#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 -0.12 -0.21 4.28 2.01 -1.26 -2.30 115.64 118.04 1ht2 s THR 2 Ca 0.00 0.32 -0.02 0.00 0.31 0.00 0.00 61.69 62.30 1ht2 s THR 2 Cb 0.00 -0.18 -0.00 0.00 0.01 0.00 0.00 72.50 72.33 1ht2 s THR 2 CO 0.00 0.13 -0.09 -0.63 -0.69 0.00 0.00 174.62 173.35 1ht2 s ILE 3 N 1.77 3.01 -0.16 1.82 -1.09 -0.43 -3.17 121.20 122.94 1ht2 s ILE 3 Ca -0.01 -0.62 0.01 0.00 -2.23 0.00 0.00 60.65 57.80 1ht2 s ILE 3 Cb -0.12 -2.35 0.02 0.00 -1.58 0.00 0.00 42.46 38.43 1ht2 s ILE 3 CO -0.04 0.46 -0.16 -0.69 -1.23 0.00 0.00 174.94 173.27 1ht2 s VAL 4 N 1.43 1.74 -0.08 2.92 1.01 0.05 -1.79 120.40 125.68 1ht2 s VAL 4 Ca 0.06 -0.74 0.03 0.00 0.00 0.00 0.00 61.98 61.33 1ht2 s VAL 4 Cb -0.14 -1.61 -0.01 0.00 0.00 0.00 0.00 36.38 34.62 1ht2 s VAL 4 CO -0.06 0.49 -0.19 -0.55 0.00 0.00 0.00 175.10 174.79 1ht2 s SER 5 N 1.39 3.60 0.08 3.32 0.15 -0.33 0.09 113.70 122.01 1ht2 s SER 5 Ca 0.04 -0.38 0.01 0.00 0.70 0.00 0.00 55.95 56.33 1ht2 s SER 5 Cb -0.13 -1.13 -0.04 0.00 -1.71 0.00 0.00 66.02 63.02 1ht2 s SER 5 CO -0.11 0.24 -0.06 -0.69 1.20 0.00 0.00 173.24 173.82 1ht2 s VAL 6 N -0.11 0.60 -0.17 4.45 1.01 -1.04 -1.75 120.40 123.39 1ht2 s VAL 6 Ca -0.03 -1.79 -0.04 0.00 0.00 0.00 0.00 61.98 60.11 1ht2 s VAL 6 Cb -0.14 -1.50 0.08 0.00 0.00 0.00 0.00 36.38 34.82 1ht2 s VAL 6 CO 0.04 -0.82 0.18 -0.60 0.00 0.00 0.00 175.10 173.90 1ht2 s ARG 7 N -3.52 0.13 -0.13 2.72 3.52 -1.26 -0.67 118.95 119.74 1ht2 s ARG 7 Ca 0.08 0.23 -0.09 0.00 -0.13 0.00 0.00 55.73 55.82 1ht2 s ARG 7 Cb 0.03 -1.12 0.04 0.00 -1.56 0.00 0.00 34.95 32.35 1ht2 s ARG 7 CO -0.05 -0.58 0.34 0.50 -0.81 0.00 0.00 175.30 174.70 1ht2 s ARG 8 N 2.28 0.35 -0.94 5.12 3.52 -0.21 -4.96 118.95 124.11 1ht2 s ARG 8 Ca 0.05 0.58 -0.08 0.00 -0.13 0.00 0.00 55.73 56.16 1ht2 s ARG 8 Cb -0.15 0.05 -0.02 0.00 -1.56 0.00 0.00 34.95 33.27 1ht2 s ARG 8 CO -0.10 -0.11 0.77 0.09 -0.81 0.00 0.00 175.30 175.14 1ht2 n ASN 9 N 3.64 -6.42 -4.04 -2.12 3.02 -1.26 -2.97 115.26 105.10 1ht2 n ASN 9 Ca -0.19 -0.62 -0.27 0.00 -0.03 0.00 0.00 54.58 53.47 1ht2 n ASN 9 Cb 0.56 -4.23 -0.04 0.00 -0.61 0.00 0.00 39.78 35.45 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 -1.60 -0.20 3.31 7.41 0.00 -1.26 -4.84 105.19 108.01 1ht2 n GLY 10 Ca -0.09 0.15 -0.10 0.00 0.00 0.00 0.00 46.02 45.99 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 -4.04 -0.70 -0.03 1.61 3.76 -1.16 -2.69 115.29 112.04 1ht2 s HIS 11 Ca 0.02 1.44 0.04 0.00 -0.15 0.00 0.00 55.06 56.40 1ht2 s HIS 11 Cb -0.01 0.32 -0.00 0.00 1.11 0.00 0.00 32.58 34.00 1ht2 s HIS 11 CO 0.92 -0.40 -0.14 0.54 -0.85 0.00 0.00 174.74 174.81 1ht2 s VAL 12 N 1.71 1.14 0.32 -0.90 0.11 -0.86 -1.05 120.40 120.87 1ht2 s VAL 12 Ca -0.08 -0.56 0.03 0.00 -2.93 0.00 0.00 61.98 58.44 1ht2 s VAL 12 Cb -0.09 -0.98 -0.05 0.00 -1.53 0.00 0.00 36.38 33.73 1ht2 s VAL 12 CO -0.14 0.33 0.08 0.68 -3.33 0.00 0.00 175.10 172.73 1ht2 s VAL 13 N 0.04 0.93 -0.17 2.04 -7.23 0.15 -2.38 120.40 113.78 1ht2 s VAL 13 Ca -0.02 -2.00 -0.07 0.00 -1.81 0.00 0.00 61.98 58.08 1ht2 s VAL 13 Cb -0.09 -2.68 0.07 0.00 0.56 0.00 0.00 36.38 34.24 1ht2 s VAL 13 CO 0.01 0.00 0.38 -0.63 -0.31 0.00 0.00 175.10 174.55 1ht2 s ILE 14 N -3.40 -0.37 0.16 -0.62 1.01 -1.02 -2.51 121.20 114.45 1ht2 s ILE 14 Ca 0.35 0.16 0.07 0.00 0.00 0.00 0.00 60.65 61.23 1ht2 s ILE 14 Cb 0.07 -0.60 -0.04 0.00 0.01 0.00 0.00 42.46 41.90 1ht2 s ILE 14 CO 0.15 0.07 -0.15 0.00 0.00 0.00 0.00 174.94 175.00 1ht2 s ALA 15 N 2.11 1.78 0.13 9.38 0.00 0.11 -1.93 121.76 133.34 1ht2 s ALA 15 Ca -0.04 -1.46 -0.23 0.00 0.00 0.00 0.00 51.96 50.23 1ht2 s ALA 15 Cb -0.11 -0.10 0.07 0.00 0.00 0.00 0.00 23.12 22.98 1ht2 s ALA 15 CO -0.12 0.12 0.59 0.20 0.00 0.00 0.00 175.76 176.55 1ht2 s GLY 16 N -2.77 -0.58 0.65 0.00 0.00 -1.17 -0.77 107.32 102.68 1ht2 s GLY 16 Ca 0.15 0.52 0.04 0.00 0.00 0.00 0.00 44.72 45.43 1ht2 s GLY 16 CO 0.05 0.20 0.90 0.51 0.00 0.00 0.00 173.10 174.75 1ht2 s ASP 17 N -2.58 4.69 -0.28 1.64 -4.77 -1.19 -2.12 116.67 112.06 1ht2 s ASP 17 Ca -0.00 -0.60 0.10 0.00 -3.30 0.00 0.00 52.55 48.74 1ht2 s ASP 17 Cb -0.01 0.15 0.46 0.00 -1.09 0.00 0.00 42.92 42.43 1ht2 s ASP 17 CO -0.10 -1.62 1.18 0.61 0.70 0.00 0.00 175.17 175.94 1ht2 n GLY 18 N -2.56 5.60 3.80 2.12 0.00 -0.89 -4.54 105.19 108.72 1ht2 n GLY 18 Ca 0.15 -2.32 -0.36 0.00 0.00 0.00 0.00 46.02 43.50 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 -3.55 3.83 -0.09 1.61 0.74 -1.26 -1.51 119.66 119.43 1ht2 s GLN 19 Ca 0.46 -0.18 0.03 0.00 0.05 0.00 0.00 55.36 55.72 1ht2 s GLN 19 Cb 0.39 -3.31 0.01 0.00 1.10 0.00 0.00 33.01 31.20 1ht2 s GLN 19 CO 0.02 0.52 -0.19 0.00 -0.55 0.00 0.00 175.29 175.09 1ht2 s ALA 20 N -0.29 1.79 0.04 1.58 0.00 -1.01 -4.64 121.76 119.23 1ht2 s ALA 20 Ca 0.11 -0.74 0.09 0.00 0.00 0.00 0.00 51.96 51.43 1ht2 s ALA 20 Cb -0.11 -0.72 -0.03 0.00 0.00 0.00 0.00 23.12 22.26 1ht2 s ALA 20 CO 0.01 0.20 -0.26 0.99 0.00 0.00 0.00 175.76 176.69 1ht2 s THR 21 N 0.51 2.13 -0.23 0.00 2.01 -1.26 -1.17 115.64 117.63 1ht2 s THR 21 Ca -0.16 -1.38 -0.00 0.00 0.31 0.00 0.00 61.69 60.45 1ht2 s THR 21 Cb -0.17 -1.82 0.06 0.00 0.01 0.00 0.00 72.50 70.58 1ht2 s THR 21 CO 0.06 0.37 -0.02 -0.22 -0.69 0.00 0.00 174.62 174.12 1ht2 s LEU 22 N -1.23 2.24 0.00 4.42 2.96 -0.60 -4.90 118.68 121.58 1ht2 s LEU 22 Ca 0.12 -1.12 0.00 0.00 -0.22 0.00 0.00 54.13 52.90 1ht2 s LEU 22 Cb -0.10 -1.03 0.00 0.00 0.50 0.00 0.00 46.19 45.56 1ht2 s LEU 22 CO 0.02 -0.26 0.00 0.61 -1.32 0.00 0.00 176.35 175.40 1ht2 n GLY 23 N 4.77 2.07 0.45 7.98 0.00 -1.26 -1.87 105.19 117.32 1ht2 n GLY 23 Ca -0.11 0.14 0.09 0.00 0.00 0.00 0.00 46.02 46.14 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 10.73 2.95 -4.16 1.61 3.02 -1.26 -5.02 115.26 123.12 1ht2 n ASN 24 Ca 0.00 -3.11 -0.13 0.00 -0.03 0.00 0.00 54.58 51.31 1ht2 n ASN 24 Cb 0.00 -0.49 -0.10 0.00 -0.61 0.00 0.00 39.78 38.58 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 -2.89 0.80 -0.17 3.41 -4.23 -0.78 -5.12 115.64 106.66 1ht2 s THR 25 Ca 0.37 -1.71 -0.22 0.00 -1.18 0.00 0.00 61.69 58.94 1ht2 s THR 25 Cb 0.31 -1.42 -0.02 0.00 1.34 0.00 0.00 72.50 72.70 1ht2 s THR 25 CO 0.05 -0.68 0.69 -0.69 -0.54 0.00 0.00 174.62 173.45 1ht2 s VAL 26 N -2.84 4.99 -0.14 2.29 1.01 -1.26 -1.56 120.40 122.89 1ht2 s VAL 26 Ca 0.07 1.33 -0.19 0.00 0.00 0.00 0.00 61.98 63.18 1ht2 s VAL 26 Cb -0.00 -4.00 -0.17 0.00 0.00 0.00 0.00 36.38 32.21 1ht2 s VAL 26 CO -0.02 0.11 0.44 -0.03 0.00 0.00 0.00 175.10 175.61 1ht2 h MET 27 N 7.32 0.00 -5.23 2.72 4.05 -1.49 -3.48 114.93 118.83 1ht2 h MET 27 Ca -0.32 0.00 -0.38 0.00 -0.28 0.00 0.00 59.70 58.72 1ht2 h MET 27 Cb 1.15 0.00 -0.19 0.00 -0.80 0.00 0.00 31.60 31.76 1ht2 h MET 27 CO 0.79 0.66 -0.75 0.21 0.23 0.00 0.00 176.91 178.04 1ht2 s LYS 28 N -2.04 0.92 0.00 0.39 2.20 -1.22 -5.02 119.74 114.97 1ht2 s LYS 28 Ca -0.14 -1.16 0.04 0.00 -0.36 0.00 0.00 55.97 54.34 1ht2 s LYS 28 Cb -0.01 -0.75 -0.02 0.00 -1.51 0.00 0.00 37.83 35.54 1ht2 s LYS 28 CO 0.46 0.14 0.26 0.41 -0.36 0.00 0.00 175.35 176.25 1ht2 n GLY 29 N 0.66 0.29 2.50 5.54 0.00 -1.25 -2.42 105.19 110.51 1ht2 n GLY 29 Ca -0.17 -0.11 -0.18 0.00 0.00 0.00 0.00 46.02 45.56 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 -0.81 3.44 -4.69 1.61 2.04 -0.80 -4.29 115.26 111.77 1ht2 n ASN 30 Ca 0.01 -3.25 -0.42 0.00 -0.44 0.00 0.00 54.58 50.47 1ht2 n ASN 30 Cb 0.07 -0.47 -0.03 0.00 -2.53 0.00 0.00 39.78 36.83 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 -4.50 4.11 -0.44 3.53 1.01 -0.57 -4.95 120.40 118.59 1ht2 s VAL 31 Ca 0.40 1.44 -0.29 0.00 0.00 0.00 0.00 61.98 63.54 1ht2 s VAL 31 Cb 0.41 -3.93 0.01 0.00 0.00 0.00 0.00 36.38 32.88 1ht2 s VAL 31 CO -0.07 -0.01 1.35 -0.75 0.00 0.00 0.00 175.10 175.61 1ht2 s LYS 32 N 2.39 3.58 0.00 2.72 2.20 -1.26 -4.16 119.74 125.21 1ht2 s LYS 32 Ca 0.58 0.81 0.13 0.00 -0.36 0.00 0.00 55.97 57.13 1ht2 s LYS 32 Cb -0.26 -4.01 0.29 0.00 -1.51 0.00 0.00 37.83 32.34 1ht2 s LYS 32 CO 0.23 -1.56 1.19 1.63 -0.36 0.00 0.00 175.35 176.48 1ht2 n LYS 33 N 8.08 2.26 -3.71 4.03 5.02 -1.26 -4.87 118.16 127.71 1ht2 n LYS 33 Ca 0.15 -1.91 -0.28 0.00 -2.02 0.00 0.00 58.31 54.25 1ht2 n LYS 33 Cb 0.48 -1.30 -0.16 0.00 -0.02 0.00 0.00 35.03 34.03 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 -1.03 0.48 0.00 -0.18 1.01 -1.26 -0.73 120.40 118.68 1ht2 s VAL 34 Ca 0.24 -0.66 0.00 0.00 0.00 0.00 0.00 61.98 61.56 1ht2 s VAL 34 Cb 0.14 -1.08 0.00 0.00 0.00 0.00 0.00 36.38 35.43 1ht2 s VAL 34 CO 0.18 -0.32 0.00 0.54 0.00 0.00 0.00 175.10 175.50 1ht2 n ARG 35 N 5.05 3.86 -3.67 2.72 1.74 0.24 -4.90 116.66 121.69 1ht2 n ARG 35 Ca -0.08 0.00 -0.14 0.00 -0.77 0.00 0.00 57.85 56.86 1ht2 n ARG 35 Cb 0.46 0.00 -0.07 0.00 -1.02 0.00 0.00 32.46 31.83 1ht2 n ARG 35 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 1ht2 s ARG 36 N 3.90 0.83 0.15 5.56 0.52 -1.26 -3.59 118.95 125.06 1ht2 s ARG 36 Ca 0.00 -0.12 0.02 0.00 -0.52 0.00 0.00 55.73 55.11 1ht2 s ARG 36 Cb 0.00 0.38 -0.01 0.00 0.52 0.00 0.00 34.95 35.84 1ht2 s ARG 36 CO 0.00 -0.25 0.15 1.28 0.02 0.00 0.00 175.30 176.50 1ht2 n LEU 37 N 0.98 0.00 -3.36 2.53 4.77 0.32 -4.89 117.00 117.36 1ht2 n LEU 37 Ca -0.20 -1.38 -0.29 0.00 -0.03 0.00 0.00 56.01 54.11 1ht2 n LEU 37 Cb 0.57 0.85 0.02 0.00 -2.33 0.00 0.00 43.42 42.53 1ht2 n LEU 37 CO 0.22 -0.25 -0.23 0.00 -1.33 0.00 0.00 177.39 175.80 1ht2 n TYR 38 N -0.28 -2.08 -4.23 -1.77 9.36 -1.26 -1.18 117.16 115.73 1ht2 n TYR 38 Ca 0.03 0.87 -0.37 0.00 3.32 0.00 0.00 57.90 61.74 1ht2 n TYR 38 Cb 0.27 -1.86 -0.05 0.00 -0.63 0.00 0.00 39.34 37.07 1ht2 n TYR 38 CO 0.00 0.00 0.00 0.09 0.22 0.00 0.00 176.86 177.17 1ht2 n ASN 39 N -0.93 -0.93 -4.20 2.98 4.13 -1.26 -0.70 115.26 114.36 1ht2 n ASN 39 Ca -0.16 -1.29 -0.33 0.00 1.68 0.00 0.00 54.58 54.48 1ht2 n ASN 39 Cb 0.60 -1.64 -0.04 0.00 -1.54 0.00 0.00 39.78 37.16 1ht2 n ASN 39 CO 0.00 0.00 0.00 0.47 0.28 0.00 0.00 177.26 178.01 1ht2 n ASP 40 N -2.62 -1.55 -0.05 6.41 9.92 -0.32 -4.82 116.55 123.53 1ht2 n ASP 40 Ca -0.25 -1.08 -0.06 0.00 -0.53 0.00 0.00 54.79 52.87 1ht2 n ASP 40 Cb 0.65 -2.52 -0.05 0.00 -0.64 0.00 0.00 41.12 38.56 1ht2 n ASP 40 CO 0.00 0.00 0.00 0.29 0.13 0.00 0.00 177.20 177.62 1ht2 n LYS 41 N -4.39 0.61 -3.93 -1.24 5.02 0.12 -4.97 118.16 109.39 1ht2 n LYS 41 Ca -0.10 0.05 -0.36 0.00 -2.02 0.00 0.00 58.31 55.88 1ht2 n LYS 41 Cb 0.58 -1.19 -0.12 0.00 -0.02 0.00 0.00 35.03 34.28 1ht2 n LYS 41 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1ht2 s VAL 42 N -2.19 4.38 0.34 -0.18 1.01 -1.00 -4.64 120.40 118.12 1ht2 s VAL 42 Ca -0.11 -0.16 0.02 0.00 0.00 0.00 0.00 61.98 61.72 1ht2 s VAL 42 Cb 0.03 -3.01 -0.03 0.00 0.00 0.00 0.00 36.38 33.37 1ht2 s VAL 42 CO 0.23 0.39 0.52 0.27 0.00 0.00 0.00 175.10 176.52 1ht2 s ILE 43 N 1.08 4.99 -0.06 2.22 -4.36 -0.68 0.12 121.20 124.52 1ht2 s ILE 43 Ca 0.04 -0.58 -0.30 0.00 -0.26 0.00 0.00 60.65 59.55 1ht2 s ILE 43 Cb -0.14 -3.81 0.09 0.00 1.25 0.00 0.00 42.46 39.85 1ht2 s ILE 43 CO 0.03 -0.48 0.79 0.00 0.24 0.00 0.00 174.94 175.51 1ht2 s ALA 44 N -2.27 -1.81 0.33 2.27 0.00 -1.24 -1.37 121.76 117.67 1ht2 s ALA 44 Ca 0.40 1.29 0.03 0.00 0.00 0.00 0.00 51.96 53.68 1ht2 s ALA 44 Cb -0.09 -0.09 -0.04 0.00 0.00 0.00 0.00 23.12 22.89 1ht2 s ALA 44 CO 0.35 -0.42 0.11 0.20 0.00 0.00 0.00 175.76 176.00 1ht2 s GLY 45 N -1.42 2.15 -0.07 0.00 0.00 -0.01 -0.59 107.32 107.37 1ht2 s GLY 45 Ca -0.06 -1.71 -0.31 0.00 0.00 0.00 0.00 44.72 42.63 1ht2 s GLY 45 CO 0.04 -1.71 1.11 -0.11 0.00 0.00 0.00 173.10 172.42 1ht2 s PHE 46 N -3.45 -0.17 -0.21 1.90 -0.71 0.09 -1.21 117.98 114.22 1ht2 s PHE 46 Ca 0.33 0.06 -0.00 0.00 -1.04 0.00 0.00 56.93 56.28 1ht2 s PHE 46 Cb 0.06 0.54 0.06 0.00 -1.21 0.00 0.00 43.02 42.46 1ht2 s PHE 46 CO 0.15 -0.38 -0.03 0.00 -1.34 0.00 0.00 175.22 173.63 1ht2 s ALA 47 N -2.71 1.63 0.00 1.99 0.00 -1.15 -4.84 121.76 116.69 1ht2 s ALA 47 Ca 0.09 -1.09 0.00 0.00 0.00 0.00 0.00 51.96 50.96 1ht2 s ALA 47 Cb -0.00 -1.31 0.00 0.00 0.00 0.00 0.00 23.12 21.81 1ht2 s ALA 47 CO -0.05 -1.11 0.00 0.41 0.00 0.00 0.00 175.76 175.01 1ht2 n GLY 48 N 4.80 -0.49 3.77 0.00 0.00 -1.26 -2.35 105.19 109.65 1ht2 n GLY 48 Ca -0.11 -1.06 -0.38 0.00 0.00 0.00 0.00 46.02 44.47 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 2.84 0.58 -0.02 0.00 -1.26 -4.90 107.32 104.56 1ht2 s GLY 49 Ca 0.00 1.03 0.33 0.00 0.00 0.00 0.00 44.72 46.08 1ht2 s GLY 49 CO 0.00 1.53 2.19 -0.84 0.00 0.00 0.00 173.10 175.99 1ht2 h THR 50 N 2.07 0.37 0.00 0.90 2.02 -1.99 -1.30 112.91 114.98 1ht2 h THR 50 Ca -0.49 -0.25 -0.25 0.00 0.77 0.00 0.00 66.41 66.19 1ht2 h THR 50 Cb 1.25 1.18 -0.04 0.00 -1.74 0.00 0.00 68.15 68.80 1ht2 h THR 50 CO 0.61 0.05 -1.39 0.00 0.37 0.00 0.00 175.52 175.15 1ht2 n ALA 51 N -2.23 0.82 -0.31 6.16 0.00 -1.26 -3.13 120.51 120.56 1ht2 n ALA 51 Ca -0.02 -0.56 0.15 0.00 0.00 0.00 0.00 53.44 53.01 1ht2 n ALA 51 Cb 0.16 -0.46 0.31 0.00 0.00 0.00 0.00 19.45 19.47 1ht2 n ALA 51 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 1ht2 h ASP 52 N -1.00 -0.13 0.00 0.00 3.45 -1.88 0.21 116.42 117.06 1ht2 h ASP 52 Ca -0.38 0.23 0.00 0.00 0.43 0.00 0.00 57.03 57.31 1ht2 h ASP 52 Cb 1.31 0.34 0.00 0.00 -0.56 0.00 0.00 39.33 40.42 1ht2 h ASP 52 CO -0.23 -0.25 0.00 0.00 -1.57 0.00 0.00 179.24 177.19 1ht2 n ALA 53 N -2.80 -0.31 0.02 3.45 0.00 -0.51 -0.61 120.51 119.75 1ht2 n ALA 53 Ca 0.23 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.67 1ht2 n ALA 53 Cb 0.76 0.09 0.01 0.00 0.00 0.00 0.00 19.45 20.31 1ht2 n ALA 53 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1ht2 n PHE 54 N -1.85 0.01 -0.09 0.00 -0.00 0.55 0.16 117.46 116.23 1ht2 n PHE 54 Ca 0.00 0.01 -0.12 0.00 -0.00 0.00 0.00 57.45 57.33 1ht2 n PHE 54 Cb 0.00 -0.08 -0.09 0.00 -0.00 0.00 0.00 39.48 39.31 1ht2 n PHE 54 CO 0.00 0.00 0.00 2.41 -0.00 0.00 0.00 176.76 179.17 1ht2 n THR 55 N -1.14 1.08 0.37 -2.13 -1.04 -0.17 -3.91 114.28 107.34 1ht2 n THR 55 Ca -0.00 -0.44 0.12 0.00 -2.04 0.00 0.00 64.05 61.69 1ht2 n THR 55 Cb 0.45 -1.11 0.27 0.00 -1.82 0.00 0.00 70.33 68.12 1ht2 n THR 55 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 1ht2 h LEU 56 N 0.00 0.00 0.00 -4.42 3.38 0.39 -2.67 115.31 111.99 1ht2 h LEU 56 Ca -0.42 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.55 1ht2 h LEU 56 Cb 1.69 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.44 1ht2 h LEU 56 CO -0.06 0.00 -1.26 0.49 0.09 0.00 0.00 178.44 177.71 1ht2 n PHE 57 N -2.80 0.59 -0.07 1.13 3.72 0.19 -3.01 117.46 117.21 1ht2 n PHE 57 Ca 0.04 0.17 -0.14 0.00 -0.05 0.00 0.00 57.45 57.48 1ht2 n PHE 57 Cb 0.49 -0.75 -0.13 0.00 -0.94 0.00 0.00 39.48 38.15 1ht2 n PHE 57 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 176.76 177.64 1ht2 h GLU 58 N 0.00 0.00 -0.60 -1.08 5.08 -1.67 -3.10 114.58 113.22 1ht2 h GLU 58 Ca 0.00 0.00 0.10 0.00 -1.00 0.00 0.00 59.36 58.46 1ht2 h GLU 58 Cb 0.95 0.00 -0.08 0.00 0.50 0.00 0.00 28.75 30.12 1ht2 h GLU 58 CO 0.00 0.98 0.19 1.25 -1.00 0.00 0.00 179.01 180.43 1ht2 h LEU 59 N -1.00 0.15 -0.33 1.33 5.85 -1.63 -1.24 115.31 118.44 1ht2 h LEU 59 Ca -0.01 0.09 0.05 0.00 0.84 0.00 0.00 57.88 58.85 1ht2 h LEU 59 Cb 0.99 0.09 -0.05 0.00 0.37 0.00 0.00 40.66 42.06 1ht2 h LEU 59 CO -0.01 0.09 0.03 0.15 -0.34 0.00 0.00 178.44 178.36 1ht2 h PHE 60 N 0.35 0.04 -0.37 1.25 3.57 -1.65 -1.76 116.94 118.37 1ht2 h PHE 60 Ca 0.30 0.02 0.08 0.00 3.53 0.00 0.00 57.97 61.91 1ht2 h PHE 60 Cb 0.40 0.03 -0.09 0.00 2.79 0.00 0.00 35.95 39.09 1ht2 h PHE 60 CO -0.19 -0.02 -0.26 0.93 -2.23 0.00 0.00 178.31 176.54 1ht2 h GLU 61 N 0.13 -0.20 -1.00 1.11 5.08 -1.15 -0.90 114.58 117.66 1ht2 h GLU 61 Ca 0.16 0.01 0.03 0.00 -1.00 0.00 0.00 59.36 58.56 1ht2 h GLU 61 Cb 0.20 0.04 -0.06 0.00 0.50 0.00 0.00 28.75 29.44 1ht2 h GLU 61 CO -0.24 -0.13 0.66 0.00 -1.00 0.00 0.00 179.01 178.30 1ht2 h ARG 62 N -0.20 1.26 -0.42 2.33 3.08 -1.14 -1.00 114.38 118.28 1ht2 h ARG 62 Ca 0.18 -0.08 0.08 0.00 0.07 0.00 0.00 59.98 60.23 1ht2 h ARG 62 Cb 0.49 -0.28 -0.02 0.00 0.08 0.00 0.00 29.97 30.23 1ht2 h ARG 62 CO -0.49 0.83 0.29 0.87 -1.07 0.00 0.00 179.97 180.40 1ht2 h LYS 63 N 1.30 0.21 -0.08 0.04 1.79 -0.31 0.35 116.57 119.87 1ht2 h LYS 63 Ca 0.39 -0.01 -0.15 0.00 -2.18 0.00 0.00 60.65 58.69 1ht2 h LYS 63 Cb -0.05 -0.05 -0.01 0.00 -1.58 0.00 0.00 32.23 30.54 1ht2 h LYS 63 CO -0.11 0.14 -0.61 -0.07 -1.08 0.00 0.00 179.45 177.72 1ht2 h LEU 64 N 0.22 0.33 -1.31 2.94 3.38 -0.56 -1.99 115.31 118.32 1ht2 h LEU 64 Ca 0.19 -0.19 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1ht2 h LEU 64 Cb 0.48 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.13 1ht2 h LEU 64 CO -0.03 0.87 0.00 -0.33 0.09 0.00 0.00 178.44 179.03 1ht2 h GLU 65 N 0.22 0.00 -0.39 1.13 5.08 0.05 -1.85 114.58 118.82 1ht2 h GLU 65 Ca -0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1ht2 h GLU 65 Cb 1.13 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.38 1ht2 h GLU 65 CO 0.10 0.00 0.00 -1.33 -1.00 0.00 0.00 179.01 176.78 1ht2 n MET 66 N -2.96 2.47 -2.69 2.33 2.81 -0.15 -4.48 117.12 114.45 1ht2 n MET 66 Ca 0.01 -2.27 -0.07 0.00 -1.81 0.00 0.00 57.70 53.56 1ht2 n MET 66 Cb 0.30 -1.50 0.08 0.00 -0.71 0.00 0.00 33.22 31.39 1ht2 n MET 66 CO 0.00 0.00 0.00 0.72 1.51 0.00 0.00 175.97 178.20 1ht2 n HIS 67 N 1.45 -0.70 -1.80 2.03 8.25 -0.73 -5.05 115.22 118.67 1ht2 n HIS 67 Ca 0.19 -2.28 0.00 0.00 -0.26 0.00 0.00 57.72 55.36 1ht2 n HIS 67 Cb 0.59 0.66 0.00 0.00 1.12 0.00 0.00 29.99 32.36 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 -0.44 0.00 0.00 -0.41 6.02 -0.97 -0.55 117.38 121.03 1ht2 n GLN 68 Ca 0.02 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.01 1ht2 n GLN 68 Cb 0.84 0.00 0.00 0.00 1.02 0.00 0.00 30.24 32.10 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 -0.29 0.15 3.55 1.08 0.00 -1.13 -4.86 105.19 103.69 1ht2 n GLY 69 Ca 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.74 1ht2 n GLY 69 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 1ht2 n HIS 70 N -1.17 1.26 0.00 1.61 -0.00 0.29 -4.86 115.22 112.35 1ht2 n HIS 70 Ca 0.00 0.08 0.00 0.00 -0.00 0.00 0.00 57.72 57.80 1ht2 n HIS 70 Cb 0.00 -2.57 0.00 0.00 -0.00 0.00 0.00 29.99 27.42 1ht2 n HIS 70 CO 0.00 0.00 0.00 -0.11 -0.00 0.00 0.00 176.34 176.23 1ht2 n LEU 71 N 16.46 0.00 0.00 0.27 -0.00 -1.26 -3.07 117.00 129.40 1ht2 n LEU 71 Ca 0.43 0.04 0.00 0.00 -0.00 0.00 0.00 56.01 56.48 1ht2 n LEU 71 Cb 0.47 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.89 1ht2 n LEU 71 CO 0.67 0.00 0.00 0.52 -0.00 0.00 0.00 177.39 178.58 1ht2 n VAL 72 N -0.08 0.00 0.02 1.96 0.31 -1.26 -0.07 118.33 119.22 1ht2 n VAL 72 Ca 0.00 0.00 -0.10 0.00 -0.01 0.00 0.00 64.34 64.23 1ht2 n VAL 72 Cb 0.00 0.00 -0.04 0.00 -0.91 0.00 0.00 33.84 32.89 1ht2 n VAL 72 CO 0.00 0.00 0.00 0.50 -1.32 0.00 0.00 176.83 176.01 1ht2 h LYS 73 N 0.00 -0.23 -0.95 5.55 3.11 -1.95 0.77 116.57 122.88 1ht2 h LYS 73 Ca 0.00 0.02 0.11 0.00 -2.81 0.00 0.00 60.65 57.96 1ht2 h LYS 73 Cb 0.00 0.05 -0.08 0.00 -1.00 0.00 0.00 32.23 31.20 1ht2 h LYS 73 CO 0.00 -0.15 0.58 0.00 -2.81 0.00 0.00 179.45 177.07 1ht2 h ALA 74 N 0.75 1.39 -0.48 5.00 0.00 -0.41 0.42 119.26 125.94 1ht2 h ALA 74 Ca 0.08 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 1ht2 h ALA 74 Cb 0.35 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 1ht2 h ALA 74 CO -0.22 0.21 0.22 0.00 0.00 0.00 0.00 179.25 179.46 1ht2 h ALA 75 N 1.50 0.63 -0.53 0.00 0.00 -0.52 0.25 119.26 120.59 1ht2 h ALA 75 Ca 0.46 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.24 1ht2 h ALA 75 Cb 0.41 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.99 1ht2 h ALA 75 CO -0.25 0.21 0.34 0.28 0.00 0.00 0.00 179.25 179.82 1ht2 h VAL 76 N 0.64 1.15 -0.09 0.00 2.07 0.33 -0.34 116.25 120.00 1ht2 h VAL 76 Ca 0.16 -0.29 -0.10 0.00 0.82 0.00 0.00 66.70 67.29 1ht2 h VAL 76 Cb 0.15 0.40 -0.01 0.00 -1.52 0.00 0.00 31.29 30.31 1ht2 h VAL 76 CO -0.02 0.14 -0.38 -0.33 0.02 0.00 0.00 177.57 177.01 1ht2 h GLU 77 N 0.71 0.19 0.49 1.57 4.39 0.07 -2.38 114.58 119.62 1ht2 h GLU 77 Ca 0.19 -0.08 -0.02 0.00 0.34 0.00 0.00 59.36 59.78 1ht2 h GLU 77 Cb -0.05 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 28.60 1ht2 h GLU 77 CO -0.04 0.55 -0.23 1.25 -1.16 0.00 0.00 179.01 179.37 1ht2 h LEU 78 N 0.17 -0.56 -1.72 1.33 5.85 0.21 -2.78 115.31 117.81 1ht2 h LEU 78 Ca 0.02 0.02 0.06 0.00 0.84 0.00 0.00 57.88 58.82 1ht2 h LEU 78 Cb 0.75 0.14 -0.01 0.00 0.37 0.00 0.00 40.66 41.91 1ht2 h LEU 78 CO 0.06 -0.28 0.50 0.00 -0.34 0.00 0.00 178.44 178.38 1ht2 h ALA 79 N -1.45 1.77 -0.87 1.25 0.00 -1.11 -2.11 119.26 116.74 1ht2 h ALA 79 Ca -0.07 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1ht2 h ALA 79 Cb 0.50 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.31 1ht2 h ALA 79 CO 0.11 -0.61 0.00 1.17 0.00 0.00 0.00 179.25 179.92 1ht2 n LYS 80 N -3.14 0.00 -0.24 0.00 4.81 -0.90 -3.46 118.16 115.23 1ht2 n LYS 80 Ca 0.03 0.36 0.04 0.00 -0.87 0.00 0.00 58.31 57.87 1ht2 n LYS 80 Cb 0.60 -1.23 0.16 0.00 0.02 0.00 0.00 35.03 34.58 1ht2 n LYS 80 CO 0.00 0.00 0.00 -0.44 1.17 0.00 0.00 177.40 178.13 1ht2 h ASP 81 N 0.00 0.03 0.00 3.14 3.32 -1.31 -1.23 116.42 120.37 1ht2 h ASP 81 Ca 0.00 0.13 0.00 0.00 0.02 0.00 0.00 57.03 57.18 1ht2 h ASP 81 Cb 0.00 0.18 0.00 0.00 0.22 0.00 0.00 39.33 39.73 1ht2 h ASP 81 CO 0.00 -0.01 0.36 1.87 -1.72 0.00 0.00 179.24 179.73 1ht2 n TRP 82 N -5.14 0.20 -0.25 4.55 -0.00 -0.83 0.14 117.44 116.11 1ht2 n TRP 82 Ca 0.13 0.11 0.00 0.00 -0.00 0.00 0.00 57.50 57.73 1ht2 n TRP 82 Cb 0.42 -0.40 0.00 0.00 -0.00 0.00 0.00 31.31 31.33 1ht2 n TRP 82 CO 0.00 0.00 0.00 2.89 -0.00 0.00 0.00 177.69 180.58 1ht2 n ARG 83 N -1.68 -0.56 -0.06 5.87 1.85 -0.49 -4.22 116.66 117.36 1ht2 n ARG 83 Ca -0.00 -0.43 -0.13 0.00 -1.00 0.00 0.00 57.85 56.29 1ht2 n ARG 83 Cb 0.37 -0.87 -0.04 0.00 -1.05 0.00 0.00 32.46 30.86 1ht2 n ARG 83 CO 0.00 0.00 0.00 2.41 -0.01 0.00 0.00 177.63 180.03 1ht2 n THR 84 N -0.02 0.77 -1.84 8.89 -1.04 0.37 -4.97 114.28 116.43 1ht2 n THR 84 Ca 0.00 -0.14 -0.42 0.00 -2.04 0.00 0.00 64.05 61.45 1ht2 n THR 84 Cb 0.08 -1.70 -0.03 0.00 -1.82 0.00 0.00 70.33 66.86 1ht2 n THR 84 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1ht2 s ASP 85 N -6.15 5.60 0.03 8.00 -1.08 0.79 -4.89 116.67 118.97 1ht2 s ASP 85 Ca -0.18 1.41 -0.06 0.00 -0.52 0.00 0.00 52.55 53.20 1ht2 s ASP 85 Cb 0.07 -2.52 -0.01 0.00 -1.46 0.00 0.00 42.92 39.00 1ht2 s ASP 85 CO 0.23 -1.93 0.32 0.54 0.52 0.00 0.00 175.17 174.85 1ht2 n ARG 86 N 8.63 -0.09 0.23 4.34 1.74 -1.26 -0.81 116.66 129.45 1ht2 n ARG 86 Ca 0.26 0.31 -0.09 0.00 -0.77 0.00 0.00 57.85 57.56 1ht2 n ARG 86 Cb 0.47 -0.46 -0.04 0.00 -1.02 0.00 0.00 32.46 31.41 1ht2 n ARG 86 CO 0.00 0.00 0.00 0.52 -1.52 0.00 0.00 177.63 176.63 1ht2 h MET 87 N 0.00 -0.58 -1.37 5.56 2.86 -1.97 -3.17 114.93 116.25 1ht2 h MET 87 Ca 0.04 0.04 0.40 0.00 -2.06 0.00 0.00 59.70 58.11 1ht2 h MET 87 Cb 0.09 0.13 -0.05 0.00 0.06 0.00 0.00 31.60 31.83 1ht2 h MET 87 CO -0.19 -0.39 1.14 1.25 1.06 0.00 0.00 176.91 179.77 1ht2 h LEU 88 N -0.75 0.00 -1.51 1.22 5.85 -1.31 -1.58 115.31 117.22 1ht2 h LEU 88 Ca -0.06 0.00 0.04 0.00 0.84 0.00 0.00 57.88 58.70 1ht2 h LEU 88 Cb 0.46 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 41.46 1ht2 h LEU 88 CO 0.10 0.00 0.37 0.03 -0.34 0.00 0.00 178.44 178.60 1ht2 h ARG 89 N 0.00 0.61 0.00 1.25 3.08 -1.07 -2.59 114.38 115.66 1ht2 h ARG 89 Ca 0.65 -0.04 -0.04 0.00 0.07 0.00 0.00 59.98 60.62 1ht2 h ARG 89 Cb 2.92 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 32.82 1ht2 h ARG 89 CO -0.01 0.40 -0.20 0.87 -1.07 0.00 0.00 179.97 179.96 1ht2 h LYS 90 N 0.63 0.00 -6.52 0.04 6.56 -1.45 -3.44 116.57 112.39 1ht2 h LYS 90 Ca 0.23 0.00 -0.56 0.00 -1.06 0.00 0.00 60.65 59.26 1ht2 h LYS 90 Cb 0.13 0.00 0.05 0.00 -0.57 0.00 0.00 32.23 31.84 1ht2 h LYS 90 CO -0.06 0.20 0.95 1.28 -2.06 0.00 0.00 179.45 179.77 1ht2 n LEU 91 N -3.42 3.57 -4.30 2.94 4.77 -0.98 -4.99 117.00 114.60 1ht2 n LEU 91 Ca -0.00 1.04 -0.32 0.00 -0.03 0.00 0.00 56.01 56.70 1ht2 n LEU 91 Cb 0.40 -1.48 -0.16 0.00 -2.33 0.00 0.00 43.42 39.85 1ht2 n LEU 91 CO 0.33 -0.04 -0.53 -1.61 -1.33 0.00 0.00 177.39 174.21 1ht2 s GLU 92 N 1.75 2.87 0.00 3.23 2.02 -1.26 -4.84 118.70 122.46 1ht2 s GLU 92 Ca 0.80 -0.83 0.00 0.00 0.02 0.00 0.00 54.97 54.97 1ht2 s GLU 92 Cb -0.59 -2.33 0.00 0.00 0.10 0.00 0.00 34.13 31.31 1ht2 s GLU 92 CO 0.38 0.32 0.00 0.00 0.02 0.00 0.00 175.26 175.98 1ht2 n ALA 93 N 3.16 0.00 -3.64 5.21 0.00 -1.26 -4.27 120.51 119.71 1ht2 n ALA 93 Ca -0.18 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 52.97 1ht2 n ALA 93 Cb 0.52 0.00 -0.15 0.00 0.00 0.00 0.00 19.45 19.83 1ht2 n ALA 93 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1ht2 s LEU 94 N 0.00 1.55 -0.03 0.00 1.43 -0.99 -4.13 118.68 116.51 1ht2 s LEU 94 Ca 0.00 -1.64 -0.29 0.00 -1.03 0.00 0.00 54.13 51.17 1ht2 s LEU 94 Cb 0.00 -0.65 -0.03 0.00 0.03 0.00 0.00 46.19 45.54 1ht2 s LEU 94 CO 0.00 -0.40 0.95 -0.76 0.23 0.00 0.00 176.35 176.36 1ht2 s LEU 95 N 1.64 4.33 -0.19 1.79 1.02 -1.10 -2.93 118.68 123.24 1ht2 s LEU 95 Ca 0.11 1.56 -0.05 0.00 0.02 0.00 0.00 54.13 55.77 1ht2 s LEU 95 Cb -0.18 -3.50 -0.03 0.00 0.02 0.00 0.00 46.19 42.51 1ht2 s LEU 95 CO -0.25 -0.28 0.00 0.00 0.02 0.00 0.00 176.35 175.84 1ht2 s ALA 96 N 1.21 3.07 -0.01 4.21 0.00 -0.35 -1.52 121.76 128.37 1ht2 s ALA 96 Ca 0.49 -0.93 0.00 0.00 0.00 0.00 0.00 51.96 51.53 1ht2 s ALA 96 Cb -0.20 -1.75 0.01 0.00 0.00 0.00 0.00 23.12 21.18 1ht2 s ALA 96 CO 0.24 -0.04 0.00 0.54 0.00 0.00 0.00 175.76 176.51 1ht2 s VAL 97 N 0.80 0.04 -0.08 0.00 0.11 -0.31 -0.83 120.40 120.14 1ht2 s VAL 97 Ca 0.01 0.06 -0.05 0.00 -2.93 0.00 0.00 61.98 59.06 1ht2 s VAL 97 Cb -0.14 -0.10 0.03 0.00 -1.53 0.00 0.00 36.38 34.64 1ht2 s VAL 97 CO 0.02 0.06 0.19 0.00 -3.33 0.00 0.00 175.10 172.03 1ht2 s ALA 98 N 0.46 -0.43 0.43 1.54 0.00 -0.47 0.08 121.76 123.36 1ht2 s ALA 98 Ca -0.04 0.65 0.03 0.00 0.00 0.00 0.00 51.96 52.60 1ht2 s ALA 98 Cb -0.06 -0.40 -0.03 0.00 0.00 0.00 0.00 23.12 22.63 1ht2 s ALA 98 CO -0.01 -0.13 0.07 0.16 0.00 0.00 0.00 175.76 175.85 1ht2 s ASP 99 N 0.59 3.23 0.64 0.00 -4.77 0.44 -1.68 116.67 115.11 1ht2 s ASP 99 Ca -0.04 -1.61 0.35 0.00 -3.30 0.00 0.00 52.55 47.96 1ht2 s ASP 99 Cb -0.06 0.37 1.98 0.00 -1.09 0.00 0.00 42.92 44.12 1ht2 s ASP 99 CO -0.03 -0.83 2.18 1.05 0.70 0.00 0.00 175.17 178.24 1ht2 h GLU 100 N 1.70 0.00 0.00 2.11 4.11 -1.97 -3.13 114.58 117.40 1ht2 h GLU 100 Ca -0.39 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.04 1ht2 h GLU 100 Cb 1.28 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.53 1ht2 h GLU 100 CO 0.66 0.00 0.00 2.41 0.07 0.00 0.00 179.01 182.15 1ht2 n THR 101 N -3.31 0.00 -3.72 -1.06 -1.04 -1.26 -5.05 114.28 98.84 1ht2 n THR 101 Ca -0.01 0.32 0.00 0.00 -2.04 0.00 0.00 64.05 62.32 1ht2 n THR 101 Cb 0.22 -0.64 0.00 0.00 -1.82 0.00 0.00 70.33 68.09 1ht2 n THR 101 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1ht2 n ALA 102 N -0.50 0.00 -3.39 2.41 0.00 -1.18 -5.18 120.51 112.66 1ht2 n ALA 102 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.32 1ht2 n ALA 102 Cb 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.35 1ht2 n ALA 102 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1ht2 s SER 103 N -0.44 -0.43 0.22 0.00 1.04 -1.26 -0.42 113.70 112.40 1ht2 s SER 103 Ca 0.00 0.81 -0.19 0.00 0.48 0.00 0.00 55.95 57.05 1ht2 s SER 103 Cb 0.00 0.79 0.03 0.00 0.10 0.00 0.00 66.02 66.93 1ht2 s SER 103 CO 0.00 -0.15 0.59 -1.48 0.98 0.00 0.00 173.24 173.18 1ht2 s LEU 104 N 0.51 -0.07 0.26 2.42 2.34 0.11 -4.62 118.68 119.62 1ht2 s LEU 104 Ca -0.02 -0.52 0.03 0.00 0.06 0.00 0.00 54.13 53.68 1ht2 s LEU 104 Cb -0.04 2.33 -0.03 0.00 -0.56 0.00 0.00 46.19 47.89 1ht2 s LEU 104 CO -0.03 -1.14 0.40 -0.63 -1.06 0.00 0.00 176.35 173.89 1ht2 s ILE 105 N -3.89 5.22 -0.05 1.48 1.01 -0.36 -1.16 121.20 123.46 1ht2 s ILE 105 Ca 0.10 -0.79 -0.02 0.00 0.00 0.00 0.00 60.65 59.95 1ht2 s ILE 105 Cb -0.02 -3.84 0.03 0.00 0.01 0.00 0.00 42.46 38.63 1ht2 s ILE 105 CO 0.00 -0.35 0.10 -0.63 0.00 0.00 0.00 174.94 174.06 1ht2 s ILE 106 N -2.03 -0.04 0.10 2.92 1.01 -0.58 -1.57 121.20 121.00 1ht2 s ILE 106 Ca 0.36 0.16 0.10 0.00 0.00 0.00 0.00 60.65 61.27 1ht2 s ILE 106 Cb -0.09 -0.17 -0.04 0.00 0.01 0.00 0.00 42.46 42.17 1ht2 s ILE 106 CO 0.31 0.06 -0.26 0.42 0.00 0.00 0.00 174.94 175.47 1ht2 s THR 107 N 0.93 2.17 0.64 2.92 -4.23 -1.08 -2.71 115.64 114.28 1ht2 s THR 107 Ca -0.07 -1.61 0.11 0.00 -1.18 0.00 0.00 61.69 58.94 1ht2 s THR 107 Cb -0.10 -1.90 0.11 0.00 1.34 0.00 0.00 72.50 71.96 1ht2 s THR 107 CO -0.04 0.18 1.34 1.23 -0.54 0.00 0.00 174.62 176.79 1ht2 h GLY 108 N 4.23 0.00 1.67 3.99 0.00 -1.89 1.06 103.07 112.13 1ht2 h GLY 108 Ca -0.49 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.84 1ht2 h GLY 108 CO 0.41 0.00 0.00 0.70 0.00 0.00 0.00 176.54 177.65 1ht2 n ASN 109 N -2.61 0.00 0.00 0.19 5.03 -1.26 -4.22 115.26 112.38 1ht2 n ASN 109 Ca -0.01 0.15 0.00 0.00 0.87 0.00 0.00 54.58 55.59 1ht2 n ASN 109 Cb 0.75 -0.33 0.00 0.00 -1.02 0.00 0.00 39.78 39.18 1ht2 n ASN 109 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1ht2 n GLY 110 N 0.10 0.85 3.77 7.41 0.00 0.37 -4.93 105.19 112.75 1ht2 n GLY 110 Ca 0.07 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.71 1ht2 n GLY 110 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1ht2 s ASP 111 N -2.96 6.40 -0.20 1.61 -0.00 -1.22 -4.57 116.67 115.73 1ht2 s ASP 111 Ca 0.00 2.39 0.01 0.00 -0.00 0.00 0.00 52.55 54.95 1ht2 s ASP 111 Cb 0.00 -2.62 0.04 0.00 -0.00 0.00 0.00 42.92 40.35 1ht2 s ASP 111 CO 0.00 -0.76 -0.11 -0.69 -0.00 0.00 0.00 175.17 173.60 1ht2 s VAL 112 N -1.42 1.74 -0.09 -1.27 1.01 -1.26 -2.63 120.40 116.48 1ht2 s VAL 112 Ca 0.59 -1.07 0.03 0.00 0.00 0.00 0.00 61.98 61.53 1ht2 s VAL 112 Cb -0.31 -1.79 0.00 0.00 0.00 0.00 0.00 36.38 34.28 1ht2 s VAL 112 CO 0.39 0.18 -0.21 -0.69 0.00 0.00 0.00 175.10 174.78 1ht2 s VAL 113 N 1.35 1.80 -0.42 2.92 1.01 -0.61 -4.98 120.40 121.48 1ht2 s VAL 113 Ca -0.02 -0.86 -0.07 0.00 0.00 0.00 0.00 61.98 61.04 1ht2 s VAL 113 Cb -0.16 -1.57 0.09 0.00 0.00 0.00 0.00 36.38 34.74 1ht2 s VAL 113 CO -0.08 0.50 0.24 -1.58 0.00 0.00 0.00 175.10 174.18 1ht2 s GLN 114 N 0.47 2.39 0.43 2.72 0.74 -1.26 -1.23 119.66 123.92 1ht2 s GLN 114 Ca -0.17 -1.61 -0.24 0.00 0.05 0.00 0.00 55.36 53.40 1ht2 s GLN 114 Cb -0.17 -3.70 -0.08 0.00 1.10 0.00 0.00 33.01 30.16 1ht2 s GLN 114 CO 0.07 -1.01 1.14 -1.25 -0.55 0.00 0.00 175.29 173.69 1ht2 s PRO 115 N 1.31 3.91 0.00 1.67 0.04 -1.26 -4.91 135.00 135.76 1ht2 s PRO 115 Ca 0.04 1.72 0.00 0.00 0.04 0.00 0.00 61.00 62.80 1ht2 s PRO 115 Cb -0.23 -2.48 0.00 0.00 0.04 0.00 0.00 34.50 31.82 1ht2 s PRO 115 CO -0.01 -0.41 0.00 0.39 0.04 0.00 0.00 177.00 177.01 1ht2 n GLU 116 N -0.29 0.00 -2.56 4.56 4.71 -1.26 -0.49 120.64 125.31 1ht2 n GLU 116 Ca 0.06 0.00 -0.12 0.00 -0.01 0.00 0.00 57.16 57.09 1ht2 n GLU 116 Cb 0.48 0.00 0.03 0.00 -1.01 0.00 0.00 31.44 30.94 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 -2.17 2.74 -1.80 1.62 3.02 -1.26 -4.87 115.26 112.54 1ht2 n ASN 117 Ca 0.00 -2.86 -0.20 0.00 -0.03 0.00 0.00 54.58 51.50 1ht2 n ASN 117 Cb 0.00 -0.46 -0.06 0.00 -0.61 0.00 0.00 39.78 38.64 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 -0.44 -5.27 -4.67 6.41 8.00 0.36 -4.62 116.55 116.31 1ht2 n ASP 118 Ca 0.20 0.36 -0.38 0.00 0.71 0.00 0.00 54.79 55.68 1ht2 n ASP 118 Cb 0.82 -4.60 -0.08 0.00 -0.02 0.00 0.00 41.12 37.24 1ht2 n ASP 118 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1ht2 s LEU 119 N -4.96 4.15 -0.03 0.64 2.96 -1.25 -4.30 118.68 115.88 1ht2 s LEU 119 Ca 0.00 0.50 0.04 0.00 -0.22 0.00 0.00 54.13 54.45 1ht2 s LEU 119 Cb 0.00 -2.50 -0.01 0.00 0.50 0.00 0.00 46.19 44.18 1ht2 s LEU 119 CO 0.00 -0.08 -0.15 -0.63 -1.32 0.00 0.00 176.35 174.16 1ht2 s ILE 120 N 1.34 1.27 -0.39 6.68 1.01 -0.72 -4.61 121.20 125.79 1ht2 s ILE 120 Ca 0.19 -0.65 0.04 0.00 0.00 0.00 0.00 60.65 60.23 1ht2 s ILE 120 Cb -0.15 -1.08 0.16 0.00 0.01 0.00 0.00 42.46 41.40 1ht2 s ILE 120 CO 0.08 0.37 0.45 0.00 0.00 0.00 0.00 174.94 175.84 1ht2 s ALA 121 N -0.09 -0.82 0.28 9.38 0.00 -1.25 -1.19 121.76 128.08 1ht2 s ALA 121 Ca -0.00 -0.81 0.07 0.00 0.00 0.00 0.00 51.96 51.22 1ht2 s ALA 121 Cb -0.09 -2.21 -0.03 0.00 0.00 0.00 0.00 23.12 20.78 1ht2 s ALA 121 CO 0.01 -2.16 0.21 0.96 0.00 0.00 0.00 175.76 174.78 1ht2 s ILE 122 N 1.37 4.02 0.00 0.00 -4.36 -0.74 -4.35 121.20 117.14 1ht2 s ILE 122 Ca 0.19 -1.44 0.00 0.00 -0.26 0.00 0.00 60.65 59.14 1ht2 s ILE 122 Cb -0.11 -3.28 0.00 0.00 1.25 0.00 0.00 42.46 40.32 1ht2 s ILE 122 CO -0.04 -0.29 0.00 0.61 0.24 0.00 0.00 174.94 175.46 1ht2 n GLY 123 N -1.22 2.34 0.46 6.27 0.00 -1.26 -1.32 105.19 110.46 1ht2 n GLY 123 Ca -0.06 -1.90 0.28 0.00 0.00 0.00 0.00 46.02 44.35 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 0.08 0.04 1.61 4.64 -1.87 1.19 113.55 119.23 1ht2 h SER 124 Ca 0.00 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.33 1ht2 h SER 124 Cb 0.00 -0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1ht2 h SER 124 CO 0.00 0.03 -0.08 0.61 -0.87 0.00 0.00 176.83 176.51 1ht2 n GLY 125 N -1.68 0.03 0.04 -0.77 0.00 -0.97 -4.59 105.19 97.24 1ht2 n GLY 125 Ca 0.20 -0.49 -0.01 0.00 0.00 0.00 0.00 46.02 45.72 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 1.25 -2.75 0.34 -0.02 0.00 0.41 -1.64 105.19 102.78 1ht2 n GLY 126 Ca 0.16 0.58 0.15 0.00 0.00 0.00 0.00 46.02 46.91 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 0.09 -0.09 1.61 0.11 -1.77 0.21 132.00 132.15 1ht2 h PRO 127 Ca 0.02 -0.01 -0.11 0.00 0.11 0.00 0.00 66.00 66.01 1ht2 h PRO 127 Cb 0.04 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 31.12 1ht2 h PRO 127 CO -0.09 0.06 -0.44 1.88 -0.21 0.00 0.00 178.00 179.20 1ht2 h TYR 128 N 0.09 0.26 -0.06 0.65 0.05 -1.63 -1.23 116.97 115.10 1ht2 h TYR 128 Ca 0.18 -0.07 -0.06 0.00 0.05 0.00 0.00 58.73 58.83 1ht2 h TYR 128 Cb 0.62 -0.06 0.00 0.00 1.01 0.00 0.00 36.73 38.30 1ht2 h TYR 128 CO -0.00 0.62 -0.21 0.00 -1.05 0.00 0.00 178.16 177.53 1ht2 h ALA 129 N 1.37 0.11 -0.64 3.88 0.00 -0.48 -2.32 119.26 121.18 1ht2 h ALA 129 Ca 0.01 -0.39 0.13 0.00 0.00 0.00 0.00 54.91 54.66 1ht2 h ALA 129 Cb 0.85 -0.01 -0.10 0.00 0.00 0.00 0.00 17.79 18.53 1ht2 h ALA 129 CO 0.07 0.08 0.09 0.37 0.00 0.00 0.00 179.25 179.85 1ht2 h GLN 130 N -0.26 0.20 0.14 0.00 4.15 -0.88 0.84 115.11 119.30 1ht2 h GLN 130 Ca -0.01 -0.01 0.01 0.00 0.77 0.00 0.00 58.65 59.41 1ht2 h GLN 130 Cb 0.84 -0.04 -0.02 0.00 0.21 0.00 0.00 27.48 28.47 1ht2 h GLN 130 CO 0.04 0.13 -0.15 0.00 -1.93 0.00 0.00 178.83 176.92 1ht2 h ALA 131 N 1.54 -0.30 -0.41 3.38 0.00 -1.15 0.49 119.26 122.81 1ht2 h ALA 131 Ca 0.34 -0.04 -0.10 0.00 0.00 0.00 0.00 54.91 55.11 1ht2 h ALA 131 Cb 0.54 0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.54 1ht2 h ALA 131 CO -0.47 -0.69 -0.16 0.00 0.00 0.00 0.00 179.25 177.93 1ht2 h ALA 132 N 0.49 0.95 0.04 0.00 0.00 -0.78 -1.09 119.26 118.87 1ht2 h ALA 132 Ca 0.01 -0.34 -0.00 0.00 0.00 0.00 0.00 54.91 54.57 1ht2 h ALA 132 Cb 0.32 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1ht2 h ALA 132 CO -0.05 0.61 -0.02 0.00 0.00 0.00 0.00 179.25 179.79 1ht2 h ALA 133 N 1.13 -0.06 -0.75 0.00 0.00 0.11 -1.95 119.26 117.75 1ht2 h ALA 133 Ca 0.11 -0.11 0.07 0.00 0.00 0.00 0.00 54.91 54.97 1ht2 h ALA 133 Cb 0.65 0.02 -0.06 0.00 0.00 0.00 0.00 17.79 18.40 1ht2 h ALA 133 CO 0.05 -0.43 0.43 -0.09 0.00 0.00 0.00 179.25 179.21 1ht2 h ARG 134 N -0.27 0.75 0.37 0.00 9.65 0.05 -0.41 114.38 124.52 1ht2 h ARG 134 Ca -0.01 -0.05 -0.01 0.00 -1.10 0.00 0.00 59.98 58.82 1ht2 h ARG 134 Cb 0.24 -0.17 -0.01 0.00 -1.39 0.00 0.00 29.97 28.64 1ht2 h ARG 134 CO 0.01 0.50 -0.30 0.00 2.80 0.00 0.00 179.97 182.98 1ht2 h ALA 135 N 1.39 -1.04 -0.26 2.80 0.00 -0.93 -2.48 119.26 118.73 1ht2 h ALA 135 Ca 0.34 -0.13 0.06 0.00 0.00 0.00 0.00 54.91 55.18 1ht2 h ALA 135 Cb 0.23 0.49 -0.08 0.00 0.00 0.00 0.00 17.79 18.43 1ht2 h ALA 135 CO -0.20 -1.04 -0.32 -0.07 0.00 0.00 0.00 179.25 177.62 1ht2 h LEU 136 N -0.65 -1.03 -1.98 0.00 4.07 -1.14 -1.29 115.31 113.30 1ht2 h LEU 136 Ca -0.05 0.17 0.14 0.00 0.08 0.00 0.00 57.88 58.22 1ht2 h LEU 136 Cb 0.54 0.46 -0.02 0.00 1.08 0.00 0.00 40.66 42.72 1ht2 h LEU 136 CO 0.00 -0.34 0.46 0.25 -1.08 0.00 0.00 178.44 177.74 1ht2 h LEU 137 N -0.32 0.00 -0.25 1.67 5.85 -1.06 -0.62 115.31 120.58 1ht2 h LEU 137 Ca 0.13 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.85 1ht2 h LEU 137 Cb 0.54 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.57 1ht2 h LEU 137 CO -0.44 0.00 -0.77 -0.62 -0.34 0.00 0.00 178.44 176.27 1ht2 n GLU 138 N -3.85 0.91 -0.17 1.25 1.02 -0.58 -4.58 120.64 114.63 1ht2 n GLU 138 Ca 0.09 -0.24 0.02 0.00 -0.02 0.00 0.00 57.16 57.00 1ht2 n GLU 138 Cb 0.66 -1.40 0.02 0.00 -0.02 0.00 0.00 31.44 30.70 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 -1.09 0.73 -3.52 1.62 3.02 -0.61 -5.09 115.26 110.32 1ht2 n ASN 139 Ca 0.05 -1.84 -0.13 0.00 -0.03 0.00 0.00 54.58 52.63 1ht2 n ASN 139 Cb 0.33 -0.13 -0.04 0.00 -0.61 0.00 0.00 39.78 39.32 1ht2 n ASN 139 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 1ht2 s THR 140 N -0.64 0.02 -2.19 3.41 -4.23 -0.34 -5.00 115.64 106.68 1ht2 s THR 140 Ca 0.05 -0.18 0.19 0.00 -1.18 0.00 0.00 61.69 60.57 1ht2 s THR 140 Cb 0.05 -1.02 0.44 0.00 1.34 0.00 0.00 72.50 73.31 1ht2 s THR 140 CO 0.00 -0.10 1.53 -0.62 -0.54 0.00 0.00 174.62 174.89 1ht2 n GLU 141 N 0.08 1.59 -1.06 3.99 -0.58 -1.26 -4.67 120.64 118.73 1ht2 n GLU 141 Ca -0.18 -0.89 -0.36 0.00 -0.42 0.00 0.00 57.16 55.32 1ht2 n GLU 141 Cb 0.62 -1.35 0.07 0.00 -0.57 0.00 0.00 31.44 30.21 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 0.13 -2.15 -4.88 -4.62 4.77 -1.26 -4.96 117.00 104.03 1ht2 n LEU 142 Ca 0.15 0.41 -0.30 0.00 -0.03 0.00 0.00 56.01 56.24 1ht2 n LEU 142 Cb 0.27 -1.03 -0.03 0.00 -2.33 0.00 0.00 43.42 40.31 1ht2 n LEU 142 CO 0.12 -4.37 0.44 -0.94 -1.33 0.00 0.00 177.39 171.30 1ht2 s SER 143 N -1.41 6.48 0.30 -1.43 1.04 -1.26 -4.87 113.70 112.56 1ht2 s SER 143 Ca 0.54 1.10 0.06 0.00 0.48 0.00 0.00 55.95 58.13 1ht2 s SER 143 Cb -0.28 -2.31 0.81 0.00 0.10 0.00 0.00 66.02 64.34 1ht2 s SER 143 CO 0.69 -0.43 1.68 0.00 0.98 0.00 0.00 173.24 176.17 1ht2 h ALA 144 N 1.10 1.53 -0.04 5.32 0.00 -1.89 0.20 119.26 125.48 1ht2 h ALA 144 Ca -0.47 0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.61 1ht2 h ALA 144 Cb 1.19 0.18 -0.00 0.00 0.00 0.00 0.00 17.79 19.16 1ht2 h ALA 144 CO 0.64 -0.41 -0.00 -0.09 0.00 0.00 0.00 179.25 179.38 1ht2 h ARG 145 N 0.36 0.07 -0.80 0.00 2.43 -1.92 -2.50 114.38 112.02 1ht2 h ARG 145 Ca 0.60 -0.02 0.09 0.00 -0.81 0.00 0.00 59.98 59.84 1ht2 h ARG 145 Cb 1.21 -0.01 -0.05 0.00 -0.42 0.00 0.00 29.97 30.70 1ht2 h ARG 145 CO -0.57 0.37 0.52 0.93 -1.51 0.00 0.00 179.97 179.71 1ht2 h GLU 146 N -0.23 0.73 0.00 0.20 5.08 -1.22 -2.16 114.58 116.97 1ht2 h GLU 146 Ca 0.01 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.33 1ht2 h GLU 146 Cb 0.34 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.43 1ht2 h GLU 146 CO 0.00 0.48 0.00 -0.89 -1.00 0.00 0.00 179.01 177.60 1ht2 n ILE 147 N -4.51 0.00 -0.33 3.13 2.08 0.43 -1.82 119.36 118.35 1ht2 n ILE 147 Ca 0.13 1.40 0.24 0.00 0.56 0.00 0.00 62.75 65.08 1ht2 n ILE 147 Cb 0.32 -2.39 0.46 0.00 -0.75 0.00 0.00 39.64 37.28 1ht2 n ILE 147 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1ht2 h ALA 148 N -1.99 1.85 0.13 -1.39 0.00 -1.40 0.54 119.26 117.01 1ht2 h ALA 148 Ca 0.00 0.23 -0.01 0.00 0.00 0.00 0.00 54.91 55.13 1ht2 h ALA 148 Cb 0.00 0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.05 1ht2 h ALA 148 CO 0.00 -0.66 -0.07 0.93 0.00 0.00 0.00 179.25 179.45 1ht2 h GLU 149 N 0.20 -0.18 -0.77 0.00 4.39 -1.35 0.14 114.58 117.00 1ht2 h GLU 149 Ca 0.73 0.01 0.10 0.00 0.34 0.00 0.00 59.36 60.54 1ht2 h GLU 149 Cb 1.71 0.04 -0.07 0.00 -0.10 0.00 0.00 28.75 30.32 1ht2 h GLU 149 CO -0.68 -0.12 0.41 0.87 -1.16 0.00 0.00 179.01 178.33 1ht2 h LYS 150 N -0.19 0.66 -0.36 2.33 1.57 -0.50 0.31 116.57 120.39 1ht2 h LYS 150 Ca -0.02 -0.04 0.05 0.00 -1.87 0.00 0.00 60.65 58.77 1ht2 h LYS 150 Cb 0.15 -0.15 -0.04 0.00 0.08 0.00 0.00 32.23 32.27 1ht2 h LYS 150 CO 0.02 0.44 0.10 0.00 -0.57 0.00 0.00 179.45 179.44 1ht2 h ALA 151 N 1.46 0.41 -0.83 3.86 0.00 0.09 -0.80 119.26 123.44 1ht2 h ALA 151 Ca 0.38 0.05 0.05 0.00 0.00 0.00 0.00 54.91 55.39 1ht2 h ALA 151 Cb 0.40 0.05 -0.05 0.00 0.00 0.00 0.00 17.79 18.18 1ht2 h ALA 151 CO -0.27 -0.29 0.52 1.25 0.00 0.00 0.00 179.25 180.46 1ht2 h LEU 152 N 0.24 0.84 -0.45 0.00 6.46 0.12 -0.74 115.31 121.79 1ht2 h LEU 152 Ca 0.17 0.01 -0.05 0.00 -0.12 0.00 0.00 57.88 57.89 1ht2 h LEU 152 Cb 0.16 -0.17 -0.02 0.00 -0.73 0.00 0.00 40.66 39.90 1ht2 h LEU 152 CO -0.19 0.56 0.10 0.44 -0.62 0.00 0.00 178.44 178.73 1ht2 h ASP 153 N 0.99 0.69 -0.17 1.25 3.45 -0.40 -0.90 116.42 121.33 1ht2 h ASP 153 Ca 0.35 -0.24 0.04 0.00 0.43 0.00 0.00 57.03 57.60 1ht2 h ASP 153 Cb 0.08 -0.18 -0.04 0.00 -0.56 0.00 0.00 39.33 38.64 1ht2 h ASP 153 CO -0.14 0.75 -0.07 0.40 -1.57 0.00 0.00 179.24 178.61 1ht2 h ILE 154 N 0.60 0.76 0.13 0.35 1.08 -0.73 -1.92 117.51 117.78 1ht2 h ILE 154 Ca 0.14 0.00 0.01 0.00 -0.39 0.00 0.00 64.86 64.62 1ht2 h ILE 154 Cb 0.34 0.76 -0.03 0.00 -3.07 0.00 0.00 36.82 34.82 1ht2 h ILE 154 CO 0.00 0.00 -0.40 0.00 -0.69 0.00 0.00 178.15 177.06 1ht2 h ALA 155 N 1.11 -0.92 0.00 1.87 0.00 -0.78 -0.96 119.26 119.58 1ht2 h ALA 155 Ca 0.09 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1ht2 h ALA 155 Cb 0.18 0.77 0.00 0.00 0.00 0.00 0.00 17.79 18.74 1ht2 h ALA 155 CO -0.20 -1.01 0.30 0.78 0.00 0.00 0.00 179.25 179.12 1ht2 h GLY 156 N -0.60 0.00 1.61 0.00 0.00 -0.95 0.52 103.07 103.65 1ht2 h GLY 156 Ca -0.01 0.00 -0.25 0.00 0.00 0.00 0.00 47.33 47.07 1ht2 h GLY 156 CO -0.20 0.00 -1.27 -0.55 0.00 0.00 0.00 176.54 174.53 1ht2 h ASP 157 N 0.00 0.13 0.03 0.19 3.45 -0.38 -3.38 116.42 116.47 1ht2 h ASP 157 Ca 0.00 -0.17 -0.31 0.00 0.43 0.00 0.00 57.03 56.99 1ht2 h ASP 157 Cb 0.59 -0.04 -0.04 0.00 -0.56 0.00 0.00 39.33 39.28 1ht2 h ASP 157 CO 0.00 1.14 -1.68 -0.38 -1.57 0.00 0.00 179.24 176.75 1ht2 n ILE 158 N -3.34 1.60 -2.44 0.35 2.08 0.83 -4.91 119.36 113.52 1ht2 n ILE 158 Ca -0.07 -0.26 -0.43 0.00 0.56 0.00 0.00 62.75 62.55 1ht2 n ILE 158 Cb 0.99 -1.91 -0.02 0.00 -0.75 0.00 0.00 39.64 37.95 1ht2 n ILE 158 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1ht2 n ILE 160 N 4.97 0.73 -0.14 0.00 0.13 -1.26 -2.37 119.36 121.42 1ht2 n ILE 160 Ca 0.12 0.08 0.08 0.00 -1.10 0.00 0.00 62.75 61.93 1ht2 n ILE 160 Cb 0.46 -0.94 0.20 0.00 -0.84 0.00 0.00 39.64 38.51 1ht2 n ILE 160 CO 0.00 0.00 0.00 -1.22 2.80 0.00 0.00 176.55 178.13 1ht2 n TYR 161 N -2.11 0.59 -4.79 9.51 4.01 -1.26 -4.92 117.16 118.19 1ht2 n TYR 161 Ca 0.04 -0.44 -0.26 0.00 -0.16 0.00 0.00 57.90 57.08 1ht2 n TYR 161 Cb 0.28 -0.01 -0.16 0.00 -0.31 0.00 0.00 39.34 39.14 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 -1.04 1.38 0.00 -0.72 2.01 -1.00 -1.33 115.64 114.94 1ht2 s THR 162 Ca 0.32 -0.68 0.00 0.00 0.31 0.00 0.00 61.69 61.64 1ht2 s THR 162 Cb 0.17 -1.19 0.00 0.00 0.01 0.00 0.00 72.50 71.49 1ht2 s THR 162 CO 0.22 0.40 0.00 -0.46 -0.69 0.00 0.00 174.62 174.09 1ht2 n ASN 163 N 3.25 0.71 -0.30 3.53 0.23 -1.26 -4.47 115.26 116.94 1ht2 n ASN 163 Ca -0.19 0.00 0.09 0.00 -0.53 0.00 0.00 54.58 53.96 1ht2 n ASN 163 Cb 0.53 0.00 0.17 0.00 -2.08 0.00 0.00 39.78 38.40 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 0.00 0.26 -3.13 -2.53 8.25 -1.26 -4.40 115.22 112.42 1ht2 n HIS 164 Ca 0.00 -0.95 -0.39 0.00 -0.26 0.00 0.00 57.72 56.11 1ht2 n HIS 164 Cb 0.00 -0.19 -0.05 0.00 1.12 0.00 0.00 29.99 30.87 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 -2.82 3.54 0.41 4.41 5.36 -1.26 -4.98 117.98 122.63 1ht2 s PHE 165 Ca 0.34 1.11 0.07 0.00 -0.96 0.00 0.00 56.93 57.50 1ht2 s PHE 165 Cb 0.29 -2.73 -0.05 0.00 -0.34 0.00 0.00 43.02 40.19 1ht2 s PHE 165 CO 0.05 0.08 0.17 -1.01 -1.46 0.00 0.00 175.22 173.05 1ht2 s HIS 166 N 0.87 2.61 -0.31 10.12 3.76 -1.26 -2.10 115.29 128.99 1ht2 s HIS 166 Ca 0.33 -0.57 0.05 0.00 -0.15 0.00 0.00 55.06 54.72 1ht2 s HIS 166 Cb -0.17 -1.93 0.18 0.00 1.11 0.00 0.00 32.58 31.78 1ht2 s HIS 166 CO 0.15 0.20 0.53 0.99 -0.85 0.00 0.00 174.74 175.77 1ht2 s THR 167 N -2.59 -0.87 -0.10 1.30 2.01 -0.90 -4.94 115.64 109.55 1ht2 s THR 167 Ca 0.41 -0.12 -0.04 0.00 0.31 0.00 0.00 61.69 62.24 1ht2 s THR 167 Cb 0.04 -0.88 -0.04 0.00 0.01 0.00 0.00 72.50 71.63 1ht2 s THR 167 CO 0.22 -0.11 0.07 -0.63 -0.69 0.00 0.00 174.62 173.49 1ht2 s ILE 168 N 2.59 4.93 -0.16 1.82 1.09 -1.26 -3.04 121.20 127.17 1ht2 s ILE 168 Ca 0.11 -0.03 -0.02 0.00 -1.10 0.00 0.00 60.65 59.61 1ht2 s ILE 168 Cb -0.10 -3.12 0.05 0.00 -1.06 0.00 0.00 42.46 38.23 1ht2 s ILE 168 CO -0.24 0.60 0.02 -1.61 -0.10 0.00 0.00 174.94 173.61 1ht2 s GLU 169 N -1.00 0.68 0.00 2.79 0.41 -0.82 -5.00 118.70 115.77 1ht2 s GLU 169 Ca 0.15 -0.29 0.00 0.00 -0.41 0.00 0.00 54.97 54.42 1ht2 s GLU 169 Cb -0.12 -1.82 0.00 0.00 -1.78 0.00 0.00 34.13 30.41 1ht2 s GLU 169 CO 0.04 -0.55 0.00 -1.91 -0.49 0.00 0.00 175.26 172.35 1ht2 n GLU 170 N 5.07 0.97 0.00 1.61 2.13 -1.26 -2.43 120.64 126.73 1ht2 n GLU 170 Ca -0.09 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.73 1ht2 n GLU 170 Cb 0.48 0.00 0.00 0.00 0.27 0.00 0.00 31.44 32.19 1ht2 n GLU 170 CO 0.00 0.00 0.00 -0.11 -0.41 0.00 0.00 177.13 176.61 1ht2 n LEU 171 N 0.00 0.00 -4.72 4.31 7.94 -1.00 -4.89 117.00 118.63 1ht2 n LEU 171 Ca 0.00 0.00 -0.30 0.00 -1.11 0.00 0.00 56.01 54.60 1ht2 n LEU 171 Cb 0.00 0.00 -0.07 0.00 0.53 0.00 0.00 43.42 43.88 1ht2 n LEU 171 CO 0.00 0.00 -0.30 -0.44 -1.11 0.00 0.00 177.39 175.54 1ht2 s SER 172 N 0.00 5.21 0.11 1.96 0.01 -1.26 -2.03 113.70 117.70 1ht2 s SER 172 Ca 0.00 -0.13 0.00 0.00 1.31 0.00 0.00 55.95 57.13 1ht2 s SER 172 Cb 0.00 -1.30 0.00 0.00 0.21 0.00 0.00 66.02 64.93 1ht2 s SER 172 CO 0.00 0.16 0.00 0.00 0.41 0.00 0.00 173.24 173.81 1ht2 n TYR 173 N 0.43 -2.88 -0.53 2.43 0.18 -1.09 -5.00 117.16 110.70 1ht2 n TYR 173 Ca -0.10 0.36 0.00 0.00 1.88 0.00 0.00 57.90 60.04 1ht2 n TYR 173 Cb 0.52 1.27 0.00 0.00 -0.38 0.00 0.00 39.34 40.75 1ht2 n TYR 173 CO 0.00 0.00 0.00 1.63 -2.08 0.00 0.00 176.86 176.41