#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 -3.52 4.31 7.64 -0.76 -4.84 113.62 116.45 3hn5 n SER 31 Ca 0.00 0.00 -0.00 0.00 1.01 0.00 0.00 58.87 59.88 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 -0.75 0.17 -3.43 2.96 0.67 -0.65 118.68 117.65 3hn5 s LEU 33 Ca 0.00 1.06 0.06 0.00 -0.22 0.00 0.00 54.13 55.02 3hn5 s LEU 33 Cb 0.00 1.89 -0.05 0.00 0.50 0.00 0.00 46.19 48.54 3hn5 s LEU 33 CO 0.00 -0.15 -0.12 0.42 -1.32 0.00 0.00 176.35 175.18 3hn5 s THR 34 N 2.38 1.37 -0.76 3.68 -4.23 -0.30 -0.74 115.64 117.04 3hn5 s THR 34 Ca -0.05 -2.11 0.00 0.00 -1.18 0.00 0.00 61.69 58.35 3hn5 s THR 34 Cb -0.07 -1.91 0.00 0.00 1.34 0.00 0.00 72.50 71.85 3hn5 s THR 34 CO -0.18 -0.69 0.00 0.61 -0.54 0.00 0.00 174.62 173.82 3hn5 n GLY 35 N -0.25 -1.23 3.11 3.99 0.00 -0.97 -0.73 105.19 109.10 3hn5 n GLY 35 Ca -0.09 -0.86 -0.20 0.00 0.00 0.00 0.00 46.02 44.87 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 -0.30 0.93 0.08 1.61 0.52 -1.26 -1.37 118.95 119.15 3hn5 s ARG 36 Ca 0.00 -0.62 -0.21 0.00 -0.52 0.00 0.00 55.73 54.38 3hn5 s ARG 36 Cb 0.00 -0.91 -0.07 0.00 0.52 0.00 0.00 34.95 34.50 3hn5 s ARG 36 CO 0.00 0.23 0.62 0.08 0.02 0.00 0.00 175.30 176.26 3hn5 s VAL 37 N -0.64 4.69 -0.25 3.52 1.01 0.22 -1.05 120.40 127.89 3hn5 s VAL 37 Ca 0.02 1.34 -0.10 0.00 0.00 0.00 0.00 61.98 63.24 3hn5 s VAL 37 Cb -0.07 -3.96 0.10 0.00 0.00 0.00 0.00 36.38 32.46 3hn5 s VAL 37 CO 0.01 0.52 0.56 -0.47 0.00 0.00 0.00 175.10 175.72 3hn5 s TYR 39 N -0.93 -1.06 -1.50 5.22 5.04 -0.40 -1.36 117.35 122.36 3hn5 s TYR 39 Ca 0.31 1.96 -0.07 0.00 -2.44 0.00 0.00 57.07 56.82 3hn5 s TYR 39 Cb -0.20 0.58 0.06 0.00 0.35 0.00 0.00 41.96 42.74 3hn5 s TYR 39 CO 0.20 -0.56 0.65 0.09 -1.34 0.00 0.00 175.55 174.59 3hn5 n ASN 40 N 5.12 -1.98 0.00 4.32 3.02 -1.26 -1.73 115.26 122.74 3hn5 n ASN 40 Ca -0.14 -0.95 0.00 0.00 -0.03 0.00 0.00 54.58 53.47 3hn5 n ASN 40 Cb 0.51 -3.24 0.00 0.00 -0.61 0.00 0.00 39.78 36.44 3hn5 n ASN 40 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3hn5 n GLY 41 N -1.73 2.26 3.57 7.41 0.00 -1.26 -5.03 105.19 110.41 3hn5 n GLY 41 Ca -0.15 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.51 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 -0.53 3.89 0.31 1.61 2.12 -0.70 -5.08 118.70 120.31 3hn5 s GLU 42 Ca 0.00 -0.37 -0.30 0.00 0.36 0.00 0.00 54.97 54.66 3hn5 s GLU 42 Cb 0.00 -3.37 -0.12 0.00 0.26 0.00 0.00 34.13 30.90 3hn5 s GLU 42 CO 0.00 0.02 1.53 0.00 -0.54 0.00 0.00 175.26 176.28 3hn5 n ALA 43 N 4.33 2.29 -1.79 6.30 0.00 -1.26 -1.27 120.51 129.11 3hn5 n ALA 43 Ca -0.16 0.37 -0.36 0.00 0.00 0.00 0.00 53.44 53.29 3hn5 n ALA 43 Cb 0.52 -2.42 -0.06 0.00 0.00 0.00 0.00 19.45 17.49 3hn5 n ALA 43 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3hn5 s LEU 44 N -0.80 4.24 -0.33 0.00 1.43 -0.47 -4.90 118.68 117.85 3hn5 s LEU 44 Ca 0.61 1.86 -0.18 0.00 -1.03 0.00 0.00 54.13 55.40 3hn5 s LEU 44 Cb -0.51 -4.13 -0.01 0.00 0.03 0.00 0.00 46.19 41.57 3hn5 s LEU 44 CO 0.53 -0.20 0.52 -1.10 0.23 0.00 0.00 176.35 176.33 3hn5 s GLN 45 N -2.31 3.75 0.33 1.70 -1.52 -1.26 -2.39 119.66 117.95 3hn5 s GLN 45 Ca 0.54 -0.01 0.03 0.00 -1.95 0.00 0.00 55.36 53.96 3hn5 s GLN 45 Cb -0.18 -3.76 -0.04 0.00 -0.22 0.00 0.00 33.01 28.80 3hn5 s GLN 45 CO 0.23 -0.57 0.11 -0.51 -0.25 0.00 0.00 175.29 174.31 3hn5 s LEU 46 N 2.39 1.89 -0.08 2.90 1.43 -0.24 -1.71 118.68 125.27 3hn5 s LEU 46 Ca 0.20 -1.51 -0.30 0.00 -1.03 0.00 0.00 54.13 51.49 3hn5 s LEU 46 Cb -0.15 -0.08 -0.02 0.00 0.03 0.00 0.00 46.19 45.97 3hn5 s LEU 46 CO 0.12 -0.79 1.02 -0.60 0.23 0.00 0.00 176.35 176.33 3hn5 s ARG 47 N -3.85 4.44 0.00 1.70 3.52 -1.26 -4.36 118.95 119.15 3hn5 s ARG 47 Ca 0.33 1.43 0.00 0.00 -0.13 0.00 0.00 55.73 57.36 3hn5 s ARG 47 Cb 0.06 -3.52 0.00 0.00 -1.56 0.00 0.00 34.95 29.93 3hn5 s ARG 47 CO 0.15 -0.27 0.00 0.41 -0.81 0.00 0.00 175.30 174.78 3hn5 n GLY 48 N 3.08 0.26 3.87 8.12 0.00 -1.26 -4.36 105.19 114.90 3hn5 n GLY 48 Ca 0.08 -1.65 -0.34 0.00 0.00 0.00 0.00 46.02 44.12 3hn5 n GLY 48 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3hn5 n ASN 49 N 0.00 -3.49 -0.60 1.61 5.15 -1.26 -2.98 115.26 113.69 3hn5 n ASN 49 Ca 0.00 -1.10 -0.08 0.00 -0.60 0.00 0.00 54.58 52.81 3hn5 n ASN 49 Cb 0.00 -2.81 -0.03 0.00 -0.53 0.00 0.00 39.78 36.41 3hn5 n ASN 49 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 3hn5 n GLU 50 N -4.46 -0.73 0.05 1.20 1.02 -1.26 -4.89 120.64 111.57 3hn5 n GLU 50 Ca -0.16 0.72 -0.06 0.00 -0.02 0.00 0.00 57.16 57.64 3hn5 n GLU 50 Cb 0.61 -4.59 0.12 0.00 -0.02 0.00 0.00 31.44 27.56 3hn5 n GLU 50 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3hn5 h ALA 51 N 0.00 0.85 -3.61 0.62 0.00 -1.75 -3.45 119.26 111.93 3hn5 h ALA 51 Ca -0.16 -0.50 -0.54 0.00 0.00 0.00 0.00 54.91 53.71 3hn5 h ALA 51 Cb 0.60 -0.09 -0.32 0.00 0.00 0.00 0.00 17.79 17.98 3hn5 h ALA 51 CO 0.23 0.68 -0.83 0.08 0.00 0.00 0.00 179.25 179.42 3hn5 s VAL 52 N -3.95 1.30 0.07 0.00 1.01 -1.26 -4.87 120.40 112.70 3hn5 s VAL 52 Ca -0.05 -0.60 0.02 0.00 0.00 0.00 0.00 61.98 61.34 3hn5 s VAL 52 Cb 0.12 -1.15 -0.03 0.00 0.00 0.00 0.00 36.38 35.32 3hn5 s VAL 52 CO 0.81 0.39 -0.07 0.00 0.00 0.00 0.00 175.10 176.22 3hn5 s GLN 53 N 0.38 0.66 0.28 2.72 -2.07 -1.26 -1.63 119.66 118.74 3hn5 s GLN 53 Ca -0.10 -1.00 0.07 0.00 -1.82 0.00 0.00 55.36 52.50 3hn5 s GLN 53 Cb -0.14 -0.26 -0.03 0.00 -1.09 0.00 0.00 33.01 31.49 3hn5 s GLN 53 CO 0.03 0.02 0.22 -0.51 -1.32 0.00 0.00 175.29 173.74 3hn5 s LEU 54 N -2.20 3.71 -0.06 2.60 1.43 0.27 -3.49 118.68 120.94 3hn5 s LEU 54 Ca -0.01 -0.35 0.05 0.00 -1.03 0.00 0.00 54.13 52.79 3hn5 s LEU 54 Cb -0.03 -2.27 -0.01 0.00 0.03 0.00 0.00 46.19 43.90 3hn5 s LEU 54 CO -0.02 -0.15 -0.22 -1.10 0.23 0.00 0.00 176.35 175.09 3hn5 s GLN 55 N -3.89 2.36 -0.21 1.70 -0.21 -0.24 -0.94 119.66 118.23 3hn5 s GLN 55 Ca 0.36 -0.80 -0.02 0.00 0.02 0.00 0.00 55.36 54.91 3hn5 s GLN 55 Cb -0.07 -1.98 -0.00 0.00 1.00 0.00 0.00 33.01 31.96 3hn5 s GLN 55 CO 0.25 0.31 -0.09 -0.51 -2.12 0.00 0.00 175.29 173.13 3hn5 s LEU 56 N -0.02 2.69 -0.15 2.90 1.43 -0.55 -1.38 118.68 123.59 3hn5 s LEU 56 Ca -0.06 -0.45 -0.07 0.00 -1.03 0.00 0.00 54.13 52.52 3hn5 s LEU 56 Cb -0.14 -1.67 -0.04 0.00 0.03 0.00 0.00 46.19 44.38 3hn5 s LEU 56 CO 0.04 -0.01 0.08 -0.31 0.23 0.00 0.00 176.35 176.38 3hn5 s TYR 57 N 1.37 3.35 -0.04 0.29 1.51 0.14 -1.20 117.35 122.77 3hn5 s TYR 57 Ca 0.05 0.25 0.12 0.00 -1.01 0.00 0.00 57.07 56.48 3hn5 s TYR 57 Cb -0.14 -1.99 -0.18 0.00 -0.11 0.00 0.00 41.96 39.53 3hn5 s TYR 57 CO -0.05 0.39 0.22 1.04 -1.11 0.00 0.00 175.55 176.04 3hn5 n GLN 58 N 2.84 0.78 -0.44 -0.62 6.02 -1.26 -0.71 117.38 123.99 3hn5 n GLN 58 Ca -0.18 -0.09 0.07 0.00 -0.01 0.00 0.00 57.00 56.79 3hn5 n GLN 58 Cb 0.53 -1.30 0.19 0.00 1.02 0.00 0.00 30.24 30.68 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 -2.05 0.02 0.00 1.08 8.25 -1.26 -4.97 115.22 116.28 3hn5 n HIS 59 Ca -0.06 -1.35 0.00 0.00 -0.26 0.00 0.00 57.72 56.05 3hn5 n HIS 59 Cb 0.45 -0.22 0.00 0.00 1.12 0.00 0.00 29.99 31.34 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 -1.22 -0.67 0.20 -1.41 0.00 -1.26 -4.53 105.19 96.29 3hn5 n GLY 60 Ca 0.18 -1.51 -0.01 0.00 0.00 0.00 0.00 46.02 44.69 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 0.21 0.00 1.61 3.20 -1.98 -2.93 116.97 117.08 3hn5 h TYR 61 Ca 0.00 -0.05 -0.02 0.00 3.14 0.00 0.00 58.73 61.80 3hn5 h TYR 61 Cb 0.00 -0.05 -0.00 0.00 1.54 0.00 0.00 36.73 38.22 3hn5 h TYR 61 CO 0.00 0.55 -0.08 0.00 -1.64 0.00 0.00 178.16 176.99 3hn5 h ALA 62 N 1.45 1.56 0.00 1.82 0.00 -2.06 -2.66 119.26 119.37 3hn5 h ALA 62 Ca 0.02 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.85 3hn5 h ALA 62 Cb 0.76 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.54 3hn5 h ALA 62 CO 0.06 0.10 0.00 1.17 0.00 0.00 0.00 179.25 180.58 3hn5 n LYS 63 N -4.00 0.06 -4.11 0.00 0.00 -1.11 -4.89 118.16 104.11 3hn5 n LYS 63 Ca -0.02 0.21 -0.33 0.00 0.00 0.00 0.00 58.31 58.17 3hn5 n LYS 63 Cb 0.17 -1.59 -0.02 0.00 0.00 0.00 0.00 35.03 33.60 3hn5 n LYS 63 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.40 175.01 3hn5 n HIS 64 N -1.69 -1.80 -2.64 5.64 1.44 -1.00 -4.87 115.22 110.30 3hn5 n HIS 64 Ca 0.04 0.80 -0.17 0.00 -2.01 0.00 0.00 57.72 56.38 3hn5 n HIS 64 Cb 0.25 -3.31 0.01 0.00 0.12 0.00 0.00 29.99 27.06 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 2.83 -4.81 4.39 5.75 -1.26 -5.11 116.55 115.57 3hn5 n ASP 65 Ca -0.03 -3.17 -0.31 0.00 -0.01 0.00 0.00 54.79 51.26 3hn5 n ASP 65 Cb 0.55 -0.51 0.05 0.00 -1.03 0.00 0.00 41.12 40.18 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 -3.26 2.92 -0.05 0.11 0.04 -1.26 -4.82 135.00 128.67 3hn5 s PRO 66 Ca 0.37 1.01 -0.24 0.00 0.04 0.00 0.00 61.00 62.18 3hn5 s PRO 66 Cb 0.42 -1.99 -0.04 0.00 0.04 0.00 0.00 34.50 32.94 3hn5 s PRO 66 CO -0.07 -1.12 0.73 0.42 0.04 0.00 0.00 177.00 177.01 3hn5 s ILE 67 N -2.95 5.02 0.10 0.56 1.01 -0.34 -4.87 121.20 119.74 3hn5 s ILE 67 Ca 0.59 1.51 -0.22 0.00 0.00 0.00 0.00 60.65 62.53 3hn5 s ILE 67 Cb -0.15 -4.07 -0.07 0.00 0.01 0.00 0.00 42.46 38.18 3hn5 s ILE 67 CO 0.53 0.25 0.67 0.20 0.00 0.00 0.00 174.94 176.59 3hn5 s ASN 68 N 0.78 7.20 -0.12 3.58 0.01 -1.26 -1.48 114.94 123.64 3hn5 s ASN 68 Ca 0.39 1.43 0.01 0.00 -0.71 0.00 0.00 52.86 53.97 3hn5 s ASN 68 Cb -0.18 -2.43 0.02 0.00 0.41 0.00 0.00 41.25 39.07 3hn5 s ASN 68 CO 0.19 0.22 -0.12 -0.69 -1.51 0.00 0.00 177.10 175.19 3hn5 s VAL 69 N -0.98 1.35 -0.02 1.60 1.01 -0.12 -5.00 120.40 118.25 3hn5 s VAL 69 Ca 0.33 -0.52 -0.10 0.00 0.00 0.00 0.00 61.98 61.69 3hn5 s VAL 69 Cb -0.21 -1.28 -0.05 0.00 0.00 0.00 0.00 36.38 34.84 3hn5 s VAL 69 CO 0.22 0.42 0.30 -0.31 0.00 0.00 0.00 175.10 175.73 3hn5 s TYR 70 N 1.35 3.64 -0.07 5.22 2.02 -1.26 -0.57 117.35 127.68 3hn5 s TYR 70 Ca 0.00 0.74 -0.05 0.00 -0.37 0.00 0.00 57.07 57.39 3hn5 s TYR 70 Cb -0.14 -2.10 -0.04 0.00 -0.40 0.00 0.00 41.96 39.28 3hn5 s TYR 70 CO -0.06 0.65 0.16 0.08 -1.57 0.00 0.00 175.55 174.81 3hn5 s VAL 71 N -1.16 5.47 0.59 0.71 1.01 -0.65 -4.30 120.40 122.08 3hn5 s VAL 71 Ca 0.23 0.03 0.00 0.00 0.00 0.00 0.00 61.98 62.24 3hn5 s VAL 71 Cb -0.14 -3.47 0.12 0.00 0.00 0.00 0.00 36.38 32.89 3hn5 s VAL 71 CO 0.12 0.48 0.81 -0.46 0.00 0.00 0.00 175.10 176.04 3hn5 n ASN 72 N 1.47 1.11 0.16 3.32 0.23 -1.26 -4.39 115.26 115.90 3hn5 n ASN 72 Ca -0.15 -1.93 0.15 0.00 -0.53 0.00 0.00 54.58 52.12 3hn5 n ASN 72 Cb 0.54 -0.52 0.73 0.00 -2.08 0.00 0.00 39.78 38.45 3hn5 n ASN 72 CO 0.00 0.00 0.00 -0.61 -0.93 0.00 0.00 177.26 175.72 3hn5 h GLN 73 N 0.00 0.00 -0.63 -3.83 4.15 -1.83 -1.16 115.11 111.80 3hn5 h GLN 73 Ca -0.27 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.15 3hn5 h GLN 73 Cb 0.99 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.68 3hn5 h GLN 73 CO 0.29 0.00 0.00 -0.25 -1.93 0.00 0.00 178.83 176.94 3hn5 n ASP 74 N -4.20 4.51 -1.47 -0.69 8.00 -1.26 -1.08 116.55 120.35 3hn5 n ASP 74 Ca 0.03 -2.37 0.00 0.00 0.71 0.00 0.00 54.79 53.16 3hn5 n ASP 74 Cb 0.34 -0.54 0.00 0.00 -0.02 0.00 0.00 41.12 40.89 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 1.12 0.38 3.62 0.44 0.00 -0.44 -4.48 105.19 105.82 3hn5 n GLY 75 Ca 0.25 -0.25 -0.04 0.00 0.00 0.00 0.00 46.02 45.98 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 -2.98 -0.09 -0.13 1.61 -0.85 -0.47 -0.61 117.35 113.83 3hn5 s TYR 77 Ca 0.00 0.07 -0.09 0.00 -0.52 0.00 0.00 57.07 56.53 3hn5 s TYR 77 Cb 0.00 0.51 0.04 0.00 0.38 0.00 0.00 41.96 42.89 3hn5 s TYR 77 CO 0.00 -0.13 0.32 0.45 -1.52 0.00 0.00 175.55 174.67 3hn5 s SER 78 N -1.96 -0.35 -0.01 -0.18 0.15 -1.26 -2.30 113.70 107.79 3hn5 s SER 78 Ca 0.10 0.66 -0.01 0.00 0.70 0.00 0.00 55.95 57.40 3hn5 s SER 78 Cb -0.01 0.60 0.00 0.00 -1.71 0.00 0.00 66.02 64.91 3hn5 s SER 78 CO -0.04 -0.14 0.02 0.00 1.20 0.00 0.00 173.24 174.28 3hn5 s ALA 79 N 0.75 -0.05 -0.28 5.45 0.00 0.08 -4.72 121.76 122.99 3hn5 s ALA 79 Ca -0.05 -0.00 -0.11 0.00 0.00 0.00 0.00 51.96 51.80 3hn5 s ALA 79 Cb -0.06 -0.02 -0.05 0.00 0.00 0.00 0.00 23.12 22.99 3hn5 s ALA 79 CO -0.05 -0.03 0.19 -0.80 0.00 0.00 0.00 175.76 175.07 3hn5 s ASN 80 N -0.17 6.02 0.18 0.00 0.01 -1.26 -0.24 114.94 119.48 3hn5 s ASN 80 Ca -0.02 -0.02 0.02 0.00 -0.71 0.00 0.00 52.86 52.12 3hn5 s ASN 80 Cb -0.01 -2.12 -0.05 0.00 0.41 0.00 0.00 41.25 39.48 3hn5 s ASN 80 CO -0.00 -0.06 0.01 -0.76 -1.51 0.00 0.00 177.10 174.78 3hn5 s LEU 81 N 1.76 2.07 0.36 0.60 1.43 0.18 -4.92 118.68 120.15 3hn5 s LEU 81 Ca 0.07 -1.19 -0.26 0.00 -1.03 0.00 0.00 54.13 51.72 3hn5 s LEU 81 Cb -0.16 -0.05 -0.09 0.00 0.03 0.00 0.00 46.19 45.92 3hn5 s LEU 81 CO 0.11 -0.58 1.04 -0.36 0.23 0.00 0.00 176.35 176.78 3hn5 s PHE 82 N -3.67 3.43 0.55 0.29 0.08 -1.26 -1.84 117.98 115.56 3hn5 s PHE 82 Ca 0.25 1.69 -0.19 0.00 0.12 0.00 0.00 56.93 58.80 3hn5 s PHE 82 Cb 0.06 -3.12 -0.08 0.00 -0.57 0.00 0.00 43.02 39.32 3hn5 s PHE 82 CO 0.05 -0.43 0.74 -0.25 -0.10 0.00 0.00 175.22 175.23 3hn5 n ASP 83 N 0.33 -0.13 0.00 1.36 8.00 -1.26 -4.91 116.55 119.95 3hn5 n ASP 83 Ca 0.03 0.81 0.00 0.00 0.71 0.00 0.00 54.79 56.34 3hn5 n ASP 83 Cb 0.49 -1.26 0.00 0.00 -0.02 0.00 0.00 41.12 40.32 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 1.54 0.12 3.65 0.44 0.00 -0.35 -4.98 105.19 105.61 3hn5 n GLY 84 Ca 0.12 -1.69 -0.35 0.00 0.00 0.00 0.00 46.02 44.10 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 -1.89 3.65 0.08 1.61 8.01 -1.26 -0.29 118.70 128.61 3hn5 s GLU 85 Ca 0.00 -0.36 0.03 0.00 0.01 0.00 0.00 54.97 54.65 3hn5 s GLU 85 Cb 0.00 -3.07 -0.03 0.00 -4.31 0.00 0.00 34.13 26.71 3hn5 s GLU 85 CO 0.00 0.42 -0.09 0.71 0.01 0.00 0.00 175.26 176.32 3hn5 s TYR 86 N -0.07 0.91 0.40 1.61 1.51 0.05 -4.76 117.35 116.99 3hn5 s TYR 86 Ca 0.06 -0.68 0.08 0.00 -1.01 0.00 0.00 57.07 55.51 3hn5 s TYR 86 Cb -0.12 -0.51 -0.06 0.00 -0.11 0.00 0.00 41.96 41.15 3hn5 s TYR 86 CO 0.01 -0.06 0.09 -0.65 -1.11 0.00 0.00 175.55 173.83 3hn5 s GLN 87 N -2.71 2.11 0.00 -0.62 -0.21 0.11 -0.51 119.66 117.83 3hn5 s GLN 87 Ca 0.03 -1.91 0.00 0.00 0.02 0.00 0.00 55.36 53.50 3hn5 s GLN 87 Cb -0.03 -1.86 0.00 0.00 1.00 0.00 0.00 33.01 32.12 3hn5 s GLN 87 CO -0.01 -0.05 0.00 1.51 -2.12 0.00 0.00 175.29 174.62 3hn5 n ILE 89 N -1.10 0.00 -1.88 1.08 3.06 -0.48 0.28 119.36 120.32 3hn5 n ILE 89 Ca -0.03 0.00 -0.35 0.00 -2.50 0.00 0.00 62.75 59.88 3hn5 n ILE 89 Cb 0.65 0.00 0.04 0.00 0.54 0.00 0.00 39.64 40.87 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 2.87 -0.06 9.51 -4.23 -1.26 -1.08 115.64 119.38 3hn5 s THR 90 Ca 0.00 0.47 -0.30 0.00 -1.18 0.00 0.00 61.69 60.69 3hn5 s THR 90 Cb 0.00 -3.08 -0.03 0.00 1.34 0.00 0.00 72.50 70.72 3hn5 s THR 90 CO 0.00 -0.18 1.21 -0.75 -0.54 0.00 0.00 174.62 174.36 3hn5 s LYS 91 N -3.66 4.34 -0.04 3.99 2.20 -1.23 -4.76 119.74 120.59 3hn5 s LYS 91 Ca 0.73 1.68 -0.36 0.00 -0.36 0.00 0.00 55.97 57.66 3hn5 s LYS 91 Cb -0.26 -3.57 -0.15 0.00 -1.51 0.00 0.00 37.83 32.35 3hn5 s LYS 91 CO 0.37 -0.47 1.64 0.45 -0.36 0.00 0.00 175.35 176.97 3hn5 n SER 92 N 5.30 2.62 0.00 1.43 2.88 -1.26 -1.41 113.62 123.17 3hn5 n SER 92 Ca 0.11 1.06 0.00 0.00 -1.33 0.00 0.00 58.87 58.71 3hn5 n SER 92 Cb 0.46 -1.27 0.00 0.00 -0.75 0.00 0.00 64.21 62.65 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 3.64 1.37 3.38 0.46 0.00 -1.26 -5.00 105.19 107.79 3hn5 n GLY 93 Ca 0.21 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.83 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 -3.13 5.68 0.00 1.61 3.04 -0.50 -4.39 114.94 117.26 3hn5 s ASN 94 Ca 0.00 -0.92 0.00 0.00 0.04 0.00 0.00 52.86 51.98 3hn5 s ASN 94 Cb 0.00 -2.01 0.00 0.00 -1.54 0.00 0.00 41.25 37.70 3hn5 s ASN 94 CO 0.00 -0.35 0.00 0.61 -3.04 0.00 0.00 177.10 174.32 3hn5 n GLY 95 N 4.99 3.54 2.59 1.21 0.00 -1.26 -4.62 105.19 111.63 3hn5 n GLY 95 Ca -0.12 -1.74 -0.41 0.00 0.00 0.00 0.00 46.02 43.75 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 -1.14 3.35 -3.76 1.61 -0.04 -1.26 -4.59 135.00 129.16 3hn5 n PRO 96 Ca 0.00 -2.64 -0.10 0.00 -0.04 0.00 0.00 63.50 60.73 3hn5 n PRO 96 Cb 0.00 -3.04 -0.04 0.00 -0.04 0.00 0.00 33.50 30.38 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 2.22 -0.06 0.77 0.54 -2.14 -1.26 -3.43 118.94 115.57 3hn5 s TRP 97 Ca 0.54 -0.28 -0.05 0.00 2.66 0.00 0.00 56.10 58.97 3hn5 s TRP 97 Cb 0.15 0.33 0.13 0.00 -3.10 0.00 0.00 33.47 30.99 3hn5 s TRP 97 CO -0.07 -0.88 1.06 0.95 -2.66 0.00 0.00 176.95 175.35 3hn5 s THR 98 N -3.88 2.14 -2.16 0.66 -4.23 -0.29 -4.88 115.64 103.00 3hn5 s THR 98 Ca 0.10 -0.44 0.18 0.00 -1.18 0.00 0.00 61.69 60.35 3hn5 s THR 98 Cb -0.00 -2.70 0.43 0.00 1.34 0.00 0.00 72.50 71.56 3hn5 s THR 98 CO -0.03 0.00 1.51 -1.54 -0.54 0.00 0.00 174.62 174.02 3hn5 n SER 99 N -3.03 1.24 -4.69 3.99 3.41 -1.26 -4.59 113.62 108.70 3hn5 n SER 99 Ca 0.14 -1.70 -0.42 0.00 -0.26 0.00 0.00 58.87 56.63 3hn5 n SER 99 Cb 0.60 -0.09 -0.03 0.00 -0.26 0.00 0.00 64.21 64.43 3hn5 n SER 99 CO 0.00 0.00 0.00 -0.70 -0.16 0.00 0.00 175.04 174.18 3hn5 s GLU 100 N -1.81 4.19 0.00 4.33 2.56 -1.26 -1.76 118.70 124.95 3hn5 s GLU 100 Ca 0.28 2.37 0.00 0.00 0.00 0.00 0.00 54.97 57.62 3hn5 s GLU 100 Cb 0.15 -3.60 0.00 0.00 2.00 0.00 0.00 34.13 32.68 3hn5 s GLU 100 CO 0.22 -0.75 0.00 0.41 -0.56 0.00 0.00 175.26 174.58 3hn5 n GLY 101 N 4.03 0.47 3.64 -1.50 0.00 -1.26 -4.37 105.19 106.20 3hn5 n GLY 101 Ca 0.16 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.75 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 -0.30 4.02 0.19 1.61 3.52 -0.72 -4.97 118.95 122.30 3hn5 s ARG 102 Ca 0.00 1.49 -0.17 0.00 -0.13 0.00 0.00 55.73 56.92 3hn5 s ARG 102 Cb 0.00 -3.87 0.02 0.00 -1.56 0.00 0.00 34.95 29.55 3hn5 s ARG 102 CO 0.00 -0.99 0.50 0.34 -0.81 0.00 0.00 175.30 174.34 3hn5 s ASP 103 N 2.74 -0.23 0.41 -2.12 -1.08 -1.26 -5.11 116.67 110.02 3hn5 s ASP 103 Ca 0.59 -0.52 -0.25 0.00 -0.52 0.00 0.00 52.55 51.85 3hn5 s ASP 103 Cb -0.20 0.56 -0.08 0.00 -1.46 0.00 0.00 42.92 41.74 3hn5 s ASP 103 CO 0.21 -1.04 1.15 0.42 0.52 0.00 0.00 175.17 176.44 3hn5 s THR 104 N -3.88 3.21 -0.18 1.71 -4.23 -1.26 -4.68 115.64 106.33 3hn5 s THR 104 Ca 0.10 0.99 -0.03 0.00 -1.18 0.00 0.00 61.69 61.57 3hn5 s THR 104 Cb -0.01 -3.54 -0.01 0.00 1.34 0.00 0.00 72.50 70.28 3hn5 s THR 104 CO -0.02 0.06 -0.07 -0.63 -0.54 0.00 0.00 174.62 173.42 3hn5 s ILE 105 N -1.46 3.38 -0.22 2.99 1.01 -1.26 -5.01 121.20 120.62 3hn5 s ILE 105 Ca 0.58 -0.52 -0.26 0.00 0.00 0.00 0.00 60.65 60.45 3hn5 s ILE 105 Cb -0.29 -2.49 -0.00 0.00 0.01 0.00 0.00 42.46 39.69 3hn5 s ILE 105 CO 0.37 0.47 0.90 0.20 0.00 0.00 0.00 174.94 176.87 3hn5 s ASN 106 N 0.86 6.94 -0.10 3.58 0.01 -1.26 -4.21 114.94 120.76 3hn5 s ASN 106 Ca -0.02 1.18 0.03 0.00 -0.71 0.00 0.00 52.86 53.33 3hn5 s ASN 106 Cb -0.15 -2.47 0.01 0.00 0.41 0.00 0.00 41.25 39.05 3hn5 s ASN 106 CO 0.01 -0.54 -0.19 -0.69 -1.51 0.00 0.00 177.10 174.19 3hn5 s VAL 107 N 2.79 1.70 -0.39 1.60 1.01 0.33 -5.00 120.40 122.44 3hn5 s VAL 107 Ca 0.39 -0.79 -0.14 0.00 0.00 0.00 0.00 61.98 61.44 3hn5 s VAL 107 Cb -0.16 -1.51 0.01 0.00 0.00 0.00 0.00 36.38 34.72 3hn5 s VAL 107 CO 0.08 0.48 0.27 -0.89 0.00 0.00 0.00 175.10 175.04 3hn5 s THR 108 N 0.68 5.12 -0.29 3.92 2.01 -1.26 -0.77 115.64 125.05 3hn5 s THR 108 Ca -0.12 -0.59 -0.19 0.00 0.31 0.00 0.00 61.69 61.09 3hn5 s THR 108 Cb -0.16 -3.80 -0.02 0.00 0.01 0.00 0.00 72.50 68.54 3hn5 s THR 108 CO 0.03 -0.22 0.57 -0.69 -0.69 0.00 0.00 174.62 173.62 3hn5 s VAL 109 N 1.66 5.00 -0.33 3.82 1.01 0.60 -4.97 120.40 127.20 3hn5 s VAL 109 Ca 0.05 0.80 -0.01 0.00 0.00 0.00 0.00 61.98 62.82 3hn5 s VAL 109 Cb -0.19 -3.93 0.13 0.00 0.00 0.00 0.00 36.38 32.40 3hn5 s VAL 109 CO 0.09 -0.06 0.21 0.00 0.00 0.00 0.00 175.10 175.34 3hn5 s ALA 110 N 2.46 0.65 0.00 5.51 0.00 -1.26 -1.22 121.76 127.91 3hn5 s ALA 110 Ca 0.23 -1.50 0.00 0.00 0.00 0.00 0.00 51.96 50.69 3hn5 s ALA 110 Cb -0.15 -1.59 0.00 0.00 0.00 0.00 0.00 23.12 21.37 3hn5 s ALA 110 CO 0.11 -1.97 0.00 0.41 0.00 0.00 0.00 175.76 174.31 3hn5 n GLY 111 N 4.44 -1.07 3.73 0.00 0.00 -1.26 -4.74 105.19 106.29 3hn5 n GLY 111 Ca 0.06 -1.08 -0.42 0.00 0.00 0.00 0.00 46.02 44.58 3hn5 n GLY 111 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3hn5 n ASN 112 N -2.10 3.59 -3.83 1.61 3.02 -1.26 -4.85 115.26 111.44 3hn5 n ASN 112 Ca 0.00 1.14 -0.12 0.00 -0.03 0.00 0.00 54.58 55.57 3hn5 n ASN 112 Cb 0.00 -1.55 -0.13 0.00 -0.61 0.00 0.00 39.78 37.49 3hn5 n ASN 112 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 3hn5 s THR 113 N 0.01 -0.00 -0.14 3.41 2.01 -1.26 -5.01 115.64 114.66 3hn5 s THR 113 Ca 0.65 0.01 -0.05 0.00 0.31 0.00 0.00 61.69 62.61 3hn5 s THR 113 Cb -0.53 -0.17 -0.04 0.00 0.01 0.00 0.00 72.50 71.77 3hn5 s THR 113 CO 0.48 0.00 0.05 -0.69 -0.69 0.00 0.00 174.62 173.77 3hn5 s VAL 114 N 0.10 4.69 -0.21 3.82 1.01 -1.26 -1.15 120.40 127.41 3hn5 s VAL 114 Ca -0.00 -0.09 -0.05 0.00 0.00 0.00 0.00 61.98 61.85 3hn5 s VAL 114 Cb -0.01 -3.05 0.11 0.00 0.00 0.00 0.00 36.38 33.42 3hn5 s VAL 114 CO -0.00 0.54 0.37 -1.58 0.00 0.00 0.00 175.10 174.43 3hn5 s GLN 115 N -0.27 0.30 0.40 2.72 2.00 0.09 -4.96 119.66 119.94 3hn5 s GLN 115 Ca 0.08 0.74 -0.03 0.00 -2.00 0.00 0.00 55.36 54.15 3hn5 s GLN 115 Cb -0.12 -0.14 -0.04 0.00 0.80 0.00 0.00 33.01 33.51 3hn5 s GLN 115 CO 0.02 -0.45 0.66 -0.51 -0.50 0.00 0.00 175.29 174.51 3hn5 s ASP 116 N 2.54 6.31 -0.11 6.67 1.01 -1.26 -4.13 116.67 127.70 3hn5 s ASP 116 Ca 0.05 0.72 0.02 0.00 0.71 0.00 0.00 52.55 54.05 3hn5 s ASP 116 Cb -0.14 -2.15 0.01 0.00 1.01 0.00 0.00 42.92 41.66 3hn5 s ASP 116 CO -0.13 -0.40 -0.16 -0.69 0.21 0.00 0.00 175.17 174.00 3hn5 s VAL 117 N -2.46 1.55 -0.11 -1.27 1.01 -0.22 -4.93 120.40 113.97 3hn5 s VAL 117 Ca 0.44 -0.67 -0.16 0.00 0.00 0.00 0.00 61.98 61.59 3hn5 s VAL 117 Cb -0.10 -1.41 -0.05 0.00 0.00 0.00 0.00 36.38 34.82 3hn5 s VAL 117 CO 0.39 0.45 0.40 -0.70 0.00 0.00 0.00 175.10 175.64 3hn5 s GLU 118 N 0.98 4.23 0.25 2.72 2.56 -1.26 -4.26 118.70 123.91 3hn5 s GLU 118 Ca -0.06 0.32 0.04 0.00 0.00 0.00 0.00 54.97 55.27 3hn5 s GLU 118 Cb -0.15 -3.39 -0.05 0.00 2.00 0.00 0.00 34.13 32.54 3hn5 s GLU 118 CO -0.02 0.29 -0.02 0.14 -0.56 0.00 0.00 175.26 175.09 3hn5 s VAL 119 N 0.24 1.23 -0.48 3.70 -7.23 -1.26 -4.92 120.40 111.68 3hn5 s VAL 119 Ca 0.22 -2.06 -0.09 0.00 -1.81 0.00 0.00 61.98 58.24 3hn5 s VAL 119 Cb -0.15 -2.38 0.12 0.00 0.56 0.00 0.00 36.38 34.54 3hn5 s VAL 119 CO 0.09 -0.32 0.36 -0.89 -0.31 0.00 0.00 175.10 174.02 3hn5 s THR 120 N -3.29 4.21 0.73 5.32 2.01 -1.26 -4.51 115.64 118.86 3hn5 s THR 120 Ca 0.29 -1.85 -0.14 0.00 0.31 0.00 0.00 61.69 60.30 3hn5 s THR 120 Cb 0.05 -3.77 0.04 0.00 0.01 0.00 0.00 72.50 68.83 3hn5 s THR 120 CO 0.10 -0.78 1.18 -2.84 -0.69 0.00 0.00 174.62 171.58 3hn5 s PRO 121 N 1.29 2.18 -0.04 4.92 0.02 -1.26 -1.14 135.00 140.96 3hn5 s PRO 121 Ca 0.06 1.64 -0.26 0.00 0.02 0.00 0.00 61.00 62.46 3hn5 s PRO 121 Cb -0.26 -1.85 -0.21 0.00 0.02 0.00 0.00 34.50 32.20 3hn5 s PRO 121 CO -0.01 -1.78 1.14 1.88 -0.33 0.00 0.00 177.00 177.90 3hn5 h TYR 122 N -0.41 -0.03 -4.02 6.54 0.05 -1.88 -0.98 116.97 116.25 3hn5 h TYR 122 Ca -0.47 -0.00 -0.11 0.00 0.05 0.00 0.00 58.73 58.21 3hn5 h TYR 122 Cb 1.28 0.01 -0.15 0.00 1.01 0.00 0.00 36.73 38.88 3hn5 h TYR 122 CO 0.49 0.54 -0.53 0.71 -1.05 0.00 0.00 178.16 178.32 3hn5 s TYR 123 N -3.83 0.34 0.08 4.88 2.02 -1.26 -0.98 117.35 118.59 3hn5 s TYR 123 Ca -0.16 -0.82 0.07 0.00 -0.37 0.00 0.00 57.07 55.79 3hn5 s TYR 123 Cb 0.01 -0.23 -0.03 0.00 -0.40 0.00 0.00 41.96 41.31 3hn5 s TYR 123 CO 0.65 -0.45 -0.18 -0.51 -1.57 0.00 0.00 175.55 173.50 3hn5 s LEU 124 N -2.84 2.26 -0.34 -1.29 1.43 0.05 -4.91 118.68 113.04 3hn5 s LEU 124 Ca 0.05 -0.61 -0.19 0.00 -1.03 0.00 0.00 54.13 52.35 3hn5 s LEU 124 Cb 0.06 -0.74 -0.00 0.00 0.03 0.00 0.00 46.19 45.54 3hn5 s LEU 124 CO -0.10 0.02 0.57 -0.69 0.23 0.00 0.00 176.35 176.38 3hn5 s VAL 125 N -1.11 4.97 0.17 -1.59 1.01 -1.26 -1.63 120.40 120.95 3hn5 s VAL 125 Ca 0.03 0.49 0.07 0.00 0.00 0.00 0.00 61.98 62.58 3hn5 s VAL 125 Cb -0.10 -4.00 -0.04 0.00 0.00 0.00 0.00 36.38 32.24 3hn5 s VAL 125 CO 0.03 -0.23 -0.01 -0.13 0.00 0.00 0.00 175.10 174.76 3hn5 s ARG 126 N 2.52 2.39 -1.54 2.72 1.81 -0.17 -4.70 118.95 121.98 3hn5 s ARG 126 Ca 0.21 -1.09 -0.15 0.00 -1.72 0.00 0.00 55.73 52.98 3hn5 s ARG 126 Cb -0.15 -2.36 0.13 0.00 -0.45 0.00 0.00 34.95 32.11 3hn5 s ARG 126 CO 0.13 0.46 0.72 -3.47 -0.68 0.00 0.00 175.30 172.47 3hn5 n ASP 127 N -0.03 -3.61 -4.74 0.23 2.03 -1.26 -0.03 116.55 109.14 3hn5 n ASP 127 Ca -0.10 -0.78 -0.42 0.00 0.52 0.00 0.00 54.79 54.01 3hn5 n ASP 127 Cb 0.55 -2.96 -0.01 0.00 -0.72 0.00 0.00 41.12 37.98 3hn5 n ASP 127 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3hn5 n ALA 128 N -4.15 2.41 -2.27 -1.67 0.00 -1.26 -4.44 120.51 109.12 3hn5 n ALA 128 Ca 0.05 0.37 -0.16 0.00 0.00 0.00 0.00 53.44 53.70 3hn5 n ALA 128 Cb 0.51 -2.44 -0.10 0.00 0.00 0.00 0.00 19.45 17.42 3hn5 n ALA 128 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 3hn5 s GLN 129 N -0.70 1.41 0.00 0.00 -0.21 -0.16 -5.00 119.66 115.00 3hn5 s GLN 129 Ca 0.63 -1.78 0.00 0.00 0.02 0.00 0.00 55.36 54.23 3hn5 s GLN 129 Cb -0.51 0.04 0.00 0.00 1.00 0.00 0.00 33.01 33.54 3hn5 s GLN 129 CO 0.51 -0.40 0.00 0.25 -2.12 0.00 0.00 175.29 173.52 3hn5 n THR 131 N -0.44 0.00 -4.12 -0.19 -2.24 -0.24 -1.04 114.28 106.02 3hn5 n THR 131 Ca 0.02 0.00 -0.35 0.00 -2.27 0.00 0.00 64.05 61.45 3hn5 n THR 131 Cb 0.65 0.00 -0.12 0.00 -2.10 0.00 0.00 70.33 68.77 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 3.41 -0.30 3.22 2.96 -1.26 -1.52 118.68 125.19 3hn5 s LEU 132 Ca 0.00 -0.12 -0.03 0.00 -0.22 0.00 0.00 54.13 53.77 3hn5 s LEU 132 Cb 0.00 -1.86 0.10 0.00 0.50 0.00 0.00 46.19 44.93 3hn5 s LEU 132 CO 0.00 0.11 0.12 -0.70 -1.32 0.00 0.00 176.35 174.56 3hn5 s GLU 133 N 0.74 0.36 7.46 1.98 2.12 0.09 -5.00 118.70 126.45 3hn5 s GLU 133 Ca 0.01 -0.72 0.00 0.00 0.36 0.00 0.00 54.97 54.62 3hn5 s GLU 133 Cb -0.14 -1.42 0.00 0.00 0.26 0.00 0.00 34.13 32.83 3hn5 s GLU 133 CO 0.02 -1.01 0.00 0.41 -0.54 0.00 0.00 175.26 174.14 3hn5 n GLY 134 N 5.10 3.16 1.46 -1.50 0.00 -1.26 -1.63 105.19 110.52 3hn5 n GLY 134 Ca -0.04 0.05 0.10 0.00 0.00 0.00 0.00 46.02 46.12 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 9.65 4.39 -4.66 1.61 3.02 -1.26 -4.96 115.26 123.05 3hn5 n ASN 135 Ca 0.00 -2.26 -0.34 0.00 -0.03 0.00 0.00 54.58 51.95 3hn5 n ASN 135 Cb 0.00 -0.53 -0.10 0.00 -0.61 0.00 0.00 39.78 38.54 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 -1.49 2.84 -0.09 3.52 1.02 -0.65 -0.24 119.74 124.66 3hn5 s LYS 136 Ca 0.49 -0.53 0.04 0.00 0.02 0.00 0.00 55.97 55.99 3hn5 s LYS 136 Cb 0.29 -2.69 0.00 0.00 -0.52 0.00 0.00 37.83 34.91 3hn5 s LYS 136 CO 0.28 0.66 -0.22 0.08 -0.92 0.00 0.00 175.35 175.23 3hn5 s VAL 137 N -0.96 1.89 -0.06 3.17 1.01 -0.40 -0.74 120.40 124.31 3hn5 s VAL 137 Ca 0.16 -0.93 0.04 0.00 0.00 0.00 0.00 61.98 61.24 3hn5 s VAL 137 Cb -0.11 -1.64 -0.02 0.00 0.00 0.00 0.00 36.38 34.61 3hn5 s VAL 137 CO 0.06 0.52 -0.17 0.20 0.00 0.00 0.00 175.10 175.72 3hn5 s ASN 138 N 0.30 3.81 0.00 3.32 0.01 -0.57 -1.91 114.94 119.90 3hn5 s ASN 138 Ca -0.15 -0.28 0.00 0.00 -0.71 0.00 0.00 52.86 51.72 3hn5 s ASN 138 Cb -0.17 -0.92 -0.00 0.00 0.41 0.00 0.00 41.25 40.57 3hn5 s ASN 138 CO 0.07 0.30 -0.00 0.00 -1.51 0.00 0.00 177.10 175.96 3hn5 s ALA 139 N -0.47 0.03 0.17 0.60 0.00 -1.26 -1.07 121.76 119.75 3hn5 s ALA 139 Ca 0.06 -0.04 -0.16 0.00 0.00 0.00 0.00 51.96 51.82 3hn5 s ALA 139 Cb -0.12 0.00 0.02 0.00 0.00 0.00 0.00 23.12 23.03 3hn5 s ALA 139 CO 0.02 -0.00 0.44 -1.54 0.00 0.00 0.00 175.76 174.68 3hn5 s SER 140 N -0.08 -0.20 0.21 0.00 1.04 -0.20 -1.39 113.70 113.08 3hn5 s SER 140 Ca -0.01 -0.51 -0.23 0.00 0.48 0.00 0.00 55.95 55.69 3hn5 s SER 140 Cb -0.01 0.52 0.04 0.00 0.10 0.00 0.00 66.02 66.68 3hn5 s SER 140 CO -0.00 -0.97 0.79 0.72 0.98 0.00 0.00 173.24 174.76 3hn5 s PHE 141 N -3.87 -0.22 -0.08 5.02 -0.71 -0.58 -0.98 117.98 116.56 3hn5 s PHE 141 Ca 0.09 -0.14 -0.00 0.00 -1.04 0.00 0.00 56.93 55.83 3hn5 s PHE 141 Cb 0.01 0.66 -0.03 0.00 -1.21 0.00 0.00 43.02 42.45 3hn5 s PHE 141 CO -0.05 -1.03 -0.05 0.15 -1.34 0.00 0.00 175.22 172.90 3hn5 s LYS 142 N -3.66 2.88 -0.03 1.99 1.02 0.96 -0.40 119.74 122.50 3hn5 s LYS 142 Ca 0.10 -0.52 -0.30 0.00 0.02 0.00 0.00 55.97 55.27 3hn5 s LYS 142 Cb -0.04 -2.66 -0.03 0.00 -0.52 0.00 0.00 37.83 34.59 3hn5 s LYS 142 CO 0.02 0.63 1.04 0.08 -0.92 0.00 0.00 175.35 176.21 3hn5 s VAL 143 N -0.72 4.66 -0.23 3.17 1.01 0.07 -1.00 120.40 127.36 3hn5 s VAL 143 Ca 0.11 1.92 -0.05 0.00 0.00 0.00 0.00 61.98 63.96 3hn5 s VAL 143 Cb -0.11 -4.23 -0.01 0.00 0.00 0.00 0.00 36.38 32.03 3hn5 s VAL 143 CO 0.02 0.09 -0.01 -0.70 0.00 0.00 0.00 175.10 174.49 3hn5 s GLU 144 N 1.47 3.39 -0.22 2.72 2.12 -0.65 -1.16 118.70 126.37 3hn5 s GLU 144 Ca 0.52 -0.63 -0.15 0.00 0.36 0.00 0.00 54.97 55.08 3hn5 s GLU 144 Cb -0.22 -3.09 -0.04 0.00 0.26 0.00 0.00 34.13 31.04 3hn5 s GLU 144 CO 0.24 -0.22 0.34 0.21 -0.54 0.00 0.00 175.26 175.29 3hn5 s LYS 145 N 1.50 4.12 0.00 4.30 2.20 -1.26 -0.77 119.74 129.83 3hn5 s LYS 145 Ca 0.05 0.07 0.00 0.00 -0.36 0.00 0.00 55.97 55.74 3hn5 s LYS 145 Cb -0.15 -3.56 0.00 0.00 -1.51 0.00 0.00 37.83 32.62 3hn5 s LYS 145 CO -0.02 -0.06 0.00 0.28 -0.36 0.00 0.00 175.35 175.20 3hn5 n VAL 146 N 4.46 0.00 0.18 4.02 0.31 -0.15 -4.80 118.33 122.34 3hn5 n VAL 146 Ca -0.10 0.00 0.02 0.00 -0.01 0.00 0.00 64.34 64.25 3hn5 n VAL 146 Cb 0.51 -0.13 0.32 0.00 -0.91 0.00 0.00 33.84 33.63 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 -0.41 1.24 -0.72 3.52 0.00 -0.93 -3.49 119.26 118.47 3hn5 h ALA 147 Ca 0.00 -0.39 0.00 0.00 0.00 0.00 0.00 54.91 54.52 3hn5 h ALA 147 Cb 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.72 3hn5 h ALA 147 CO 0.00 0.53 0.00 0.41 0.00 0.00 0.00 179.25 180.19 3hn5 n GLY 148 N -0.23 -0.39 0.00 0.00 0.00 -0.42 -4.99 105.19 99.15 3hn5 n GLY 148 Ca -0.02 -1.07 0.00 0.00 0.00 0.00 0.00 46.02 44.94 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 1.07 0.00 -0.02 0.00 -1.26 -4.83 105.19 100.15 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 2.65 3.32 -0.02 0.00 -1.26 -4.62 105.19 105.25 3hn5 n GLY 150 Ca 0.00 -1.92 -0.35 0.00 0.00 0.00 0.00 46.02 43.75 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 -2.96 3.29 -0.02 -0.61 1.01 -1.26 -1.06 121.20 119.59 3hn5 s ILE 151 Ca 0.00 -0.53 -0.15 0.00 0.00 0.00 0.00 60.65 59.97 3hn5 s ILE 151 Cb 0.00 -2.47 -0.33 0.00 0.01 0.00 0.00 42.46 39.67 3hn5 s ILE 151 CO 0.00 0.45 0.83 -0.78 0.00 0.00 0.00 174.94 175.44 3hn5 h ASP 152 N 7.82 0.70 -5.00 3.58 3.58 -0.98 -3.45 116.42 122.68 3hn5 h ASP 152 Ca -0.39 -0.93 -0.09 0.00 0.42 0.00 0.00 57.03 56.04 3hn5 h ASP 152 Cb 1.17 -0.23 -0.19 0.00 1.72 0.00 0.00 39.33 41.80 3hn5 h ASP 152 CO 0.60 1.71 -0.10 -0.13 -2.88 0.00 0.00 179.24 178.44 3hn5 s ARG 153 N -2.57 0.82 0.01 0.28 0.52 -1.18 -4.90 118.95 111.93 3hn5 s ARG 153 Ca -0.13 -0.06 0.05 0.00 -0.52 0.00 0.00 55.73 55.07 3hn5 s ARG 153 Cb 0.04 0.38 -0.02 0.00 0.52 0.00 0.00 34.95 35.87 3hn5 s ARG 153 CO 0.89 -0.25 -0.16 0.14 0.02 0.00 0.00 175.30 175.94 3hn5 s VAL 154 N -1.41 1.30 0.18 3.52 -7.23 -1.11 -1.10 120.40 114.55 3hn5 s VAL 154 Ca -0.12 -0.86 -0.20 0.00 -1.81 0.00 0.00 61.98 59.00 3hn5 s VAL 154 Cb -0.03 -1.11 0.04 0.00 0.56 0.00 0.00 36.38 35.84 3hn5 s VAL 154 CO 0.05 0.24 0.55 0.72 -0.31 0.00 0.00 175.10 176.35 3hn5 s PHE 155 N -0.57 -0.29 0.00 2.82 -0.71 -0.69 -1.39 117.98 117.14 3hn5 s PHE 155 Ca 0.05 -0.01 0.00 0.00 -1.04 0.00 0.00 56.93 55.93 3hn5 s PHE 155 Cb -0.07 0.46 0.00 0.00 -1.21 0.00 0.00 43.02 42.20 3hn5 s PHE 155 CO 0.00 -0.88 0.00 1.97 -1.34 0.00 0.00 175.22 174.97 3hn5 n PHE 156 N -0.34 0.00 -3.61 3.49 1.16 -0.47 -0.29 117.46 117.39 3hn5 n PHE 156 Ca -0.13 0.00 -0.09 0.00 -1.87 0.00 0.00 57.45 55.36 3hn5 n PHE 156 Cb 0.63 0.00 -0.06 0.00 -1.61 0.00 0.00 39.48 38.44 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 0.03 5.98 1.43 0.01 -0.94 118.68 124.81 3hn5 s LEU 158 Ca 0.00 0.58 -0.23 0.00 -1.03 0.00 0.00 54.13 53.45 3hn5 s LEU 158 Cb 0.00 1.82 0.05 0.00 0.03 0.00 0.00 46.19 48.09 3hn5 s LEU 158 CO 0.00 -0.24 0.52 -0.55 0.23 0.00 0.00 176.35 176.31 3hn5 s SER 159 N -0.49 -0.44 0.00 2.29 0.15 -0.10 -1.67 113.70 113.43 3hn5 s SER 159 Ca 0.01 0.22 0.27 0.00 0.70 0.00 0.00 55.95 57.16 3hn5 s SER 159 Cb -0.03 0.48 0.91 0.00 -1.71 0.00 0.00 66.02 65.68 3hn5 s SER 159 CO -0.03 -0.69 1.69 0.35 1.20 0.00 0.00 173.24 175.77 3hn5 n THR 160 N 0.52 0.00 -4.43 6.45 -2.24 -1.26 0.07 114.28 113.39 3hn5 n THR 160 Ca -0.19 -0.01 -0.21 0.00 -2.27 0.00 0.00 64.05 61.38 3hn5 n THR 160 Cb 0.60 -0.10 -0.10 0.00 -2.10 0.00 0.00 70.33 68.62 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 -2.91 1.26 -0.44 4.28 -4.23 -1.26 -4.64 115.64 107.70 3hn5 s THR 161 Ca 0.15 -2.03 0.22 0.00 -1.18 0.00 0.00 61.69 58.86 3hn5 s THR 161 Cb 0.19 -2.65 0.23 0.00 1.34 0.00 0.00 72.50 71.60 3hn5 s THR 161 CO 0.59 -0.11 1.68 0.00 -0.54 0.00 0.00 174.62 176.24 3hn5 n GLN 162 N -0.62 0.17 -3.04 3.99 10.64 -1.26 -4.54 117.38 122.72 3hn5 n GLN 162 Ca -0.03 0.47 -0.43 0.00 -1.83 0.00 0.00 57.00 55.17 3hn5 n GLN 162 Cb 0.65 -1.88 -0.05 0.00 -0.86 0.00 0.00 30.24 28.10 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 -3.36 2.95 -0.03 2.61 0.08 -1.26 -4.94 117.98 114.03 3hn5 s PHE 163 Ca 0.03 -0.39 -0.01 0.00 0.12 0.00 0.00 56.93 56.68 3hn5 s PHE 163 Cb 0.08 -3.75 0.03 0.00 -0.57 0.00 0.00 43.02 38.81 3hn5 s PHE 163 CO 0.34 -1.17 0.04 0.08 -0.10 0.00 0.00 175.22 174.41 3hn5 s VAL 164 N 3.10 -0.06 0.17 -0.44 1.01 -1.26 -4.77 120.40 118.14 3hn5 s VAL 164 Ca 0.20 0.30 -0.06 0.00 0.00 0.00 0.00 61.98 62.42 3hn5 s VAL 164 Cb -0.17 -0.12 0.02 0.00 0.00 0.00 0.00 36.38 36.11 3hn5 s VAL 164 CO 0.14 0.13 0.33 -0.46 0.00 0.00 0.00 175.10 175.24 3hn5 n ASN 165 N 4.66 -0.95 0.28 3.32 0.23 -0.33 -4.93 115.26 117.53 3hn5 n ASN 165 Ca -0.17 -1.70 0.13 0.00 -0.53 0.00 0.00 54.58 52.30 3hn5 n ASN 165 Cb 0.50 1.60 0.81 0.00 -2.08 0.00 0.00 39.78 40.61 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 0.85 0.00 0.00 0.53 2.03 -2.00 -2.59 116.42 115.24 3hn5 h ASP 166 Ca -0.14 0.00 -0.18 0.00 -0.73 0.00 0.00 57.03 55.97 3hn5 h ASP 166 Cb 0.53 0.00 -0.03 0.00 -0.83 0.00 0.00 39.33 39.00 3hn5 h ASP 166 CO 0.18 0.02 -2.18 0.00 -1.03 0.00 0.00 179.24 176.23 3hn5 n ALA 167 N -2.38 2.15 -3.67 4.15 0.00 -1.26 -4.88 120.51 114.62 3hn5 n ALA 167 Ca -0.03 -0.92 -0.37 0.00 0.00 0.00 0.00 53.44 52.12 3hn5 n ALA 167 Cb 0.11 -0.46 -0.12 0.00 0.00 0.00 0.00 19.45 18.98 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 -2.99 2.17 -0.48 0.00 2.02 -0.98 -4.96 118.70 113.48 3hn5 s GLU 168 Ca -0.09 -1.67 0.07 0.00 0.02 0.00 0.00 54.97 53.30 3hn5 s GLU 168 Cb 0.10 -3.56 0.19 0.00 0.10 0.00 0.00 34.13 30.96 3hn5 s GLU 168 CO 0.86 -0.98 0.70 -3.38 0.02 0.00 0.00 175.26 172.48 3hn5 s HIS 169 N 1.21 -1.65 -2.00 1.61 -3.43 -1.26 -1.19 115.29 108.58 3hn5 s HIS 169 Ca 0.05 -0.30 0.22 0.00 -0.80 0.00 0.00 55.06 54.23 3hn5 s HIS 169 Cb -0.22 0.32 1.34 0.00 -1.43 0.00 0.00 32.58 32.59 3hn5 s HIS 169 CO -0.03 -1.24 1.75 0.27 -2.00 0.00 0.00 174.74 173.50 3hn5 n ASN 170 N 3.41 0.00 -0.07 7.38 0.23 -1.21 -3.33 115.26 121.66 3hn5 n ASN 170 Ca 0.16 -0.90 -0.15 0.00 -0.53 0.00 0.00 54.58 53.16 3hn5 n ASN 170 Cb 0.56 0.00 -0.05 0.00 -2.08 0.00 0.00 39.78 38.21 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 -0.94 1.05 -3.50 3.53 0.31 -0.67 -4.89 118.33 113.23 3hn5 n VAL 171 Ca 0.17 -0.10 -0.10 0.00 -0.01 0.00 0.00 64.34 64.29 3hn5 n VAL 171 Cb 0.08 -1.82 -0.03 0.00 -0.91 0.00 0.00 33.84 31.16 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 -6.36 -0.44 -0.05 4.52 2.15 -0.95 -4.72 116.67 110.83 3hn5 s ASP 172 Ca -0.22 0.12 0.01 0.00 0.43 0.00 0.00 52.55 52.89 3hn5 s ASP 172 Cb 0.07 0.43 0.02 0.00 -0.30 0.00 0.00 42.92 43.15 3hn5 s ASP 172 CO 0.29 -0.66 -0.04 -0.60 -0.17 0.00 0.00 175.17 173.99 3hn5 s ARG 173 N -2.79 0.78 -0.12 4.34 3.52 -1.26 -0.81 118.95 122.60 3hn5 s ARG 173 Ca 0.02 -0.07 -0.00 0.00 -0.13 0.00 0.00 55.73 55.54 3hn5 s ARG 173 Cb -0.01 -0.84 0.02 0.00 -1.56 0.00 0.00 34.95 32.57 3hn5 s ARG 173 CO -0.07 -0.11 -0.09 -0.47 -0.81 0.00 0.00 175.30 173.76 3hn5 s TYR 174 N 1.04 1.58 0.10 5.12 5.04 -0.12 -5.01 117.35 125.11 3hn5 s TYR 174 Ca -0.09 -0.81 0.06 0.00 -2.44 0.00 0.00 57.07 53.79 3hn5 s TYR 174 Cb -0.14 -1.29 -0.04 0.00 0.35 0.00 0.00 41.96 40.84 3hn5 s TYR 174 CO -0.01 -0.54 -0.06 -0.51 -1.34 0.00 0.00 175.55 173.10 3hn5 s ASP 175 N 1.67 4.66 -0.04 4.32 1.11 -1.26 -1.37 116.67 125.75 3hn5 s ASP 175 Ca 0.05 -0.29 0.03 0.00 0.18 0.00 0.00 52.55 52.52 3hn5 s ASP 175 Cb -0.13 -0.99 0.00 0.00 1.07 0.00 0.00 42.92 42.88 3hn5 s ASP 175 CO -0.09 0.18 -0.14 -1.61 1.18 0.00 0.00 175.17 174.70 3hn5 s GLU 176 N -2.23 1.54 0.00 8.23 2.02 -0.48 -5.01 118.70 122.77 3hn5 s GLU 176 Ca 0.23 -0.47 0.00 0.00 0.02 0.00 0.00 54.97 54.75 3hn5 s GLU 176 Cb -0.11 -1.34 0.00 0.00 0.10 0.00 0.00 34.13 32.78 3hn5 s GLU 176 CO 0.15 0.15 0.39 0.25 0.02 0.00 0.00 175.26 176.22 3hn5 n THR 177 N 3.37 0.14 -3.53 3.63 -2.24 -1.26 -2.77 114.28 111.62 3hn5 n THR 177 Ca -0.19 -0.32 -0.37 0.00 -2.27 0.00 0.00 64.05 60.90 3hn5 n THR 177 Cb 0.53 1.29 -0.06 0.00 -2.10 0.00 0.00 70.33 69.99 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 -0.14 6.75 -1.45 3.42 1.01 -1.26 -4.52 116.67 120.48 3hn5 s ASP 178 Ca 0.00 0.90 -0.07 0.00 0.71 0.00 0.00 52.55 54.09 3hn5 s ASP 178 Cb 0.00 -2.23 0.03 0.00 1.01 0.00 0.00 42.92 41.74 3hn5 s ASP 178 CO 0.00 0.29 0.60 0.59 0.21 0.00 0.00 175.17 176.86 3hn5 n ASN 179 N 1.60 -5.21 0.24 0.27 3.02 -1.26 -4.86 115.26 109.06 3hn5 n ASN 179 Ca -0.13 -0.35 0.12 0.00 -0.03 0.00 0.00 54.58 54.20 3hn5 n ASN 179 Cb 0.52 -4.23 0.49 0.00 -0.61 0.00 0.00 39.78 35.96 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 -1.31 0.00 -1.71 3.41 3.38 -1.89 -2.70 115.31 114.48 3hn5 h LEU 180 Ca -0.50 0.00 0.16 0.00 0.09 0.00 0.00 57.88 57.64 3hn5 h LEU 180 Cb 1.34 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 42.05 3hn5 h LEU 180 CO 0.56 0.14 0.49 -2.24 0.09 0.00 0.00 178.44 177.48 3hn5 h ASP 181 N 0.00 0.26 0.49 -0.43 2.03 -1.89 -1.88 116.42 115.00 3hn5 h ASP 181 Ca -0.00 0.02 0.00 0.00 -0.73 0.00 0.00 57.03 56.32 3hn5 h ASP 181 Cb 0.72 -0.03 0.00 0.00 -0.83 0.00 0.00 39.33 39.18 3hn5 h ASP 181 CO 0.02 0.13 0.00 0.00 -1.03 0.00 0.00 179.24 178.36 3hn5 h ALA 182 N 1.66 1.00 -0.29 4.15 0.00 -1.87 -2.74 119.26 121.17 3hn5 h ALA 182 Ca 0.35 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.26 3hn5 h ALA 182 Cb 0.98 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.77 3hn5 h ALA 182 CO -0.08 0.00 0.00 0.66 0.00 0.00 0.00 179.25 179.83 3hn5 n TYR 183 N -2.54 0.38 -1.51 0.00 4.02 -0.71 -4.84 117.16 111.97 3hn5 n TYR 183 Ca 0.00 -0.37 -0.40 0.00 -0.01 0.00 0.00 57.90 57.12 3hn5 n TYR 183 Cb 0.17 -0.02 -0.02 0.00 -0.02 0.00 0.00 39.34 39.45 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 0.64 8.14 -3.69 7.72 2.03 -1.03 -4.69 116.55 125.66 3hn5 n ASP 184 Ca 0.11 -2.72 -0.13 0.00 0.52 0.00 0.00 54.79 52.57 3hn5 n ASP 184 Cb 0.41 -1.53 -0.09 0.00 -0.72 0.00 0.00 41.12 39.20 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 1.53 0.63 0.21 -0.67 2.12 -1.26 -5.06 118.70 116.21 3hn5 s GLU 185 Ca 0.64 0.78 -0.32 0.00 0.36 0.00 0.00 54.97 56.43 3hn5 s GLU 185 Cb 0.18 0.29 -0.13 0.00 0.26 0.00 0.00 34.13 34.73 3hn5 s GLU 185 CO -0.07 -0.08 1.61 2.41 -0.54 0.00 0.00 175.26 178.59 3hn5 n THR 186 N 2.90 0.27 -0.36 -1.70 -1.04 -1.26 -2.41 114.28 110.69 3hn5 n THR 186 Ca -0.14 -0.07 0.00 0.00 -2.04 0.00 0.00 64.05 61.80 3hn5 n THR 186 Cb 0.56 -1.76 0.00 0.00 -1.82 0.00 0.00 70.33 67.31 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 3.27 0.82 3.76 3.41 0.00 -0.31 -4.98 105.19 111.17 3hn5 n GLY 187 Ca 0.15 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.76 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 -0.57 4.45 -0.21 1.61 -0.14 -1.01 -4.82 119.74 119.05 3hn5 s LYS 188 Ca 0.00 2.07 -0.07 0.00 -1.36 0.00 0.00 55.97 56.61 3hn5 s LYS 188 Cb 0.00 -3.12 -0.04 0.00 -1.68 0.00 0.00 37.83 33.00 3hn5 s LYS 188 CO 0.00 -0.06 0.06 -1.17 -0.76 0.00 0.00 175.35 173.42 3hn5 s LEU 189 N -1.60 3.62 -0.19 3.17 2.96 -1.26 -0.75 118.68 124.63 3hn5 s LEU 189 Ca 0.48 -0.05 -0.06 0.00 -0.22 0.00 0.00 54.13 54.28 3hn5 s LEU 189 Cb -0.37 -1.94 -0.03 0.00 0.50 0.00 0.00 46.19 44.35 3hn5 s LEU 189 CO 0.48 0.09 0.02 -0.47 -1.32 0.00 0.00 176.35 175.15 3hn5 s TYR 190 N 0.88 3.10 -0.19 5.38 6.14 0.46 -4.98 117.35 128.15 3hn5 s TYR 190 Ca 0.03 -0.25 0.01 0.00 0.64 0.00 0.00 57.07 57.50 3hn5 s TYR 190 Cb -0.14 -2.08 0.02 0.00 0.42 0.00 0.00 41.96 40.19 3hn5 s TYR 190 CO 0.02 -0.09 -0.18 0.99 0.64 0.00 0.00 175.55 176.93 3hn5 s THR 191 N 0.76 2.18 0.65 4.34 2.01 -1.26 -1.52 115.64 122.79 3hn5 s THR 191 Ca 0.01 -0.95 -0.15 0.00 0.31 0.00 0.00 61.69 60.91 3hn5 s THR 191 Cb -0.14 -1.94 -0.00 0.00 0.01 0.00 0.00 72.50 70.42 3hn5 s THR 191 CO 0.02 0.49 1.11 -0.36 -0.69 0.00 0.00 174.62 175.19 3hn5 s PHE 192 N 1.29 2.63 0.33 4.92 0.08 -0.49 -4.98 117.98 121.77 3hn5 s PHE 192 Ca 0.04 1.55 -0.29 0.00 0.12 0.00 0.00 56.93 58.36 3hn5 s PHE 192 Cb -0.14 -3.18 -0.12 0.00 -0.57 0.00 0.00 43.02 39.02 3hn5 s PHE 192 CO -0.12 -1.68 1.38 0.00 -0.10 0.00 0.00 175.22 174.70 3hn5 n ALA 193 N -2.34 1.65 -1.67 5.36 0.00 -1.26 -4.66 120.51 117.59 3hn5 n ALA 193 Ca 0.10 0.36 -0.46 0.00 0.00 0.00 0.00 53.44 53.45 3hn5 n ALA 193 Cb 0.52 -2.31 -0.04 0.00 0.00 0.00 0.00 19.45 17.62 3hn5 n ALA 193 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 3hn5 n THR 194 N 0.70 0.46 -4.68 0.00 -1.04 -1.26 -4.83 114.28 103.62 3hn5 n THR 194 Ca 0.05 -0.11 -0.33 0.00 -2.04 0.00 0.00 64.05 61.61 3hn5 n THR 194 Cb 0.36 -1.48 -0.13 0.00 -1.82 0.00 0.00 70.33 67.27 3hn5 n THR 194 CO 0.00 0.00 0.00 -0.13 -0.64 0.00 0.00 175.07 174.30 3hn5 s ARG 195 N 0.25 3.13 -0.11 -2.82 1.81 -0.80 -4.99 118.95 115.41 3hn5 s ARG 195 Ca 0.74 -0.62 0.01 0.00 -1.72 0.00 0.00 55.73 54.14 3hn5 s ARG 195 Cb -0.68 -2.64 -0.02 0.00 -0.45 0.00 0.00 34.95 31.17 3hn5 s ARG 195 CO 0.44 0.41 -0.14 0.34 -0.68 0.00 0.00 175.30 175.67 3hn5 s ASP 196 N -0.14 3.97 -0.18 0.23 -1.08 -1.26 -1.28 116.67 116.92 3hn5 s ASP 196 Ca 0.01 -0.31 0.15 0.00 -0.52 0.00 0.00 52.55 51.87 3hn5 s ASP 196 Cb -0.13 -1.46 0.39 0.00 -1.46 0.00 0.00 42.92 40.26 3hn5 s ASP 196 CO 0.03 0.20 1.25 -1.22 0.52 0.00 0.00 175.17 175.95 3hn5 n TYR 197 N 3.30 0.27 -0.34 -5.34 4.01 0.67 -4.72 117.16 115.00 3hn5 n TYR 197 Ca -0.18 -1.20 0.17 0.00 -0.16 0.00 0.00 57.90 56.53 3hn5 n TYR 197 Cb 0.53 -0.24 0.39 0.00 -0.31 0.00 0.00 39.34 39.70 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 0.66 0.58 -0.45 -0.72 2.02 -1.96 -1.88 112.91 111.16 3hn5 h THR 198 Ca 0.03 -0.20 0.00 0.00 0.77 0.00 0.00 66.41 67.00 3hn5 h THR 198 Cb 1.14 -0.07 0.00 0.00 -1.74 0.00 0.00 68.15 67.48 3hn5 h THR 198 CO 0.08 0.11 0.00 0.47 0.37 0.00 0.00 175.52 176.55 3hn5 n ASP 199 N -4.81 4.86 -4.38 4.18 8.00 -1.26 -4.86 116.55 118.27 3hn5 n ASP 199 Ca 0.26 -2.91 -0.42 0.00 0.71 0.00 0.00 54.79 52.43 3hn5 n ASP 199 Cb 0.72 -0.61 -0.10 0.00 -0.02 0.00 0.00 41.12 41.12 3hn5 n ASP 199 CO 0.00 0.00 0.00 0.21 -0.39 0.00 0.00 177.20 177.02 3hn5 s ASN 200 N -1.27 5.92 0.00 -2.24 3.84 -0.71 -5.08 114.94 115.39 3hn5 s ASN 200 Ca 0.49 -1.16 0.00 0.00 0.21 0.00 0.00 52.86 52.39 3hn5 s ASN 200 Cb 0.37 -2.09 0.00 0.00 -0.55 0.00 0.00 41.25 38.98 3hn5 s ASN 200 CO 0.14 -0.50 0.68 -1.54 -2.79 0.00 0.00 177.10 173.08 3hn5 n SER 201 N 5.08 1.85 0.00 -4.21 3.41 -1.26 -1.27 113.62 117.21 3hn5 n SER 201 Ca -0.11 -1.36 0.00 0.00 -0.26 0.00 0.00 58.87 57.14 3hn5 n SER 201 Cb 0.45 -0.38 0.00 0.00 -0.26 0.00 0.00 64.21 64.02 3hn5 n SER 201 CO 0.00 0.00 0.00 0.33 -0.16 0.00 0.00 175.04 175.21 3hn5 n PHE 203 N 1.56 0.00 -0.36 7.33 -0.00 -1.26 -0.90 117.46 123.83 3hn5 n PHE 203 Ca 0.00 0.00 0.05 0.00 -0.00 0.00 0.00 57.45 57.50 3hn5 n PHE 203 Cb 0.19 0.00 0.21 0.00 -0.00 0.00 0.00 39.48 39.88 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 1.03 -0.26 -4.13 1.08 -1.44 -1.15 115.11 110.24 3hn5 h GLN 204 Ca 0.00 -0.06 -0.14 0.00 -1.45 0.00 0.00 58.65 57.00 3hn5 h GLN 204 Cb 0.00 -0.23 -0.01 0.00 -0.05 0.00 0.00 27.48 27.19 3hn5 h GLN 204 CO 0.00 0.68 -0.41 1.15 -0.95 0.00 0.00 178.83 179.30 3hn5 h THR 205 N 1.06 1.30 -0.56 -0.54 2.02 -1.28 -2.15 112.91 112.76 3hn5 h THR 205 Ca 0.46 -1.59 0.03 0.00 0.77 0.00 0.00 66.41 66.09 3hn5 h THR 205 Cb 0.35 1.54 -0.04 0.00 -1.74 0.00 0.00 68.15 68.26 3hn5 h THR 205 CO -0.23 0.50 0.34 0.00 0.37 0.00 0.00 175.52 176.51 3hn5 h ALA 206 N 1.03 0.73 -0.82 6.16 0.00 -1.63 -0.70 119.26 124.03 3hn5 h ALA 206 Ca 0.04 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 54.96 3hn5 h ALA 206 Cb 0.93 -0.17 -0.05 0.00 0.00 0.00 0.00 17.79 18.51 3hn5 h ALA 206 CO 0.08 0.06 0.53 -0.07 0.00 0.00 0.00 179.25 179.86 3hn5 h LEU 207 N 0.67 0.90 -0.60 0.00 3.38 -1.04 -0.19 115.31 118.43 3hn5 h LEU 207 Ca 0.23 -0.01 -0.09 0.00 0.09 0.00 0.00 57.88 58.10 3hn5 h LEU 207 Cb 0.03 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.54 3hn5 h LEU 207 CO -0.10 0.63 0.03 0.11 0.09 0.00 0.00 178.44 179.20 3hn5 h LYS 208 N 1.06 1.04 0.00 1.13 1.57 -0.92 -2.28 116.57 118.17 3hn5 h LYS 208 Ca 0.32 -0.32 -0.01 0.00 -1.87 0.00 0.00 60.65 58.77 3hn5 h LYS 208 Cb -0.05 -0.10 -0.00 0.00 0.08 0.00 0.00 32.23 32.16 3hn5 h LYS 208 CO -0.09 1.01 -0.04 0.00 -0.57 0.00 0.00 179.45 179.75 3hn5 h ARG 209 N 0.94 0.00 -0.38 3.15 3.08 -0.98 -3.47 114.38 116.72 3hn5 h ARG 209 Ca 0.17 0.00 -0.11 0.00 0.07 0.00 0.00 59.98 60.12 3hn5 h ARG 209 Cb 0.52 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.54 3hn5 h ARG 209 CO 0.03 0.04 -0.11 0.41 -1.07 0.00 0.00 179.97 179.27 3hn5 n GLY 210 N -0.27 0.62 2.72 0.04 0.00 -0.15 -5.02 105.19 103.13 3hn5 n GLY 210 Ca -0.01 -0.78 -0.29 0.00 0.00 0.00 0.00 46.02 44.94 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 -2.21 0.59 -0.05 2.61 -4.23 -0.81 -4.82 115.64 106.71 3hn5 s THR 211 Ca 0.00 -0.88 -0.01 0.00 -1.18 0.00 0.00 61.69 59.62 3hn5 s THR 211 Cb 0.00 -1.25 0.03 0.00 1.34 0.00 0.00 72.50 72.61 3hn5 s THR 211 CO 0.00 -0.42 0.02 -0.22 -0.54 0.00 0.00 174.62 173.45 3hn5 s LEU 212 N 1.80 0.59 0.16 4.79 2.96 -0.12 -4.45 118.68 124.41 3hn5 s LEU 212 Ca 0.04 -0.02 0.09 0.00 -0.22 0.00 0.00 54.13 54.01 3hn5 s LEU 212 Cb -0.17 -0.30 -0.04 0.00 0.50 0.00 0.00 46.19 46.18 3hn5 s LEU 212 CO -0.17 -0.19 -0.13 -0.36 -1.32 0.00 0.00 176.35 174.18 3hn5 s PHE 213 N 1.80 2.59 0.07 5.38 0.40 0.11 -0.05 117.98 128.28 3hn5 s PHE 213 Ca 0.01 -0.24 0.00 0.00 -0.60 0.00 0.00 56.93 56.11 3hn5 s PHE 213 Cb -0.12 -1.30 -0.04 0.00 0.51 0.00 0.00 43.02 42.06 3hn5 s PHE 213 CO -0.04 0.47 -0.05 0.20 0.70 0.00 0.00 175.22 176.51 3hn5 s GLY 214 N -2.58 0.61 0.00 4.36 0.00 0.84 -0.92 107.32 109.63 3hn5 s GLY 214 Ca 0.22 -1.24 -0.19 0.00 0.00 0.00 0.00 44.72 43.52 3hn5 s GLY 214 CO 0.13 -1.34 0.41 -1.60 0.00 0.00 0.00 173.10 170.70 3hn5 s ARG 215 N -3.69 0.83 0.06 2.90 3.52 -1.26 -0.41 118.95 120.89 3hn5 s ARG 215 Ca 0.08 -0.19 0.08 0.00 -0.13 0.00 0.00 55.73 55.57 3hn5 s ARG 215 Cb 0.05 0.37 -0.03 0.00 -1.56 0.00 0.00 34.95 33.78 3hn5 s ARG 215 CO -0.07 -0.26 -0.21 0.42 -0.81 0.00 0.00 175.30 174.38 3hn5 s ILE 216 N -1.76 2.61 -0.04 4.11 1.01 -1.26 -4.36 121.20 121.51 3hn5 s ILE 216 Ca -0.10 -1.31 0.02 0.00 0.00 0.00 0.00 60.65 59.26 3hn5 s ILE 216 Cb -0.03 -2.10 0.01 0.00 0.01 0.00 0.00 42.46 40.36 3hn5 s ILE 216 CO 0.03 0.30 -0.06 0.00 0.00 0.00 0.00 174.94 175.20 3hn5 s ILE 218 N 0.60 5.33 -0.44 0.00 1.01 -0.22 -1.71 121.20 125.76 3hn5 s ILE 218 Ca -0.08 0.17 -0.12 0.00 0.00 0.00 0.00 60.65 60.61 3hn5 s ILE 218 Cb -0.12 -3.46 0.07 0.00 0.01 0.00 0.00 42.46 38.96 3hn5 s ILE 218 CO 0.00 0.38 0.33 0.86 0.00 0.00 0.00 174.94 176.51 3hn5 s TRP 219 N 0.80 3.29 0.34 3.97 -0.11 -0.26 -1.41 118.94 125.56 3hn5 s TRP 219 Ca 0.07 -1.21 -0.28 0.00 1.22 0.00 0.00 56.10 55.91 3hn5 s TRP 219 Cb -0.13 -3.05 -0.09 0.00 -1.50 0.00 0.00 33.47 28.70 3hn5 s TRP 219 CO 0.02 -0.82 1.15 -2.14 -4.62 0.00 0.00 176.95 170.55 3hn5 s PRO 220 N 1.54 4.37 0.14 5.86 0.02 -1.26 -0.38 135.00 145.28 3hn5 s PRO 220 Ca 0.03 1.87 -0.34 0.00 0.02 0.00 0.00 61.00 62.58 3hn5 s PRO 220 Cb -0.24 -2.95 -0.14 0.00 0.02 0.00 0.00 34.50 31.19 3hn5 s PRO 220 CO 0.04 -0.05 1.60 1.63 -0.33 0.00 0.00 177.00 179.89 3hn5 n LYS 221 N 0.66 2.12 0.00 5.54 5.02 -0.22 -1.79 118.16 129.50 3hn5 n LYS 221 Ca 0.01 0.77 0.00 0.00 -2.02 0.00 0.00 58.31 57.07 3hn5 n LYS 221 Cb 0.45 -2.54 0.00 0.00 -0.02 0.00 0.00 35.03 32.92 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 3.47 0.96 3.86 0.72 0.00 -1.26 -4.78 105.19 108.16 3hn5 n GLY 222 Ca 0.17 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.85 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 -2.49 6.71 0.00 1.61 0.15 -0.74 -4.97 113.70 113.98 3hn5 s SER 223 Ca 0.00 0.94 0.30 0.00 0.70 0.00 0.00 55.95 57.89 3hn5 s SER 223 Cb 0.00 -2.24 1.52 0.00 -1.71 0.00 0.00 66.02 63.60 3hn5 s SER 223 CO 0.00 0.08 2.01 -0.90 1.20 0.00 0.00 173.24 175.63 3hn5 n ASP 224 N 0.58 0.67 -3.77 5.45 5.75 -1.26 -4.90 116.55 119.06 3hn5 n ASP 224 Ca -0.04 -1.23 -0.13 0.00 -0.01 0.00 0.00 54.79 53.38 3hn5 n ASP 224 Cb 0.52 -0.00 -0.09 0.00 -1.03 0.00 0.00 41.12 40.52 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 -2.00 0.62 0.64 0.11 -1.52 -1.26 -4.89 119.66 111.35 3hn5 s GLN 225 Ca 0.43 -0.13 -0.13 0.00 -1.95 0.00 0.00 55.36 53.58 3hn5 s GLN 225 Cb 0.21 0.28 -0.02 0.00 -0.22 0.00 0.00 33.01 33.26 3hn5 s GLN 225 CO 0.35 -0.16 1.05 0.20 -0.25 0.00 0.00 175.29 176.48 3hn5 s GLY 226 N -1.15 1.87 -0.01 3.09 0.00 -1.26 -4.42 107.32 105.44 3hn5 s GLY 226 Ca -0.12 0.20 0.04 0.00 0.00 0.00 0.00 44.72 44.84 3hn5 s GLY 226 CO 0.04 0.50 -0.12 -1.50 0.00 0.00 0.00 173.10 172.02 3hn5 s ILE 227 N -2.80 3.25 0.31 0.90 1.10 -0.50 -4.61 121.20 118.86 3hn5 s ILE 227 Ca 0.60 -0.84 0.06 0.00 -0.51 0.00 0.00 60.65 59.96 3hn5 s ILE 227 Cb -0.14 -2.36 -0.06 0.00 0.15 0.00 0.00 42.46 40.05 3hn5 s ILE 227 CO 0.46 0.45 -0.03 -0.31 -2.11 0.00 0.00 174.94 173.40 3hn5 s TYR 228 N -0.89 2.08 0.91 3.50 1.51 -0.69 -1.06 117.35 122.71 3hn5 s TYR 228 Ca 0.14 -0.72 -0.13 0.00 -1.01 0.00 0.00 57.07 55.35 3hn5 s TYR 228 Cb -0.11 -1.26 0.14 0.00 -0.11 0.00 0.00 41.96 40.63 3hn5 s TYR 228 CO 0.04 0.28 1.18 -1.54 -1.11 0.00 0.00 175.55 174.41 3hn5 s SER 229 N -3.50 3.54 0.82 2.29 1.04 -0.01 -4.50 113.70 113.38 3hn5 s SER 229 Ca 0.32 0.76 -0.11 0.00 0.48 0.00 0.00 55.95 57.41 3hn5 s SER 229 Cb 0.05 -1.20 0.09 0.00 0.10 0.00 0.00 66.02 65.06 3hn5 s SER 229 CO 0.14 -2.51 1.12 -0.54 0.98 0.00 0.00 173.24 172.43 3hn5 s LYS 230 N -5.48 1.82 0.35 4.02 1.02 -1.26 -4.70 119.74 115.50 3hn5 s LYS 230 Ca 0.66 1.35 -0.28 0.00 0.02 0.00 0.00 55.97 57.71 3hn5 s LYS 230 Cb -0.11 -1.83 -0.10 0.00 -0.52 0.00 0.00 37.83 35.26 3hn5 s LYS 230 CO 0.52 -2.00 1.30 0.08 -0.92 0.00 0.00 175.35 174.33 3hn5 s VAL 231 N -2.75 2.71 -0.13 3.17 1.01 -1.26 -4.68 120.40 118.47 3hn5 s VAL 231 Ca 0.64 0.69 0.01 0.00 0.00 0.00 0.00 61.98 63.32 3hn5 s VAL 231 Cb -0.20 -3.43 -0.01 0.00 0.00 0.00 0.00 36.38 32.74 3hn5 s VAL 231 CO 0.56 0.15 -0.16 -0.63 0.00 0.00 0.00 175.10 175.02 3hn5 s ILE 232 N -1.18 2.76 -0.43 2.22 1.01 0.45 -4.98 121.20 121.06 3hn5 s ILE 232 Ca 0.51 -0.76 -0.21 0.00 0.00 0.00 0.00 60.65 60.19 3hn5 s ILE 232 Cb -0.39 -2.14 0.02 0.00 0.01 0.00 0.00 42.46 39.96 3hn5 s ILE 232 CO 0.52 0.53 0.65 -0.60 0.00 0.00 0.00 174.94 176.04 3hn5 s ARG 233 N 0.41 3.36 0.05 2.79 3.52 -1.26 -0.11 118.95 127.71 3hn5 s ARG 233 Ca -0.12 -0.28 0.04 0.00 -0.13 0.00 0.00 55.73 55.24 3hn5 s ARG 233 Cb -0.16 -3.93 -0.24 0.00 -1.56 0.00 0.00 34.95 29.06 3hn5 s ARG 233 CO 0.06 -0.98 1.02 -0.07 -0.81 0.00 0.00 175.30 174.52 3hn5 h LEU 234 N 9.69 0.17 0.00 -0.88 3.38 -0.81 -3.49 115.31 123.37 3hn5 h LEU 234 Ca -0.25 -0.22 0.00 0.00 0.09 0.00 0.00 57.88 57.50 3hn5 h LEU 234 Cb 1.10 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.79 3hn5 h LEU 234 CO 0.89 1.18 0.00 1.17 0.09 0.00 0.00 178.44 181.77