#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 -0.30 -0.15 4.28 2.01 -1.26 -2.17 115.64 118.06 1ht1 s THR 2 Ca 0.00 0.29 -0.01 0.00 0.31 0.00 0.00 61.69 62.28 1ht1 s THR 2 Cb 0.00 -0.37 -0.01 0.00 0.01 0.00 0.00 72.50 72.13 1ht1 s THR 2 CO 0.00 0.12 -0.12 -0.63 -0.69 0.00 0.00 174.62 173.30 1ht1 s ILE 3 N 2.17 3.06 -0.09 1.82 -1.09 -0.66 -3.09 121.20 123.31 1ht1 s ILE 3 Ca 0.00 -0.65 0.01 0.00 -2.23 0.00 0.00 60.65 57.78 1ht1 s ILE 3 Cb -0.12 -2.30 0.02 0.00 -1.58 0.00 0.00 42.46 38.48 1ht1 s ILE 3 CO -0.07 0.51 -0.10 -0.69 -1.23 0.00 0.00 174.94 173.35 1ht1 s VAL 4 N 0.56 1.11 -0.07 2.92 1.01 0.41 -2.05 120.40 124.30 1ht1 s VAL 4 Ca -0.08 -0.40 0.05 0.00 0.00 0.00 0.00 61.98 61.55 1ht1 s VAL 4 Cb -0.16 -1.07 -0.00 0.00 0.00 0.00 0.00 36.38 35.15 1ht1 s VAL 4 CO 0.03 0.37 -0.22 -0.55 0.00 0.00 0.00 175.10 174.74 1ht1 s SER 5 N 1.20 2.73 0.26 3.32 0.15 -0.44 0.36 113.70 121.29 1ht1 s SER 5 Ca -0.04 -0.47 0.03 0.00 0.70 0.00 0.00 55.95 56.17 1ht1 s SER 5 Cb -0.14 -0.95 -0.05 0.00 -1.71 0.00 0.00 66.02 63.16 1ht1 s SER 5 CO -0.03 0.18 0.05 -0.69 1.20 0.00 0.00 173.24 173.95 1ht1 s VAL 6 N 0.12 0.90 -0.23 4.45 1.01 -0.95 -1.50 120.40 124.19 1ht1 s VAL 6 Ca -0.09 -2.01 -0.04 0.00 0.00 0.00 0.00 61.98 59.83 1ht1 s VAL 6 Cb -0.15 -2.55 0.12 0.00 0.00 0.00 0.00 36.38 33.80 1ht1 s VAL 6 CO 0.05 -0.14 0.42 -0.60 0.00 0.00 0.00 175.10 174.83 1ht1 s ARG 7 N -3.93 0.37 -0.18 2.72 3.52 -1.26 -1.36 118.95 118.83 1ht1 s ARG 7 Ca 0.34 0.79 -0.15 0.00 -0.13 0.00 0.00 55.73 56.58 1ht1 s ARG 7 Cb 0.07 -0.04 0.05 0.00 -1.56 0.00 0.00 34.95 33.47 1ht1 s ARG 7 CO 0.12 -0.48 0.46 0.50 -0.81 0.00 0.00 175.30 175.09 1ht1 s ARG 8 N 2.61 0.53 -1.05 5.12 3.52 0.89 -4.95 118.95 125.62 1ht1 s ARG 8 Ca 0.08 0.68 -0.16 0.00 -0.13 0.00 0.00 55.73 56.20 1ht1 s ARG 8 Cb -0.14 0.22 -0.01 0.00 -1.56 0.00 0.00 34.95 33.46 1ht1 s ARG 8 CO -0.15 -0.08 0.76 0.09 -0.81 0.00 0.00 175.30 175.11 1ht1 n ASN 9 N 3.07 -5.58 -3.78 -2.12 3.02 -1.26 -2.01 115.26 106.61 1ht1 n ASN 9 Ca -0.15 -0.90 -0.29 0.00 -0.03 0.00 0.00 54.58 53.21 1ht1 n ASN 9 Cb 0.57 -3.40 0.02 0.00 -0.61 0.00 0.00 39.78 36.35 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 -1.68 -0.50 2.92 7.41 0.00 -1.26 -4.82 105.19 107.26 1ht1 n GLY 10 Ca -0.11 0.18 -0.14 0.00 0.00 0.00 0.00 46.02 45.94 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 -3.24 -0.21 0.03 1.61 3.76 -0.85 -2.44 115.29 113.96 1ht1 s HIS 11 Ca 0.61 0.60 0.06 0.00 -0.15 0.00 0.00 55.06 56.18 1ht1 s HIS 11 Cb -0.31 -0.11 -0.02 0.00 1.11 0.00 0.00 32.58 33.25 1ht1 s HIS 11 CO 0.75 -0.22 -0.19 0.54 -0.85 0.00 0.00 174.74 174.77 1ht1 s VAL 12 N 1.58 1.49 0.21 -0.90 0.11 -0.97 -0.07 120.40 121.86 1ht1 s VAL 12 Ca -0.05 -1.06 -0.05 0.00 -2.93 0.00 0.00 61.98 57.89 1ht1 s VAL 12 Cb -0.12 -1.30 -0.03 0.00 -1.53 0.00 0.00 36.38 33.41 1ht1 s VAL 12 CO -0.06 0.20 0.25 0.68 -3.33 0.00 0.00 175.10 172.84 1ht1 s VAL 13 N -0.73 0.00 -0.09 2.04 -7.23 -0.47 -2.19 120.40 111.74 1ht1 s VAL 13 Ca 0.06 -1.79 -0.04 0.00 -1.81 0.00 0.00 61.98 58.40 1ht1 s VAL 13 Cb -0.08 -2.39 0.04 0.00 0.56 0.00 0.00 36.38 34.51 1ht1 s VAL 13 CO 0.01 -0.01 0.19 -0.63 -0.31 0.00 0.00 175.10 174.36 1ht1 s ILE 14 N -4.11 -0.11 0.09 -0.62 1.01 -1.03 -2.24 121.20 114.19 1ht1 s ILE 14 Ca 0.33 0.20 0.05 0.00 0.00 0.00 0.00 60.65 61.23 1ht1 s ILE 14 Cb 0.04 -0.32 -0.03 0.00 0.01 0.00 0.00 42.46 42.16 1ht1 s ILE 14 CO 0.11 0.08 -0.14 0.00 0.00 0.00 0.00 174.94 174.99 1ht1 s ALA 15 N 1.46 1.24 0.19 9.38 0.00 0.16 -1.96 121.76 132.22 1ht1 s ALA 15 Ca -0.07 -1.09 -0.12 0.00 0.00 0.00 0.00 51.96 50.68 1ht1 s ALA 15 Cb -0.11 -0.08 0.00 0.00 0.00 0.00 0.00 23.12 22.93 1ht1 s ALA 15 CO -0.07 0.13 0.39 0.20 0.00 0.00 0.00 175.76 176.41 1ht1 s GLY 16 N -1.99 0.36 0.55 0.00 0.00 -1.20 -0.44 107.32 104.59 1ht1 s GLY 16 Ca 0.01 -0.72 0.09 0.00 0.00 0.00 0.00 44.72 44.10 1ht1 s GLY 16 CO 0.02 -0.64 0.73 2.09 0.00 0.00 0.00 173.10 175.30 1ht1 n ASP 17 N -0.29 2.04 -0.31 1.64 5.75 -1.18 -2.21 116.55 121.99 1ht1 n ASP 17 Ca -0.06 -2.48 0.08 0.00 -0.01 0.00 0.00 54.79 52.32 1ht1 n ASP 17 Cb 0.63 -0.38 0.15 0.00 -1.03 0.00 0.00 41.12 40.49 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 -1.64 4.63 3.73 6.12 0.00 -0.96 -4.52 105.19 112.53 1ht1 n GLY 18 Ca 0.14 -1.13 -0.39 0.00 0.00 0.00 0.00 46.02 44.65 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 -2.76 4.39 -0.12 1.61 0.74 -1.26 -1.10 119.66 121.17 1ht1 s GLN 19 Ca 0.32 0.73 0.02 0.00 0.05 0.00 0.00 55.36 56.48 1ht1 s GLN 19 Cb 0.30 -3.43 -0.00 0.00 1.10 0.00 0.00 33.01 30.98 1ht1 s GLN 19 CO -0.01 0.15 -0.20 0.00 -0.55 0.00 0.00 175.29 174.68 1ht1 s ALA 20 N 0.57 2.35 0.11 1.58 0.00 -0.66 -4.62 121.76 121.07 1ht1 s ALA 20 Ca 0.33 -0.95 0.09 0.00 0.00 0.00 0.00 51.96 51.43 1ht1 s ALA 20 Cb -0.17 -0.98 -0.04 0.00 0.00 0.00 0.00 23.12 21.93 1ht1 s ALA 20 CO 0.16 0.24 -0.22 0.99 0.00 0.00 0.00 175.76 176.93 1ht1 s THR 21 N 0.40 2.58 -0.18 0.00 2.01 -1.26 -1.34 115.64 117.84 1ht1 s THR 21 Ca -0.15 -1.54 -0.04 0.00 0.31 0.00 0.00 61.69 60.27 1ht1 s THR 21 Cb -0.17 -2.15 0.06 0.00 0.01 0.00 0.00 72.50 70.26 1ht1 s THR 21 CO 0.07 0.15 0.07 -0.22 -0.69 0.00 0.00 174.62 174.00 1ht1 s LEU 22 N -1.95 0.71 0.00 4.42 0.20 -0.69 -4.89 118.68 116.48 1ht1 s LEU 22 Ca 0.16 -0.72 0.00 0.00 0.69 0.00 0.00 54.13 54.25 1ht1 s LEU 22 Cb -0.10 -0.39 0.00 0.00 -0.43 0.00 0.00 46.19 45.26 1ht1 s LEU 22 CO 0.07 -0.34 0.00 0.61 -0.29 0.00 0.00 176.35 176.41 1ht1 n GLY 23 N 5.18 2.21 0.35 7.98 0.00 -1.26 -2.00 105.19 117.65 1ht1 n GLY 23 Ca -0.08 0.03 0.08 0.00 0.00 0.00 0.00 46.02 46.06 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 10.34 2.53 -4.09 1.61 3.02 -1.26 -5.03 115.26 122.38 1ht1 n ASN 24 Ca 0.00 -3.24 -0.10 0.00 -0.03 0.00 0.00 54.58 51.22 1ht1 n ASN 24 Cb 0.00 -0.48 -0.11 0.00 -0.61 0.00 0.00 39.78 38.59 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 -2.94 0.43 -0.07 3.41 -4.23 -0.85 -5.13 115.64 106.26 1ht1 s THR 25 Ca 0.35 -1.53 -0.25 0.00 -1.18 0.00 0.00 61.69 59.09 1ht1 s THR 25 Cb 0.31 -1.14 -0.03 0.00 1.34 0.00 0.00 72.50 72.98 1ht1 s THR 25 CO 0.02 -0.73 0.78 -0.69 -0.54 0.00 0.00 174.62 173.46 1ht1 s VAL 26 N -2.80 4.99 -0.18 2.29 1.01 -1.26 -1.71 120.40 122.73 1ht1 s VAL 26 Ca 0.01 1.59 -0.24 0.00 0.00 0.00 0.00 61.98 63.34 1ht1 s VAL 26 Cb -0.00 -4.11 -0.22 0.00 0.00 0.00 0.00 36.38 32.05 1ht1 s VAL 26 CO -0.04 0.20 0.40 -0.03 0.00 0.00 0.00 175.10 175.63 1ht1 h MET 27 N 6.87 0.01 -4.02 2.72 4.05 -1.55 -3.48 114.93 119.52 1ht1 h MET 27 Ca -0.39 -0.01 -0.19 0.00 -0.28 0.00 0.00 59.70 58.83 1ht1 h MET 27 Cb 1.19 0.00 -0.22 0.00 -0.80 0.00 0.00 31.60 31.78 1ht1 h MET 27 CO 0.77 1.01 -0.71 0.21 0.23 0.00 0.00 176.91 178.42 1ht1 s LYS 28 N -2.32 0.31 0.00 0.39 2.20 -1.23 -5.02 119.74 114.07 1ht1 s LYS 28 Ca -0.25 -0.56 0.06 0.00 -0.36 0.00 0.00 55.97 54.85 1ht1 s LYS 28 Cb 0.03 0.05 0.04 0.00 -1.51 0.00 0.00 37.83 36.44 1ht1 s LYS 28 CO 0.63 -0.03 0.64 0.41 -0.36 0.00 0.00 175.35 176.64 1ht1 n GLY 29 N 1.74 -0.76 2.51 5.54 0.00 -1.25 -1.66 105.19 111.31 1ht1 n GLY 29 Ca -0.23 -0.17 -0.15 0.00 0.00 0.00 0.00 46.02 45.48 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 0.20 3.13 -4.69 1.61 2.04 -0.85 -4.21 115.26 112.48 1ht1 n ASN 30 Ca 0.03 -3.05 -0.42 0.00 -0.44 0.00 0.00 54.58 50.70 1ht1 n ASN 30 Cb 0.14 -0.46 -0.03 0.00 -2.53 0.00 0.00 39.78 36.91 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 -4.26 4.05 -0.32 3.53 1.01 -0.26 -4.95 120.40 119.20 1ht1 s VAL 31 Ca 0.38 1.40 -0.29 0.00 0.00 0.00 0.00 61.98 63.47 1ht1 s VAL 31 Cb 0.40 -3.90 0.00 0.00 0.00 0.00 0.00 36.38 32.88 1ht1 s VAL 31 CO -0.04 -0.01 1.31 -0.75 0.00 0.00 0.00 175.10 175.62 1ht1 s LYS 32 N 2.32 3.85 0.00 2.72 2.20 -1.26 -4.22 119.74 125.35 1ht1 s LYS 32 Ca 0.59 1.17 0.12 0.00 -0.36 0.00 0.00 55.97 57.49 1ht1 s LYS 32 Cb -0.27 -3.90 0.13 0.00 -1.51 0.00 0.00 37.83 32.28 1ht1 s LYS 32 CO 0.23 -1.20 0.94 1.63 -0.36 0.00 0.00 175.35 176.59 1ht1 n LYS 33 N 7.45 1.00 -3.80 4.03 5.02 -1.26 -4.91 118.16 125.70 1ht1 n LYS 33 Ca 0.15 -1.34 -0.27 0.00 -2.02 0.00 0.00 58.31 54.82 1ht1 n LYS 33 Cb 0.47 -1.23 -0.17 0.00 -0.02 0.00 0.00 35.03 34.08 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 -0.97 0.74 0.00 -0.18 1.01 -1.26 -0.94 120.40 118.80 1ht1 s VAL 34 Ca 0.15 -0.56 0.00 0.00 0.00 0.00 0.00 61.98 61.58 1ht1 s VAL 34 Cb 0.10 -1.11 0.00 0.00 0.00 0.00 0.00 36.38 35.38 1ht1 s VAL 34 CO 0.15 -0.06 0.00 -2.11 0.00 0.00 0.00 175.10 173.08 1ht1 n ARG 35 N 4.98 3.68 -4.17 2.72 1.85 -0.38 -4.90 116.66 120.44 1ht1 n ARG 35 Ca -0.10 0.00 -0.10 0.00 -1.00 0.00 0.00 57.85 56.65 1ht1 n ARG 35 Cb 0.47 0.00 -0.10 0.00 -1.05 0.00 0.00 32.46 31.78 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 2.41 0.87 0.16 2.89 1.81 -1.26 -3.27 118.95 122.56 1ht1 s ARG 36 Ca 0.00 -1.37 -0.01 0.00 -1.72 0.00 0.00 55.73 52.62 1ht1 s ARG 36 Cb 0.00 -0.09 0.01 0.00 -0.45 0.00 0.00 34.95 34.42 1ht1 s ARG 36 CO 0.00 -0.09 0.23 1.28 -0.68 0.00 0.00 175.30 176.04 1ht1 n LEU 37 N -0.07 0.00 -3.27 2.53 4.77 0.31 -4.91 117.00 116.37 1ht1 n LEU 37 Ca -0.10 -1.25 -0.15 0.00 -0.03 0.00 0.00 56.01 54.48 1ht1 n LEU 37 Cb 0.62 1.17 0.00 0.00 -2.33 0.00 0.00 43.42 42.88 1ht1 n LEU 37 CO 0.31 -0.30 -0.15 0.00 -1.33 0.00 0.00 177.39 175.92 1ht1 n TYR 38 N -0.25 -1.13 -3.83 -1.77 9.36 -1.26 -0.47 117.16 117.81 1ht1 n TYR 38 Ca -0.00 0.45 -0.37 0.00 3.32 0.00 0.00 57.90 61.30 1ht1 n TYR 38 Cb 0.26 -1.56 0.04 0.00 -0.63 0.00 0.00 39.34 37.45 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 -1.27 -4.92 -4.24 2.98 4.13 -1.26 -1.64 115.26 109.04 1ht1 n ASN 39 Ca -0.18 -1.12 -0.36 0.00 1.68 0.00 0.00 54.58 54.60 1ht1 n ASN 39 Cb 0.39 -2.74 -0.08 0.00 -1.54 0.00 0.00 39.78 35.82 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 -2.47 -0.83 -0.03 6.41 9.92 0.38 -4.74 116.55 125.20 1ht1 n ASP 40 Ca -0.10 -1.15 -0.02 0.00 -0.53 0.00 0.00 54.79 53.00 1ht1 n ASP 40 Cb 0.58 -1.45 -0.05 0.00 -0.64 0.00 0.00 41.12 39.55 1ht1 n ASP 40 CO 0.00 0.00 0.00 0.29 0.13 0.00 0.00 177.20 177.62 1ht1 n LYS 41 N -3.92 2.39 -4.12 -1.24 5.02 -0.65 -4.96 118.16 110.68 1ht1 n LYS 41 Ca -0.03 -0.02 -0.33 0.00 -2.02 0.00 0.00 58.31 55.91 1ht1 n LYS 41 Cb 0.49 -1.16 -0.16 0.00 -0.02 0.00 0.00 35.03 34.18 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 -2.22 2.35 0.34 -0.18 1.01 -1.05 -4.61 120.40 116.04 1ht1 s VAL 42 Ca -0.03 -0.84 0.01 0.00 0.00 0.00 0.00 61.98 61.11 1ht1 s VAL 42 Cb 0.02 -2.00 -0.03 0.00 0.00 0.00 0.00 36.38 34.37 1ht1 s VAL 42 CO 0.27 0.52 0.53 0.27 0.00 0.00 0.00 175.10 176.69 1ht1 s ILE 43 N 1.28 5.12 0.10 2.22 -4.36 -0.78 0.12 121.20 124.90 1ht1 s ILE 43 Ca 0.04 -0.50 -0.25 0.00 -0.26 0.00 0.00 60.65 59.67 1ht1 s ILE 43 Cb -0.13 -3.86 0.08 0.00 1.25 0.00 0.00 42.46 39.79 1ht1 s ILE 43 CO -0.10 -0.54 0.77 0.00 0.24 0.00 0.00 174.94 175.31 1ht1 s ALA 44 N -2.29 -1.66 0.23 2.27 0.00 -1.20 -1.23 121.76 117.87 1ht1 s ALA 44 Ca 0.39 0.59 -0.02 0.00 0.00 0.00 0.00 51.96 52.93 1ht1 s ALA 44 Cb -0.10 0.66 -0.03 0.00 0.00 0.00 0.00 23.12 23.65 1ht1 s ALA 44 CO 0.35 -0.79 0.22 0.20 0.00 0.00 0.00 175.76 175.74 1ht1 s GLY 45 N -2.68 1.43 -0.11 0.00 0.00 -0.14 -1.25 107.32 104.58 1ht1 s GLY 45 Ca 0.05 -1.62 -0.32 0.00 0.00 0.00 0.00 44.72 42.83 1ht1 s GLY 45 CO -0.08 -1.27 1.08 -0.11 0.00 0.00 0.00 173.10 172.72 1ht1 s PHE 46 N -3.98 -0.22 -0.21 1.90 -0.71 -0.11 -1.57 117.98 113.09 1ht1 s PHE 46 Ca 0.36 0.13 0.01 0.00 -1.04 0.00 0.00 56.93 56.39 1ht1 s PHE 46 Cb 0.05 0.53 0.04 0.00 -1.21 0.00 0.00 43.02 42.42 1ht1 s PHE 46 CO 0.14 -0.35 -0.13 0.00 -1.34 0.00 0.00 175.22 173.54 1ht1 s ALA 47 N -2.71 2.20 0.00 1.99 0.00 -1.16 -4.84 121.76 117.25 1ht1 s ALA 47 Ca 0.08 -1.33 0.00 0.00 0.00 0.00 0.00 51.96 50.71 1ht1 s ALA 47 Cb -0.01 -1.32 0.00 0.00 0.00 0.00 0.00 23.12 21.79 1ht1 s ALA 47 CO -0.06 -0.78 0.00 0.41 0.00 0.00 0.00 175.76 175.32 1ht1 n GLY 48 N 4.61 -0.16 3.76 0.00 0.00 -1.26 -2.40 105.19 109.74 1ht1 n GLY 48 Ca -0.16 -1.29 -0.41 0.00 0.00 0.00 0.00 46.02 44.16 1ht1 n GLY 48 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1ht1 s GLY 49 N 0.00 2.48 0.56 -0.02 0.00 -1.26 -4.85 107.32 104.22 1ht1 s GLY 49 Ca 0.00 1.59 0.36 0.00 0.00 0.00 0.00 44.72 46.67 1ht1 s GLY 49 CO 0.00 2.44 2.09 -0.84 0.00 0.00 0.00 173.10 176.79 1ht1 h THR 50 N 3.20 0.00 0.04 0.90 2.02 -1.99 -1.31 112.91 115.77 1ht1 h THR 50 Ca -0.49 -0.26 -0.33 0.00 0.77 0.00 0.00 66.41 66.10 1ht1 h THR 50 Cb 1.23 1.20 -0.04 0.00 -1.74 0.00 0.00 68.15 68.80 1ht1 h THR 50 CO 0.73 0.00 -1.85 0.00 0.37 0.00 0.00 175.52 174.77 1ht1 n ALA 51 N -2.04 0.95 -0.33 6.16 0.00 -1.26 -3.31 120.51 120.69 1ht1 n ALA 51 Ca -0.01 -0.68 0.18 0.00 0.00 0.00 0.00 53.44 52.94 1ht1 n ALA 51 Cb 0.19 -0.45 0.43 0.00 0.00 0.00 0.00 19.45 19.62 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 -0.51 0.58 0.00 0.00 3.45 -1.83 -0.70 116.42 117.41 1ht1 h ASP 52 Ca -0.45 0.09 0.00 0.00 0.43 0.00 0.00 57.03 57.10 1ht1 h ASP 52 Cb 1.68 -0.01 0.00 0.00 -0.56 0.00 0.00 39.33 40.44 1ht1 h ASP 52 CO -0.12 0.15 0.00 0.00 -1.57 0.00 0.00 179.24 177.70 1ht1 n ALA 53 N -2.41 -0.46 0.00 3.45 0.00 -0.53 -0.93 120.51 119.64 1ht1 n ALA 53 Ca 0.24 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.68 1ht1 n ALA 53 Cb 0.74 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.19 1ht1 n ALA 53 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1ht1 n PHE 54 N -1.89 0.00 -0.05 0.00 -0.00 -0.35 0.39 117.46 115.56 1ht1 n PHE 54 Ca 0.00 0.00 -0.09 0.00 -0.00 0.00 0.00 57.45 57.36 1ht1 n PHE 54 Cb 0.00 -0.03 -0.04 0.00 -0.00 0.00 0.00 39.48 39.40 1ht1 n PHE 54 CO 0.00 0.00 0.00 2.41 -0.00 0.00 0.00 176.76 179.17 1ht1 n THR 55 N -0.76 0.59 0.01 -2.13 -1.04 -0.73 -4.28 114.28 105.94 1ht1 n THR 55 Ca 0.00 -0.19 -0.09 0.00 -2.04 0.00 0.00 64.05 61.73 1ht1 n THR 55 Cb 0.07 -1.21 0.07 0.00 -1.82 0.00 0.00 70.33 67.44 1ht1 n THR 55 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 1ht1 h LEU 56 N -0.17 0.60 -0.60 -4.42 3.38 0.18 -2.33 115.31 111.95 1ht1 h LEU 56 Ca -0.25 -0.31 -0.15 0.00 0.09 0.00 0.00 57.88 57.26 1ht1 h LEU 56 Cb 1.31 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.87 1ht1 h LEU 56 CO -0.09 1.01 -0.69 -0.26 0.09 0.00 0.00 178.44 178.50 1ht1 h PHE 57 N 0.42 0.10 0.26 1.13 0.04 -1.03 -1.22 116.94 116.65 1ht1 h PHE 57 Ca 0.01 -0.05 -0.01 0.00 2.80 0.00 0.00 57.97 60.72 1ht1 h PHE 57 Cb 1.06 -0.02 0.00 0.00 2.20 0.00 0.00 35.95 39.19 1ht1 h PHE 57 CO 0.04 0.74 -0.12 0.93 -0.60 0.00 0.00 178.31 179.30 1ht1 h GLU 58 N 0.05 -0.33 -0.49 1.51 5.08 -1.73 -1.84 114.58 116.83 1ht1 h GLU 58 Ca -0.01 0.02 0.10 0.00 -1.00 0.00 0.00 59.36 58.47 1ht1 h GLU 58 Cb 1.22 0.08 -0.09 0.00 0.50 0.00 0.00 28.75 30.46 1ht1 h GLU 58 CO 0.10 0.02 -0.06 1.25 -1.00 0.00 0.00 179.01 179.31 1ht1 h LEU 59 N -0.77 -0.33 -0.88 1.33 5.85 -1.43 0.26 115.31 119.35 1ht1 h LEU 59 Ca -0.04 0.13 0.10 0.00 0.84 0.00 0.00 57.88 58.92 1ht1 h LEU 59 Cb 0.50 0.25 -0.08 0.00 0.37 0.00 0.00 40.66 41.71 1ht1 h LEU 59 CO 0.06 -0.12 0.52 0.15 -0.34 0.00 0.00 178.44 178.71 1ht1 h PHE 60 N 0.06 0.94 -0.61 1.25 3.57 -1.21 0.06 116.94 120.99 1ht1 h PHE 60 Ca 0.24 0.03 0.05 0.00 3.53 0.00 0.00 57.97 61.82 1ht1 h PHE 60 Cb 0.37 -0.29 -0.05 0.00 2.79 0.00 0.00 35.95 38.78 1ht1 h PHE 60 CO -0.36 0.38 0.34 0.93 -2.23 0.00 0.00 178.31 177.37 1ht1 h GLU 61 N 0.85 0.64 -0.22 1.11 5.08 -0.07 -1.81 114.58 120.16 1ht1 h GLU 61 Ca 0.43 -0.04 -0.12 0.00 -1.00 0.00 0.00 59.36 58.63 1ht1 h GLU 61 Cb 0.40 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.50 1ht1 h GLU 61 CO -0.25 0.42 -0.37 0.00 -1.00 0.00 0.00 179.01 177.80 1ht1 h ARG 62 N 0.66 0.48 0.00 2.33 3.08 -0.67 -2.73 114.38 117.53 1ht1 h ARG 62 Ca 0.27 -0.23 -0.01 0.00 0.07 0.00 0.00 59.98 60.08 1ht1 h ARG 62 Cb 0.13 -0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.17 1ht1 h ARG 62 CO -0.15 0.79 -0.05 0.87 -1.07 0.00 0.00 179.97 180.35 1ht1 h LYS 63 N 0.41 0.00 0.07 0.04 1.79 -0.20 -1.05 116.57 117.63 1ht1 h LYS 63 Ca 0.04 0.00 -0.22 0.00 -2.18 0.00 0.00 60.65 58.29 1ht1 h LYS 63 Cb 0.84 0.00 0.02 0.00 -1.58 0.00 0.00 32.23 31.51 1ht1 h LYS 63 CO 0.07 0.05 -0.89 -0.07 -1.08 0.00 0.00 179.45 177.52 1ht1 h LEU 64 N 0.00 0.66 -1.46 2.94 3.38 -1.13 -2.89 115.31 116.80 1ht1 h LEU 64 Ca -0.00 -0.83 0.00 0.00 0.09 0.00 0.00 57.88 57.14 1ht1 h LEU 64 Cb 0.12 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 40.66 1ht1 h LEU 64 CO 0.01 1.41 0.00 -0.33 0.09 0.00 0.00 178.44 179.62 1ht1 h GLU 65 N -0.01 0.00 -0.41 1.13 5.08 -1.08 0.27 114.58 119.55 1ht1 h GLU 65 Ca -0.13 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.23 1ht1 h GLU 65 Cb 1.62 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.87 1ht1 h GLU 65 CO 0.17 0.00 0.00 -1.33 -1.00 0.00 0.00 179.01 176.85 1ht1 n MET 66 N -2.47 2.41 -2.60 2.33 2.81 -0.50 -4.45 117.12 114.66 1ht1 n MET 66 Ca -0.00 -2.20 -0.01 0.00 -1.81 0.00 0.00 57.70 53.68 1ht1 n MET 66 Cb 0.13 -1.44 0.08 0.00 -0.71 0.00 0.00 33.22 31.27 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 1.24 -0.45 -2.25 2.03 8.25 0.77 -5.05 115.22 119.76 1ht1 n HIS 67 Ca 0.17 -1.78 -0.12 0.00 -0.26 0.00 0.00 57.72 55.74 1ht1 n HIS 67 Cb 0.54 0.67 0.01 0.00 1.12 0.00 0.00 29.99 32.33 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 -0.97 -0.62 0.00 -0.41 6.02 -0.25 -0.89 117.38 120.26 1ht1 n GLN 68 Ca -0.07 0.40 0.00 0.00 -0.01 0.00 0.00 57.00 57.33 1ht1 n GLN 68 Cb 0.85 -0.71 0.00 0.00 1.02 0.00 0.00 30.24 31.40 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 -0.36 0.00 3.58 1.08 0.00 -1.16 -4.81 105.19 103.52 1ht1 n GLY 69 Ca -0.06 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.82 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 -0.60 1.19 0.00 1.61 5.04 -0.07 -4.78 115.29 117.68 1ht1 s HIS 70 Ca 0.00 2.32 0.00 0.00 -1.54 0.00 0.00 55.06 55.84 1ht1 s HIS 70 Cb 0.00 -3.32 0.00 0.00 0.04 0.00 0.00 32.58 29.30 1ht1 s HIS 70 CO 0.00 -0.77 0.65 -0.11 -2.34 0.00 0.00 174.74 172.17 1ht1 n LEU 71 N 19.71 0.00 -0.18 8.88 -0.00 -1.26 -2.14 117.00 142.00 1ht1 n LEU 71 Ca 0.42 0.65 -0.05 0.00 -0.00 0.00 0.00 56.01 57.03 1ht1 n LEU 71 Cb 0.46 -0.29 -0.04 0.00 -0.00 0.00 0.00 43.42 43.54 1ht1 n LEU 71 CO 0.58 -0.29 0.37 0.52 -0.00 0.00 0.00 177.39 178.57 1ht1 n VAL 72 N -2.39 -0.30 0.00 1.96 0.31 -1.26 -0.67 118.33 115.98 1ht1 n VAL 72 Ca 0.00 1.54 -0.11 0.00 -0.01 0.00 0.00 64.34 65.76 1ht1 n VAL 72 Cb 0.00 -1.95 -0.05 0.00 -0.91 0.00 0.00 33.84 30.93 1ht1 n VAL 72 CO 0.00 0.00 0.00 0.11 -1.32 0.00 0.00 176.83 175.62 1ht1 h LYS 73 N 0.00 -0.41 -0.97 5.55 1.79 -1.81 0.85 116.57 121.56 1ht1 h LYS 73 Ca 0.07 0.03 0.13 0.00 -2.18 0.00 0.00 60.65 58.69 1ht1 h LYS 73 Cb 0.18 0.09 -0.09 0.00 -1.58 0.00 0.00 32.23 30.84 1ht1 h LYS 73 CO -0.41 -0.28 0.60 0.00 -1.08 0.00 0.00 179.45 178.28 1ht1 h ALA 74 N 0.32 1.47 -0.73 3.86 0.00 -1.05 0.83 119.26 123.95 1ht1 h ALA 74 Ca 0.09 0.03 -0.05 0.00 0.00 0.00 0.00 54.91 54.98 1ht1 h ALA 74 Cb 0.58 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.16 1ht1 h ALA 74 CO -0.37 0.16 0.26 0.00 0.00 0.00 0.00 179.25 179.31 1ht1 h ALA 75 N 1.54 1.08 -0.29 0.00 0.00 0.11 0.29 119.26 121.98 1ht1 h ALA 75 Ca 0.49 -0.20 -0.07 0.00 0.00 0.00 0.00 54.91 55.12 1ht1 h ALA 75 Cb 0.52 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 1ht1 h ALA 75 CO -0.28 0.64 -0.10 0.28 0.00 0.00 0.00 179.25 179.79 1ht1 h VAL 76 N 1.08 1.29 0.00 0.00 2.07 0.49 -2.59 116.25 118.58 1ht1 h VAL 76 Ca 0.24 -1.16 -0.05 0.00 0.82 0.00 0.00 66.70 66.55 1ht1 h VAL 76 Cb 0.25 1.43 -0.01 0.00 -1.52 0.00 0.00 31.29 31.45 1ht1 h VAL 76 CO -0.01 0.37 -0.23 -0.33 0.02 0.00 0.00 177.57 177.38 1ht1 h GLU 77 N 0.34 0.00 0.17 1.57 4.39 0.84 -2.95 114.58 118.93 1ht1 h GLU 77 Ca 0.07 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.76 1ht1 h GLU 77 Cb 0.60 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.25 1ht1 h GLU 77 CO 0.03 0.23 -0.08 1.25 -1.16 0.00 0.00 179.01 179.29 1ht1 h LEU 78 N 0.00 -0.19 -0.93 1.33 5.85 -0.16 -3.08 115.31 118.13 1ht1 h LEU 78 Ca -0.00 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1ht1 h LEU 78 Cb 0.56 0.05 0.00 0.00 0.37 0.00 0.00 40.66 41.64 1ht1 h LEU 78 CO 0.03 -0.07 0.39 0.00 -0.34 0.00 0.00 178.44 178.45 1ht1 h ALA 79 N -1.77 1.30 -0.34 1.25 0.00 -1.53 -2.24 119.26 115.93 1ht1 h ALA 79 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1ht1 h ALA 79 Cb 0.17 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.96 1ht1 h ALA 79 CO 0.04 -0.30 0.00 1.17 0.00 0.00 0.00 179.25 180.16 1ht1 n LYS 80 N -2.19 0.00 -0.28 0.00 4.81 -1.12 -3.37 118.16 116.02 1ht1 n LYS 80 Ca -0.01 0.44 0.06 0.00 -0.87 0.00 0.00 58.31 57.93 1ht1 n LYS 80 Cb 0.41 -1.27 0.20 0.00 0.02 0.00 0.00 35.03 34.39 1ht1 n LYS 80 CO 0.00 0.00 0.00 -0.44 1.17 0.00 0.00 177.40 178.13 1ht1 h ASP 81 N 0.00 0.46 -0.25 3.14 3.32 -1.43 -1.71 116.42 119.94 1ht1 h ASP 81 Ca 0.00 0.09 0.07 0.00 0.02 0.00 0.00 57.03 57.21 1ht1 h ASP 81 Cb 0.00 0.02 -0.01 0.00 0.22 0.00 0.00 39.33 39.56 1ht1 h ASP 81 CO 0.00 0.20 0.72 -0.25 -1.72 0.00 0.00 179.24 178.19 1ht1 h TRP 82 N 0.58 0.00 -0.00 4.55 7.01 -1.51 0.88 115.95 127.46 1ht1 h TRP 82 Ca 0.43 0.00 0.00 0.00 2.11 0.00 0.00 58.89 61.43 1ht1 h TRP 82 Cb 0.59 0.00 0.00 0.00 -2.10 0.00 0.00 29.16 27.65 1ht1 h TRP 82 CO -0.11 0.00 -0.01 2.89 -2.79 0.00 0.00 178.44 178.42 1ht1 n ARG 83 N -2.97 -0.08 -0.06 2.65 1.85 -0.66 -4.13 116.66 113.25 1ht1 n ARG 83 Ca 0.05 -0.62 -0.09 0.00 -1.00 0.00 0.00 57.85 56.19 1ht1 n ARG 83 Cb 0.82 -1.02 -0.03 0.00 -1.05 0.00 0.00 32.46 31.18 1ht1 n ARG 83 CO 0.00 0.00 0.00 2.41 -0.01 0.00 0.00 177.63 180.03 1ht1 n THR 84 N 0.07 1.35 -1.55 8.89 -1.04 0.27 -4.95 114.28 117.33 1ht1 n THR 84 Ca 0.02 0.13 -0.41 0.00 -2.04 0.00 0.00 64.05 61.75 1ht1 n THR 84 Cb 0.07 -2.05 -0.04 0.00 -1.82 0.00 0.00 70.33 66.49 1ht1 n THR 84 CO 0.00 0.00 0.00 -0.67 -0.64 0.00 0.00 175.07 173.76 1ht1 n ASP 85 N -4.11 2.51 -0.13 8.00 -0.08 0.69 -4.85 116.55 118.58 1ht1 n ASP 85 Ca -0.15 -0.06 -0.02 0.00 -1.51 0.00 0.00 54.79 53.05 1ht1 n ASP 85 Cb 0.43 -1.48 -0.01 0.00 2.34 0.00 0.00 41.12 42.40 1ht1 n ASP 85 CO 0.00 0.00 0.00 0.54 0.12 0.00 0.00 177.20 177.86 1ht1 n ARG 86 N 8.76 -0.11 0.13 -0.67 1.74 -1.26 -1.07 116.66 124.17 1ht1 n ARG 86 Ca 0.37 0.48 -0.05 0.00 -0.77 0.00 0.00 57.85 57.88 1ht1 n ARG 86 Cb 0.43 -0.71 -0.02 0.00 -1.02 0.00 0.00 32.46 31.13 1ht1 n ARG 86 CO 0.00 0.00 0.00 0.52 -1.52 0.00 0.00 177.63 176.63 1ht1 h MET 87 N 0.00 -0.32 -1.16 5.56 2.86 -1.97 -3.14 114.93 116.75 1ht1 h MET 87 Ca 0.07 0.02 0.34 0.00 -2.06 0.00 0.00 59.70 58.07 1ht1 h MET 87 Cb 0.15 0.07 -0.05 0.00 0.06 0.00 0.00 31.60 31.84 1ht1 h MET 87 CO -0.30 -0.21 1.22 1.25 1.06 0.00 0.00 176.91 179.93 1ht1 h LEU 88 N -0.43 0.00 0.08 1.22 5.85 -1.53 -1.67 115.31 118.83 1ht1 h LEU 88 Ca -0.03 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.69 1ht1 h LEU 88 Cb 0.26 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.28 1ht1 h LEU 88 CO 0.06 0.00 -0.08 0.03 -0.34 0.00 0.00 178.44 178.11 1ht1 h ARG 89 N 0.00 -0.17 0.00 1.25 3.08 -1.05 -2.70 114.38 114.79 1ht1 h ARG 89 Ca 0.55 0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.61 1ht1 h ARG 89 Cb 3.00 0.04 0.00 0.00 0.08 0.00 0.00 29.97 33.08 1ht1 h ARG 89 CO -0.01 -0.11 0.31 0.87 -1.07 0.00 0.00 179.97 179.96 1ht1 h LYS 90 N -0.17 0.00 -6.47 0.04 6.56 -1.45 -3.41 116.57 111.66 1ht1 h LYS 90 Ca 0.00 0.00 -0.53 0.00 -1.06 0.00 0.00 60.65 59.06 1ht1 h LYS 90 Cb 0.17 0.00 0.03 0.00 -0.57 0.00 0.00 32.23 31.86 1ht1 h LYS 90 CO -0.02 0.00 1.05 -0.51 -2.06 0.00 0.00 179.45 177.90 1ht1 s LEU 91 N -5.16 4.38 -0.09 2.94 1.43 -1.02 -4.99 118.68 116.16 1ht1 s LEU 91 Ca -0.03 2.60 0.02 0.00 -1.03 0.00 0.00 54.13 55.69 1ht1 s LEU 91 Cb 0.07 -3.56 -0.02 0.00 0.03 0.00 0.00 46.19 42.71 1ht1 s LEU 91 CO 0.22 -0.93 -0.16 -1.61 0.23 0.00 0.00 176.35 174.09 1ht1 s GLU 92 N 2.69 2.96 0.00 1.70 2.02 -1.26 -4.85 118.70 121.96 1ht1 s GLU 92 Ca 0.77 -0.74 0.00 0.00 0.02 0.00 0.00 54.97 55.02 1ht1 s GLU 92 Cb -0.42 -2.46 0.00 0.00 0.10 0.00 0.00 34.13 31.35 1ht1 s GLU 92 CO 0.34 0.36 0.00 0.00 0.02 0.00 0.00 175.26 175.98 1ht1 n ALA 93 N 3.07 0.00 -3.46 5.21 0.00 -1.26 -4.24 120.51 119.82 1ht1 n ALA 93 Ca -0.18 0.00 -0.25 0.00 0.00 0.00 0.00 53.44 53.01 1ht1 n ALA 93 Cb 0.52 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.85 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 0.49 0.09 0.00 1.43 -1.01 -4.13 118.68 115.55 1ht1 s LEU 94 Ca 0.00 -1.59 -0.29 0.00 -1.03 0.00 0.00 54.13 51.23 1ht1 s LEU 94 Cb 0.00 -0.10 -0.06 0.00 0.03 0.00 0.00 46.19 46.06 1ht1 s LEU 94 CO 0.00 -0.36 0.91 -0.76 0.23 0.00 0.00 176.35 176.37 1ht1 s LEU 95 N 1.66 4.49 -0.16 1.79 1.02 -1.06 -2.96 118.68 123.46 1ht1 s LEU 95 Ca 0.14 1.70 0.01 0.00 0.02 0.00 0.00 54.13 55.99 1ht1 s LEU 95 Cb -0.18 -3.49 0.00 0.00 0.02 0.00 0.00 46.19 42.54 1ht1 s LEU 95 CO -0.17 -0.04 -0.17 0.00 0.02 0.00 0.00 176.35 175.99 1ht1 s ALA 96 N -0.04 2.44 0.00 4.21 0.00 -0.61 -0.85 121.76 126.91 1ht1 s ALA 96 Ca 0.44 -1.08 0.01 0.00 0.00 0.00 0.00 51.96 51.34 1ht1 s ALA 96 Cb -0.23 -1.19 -0.00 0.00 0.00 0.00 0.00 23.12 21.70 1ht1 s ALA 96 CO 0.28 -0.08 -0.03 0.54 0.00 0.00 0.00 175.76 176.47 1ht1 s VAL 97 N 0.89 0.23 -0.15 0.00 0.11 -0.16 -0.97 120.40 120.35 1ht1 s VAL 97 Ca -0.04 -0.19 -0.11 0.00 -2.93 0.00 0.00 61.98 58.70 1ht1 s VAL 97 Cb -0.15 -0.21 0.05 0.00 -1.53 0.00 0.00 36.38 34.53 1ht1 s VAL 97 CO -0.02 0.02 0.39 0.00 -3.33 0.00 0.00 175.10 172.16 1ht1 s ALA 98 N -0.18 -0.96 0.15 1.54 0.00 -0.37 -0.19 121.76 121.75 1ht1 s ALA 98 Ca -0.00 1.24 0.01 0.00 0.00 0.00 0.00 51.96 53.20 1ht1 s ALA 98 Cb -0.02 -0.74 -0.00 0.00 0.00 0.00 0.00 23.12 22.36 1ht1 s ALA 98 CO -0.00 -0.21 0.02 -0.40 0.00 0.00 0.00 175.76 175.17 1ht1 n ASP 99 N 3.45 1.82 0.14 0.00 5.75 -0.29 -1.86 116.55 125.56 1ht1 n ASP 99 Ca -0.18 -1.70 0.03 0.00 -0.01 0.00 0.00 54.79 52.94 1ht1 n ASP 99 Cb 0.56 0.21 0.41 0.00 -1.03 0.00 0.00 41.12 41.28 1ht1 n ASP 99 CO 0.00 0.00 0.00 1.05 -0.11 0.00 0.00 177.20 178.14 1ht1 h GLU 100 N 0.00 0.18 0.00 0.11 4.11 -1.97 -3.20 114.58 113.81 1ht1 h GLU 100 Ca -0.12 -0.04 0.00 0.00 0.07 0.00 0.00 59.36 59.27 1ht1 h GLU 100 Cb 0.40 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.62 1ht1 h GLU 100 CO 0.19 0.33 0.00 2.41 0.07 0.00 0.00 179.01 182.02 1ht1 n THR 101 N -4.28 0.00 -3.49 -1.06 -1.04 -1.26 -5.00 114.28 98.14 1ht1 n THR 101 Ca -0.01 1.39 -0.04 0.00 -2.04 0.00 0.00 64.05 63.35 1ht1 n THR 101 Cb 0.26 -2.39 0.00 0.00 -1.82 0.00 0.00 70.33 66.39 1ht1 n THR 101 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1ht1 n ALA 102 N -1.73 -0.48 -2.81 2.41 0.00 -1.21 -5.17 120.51 111.52 1ht1 n ALA 102 Ca 0.00 -0.56 -0.14 0.00 0.00 0.00 0.00 53.44 52.73 1ht1 n ALA 102 Cb 0.00 0.45 -0.13 0.00 0.00 0.00 0.00 19.45 19.78 1ht1 n ALA 102 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1ht1 s SER 103 N -1.84 0.82 0.13 0.00 1.04 -1.26 -1.14 113.70 111.44 1ht1 s SER 103 Ca 0.08 -0.39 -0.25 0.00 0.48 0.00 0.00 55.95 55.88 1ht1 s SER 103 Cb -0.01 -0.01 0.07 0.00 0.10 0.00 0.00 66.02 66.17 1ht1 s SER 103 CO 0.06 -0.10 0.76 -1.48 0.98 0.00 0.00 173.24 173.47 1ht1 s LEU 104 N -1.05 -0.40 0.14 2.42 2.34 0.73 -4.64 118.68 118.23 1ht1 s LEU 104 Ca -0.05 -0.15 -0.01 0.00 0.06 0.00 0.00 54.13 53.98 1ht1 s LEU 104 Cb -0.07 2.37 -0.04 0.00 -0.56 0.00 0.00 46.19 47.89 1ht1 s LEU 104 CO 0.00 -0.91 0.31 -0.63 -1.06 0.00 0.00 176.35 174.06 1ht1 s ILE 105 N -3.51 5.28 -0.06 1.48 1.01 -0.46 -0.99 121.20 123.95 1ht1 s ILE 105 Ca 0.05 -0.37 -0.01 0.00 0.00 0.00 0.00 60.65 60.33 1ht1 s ILE 105 Cb -0.02 -3.68 0.03 0.00 0.01 0.00 0.00 42.46 38.79 1ht1 s ILE 105 CO -0.06 -0.02 -0.01 -0.63 0.00 0.00 0.00 174.94 174.21 1ht1 s ILE 106 N -1.70 0.39 0.14 2.92 1.01 -0.03 -1.68 121.20 122.25 1ht1 s ILE 106 Ca 0.37 0.06 0.07 0.00 0.00 0.00 0.00 60.65 61.15 1ht1 s ILE 106 Cb -0.12 -0.50 -0.04 0.00 0.01 0.00 0.00 42.46 41.81 1ht1 s ILE 106 CO 0.28 0.24 -0.04 0.42 0.00 0.00 0.00 174.94 175.84 1ht1 s THR 107 N 1.59 3.63 0.59 2.92 -4.23 -1.15 -2.57 115.64 116.42 1ht1 s THR 107 Ca -0.01 -1.32 0.30 0.00 -1.18 0.00 0.00 61.69 59.48 1ht1 s THR 107 Cb -0.13 -2.77 0.42 0.00 1.34 0.00 0.00 72.50 71.36 1ht1 s THR 107 CO -0.03 -0.01 1.63 1.23 -0.54 0.00 0.00 174.62 176.90 1ht1 h GLY 108 N 3.10 0.00 2.00 3.99 0.00 -1.89 0.91 103.07 111.19 1ht1 h GLY 108 Ca -0.48 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.85 1ht1 h GLY 108 CO 0.56 0.00 0.00 0.70 0.00 0.00 0.00 176.54 177.80 1ht1 n ASN 109 N -3.56 0.47 0.00 0.19 5.03 -1.26 -4.24 115.26 111.89 1ht1 n ASN 109 Ca 0.17 0.66 0.00 0.00 0.87 0.00 0.00 54.58 56.29 1ht1 n ASN 109 Cb 1.13 -0.74 0.00 0.00 -1.02 0.00 0.00 39.78 39.15 1ht1 n ASN 109 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1ht1 n GLY 110 N -0.68 0.61 3.77 7.41 0.00 0.32 -4.89 105.19 111.73 1ht1 n GLY 110 Ca 0.01 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.66 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 -2.99 6.18 -0.28 1.61 -0.00 -1.24 -4.57 116.67 115.39 1ht1 s ASP 111 Ca 0.00 2.24 0.02 0.00 -0.00 0.00 0.00 52.55 54.81 1ht1 s ASP 111 Cb 0.00 -2.60 0.07 0.00 -0.00 0.00 0.00 42.92 40.40 1ht1 s ASP 111 CO 0.00 -0.91 -0.02 -0.69 -0.00 0.00 0.00 175.17 173.55 1ht1 s VAL 112 N -1.61 1.78 -0.13 -1.27 1.01 -1.26 -2.93 120.40 115.99 1ht1 s VAL 112 Ca 0.64 -1.62 -0.01 0.00 0.00 0.00 0.00 61.98 60.99 1ht1 s VAL 112 Cb -0.27 -2.11 -0.02 0.00 0.00 0.00 0.00 36.38 33.98 1ht1 s VAL 112 CO 0.32 -0.28 -0.09 -0.69 0.00 0.00 0.00 175.10 174.35 1ht1 s VAL 113 N 1.23 3.40 -0.38 2.92 1.01 -0.67 -4.97 120.40 122.94 1ht1 s VAL 113 Ca -0.00 -0.54 -0.06 0.00 0.00 0.00 0.00 61.98 61.38 1ht1 s VAL 113 Cb -0.19 -2.45 0.07 0.00 0.00 0.00 0.00 36.38 33.81 1ht1 s VAL 113 CO -0.09 0.52 0.16 -1.58 0.00 0.00 0.00 175.10 174.12 1ht1 s GLN 114 N 0.27 2.46 0.49 2.72 0.74 -1.26 -1.35 119.66 123.72 1ht1 s GLN 114 Ca -0.07 -1.42 -0.22 0.00 0.05 0.00 0.00 55.36 53.70 1ht1 s GLN 114 Cb -0.15 -3.55 -0.07 0.00 1.10 0.00 0.00 33.01 30.34 1ht1 s GLN 114 CO 0.04 -0.84 1.16 -1.25 -0.55 0.00 0.00 175.29 173.85 1ht1 s PRO 115 N 1.33 3.58 0.00 1.67 0.04 -1.26 -4.91 135.00 135.45 1ht1 s PRO 115 Ca 0.01 1.73 0.00 0.00 0.04 0.00 0.00 61.00 62.78 1ht1 s PRO 115 Cb -0.21 -2.25 0.00 0.00 0.04 0.00 0.00 34.50 32.07 1ht1 s PRO 115 CO 0.00 -0.69 0.00 0.39 0.04 0.00 0.00 177.00 176.75 1ht1 n GLU 116 N -0.81 0.00 -2.67 4.56 4.71 -1.26 -0.78 120.64 124.38 1ht1 n GLU 116 Ca 0.09 0.00 -0.07 0.00 -0.01 0.00 0.00 57.16 57.17 1ht1 n GLU 116 Cb 0.49 0.00 0.04 0.00 -1.01 0.00 0.00 31.44 30.96 1ht1 n GLU 116 CO 0.00 0.00 0.00 0.09 0.09 0.00 0.00 177.13 177.31 1ht1 n ASN 117 N -3.74 2.13 0.00 1.62 3.02 -1.26 -4.88 115.26 112.15 1ht1 n ASN 117 Ca 0.00 -2.51 0.00 0.00 -0.03 0.00 0.00 54.58 52.04 1ht1 n ASN 117 Cb 0.00 -0.47 0.00 0.00 -0.61 0.00 0.00 39.78 38.70 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 -0.47 -4.42 -4.69 6.41 8.00 0.04 -4.64 116.55 116.78 1ht1 n ASP 118 Ca 0.14 0.00 -0.42 0.00 0.71 0.00 0.00 54.79 55.22 1ht1 n ASP 118 Cb 0.82 -2.98 -0.03 0.00 -0.02 0.00 0.00 41.12 38.91 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 0.00 4.28 -0.02 0.64 2.96 -1.26 -4.33 118.68 120.95 1ht1 s LEU 119 Ca 0.00 1.66 0.04 0.00 -0.22 0.00 0.00 54.13 55.62 1ht1 s LEU 119 Cb 0.00 -3.56 -0.01 0.00 0.50 0.00 0.00 46.19 43.12 1ht1 s LEU 119 CO 0.00 -0.48 -0.14 -0.63 -1.32 0.00 0.00 176.35 173.78 1ht1 s ILE 120 N 1.93 1.14 -0.42 6.68 1.01 -0.56 -4.60 121.20 126.39 1ht1 s ILE 120 Ca 0.52 -0.61 0.06 0.00 0.00 0.00 0.00 60.65 60.63 1ht1 s ILE 120 Cb -0.21 -0.96 0.17 0.00 0.01 0.00 0.00 42.46 41.47 1ht1 s ILE 120 CO 0.21 0.33 0.57 0.00 0.00 0.00 0.00 174.94 176.04 1ht1 s ALA 121 N -0.24 -1.69 0.30 9.38 0.00 -1.25 -1.32 121.76 126.94 1ht1 s ALA 121 Ca 0.04 -0.29 0.07 0.00 0.00 0.00 0.00 51.96 51.78 1ht1 s ALA 121 Cb -0.07 -2.51 -0.03 0.00 0.00 0.00 0.00 23.12 20.51 1ht1 s ALA 121 CO -0.00 -2.20 0.28 0.96 0.00 0.00 0.00 175.76 174.80 1ht1 s ILE 122 N 1.53 4.00 0.00 0.00 -4.36 -0.87 -4.29 121.20 117.22 1ht1 s ILE 122 Ca 0.19 -1.32 0.00 0.00 -0.26 0.00 0.00 60.65 59.26 1ht1 s ILE 122 Cb -0.06 -3.32 0.00 0.00 1.25 0.00 0.00 42.46 40.33 1ht1 s ILE 122 CO -0.06 -0.24 0.00 0.61 0.24 0.00 0.00 174.94 175.49 1ht1 n GLY 123 N -1.34 1.94 0.38 6.27 0.00 -1.26 -1.65 105.19 109.53 1ht1 n GLY 123 Ca -0.04 -1.87 0.18 0.00 0.00 0.00 0.00 46.02 44.29 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 0.01 1.61 4.64 -1.90 1.04 113.55 118.95 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 -0.39 0.61 -0.87 0.00 0.00 176.83 176.18 1ht1 n GLY 125 N -1.42 0.08 0.14 -0.77 0.00 -0.92 -4.66 105.19 97.63 1ht1 n GLY 125 Ca 0.05 -0.62 -0.04 0.00 0.00 0.00 0.00 46.02 45.42 1ht1 n GLY 125 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ht1 n GLY 126 N 1.40 -2.81 0.37 -0.02 0.00 0.36 -1.65 105.19 102.83 1ht1 n GLY 126 Ca 0.10 0.76 0.08 0.00 0.00 0.00 0.00 46.02 46.97 1ht1 n GLY 126 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1ht1 h PRO 127 N 0.00 0.87 -0.51 1.61 0.11 -1.77 0.16 132.00 132.47 1ht1 h PRO 127 Ca 0.05 -0.05 -0.07 0.00 0.11 0.00 0.00 66.00 66.04 1ht1 h PRO 127 Cb 0.14 -0.20 -0.02 0.00 0.11 0.00 0.00 31.00 31.03 1ht1 h PRO 127 CO -0.32 0.57 0.02 1.88 -0.21 0.00 0.00 178.00 179.95 1ht1 h TYR 128 N 0.89 0.89 -0.06 0.65 0.05 -1.67 -0.02 116.97 117.70 1ht1 h TYR 128 Ca 0.45 -0.12 -0.01 0.00 0.05 0.00 0.00 58.73 59.10 1ht1 h TYR 128 Cb 0.48 -0.24 -0.00 0.00 1.01 0.00 0.00 36.73 37.98 1ht1 h TYR 128 CO -0.00 0.80 0.00 0.00 -1.05 0.00 0.00 178.16 177.91 1ht1 h ALA 129 N 1.24 0.08 -0.22 3.88 0.00 -0.23 -2.11 119.26 121.90 1ht1 h ALA 129 Ca 0.15 -0.16 0.06 0.00 0.00 0.00 0.00 54.91 54.96 1ht1 h ALA 129 Cb 0.44 -0.02 -0.07 0.00 0.00 0.00 0.00 17.79 18.13 1ht1 h ALA 129 CO 0.02 -0.26 -0.32 0.37 0.00 0.00 0.00 179.25 179.06 1ht1 h GLN 130 N -0.16 -0.33 -0.36 0.00 4.15 -0.27 0.41 115.11 118.54 1ht1 h GLN 130 Ca 0.02 0.02 0.07 0.00 0.77 0.00 0.00 58.65 59.53 1ht1 h GLN 130 Cb 0.31 0.08 -0.07 0.00 0.21 0.00 0.00 27.48 28.00 1ht1 h GLN 130 CO 0.00 -0.22 -0.10 0.00 -1.93 0.00 0.00 178.83 176.58 1ht1 h ALA 131 N 0.53 0.23 -0.32 3.38 0.00 -0.90 0.52 119.26 122.69 1ht1 h ALA 131 Ca 0.12 0.14 -0.11 0.00 0.00 0.00 0.00 54.91 55.06 1ht1 h ALA 131 Cb 0.54 0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.61 1ht1 h ALA 131 CO -0.41 -0.47 -0.26 0.00 0.00 0.00 0.00 179.25 178.11 1ht1 h ALA 132 N 1.34 0.96 0.23 0.00 0.00 -0.82 -0.97 119.26 120.01 1ht1 h ALA 132 Ca 0.18 -0.37 -0.01 0.00 0.00 0.00 0.00 54.91 54.70 1ht1 h ALA 132 Cb 0.28 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.94 1ht1 h ALA 132 CO -0.38 0.61 -0.11 0.00 0.00 0.00 0.00 179.25 179.36 1ht1 h ALA 133 N 1.16 -0.31 -0.49 0.00 0.00 0.95 -1.78 119.26 118.78 1ht1 h ALA 133 Ca 0.08 -0.16 0.09 0.00 0.00 0.00 0.00 54.91 54.91 1ht1 h ALA 133 Cb 0.73 0.12 -0.07 0.00 0.00 0.00 0.00 17.79 18.57 1ht1 h ALA 133 CO 0.06 -0.54 0.06 -0.09 0.00 0.00 0.00 179.25 178.73 1ht1 h ARG 134 N -0.58 0.18 -0.08 0.00 9.65 0.04 0.11 114.38 123.69 1ht1 h ARG 134 Ca -0.03 -0.01 0.03 0.00 -1.10 0.00 0.00 59.98 58.87 1ht1 h ARG 134 Cb 0.43 -0.04 -0.06 0.00 -1.39 0.00 0.00 29.97 28.90 1ht1 h ARG 134 CO 0.05 0.12 -0.47 0.00 2.80 0.00 0.00 179.97 182.47 1ht1 h ALA 135 N 1.40 -0.75 -0.26 2.80 0.00 -0.98 -2.12 119.26 119.36 1ht1 h ALA 135 Ca 0.25 -0.04 0.02 0.00 0.00 0.00 0.00 54.91 55.13 1ht1 h ALA 135 Cb 0.35 0.86 -0.02 0.00 0.00 0.00 0.00 17.79 18.98 1ht1 h ALA 135 CO -0.36 -1.01 0.13 -0.07 0.00 0.00 0.00 179.25 177.94 1ht1 h LEU 136 N -0.57 0.19 -2.85 0.00 4.07 -0.68 -2.35 115.31 113.13 1ht1 h LEU 136 Ca 0.05 0.01 0.00 0.00 0.08 0.00 0.00 57.88 58.02 1ht1 h LEU 136 Cb 0.67 -0.03 -0.00 0.00 1.08 0.00 0.00 40.66 42.38 1ht1 h LEU 136 CO -0.38 0.15 0.03 0.25 -1.08 0.00 0.00 178.44 177.40 1ht1 h LEU 137 N 0.27 0.00 0.00 1.67 5.85 -0.50 -1.93 115.31 120.67 1ht1 h LEU 137 Ca 0.10 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.82 1ht1 h LEU 137 Cb 0.03 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.06 1ht1 h LEU 137 CO -0.07 0.00 -0.66 -0.62 -0.34 0.00 0.00 178.44 176.75 1ht1 n GLU 138 N -3.16 2.54 -0.25 1.25 1.02 -0.82 -4.63 120.64 116.58 1ht1 n GLU 138 Ca -0.03 -0.00 0.03 0.00 -0.02 0.00 0.00 57.16 57.14 1ht1 n GLU 138 Cb 0.10 -1.13 0.04 0.00 -0.02 0.00 0.00 31.44 30.43 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 -1.34 0.89 -3.53 1.62 3.02 -0.92 -5.08 115.26 109.92 1ht1 n ASN 139 Ca 0.02 -2.18 -0.14 0.00 -0.03 0.00 0.00 54.58 52.26 1ht1 n ASN 139 Cb 0.21 -0.22 -0.04 0.00 -0.61 0.00 0.00 39.78 39.12 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 -0.95 0.02 -1.74 3.41 -4.23 -0.76 -5.01 115.64 106.39 1ht1 s THR 140 Ca 0.09 -0.16 0.10 0.00 -1.18 0.00 0.00 61.69 60.54 1ht1 s THR 140 Cb 0.08 -1.00 0.32 0.00 1.34 0.00 0.00 72.50 73.25 1ht1 s THR 140 CO 0.01 -0.09 1.22 -0.62 -0.54 0.00 0.00 174.62 174.60 1ht1 n GLU 141 N 0.24 2.00 -0.76 3.99 -0.58 -1.26 -4.71 120.64 119.56 1ht1 n GLU 141 Ca -0.18 -1.29 -0.32 0.00 -0.42 0.00 0.00 57.16 54.95 1ht1 n GLU 141 Cb 0.61 -1.38 0.14 0.00 -0.57 0.00 0.00 31.44 30.23 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 0.47 0.00 -4.87 -4.62 4.77 -1.26 -4.99 117.00 106.50 1ht1 n LEU 142 Ca 0.12 0.29 -0.31 0.00 -0.03 0.00 0.00 56.01 56.08 1ht1 n LEU 142 Cb 0.37 -1.22 -0.04 0.00 -2.33 0.00 0.00 43.42 40.20 1ht1 n LEU 142 CO 0.09 -3.39 0.37 -0.94 -1.33 0.00 0.00 177.39 172.20 1ht1 s SER 143 N -2.09 6.57 0.29 -1.43 1.04 -1.26 -4.89 113.70 111.93 1ht1 s SER 143 Ca 0.58 1.07 0.03 0.00 0.48 0.00 0.00 55.95 58.11 1ht1 s SER 143 Cb -0.21 -2.29 0.75 0.00 0.10 0.00 0.00 66.02 64.37 1ht1 s SER 143 CO 0.66 -0.29 1.64 0.00 0.98 0.00 0.00 173.24 176.23 1ht1 h ALA 144 N 1.68 1.32 -0.06 5.32 0.00 -1.87 0.14 119.26 125.77 1ht1 h ALA 144 Ca -0.47 0.24 -0.02 0.00 0.00 0.00 0.00 54.91 54.66 1ht1 h ALA 144 Cb 1.18 0.34 -0.00 0.00 0.00 0.00 0.00 17.79 19.31 1ht1 h ALA 144 CO 0.65 -0.50 -0.02 -0.09 0.00 0.00 0.00 179.25 179.29 1ht1 h ARG 145 N 0.18 0.12 -0.51 0.00 2.43 -1.93 -2.74 114.38 111.94 1ht1 h ARG 145 Ca 0.57 -0.05 0.10 0.00 -0.81 0.00 0.00 59.98 59.79 1ht1 h ARG 145 Cb 1.18 -0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 30.70 1ht1 h ARG 145 CO -0.69 0.49 0.35 0.93 -1.51 0.00 0.00 179.97 179.54 1ht1 h GLU 146 N -0.25 0.24 0.15 0.20 5.08 -1.23 -1.78 114.58 117.00 1ht1 h GLU 146 Ca 0.01 -0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.35 1ht1 h GLU 146 Cb 0.45 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.65 1ht1 h GLU 146 CO 0.01 0.16 -0.07 0.82 -1.00 0.00 0.00 179.01 178.93 1ht1 h ILE 147 N 0.25 0.00 -0.86 3.13 1.08 -0.72 -1.33 117.51 119.06 1ht1 h ILE 147 Ca 0.24 -0.03 0.22 0.00 -0.39 0.00 0.00 64.86 64.90 1ht1 h ILE 147 Cb 0.61 0.00 -0.14 0.00 -3.07 0.00 0.00 36.82 34.22 1ht1 h ILE 147 CO -0.05 0.00 0.20 0.00 -0.69 0.00 0.00 178.15 177.61 1ht1 h ALA 148 N -1.88 1.18 0.01 1.87 0.00 -1.35 0.99 119.26 120.09 1ht1 h ALA 148 Ca -0.02 0.22 -0.00 0.00 0.00 0.00 0.00 54.91 55.11 1ht1 h ALA 148 Cb 0.15 0.33 -0.00 0.00 0.00 0.00 0.00 17.79 18.27 1ht1 h ALA 148 CO 0.03 -0.45 -0.00 0.93 0.00 0.00 0.00 179.25 179.76 1ht1 h GLU 149 N 0.20 -0.01 -0.79 0.00 4.39 -1.34 0.46 114.58 117.49 1ht1 h GLU 149 Ca 0.52 0.00 0.16 0.00 0.34 0.00 0.00 59.36 60.39 1ht1 h GLU 149 Cb 1.03 0.00 -0.10 0.00 -0.10 0.00 0.00 28.75 29.58 1ht1 h GLU 149 CO -0.65 -0.01 0.32 0.87 -1.16 0.00 0.00 179.01 178.38 1ht1 h LYS 150 N -0.01 0.41 -0.69 2.33 1.57 -0.54 0.12 116.57 119.76 1ht1 h LYS 150 Ca -0.00 -0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.75 1ht1 h LYS 150 Cb 0.01 -0.09 -0.03 0.00 0.08 0.00 0.00 32.23 32.19 1ht1 h LYS 150 CO 0.00 0.27 0.41 0.00 -0.57 0.00 0.00 179.45 179.57 1ht1 h ALA 151 N 1.60 0.88 -0.77 3.86 0.00 0.11 -1.51 119.26 123.43 1ht1 h ALA 151 Ca 0.45 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 55.26 1ht1 h ALA 151 Cb 0.74 -0.28 -0.04 0.00 0.00 0.00 0.00 17.79 18.21 1ht1 h ALA 151 CO -0.45 0.36 0.43 1.25 0.00 0.00 0.00 179.25 180.85 1ht1 h LEU 152 N 0.95 0.96 0.06 0.00 6.46 0.24 -1.77 115.31 122.20 1ht1 h LEU 152 Ca 0.25 -0.09 -0.00 0.00 -0.12 0.00 0.00 57.88 57.91 1ht1 h LEU 152 Cb -0.02 -0.24 0.00 0.00 -0.73 0.00 0.00 40.66 39.67 1ht1 h LEU 152 CO -0.05 0.77 -0.03 0.44 -0.62 0.00 0.00 178.44 178.96 1ht1 h ASP 153 N 1.06 -0.07 -0.68 1.25 3.45 -0.71 -0.94 116.42 119.78 1ht1 h ASP 153 Ca 0.27 -0.09 0.14 0.00 0.43 0.00 0.00 57.03 57.78 1ht1 h ASP 153 Cb 0.02 0.02 -0.12 0.00 -0.56 0.00 0.00 39.33 38.69 1ht1 h ASP 153 CO -0.04 0.05 -0.08 0.40 -1.57 0.00 0.00 179.24 177.99 1ht1 h ILE 154 N -0.19 0.37 0.25 0.35 1.08 -0.99 -0.67 117.51 117.72 1ht1 h ILE 154 Ca -0.01 -0.02 -0.01 0.00 -0.39 0.00 0.00 64.86 64.43 1ht1 h ILE 154 Cb 0.16 0.31 -0.00 0.00 -3.07 0.00 0.00 36.82 34.22 1ht1 h ILE 154 CO 0.01 0.01 -0.19 0.00 -0.69 0.00 0.00 178.15 177.29 1ht1 h ALA 155 N 1.65 -0.98 0.00 1.87 0.00 -0.95 -2.09 119.26 118.77 1ht1 h ALA 155 Ca 0.35 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.17 1ht1 h ALA 155 Cb 0.56 0.36 0.00 0.00 0.00 0.00 0.00 17.79 18.71 1ht1 h ALA 155 CO -0.64 -0.98 0.60 0.78 0.00 0.00 0.00 179.25 179.01 1ht1 h GLY 156 N -0.43 0.00 1.62 0.00 0.00 -0.59 1.55 103.07 105.23 1ht1 h GLY 156 Ca -0.03 0.00 -0.20 0.00 0.00 0.00 0.00 47.33 47.10 1ht1 h GLY 156 CO 0.01 0.00 -1.10 -0.55 0.00 0.00 0.00 176.54 174.90 1ht1 h ASP 157 N 0.00 0.00 0.02 0.19 3.45 -0.49 -3.38 116.42 116.21 1ht1 h ASP 157 Ca 0.00 0.00 -0.39 0.00 0.43 0.00 0.00 57.03 57.07 1ht1 h ASP 157 Cb 1.20 0.00 -0.06 0.00 -0.56 0.00 0.00 39.33 39.90 1ht1 h ASP 157 CO 0.00 0.82 -2.38 -0.38 -1.57 0.00 0.00 179.24 175.72 1ht1 n ILE 158 N -3.18 1.54 -2.69 0.35 2.08 0.49 -4.93 119.36 113.02 1ht1 n ILE 158 Ca -0.05 -0.53 -0.43 0.00 0.56 0.00 0.00 62.75 62.30 1ht1 n ILE 158 Cb 0.90 -1.56 -0.02 0.00 -0.75 0.00 0.00 39.64 38.20 1ht1 n ILE 158 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1ht1 n ILE 160 N 5.28 0.91 -0.41 0.00 -0.00 -1.26 -1.72 119.36 122.15 1ht1 n ILE 160 Ca 0.11 0.32 0.08 0.00 -0.00 0.00 0.00 62.75 63.26 1ht1 n ILE 160 Cb 0.46 -1.25 0.24 0.00 -0.00 0.00 0.00 39.64 39.09 1ht1 n ILE 160 CO 0.00 0.00 0.00 -1.22 -0.00 0.00 0.00 176.55 175.33 1ht1 n TYR 161 N -2.15 0.81 -4.56 1.39 4.01 -1.26 -4.93 117.16 110.47 1ht1 n TYR 161 Ca 0.02 -0.58 -0.23 0.00 -0.16 0.00 0.00 57.90 56.95 1ht1 n TYR 161 Cb 0.18 -0.10 -0.16 0.00 -0.31 0.00 0.00 39.34 38.95 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 -1.43 1.04 0.00 -0.72 2.01 -0.70 -0.55 115.64 115.30 1ht1 s THR 162 Ca 0.36 -0.49 0.00 0.00 0.31 0.00 0.00 61.69 61.87 1ht1 s THR 162 Cb 0.21 -0.92 0.00 0.00 0.01 0.00 0.00 72.50 71.80 1ht1 s THR 162 CO 0.19 0.32 0.00 -0.46 -0.69 0.00 0.00 174.62 173.98 1ht1 n ASN 163 N 3.35 0.88 -0.89 3.53 0.23 -1.26 -4.49 115.26 116.62 1ht1 n ASN 163 Ca -0.19 -0.25 0.03 0.00 -0.53 0.00 0.00 54.58 53.63 1ht1 n ASN 163 Cb 0.53 0.00 0.21 0.00 -2.08 0.00 0.00 39.78 38.45 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 -0.14 0.82 -3.42 -2.53 8.25 -1.26 -4.46 115.22 112.49 1ht1 n HIS 164 Ca 0.00 -1.26 -0.38 0.00 -0.26 0.00 0.00 57.72 55.82 1ht1 n HIS 164 Cb 0.00 -0.37 -0.07 0.00 1.12 0.00 0.00 29.99 30.67 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 -3.05 3.39 0.30 4.41 5.36 -1.26 -5.00 117.98 122.12 1ht1 s PHE 165 Ca 0.42 0.61 0.09 0.00 -0.96 0.00 0.00 56.93 57.08 1ht1 s PHE 165 Cb 0.36 -2.49 -0.04 0.00 -0.34 0.00 0.00 43.02 40.51 1ht1 s PHE 165 CO 0.03 0.04 0.07 -1.01 -1.46 0.00 0.00 175.22 172.89 1ht1 s HIS 166 N 1.14 2.73 -0.37 10.12 3.76 -1.26 -2.27 115.29 129.15 1ht1 s HIS 166 Ca 0.18 -0.28 0.04 0.00 -0.15 0.00 0.00 55.06 54.85 1ht1 s HIS 166 Cb -0.14 -1.40 0.16 0.00 1.11 0.00 0.00 32.58 32.30 1ht1 s HIS 166 CO 0.07 0.50 0.41 0.99 -0.85 0.00 0.00 174.74 175.86 1ht1 s THR 167 N -2.35 -0.43 0.02 1.30 2.01 -0.94 -4.95 115.64 110.29 1ht1 s THR 167 Ca 0.34 -0.83 -0.08 0.00 0.31 0.00 0.00 61.69 61.43 1ht1 s THR 167 Cb -0.05 -0.61 -0.05 0.00 0.01 0.00 0.00 72.50 71.80 1ht1 s THR 167 CO 0.21 -0.50 0.30 -0.63 -0.69 0.00 0.00 174.62 173.32 1ht1 s ILE 168 N 1.55 5.24 -0.18 1.82 1.09 -1.26 -3.26 121.20 126.19 1ht1 s ILE 168 Ca 0.16 0.30 -0.03 0.00 -1.10 0.00 0.00 60.65 59.98 1ht1 s ILE 168 Cb -0.14 -3.59 0.06 0.00 -1.06 0.00 0.00 42.46 37.73 1ht1 s ILE 168 CO -0.06 0.38 0.05 -1.61 -0.10 0.00 0.00 174.94 173.61 1ht1 s GLU 169 N -1.68 0.46 0.09 2.79 0.41 -0.83 -5.01 118.70 114.93 1ht1 s GLU 169 Ca 0.28 -0.28 -0.00 0.00 -0.41 0.00 0.00 54.97 54.55 1ht1 s GLU 169 Cb -0.14 -1.96 0.02 0.00 -1.78 0.00 0.00 34.13 30.27 1ht1 s GLU 169 CO 0.15 -0.63 0.13 -1.91 -0.49 0.00 0.00 175.26 172.51 1ht1 n GLU 170 N 5.13 0.50 -3.25 1.61 2.13 -1.26 -2.47 120.64 123.02 1ht1 n GLU 170 Ca -0.08 -0.33 0.03 0.00 0.66 0.00 0.00 57.16 57.44 1ht1 n GLU 170 Cb 0.48 -0.09 -0.04 0.00 0.27 0.00 0.00 31.44 32.06 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 0.00 -0.15 0.10 4.31 2.96 -0.93 -4.90 118.68 120.08 1ht1 s LEU 171 Ca 0.08 0.21 0.05 0.00 -0.22 0.00 0.00 54.13 54.25 1ht1 s LEU 171 Cb -0.00 1.17 -0.04 0.00 0.50 0.00 0.00 46.19 47.82 1ht1 s LEU 171 CO 0.05 -0.03 0.02 -0.44 -1.32 0.00 0.00 176.35 174.64 1ht1 s SER 172 N 2.03 5.11 0.38 3.68 0.01 -1.26 -2.30 113.70 121.35 1ht1 s SER 172 Ca -0.01 -0.17 0.00 0.00 1.31 0.00 0.00 55.95 57.08 1ht1 s SER 172 Cb -0.02 -1.24 0.00 0.00 0.21 0.00 0.00 66.02 64.98 1ht1 s SER 172 CO -0.16 0.16 0.00 0.00 0.41 0.00 0.00 173.24 173.65 1ht1 n TYR 173 N 0.40 -4.30 -0.66 2.43 0.18 -1.02 -5.02 117.16 109.16 1ht1 n TYR 173 Ca -0.10 1.31 0.00 0.00 1.88 0.00 0.00 57.90 60.99 1ht1 n TYR 173 Cb 0.52 3.35 0.00 0.00 -0.38 0.00 0.00 39.34 42.83 1ht1 n TYR 173 CO 0.00 0.00 0.00 1.63 -2.08 0.00 0.00 176.86 176.41