31 116.42 119.09 1ht1 h ASP 52 Ca -0.58 0.04 -0.03 0.00 0.43 0.00 0.00 57.03 56.89 1ht1 h ASP 52 Cb 1.82 -0.05 0.01 0.00 -0.56 0.00 0.00 39.33 40.55 1ht1 h ASP 52 CO -0.15 0.20 -0.25 0.00 -1.57 0.00 0.00 179.24 177.47 1ht1 h ALA 53 N 1.62 -0.69 -0.71 3.45 0.00 -1.35 0.41 119.26 121.99 1ht1 h ALA 53 Ca 0.44 -0.19 0.15 0.00 0.00 0.00 0.00 54.91 55.31 1ht1 h ALA 53 Cb 1.00 0.27 -0.12 0.00 0.00 0.00 0.00 17.79 18.94 1ht1 h ALA 53 CO -0.16 -0.76 -0.01 0.35 0.00 0.00 0.00 179.25 178.66 1ht1 h PHE 54 N -0.94 -0.07 -0.17 0.00 -0.00 -0.64 0.79 116.94 115.91 1ht1 h PHE 54 Ca -0.07 0.05 -0.14 0.00 -0.00 0.00 0.00 57.97 57.81 1ht1 h PHE 54 Cb 0.61 0.14 0.00 0.00 -0.00 0.00 0.00 35.95 36.70 1ht1 h PHE 54 CO 0.00 -0.22 -0.45 1.15 -0.00 0.00 0.00 178.31 178.79 1ht1 h THR 55 N 0.10 1.33 0.11 4.41 2.02 -0.46 -2.55 112.91 117.87 1ht1 h THR 55 Ca 0.38 -1.70 -0.01 0.00 0.77 0.00 0.00 66.41 65.85 1ht1 h THR 55 Cb 0.64 1.96 0.00 0.00 -1.74 0.00 0.00 68.15 69.01 1ht1 h THR 55 CO -0.62 0.52 -0.05 -0.07 0.37 0.00 0.00 175.52 175.67 1ht1 h LEU 56 N 0.27 -0.12 -1.43 2.58 3.38 0.96 -2.87 115.31 118.08 1ht1 h LEU 56 Ca -0.01 -0.40 -0.02 0.00 0.09 0.00 0.00 57.88 57.54 1ht1 h LEU 56 Cb 1.06 0.03 -0.02 0.00 0.09 0.00 0.00 40.66 41.83 1ht1 h LEU 56 CO 0.10 0.37 0.15 -0.26 0.09 0.00 0.00 178.44 178.88 1ht1 h PHE 57 N -0.65 0.53 0.36 1.13 0.04 0.42 -2.51 116.94 116.25 1ht1 h PHE 57 Ca -0.01 -0.02 -0.02 0.00 2.80 0.00 0.00 57.97 60.72 1ht1 h PHE 57 Cb 0.51 -0.17 0.00 0.00 2.20 0.00 0.00 35.95 38.50 1ht1 h PHE 57 CO 0.08 0.42 -0.17 1.49 -0.60 0.00 0.00 178.31 179.53 1ht1 h GLU 58 N 0.53 -0.46 -0.58 1.51 4.81 -1.48 -0.01 114.58 118.90 1ht1 h GLU 58 Ca 0.13 0.03 0.08 0.00 -0.13 0.00 0.00 59.36 59.48 1ht1 h GLU 58 Cb 0.12 0.11 -0.03 0.00 0.63 0.00 0.00 28.75 29.57 1ht1 h GLU 58 CO -0.01 -0.28 0.39 1.25 -0.73 0.00 0.00 179.01 179.62 1ht1 h LEU 59 N -0.53 0.40 -1.08 1.64 5.85 -1.35 0.41 115.31 120.65 1ht1 h LEU 59 Ca -0.05 0.01 -0.06 0.00 0.84 0.00 0.00 57.88 58.62 1ht1 h LEU 59 Cb 0.40 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.33 1ht1 h LEU 59 CO 0.08 0.25 0.01 0.15 -0.34 0.00 0.00 178.44 178.60 1ht1 h PHE 60 N 0.45 0.69 0.46 1.25 3.57 -0.90 -1.90 116.94 120.56 1ht1 h PHE 60 Ca 0.26 -0.08 -0.01 0.00 3.53 0.00 0.00 57.97 61.67 1ht1 h PHE 60 Cb 0.44 -0.20 -0.01 0.00 2.79 0.00 0.00 35.95 38.97 1ht1 h PHE 60 CO -0.00 0.65 -0.31 0.93 -2.23 0.00 0.00 178.31 177.35 1ht1 h GLU 61 N 0.63 -0.71 0.25 1.11 4.39 0.17 -3.05 114.58 117.37 1ht1 h GLU 61 Ca 0.13 0.05 0.01 0.00 0.34 0.00 0.00 59.36 59.89 1ht1 h GLU 61 Cb 0.37 0.16 -0.03 0.00 -0.10 0.00 0.00 28.75 29.15 1ht1 h GLU 61 CO 0.01 -0.47 -0.39 0.00 -1.16 0.00 0.00 179.01 177.00 1ht1 h ARG 62 N -0.74 -0.68 -0.92 2.33 3.08 -1.15 -2.94 114.38 113.37 1ht1 h ARG 62 Ca -0.05 0.05 0.25 0.00 0.07 0.00 0.00 59.98 60.30 1ht1 h ARG 62 Cb 0.62 0.15 -0.16 0.00 0.08 0.00 0.00 29.97 30.66 1ht1 h ARG 62 CO 0.03 -0.45 0.13 0.87 -1.07 0.00 0.00 179.97 179.48 1ht1 h LYS 63 N -0.70 0.08 -0.66 0.04 1.79 -1.37 0.74 116.57 116.50 1ht1 h LYS 63 Ca -0.00 -0.01 0.02 0.00 -2.18 0.00 0.00 60.65 58.48 1ht1 h LYS 63 Cb 0.68 -0.02 -0.03 0.00 -1.58 0.00 0.00 32.23 31.27 1ht1 h LYS 63 CO -0.15 0.06 0.44 -0.07 -1.08 0.00 0.00 179.45 178.65 1ht1 h LEU 64 N 0.09 0.73 -0.93 2.94 3.38 -1.40 0.27 115.31 120.38 1ht1 h LEU 64 Ca 0.57 -0.01 -0.10 0.00 0.09 0.00 0.00 57.88 58.43 1ht1 h LEU 64 Cb 1.19 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.75 1ht1 h LEU 64 CO -0.79 0.51 -0.46 -0.33 0.09 0.00 0.00 178.44 177.46 1ht1 h GLU 65 N 0.85 0.00 0.00 1.13 5.08 0.48 0.45 114.58 122.57 1ht1 h GLU 65 Ca 0.25 0.00 -0.11 0.00 -1.00 0.00 0.00 59.36 58.50 1ht1 h GLU 65 Cb -0.02 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.21 1ht1 h GLU 65 CO -0.06 0.46 -0.81 0.52 -1.00 0.00 0.00 179.01 178.12 1ht1 h MET 66 N 0.00 0.00 -2.14 2.33 2.86 0.04 -3.38 114.93 114.64 1ht1 h MET 66 Ca -0.00 0.00 -0.58 0.00 -2.06 0.00 0.00 59.70 57.05 1ht1 h MET 66 Cb 0.93 0.00 -0.41 0.00 0.06 0.00 0.00 31.60 32.18 1ht1 h MET 66 CO 0.06 0.38 -0.76 0.72 1.06 0.00 0.00 176.91 178.37 1ht1 n HIS 67 N -3.08 2.43 -0.97 -0.22 8.25 0.79 -5.01 115.22 117.42 1ht1 n HIS 67 Ca -0.02 -3.97 0.00 0.00 -0.26 0.00 0.00 57.72 53.48 1ht1 n HIS 67 Cb 0.75 -0.49 0.00 0.00 1.12 0.00 0.00 29.99 31.37 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 0.90 0.00 -0.28 -0.41 6.02 -1.05 0.10 117.38 122.66 1ht1 n GLN 68 Ca 0.27 0.00 -0.00 0.00 -0.01 0.00 0.00 57.00 57.26 1ht1 n GLN 68 Cb 0.45 0.00 -0.00 0.00 1.02 0.00 0.00 30.24 31.71 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 -0.16 0.04 3.56 1.08 0.00 0.16 -4.78 105.19 105.09 1ht1 n GLY 69 Ca 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.74 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 -0.31 1.56 0.06 1.61 5.04 0.28 -4.81 115.29 118.73 1ht1 s HIS 70 Ca 0.00 1.04 -0.14 0.00 -1.54 0.00 0.00 55.06 54.42 1ht1 s HIS 70 Cb 0.00 -3.88 -0.04 0.00 0.04 0.00 0.00 32.58 28.69 1ht1 s HIS 70 CO 0.00 -1.94 1.24 1.25 -2.34 0.00 0.00 174.74 172.96 1ht1 h LEU 71 N 18.64 -0.87 -1.57 8.88 7.12 -1.86 0.25 115.31 145.89 1ht1 h LEU 71 Ca -0.05 0.12 0.35 0.00 0.13 0.00 0.00 57.88 58.44 1ht1 h LEU 71 Cb 1.07 0.37 -0.09 0.00 -0.53 0.00 0.00 40.66 41.48 1ht1 h LEU 71 CO 1.17 -0.16 0.82 0.58 -0.13 0.00 0.00 178.44 180.71 1ht1 h VAL 72 N -0.13 0.35 0.08 1.05 2.07 -1.94 0.18 116.25 117.92 1ht1 h VAL 72 Ca 0.04 -0.06 -0.14 0.00 0.82 0.00 0.00 66.70 67.36 1ht1 h VAL 72 Cb 0.24 0.15 0.01 0.00 -1.52 0.00 0.00 31.29 30.16 1ht1 h VAL 72 CO -0.31 0.03 -0.68 0.11 0.02 0.00 0.00 177.57 176.74 1ht1 h LYS 73 N 0.18 0.17 -0.86 1.57 1.79 -1.57 -1.36 116.57 116.49 1ht1 h LYS 73 Ca 0.67 -0.28 0.05 0.00 -2.18 0.00 0.00 60.65 58.91 1ht1 h LYS 73 Cb 2.14 0.11 -0.05 0.00 -1.58 0.00 0.00 32.23 32.85 1ht1 h LYS 73 CO -0.24 1.14 0.56 0.00 -1.08 0.00 0.00 179.45 179.83 1ht1 h ALA 74 N -0.02 1.51 0.82 3.86 0.00 -0.17 0.77 119.26 126.04 1ht1 h ALA 74 Ca -0.14 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.70 1ht1 h ALA 74 Cb 1.42 -0.28 0.01 0.00 0.00 0.00 0.00 17.79 18.94 1ht1 h ALA 74 CO 0.06 0.39 -0.40 0.00 0.00 0.00 0.00 179.25 179.30 1ht1 h ALA 75 N 1.52 -1.16 -0.63 0.00 0.00 -0.73 0.35 119.26 118.60 1ht1 h ALA 75 Ca 0.35 -0.24 0.03 0.00 0.00 0.00 0.00 54.91 55.05 1ht1 h ALA 75 Cb 0.11 0.43 -0.03 0.00 0.00 0.00 0.00 17.79 18.30 1ht1 h ALA 75 CO -0.12 -1.08 0.42 -0.24 0.00 0.00 0.00 179.25 178.23 1ht1 h VAL 76 N -1.23 1.10 -0.33 0.00 3.04 -0.87 -0.63 116.25 117.34 1ht1 h VAL 76 Ca -0.11 -0.27 -0.03 0.00 -1.01 0.00 0.00 66.70 65.28 1ht1 h VAL 76 Cb 0.85 0.26 -0.01 0.00 -2.01 0.00 0.00 31.29 30.38 1ht1 h VAL 76 CO 0.19 0.14 0.08 -0.08 -1.01 0.00 0.00 177.57 176.88 1ht1 h GLU 77 N 0.77 0.53 0.36 4.17 4.22 0.68 -3.11 114.58 122.20 1ht1 h GLU 77 Ca 0.25 -0.13 -0.01 0.00 0.08 0.00 0.00 59.36 59.55 1ht1 h GLU 77 Cb 0.04 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.19 1ht1 h GLU 77 CO -0.07 0.59 -0.49 1.25 -2.18 0.00 0.00 179.01 178.11 1ht1 h LEU 78 N 0.37 -1.40 -1.56 1.64 5.85 0.11 -1.77 115.31 118.54 1ht1 h LEU 78 Ca 0.10 0.13 0.25 0.00 0.84 0.00 0.00 57.88 59.20 1ht1 h LEU 78 Cb 0.30 0.48 -0.04 0.00 0.37 0.00 0.00 40.66 41.78 1ht1 h LEU 78 CO 0.00 -0.61 0.91 0.00 -0.34 0.00 0.00 178.44 178.40 1ht1 h ALA 79 N -0.82 2.72 -0.20 1.25 0.00 -1.16 0.22 119.26 121.26 1ht1 h ALA 79 Ca -0.04 -0.03 -0.15 0.00 0.00 0.00 0.00 54.91 54.69 1ht1 h ALA 79 Cb 0.80 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.66 1ht1 h ALA 79 CO -0.13 -1.36 -0.45 -0.22 0.00 0.00 0.00 179.25 177.09 1ht1 h LYS 80 N 0.00 0.66 -0.10 0.00 3.11 -1.25 -2.44 116.57 116.55 1ht1 h LYS 80 Ca 0.42 -0.44 -0.02 0.00 -2.81 0.00 0.00 60.65 57.80 1ht1 h LYS 80 Cb 2.22 0.06 -0.00 0.00 -1.00 0.00 0.00 32.23 33.51 1ht1 h LYS 80 CO -0.00 1.06 -0.01 -0.44 -2.81 0.00 0.00 179.45 177.24 1ht1 h ASP 81 N 0.35 0.18 -0.96 4.20 3.32 -0.96 -1.10 116.42 121.45 1ht1 h ASP 81 Ca 0.00 -0.34 0.24 0.00 0.02 0.00 0.00 57.03 56.95 1ht1 h ASP 81 Cb 1.05 -0.05 -0.13 0.00 0.22 0.00 0.00 39.33 40.43 1ht1 h ASP 81 CO 0.10 0.47 0.51 -0.25 -1.72 0.00 0.00 179.24 178.35 1ht1 h TRP 82 N -0.12 0.85 0.00 4.55 2.91 -1.43 0.39 115.95 123.11 1ht1 h TRP 82 Ca 0.03 0.04 0.00 0.00 1.13 0.00 0.00 58.89 60.08 1ht1 h TRP 82 Cb 0.39 -0.23 0.00 0.00 -0.51 0.00 0.00 29.16 28.81 1ht1 h TRP 82 CO 0.04 0.01 -1.33 -2.13 -1.03 0.00 0.00 178.44 174.00 1ht1 n ARG 83 N -4.96 0.35 -0.01 2.65 0.00 -0.92 -3.41 116.66 110.36 1ht1 n ARG 83 Ca 0.25 -0.06 0.07 0.00 -0.00 0.00 0.00 57.85 58.12 1ht1 n ARG 83 Cb 0.72 -1.56 -0.11 0.00 0.00 0.00 0.00 32.46 31.50 1ht1 n ARG 83 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.63 180.04 1ht1 n THR 84 N -1.98 0.00 -3.37 5.15 -1.04 -0.42 -4.94 114.28 107.69 1ht1 n THR 84 Ca 0.00 -0.33 -0.42 0.00 -2.04 0.00 0.00 64.05 61.26 1ht1 n THR 84 Cb 0.46 0.19 -0.09 0.00 -1.82 0.00 0.00 70.33 69.07 1ht1 n THR 84 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1ht1 s ASP 85 N -3.65 6.18 0.25 8.00 -1.08 0.13 -4.97 116.67 121.52 1ht1 s ASP 85 Ca -0.05 -0.48 -0.10 0.00 -0.52 0.00 0.00 52.55 51.40 1ht1 s ASP 85 Cb 0.09 -2.21 0.37 0.00 -1.46 0.00 0.00 42.92 39.72 1ht1 s ASP 85 CO 0.61 -0.46 1.59 -0.09 0.52 0.00 0.00 175.17 177.34 1ht1 h ARG 86 N 8.60 0.00 -0.16 4.34 2.43 -1.92 1.47 114.38 129.15 1ht1 h ARG 86 Ca -0.28 -0.00 0.01 0.00 -0.81 0.00 0.00 59.98 58.90 1ht1 h ARG 86 Cb 1.13 -0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.66 1ht1 h ARG 86 CO 0.74 0.00 0.07 0.52 -1.51 0.00 0.00 179.97 179.79 1ht1 h MET 87 N 0.00 0.15 -0.24 0.20 2.86 -1.96 -3.02 114.93 112.92 1ht1 h MET 87 Ca 0.41 -0.01 -0.17 0.00 -2.06 0.00 0.00 59.70 57.87 1ht1 h MET 87 Cb 0.63 -0.03 -0.00 0.00 0.06 0.00 0.00 31.60 32.25 1ht1 h MET 87 CO -0.86 0.10 -0.53 -0.07 1.06 0.00 0.00 176.91 176.61 1ht1 h LEU 88 N 0.15 0.78 -0.84 1.22 3.38 -0.95 -3.22 115.31 115.83 1ht1 h LEU 88 Ca 0.07 -0.41 0.00 0.00 0.09 0.00 0.00 57.88 57.63 1ht1 h LEU 88 Cb 0.03 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 40.55 1ht1 h LEU 88 CO -0.06 1.16 0.10 -1.14 0.09 0.00 0.00 178.44 178.60 1ht1 n ARG 89 N -3.99 0.08 -0.02 1.13 0.63 0.47 -2.22 116.66 112.75 1ht1 n ARG 89 Ca -0.03 0.55 -0.16 0.00 -0.92 0.00 0.00 57.85 57.29 1ht1 n ARG 89 Cb 0.61 -1.88 -0.10 0.00 0.45 0.00 0.00 32.46 31.54 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 0.34 -6.85 -0.14 1.79 -1.57 -3.45 116.57 106.69 1ht1 h LYS 90 Ca 0.00 -0.32 -0.50 0.00 -2.18 0.00 0.00 60.65 57.65 1ht1 h LYS 90 Cb 0.21 0.08 0.02 0.00 -1.58 0.00 0.00 32.23 30.96 1ht1 h LYS 90 CO 0.00 0.98 0.47 -0.48 -1.08 0.00 0.00 179.45 179.35 1ht1 s LEU 91 N -8.54 4.44 -0.01 2.94 0.05 -0.94 -5.06 118.68 111.56 1ht1 s LEU 91 Ca -0.14 2.26 0.03 0.00 0.05 0.00 0.00 54.13 56.33 1ht1 s LEU 91 Cb 0.03 -3.76 -0.01 0.00 -2.05 0.00 0.00 46.19 40.40 1ht1 s LEU 91 CO 0.79 -0.27 -0.11 -1.83 -0.55 0.00 0.00 176.35 174.38 1ht1 s GLU 92 N -1.73 0.85 0.02 1.48 -1.05 -1.26 -4.97 118.70 112.04 1ht1 s GLU 92 Ca 0.48 -0.40 -0.03 0.00 -0.15 0.00 0.00 54.97 54.87 1ht1 s GLU 92 Cb -0.30 -0.82 0.01 0.00 -0.44 0.00 0.00 34.13 32.57 1ht1 s GLU 92 CO 0.39 0.22 0.16 0.00 0.95 0.00 0.00 175.26 176.98 1ht1 n ALA 93 N 2.77 -0.42 -3.60 -0.84 0.00 -1.26 -4.50 120.51 112.66 1ht1 n ALA 93 Ca -0.14 -0.14 -0.29 0.00 0.00 0.00 0.00 53.44 52.88 1ht1 n ALA 93 Cb 0.56 0.06 -0.12 0.00 0.00 0.00 0.00 19.45 19.96 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 2.25 -0.09 0.00 1.43 -1.06 -4.41 118.68 116.79 1ht1 s LEU 94 Ca 0.04 -2.77 -0.30 0.00 -1.03 0.00 0.00 54.13 50.07 1ht1 s LEU 94 Cb -0.00 -0.82 -0.03 0.00 0.03 0.00 0.00 46.19 45.37 1ht1 s LEU 94 CO 0.01 -0.23 1.32 -0.76 0.23 0.00 0.00 176.35 176.91 1ht1 s LEU 95 N 0.24 4.25 -0.30 1.79 1.02 -1.23 -3.15 118.68 121.31 1ht1 s LEU 95 Ca 0.22 1.87 -0.04 0.00 0.02 0.00 0.00 54.13 56.20 1ht1 s LEU 95 Cb -0.15 -3.55 0.03 0.00 0.02 0.00 0.00 46.19 42.54 1ht1 s LEU 95 CO -0.06 -0.73 0.03 0.00 0.02 0.00 0.00 176.35 175.61 1ht1 s ALA 96 N 3.02 2.90 0.02 4.21 0.00 0.18 -0.96 121.76 131.13 1ht1 s ALA 96 Ca 0.59 -1.61 0.08 0.00 0.00 0.00 0.00 51.96 51.03 1ht1 s ALA 96 Cb -0.26 -2.01 -0.02 0.00 0.00 0.00 0.00 23.12 20.83 1ht1 s ALA 96 CO 0.21 -1.09 -0.25 0.08 0.00 0.00 0.00 175.76 174.70 1ht1 s VAL 97 N 1.37 2.03 0.09 0.00 1.01 0.38 -0.54 120.40 124.74 1ht1 s VAL 97 Ca -0.01 -1.25 -0.19 0.00 0.00 0.00 0.00 61.98 60.52 1ht1 s VAL 97 Cb -0.18 -1.72 0.05 0.00 0.00 0.00 0.00 36.38 34.52 1ht1 s VAL 97 CO -0.00 0.42 0.47 0.00 0.00 0.00 0.00 175.10 175.99 1ht1 s ALA 98 N -0.72 -1.17 0.08 5.51 0.00 -0.67 0.95 121.76 125.74 1ht1 s ALA 98 Ca 0.11 0.29 -0.08 0.00 0.00 0.00 0.00 51.96 52.28 1ht1 s ALA 98 Cb -0.10 0.57 0.03 0.00 0.00 0.00 0.00 23.12 23.62 1ht1 s ALA 98 CO 0.01 -0.59 0.37 -0.40 0.00 0.00 0.00 175.76 175.15 1ht1 n ASP 99 N 0.07 -0.69 -0.40 0.00 5.75 -0.92 -1.03 116.55 119.33 1ht1 n ASP 99 Ca -0.17 -1.39 0.33 0.00 -0.01 0.00 0.00 54.79 53.54 1ht1 n ASP 99 Cb 0.62 1.13 0.60 0.00 -1.03 0.00 0.00 41.12 42.45 1ht1 n ASP 99 CO 0.00 0.00 0.00 -0.08 -0.11 0.00 0.00 177.20 177.01 1ht1 h GLU 100 N 0.00 0.15 0.00 0.11 4.81 -1.96 -3.04 114.58 114.65 1ht1 h GLU 100 Ca -0.11 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.11 1ht1 h GLU 100 Cb 0.45 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.80 1ht1 h GLU 100 CO 0.14 0.10 -0.21 1.79 -0.73 0.00 0.00 179.01 180.10 1ht1 h THR 101 N 0.16 0.00 -3.51 0.32 1.35 -1.97 -3.50 112.91 105.75 1ht1 h THR 101 Ca 0.77 -0.95 -0.07 0.00 -0.55 0.00 0.00 66.41 65.61 1ht1 h THR 101 Cb 2.28 0.00 -0.14 0.00 -1.73 0.00 0.00 68.15 68.56 1ht1 h THR 101 CO -0.44 0.00 -0.19 0.00 -0.25 0.00 0.00 175.52 174.65 1ht1 s ALA 102 N -2.65 -0.68 0.16 6.62 0.00 -1.15 -5.14 121.76 118.92 1ht1 s ALA 102 Ca -0.06 -0.22 0.04 0.00 0.00 0.00 0.00 51.96 51.72 1ht1 s ALA 102 Cb 0.01 0.58 -0.04 0.00 0.00 0.00 0.00 23.12 23.67 1ht1 s ALA 102 CO 0.09 -0.57 0.18 -1.12 0.00 0.00 0.00 175.76 174.33 1ht1 s SER 103 N -2.73 5.73 -0.10 0.00 0.01 -1.26 -2.16 113.70 113.19 1ht1 s SER 103 Ca 0.03 -0.06 -0.33 0.00 1.31 0.00 0.00 55.95 56.91 1ht1 s SER 103 Cb 0.03 -1.56 0.12 0.00 0.21 0.00 0.00 66.02 64.82 1ht1 s SER 103 CO -0.11 0.06 1.18 -1.48 0.41 0.00 0.00 173.24 173.30 1ht1 s LEU 104 N -3.16 -0.14 -0.09 2.44 0.05 0.27 -4.71 118.68 113.34 1ht1 s LEU 104 Ca 0.32 -0.06 0.03 0.00 0.05 0.00 0.00 54.13 54.47 1ht1 s LEU 104 Cb -0.10 1.51 -0.01 0.00 -2.05 0.00 0.00 46.19 45.53 1ht1 s LEU 104 CO 0.25 -0.34 -0.19 -0.63 -0.55 0.00 0.00 176.35 174.89 1ht1 s ILE 105 N -2.56 2.55 0.20 1.48 -1.09 0.15 -0.47 121.20 121.46 1ht1 s ILE 105 Ca 0.10 -0.87 0.10 0.00 -2.23 0.00 0.00 60.65 57.75 1ht1 s ILE 105 Cb 0.01 -2.00 -0.04 0.00 -1.58 0.00 0.00 42.46 38.84 1ht1 s ILE 105 CO -0.05 0.56 -0.13 -0.63 -1.23 0.00 0.00 174.94 173.46 1ht1 s ILE 106 N 0.03 2.95 0.20 2.92 1.01 -0.14 -1.52 121.20 126.66 1ht1 s ILE 106 Ca -0.07 -1.83 0.05 0.00 0.00 0.00 0.00 60.65 58.79 1ht1 s ILE 106 Cb -0.15 -2.47 -0.02 0.00 0.01 0.00 0.00 42.46 39.83 1ht1 s ILE 106 CO 0.05 -0.16 0.17 0.35 0.00 0.00 0.00 174.94 175.35 1ht1 n THR 107 N -0.03 0.00 0.83 2.92 -2.24 -1.13 -3.50 114.28 111.13 1ht1 n THR 107 Ca -0.10 -1.46 0.12 0.00 -2.27 0.00 0.00 64.05 60.33 1ht1 n THR 107 Cb 0.56 0.72 0.52 0.00 -2.10 0.00 0.00 70.33 70.03 1ht1 n THR 107 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ht1 n GLY 108 N -0.35 -1.35 0.51 3.38 0.00 -1.26 -2.74 105.19 103.39 1ht1 n GLY 108 Ca 0.04 -0.08 0.13 0.00 0.00 0.00 0.00 46.02 46.12 1ht1 n GLY 108 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1ht1 n ASN 109 N -1.53 1.66 -0.32 1.61 4.13 -1.26 -4.24 115.26 115.31 1ht1 n ASN 109 Ca 0.06 -1.48 -0.03 0.00 1.68 0.00 0.00 54.58 54.81 1ht1 n ASN 109 Cb 0.29 0.04 -0.00 0.00 -1.54 0.00 0.00 39.78 38.56 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 1.23 0.28 3.78 7.41 0.00 -1.11 -4.87 105.19 111.91 1ht1 n GLY 110 Ca 0.17 -0.78 -0.38 0.00 0.00 0.00 0.00 46.02 45.03 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 -2.88 6.82 -0.63 1.61 1.11 -1.26 -4.78 116.67 116.66 1ht1 s ASP 111 Ca 0.00 0.97 0.04 0.00 0.18 0.00 0.00 52.55 53.74 1ht1 s ASP 111 Cb 0.00 -2.30 0.35 0.00 1.07 0.00 0.00 42.92 42.05 1ht1 s ASP 111 CO 0.00 0.16 1.15 0.52 1.18 0.00 0.00 175.17 178.18 1ht1 n VAL 112 N 2.67 3.42 -1.70 -1.27 0.31 -1.26 -2.82 118.33 117.68 1ht1 n VAL 112 Ca -0.10 -5.47 -0.44 0.00 -0.01 0.00 0.00 64.34 58.32 1ht1 n VAL 112 Cb 0.52 -1.39 -0.02 0.00 -0.91 0.00 0.00 33.84 32.03 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 -0.28 0.81 -3.74 2.52 0.31 -0.57 -4.75 118.33 112.63 1ht1 n VAL 113 Ca 0.36 -0.20 -0.36 0.00 -0.01 0.00 0.00 64.34 64.12 1ht1 n VAL 113 Cb 0.41 -1.69 -0.10 0.00 -0.91 0.00 0.00 33.84 31.55 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 -0.20 2.34 0.30 5.55 0.74 -1.26 -0.67 119.66 126.46 1ht1 s GLN 114 Ca 0.68 -2.24 -0.28 0.00 0.05 0.00 0.00 55.36 53.57 1ht1 s GLN 114 Cb -0.59 -3.68 -0.14 0.00 1.10 0.00 0.00 33.01 29.71 1ht1 s GLN 114 CO 0.47 -1.14 1.07 -0.35 -0.55 0.00 0.00 175.29 174.79 1ht1 n PRO 115 N 3.94 1.50 0.00 1.67 -0.04 -1.26 -4.89 135.00 135.92 1ht1 n PRO 115 Ca 0.04 0.53 0.00 0.00 -0.04 0.00 0.00 63.50 64.02 1ht1 n PRO 115 Cb 0.39 -1.94 0.00 0.00 -0.04 0.00 0.00 33.50 31.91 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 0.71 0.00 -1.92 0.54 4.07 -1.26 -0.92 120.64 121.86 1ht1 n GLU 116 Ca 0.09 0.00 -0.37 0.00 -0.06 0.00 0.00 57.16 56.82 1ht1 n GLU 116 Cb 0.33 0.00 0.01 0.00 -0.06 0.00 0.00 31.44 31.72 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 -0.20 7.29 -2.75 4.31 3.02 -1.26 -4.74 115.26 120.93 1ht1 n ASN 117 Ca 0.00 -3.63 -0.13 0.00 -0.03 0.00 0.00 54.58 50.79 1ht1 n ASN 117 Cb 0.00 -1.14 -0.01 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 -0.01 -3.19 -4.48 6.41 8.00 -0.10 -4.64 116.55 118.54 1ht1 n ASP 118 Ca 0.52 0.07 -0.36 0.00 0.71 0.00 0.00 54.79 55.73 1ht1 n ASP 118 Cb 0.31 -2.73 -0.12 0.00 -0.02 0.00 0.00 41.12 38.57 1ht1 n ASP 118 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1ht1 s LEU 119 N -5.76 3.53 0.00 0.64 2.96 -1.25 -4.24 118.68 114.56 1ht1 s LEU 119 Ca 0.13 -0.16 0.04 0.00 -0.22 0.00 0.00 54.13 53.91 1ht1 s LEU 119 Cb -0.07 -1.95 -0.03 0.00 0.50 0.00 0.00 46.19 44.64 1ht1 s LEU 119 CO 0.16 -0.02 -0.11 -0.63 -1.32 0.00 0.00 176.35 174.43 1ht1 s ILE 120 N 1.54 3.34 -0.45 6.68 1.09 -0.60 -4.52 121.20 128.28 1ht1 s ILE 120 Ca 0.06 -0.86 0.07 0.00 -1.10 0.00 0.00 60.65 58.82 1ht1 s ILE 120 Cb -0.15 -2.42 0.28 0.00 -1.06 0.00 0.00 42.46 39.11 1ht1 s ILE 120 CO 0.04 0.42 0.87 0.00 -0.10 0.00 0.00 174.94 176.17 1ht1 n ALA 121 N 1.69 -0.04 -1.92 9.38 0.00 -1.24 -0.41 120.51 127.96 1ht1 n ALA 121 Ca -0.16 -2.07 -0.28 0.00 0.00 0.00 0.00 53.44 50.93 1ht1 n ALA 121 Cb 0.52 -1.13 0.07 0.00 0.00 0.00 0.00 19.45 18.91 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 -0.22 2.52 0.00 0.00 -4.36 -0.61 -3.98 121.20 114.55 1ht1 s ILE 122 Ca 0.31 0.01 0.00 0.00 -0.26 0.00 0.00 60.65 60.71 1ht1 s ILE 122 Cb 0.25 -3.13 0.00 0.00 1.25 0.00 0.00 42.46 40.83 1ht1 s ILE 122 CO -0.14 -0.16 0.00 0.61 0.24 0.00 0.00 174.94 175.49 1ht1 n GLY 123 N -3.08 0.18 0.43 6.27 0.00 -1.26 -1.68 105.19 106.05 1ht1 n GLY 123 Ca 0.07 -1.63 0.22 0.00 0.00 0.00 0.00 46.02 44.68 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 0.00 0.04 1.61 4.64 -1.84 2.06 113.55 120.06 1ht1 h SER 124 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1ht1 h SER 124 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1ht1 h SER 124 CO 0.00 0.00 -0.46 0.61 -0.87 0.00 0.00 176.83 176.11 1ht1 n GLY 125 N -1.55 -0.17 0.24 -0.77 0.00 -0.73 -4.63 105.19 97.59 1ht1 n GLY 125 Ca 0.12 -0.59 -0.07 0.00 0.00 0.00 0.00 46.02 45.48 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 4.87 -1.62 0.27 -0.02 0.00 0.33 -1.35 103.07 105.56 1ht1 h GLY 126 Ca 0.00 0.94 0.17 0.00 0.00 0.00 0.00 47.33 48.43 1ht1 h GLY 126 CO 0.00 -0.41 0.62 -2.55 0.00 0.00 0.00 176.54 174.20 1ht1 h PRO 127 N -0.03 0.80 -0.50 4.80 0.11 -1.75 0.87 132.00 136.30 1ht1 h PRO 127 Ca 0.09 -0.05 -0.06 0.00 0.11 0.00 0.00 66.00 66.09 1ht1 h PRO 127 Cb 0.25 -0.18 -0.02 0.00 0.11 0.00 0.00 31.00 31.16 1ht1 h PRO 127 CO -0.52 0.53 0.08 1.88 -0.21 0.00 0.00 178.00 179.76 1ht1 h TYR 128 N 0.83 0.88 -0.70 0.65 0.05 -1.68 -0.32 116.97 116.68 1ht1 h TYR 128 Ca 0.54 -0.12 0.03 0.00 0.05 0.00 0.00 58.73 59.23 1ht1 h TYR 128 Cb 0.77 -0.24 -0.04 0.00 1.01 0.00 0.00 36.73 38.23 1ht1 h TYR 128 CO -0.00 0.80 0.44 0.00 -1.05 0.00 0.00 178.16 178.35 1ht1 h ALA 129 N 0.97 0.90 0.18 3.88 0.00 0.03 -1.89 119.26 123.33 1ht1 h ALA 129 Ca 0.15 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 1ht1 h ALA 129 Cb 0.40 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.96 1ht1 h ALA 129 CO 0.01 0.22 -0.09 0.37 0.00 0.00 0.00 179.25 179.77 1ht1 h GLN 130 N 0.87 -0.23 -0.87 0.00 4.15 -0.43 0.36 115.11 118.96 1ht1 h GLN 130 Ca 0.28 0.02 0.15 0.00 0.77 0.00 0.00 58.65 59.86 1ht1 h GLN 130 Cb -0.00 0.05 -0.07 0.00 0.21 0.00 0.00 27.48 27.67 1ht1 h GLN 130 CO -0.10 -0.06 0.56 0.00 -1.93 0.00 0.00 178.83 177.30 1ht1 h ALA 131 N 0.45 1.93 0.12 3.38 0.00 -0.76 0.47 119.26 124.85 1ht1 h ALA 131 Ca -0.02 0.01 -0.29 0.00 0.00 0.00 0.00 54.91 54.61 1ht1 h ALA 131 Cb 0.27 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.96 1ht1 h ALA 131 CO 0.04 -0.17 -1.42 0.00 0.00 0.00 0.00 179.25 177.70 1ht1 h ALA 132 N 1.61 0.20 -0.38 0.00 0.00 -1.11 -2.91 119.26 116.68 1ht1 h ALA 132 Ca 0.44 -1.02 -0.14 0.00 0.00 0.00 0.00 54.91 54.19 1ht1 h ALA 132 Cb 0.80 0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.76 1ht1 h ALA 132 CO -0.19 1.07 -0.32 0.00 0.00 0.00 0.00 179.25 179.81 1ht1 h ALA 133 N 0.53 0.71 0.69 0.00 0.00 0.94 -2.70 119.26 119.43 1ht1 h ALA 133 Ca -0.20 -0.42 -0.03 0.00 0.00 0.00 0.00 54.91 54.25 1ht1 h ALA 133 Cb 2.00 -0.13 0.01 0.00 0.00 0.00 0.00 17.79 19.66 1ht1 h ALA 133 CO 0.18 0.66 -0.33 -0.09 0.00 0.00 0.00 179.25 179.67 1ht1 h ARG 134 N 0.71 -0.90 -0.97 0.00 9.65 -0.20 0.17 114.38 122.83 1ht1 h ARG 134 Ca 0.07 0.06 0.30 0.00 -1.10 0.00 0.00 59.98 59.32 1ht1 h ARG 134 Cb 0.88 0.20 -0.15 0.00 -1.39 0.00 0.00 29.97 29.52 1ht1 h ARG 134 CO 0.08 -0.58 0.49 0.00 2.80 0.00 0.00 179.97 182.76 1ht1 h ALA 135 N -1.10 1.79 0.00 2.80 0.00 -1.56 -1.50 119.26 119.69 1ht1 h ALA 135 Ca -0.09 0.20 -0.03 0.00 0.00 0.00 0.00 54.91 54.99 1ht1 h ALA 135 Cb 0.73 0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.72 1ht1 h ALA 135 CO 0.16 -0.54 -0.11 -0.07 0.00 0.00 0.00 179.25 178.68 1ht1 h LEU 136 N 0.30 0.10 -1.26 0.00 4.07 -1.36 -2.65 115.31 114.50 1ht1 h LEU 136 Ca 0.69 -0.81 0.00 0.00 0.08 0.00 0.00 57.88 57.84 1ht1 h LEU 136 Cb 1.54 -0.03 0.00 0.00 1.08 0.00 0.00 40.66 43.25 1ht1 h LEU 136 CO -0.62 0.89 0.00 -0.11 -1.08 0.00 0.00 178.44 177.52 1ht1 n LEU 137 N -4.61 0.53 -0.00 1.67 7.94 0.59 -1.76 117.00 121.36 1ht1 n LEU 137 Ca -0.10 0.74 0.04 0.00 -1.11 0.00 0.00 56.01 55.58 1ht1 n LEU 137 Cb 0.45 -0.79 -0.05 0.00 0.53 0.00 0.00 43.42 43.56 1ht1 n LEU 137 CO 0.36 -0.88 -0.32 -0.62 -1.11 0.00 0.00 177.39 174.82 1ht1 n GLU 138 N -2.20 2.26 -0.06 1.96 1.02 -0.65 -4.69 120.64 118.27 1ht1 n GLU 138 Ca -0.01 -0.04 0.03 0.00 -0.02 0.00 0.00 57.16 57.13 1ht1 n GLU 138 Cb 0.05 -1.03 0.05 0.00 -0.02 0.00 0.00 31.44 30.49 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 -1.49 1.77 -3.60 1.62 5.03 -1.00 -5.07 115.26 112.52 1ht1 n ASN 139 Ca -0.00 -2.28 -0.11 0.00 0.87 0.00 0.00 54.58 53.07 1ht1 n ASN 139 Cb 0.16 -0.16 -0.04 0.00 -1.02 0.00 0.00 39.78 38.72 1ht1 n ASN 139 CO 0.00 0.00 0.00 0.42 -1.83 0.00 0.00 177.26 175.85 1ht1 s THR 140 N -1.48 0.05 -2.40 3.41 -4.23 -0.72 -5.01 115.64 105.27 1ht1 s THR 140 Ca 0.11 -0.48 0.25 0.00 -1.18 0.00 0.00 61.69 60.39 1ht1 s THR 140 Cb 0.10 -1.16 0.51 0.00 1.34 0.00 0.00 72.50 73.29 1ht1 s THR 140 CO 0.01 -0.25 1.66 -0.62 -0.54 0.00 0.00 174.62 174.88 1ht1 n GLU 141 N -0.26 1.69 -1.41 3.99 -0.58 -1.26 -4.73 120.64 118.08 1ht1 n GLU 141 Ca -0.16 -1.02 -0.39 0.00 -0.42 0.00 0.00 57.16 55.17 1ht1 n GLU 141 Cb 0.64 -1.44 0.02 0.00 -0.57 0.00 0.00 31.44 30.09 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 0.24 -0.50 -4.85 -4.62 4.77 -1.26 -4.95 117.00 105.83 1ht1 n LEU 142 Ca 0.18 0.75 -0.32 0.00 -0.03 0.00 0.00 56.01 56.59 1ht1 n LEU 142 Cb 0.34 -1.08 -0.02 0.00 -2.33 0.00 0.00 43.42 40.33 1ht1 n LEU 142 CO 0.15 -3.46 0.67 -0.94 -1.33 0.00 0.00 177.39 172.49 1ht1 s SER 143 N -1.08 6.50 0.25 -1.43 1.04 -1.26 -4.87 113.70 112.84 1ht1 s SER 143 Ca 0.65 1.49 -0.10 0.00 0.48 0.00 0.00 55.95 58.46 1ht1 s SER 143 Cb -0.49 -2.48 0.37 0.00 0.10 0.00 0.00 66.02 63.52 1ht1 s SER 143 CO 0.58 -0.66 1.58 0.00 0.98 0.00 0.00 173.24 175.72 1ht1 h ALA 144 N 0.56 0.55 -0.26 5.32 0.00 -1.90 0.01 119.26 123.54 1ht1 h ALA 144 Ca -0.46 0.34 -0.05 0.00 0.00 0.00 0.00 54.91 54.74 1ht1 h ALA 144 Cb 1.19 0.69 -0.01 0.00 0.00 0.00 0.00 17.79 19.66 1ht1 h ALA 144 CO 0.62 -0.41 -0.04 -0.09 0.00 0.00 0.00 179.25 179.33 1ht1 h ARG 145 N -0.00 0.48 -0.24 0.00 2.43 -1.92 -2.65 114.38 112.48 1ht1 h ARG 145 Ca 0.42 -0.17 0.07 0.00 -0.81 0.00 0.00 59.98 59.48 1ht1 h ARG 145 Cb 0.64 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 30.15 1ht1 h ARG 145 CO -0.91 0.68 0.18 0.93 -1.51 0.00 0.00 179.97 179.35 1ht1 h GLU 146 N 0.24 0.00 0.23 0.20 5.08 -1.44 -2.20 114.58 116.69 1ht1 h GLU 146 Ca 0.07 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.42 1ht1 h GLU 146 Cb 0.49 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.74 1ht1 h GLU 146 CO 0.02 0.00 -0.11 0.82 -1.00 0.00 0.00 179.01 178.74 1ht1 h ILE 147 N 0.00 0.00 -1.18 3.13 1.08 -0.95 -1.39 117.51 118.20 1ht1 h ILE 147 Ca 0.11 -0.27 0.33 0.00 -0.39 0.00 0.00 64.86 64.64 1ht1 h ILE 147 Cb 0.48 0.00 -0.08 0.00 -3.07 0.00 0.00 36.82 34.15 1ht1 h ILE 147 CO -0.00 0.00 0.80 0.00 -0.69 0.00 0.00 178.15 178.26 1ht1 h ALA 148 N -1.59 2.75 -1.63 1.87 0.00 -1.37 0.69 119.26 119.98 1ht1 h ALA 148 Ca -0.03 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1ht1 h ALA 148 Cb 0.23 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.11 1ht1 h ALA 148 CO 0.05 -1.16 0.00 0.39 0.00 0.00 0.00 179.25 178.53 1ht1 n GLU 149 N -4.42 0.00 -0.33 0.00 -0.58 -0.84 -0.99 120.64 113.49 1ht1 n GLU 149 Ca 0.28 0.23 0.20 0.00 -0.42 0.00 0.00 57.16 57.45 1ht1 n GLU 149 Cb 1.16 -0.94 0.39 0.00 -0.57 0.00 0.00 31.44 31.48 1ht1 n GLU 149 CO 0.00 0.00 0.00 0.87 -0.48 0.00 0.00 177.13 177.52 1ht1 h LYS 150 N 0.00 0.07 0.08 3.49 1.57 -0.79 0.71 116.57 121.70 1ht1 h LYS 150 Ca 0.00 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1ht1 h LYS 150 Cb 0.00 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.29 1ht1 h LYS 150 CO 0.00 0.05 -0.07 0.00 -0.57 0.00 0.00 179.45 178.86 1ht1 h ALA 151 N 1.93 -0.15 -0.93 3.86 0.00 0.30 -0.56 119.26 123.72 1ht1 h ALA 151 Ca 0.67 -0.02 0.02 0.00 0.00 0.00 0.00 54.91 55.58 1ht1 h ALA 151 Cb 1.54 0.10 -0.05 0.00 0.00 0.00 0.00 17.79 19.38 1ht1 h ALA 151 CO -0.80 -0.59 0.61 1.25 0.00 0.00 0.00 179.25 179.72 1ht1 h LEU 152 N -0.17 1.04 -0.48 0.00 6.46 0.20 -1.19 115.31 121.18 1ht1 h LEU 152 Ca 0.00 -0.02 -0.00 0.00 -0.12 0.00 0.00 57.88 57.74 1ht1 h LEU 152 Cb 0.16 -0.25 -0.02 0.00 -0.73 0.00 0.00 40.66 39.81 1ht1 h LEU 152 CO -0.01 0.74 0.29 0.44 -0.62 0.00 0.00 178.44 179.28 1ht1 h ASP 153 N 1.23 0.57 -0.40 1.25 3.45 -0.41 -1.72 116.42 120.39 1ht1 h ASP 153 Ca 0.35 -0.06 0.05 0.00 0.43 0.00 0.00 57.03 57.81 1ht1 h ASP 153 Cb -0.10 -0.14 -0.05 0.00 -0.56 0.00 0.00 39.33 38.48 1ht1 h ASP 153 CO -0.09 0.46 0.12 0.40 -1.57 0.00 0.00 179.24 178.57 1ht1 h ILE 154 N 0.64 0.85 0.79 0.35 5.03 -0.15 -2.49 117.51 122.54 1ht1 h ILE 154 Ca 0.17 -0.09 -0.04 0.00 -0.12 0.00 0.00 64.86 64.78 1ht1 h ILE 154 Cb -0.01 0.55 0.00 0.00 -3.03 0.00 0.00 36.82 34.34 1ht1 h ILE 154 CO -0.03 0.05 -0.42 0.00 -0.68 0.00 0.00 178.15 177.07 1ht1 h ALA 155 N 1.28 -1.13 -0.72 1.87 0.00 -0.94 -2.58 119.26 117.04 1ht1 h ALA 155 Ca 0.19 -0.24 0.21 0.00 0.00 0.00 0.00 54.91 55.07 1ht1 h ALA 155 Cb 0.19 0.48 -0.03 0.00 0.00 0.00 0.00 17.79 18.43 1ht1 h ALA 155 CO -0.21 -1.14 0.72 0.78 0.00 0.00 0.00 179.25 179.40 1ht1 h GLY 156 N -1.11 0.00 2.00 0.00 0.00 -1.16 0.60 103.07 103.40 1ht1 h GLY 156 Ca -0.11 0.00 -0.15 0.00 0.00 0.00 0.00 47.33 47.07 1ht1 h GLY 156 CO 0.15 0.00 -0.71 -0.55 0.00 0.00 0.00 176.54 175.43 1ht1 h ASP 157 N 0.00 0.00 0.00 0.19 3.45 -1.04 -3.37 116.42 115.65 1ht1 h ASP 157 Ca 0.34 0.00 -0.42 0.00 0.43 0.00 0.00 57.03 57.38 1ht1 h ASP 157 Cb 1.78 0.00 -0.07 0.00 -0.56 0.00 0.00 39.33 40.48 1ht1 h ASP 157 CO -0.00 0.71 -2.50 -0.38 -1.57 0.00 0.00 179.24 175.49 1ht1 n ILE 158 N -3.44 1.50 -2.43 0.35 5.41 0.14 -4.95 119.36 115.94 1ht1 n ILE 158 Ca 0.00 -0.50 -0.42 0.00 1.00 0.00 0.00 62.75 62.83 1ht1 n ILE 158 Cb 0.76 -1.60 -0.03 0.00 -0.71 0.00 0.00 39.64 38.06 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 5.08 0.00 -0.49 0.00 5.03 -1.88 -2.80 117.51 122.45 1ht1 h ILE 160 Ca -0.33 -0.43 0.00 0.00 -0.12 0.00 0.00 64.86 63.98 1ht1 h ILE 160 Cb 1.15 1.40 0.00 0.00 -3.03 0.00 0.00 36.82 36.34 1ht1 h ILE 160 CO 0.90 0.00 0.00 -1.22 -0.68 0.00 0.00 178.15 177.15 1ht1 n TYR 161 N -3.01 0.85 -4.61 1.37 4.01 -1.26 -4.94 117.16 109.57 1ht1 n TYR 161 Ca 0.00 -0.57 -0.23 0.00 -0.16 0.00 0.00 57.90 56.94 1ht1 n TYR 161 Cb 0.27 -0.10 -0.16 0.00 -0.31 0.00 0.00 39.34 39.04 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 -1.40 1.12 0.17 -0.72 2.01 -1.06 -1.39 115.64 114.37 1ht1 s THR 162 Ca 0.37 -0.53 0.01 0.00 0.31 0.00 0.00 61.69 61.85 1ht1 s THR 162 Cb 0.22 -0.98 0.01 0.00 0.01 0.00 0.00 72.50 71.76 1ht1 s THR 162 CO 0.21 0.33 0.09 -0.46 -0.69 0.00 0.00 174.62 174.10 1ht1 n ASN 163 N 3.29 1.81 -1.52 3.53 0.23 -1.26 -4.51 115.26 116.82 1ht1 n ASN 163 Ca -0.19 -1.62 0.09 0.00 -0.53 0.00 0.00 54.58 52.33 1ht1 n ASN 163 Cb 0.53 0.02 0.35 0.00 -2.08 0.00 0.00 39.78 38.60 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 -0.75 1.49 -2.79 -2.53 8.25 -1.26 -4.59 115.22 113.02 1ht1 n HIS 164 Ca -0.02 -0.65 -0.40 0.00 -0.26 0.00 0.00 57.72 56.38 1ht1 n HIS 164 Cb 0.20 -0.29 -0.06 0.00 1.12 0.00 0.00 29.99 30.97 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 -2.05 3.91 0.17 4.41 5.36 -1.26 -4.98 117.98 123.54 1ht1 s PHE 165 Ca 0.49 1.82 0.07 0.00 -0.96 0.00 0.00 56.93 58.35 1ht1 s PHE 165 Cb 0.34 -2.96 -0.04 0.00 -0.34 0.00 0.00 43.02 40.01 1ht1 s PHE 165 CO 0.21 0.39 -0.14 -1.01 -1.46 0.00 0.00 175.22 173.21 1ht1 s HIS 166 N -0.78 1.55 -0.29 10.12 3.76 -1.26 -2.76 115.29 125.63 1ht1 s HIS 166 Ca 0.42 -0.60 0.01 0.00 -0.15 0.00 0.00 55.06 54.73 1ht1 s HIS 166 Cb -0.24 -0.76 0.15 0.00 1.11 0.00 0.00 32.58 32.84 1ht1 s HIS 166 CO 0.30 0.25 0.36 0.99 -0.85 0.00 0.00 174.74 175.79 1ht1 s THR 167 N -2.81 -0.52 0.23 1.30 2.01 -0.80 -4.98 115.64 110.06 1ht1 s THR 167 Ca 0.18 -0.41 0.05 0.00 0.31 0.00 0.00 61.69 61.82 1ht1 s THR 167 Cb -0.01 -0.97 -0.03 0.00 0.01 0.00 0.00 72.50 71.49 1ht1 s THR 167 CO 0.05 -0.38 0.29 -0.63 -0.69 0.00 0.00 174.62 173.26 1ht1 s ILE 168 N 2.41 5.00 -0.42 1.82 1.01 -1.26 -2.69 121.20 127.08 1ht1 s ILE 168 Ca 0.10 -1.07 0.06 0.00 0.00 0.00 0.00 60.65 59.75 1ht1 s ILE 168 Cb -0.13 -3.68 0.22 0.00 0.01 0.00 0.00 42.46 38.88 1ht1 s ILE 168 CO -0.30 -0.29 0.53 -0.62 0.00 0.00 0.00 174.94 174.26 1ht1 n GLU 169 N -1.16 0.55 -0.46 2.79 -0.58 -0.69 -4.96 120.64 116.14 1ht1 n GLU 169 Ca -0.08 -2.94 -0.28 0.00 -0.42 0.00 0.00 57.16 53.44 1ht1 n GLU 169 Cb 0.57 -1.40 0.27 0.00 -0.57 0.00 0.00 31.44 30.31 1ht1 n GLU 169 CO 0.00 0.00 0.00 -1.91 -0.48 0.00 0.00 177.13 174.74 1ht1 n GLU 170 N 1.97 -2.65 -3.66 3.49 2.13 -1.26 -4.05 120.64 116.61 1ht1 n GLU 170 Ca 0.22 -0.75 -0.11 0.00 0.66 0.00 0.00 57.16 57.19 1ht1 n GLU 170 Cb 0.53 -2.14 -0.08 0.00 0.27 0.00 0.00 31.44 30.02 1ht1 n GLU 170 CO 0.00 0.00 0.00 -1.17 -0.41 0.00 0.00 177.13 175.55 1ht1 s LEU 171 N -7.22 -0.57 0.02 4.31 2.96 -0.67 -4.93 118.68 112.58 1ht1 s LEU 171 Ca 0.69 1.31 0.06 0.00 -0.22 0.00 0.00 54.13 55.97 1ht1 s LEU 171 Cb -0.26 2.13 -0.03 0.00 0.50 0.00 0.00 46.19 48.53 1ht1 s LEU 171 CO 0.66 -0.22 -0.16 -0.44 -1.32 0.00 0.00 176.35 174.86 1ht1 s SER 172 N 0.99 3.90 0.00 3.68 0.01 -1.26 -2.50 113.70 118.52 1ht1 s SER 172 Ca -0.05 -0.36 0.00 0.00 1.31 0.00 0.00 55.95 56.85 1ht1 s SER 172 Cb -0.05 -0.69 0.00 0.00 0.21 0.00 0.00 66.02 65.48 1ht1 s SER 172 CO -0.09 0.28 0.00 0.00 0.41 0.00 0.00 173.24 173.83 1ht1 n TYR 173 N 1.71 0.00 0.00 2.43 -0.00 -1.01 -5.00 117.16 115.28 1ht1 n TYR 173 Ca -0.16 0.00 0.00 0.00 -0.00 0.00 0.00 57.90 57.74 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