#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hn5 n SER 31 N 0.00 0.00 -3.58 4.31 7.64 0.76 -4.86 113.62 117.89 3hn5 n SER 31 Ca 0.00 0.00 -0.02 0.00 1.01 0.00 0.00 58.87 59.86 3hn5 n SER 31 Cb 0.00 0.00 -0.05 0.00 -1.01 0.00 0.00 64.21 63.15 3hn5 n SER 31 CO 0.00 0.00 0.00 -0.22 -3.01 0.00 0.00 175.04 171.81 3hn5 s LEU 33 N 0.00 -0.88 0.19 -3.43 2.96 -0.02 -0.30 118.68 117.20 3hn5 s LEU 33 Ca 0.00 1.26 0.05 0.00 -0.22 0.00 0.00 54.13 55.22 3hn5 s LEU 33 Cb 0.00 2.08 -0.05 0.00 0.50 0.00 0.00 46.19 48.72 3hn5 s LEU 33 CO 0.00 -0.18 -0.08 0.42 -1.32 0.00 0.00 176.35 175.18 3hn5 s THR 34 N 2.35 1.28 -1.70 3.68 -4.23 -0.36 -0.54 115.64 116.13 3hn5 s THR 34 Ca -0.06 -2.09 0.00 0.00 -1.18 0.00 0.00 61.69 58.36 3hn5 s THR 34 Cb -0.08 -2.05 0.00 0.00 1.34 0.00 0.00 72.50 71.71 3hn5 s THR 34 CO -0.18 -0.58 0.00 0.61 -0.54 0.00 0.00 174.62 173.92 3hn5 n GLY 35 N -0.31 -1.18 3.11 3.99 0.00 -0.99 -1.01 105.19 108.80 3hn5 n GLY 35 Ca -0.08 -0.92 -0.19 0.00 0.00 0.00 0.00 46.02 44.83 3hn5 n GLY 35 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3hn5 s ARG 36 N -0.68 0.87 -0.00 1.61 0.52 -1.26 -0.83 118.95 119.18 3hn5 s ARG 36 Ca 0.00 -0.66 -0.18 0.00 -0.52 0.00 0.00 55.73 54.38 3hn5 s ARG 36 Cb 0.00 -0.85 -0.06 0.00 0.52 0.00 0.00 34.95 34.56 3hn5 s ARG 36 CO 0.00 0.21 0.49 0.08 0.02 0.00 0.00 175.30 176.11 3hn5 s VAL 37 N -0.74 4.96 -0.30 3.52 1.01 0.79 -0.88 120.40 128.76 3hn5 s VAL 37 Ca 0.01 1.02 -0.12 0.00 0.00 0.00 0.00 61.98 62.89 3hn5 s VAL 37 Cb -0.07 -3.82 0.13 0.00 0.00 0.00 0.00 36.38 32.62 3hn5 s VAL 37 CO 0.01 0.50 0.74 -0.47 0.00 0.00 0.00 175.10 175.87 3hn5 s TYR 39 N -0.62 -1.13 -1.53 5.22 5.04 -0.33 -1.61 117.35 122.40 3hn5 s TYR 39 Ca 0.27 2.02 -0.13 0.00 -2.44 0.00 0.00 57.07 56.79 3hn5 s TYR 39 Cb -0.17 0.68 0.08 0.00 0.35 0.00 0.00 41.96 42.89 3hn5 s TYR 39 CO 0.15 -0.56 0.93 -1.71 -1.34 0.00 0.00 175.55 173.02 3hn5 n ASN 40 N 5.02 -4.22 0.00 4.32 5.15 -1.26 -1.74 115.26 122.52 3hn5 n ASN 40 Ca -0.14 -0.81 0.00 0.00 -0.60 0.00 0.00 54.58 53.03 3hn5 n ASN 40 Cb 0.52 -3.78 0.00 0.00 -0.53 0.00 0.00 39.78 36.00 3hn5 n ASN 40 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3hn5 n GLY 41 N -1.67 0.30 3.19 8.20 0.00 -1.26 -5.04 105.19 108.92 3hn5 n GLY 41 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.71 3hn5 n GLY 41 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3hn5 s GLU 42 N -0.91 2.94 0.32 1.61 2.12 -0.71 -5.11 118.70 118.96 3hn5 s GLU 42 Ca 0.00 -0.84 -0.29 0.00 0.36 0.00 0.00 54.97 54.20 3hn5 s GLU 42 Cb 0.00 -2.25 -0.11 0.00 0.26 0.00 0.00 34.13 32.03 3hn5 s GLU 42 CO 0.00 0.13 1.49 0.00 -0.54 0.00 0.00 175.26 176.34 3hn5 s ALA 43 N 0.46 3.63 0.50 6.30 0.00 -1.26 -1.19 121.76 130.20 3hn5 s ALA 43 Ca -0.16 1.48 -0.19 0.00 0.00 0.00 0.00 51.96 53.09 3hn5 s ALA 43 Cb -0.17 -3.59 -0.08 0.00 0.00 0.00 0.00 23.12 19.27 3hn5 s ALA 43 CO 0.06 -0.92 1.02 -0.51 0.00 0.00 0.00 175.76 175.42 3hn5 s LEU 44 N -1.18 3.78 -0.39 0.00 1.43 -0.63 -4.89 118.68 116.81 3hn5 s LEU 44 Ca 0.57 1.84 -0.17 0.00 -1.03 0.00 0.00 54.13 55.34 3hn5 s LEU 44 Cb -0.45 -4.55 0.01 0.00 0.03 0.00 0.00 46.19 41.23 3hn5 s LEU 44 CO 0.53 -0.76 0.42 -1.10 0.23 0.00 0.00 176.35 175.67 3hn5 s GLN 45 N -3.44 3.32 0.45 1.70 -1.52 -1.26 -2.02 119.66 116.88 3hn5 s GLN 45 Ca 0.65 -0.58 0.03 0.00 -1.95 0.00 0.00 55.36 53.51 3hn5 s GLN 45 Cb -0.14 -3.89 -0.03 0.00 -0.22 0.00 0.00 33.01 28.72 3hn5 s GLN 45 CO 0.23 -0.72 0.05 -0.51 -0.25 0.00 0.00 175.29 174.08 3hn5 s LEU 46 N 2.12 2.28 0.09 2.90 1.43 -0.33 -1.88 118.68 125.30 3hn5 s LEU 46 Ca 0.13 -1.59 -0.22 0.00 -1.03 0.00 0.00 54.13 51.42 3hn5 s LEU 46 Cb -0.17 -0.54 -0.12 0.00 0.03 0.00 0.00 46.19 45.39 3hn5 s LEU 46 CO 0.13 -0.79 1.71 -0.09 0.23 0.00 0.00 176.35 177.54 3hn5 h ARG 47 N 1.62 0.10 0.00 1.70 2.43 -1.84 -3.39 114.38 115.00 3hn5 h ARG 47 Ca -0.41 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 58.75 3hn5 h ARG 47 Cb 1.28 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.81 3hn5 h ARG 47 CO 0.70 0.12 0.00 0.41 -1.51 0.00 0.00 179.97 179.68 3hn5 n GLY 48 N -0.98 -1.85 4.13 2.80 0.00 -1.26 -4.62 105.19 103.40 3hn5 n GLY 48 Ca -0.06 -1.70 -0.45 0.00 0.00 0.00 0.00 46.02 43.81 3hn5 n GLY 48 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3hn5 n ASN 49 N 0.41 -3.34 -0.10 1.61 3.02 -1.26 -2.67 115.26 112.92 3hn5 n ASN 49 Ca 0.00 -1.31 -0.01 0.00 -0.03 0.00 0.00 54.58 53.22 3hn5 n ASN 49 Cb 0.00 -1.59 -0.01 0.00 -0.61 0.00 0.00 39.78 37.58 3hn5 n ASN 49 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3hn5 n GLU 50 N -5.04 -0.86 0.07 3.52 4.71 -1.26 -4.90 120.64 116.88 3hn5 n GLU 50 Ca -0.14 0.31 -0.04 0.00 -0.01 0.00 0.00 57.16 57.28 3hn5 n GLU 50 Cb 0.58 -4.01 -0.08 0.00 -1.01 0.00 0.00 31.44 26.92 3hn5 n GLU 50 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 3hn5 h ALA 51 N 0.00 0.51 -3.30 0.62 0.00 -1.82 -3.44 119.26 111.83 3hn5 h ALA 51 Ca -0.03 -0.83 -0.66 0.00 0.00 0.00 0.00 54.91 53.39 3hn5 h ALA 51 Cb 0.47 -0.04 -0.33 0.00 0.00 0.00 0.00 17.79 17.89 3hn5 h ALA 51 CO 0.04 1.08 -0.87 0.08 0.00 0.00 0.00 179.25 179.58 3hn5 s VAL 52 N -2.78 1.96 0.02 0.00 1.01 -1.26 -4.84 120.40 114.50 3hn5 s VAL 52 Ca 0.01 -0.95 0.06 0.00 0.00 0.00 0.00 61.98 61.10 3hn5 s VAL 52 Cb 0.09 -1.71 -0.02 0.00 0.00 0.00 0.00 36.38 34.74 3hn5 s VAL 52 CO 0.80 0.54 -0.18 -1.10 0.00 0.00 0.00 175.10 175.16 3hn5 s GLN 53 N 0.54 1.27 0.32 2.72 -0.21 -1.26 -0.96 119.66 122.07 3hn5 s GLN 53 Ca -0.14 -0.76 0.08 0.00 0.02 0.00 0.00 55.36 54.55 3hn5 s GLN 53 Cb -0.17 -1.29 -0.03 0.00 1.00 0.00 0.00 33.01 32.52 3hn5 s GLN 53 CO 0.05 0.34 0.22 -0.51 -2.12 0.00 0.00 175.29 173.27 3hn5 s LEU 54 N -0.85 3.52 -0.05 2.90 1.43 0.87 -3.40 118.68 123.10 3hn5 s LEU 54 Ca 0.06 -0.54 0.05 0.00 -1.03 0.00 0.00 54.13 52.67 3hn5 s LEU 54 Cb -0.08 -2.08 -0.01 0.00 0.03 0.00 0.00 46.19 44.05 3hn5 s LEU 54 CO 0.01 -0.27 -0.22 -1.10 0.23 0.00 0.00 176.35 175.00 3hn5 s GLN 55 N -3.92 2.20 -0.17 1.70 -0.21 -0.09 -1.77 119.66 117.40 3hn5 s GLN 55 Ca 0.38 -0.78 0.01 0.00 0.02 0.00 0.00 55.36 54.99 3hn5 s GLN 55 Cb -0.05 -1.89 0.01 0.00 1.00 0.00 0.00 33.01 32.07 3hn5 s GLN 55 CO 0.25 0.34 -0.18 -0.51 -2.12 0.00 0.00 175.29 173.07 3hn5 s LEU 56 N -0.11 2.28 -0.12 2.90 1.43 -0.30 -1.17 118.68 123.59 3hn5 s LEU 56 Ca -0.03 -0.57 -0.02 0.00 -1.03 0.00 0.00 54.13 52.49 3hn5 s LEU 56 Cb -0.12 -1.52 -0.03 0.00 0.03 0.00 0.00 46.19 44.55 3hn5 s LEU 56 CO 0.03 0.04 -0.05 -0.31 0.23 0.00 0.00 176.35 176.29 3hn5 s TYR 57 N 1.06 2.99 -0.24 0.29 1.51 0.52 -0.33 117.35 123.15 3hn5 s TYR 57 Ca -0.01 -0.18 0.12 0.00 -1.01 0.00 0.00 57.07 55.99 3hn5 s TYR 57 Cb -0.14 -1.86 -0.16 0.00 -0.11 0.00 0.00 41.96 39.69 3hn5 s TYR 57 CO -0.06 0.11 0.36 1.04 -1.11 0.00 0.00 175.55 175.90 3hn5 n GLN 58 N 2.99 1.50 -0.71 -0.62 6.02 -1.26 -0.61 117.38 124.69 3hn5 n GLN 58 Ca -0.18 -0.07 0.03 0.00 -0.01 0.00 0.00 57.00 56.78 3hn5 n GLN 58 Cb 0.53 -1.19 0.20 0.00 1.02 0.00 0.00 30.24 30.79 3hn5 n GLN 58 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 177.06 176.77 3hn5 n HIS 59 N -1.66 0.23 0.00 1.08 8.25 -1.26 -4.97 115.22 116.90 3hn5 n HIS 59 Ca -0.00 -1.56 0.00 0.00 -0.26 0.00 0.00 57.72 55.90 3hn5 n HIS 59 Cb 0.26 -0.26 0.00 0.00 1.12 0.00 0.00 29.99 31.11 3hn5 n HIS 59 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3hn5 n GLY 60 N -1.09 -1.39 0.34 -1.41 0.00 -1.26 -4.45 105.19 95.94 3hn5 n GLY 60 Ca 0.21 -1.43 0.01 0.00 0.00 0.00 0.00 46.02 44.81 3hn5 n GLY 60 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 3hn5 h TYR 61 N 0.00 0.89 0.00 1.61 3.20 -1.98 -2.92 116.97 117.77 3hn5 h TYR 61 Ca 0.00 0.02 -0.02 0.00 3.14 0.00 0.00 58.73 61.87 3hn5 h TYR 61 Cb 0.00 -0.30 -0.00 0.00 1.54 0.00 0.00 36.73 37.97 3hn5 h TYR 61 CO 0.00 0.57 -0.08 0.00 -1.64 0.00 0.00 178.16 177.00 3hn5 h ALA 62 N 1.55 1.61 0.00 1.82 0.00 -2.05 -2.43 119.26 119.76 3hn5 h ALA 62 Ca 0.26 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.09 3hn5 h ALA 62 Cb -0.09 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.68 3hn5 h ALA 62 CO -0.05 0.11 0.00 1.63 0.00 0.00 0.00 179.25 180.93 3hn5 n LYS 63 N -4.07 0.10 -4.06 0.00 4.76 -1.10 -4.91 118.16 108.87 3hn5 n LYS 63 Ca -0.03 0.09 -0.32 0.00 -2.87 0.00 0.00 58.31 55.18 3hn5 n LYS 63 Cb 0.17 -1.50 -0.00 0.00 -1.84 0.00 0.00 35.03 31.86 3hn5 n LYS 63 CO 0.00 0.00 0.00 -2.39 -1.37 0.00 0.00 177.40 173.64 3hn5 n HIS 64 N -1.43 -1.96 -2.92 2.13 1.44 -0.92 -4.89 115.22 106.67 3hn5 n HIS 64 Ca 0.07 0.84 -0.20 0.00 -2.01 0.00 0.00 57.72 56.42 3hn5 n HIS 64 Cb 0.25 -3.47 -0.02 0.00 0.12 0.00 0.00 29.99 26.87 3hn5 n HIS 64 CO 0.00 0.00 0.00 -0.40 -2.81 0.00 0.00 176.34 173.13 3hn5 n ASP 65 N -2.77 2.58 -4.88 4.39 5.75 -1.26 -5.12 116.55 115.24 3hn5 n ASP 65 Ca 0.01 -3.26 -0.31 0.00 -0.01 0.00 0.00 54.79 51.23 3hn5 n ASP 65 Cb 0.53 -0.56 0.02 0.00 -1.03 0.00 0.00 41.12 40.08 3hn5 n ASP 65 CO 0.00 0.00 0.00 -2.16 -0.11 0.00 0.00 177.20 174.93 3hn5 s PRO 66 N -3.02 3.36 0.15 0.11 0.04 -1.26 -4.80 135.00 129.58 3hn5 s PRO 66 Ca 0.41 0.65 -0.27 0.00 0.04 0.00 0.00 61.00 61.83 3hn5 s PRO 66 Cb 0.36 -2.07 -0.07 0.00 0.04 0.00 0.00 34.50 32.76 3hn5 s PRO 66 CO -0.09 -0.71 0.83 0.42 0.04 0.00 0.00 177.00 177.49 3hn5 s ILE 67 N -3.23 4.38 -0.04 0.56 1.01 0.56 -4.88 121.20 119.55 3hn5 s ILE 67 Ca 0.56 1.82 -0.16 0.00 0.00 0.00 0.00 60.65 62.88 3hn5 s ILE 67 Cb -0.11 -4.20 -0.05 0.00 0.01 0.00 0.00 42.46 38.11 3hn5 s ILE 67 CO 0.53 0.46 0.41 0.21 0.00 0.00 0.00 174.94 176.56 3hn5 s ASN 68 N -0.82 6.74 -0.08 3.58 2.47 -1.26 -1.15 114.94 124.43 3hn5 s ASN 68 Ca 0.39 0.88 0.01 0.00 0.42 0.00 0.00 52.86 54.56 3hn5 s ASN 68 Cb -0.23 -2.25 0.02 0.00 -1.45 0.00 0.00 41.25 37.33 3hn5 s ASN 68 CO 0.27 0.22 -0.09 -0.69 -3.72 0.00 0.00 177.10 173.10 3hn5 s VAL 69 N -0.51 0.96 0.18 -5.21 1.01 -0.73 -4.99 120.40 111.11 3hn5 s VAL 69 Ca 0.24 -0.33 -0.08 0.00 0.00 0.00 0.00 61.98 61.81 3hn5 s VAL 69 Cb -0.16 -0.93 -0.06 0.00 0.00 0.00 0.00 36.38 35.23 3hn5 s VAL 69 CO 0.12 0.33 0.47 -0.31 0.00 0.00 0.00 175.10 175.71 3hn5 s TYR 70 N 1.08 3.47 -0.14 5.22 2.02 -1.26 -0.09 117.35 127.65 3hn5 s TYR 70 Ca -0.07 0.76 -0.03 0.00 -0.37 0.00 0.00 57.07 57.36 3hn5 s TYR 70 Cb -0.14 -2.16 -0.03 0.00 -0.40 0.00 0.00 41.96 39.22 3hn5 s TYR 70 CO -0.01 0.37 -0.03 0.08 -1.57 0.00 0.00 175.55 174.39 3hn5 s VAL 71 N -1.69 3.97 0.53 0.71 1.01 -0.14 -4.25 120.40 120.54 3hn5 s VAL 71 Ca 0.43 -0.34 -0.06 0.00 0.00 0.00 0.00 61.98 62.01 3hn5 s VAL 71 Cb -0.12 -2.72 0.12 0.00 0.00 0.00 0.00 36.38 33.65 3hn5 s VAL 71 CO 0.22 0.51 0.73 -0.46 0.00 0.00 0.00 175.10 176.10 3hn5 n ASN 72 N 3.28 0.34 0.29 3.32 0.23 -1.26 -4.49 115.26 116.97 3hn5 n ASN 72 Ca -0.17 -1.44 0.18 0.00 -0.53 0.00 0.00 54.58 52.61 3hn5 n ASN 72 Cb 0.53 -0.53 0.84 0.00 -2.08 0.00 0.00 39.78 38.53 3hn5 n ASN 72 CO 0.00 0.00 0.00 0.06 -0.93 0.00 0.00 177.26 176.39 3hn5 h GLN 73 N 0.00 0.00 -0.67 -3.83 -0.00 -1.82 -1.75 115.11 107.04 3hn5 h GLN 73 Ca -0.24 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.41 3hn5 h GLN 73 Cb 0.72 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.20 3hn5 h GLN 73 CO 0.19 0.04 0.00 -0.25 -0.00 0.00 0.00 178.83 178.81 3hn5 n ASP 74 N -3.22 4.66 -1.49 0.06 8.00 -1.26 -1.18 116.55 122.12 3hn5 n ASP 74 Ca -0.01 -2.38 0.00 0.00 0.71 0.00 0.00 54.79 53.11 3hn5 n ASP 74 Cb 0.23 -0.57 0.00 0.00 -0.02 0.00 0.00 41.12 40.76 3hn5 n ASP 74 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3hn5 n GLY 75 N 1.23 -0.24 3.60 0.44 0.00 -0.66 -4.50 105.19 105.06 3hn5 n GLY 75 Ca 0.26 -0.21 -0.04 0.00 0.00 0.00 0.00 46.02 46.03 3hn5 n GLY 75 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3hn5 s TYR 77 N -2.99 -0.12 -0.16 1.61 -0.85 -0.01 -0.15 117.35 114.69 3hn5 s TYR 77 Ca 0.00 0.07 -0.09 0.00 -0.52 0.00 0.00 57.07 56.54 3hn5 s TYR 77 Cb 0.00 0.51 0.06 0.00 0.38 0.00 0.00 41.96 42.91 3hn5 s TYR 77 CO 0.00 -0.19 0.38 0.45 -1.52 0.00 0.00 175.55 174.67 3hn5 s SER 78 N -2.16 -0.47 -0.04 -0.18 0.15 -1.26 -2.34 113.70 107.40 3hn5 s SER 78 Ca 0.10 0.82 0.03 0.00 0.70 0.00 0.00 55.95 57.59 3hn5 s SER 78 Cb -0.01 0.71 0.01 0.00 -1.71 0.00 0.00 66.02 65.01 3hn5 s SER 78 CO -0.04 -0.19 -0.12 0.00 1.20 0.00 0.00 173.24 174.09 3hn5 s ALA 79 N 1.32 1.17 -0.29 5.45 0.00 0.30 -4.74 121.76 124.97 3hn5 s ALA 79 Ca -0.09 -0.44 -0.18 0.00 0.00 0.00 0.00 51.96 51.24 3hn5 s ALA 79 Cb -0.08 -0.46 -0.02 0.00 0.00 0.00 0.00 23.12 22.56 3hn5 s ALA 79 CO -0.11 0.16 0.52 -0.80 0.00 0.00 0.00 175.76 175.53 3hn5 s ASN 80 N 0.34 6.41 0.05 0.00 0.01 -1.26 -0.84 114.94 119.64 3hn5 s ASN 80 Ca -0.08 0.38 0.01 0.00 -0.71 0.00 0.00 52.86 52.46 3hn5 s ASN 80 Cb -0.12 -2.28 -0.03 0.00 0.41 0.00 0.00 41.25 39.23 3hn5 s ASN 80 CO 0.02 -0.35 -0.05 -0.76 -1.51 0.00 0.00 177.10 174.44 3hn5 s LEU 81 N 2.36 2.34 0.51 0.60 1.43 0.59 -4.94 118.68 121.58 3hn5 s LEU 81 Ca 0.21 -0.70 -0.18 0.00 -1.03 0.00 0.00 54.13 52.42 3hn5 s LEU 81 Cb -0.15 0.00 -0.08 0.00 0.03 0.00 0.00 46.19 45.99 3hn5 s LEU 81 CO 0.10 -0.36 1.01 -0.36 0.23 0.00 0.00 176.35 176.98 3hn5 s PHE 82 N -2.29 3.17 0.55 0.29 0.08 -1.26 -0.17 117.98 118.35 3hn5 s PHE 82 Ca -0.05 1.54 -0.21 0.00 0.12 0.00 0.00 56.93 58.33 3hn5 s PHE 82 Cb -0.04 -2.94 -0.05 0.00 -0.57 0.00 0.00 43.02 39.42 3hn5 s PHE 82 CO -0.03 -0.64 1.32 -0.25 -0.10 0.00 0.00 175.22 175.52 3hn5 n ASP 83 N -1.31 2.48 0.00 1.36 8.00 -1.26 -4.90 116.55 120.91 3hn5 n ASP 83 Ca 0.08 0.96 0.00 0.00 0.71 0.00 0.00 54.79 56.54 3hn5 n ASP 83 Cb 0.53 -1.56 0.00 0.00 -0.02 0.00 0.00 41.12 40.08 3hn5 n ASP 83 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3hn5 n GLY 84 N 0.82 -0.29 3.79 0.44 0.00 -0.40 -4.97 105.19 104.57 3hn5 n GLY 84 Ca 0.11 -1.47 -0.36 0.00 0.00 0.00 0.00 46.02 44.29 3hn5 n GLY 84 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3hn5 s GLU 85 N -2.00 3.96 0.09 1.61 0.41 -1.26 -0.28 118.70 121.23 3hn5 s GLU 85 Ca 0.00 -0.00 0.03 0.00 -0.41 0.00 0.00 54.97 54.59 3hn5 s GLU 85 Cb 0.00 -3.33 -0.04 0.00 -1.78 0.00 0.00 34.13 28.99 3hn5 s GLU 85 CO 0.00 0.47 -0.09 0.71 -0.49 0.00 0.00 175.26 175.86 3hn5 s TYR 86 N -0.20 0.98 0.51 1.61 1.51 0.33 -4.73 117.35 117.36 3hn5 s TYR 86 Ca 0.15 -0.68 0.04 0.00 -1.01 0.00 0.00 57.07 55.57 3hn5 s TYR 86 Cb -0.13 -0.54 0.00 0.00 -0.11 0.00 0.00 41.96 41.18 3hn5 s TYR 86 CO 0.04 -0.04 0.20 -0.65 -1.11 0.00 0.00 175.55 173.99 3hn5 s GLN 87 N -2.82 2.22 0.00 -0.62 -0.21 0.22 -0.61 119.66 117.84 3hn5 s GLN 87 Ca 0.04 -2.15 0.00 0.00 0.02 0.00 0.00 55.36 53.27 3hn5 s GLN 87 Cb -0.02 -1.84 0.00 0.00 1.00 0.00 0.00 33.01 32.14 3hn5 s GLN 87 CO -0.01 -0.43 0.00 1.51 -2.12 0.00 0.00 175.29 174.25 3hn5 n ILE 89 N -1.47 0.00 -1.52 1.08 3.06 -0.32 -0.36 119.36 119.83 3hn5 n ILE 89 Ca -0.09 0.00 -0.33 0.00 -2.50 0.00 0.00 62.75 59.83 3hn5 n ILE 89 Cb 0.65 0.00 0.08 0.00 0.54 0.00 0.00 39.64 40.91 3hn5 n ILE 89 CO 0.00 0.00 0.00 0.42 -2.50 0.00 0.00 176.55 174.47 3hn5 s THR 90 N -2.00 2.86 -0.15 9.51 -4.23 -1.26 -0.92 115.64 119.46 3hn5 s THR 90 Ca 0.00 0.39 -0.28 0.00 -1.18 0.00 0.00 61.69 60.61 3hn5 s THR 90 Cb 0.00 -2.88 -0.01 0.00 1.34 0.00 0.00 72.50 70.95 3hn5 s THR 90 CO 0.00 -0.26 0.96 -0.75 -0.54 0.00 0.00 174.62 174.03 3hn5 s LYS 91 N -4.16 4.35 0.04 3.99 2.20 -1.22 -4.72 119.74 120.23 3hn5 s LYS 91 Ca 0.69 1.28 -0.36 0.00 -0.36 0.00 0.00 55.97 57.22 3hn5 s LYS 91 Cb -0.23 -3.57 -0.15 0.00 -1.51 0.00 0.00 37.83 32.37 3hn5 s LYS 91 CO 0.45 -0.38 1.58 0.45 -0.36 0.00 0.00 175.35 177.09 3hn5 n SER 92 N 5.33 2.63 0.00 1.43 2.88 -1.26 -1.41 113.62 123.22 3hn5 n SER 92 Ca 0.08 1.07 0.00 0.00 -1.33 0.00 0.00 58.87 58.69 3hn5 n SER 92 Cb 0.48 -1.31 0.00 0.00 -0.75 0.00 0.00 64.21 62.63 3hn5 n SER 92 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3hn5 n GLY 93 N 3.41 1.51 3.38 0.46 0.00 -1.26 -4.99 105.19 107.69 3hn5 n GLY 93 Ca 0.20 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.84 3hn5 n GLY 93 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3hn5 s ASN 94 N -3.25 5.25 0.00 1.61 3.04 -0.50 -4.39 114.94 116.70 3hn5 s ASN 94 Ca 0.00 -0.62 0.00 0.00 0.04 0.00 0.00 52.86 52.28 3hn5 s ASN 94 Cb 0.00 -1.92 0.00 0.00 -1.54 0.00 0.00 41.25 37.79 3hn5 s ASN 94 CO 0.00 -0.18 0.00 0.61 -3.04 0.00 0.00 177.10 174.49 3hn5 n GLY 95 N 4.91 3.25 2.28 1.21 0.00 -1.26 -4.60 105.19 110.97 3hn5 n GLY 95 Ca -0.14 -1.82 -0.32 0.00 0.00 0.00 0.00 46.02 43.74 3hn5 n GLY 95 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3hn5 n PRO 96 N -0.75 3.34 -3.99 1.61 -0.04 -1.26 -4.59 135.00 129.32 3hn5 n PRO 96 Ca 0.00 -2.12 -0.10 0.00 -0.04 0.00 0.00 63.50 61.24 3hn5 n PRO 96 Cb 0.00 -2.53 -0.06 0.00 -0.04 0.00 0.00 33.50 30.87 3hn5 n PRO 96 CO 0.00 0.00 0.00 1.67 -0.04 0.00 0.00 175.50 177.13 3hn5 s TRP 97 N 1.05 0.43 0.68 0.54 -2.14 -1.26 -3.18 118.94 115.06 3hn5 s TRP 97 Ca 0.66 -0.77 0.03 0.00 2.66 0.00 0.00 56.10 58.67 3hn5 s TRP 97 Cb 0.23 0.04 0.12 0.00 -3.10 0.00 0.00 33.47 30.76 3hn5 s TRP 97 CO -0.06 -0.86 0.94 0.95 -2.66 0.00 0.00 176.95 175.26 3hn5 s THR 98 N -4.01 2.12 -2.09 0.66 -4.23 -0.61 -4.90 115.64 102.59 3hn5 s THR 98 Ca 0.22 -0.72 0.20 0.00 -1.18 0.00 0.00 61.69 60.21 3hn5 s THR 98 Cb 0.01 -2.40 0.54 0.00 1.34 0.00 0.00 72.50 71.99 3hn5 s THR 98 CO 0.06 0.00 1.71 -1.54 -0.54 0.00 0.00 174.62 174.31 3hn5 n SER 99 N -2.66 0.46 -4.67 3.99 3.41 -1.26 -4.62 113.62 108.27 3hn5 n SER 99 Ca 0.15 -1.46 -0.50 0.00 -0.26 0.00 0.00 58.87 56.80 3hn5 n SER 99 Cb 0.61 -0.03 -0.05 0.00 -0.26 0.00 0.00 64.21 64.48 3hn5 n SER 99 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 3hn5 n GLU 100 N -0.50 1.80 -1.16 4.33 4.07 -1.26 -0.84 120.64 127.09 3hn5 n GLU 100 Ca 0.15 0.66 -0.05 0.00 -0.06 0.00 0.00 57.16 57.86 3hn5 n GLU 100 Cb 0.14 -2.42 -0.02 0.00 -0.06 0.00 0.00 31.44 29.08 3hn5 n GLU 100 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 3hn5 n GLY 101 N 3.85 0.74 3.68 8.31 0.00 -1.26 -4.42 105.19 116.09 3hn5 n GLY 101 Ca 0.21 -0.30 -0.42 0.00 0.00 0.00 0.00 46.02 45.51 3hn5 n GLY 101 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3hn5 s ARG 102 N -1.97 4.38 0.17 1.61 3.52 -0.02 -4.97 118.95 121.67 3hn5 s ARG 102 Ca 0.00 1.48 -0.24 0.00 -0.13 0.00 0.00 55.73 56.84 3hn5 s ARG 102 Cb 0.00 -3.56 0.06 0.00 -1.56 0.00 0.00 34.95 29.88 3hn5 s ARG 102 CO 0.00 -0.39 0.77 0.34 -0.81 0.00 0.00 175.30 175.21 3hn5 s ASP 103 N 1.25 -0.34 0.46 -2.12 2.15 -1.26 -5.12 116.67 111.69 3hn5 s ASP 103 Ca 0.50 -0.31 -0.22 0.00 0.43 0.00 0.00 52.55 52.95 3hn5 s ASP 103 Cb -0.20 0.58 -0.07 0.00 -0.30 0.00 0.00 42.92 42.93 3hn5 s ASP 103 CO 0.18 -1.03 1.13 0.42 -0.17 0.00 0.00 175.17 175.71 3hn5 s THR 104 N -3.59 3.26 -0.20 1.71 -4.23 -1.26 -4.66 115.64 106.66 3hn5 s THR 104 Ca 0.08 0.91 -0.00 0.00 -1.18 0.00 0.00 61.69 61.50 3hn5 s THR 104 Cb -0.03 -3.45 0.02 0.00 1.34 0.00 0.00 72.50 70.38 3hn5 s THR 104 CO -0.02 -0.04 -0.15 -0.63 -0.54 0.00 0.00 174.62 173.24 3hn5 s ILE 105 N -1.62 2.44 -0.11 2.99 1.01 -1.26 -5.02 121.20 119.62 3hn5 s ILE 105 Ca 0.64 -0.89 -0.30 0.00 0.00 0.00 0.00 60.65 60.11 3hn5 s ILE 105 Cb -0.26 -2.09 -0.02 0.00 0.01 0.00 0.00 42.46 40.10 3hn5 s ILE 105 CO 0.31 0.45 1.15 0.20 0.00 0.00 0.00 174.94 177.06 3hn5 s ASN 106 N 1.33 7.08 -0.08 3.58 0.01 -1.26 -4.24 114.94 121.35 3hn5 s ASN 106 Ca 0.04 1.67 0.04 0.00 -0.71 0.00 0.00 52.86 53.90 3hn5 s ASN 106 Cb -0.14 -2.55 0.00 0.00 0.41 0.00 0.00 41.25 38.97 3hn5 s ASN 106 CO -0.10 -0.60 -0.20 -0.69 -1.51 0.00 0.00 177.10 174.00 3hn5 s VAL 107 N 2.58 1.71 -0.35 1.60 1.01 0.22 -5.01 120.40 122.16 3hn5 s VAL 107 Ca 0.52 -0.83 -0.11 0.00 0.00 0.00 0.00 61.98 61.57 3hn5 s VAL 107 Cb -0.21 -1.49 0.02 0.00 0.00 0.00 0.00 36.38 34.69 3hn5 s VAL 107 CO 0.17 0.48 0.19 -0.89 0.00 0.00 0.00 175.10 175.06 3hn5 s THR 108 N 0.34 4.61 -0.29 3.92 2.01 -1.26 -0.51 115.64 124.45 3hn5 s THR 108 Ca -0.14 -0.70 -0.21 0.00 0.31 0.00 0.00 61.69 60.94 3hn5 s THR 108 Cb -0.16 -3.50 -0.01 0.00 0.01 0.00 0.00 72.50 68.84 3hn5 s THR 108 CO 0.06 -0.14 0.67 -0.69 -0.69 0.00 0.00 174.62 173.84 3hn5 s VAL 109 N 1.58 4.91 -0.33 3.82 1.01 0.61 -4.96 120.40 127.04 3hn5 s VAL 109 Ca 0.03 1.01 -0.01 0.00 0.00 0.00 0.00 61.98 63.01 3hn5 s VAL 109 Cb -0.18 -4.03 0.13 0.00 0.00 0.00 0.00 36.38 32.30 3hn5 s VAL 109 CO 0.07 -0.13 0.18 0.00 0.00 0.00 0.00 175.10 175.22 3hn5 s ALA 110 N 2.68 0.82 0.00 5.51 0.00 -1.26 -1.28 121.76 128.24 3hn5 s ALA 110 Ca 0.27 -1.59 0.00 0.00 0.00 0.00 0.00 51.96 50.64 3hn5 s ALA 110 Cb -0.15 -1.53 0.00 0.00 0.00 0.00 0.00 23.12 21.44 3hn5 s ALA 110 CO 0.11 -1.95 0.00 0.41 0.00 0.00 0.00 175.76 174.33 3hn5 n GLY 111 N 4.46 -0.47 3.73 0.00 0.00 -1.26 -4.75 105.19 106.90 3hn5 n GLY 111 Ca 0.06 -1.01 -0.42 0.00 0.00 0.00 0.00 46.02 44.65 3hn5 n GLY 111 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3hn5 s ASN 112 N -4.00 6.46 0.01 1.61 0.01 -1.26 -4.85 114.94 112.92 3hn5 s ASN 112 Ca 0.00 2.80 0.01 0.00 -0.71 0.00 0.00 52.86 54.96 3hn5 s ASN 112 Cb 0.00 -2.61 -0.01 0.00 0.41 0.00 0.00 41.25 39.04 3hn5 s ASN 112 CO 0.00 -0.89 -0.04 -0.89 -1.51 0.00 0.00 177.10 173.78 3hn5 s THR 113 N 0.72 0.23 -0.09 1.60 2.01 -1.26 -5.01 115.64 113.84 3hn5 s THR 113 Ca 0.69 -0.51 0.01 0.00 0.31 0.00 0.00 61.69 62.19 3hn5 s THR 113 Cb -0.47 -0.27 -0.02 0.00 0.01 0.00 0.00 72.50 71.75 3hn5 s THR 113 CO 0.37 -0.18 -0.10 -0.69 -0.69 0.00 0.00 174.62 173.33 3hn5 s VAL 114 N -0.69 3.38 -0.18 3.82 1.01 -1.26 -1.22 120.40 125.26 3hn5 s VAL 114 Ca -0.06 -0.58 -0.04 0.00 0.00 0.00 0.00 61.98 61.30 3hn5 s VAL 114 Cb -0.05 -2.39 0.09 0.00 0.00 0.00 0.00 36.38 34.03 3hn5 s VAL 114 CO -0.00 0.56 0.30 -1.58 0.00 0.00 0.00 175.10 174.38 3hn5 s GLN 115 N -0.30 0.22 0.52 2.72 2.00 -0.18 -4.96 119.66 119.69 3hn5 s GLN 115 Ca 0.03 0.63 -0.06 0.00 -2.00 0.00 0.00 55.36 53.97 3hn5 s GLN 115 Cb -0.13 -0.32 -0.02 0.00 0.80 0.00 0.00 33.01 33.34 3hn5 s GLN 115 CO 0.03 -0.43 0.83 -0.51 -0.50 0.00 0.00 175.29 174.71 3hn5 s ASP 116 N 2.46 6.05 -0.12 6.67 1.01 -1.26 -4.16 116.67 127.31 3hn5 s ASP 116 Ca 0.04 0.88 -0.00 0.00 0.71 0.00 0.00 52.55 54.18 3hn5 s ASP 116 Cb -0.14 -2.08 0.02 0.00 1.01 0.00 0.00 42.92 41.74 3hn5 s ASP 116 CO -0.11 -0.75 -0.10 -0.69 0.21 0.00 0.00 175.17 173.73 3hn5 s VAL 117 N -2.84 1.20 0.01 -1.27 1.01 -0.06 -4.94 120.40 113.50 3hn5 s VAL 117 Ca 0.50 -0.40 -0.19 0.00 0.00 0.00 0.00 61.98 61.90 3hn5 s VAL 117 Cb -0.10 -1.18 -0.06 0.00 0.00 0.00 0.00 36.38 35.04 3hn5 s VAL 117 CO 0.45 0.40 0.53 -0.70 0.00 0.00 0.00 175.10 175.78 3hn5 s GLU 118 N 1.62 4.20 0.19 2.72 2.56 -1.26 -4.26 118.70 124.46 3hn5 s GLU 118 Ca 0.05 0.63 0.01 0.00 0.00 0.00 0.00 54.97 55.66 3hn5 s GLU 118 Cb -0.13 -3.29 -0.05 0.00 2.00 0.00 0.00 34.13 32.66 3hn5 s GLU 118 CO -0.09 0.50 0.02 0.14 -0.56 0.00 0.00 175.26 175.28 3hn5 s VAL 119 N -0.59 0.61 -0.40 3.70 -7.23 -1.26 -4.90 120.40 110.33 3hn5 s VAL 119 Ca 0.28 -1.98 -0.05 0.00 -1.81 0.00 0.00 61.98 58.43 3hn5 s VAL 119 Cb -0.18 -2.21 0.09 0.00 0.56 0.00 0.00 36.38 34.64 3hn5 s VAL 119 CO 0.16 -0.38 0.19 -0.89 -0.31 0.00 0.00 175.10 173.87 3hn5 s THR 120 N -3.70 3.51 0.86 5.32 2.01 -1.26 -4.47 115.64 117.91 3hn5 s THR 120 Ca 0.27 -1.78 -0.11 0.00 0.31 0.00 0.00 61.69 60.38 3hn5 s THR 120 Cb 0.06 -3.28 0.11 0.00 0.01 0.00 0.00 72.50 69.41 3hn5 s THR 120 CO 0.06 -0.56 1.10 -2.84 -0.69 0.00 0.00 174.62 171.69 3hn5 s PRO 121 N 1.24 1.52 -0.07 4.92 0.02 -1.26 -1.57 135.00 139.79 3hn5 s PRO 121 Ca 0.05 1.06 -0.27 0.00 0.02 0.00 0.00 61.00 61.86 3hn5 s PRO 121 Cb -0.23 -1.82 -0.23 0.00 0.02 0.00 0.00 34.50 32.24 3hn5 s PRO 121 CO -0.02 -2.13 1.02 1.88 -0.33 0.00 0.00 177.00 177.42 3hn5 h TYR 122 N -1.48 0.07 -4.04 6.54 0.05 -1.87 -0.60 116.97 115.64 3hn5 h TYR 122 Ca -0.47 -0.03 -0.12 0.00 0.05 0.00 0.00 58.73 58.16 3hn5 h TYR 122 Cb 1.26 -0.01 -0.14 0.00 1.01 0.00 0.00 36.73 38.85 3hn5 h TYR 122 CO 0.49 0.80 -0.49 0.71 -1.05 0.00 0.00 178.16 178.62 3hn5 s TYR 123 N -3.19 0.42 0.09 4.88 2.02 -1.26 -1.26 117.35 119.06 3hn5 s TYR 123 Ca -0.17 -0.86 0.07 0.00 -0.37 0.00 0.00 57.07 55.74 3hn5 s TYR 123 Cb -0.00 -0.22 -0.03 0.00 -0.40 0.00 0.00 41.96 41.31 3hn5 s TYR 123 CO 0.70 -0.54 -0.17 -0.51 -1.57 0.00 0.00 175.55 173.46 3hn5 s LEU 124 N -2.93 2.30 -0.35 -1.29 1.43 -0.13 -4.91 118.68 112.80 3hn5 s LEU 124 Ca 0.11 -0.67 -0.17 0.00 -1.03 0.00 0.00 54.13 52.37 3hn5 s LEU 124 Cb 0.06 -0.67 -0.00 0.00 0.03 0.00 0.00 46.19 45.60 3hn5 s LEU 124 CO -0.06 -0.03 0.48 -0.69 0.23 0.00 0.00 176.35 176.28 3hn5 s VAL 125 N -1.35 5.05 0.21 -1.59 1.01 -1.26 -1.79 120.40 120.68 3hn5 s VAL 125 Ca 0.03 0.25 0.08 0.00 0.00 0.00 0.00 61.98 62.35 3hn5 s VAL 125 Cb -0.09 -3.94 -0.04 0.00 0.00 0.00 0.00 36.38 32.31 3hn5 s VAL 125 CO 0.03 -0.20 -0.02 -0.13 0.00 0.00 0.00 175.10 174.79 3hn5 s ARG 126 N 2.31 2.31 -1.35 2.72 1.81 0.14 -4.68 118.95 122.20 3hn5 s ARG 126 Ca 0.17 -1.25 -0.10 0.00 -1.72 0.00 0.00 55.73 52.84 3hn5 s ARG 126 Cb -0.16 -2.25 0.07 0.00 -0.45 0.00 0.00 34.95 32.16 3hn5 s ARG 126 CO 0.13 0.42 0.55 -0.25 -0.68 0.00 0.00 175.30 175.47 3hn5 n ASP 127 N -0.40 -4.04 -4.74 0.23 8.00 -1.26 -0.50 116.55 113.84 3hn5 n ASP 127 Ca -0.09 -0.43 -0.42 0.00 0.71 0.00 0.00 54.79 54.56 3hn5 n ASP 127 Cb 0.57 -3.32 -0.02 0.00 -0.02 0.00 0.00 41.12 38.33 3hn5 n ASP 127 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3hn5 s ALA 128 N -3.00 3.72 0.28 2.24 0.00 -1.26 -4.47 121.76 119.27 3hn5 s ALA 128 Ca 0.42 1.47 0.04 0.00 0.00 0.00 0.00 51.96 53.89 3hn5 s ALA 128 Cb -0.22 -3.62 -0.03 0.00 0.00 0.00 0.00 23.12 19.25 3hn5 s ALA 128 CO 0.52 -0.87 0.22 -0.65 0.00 0.00 0.00 175.76 174.98 3hn5 s GLN 129 N -0.19 1.55 0.00 0.00 -0.21 -0.45 -5.01 119.66 115.34 3hn5 s GLN 129 Ca 0.63 -1.87 0.00 0.00 0.02 0.00 0.00 55.36 54.14 3hn5 s GLN 129 Cb -0.45 0.28 0.00 0.00 1.00 0.00 0.00 33.01 33.84 3hn5 s GLN 129 CO 0.44 -0.55 0.00 0.25 -2.12 0.00 0.00 175.29 173.31 3hn5 n THR 131 N -0.49 0.00 -3.78 -0.19 -2.24 -0.31 -0.98 114.28 106.29 3hn5 n THR 131 Ca 0.05 0.00 -0.35 0.00 -2.27 0.00 0.00 64.05 61.48 3hn5 n THR 131 Cb 0.64 0.00 -0.08 0.00 -2.10 0.00 0.00 70.33 68.79 3hn5 n THR 131 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 3hn5 s LEU 132 N 0.00 4.18 -0.34 3.22 2.96 -1.26 -1.32 118.68 126.12 3hn5 s LEU 132 Ca 0.00 0.24 -0.01 0.00 -0.22 0.00 0.00 54.13 54.14 3hn5 s LEU 132 Cb 0.00 -2.07 0.12 0.00 0.50 0.00 0.00 46.19 44.73 3hn5 s LEU 132 CO 0.00 0.20 0.16 -1.61 -1.32 0.00 0.00 176.35 173.78 3hn5 s GLU 133 N 0.22 0.66 7.15 1.98 2.02 0.55 -5.01 118.70 126.26 3hn5 s GLU 133 Ca 0.08 -1.19 0.00 0.00 0.02 0.00 0.00 54.97 53.89 3hn5 s GLU 133 Cb -0.11 -1.68 0.00 0.00 0.10 0.00 0.00 34.13 32.43 3hn5 s GLU 133 CO -0.01 -1.08 0.00 0.41 0.02 0.00 0.00 175.26 174.59 3hn5 n GLY 134 N 4.49 3.95 0.37 -1.39 0.00 -1.26 -1.15 105.19 110.21 3hn5 n GLY 134 Ca 0.03 0.09 0.13 0.00 0.00 0.00 0.00 46.02 46.27 3hn5 n GLY 134 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3hn5 n ASN 135 N 7.03 1.15 -4.89 1.61 3.02 -1.26 -4.93 115.26 117.00 3hn5 n ASN 135 Ca 0.00 -1.44 -0.31 0.00 -0.03 0.00 0.00 54.58 52.80 3hn5 n ASN 135 Cb 0.00 -0.02 -0.05 0.00 -0.61 0.00 0.00 39.78 39.10 3hn5 n ASN 135 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 3hn5 s LYS 136 N -1.96 3.33 -0.11 3.52 1.02 -0.30 -0.89 119.74 124.35 3hn5 s LYS 136 Ca 0.38 -0.47 0.03 0.00 0.02 0.00 0.00 55.97 55.93 3hn5 s LYS 136 Cb 0.20 -2.99 -0.00 0.00 -0.52 0.00 0.00 37.83 34.52 3hn5 s LYS 136 CO 0.32 0.61 -0.21 0.08 -0.92 0.00 0.00 175.35 175.23 3hn5 s VAL 137 N -1.46 2.34 -0.20 3.17 1.01 -0.27 -0.33 120.40 124.66 3hn5 s VAL 137 Ca 0.33 -0.91 -0.03 0.00 0.00 0.00 0.00 61.98 61.36 3hn5 s VAL 137 Cb -0.13 -1.93 -0.01 0.00 0.00 0.00 0.00 36.38 34.32 3hn5 s VAL 137 CO 0.25 0.55 -0.06 0.20 0.00 0.00 0.00 175.10 176.04 3hn5 s ASN 138 N 0.40 4.24 -0.03 3.32 0.01 -0.44 -2.48 114.94 119.96 3hn5 s ASN 138 Ca -0.15 -0.38 0.06 0.00 -0.71 0.00 0.00 52.86 51.68 3hn5 s ASN 138 Cb -0.17 -1.71 -0.01 0.00 0.41 0.00 0.00 41.25 39.77 3hn5 s ASN 138 CO 0.07 0.02 -0.20 0.00 -1.51 0.00 0.00 177.10 175.48 3hn5 s ALA 139 N 1.23 1.71 0.19 0.60 0.00 -1.26 -1.16 121.76 123.07 3hn5 s ALA 139 Ca 0.03 -0.86 -0.10 0.00 0.00 0.00 0.00 51.96 51.02 3hn5 s ALA 139 Cb -0.14 -0.47 -0.01 0.00 0.00 0.00 0.00 23.12 22.50 3hn5 s ALA 139 CO -0.02 0.39 0.35 -1.54 0.00 0.00 0.00 175.76 174.94 3hn5 s SER 140 N -0.34 -0.01 0.20 0.00 1.04 -0.15 -1.39 113.70 113.05 3hn5 s SER 140 Ca 0.04 -0.90 -0.24 0.00 0.48 0.00 0.00 55.95 55.33 3hn5 s SER 140 Cb -0.09 0.49 0.05 0.00 0.10 0.00 0.00 66.02 66.56 3hn5 s SER 140 CO 0.00 -0.97 0.87 0.72 0.98 0.00 0.00 173.24 174.84 3hn5 s PHE 141 N -3.99 -0.15 0.00 5.02 -0.71 -0.11 -1.35 117.98 116.69 3hn5 s PHE 141 Ca 0.20 -0.21 0.06 0.00 -1.04 0.00 0.00 56.93 55.94 3hn5 s PHE 141 Cb 0.02 0.67 -0.03 0.00 -1.21 0.00 0.00 43.02 42.47 3hn5 s PHE 141 CO 0.04 -0.98 -0.16 0.15 -1.34 0.00 0.00 175.22 172.92 3hn5 s LYS 142 N -3.52 2.27 -0.03 1.99 1.02 0.34 0.13 119.74 121.94 3hn5 s LYS 142 Ca 0.12 -0.85 -0.29 0.00 0.02 0.00 0.00 55.97 54.97 3hn5 s LYS 142 Cb -0.03 -2.27 -0.03 0.00 -0.52 0.00 0.00 37.83 34.98 3hn5 s LYS 142 CO 0.04 0.58 0.93 0.08 -0.92 0.00 0.00 175.35 176.05 3hn5 s VAL 143 N -0.85 4.89 -0.23 3.17 1.01 -0.39 -0.69 120.40 127.32 3hn5 s VAL 143 Ca 0.14 1.93 -0.04 0.00 0.00 0.00 0.00 61.98 64.01 3hn5 s VAL 143 Cb -0.11 -4.26 -0.00 0.00 0.00 0.00 0.00 36.38 32.01 3hn5 s VAL 143 CO 0.03 0.15 -0.04 -0.70 0.00 0.00 0.00 175.10 174.55 3hn5 s GLU 144 N 1.15 3.27 -0.21 2.72 2.12 -0.74 0.38 118.70 127.39 3hn5 s GLU 144 Ca 0.48 -0.70 -0.19 0.00 0.36 0.00 0.00 54.97 54.92 3hn5 s GLU 144 Cb -0.20 -3.03 -0.03 0.00 0.26 0.00 0.00 34.13 31.13 3hn5 s GLU 144 CO 0.24 -0.25 0.56 0.21 -0.54 0.00 0.00 175.26 175.48 3hn5 s LYS 145 N 1.46 4.18 0.00 4.30 2.20 -1.26 -0.96 119.74 129.66 3hn5 s LYS 145 Ca 0.05 0.47 0.00 0.00 -0.36 0.00 0.00 55.97 56.13 3hn5 s LYS 145 Cb -0.15 -3.58 0.00 0.00 -1.51 0.00 0.00 37.83 32.59 3hn5 s LYS 145 CO -0.03 -0.21 0.00 0.28 -0.36 0.00 0.00 175.35 175.02 3hn5 n VAL 146 N 4.70 0.00 0.08 4.02 0.31 -0.39 -4.80 118.33 122.24 3hn5 n VAL 146 Ca -0.03 0.00 0.03 0.00 -0.01 0.00 0.00 64.34 64.32 3hn5 n VAL 146 Cb 0.50 -0.00 0.39 0.00 -0.91 0.00 0.00 33.84 33.82 3hn5 n VAL 146 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3hn5 h ALA 147 N -0.51 1.55 -0.76 3.52 0.00 -0.85 -3.49 119.26 118.72 3hn5 h ALA 147 Ca 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.76 3hn5 h ALA 147 Cb 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.68 3hn5 h ALA 147 CO 0.00 0.33 0.00 0.41 0.00 0.00 0.00 179.25 179.99 3hn5 n GLY 148 N -1.05 -0.66 0.00 0.00 0.00 -0.63 -5.00 105.19 97.85 3hn5 n GLY 148 Ca 0.00 -1.10 0.00 0.00 0.00 0.00 0.00 46.02 44.92 3hn5 n GLY 148 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hn5 n GLY 149 N 0.00 1.15 0.00 -0.02 0.00 -1.26 -4.85 105.19 100.20 3hn5 n GLY 149 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3hn5 n GLY 149 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hn5 n GLY 150 N 0.00 2.83 3.45 -0.02 0.00 -1.26 -4.63 105.19 105.55 3hn5 n GLY 150 Ca 0.00 -1.88 -0.35 0.00 0.00 0.00 0.00 46.02 43.79 3hn5 n GLY 150 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3hn5 s ILE 151 N -2.66 4.03 -0.06 -0.61 1.01 -1.26 -0.44 121.20 121.20 3hn5 s ILE 151 Ca 0.00 -0.28 -0.16 0.00 0.00 0.00 0.00 60.65 60.21 3hn5 s ILE 151 Cb 0.00 -2.83 -0.30 0.00 0.01 0.00 0.00 42.46 39.34 3hn5 s ILE 151 CO 0.00 0.41 0.71 -0.78 0.00 0.00 0.00 174.94 175.29 3hn5 h ASP 152 N 7.60 0.54 -4.92 3.58 3.58 -1.02 -3.45 116.42 122.33 3hn5 h ASP 152 Ca -0.37 -0.91 -0.00 0.00 0.42 0.00 0.00 57.03 56.18 3hn5 h ASP 152 Cb 1.18 -0.17 -0.14 0.00 1.72 0.00 0.00 39.33 41.91 3hn5 h ASP 152 CO 0.61 1.64 0.26 0.00 -2.88 0.00 0.00 179.24 178.88 3hn5 s ARG 153 N -2.51 1.16 0.04 0.28 1.70 -1.21 -4.90 118.95 113.50 3hn5 s ARG 153 Ca -0.16 -0.33 0.04 0.00 -0.47 0.00 0.00 55.73 54.82 3hn5 s ARG 153 Cb 0.04 0.53 -0.02 0.00 -0.57 0.00 0.00 34.95 34.93 3hn5 s ARG 153 CO 0.83 -0.49 -0.13 0.14 -1.08 0.00 0.00 175.30 174.58 3hn5 s VAL 154 N -3.22 0.98 0.14 4.99 -7.23 -0.92 -1.25 120.40 113.90 3hn5 s VAL 154 Ca -0.00 -0.98 -0.20 0.00 -1.81 0.00 0.00 61.98 58.99 3hn5 s VAL 154 Cb -0.01 -0.91 0.05 0.00 0.56 0.00 0.00 36.38 36.07 3hn5 s VAL 154 CO -0.09 -0.06 0.50 0.72 -0.31 0.00 0.00 175.10 175.86 3hn5 s PHE 155 N -0.91 -0.37 0.00 2.82 -0.71 -0.75 -0.78 117.98 117.27 3hn5 s PHE 155 Ca -0.00 0.11 0.00 0.00 -1.04 0.00 0.00 56.93 55.99 3hn5 s PHE 155 Cb -0.08 0.41 0.00 0.00 -1.21 0.00 0.00 43.02 42.14 3hn5 s PHE 155 CO 0.01 -0.78 0.00 1.97 -1.34 0.00 0.00 175.22 175.08 3hn5 n PHE 156 N -0.31 0.00 -3.60 3.49 1.16 -0.47 -0.75 117.46 116.98 3hn5 n PHE 156 Ca -0.16 0.00 -0.10 0.00 -1.87 0.00 0.00 57.45 55.32 3hn5 n PHE 156 Cb 0.64 0.00 -0.06 0.00 -1.61 0.00 0.00 39.48 38.45 3hn5 n PHE 156 CO 0.00 0.00 0.00 -0.51 -1.87 0.00 0.00 176.76 174.38 3hn5 s LEU 158 N 0.00 -0.38 0.10 5.98 1.43 0.35 -0.95 118.68 125.22 3hn5 s LEU 158 Ca 0.00 0.55 -0.24 0.00 -1.03 0.00 0.00 54.13 53.41 3hn5 s LEU 158 Cb 0.00 1.82 0.07 0.00 0.03 0.00 0.00 46.19 48.11 3hn5 s LEU 158 CO 0.00 -0.25 0.59 -0.55 0.23 0.00 0.00 176.35 176.37 3hn5 s SER 159 N -0.59 -0.55 0.07 2.29 0.15 -0.23 -1.68 113.70 113.16 3hn5 s SER 159 Ca 0.01 0.15 0.25 0.00 0.70 0.00 0.00 55.95 57.06 3hn5 s SER 159 Cb -0.02 0.56 0.60 0.00 -1.71 0.00 0.00 66.02 65.45 3hn5 s SER 159 CO -0.02 -0.86 1.51 0.35 1.20 0.00 0.00 173.24 175.42 3hn5 n THR 160 N -0.00 0.20 -4.53 6.45 -2.24 -1.26 -0.49 114.28 112.40 3hn5 n THR 160 Ca -0.18 -0.14 -0.25 0.00 -2.27 0.00 0.00 64.05 61.22 3hn5 n THR 160 Cb 0.63 -0.11 -0.10 0.00 -2.10 0.00 0.00 70.33 68.64 3hn5 n THR 160 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 3hn5 s THR 161 N -3.07 1.30 -0.77 4.28 -4.23 -1.26 -4.64 115.64 107.24 3hn5 s THR 161 Ca 0.10 -2.00 0.23 0.00 -1.18 0.00 0.00 61.69 58.84 3hn5 s THR 161 Cb 0.16 -2.72 0.23 0.00 1.34 0.00 0.00 72.50 71.51 3hn5 s THR 161 CO 0.67 0.00 1.71 0.00 -0.54 0.00 0.00 174.62 176.46 3hn5 n GLN 162 N -0.84 0.13 -2.89 3.99 10.64 -1.26 -4.46 117.38 122.68 3hn5 n GLN 162 Ca -0.05 0.25 -0.44 0.00 -1.83 0.00 0.00 57.00 54.93 3hn5 n GLN 162 Cb 0.66 -1.69 -0.01 0.00 -0.86 0.00 0.00 30.24 28.34 3hn5 n GLN 162 CO 0.00 0.00 0.00 -0.06 -1.83 0.00 0.00 177.06 175.17 3hn5 s PHE 163 N -3.13 3.21 -0.11 2.61 0.08 -1.26 -4.94 117.98 114.44 3hn5 s PHE 163 Ca 0.08 -1.67 0.03 0.00 0.12 0.00 0.00 56.93 55.50 3hn5 s PHE 163 Cb 0.12 -4.35 0.01 0.00 -0.57 0.00 0.00 43.02 38.23 3hn5 s PHE 163 CO 0.44 -1.50 -0.22 0.08 -0.10 0.00 0.00 175.22 173.92 3hn5 s VAL 164 N 2.48 1.95 0.19 -0.44 1.01 -1.26 -4.69 120.40 119.65 3hn5 s VAL 164 Ca 0.39 -0.94 -0.10 0.00 0.00 0.00 0.00 61.98 61.33 3hn5 s VAL 164 Cb -0.03 -1.71 0.04 0.00 0.00 0.00 0.00 36.38 34.68 3hn5 s VAL 164 CO -0.05 0.53 0.52 -0.46 0.00 0.00 0.00 175.10 175.65 3hn5 n ASN 165 N 3.78 -1.27 0.27 3.32 0.23 -0.51 -4.98 115.26 116.11 3hn5 n ASN 165 Ca -0.20 -1.82 0.13 0.00 -0.53 0.00 0.00 54.58 52.17 3hn5 n ASN 165 Cb 0.52 2.10 0.81 0.00 -2.08 0.00 0.00 39.78 41.13 3hn5 n ASN 165 CO 0.00 0.00 0.00 -2.24 -0.93 0.00 0.00 177.26 174.09 3hn5 h ASP 166 N 1.19 0.00 0.00 0.53 3.04 -1.98 -2.90 116.42 116.30 3hn5 h ASP 166 Ca -0.19 0.00 -0.31 0.00 -3.24 0.00 0.00 57.03 53.29 3hn5 h ASP 166 Cb 0.73 0.00 -0.06 0.00 -1.04 0.00 0.00 39.33 38.97 3hn5 h ASP 166 CO 0.24 0.00 -2.24 0.00 -2.04 0.00 0.00 179.24 175.20 3hn5 n ALA 167 N -2.40 1.65 -2.99 4.15 0.00 -1.26 -4.90 120.51 114.76 3hn5 n ALA 167 Ca -0.02 -1.16 -0.39 0.00 0.00 0.00 0.00 53.44 51.86 3hn5 n ALA 167 Cb 0.12 -0.20 -0.12 0.00 0.00 0.00 0.00 19.45 19.25 3hn5 n ALA 167 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 3hn5 s GLU 168 N -2.54 2.74 -0.44 0.00 2.02 -1.09 -4.98 118.70 114.42 3hn5 s GLU 168 Ca -0.09 -1.12 0.02 0.00 0.02 0.00 0.00 54.97 53.80 3hn5 s GLU 168 Cb 0.06 -3.62 0.19 0.00 0.10 0.00 0.00 34.13 30.87 3hn5 s GLU 168 CO 0.77 -0.68 0.83 -3.38 0.02 0.00 0.00 175.26 172.81 3hn5 s HIS 169 N 1.49 -1.21 -2.02 1.61 -3.43 -1.26 -1.42 115.29 109.06 3hn5 s HIS 169 Ca 0.00 -0.23 0.07 0.00 -0.80 0.00 0.00 55.06 54.11 3hn5 s HIS 169 Cb -0.19 0.23 0.34 0.00 -1.43 0.00 0.00 32.58 31.53 3hn5 s HIS 169 CO 0.05 -0.91 1.23 0.27 -2.00 0.00 0.00 174.74 173.38 3hn5 n ASN 170 N 3.24 0.41 -0.02 7.38 0.23 -1.17 -3.28 115.26 122.05 3hn5 n ASN 170 Ca 0.14 -1.86 -0.05 0.00 -0.53 0.00 0.00 54.58 52.28 3hn5 n ASN 170 Cb 0.59 -0.05 -0.02 0.00 -2.08 0.00 0.00 39.78 38.23 3hn5 n ASN 170 CO 0.00 0.00 0.00 0.52 -0.93 0.00 0.00 177.26 176.85 3hn5 n VAL 171 N -0.34 0.43 -3.52 3.53 0.31 -0.67 -4.83 118.33 113.22 3hn5 n VAL 171 Ca 0.06 -0.02 -0.08 0.00 -0.01 0.00 0.00 64.34 64.29 3hn5 n VAL 171 Cb 0.08 -1.60 -0.02 0.00 -0.91 0.00 0.00 33.84 31.40 3hn5 n VAL 171 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 3hn5 s ASP 172 N -5.55 -0.37 -0.02 4.52 2.15 -0.94 -4.90 116.67 111.55 3hn5 s ASP 172 Ca -0.07 -0.05 0.00 0.00 0.43 0.00 0.00 52.55 52.86 3hn5 s ASP 172 Cb 0.03 0.43 0.02 0.00 -0.30 0.00 0.00 42.92 43.10 3hn5 s ASP 172 CO 0.09 -0.71 -0.00 -0.60 -0.17 0.00 0.00 175.17 173.78 3hn5 s ARG 173 N -3.23 0.28 -0.09 4.34 3.52 -1.26 -0.49 118.95 122.00 3hn5 s ARG 173 Ca 0.05 0.05 -0.00 0.00 -0.13 0.00 0.00 55.73 55.70 3hn5 s ARG 173 Cb -0.01 -0.43 0.02 0.00 -1.56 0.00 0.00 34.95 32.98 3hn5 s ARG 173 CO -0.08 -0.10 -0.05 -0.47 -0.81 0.00 0.00 175.30 173.79 3hn5 s TYR 174 N 0.82 1.17 0.01 5.12 5.04 -0.12 -5.00 117.35 124.40 3hn5 s TYR 174 Ca -0.08 -0.51 0.02 0.00 -2.44 0.00 0.00 57.07 54.05 3hn5 s TYR 174 Cb -0.11 -1.05 -0.04 0.00 0.35 0.00 0.00 41.96 41.11 3hn5 s TYR 174 CO -0.01 -0.42 0.02 -0.51 -1.34 0.00 0.00 175.55 173.28 3hn5 s ASP 175 N 1.69 5.21 -0.00 4.32 1.11 -1.26 -1.37 116.67 126.37 3hn5 s ASP 175 Ca 0.03 -0.00 0.05 0.00 0.18 0.00 0.00 52.55 52.81 3hn5 s ASP 175 Cb -0.13 -1.37 -0.01 0.00 1.07 0.00 0.00 42.92 42.48 3hn5 s ASP 175 CO -0.06 0.26 -0.17 -1.61 1.18 0.00 0.00 175.17 174.77 3hn5 s GLU 176 N -1.69 1.35 0.00 8.23 2.02 0.04 -5.00 118.70 123.65 3hn5 s GLU 176 Ca 0.21 -0.65 0.00 0.00 0.02 0.00 0.00 54.97 54.55 3hn5 s GLU 176 Cb -0.12 -1.33 0.00 0.00 0.10 0.00 0.00 34.13 32.79 3hn5 s GLU 176 CO 0.12 0.36 0.09 0.25 0.02 0.00 0.00 175.26 176.10 3hn5 n THR 177 N 2.53 0.00 -2.71 3.63 -2.24 -1.26 -2.17 114.28 112.06 3hn5 n THR 177 Ca -0.15 -0.20 -0.37 0.00 -2.27 0.00 0.00 64.05 61.06 3hn5 n THR 177 Cb 0.54 1.26 -0.06 0.00 -2.10 0.00 0.00 70.33 69.97 3hn5 n THR 177 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 3hn5 s ASP 178 N -0.22 7.24 -1.81 3.42 1.01 -1.26 -4.40 116.67 120.64 3hn5 s ASP 178 Ca 0.00 1.91 0.00 0.00 0.71 0.00 0.00 52.55 55.17 3hn5 s ASP 178 Cb 0.00 -2.59 0.00 0.00 1.01 0.00 0.00 42.92 41.34 3hn5 s ASP 178 CO 0.00 -0.14 0.00 0.59 0.21 0.00 0.00 175.17 175.83 3hn5 n ASN 179 N 0.52 -5.33 0.29 0.27 3.02 -1.26 -4.84 115.26 107.93 3hn5 n ASN 179 Ca 0.02 0.42 0.16 0.00 -0.03 0.00 0.00 54.58 55.16 3hn5 n ASN 179 Cb 0.49 -4.34 0.84 0.00 -0.61 0.00 0.00 39.78 36.17 3hn5 n ASN 179 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 3hn5 h LEU 180 N 0.00 0.00 -1.61 3.41 3.38 -1.89 0.86 115.31 119.46 3hn5 h LEU 180 Ca -0.35 0.00 0.02 0.00 0.09 0.00 0.00 57.88 57.64 3hn5 h LEU 180 Cb 1.21 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.93 3hn5 h LEU 180 CO 0.51 0.06 0.30 0.44 0.09 0.00 0.00 178.44 179.84 3hn5 h ASP 181 N 0.00 0.44 0.45 -0.43 3.32 -1.88 -0.99 116.42 117.33 3hn5 h ASP 181 Ca -0.00 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.04 3hn5 h ASP 181 Cb 0.29 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 39.74 3hn5 h ASP 181 CO 0.01 0.31 0.00 0.00 -1.72 0.00 0.00 179.24 177.84 3hn5 n ALA 182 N -2.48 1.49 0.06 3.45 0.00 0.29 -2.34 120.51 120.98 3hn5 n ALA 182 Ca 0.04 0.04 0.07 0.00 0.00 0.00 0.00 53.44 53.59 3hn5 n ALA 182 Cb 0.13 -1.27 0.14 0.00 0.00 0.00 0.00 19.45 18.45 3hn5 n ALA 182 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3hn5 n TYR 183 N -1.87 0.37 -1.48 0.00 4.02 -0.38 -4.86 117.16 112.96 3hn5 n TYR 183 Ca 0.02 -0.33 -0.40 0.00 -0.01 0.00 0.00 57.90 57.18 3hn5 n TYR 183 Cb 0.15 -0.01 -0.02 0.00 -0.02 0.00 0.00 39.34 39.44 3hn5 n TYR 183 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 176.86 172.38 3hn5 n ASP 184 N 0.74 7.43 -3.63 7.72 2.03 -0.99 -4.72 116.55 125.13 3hn5 n ASP 184 Ca 0.12 -2.68 -0.13 0.00 0.52 0.00 0.00 54.79 52.62 3hn5 n ASP 184 Cb 0.42 -1.57 -0.07 0.00 -0.72 0.00 0.00 41.12 39.18 3hn5 n ASP 184 CO 0.00 0.00 0.00 -0.70 -1.92 0.00 0.00 177.20 174.58 3hn5 s GLU 185 N 2.18 0.79 0.17 -0.67 2.56 -1.26 -5.04 118.70 117.43 3hn5 s GLU 185 Ca 0.63 0.99 -0.34 0.00 0.00 0.00 0.00 54.97 56.25 3hn5 s GLU 185 Cb 0.17 0.36 -0.15 0.00 2.00 0.00 0.00 34.13 36.51 3hn5 s GLU 185 CO -0.07 -0.10 1.42 2.41 -0.56 0.00 0.00 175.26 178.36 3hn5 n THR 186 N 2.87 0.40 0.00 -1.70 -1.04 -1.26 -2.46 114.28 111.09 3hn5 n THR 186 Ca -0.15 -0.10 0.00 0.00 -2.04 0.00 0.00 64.05 61.76 3hn5 n THR 186 Cb 0.56 -1.27 0.00 0.00 -1.82 0.00 0.00 70.33 67.80 3hn5 n THR 186 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3hn5 n GLY 187 N 2.67 2.19 3.70 3.41 0.00 0.16 -4.95 105.19 112.36 3hn5 n GLY 187 Ca 0.15 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.75 3hn5 n GLY 187 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hn5 s LYS 188 N -0.83 4.14 -0.18 1.61 -0.14 -1.03 -4.71 119.74 118.59 3hn5 s LYS 188 Ca 0.00 2.58 -0.24 0.00 -1.36 0.00 0.00 55.97 56.95 3hn5 s LYS 188 Cb 0.00 -3.44 -0.02 0.00 -1.68 0.00 0.00 37.83 32.70 3hn5 s LYS 188 CO 0.00 -0.80 0.76 -1.17 -0.76 0.00 0.00 175.35 173.38 3hn5 s LEU 189 N 2.25 4.16 -0.20 3.17 2.96 -1.26 -1.26 118.68 128.50 3hn5 s LEU 189 Ca 0.78 1.05 -0.04 0.00 -0.22 0.00 0.00 54.13 55.71 3hn5 s LEU 189 Cb -0.47 -3.11 -0.02 0.00 0.50 0.00 0.00 46.19 43.09 3hn5 s LEU 189 CO 0.35 -0.36 -0.03 -0.47 -1.32 0.00 0.00 176.35 174.52 3hn5 s TYR 190 N 2.08 2.99 -0.22 5.38 6.14 0.12 -4.98 117.35 128.86 3hn5 s TYR 190 Ca 0.35 -0.59 -0.02 0.00 0.64 0.00 0.00 57.07 57.45 3hn5 s TYR 190 Cb -0.16 -2.06 0.01 0.00 0.42 0.00 0.00 41.96 40.17 3hn5 s TYR 190 CO 0.12 -0.30 -0.09 0.99 0.64 0.00 0.00 175.55 176.90 3hn5 s THR 191 N 1.02 2.83 0.62 4.34 2.01 -1.26 -0.94 115.64 124.26 3hn5 s THR 191 Ca 0.01 -0.79 -0.17 0.00 0.31 0.00 0.00 61.69 61.05 3hn5 s THR 191 Cb -0.15 -2.31 -0.02 0.00 0.01 0.00 0.00 72.50 70.03 3hn5 s THR 191 CO 0.01 0.39 1.14 -0.36 -0.69 0.00 0.00 174.62 175.11 3hn5 s PHE 192 N 1.38 2.53 0.49 4.92 0.08 -0.48 -5.02 117.98 121.87 3hn5 s PHE 192 Ca 0.04 1.55 -0.23 0.00 0.12 0.00 0.00 56.93 58.41 3hn5 s PHE 192 Cb -0.15 -3.29 -0.07 0.00 -0.57 0.00 0.00 43.02 38.94 3hn5 s PHE 192 CO -0.06 -1.85 1.25 0.00 -0.10 0.00 0.00 175.22 174.46 3hn5 n ALA 193 N -2.01 1.19 -1.77 5.36 0.00 -1.26 -4.64 120.51 117.39 3hn5 n ALA 193 Ca 0.12 0.18 -0.40 0.00 0.00 0.00 0.00 53.44 53.34 3hn5 n ALA 193 Cb 0.51 -2.27 -0.02 0.00 0.00 0.00 0.00 19.45 17.67 3hn5 n ALA 193 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 3hn5 s THR 194 N -1.28 2.99 -0.05 0.00 2.01 -1.26 -4.82 115.64 113.23 3hn5 s THR 194 Ca 0.67 0.94 0.06 0.00 0.31 0.00 0.00 61.69 63.66 3hn5 s THR 194 Cb -0.47 -3.57 -0.01 0.00 0.01 0.00 0.00 72.50 68.46 3hn5 s THR 194 CO 0.54 0.18 -0.23 -0.13 -0.69 0.00 0.00 174.62 174.29 3hn5 s ARG 195 N -1.92 2.27 -0.12 4.92 1.81 -1.04 -4.98 118.95 119.89 3hn5 s ARG 195 Ca 0.51 -0.81 -0.04 0.00 -1.72 0.00 0.00 55.73 53.68 3hn5 s ARG 195 Cb -0.35 -1.95 -0.03 0.00 -0.45 0.00 0.00 34.95 32.16 3hn5 s ARG 195 CO 0.46 0.35 0.01 0.34 -0.68 0.00 0.00 175.30 175.77 3hn5 s ASP 196 N -0.13 5.24 -0.17 0.23 -1.08 -1.26 -1.11 116.67 118.39 3hn5 s ASP 196 Ca -0.03 0.07 0.14 0.00 -0.52 0.00 0.00 52.55 52.21 3hn5 s ASP 196 Cb -0.13 -1.67 0.39 0.00 -1.46 0.00 0.00 42.92 40.05 3hn5 s ASP 196 CO 0.03 0.28 1.20 -1.22 0.52 0.00 0.00 175.17 175.98 3hn5 n TYR 197 N 2.79 0.00 -0.23 -5.34 4.01 -0.07 -4.86 117.16 113.46 3hn5 n TYR 197 Ca -0.18 -1.28 0.00 0.00 -0.16 0.00 0.00 57.90 56.28 3hn5 n TYR 197 Cb 0.53 -0.22 0.08 0.00 -0.31 0.00 0.00 39.34 39.42 3hn5 n TYR 197 CO 0.00 0.00 0.00 1.15 -0.46 0.00 0.00 176.86 177.55 3hn5 h THR 198 N 1.55 0.34 -0.47 -0.72 2.02 -1.96 -2.55 112.91 111.12 3hn5 h THR 198 Ca -0.02 -0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.15 3hn5 h THR 198 Cb 1.10 0.33 0.00 0.00 -1.74 0.00 0.00 68.15 67.84 3hn5 h THR 198 CO 0.01 0.00 0.00 0.47 0.37 0.00 0.00 175.52 176.37 3hn5 n ASP 199 N -5.43 3.00 -4.56 4.18 9.92 -1.26 -4.87 116.55 117.52 3hn5 n ASP 199 Ca 0.09 -1.95 -0.42 0.00 -0.53 0.00 0.00 54.79 51.97 3hn5 n ASP 199 Cb 0.35 -0.31 -0.03 0.00 -0.64 0.00 0.00 41.12 40.49 3hn5 n ASP 199 CO 0.00 0.00 0.00 0.21 0.13 0.00 0.00 177.20 177.54 3hn5 s ASN 200 N -1.22 6.41 0.00 -2.24 3.84 -0.96 -5.04 114.94 115.74 3hn5 s ASN 200 Ca 0.38 -0.04 0.00 0.00 0.21 0.00 0.00 52.86 53.41 3hn5 s ASN 200 Cb 0.21 -2.51 0.00 0.00 -0.55 0.00 0.00 41.25 38.39 3hn5 s ASN 200 CO 0.28 -1.38 0.11 -1.20 -2.79 0.00 0.00 177.10 172.11 3hn5 n SER 201 N 8.07 0.29 0.00 -4.21 7.64 -1.26 -0.31 113.62 123.83 3hn5 n SER 201 Ca 0.06 -0.28 0.00 0.00 1.01 0.00 0.00 58.87 59.66 3hn5 n SER 201 Cb 0.48 -0.07 0.00 0.00 -1.01 0.00 0.00 64.21 63.62 3hn5 n SER 201 CO 0.00 0.00 0.00 0.33 -3.01 0.00 0.00 175.04 172.36 3hn5 n PHE 203 N 0.70 0.00 0.13 1.43 -0.00 -1.26 -0.03 117.46 118.42 3hn5 n PHE 203 Ca 0.00 0.00 0.03 0.00 -0.00 0.00 0.00 57.45 57.48 3hn5 n PHE 203 Cb 0.05 0.00 0.43 0.00 -0.00 0.00 0.00 39.48 39.96 3hn5 n PHE 203 CO 0.00 0.00 0.00 1.96 -0.00 0.00 0.00 176.76 178.72 3hn5 h GLN 204 N 0.00 0.23 -0.29 -4.13 1.08 -0.93 0.23 115.11 111.31 3hn5 h GLN 204 Ca 0.00 -0.04 -0.14 0.00 -1.45 0.00 0.00 58.65 57.02 3hn5 h GLN 204 Cb 0.00 -0.04 -0.00 0.00 -0.05 0.00 0.00 27.48 27.39 3hn5 h GLN 204 CO 0.00 0.32 -0.37 1.15 -0.95 0.00 0.00 178.83 178.98 3hn5 h THR 205 N 0.22 1.30 -0.24 -0.54 2.02 -0.67 -1.14 112.91 113.86 3hn5 h THR 205 Ca 0.05 -1.56 -0.00 0.00 0.77 0.00 0.00 66.41 65.67 3hn5 h THR 205 Cb 0.28 1.61 -0.01 0.00 -1.74 0.00 0.00 68.15 68.29 3hn5 h THR 205 CO 0.01 0.50 0.14 0.00 0.37 0.00 0.00 175.52 176.54 3hn5 h ALA 206 N 0.69 0.31 -0.09 6.16 0.00 -1.21 0.49 119.26 125.62 3hn5 h ALA 206 Ca 0.03 -0.06 0.04 0.00 0.00 0.00 0.00 54.91 54.93 3hn5 h ALA 206 Cb 0.96 -0.10 -0.06 0.00 0.00 0.00 0.00 17.79 18.59 3hn5 h ALA 206 CO 0.09 -0.17 -0.41 -0.07 0.00 0.00 0.00 179.25 178.69 3hn5 h LEU 207 N 0.29 -1.27 -1.15 0.00 4.07 -0.59 0.57 115.31 117.22 3hn5 h LEU 207 Ca 0.09 0.17 -0.03 0.00 0.08 0.00 0.00 57.88 58.18 3hn5 h LEU 207 Cb 0.05 0.51 -0.03 0.00 1.08 0.00 0.00 40.66 42.27 3hn5 h LEU 207 CO -0.01 -0.43 0.21 0.11 -1.08 0.00 0.00 178.44 177.23 3hn5 h LYS 208 N -0.51 0.80 0.00 1.13 6.56 -0.70 0.53 116.57 124.38 3hn5 h LYS 208 Ca 0.07 -0.13 -0.01 0.00 -1.06 0.00 0.00 60.65 59.53 3hn5 h LYS 208 Cb 0.63 -0.14 -0.00 0.00 -0.57 0.00 0.00 32.23 32.15 3hn5 h LYS 208 CO -0.37 0.67 -0.04 0.00 -2.06 0.00 0.00 179.45 177.66 3hn5 h ARG 209 N 0.79 0.00 0.00 3.15 3.08 0.09 -3.47 114.38 118.01 3hn5 h ARG 209 Ca 0.19 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.24 3hn5 h ARG 209 Cb 0.17 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.22 3hn5 h ARG 209 CO -0.02 0.04 0.00 0.41 -1.07 0.00 0.00 179.97 179.33 3hn5 n GLY 210 N 0.81 0.84 2.58 0.04 0.00 0.16 -5.03 105.19 104.58 3hn5 n GLY 210 Ca 0.03 -0.63 -0.28 0.00 0.00 0.00 0.00 46.02 45.13 3hn5 n GLY 210 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3hn5 s THR 211 N -2.00 0.97 -0.13 2.61 -4.23 0.13 -4.77 115.64 108.21 3hn5 s THR 211 Ca 0.00 -2.62 0.01 0.00 -1.18 0.00 0.00 61.69 57.90 3hn5 s THR 211 Cb 0.00 -1.67 0.02 0.00 1.34 0.00 0.00 72.50 72.19 3hn5 s THR 211 CO 0.00 -1.04 -0.13 -0.22 -0.54 0.00 0.00 174.62 172.69 3hn5 s LEU 212 N 0.19 1.61 0.11 4.79 2.96 0.10 -4.51 118.68 123.93 3hn5 s LEU 212 Ca 0.23 -0.44 0.06 0.00 -0.22 0.00 0.00 54.13 53.76 3hn5 s LEU 212 Cb -0.12 -1.09 -0.04 0.00 0.50 0.00 0.00 46.19 45.43 3hn5 s LEU 212 CO -0.08 -0.05 -0.01 -0.36 -1.32 0.00 0.00 176.35 174.53 3hn5 s PHE 213 N 1.38 2.93 0.14 5.38 0.40 0.35 0.75 117.98 129.31 3hn5 s PHE 213 Ca 0.02 -0.07 -0.04 0.00 -0.60 0.00 0.00 56.93 56.24 3hn5 s PHE 213 Cb -0.13 -1.49 -0.03 0.00 0.51 0.00 0.00 43.02 41.88 3hn5 s PHE 213 CO -0.08 0.48 0.13 0.20 0.70 0.00 0.00 175.22 176.66 3hn5 s GLY 214 N -2.45 0.84 0.06 4.36 0.00 0.77 -1.07 107.32 109.83 3hn5 s GLY 214 Ca 0.26 -1.29 -0.25 0.00 0.00 0.00 0.00 44.72 43.44 3hn5 s GLY 214 CO 0.18 -1.19 0.59 -1.60 0.00 0.00 0.00 173.10 171.08 3hn5 s ARG 215 N -4.03 1.13 0.06 2.90 3.52 -1.26 -0.77 118.95 120.50 3hn5 s ARG 215 Ca 0.22 -0.19 0.08 0.00 -0.13 0.00 0.00 55.73 55.71 3hn5 s ARG 215 Cb 0.06 0.52 -0.03 0.00 -1.56 0.00 0.00 34.95 33.95 3hn5 s ARG 215 CO 0.02 -0.43 -0.22 0.42 -0.81 0.00 0.00 175.30 174.28 3hn5 s ILE 216 N -2.59 1.75 -0.03 4.11 1.01 -1.26 -4.36 121.20 119.83 3hn5 s ILE 216 Ca -0.04 -1.31 0.03 0.00 0.00 0.00 0.00 60.65 59.32 3hn5 s ILE 216 Cb -0.01 -1.54 0.00 0.00 0.01 0.00 0.00 42.46 40.93 3hn5 s ILE 216 CO -0.03 0.17 -0.10 0.00 0.00 0.00 0.00 174.94 174.98 3hn5 s ILE 218 N 0.23 4.90 -0.45 0.00 1.01 -0.31 -1.82 121.20 124.76 3hn5 s ILE 218 Ca -0.04 0.02 -0.15 0.00 0.00 0.00 0.00 60.65 60.47 3hn5 s ILE 218 Cb -0.09 -3.26 0.06 0.00 0.01 0.00 0.00 42.46 39.17 3hn5 s ILE 218 CO 0.01 0.38 0.37 0.86 0.00 0.00 0.00 174.94 176.57 3hn5 s TRP 219 N 0.94 3.24 0.35 3.97 -0.11 -0.38 -1.18 118.94 125.77 3hn5 s TRP 219 Ca 0.05 -0.80 -0.27 0.00 1.22 0.00 0.00 56.10 56.30 3hn5 s TRP 219 Cb -0.14 -3.00 -0.09 0.00 -1.50 0.00 0.00 33.47 28.74 3hn5 s TRP 219 CO 0.03 -0.74 1.17 -2.14 -4.62 0.00 0.00 176.95 170.65 3hn5 s PRO 220 N 1.69 4.28 0.19 5.86 0.02 -1.26 -0.45 135.00 145.33 3hn5 s PRO 220 Ca 0.05 1.87 -0.33 0.00 0.02 0.00 0.00 61.00 62.61 3hn5 s PRO 220 Cb -0.22 -2.88 -0.13 0.00 0.02 0.00 0.00 34.50 31.29 3hn5 s PRO 220 CO 0.08 -0.14 1.60 1.63 -0.33 0.00 0.00 177.00 179.84 3hn5 n LYS 221 N 0.50 2.33 0.00 5.54 5.02 0.41 -1.85 118.16 130.11 3hn5 n LYS 221 Ca 0.02 0.84 0.00 0.00 -2.02 0.00 0.00 58.31 57.15 3hn5 n LYS 221 Cb 0.45 -2.62 0.00 0.00 -0.02 0.00 0.00 35.03 32.84 3hn5 n LYS 221 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3hn5 n GLY 222 N 3.38 1.74 3.86 0.72 0.00 -1.26 -4.76 105.19 108.87 3hn5 n GLY 222 Ca 0.16 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.84 3hn5 n GLY 222 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3hn5 s SER 223 N -2.38 6.71 0.00 1.61 0.15 -0.77 -4.97 113.70 114.05 3hn5 s SER 223 Ca 0.00 0.98 0.29 0.00 0.70 0.00 0.00 55.95 57.93 3hn5 s SER 223 Cb 0.00 -2.25 1.35 0.00 -1.71 0.00 0.00 66.02 63.41 3hn5 s SER 223 CO 0.00 0.02 1.92 -0.90 1.20 0.00 0.00 173.24 175.48 3hn5 n ASP 224 N 0.33 0.78 -3.75 5.45 5.75 -1.26 -4.88 116.55 118.97 3hn5 n ASP 224 Ca -0.02 -1.12 -0.13 0.00 -0.01 0.00 0.00 54.79 53.50 3hn5 n ASP 224 Cb 0.52 -0.01 -0.09 0.00 -1.03 0.00 0.00 41.12 40.51 3hn5 n ASP 224 CO 0.00 0.00 0.00 -1.10 -0.11 0.00 0.00 177.20 175.99 3hn5 s GLN 225 N -2.12 0.65 0.58 0.11 -1.52 -1.26 -4.91 119.66 111.20 3hn5 s GLN 225 Ca 0.39 -0.11 -0.14 0.00 -1.95 0.00 0.00 55.36 53.55 3hn5 s GLN 225 Cb 0.21 0.29 -0.05 0.00 -0.22 0.00 0.00 33.01 33.24 3hn5 s GLN 225 CO 0.38 -0.17 1.02 0.20 -0.25 0.00 0.00 175.29 176.47 3hn5 s GLY 226 N -1.17 1.89 0.05 3.09 0.00 -1.26 -4.44 107.32 105.48 3hn5 s GLY 226 Ca -0.12 0.11 0.04 0.00 0.00 0.00 0.00 44.72 44.76 3hn5 s GLY 226 CO 0.04 0.40 -0.05 -1.50 0.00 0.00 0.00 173.10 171.99 3hn5 s ILE 227 N -2.83 3.73 0.21 0.90 1.10 -0.32 -4.57 121.20 119.42 3hn5 s ILE 227 Ca 0.58 -0.92 0.06 0.00 -0.51 0.00 0.00 60.65 59.86 3hn5 s ILE 227 Cb -0.12 -2.69 -0.05 0.00 0.15 0.00 0.00 42.46 39.75 3hn5 s ILE 227 CO 0.42 0.26 -0.09 -0.31 -2.11 0.00 0.00 174.94 173.12 3hn5 s TYR 228 N -1.13 1.63 0.92 3.50 1.51 -0.79 -1.16 117.35 121.83 3hn5 s TYR 228 Ca 0.20 -0.71 -0.12 0.00 -1.01 0.00 0.00 57.07 55.43 3hn5 s TYR 228 Cb -0.11 -0.85 0.14 0.00 -0.11 0.00 0.00 41.96 41.03 3hn5 s TYR 228 CO 0.12 0.20 1.11 -1.54 -1.11 0.00 0.00 175.55 174.33 3hn5 s SER 229 N -3.31 3.37 0.75 2.29 1.04 0.26 -4.42 113.70 113.68 3hn5 s SER 229 Ca 0.24 1.16 -0.14 0.00 0.48 0.00 0.00 55.95 57.68 3hn5 s SER 229 Cb 0.02 -1.80 0.05 0.00 0.10 0.00 0.00 66.02 64.39 3hn5 s SER 229 CO 0.07 -2.66 1.20 -0.54 0.98 0.00 0.00 173.24 172.29 3hn5 s LYS 230 N -5.11 2.05 0.35 4.02 1.02 -1.26 -4.70 119.74 116.11 3hn5 s LYS 230 Ca 0.64 1.72 -0.28 0.00 0.02 0.00 0.00 55.97 58.07 3hn5 s LYS 230 Cb -0.16 -1.83 -0.12 0.00 -0.52 0.00 0.00 37.83 35.20 3hn5 s LYS 230 CO 0.55 -1.89 1.44 0.28 -0.92 0.00 0.00 175.35 174.81 3hn5 n VAL 231 N -2.87 1.84 -5.24 3.17 0.31 -1.26 -4.69 118.33 109.60 3hn5 n VAL 231 Ca 0.13 -0.46 -0.32 0.00 -0.01 0.00 0.00 64.34 63.68 3hn5 n VAL 231 Cb 0.50 -1.83 -0.17 0.00 -0.91 0.00 0.00 33.84 31.44 3hn5 n VAL 231 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 3hn5 s ILE 232 N -0.93 2.09 -0.34 2.52 1.01 0.05 -4.98 121.20 120.62 3hn5 s ILE 232 Ca 0.56 -1.04 -0.17 0.00 0.00 0.00 0.00 60.65 60.00 3hn5 s ILE 232 Cb -0.51 -1.77 -0.01 0.00 0.01 0.00 0.00 42.46 40.18 3hn5 s ILE 232 CO 0.61 0.57 0.43 -0.60 0.00 0.00 0.00 174.94 175.95 3hn5 s ARG 233 N 0.02 3.64 0.04 2.79 3.52 -1.26 -0.16 118.95 127.54 3hn5 s ARG 233 Ca -0.09 -0.25 0.06 0.00 -0.13 0.00 0.00 55.73 55.32 3hn5 s ARG 233 Cb -0.15 -3.79 -0.23 0.00 -1.56 0.00 0.00 34.95 29.21 3hn5 s ARG 233 CO 0.06 -0.55 1.00 -0.07 -0.81 0.00 0.00 175.30 174.92 3hn5 h LEU 234 N 8.89 0.11 0.00 -0.88 4.07 -0.01 -3.49 115.31 124.00 3hn5 h LEU 234 Ca -0.29 -0.15 0.00 0.00 0.08 0.00 0.00 57.88 57.52 3hn5 h LEU 234 Cb 1.14 -0.04 0.00 0.00 1.08 0.00 0.00 40.66 42.84 3hn5 h LEU 234 CO 0.73 1.12 0.00 1.17 -1.08 0.00 0.00 178.44 180.38