#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hx6 s THR 2 N 0.00 4.65 -0.14 2.03 -4.23 -1.26 -4.83 115.64 111.86 2hx6 s THR 2 Ca 0.00 -2.21 -0.11 0.00 -1.18 0.00 0.00 61.69 58.19 2hx6 s THR 2 Cb 0.00 -5.00 -0.08 0.00 1.34 0.00 0.00 72.50 68.76 2hx6 s THR 2 CO 0.00 -1.76 0.09 0.40 -0.54 0.00 0.00 174.62 172.81 2hx6 h ILE 3 N 5.17 0.41 -0.26 2.99 1.08 -2.06 -3.48 117.51 121.36 2hx6 h ILE 3 Ca 0.34 -1.38 0.00 0.00 -0.39 0.00 0.00 64.86 63.43 2hx6 h ILE 3 Cb 0.89 0.84 0.00 0.00 -3.07 0.00 0.00 36.82 35.48 2hx6 h ILE 3 CO 1.31 0.14 0.00 0.59 -0.69 0.00 0.00 178.15 179.50 2hx6 n ASN 4 N -4.65 0.00 -0.01 1.72 3.02 -1.26 -4.59 115.26 109.48 2hx6 n ASN 4 Ca -0.08 0.00 -0.01 0.00 -0.03 0.00 0.00 54.58 54.46 2hx6 n ASN 4 Cb 0.26 -0.11 -0.00 0.00 -0.61 0.00 0.00 39.78 39.32 2hx6 n ASN 4 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 2hx6 n THR 5 N -0.13 0.26 0.44 3.41 -2.24 -1.26 -3.24 114.28 111.52 2hx6 n THR 5 Ca 0.00 0.45 0.11 0.00 -2.27 0.00 0.00 64.05 62.34 2hx6 n THR 5 Cb 0.00 -1.66 0.45 0.00 -2.10 0.00 0.00 70.33 67.02 2hx6 n THR 5 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2hx6 n GLU 6 N -2.71 0.15 0.09 -0.78 1.02 -1.26 -1.49 120.64 115.67 2hx6 n GLU 6 Ca -0.01 0.37 -0.18 0.00 -0.02 0.00 0.00 57.16 57.31 2hx6 n GLU 6 Cb 0.05 -1.78 -0.14 0.00 -0.02 0.00 0.00 31.44 29.55 2hx6 n GLU 6 CO 0.00 0.00 0.00 -0.39 1.18 0.00 0.00 177.13 177.92 2hx6 h VAL 7 N 0.00 1.29 -0.36 2.62 -1.51 -1.91 -1.65 116.25 114.73 2hx6 h VAL 7 Ca 0.00 -2.87 -0.10 0.00 -1.23 0.00 0.00 66.70 62.51 2hx6 h VAL 7 Cb 0.36 2.87 -0.01 0.00 -2.13 0.00 0.00 31.29 32.38 2hx6 h VAL 7 CO 0.00 0.85 -0.15 0.15 -1.23 0.00 0.00 177.57 177.19 2hx6 h PHE 8 N 0.08 0.85 -0.63 5.19 3.04 -1.24 0.19 116.94 124.44 2hx6 h PHE 8 Ca -0.21 -0.20 -0.01 0.00 3.98 0.00 0.00 57.97 61.52 2hx6 h PHE 8 Cb 2.03 -0.20 -0.03 0.00 2.56 0.00 0.00 35.95 40.31 2hx6 h PHE 8 CO 0.07 0.92 0.34 0.82 -2.02 0.00 0.00 178.31 178.45 2hx6 h ILE 9 N 0.54 1.20 -0.44 1.41 2.04 -1.47 0.24 117.51 121.02 2hx6 h ILE 9 Ca 0.08 -0.51 -0.02 0.00 1.00 0.00 0.00 64.86 65.41 2hx6 h ILE 9 Cb 0.68 0.40 -0.02 0.00 -0.74 0.00 0.00 36.82 37.14 2hx6 h ILE 9 CO 0.05 0.22 0.19 -0.09 0.00 0.00 0.00 178.15 178.52 2hx6 h ARG 10 N 0.85 0.65 -0.03 2.37 9.65 -0.86 0.22 114.38 127.23 2hx6 h ARG 10 Ca 0.22 -0.11 -0.03 0.00 -1.10 0.00 0.00 59.98 58.96 2hx6 h ARG 10 Cb 0.05 -0.11 -0.01 0.00 -1.39 0.00 0.00 29.97 28.51 2hx6 h ARG 10 CO -0.03 0.58 -0.13 0.00 2.80 0.00 0.00 179.97 183.19 2hx6 h ARG 11 N 0.57 0.05 0.02 0.20 3.08 -0.54 0.42 114.38 118.18 2hx6 h ARG 11 Ca 0.15 -0.01 -0.00 0.00 0.07 0.00 0.00 59.98 60.19 2hx6 h ARG 11 Cb 0.16 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.20 2hx6 h ARG 11 CO -0.02 0.18 -0.01 -0.91 -1.07 0.00 0.00 179.97 178.15 2hx6 h ASN 12 N 0.05 -0.02 0.12 7.04 -0.26 -0.80 -1.13 115.58 120.58 2hx6 h ASN 12 Ca 0.01 -0.75 -0.02 0.00 -0.56 0.00 0.00 56.30 54.97 2hx6 h ASN 12 Cb 0.26 0.00 -0.00 0.00 -1.06 0.00 0.00 38.32 37.52 2hx6 h ASN 12 CO 0.02 0.78 -0.11 0.11 -1.06 0.00 0.00 177.43 177.16 2hx6 h LYS 13 N -0.85 0.00 0.12 0.81 1.79 -0.64 0.18 116.57 117.98 2hx6 h LYS 13 Ca -0.00 0.00 -0.01 0.00 -2.18 0.00 0.00 60.65 58.46 2hx6 h LYS 13 Cb 0.77 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.42 2hx6 h LYS 13 CO 0.00 0.11 -0.06 1.25 -1.08 0.00 0.00 179.45 179.68 2hx6 h LEU 14 N 0.00 -0.14 -1.23 2.94 7.12 -0.96 0.17 115.31 123.21 2hx6 h LEU 14 Ca -0.00 -0.27 0.13 0.00 0.13 0.00 0.00 57.88 57.87 2hx6 h LEU 14 Cb 0.20 0.04 -0.07 0.00 -0.53 0.00 0.00 40.66 40.30 2hx6 h LEU 14 CO 0.01 0.20 0.58 0.03 -0.13 0.00 0.00 178.44 179.14 2hx6 h ARG 15 N -0.50 0.76 -0.21 1.25 3.08 0.14 0.66 114.38 119.55 2hx6 h ARG 15 Ca -0.02 -0.05 -0.17 0.00 0.07 0.00 0.00 59.98 59.82 2hx6 h ARG 15 Cb 0.40 -0.17 0.00 0.00 0.08 0.00 0.00 29.97 30.28 2hx6 h ARG 15 CO 0.03 0.50 -0.51 0.07 -1.07 0.00 0.00 179.97 178.98 2hx6 h ARG 16 N 0.78 0.72 -0.59 0.04 -0.00 -0.73 -2.22 114.38 112.39 2hx6 h ARG 16 Ca 0.44 -0.49 0.04 0.00 -0.00 0.00 0.00 59.98 59.97 2hx6 h ARG 16 Cb 0.61 0.07 -0.04 0.00 -0.00 0.00 0.00 29.97 30.61 2hx6 h ARG 16 CO -0.21 1.12 0.34 0.45 -0.00 0.00 0.00 179.97 181.67 2hx6 h HIS 17 N 0.44 0.63 0.36 4.08 3.86 0.33 0.13 115.15 124.98 2hx6 h HIS 17 Ca -0.00 0.02 -0.02 0.00 -1.16 0.00 0.00 60.37 59.21 2hx6 h HIS 17 Cb 1.13 -0.20 0.00 0.00 1.06 0.00 0.00 27.41 29.40 2hx6 h HIS 17 CO 0.09 0.34 -0.17 0.35 0.86 0.00 0.00 177.93 179.39 2hx6 h PHE 18 N 0.66 -0.45 -0.01 2.45 3.04 0.22 -1.98 116.94 120.86 2hx6 h PHE 18 Ca 0.25 -0.01 -0.19 0.00 3.98 0.00 0.00 57.97 62.00 2hx6 h PHE 18 Cb 0.08 0.15 -0.01 0.00 2.56 0.00 0.00 35.95 38.73 2hx6 h PHE 18 CO -0.07 -0.13 -0.82 0.93 -2.02 0.00 0.00 178.31 176.21 2hx6 h GLU 19 N -0.81 0.22 -0.13 1.11 5.08 -1.43 -1.10 114.58 117.52 2hx6 h GLU 19 Ca -0.05 -0.22 -0.21 0.00 -1.00 0.00 0.00 59.36 57.88 2hx6 h GLU 19 Cb 0.53 0.06 0.01 0.00 0.50 0.00 0.00 28.75 29.84 2hx6 h GLU 19 CO 0.08 0.92 -0.74 0.77 -1.00 0.00 0.00 179.01 179.04 2hx6 h SER 20 N 0.13 0.88 0.75 1.42 0.02 -0.84 -0.98 113.55 114.93 2hx6 h SER 20 Ca -0.04 -0.64 -0.12 0.00 -0.84 0.00 0.00 61.79 60.15 2hx6 h SER 20 Cb 1.42 -0.26 -0.02 0.00 0.14 0.00 0.00 62.40 63.68 2hx6 h SER 20 CO 0.13 1.38 -0.59 -0.33 -1.14 0.00 0.00 176.83 176.28 2hx6 h GLU 21 N 0.44 0.00 -0.81 3.45 3.07 -1.48 -2.12 114.58 117.12 2hx6 h GLU 21 Ca -0.06 0.00 0.06 0.00 -0.50 0.00 0.00 59.36 58.86 2hx6 h GLU 21 Cb 1.38 0.00 -0.06 0.00 -0.84 0.00 0.00 28.75 29.23 2hx6 h GLU 21 CO 0.15 0.59 0.50 0.35 -1.40 0.00 0.00 179.01 179.20 2hx6 h PHE 22 N 0.00 0.92 -0.81 4.33 3.57 -1.06 0.14 116.94 124.03 2hx6 h PHE 22 Ca -0.01 0.03 0.02 0.00 3.53 0.00 0.00 57.97 61.54 2hx6 h PHE 22 Cb 1.12 -0.29 -0.04 0.00 2.79 0.00 0.00 35.95 39.53 2hx6 h PHE 22 CO 0.00 0.47 0.54 0.00 -2.23 0.00 0.00 178.31 177.08 2hx6 h ARG 23 N 0.91 1.03 -0.15 1.11 3.08 -0.89 0.18 114.38 119.64 2hx6 h ARG 23 Ca 0.35 -0.06 0.02 0.00 0.07 0.00 0.00 59.98 60.36 2hx6 h ARG 23 Cb 0.16 -0.23 -0.02 0.00 0.08 0.00 0.00 29.97 29.95 2hx6 h ARG 23 CO -0.17 0.68 0.03 0.37 -1.07 0.00 0.00 179.97 179.81 2hx6 h GLN 24 N 1.06 0.09 -0.45 0.04 5.75 -0.51 0.15 115.11 121.23 2hx6 h GLN 24 Ca 0.31 -0.01 -0.08 0.00 -0.15 0.00 0.00 58.65 58.73 2hx6 h GLN 24 Cb -0.07 -0.02 -0.02 0.00 1.07 0.00 0.00 27.48 28.45 2hx6 h GLN 24 CO -0.08 0.06 -0.01 0.82 -2.65 0.00 0.00 178.83 176.97 2hx6 h ILE 25 N 0.09 1.26 0.00 2.39 2.04 -0.42 -1.39 117.51 121.49 2hx6 h ILE 25 Ca 0.07 -1.07 -0.10 0.00 1.00 0.00 0.00 64.86 64.76 2hx6 h ILE 25 Cb 0.06 1.05 -0.01 0.00 -0.74 0.00 0.00 36.82 37.17 2hx6 h ILE 25 CO -0.09 0.37 -0.49 0.78 0.00 0.00 0.00 178.15 178.71 2hx6 h ASN 26 N 0.66 0.00 0.02 1.72 -0.26 -0.66 -1.01 115.58 116.05 2hx6 h ASN 26 Ca 0.13 0.00 -0.15 0.00 -0.56 0.00 0.00 56.30 55.71 2hx6 h ASN 26 Cb 0.51 0.00 -0.01 0.00 -1.06 0.00 0.00 38.32 37.77 2hx6 h ASN 26 CO 0.03 0.49 -0.52 -1.13 -1.06 0.00 0.00 177.43 175.24 2hx6 h ASN 27 N 0.00 0.60 -0.15 5.81 -0.00 -0.62 0.19 115.58 121.40 2hx6 h ASN 27 Ca -0.00 -0.31 -0.15 0.00 -0.00 0.00 0.00 56.30 55.84 2hx6 h ASN 27 Cb 1.08 -0.17 -0.01 0.00 -0.00 0.00 0.00 38.32 39.22 2hx6 h ASN 27 CO 0.06 1.00 -0.42 -0.08 -0.00 0.00 0.00 177.43 178.00 2hx6 h GLU 28 N 0.42 0.69 0.02 6.67 4.57 -1.02 -1.47 114.58 124.47 2hx6 h GLU 28 Ca 0.02 -0.37 -0.00 0.00 -1.18 0.00 0.00 59.36 57.83 2hx6 h GLU 28 Cb 1.05 0.01 0.00 0.00 -0.16 0.00 0.00 28.75 29.65 2hx6 h GLU 28 CO 0.10 0.98 -0.01 0.82 -1.18 0.00 0.00 179.01 179.72 2hx6 h ILE 29 N 0.56 1.17 -0.23 2.32 2.04 -1.08 0.13 117.51 122.42 2hx6 h ILE 29 Ca 0.04 -0.59 -0.03 0.00 1.00 0.00 0.00 64.86 65.28 2hx6 h ILE 29 Cb 0.96 1.57 -0.01 0.00 -0.74 0.00 0.00 36.82 38.59 2hx6 h ILE 29 CO 0.09 0.15 -0.01 0.03 0.00 0.00 0.00 178.15 178.41 2hx6 h ARG 30 N -0.29 0.34 0.06 2.37 2.47 -0.66 0.27 114.38 118.94 2hx6 h ARG 30 Ca -0.00 -0.06 -0.19 0.00 -1.26 0.00 0.00 59.98 58.47 2hx6 h ARG 30 Cb 0.27 -0.06 0.02 0.00 -1.65 0.00 0.00 29.97 28.55 2hx6 h ARG 30 CO 0.01 0.38 -0.76 1.05 0.56 0.00 0.00 179.97 181.20 2hx6 h GLU 31 N 0.33 0.42 -0.16 0.04 4.11 -1.23 -2.00 114.58 116.09 2hx6 h GLU 31 Ca 0.08 -0.53 -0.20 0.00 0.07 0.00 0.00 59.36 58.78 2hx6 h GLU 31 Cb 0.25 0.17 0.01 0.00 0.50 0.00 0.00 28.75 29.67 2hx6 h GLU 31 CO 0.01 1.19 -0.67 0.00 0.07 0.00 0.00 179.01 179.61 2hx6 h ALA 32 N 0.25 0.29 0.00 1.06 0.00 -0.69 0.27 119.26 120.45 2hx6 h ALA 32 Ca -0.11 -0.56 -0.11 0.00 0.00 0.00 0.00 54.91 54.13 2hx6 h ALA 32 Cb 1.50 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 19.26 2hx6 h ALA 32 CO 0.15 0.59 -0.50 1.03 0.00 0.00 0.00 179.25 180.52 2hx6 h SER 33 N 0.44 0.00 0.26 0.00 0.87 -0.60 0.79 113.55 115.31 2hx6 h SER 33 Ca -0.04 0.00 -0.28 0.00 -1.23 0.00 0.00 61.79 60.24 2hx6 h SER 33 Cb 1.30 0.00 0.02 0.00 -0.44 0.00 0.00 62.40 63.28 2hx6 h SER 33 CO 0.14 0.50 -1.20 0.11 -0.53 0.00 0.00 176.83 175.85 2hx6 h LYS 34 N 0.00 0.52 -0.01 2.24 1.79 -1.31 -1.01 116.57 118.79 2hx6 h LYS 34 Ca -0.01 -0.71 -0.16 0.00 -2.18 0.00 0.00 60.65 57.60 2hx6 h LYS 34 Cb 0.96 0.23 -0.02 0.00 -1.58 0.00 0.00 32.23 31.83 2hx6 h LYS 34 CO 0.07 1.31 -0.72 0.00 -1.08 0.00 0.00 179.45 179.02 2hx6 h ALA 35 N 0.42 0.78 0.00 3.86 0.00 -0.35 -2.43 119.26 121.54 2hx6 h ALA 35 Ca -0.16 -0.64 0.00 0.00 0.00 0.00 0.00 54.91 54.10 2hx6 h ALA 35 Cb 1.88 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.56 2hx6 h ALA 35 CO 0.22 0.87 0.00 0.00 0.00 0.00 0.00 179.25 180.34 2hx6 n ALA 36 N -2.42 2.05 -0.59 0.00 0.00 0.27 -4.93 120.51 114.88 2hx6 n ALA 36 Ca -0.02 -0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.35 2hx6 n ALA 36 Cb 0.70 -1.37 0.00 0.00 0.00 0.00 0.00 19.45 18.78 2hx6 n ALA 36 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2hx6 n GLY 37 N 0.87 0.65 3.79 0.00 0.00 -0.92 -5.04 105.19 104.54 2hx6 n GLY 37 Ca 0.06 -0.52 -0.22 0.00 0.00 0.00 0.00 46.02 45.34 2hx6 n GLY 37 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2hx6 n VAL 38 N -2.59 0.00 -0.28 1.61 0.24 -0.39 -5.03 118.33 111.88 2hx6 n VAL 38 Ca 0.00 -1.62 0.02 0.00 -2.04 0.00 0.00 64.34 60.69 2hx6 n VAL 38 Cb 0.00 -0.81 0.09 0.00 -1.47 0.00 0.00 33.84 31.65 2hx6 n VAL 38 CO 0.00 0.00 0.00 -1.28 -2.14 0.00 0.00 176.83 173.41 2hx6 h SER 39 N -0.41 -0.80 -1.70 -1.34 0.87 -1.91 -3.43 113.55 104.84 2hx6 h SER 39 Ca -0.31 0.24 0.00 0.00 -1.23 0.00 0.00 61.79 60.50 2hx6 h SER 39 Cb 1.20 0.51 0.00 0.00 -0.44 0.00 0.00 62.40 63.67 2hx6 h SER 39 CO 0.35 -0.27 0.00 -0.24 -0.53 0.00 0.00 176.83 176.14 2hx6 n SER 40 N -5.52 -0.95 -4.61 6.23 2.88 -1.26 -5.05 113.62 105.33 2hx6 n SER 40 Ca 0.11 0.00 -0.27 0.00 -1.33 0.00 0.00 58.87 57.38 2hx6 n SER 40 Cb 0.40 0.08 -0.09 0.00 -0.75 0.00 0.00 64.21 63.86 2hx6 n SER 40 CO 0.00 0.00 0.00 0.72 -1.23 0.00 0.00 175.04 174.53 2hx6 s PHE 41 N -0.28 2.74 0.26 0.66 -0.71 -1.26 -4.71 117.98 114.69 2hx6 s PHE 41 Ca 0.00 -0.17 0.08 0.00 -1.04 0.00 0.00 56.93 55.79 2hx6 s PHE 41 Cb 0.00 -1.34 -0.05 0.00 -1.21 0.00 0.00 43.02 40.41 2hx6 s PHE 41 CO 0.00 0.51 -0.10 -1.58 -1.34 0.00 0.00 175.22 172.70 2hx6 s HIS 42 N -1.66 1.96 -0.04 3.49 2.46 -0.98 -4.64 115.29 115.88 2hx6 s HIS 42 Ca 0.26 -0.60 0.06 0.00 0.47 0.00 0.00 55.06 55.24 2hx6 s HIS 42 Cb -0.09 -1.03 -0.02 0.00 -0.13 0.00 0.00 32.58 31.31 2hx6 s HIS 42 CO 0.17 0.38 -0.23 -0.51 -2.47 0.00 0.00 174.74 172.07 2hx6 s LEU 43 N -3.43 2.21 0.01 8.88 2.01 -1.26 -0.33 118.68 126.77 2hx6 s LEU 43 Ca 0.28 -0.43 0.03 0.00 0.01 0.00 0.00 54.13 54.03 2hx6 s LEU 43 Cb 0.01 -1.40 -0.01 0.00 0.01 0.00 0.00 46.19 44.80 2hx6 s LEU 43 CO 0.11 0.30 -0.11 -0.54 1.01 0.00 0.00 176.35 177.12 2hx6 s LYS 44 N -0.46 0.82 0.13 1.70 1.02 -0.96 -4.90 119.74 117.10 2hx6 s LYS 44 Ca 0.05 -0.47 0.02 0.00 0.02 0.00 0.00 55.97 55.60 2hx6 s LYS 44 Cb -0.11 -0.79 -0.04 0.00 -0.52 0.00 0.00 37.83 36.37 2hx6 s LYS 44 CO 0.01 0.21 0.24 0.71 -0.92 0.00 0.00 175.35 175.60 2hx6 s TYR 45 N -0.44 3.43 -0.42 3.18 2.02 -1.26 -1.62 117.35 122.24 2hx6 s TYR 45 Ca 0.02 0.12 0.02 0.00 -0.37 0.00 0.00 57.07 56.86 2hx6 s TYR 45 Cb -0.05 -1.66 0.14 0.00 -0.40 0.00 0.00 41.96 39.99 2hx6 s TYR 45 CO 0.00 0.53 0.23 -1.12 -1.57 0.00 0.00 175.55 173.62 2hx6 s SER 46 N -3.04 3.52 0.00 2.29 0.01 -1.26 -4.86 113.70 110.36 2hx6 s SER 46 Ca 0.34 -2.52 0.00 0.00 1.31 0.00 0.00 55.95 55.08 2hx6 s SER 46 Cb -0.11 -0.90 0.00 0.00 0.21 0.00 0.00 66.02 65.21 2hx6 s SER 46 CO 0.27 -0.28 0.67 0.00 0.41 0.00 0.00 173.24 174.32 2hx6 n GLN 47 N 3.66 0.00 -0.33 12.44 1.13 -1.26 -4.33 117.38 128.70 2hx6 n GLN 47 Ca 0.09 0.19 0.10 0.00 -1.94 0.00 0.00 57.00 55.44 2hx6 n GLN 47 Cb 0.35 -1.79 0.28 0.00 0.11 0.00 0.00 30.24 29.18 2hx6 n GLN 47 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2hx6 h ALA 48 N 0.78 1.50 -0.54 -1.58 0.00 -1.97 1.26 119.26 118.71 2hx6 h ALA 48 Ca 0.00 0.08 -0.04 0.00 0.00 0.00 0.00 54.91 54.94 2hx6 h ALA 48 Cb 0.59 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.29 2hx6 h ALA 48 CO 0.00 -0.04 0.16 1.37 0.00 0.00 0.00 179.25 180.74 2hx6 h LEU 49 N 0.72 0.79 -0.43 0.00 -0.00 -1.93 -2.08 115.31 112.39 2hx6 h LEU 49 Ca 0.53 -0.21 -0.12 0.00 -0.00 0.00 0.00 57.88 58.07 2hx6 h LEU 49 Cb 0.77 -0.21 -0.01 0.00 -0.00 0.00 0.00 40.66 41.21 2hx6 h LEU 49 CO -0.37 0.80 -0.22 0.25 -0.00 0.00 0.00 178.44 178.90 2hx6 h LEU 50 N 0.75 0.93 -1.61 0.17 6.46 -1.66 -2.14 115.31 118.22 2hx6 h LEU 50 Ca 0.17 -0.41 0.03 0.00 -0.12 0.00 0.00 57.88 57.56 2hx6 h LEU 50 Cb 0.29 -0.26 -0.03 0.00 -0.73 0.00 0.00 40.66 39.94 2hx6 h LEU 50 CO -0.00 1.13 0.31 0.44 -0.62 0.00 0.00 178.44 179.70 2hx6 h ASP 51 N 0.73 0.44 0.48 1.25 3.32 0.20 0.71 116.42 123.55 2hx6 h ASP 51 Ca 0.09 -0.01 -0.18 0.00 0.02 0.00 0.00 57.03 56.95 2hx6 h ASP 51 Cb 0.79 -0.10 -0.01 0.00 0.22 0.00 0.00 39.33 40.23 2hx6 h ASP 51 CO 0.07 0.30 -0.79 -0.09 -1.72 0.00 0.00 179.24 177.01 2hx6 h ARG 52 N 0.51 0.24 0.01 3.56 9.65 -1.32 -2.99 114.38 124.04 2hx6 h ARG 52 Ca 0.19 -0.22 -0.21 0.00 -1.10 0.00 0.00 59.98 58.64 2hx6 h ARG 52 Cb 0.12 0.06 -0.01 0.00 -1.39 0.00 0.00 29.97 28.74 2hx6 h ARG 52 CO -0.05 0.91 -0.91 0.00 2.80 0.00 0.00 179.97 182.72 2hx6 h ALA 53 N 1.02 0.47 -0.45 2.80 0.00 0.82 0.27 119.26 124.19 2hx6 h ALA 53 Ca -0.03 -0.74 -0.03 0.00 0.00 0.00 0.00 54.91 54.11 2hx6 h ALA 53 Cb 1.38 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 19.09 2hx6 h ALA 53 CO 0.12 0.92 0.17 0.82 0.00 0.00 0.00 179.25 181.28 2hx6 h ILE 54 N 0.12 1.21 0.00 0.00 2.04 -0.15 0.26 117.51 120.99 2hx6 h ILE 54 Ca -0.05 -0.64 -0.11 0.00 1.00 0.00 0.00 64.86 65.06 2hx6 h ILE 54 Cb 1.55 0.80 -0.02 0.00 -0.74 0.00 0.00 36.82 38.41 2hx6 h ILE 54 CO 0.14 0.24 -1.70 0.00 0.00 0.00 0.00 178.15 176.83 2hx6 n GLN 55 N -4.60 1.20 0.13 2.37 3.00 -1.13 -3.93 117.38 114.42 2hx6 n GLN 55 Ca 0.01 -0.06 0.12 0.00 -0.01 0.00 0.00 57.00 57.06 2hx6 n GLN 55 Cb 0.15 -1.31 0.22 0.00 0.00 0.00 0.00 30.24 29.31 2hx6 n GLN 55 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.06 176.97 2hx6 h ARG 56 N 0.00 0.00 0.00 -1.09 9.65 -0.60 -3.40 114.38 118.93 2hx6 h ARG 56 Ca -0.16 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.72 2hx6 h ARG 56 Cb 1.15 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.73 2hx6 h ARG 56 CO 0.01 0.00 -0.38 -0.85 2.80 0.00 0.00 179.97 181.55 2hx6 n GLU 57 N -2.53 0.00 -0.48 0.20 0.00 -1.23 -4.43 120.64 112.18 2hx6 n GLU 57 Ca 0.04 0.00 0.04 0.00 0.00 0.00 0.00 57.16 57.23 2hx6 n GLU 57 Cb 0.48 -0.20 -0.02 0.00 0.00 0.00 0.00 31.44 31.70 2hx6 n GLU 57 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.13 177.57 2hx6 n ILE 58 N -2.75 -0.53 -3.48 3.84 -6.64 0.08 -4.90 119.36 104.98 2hx6 n ILE 58 Ca 0.00 0.37 -0.17 0.00 -1.77 0.00 0.00 62.75 61.18 2hx6 n ILE 58 Cb 0.19 -0.58 -0.05 0.00 -1.44 0.00 0.00 39.64 37.76 2hx6 n ILE 58 CO 0.00 0.00 0.00 -0.67 -1.77 0.00 0.00 176.55 174.11 2hx6 n ASP 59 N -2.43 0.48 -4.48 7.28 2.03 -1.26 -4.85 116.55 113.32 2hx6 n ASP 59 Ca -0.02 -0.68 -0.44 0.00 0.52 0.00 0.00 54.79 54.17 2hx6 n ASP 59 Cb 0.20 -0.85 0.00 0.00 -0.72 0.00 0.00 41.12 39.75 2hx6 n ASP 59 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 2hx6 n GLU 60 N -2.92 3.31 0.13 -0.67 -0.58 -1.26 -4.70 120.64 113.95 2hx6 n GLU 60 Ca -0.18 -3.63 0.13 0.00 -0.42 0.00 0.00 57.16 53.06 2hx6 n GLU 60 Cb 0.37 -3.20 0.39 0.00 -0.57 0.00 0.00 31.44 28.44 2hx6 n GLU 60 CO 0.00 0.00 0.00 1.79 -0.48 0.00 0.00 177.13 178.44 2hx6 h THR 61 N 4.92 0.00 -0.19 2.62 1.35 -1.99 -2.68 112.91 116.95 2hx6 h THR 61 Ca 0.37 -0.51 -0.12 0.00 -0.55 0.00 0.00 66.41 65.60 2hx6 h THR 61 Cb 0.86 1.48 -0.01 0.00 -1.73 0.00 0.00 68.15 68.75 2hx6 h THR 61 CO 1.34 0.00 -0.38 0.22 -0.25 0.00 0.00 175.52 176.44 2hx6 h TYR 62 N 0.00 0.49 -0.28 4.73 3.20 -1.99 -0.53 116.97 122.58 2hx6 h TYR 62 Ca 0.00 -0.13 -0.03 0.00 3.14 0.00 0.00 58.73 61.71 2hx6 h TYR 62 Cb 0.72 -0.11 -0.01 0.00 1.54 0.00 0.00 36.73 38.87 2hx6 h TYR 62 CO 0.00 0.74 0.06 -0.24 -1.64 0.00 0.00 178.16 177.08 2hx6 h VAL 63 N 0.35 1.22 -0.72 1.81 3.04 -1.87 -1.33 116.25 118.76 2hx6 h VAL 63 Ca 0.03 -0.75 -0.03 0.00 -1.01 0.00 0.00 66.70 64.95 2hx6 h VAL 63 Cb 0.83 1.17 -0.03 0.00 -2.01 0.00 0.00 31.29 31.25 2hx6 h VAL 63 CO 0.07 0.24 0.33 -0.26 -1.01 0.00 0.00 177.57 176.95 2hx6 h PHE 64 N 0.29 1.05 -0.51 3.17 -1.00 -1.50 -1.66 116.94 116.77 2hx6 h PHE 64 Ca 0.09 -0.06 -0.05 0.00 2.81 0.00 0.00 57.97 60.77 2hx6 h PHE 64 Cb 0.31 -0.32 -0.02 0.00 3.61 0.00 0.00 35.95 39.53 2hx6 h PHE 64 CO 0.02 0.78 0.14 0.93 -1.61 0.00 0.00 178.31 178.57 2hx6 h GLU 65 N 1.01 0.81 -0.41 1.51 4.39 -0.46 0.54 114.58 121.97 2hx6 h GLU 65 Ca 0.24 -0.18 -0.11 0.00 0.34 0.00 0.00 59.36 59.65 2hx6 h GLU 65 Cb 0.14 -0.11 -0.01 0.00 -0.10 0.00 0.00 28.75 28.67 2hx6 h GLU 65 CO -0.03 0.76 -0.18 1.25 -1.16 0.00 0.00 179.01 179.66 2hx6 h LEU 66 N 0.71 0.87 -0.24 1.33 7.12 -1.32 -0.45 115.31 123.32 2hx6 h LEU 66 Ca 0.16 -0.39 0.00 0.00 0.13 0.00 0.00 57.88 57.78 2hx6 h LEU 66 Cb 0.30 -0.24 0.00 0.00 -0.53 0.00 0.00 40.66 40.19 2hx6 h LEU 66 CO -0.00 1.07 0.00 2.19 -0.13 0.00 0.00 178.44 181.57 2hx6 h PHE 67 N 0.67 0.00 0.00 1.25 -5.15 -1.17 -0.79 116.94 111.75 2hx6 h PHE 67 Ca 0.10 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.87 2hx6 h PHE 67 Cb 0.73 0.00 0.00 0.00 0.22 0.00 0.00 35.95 36.90 2hx6 h PHE 67 CO 0.06 0.00 0.00 0.45 -2.00 0.00 0.00 178.31 176.82 2hx6 h HIS 68 N 0.00 0.00 0.04 6.09 3.86 0.14 -1.73 115.15 123.55 2hx6 h HIS 68 Ca 0.00 0.00 -0.23 0.00 -1.16 0.00 0.00 60.37 58.98 2hx6 h HIS 68 Cb 0.76 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.22 2hx6 h HIS 68 CO 0.00 0.00 -1.03 0.87 0.86 0.00 0.00 177.93 178.63 2hx6 h LYS 69 N 0.00 0.20 -0.46 2.45 1.57 0.20 -3.37 116.57 117.16 2hx6 h LYS 69 Ca 0.00 -0.27 0.03 0.00 -1.87 0.00 0.00 60.65 58.54 2hx6 h LYS 69 Cb 0.87 0.09 -0.04 0.00 0.08 0.00 0.00 32.23 33.23 2hx6 h LYS 69 CO 0.00 1.06 0.24 0.82 -0.57 0.00 0.00 179.45 181.00 2hx6 h ILE 70 N 0.08 0.99 0.00 1.86 1.08 -0.73 -3.28 117.51 117.52 2hx6 h ILE 70 Ca -0.07 -0.17 0.00 0.00 -0.39 0.00 0.00 64.86 64.23 2hx6 h ILE 70 Cb 1.72 0.47 0.00 0.00 -3.07 0.00 0.00 36.82 35.93 2hx6 h ILE 70 CO 0.16 0.09 0.32 0.07 -0.69 0.00 0.00 178.15 178.10 2hx6 h LYS 71 N 0.48 0.00 0.00 2.37 2.10 -1.49 0.92 116.57 120.95 2hx6 h LYS 71 Ca 0.19 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.84 2hx6 h LYS 71 Cb 0.08 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.41 2hx6 h LYS 71 CO -0.12 0.00 -1.35 -0.25 -2.00 0.00 0.00 179.45 175.73 2hx6 n ASP 72 N -2.38 0.68 -0.72 7.07 8.00 -1.24 -4.43 116.55 123.53 2hx6 n ASP 72 Ca -0.01 -0.57 0.05 0.00 0.71 0.00 0.00 54.79 54.97 2hx6 n ASP 72 Cb 0.35 1.39 0.15 0.00 -0.02 0.00 0.00 41.12 42.99 2hx6 n ASP 72 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 2hx6 n HIS 73 N -1.78 0.54 -0.59 1.24 8.25 0.32 -4.42 115.22 118.79 2hx6 n HIS 73 Ca 0.01 -0.24 0.45 0.00 -0.26 0.00 0.00 57.72 57.67 2hx6 n HIS 73 Cb 0.40 -0.06 0.71 0.00 1.12 0.00 0.00 29.99 32.16 2hx6 n HIS 73 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 2hx6 n VAL 74 N 0.44 -0.06 -0.07 1.59 0.31 -1.26 -0.62 118.33 118.67 2hx6 n VAL 74 Ca 0.11 1.42 -0.10 0.00 -0.01 0.00 0.00 64.34 65.76 2hx6 n VAL 74 Cb 0.36 -2.35 0.04 0.00 -0.91 0.00 0.00 33.84 30.97 2hx6 n VAL 74 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 2hx6 h LEU 75 N 0.00 0.82 -0.24 7.52 -0.00 -1.97 0.18 115.31 121.63 2hx6 h LEU 75 Ca 0.83 -0.37 -0.20 0.00 -0.00 0.00 0.00 57.88 58.14 2hx6 h LEU 75 Cb 3.19 -0.23 -0.01 0.00 -0.00 0.00 0.00 40.66 43.60 2hx6 h LEU 75 CO -0.12 1.11 -0.91 -0.33 -0.00 0.00 0.00 178.44 178.19 2hx6 h GLU 76 N 0.64 0.21 0.00 1.13 3.07 -1.23 -0.34 114.58 118.06 2hx6 h GLU 76 Ca 0.06 -0.24 -0.08 0.00 -0.50 0.00 0.00 59.36 58.60 2hx6 h GLU 76 Cb 0.93 0.07 -0.01 0.00 -0.84 0.00 0.00 28.75 28.90 2hx6 h GLU 76 CO 0.09 0.98 -0.39 -0.24 -1.40 0.00 0.00 179.01 178.05 2hx6 h VAL 77 N 0.11 0.96 -0.09 3.13 3.04 -1.41 -1.12 116.25 120.87 2hx6 h VAL 77 Ca -0.05 -1.52 -0.13 0.00 -1.01 0.00 0.00 66.70 63.99 2hx6 h VAL 77 Cb 1.55 1.91 -0.01 0.00 -2.01 0.00 0.00 31.29 32.72 2hx6 h VAL 77 CO 0.14 0.38 -0.51 0.78 -1.01 0.00 0.00 177.57 177.36 2hx6 h ASN 78 N 0.00 0.26 0.16 3.17 -0.26 -0.54 -1.74 115.58 116.63 2hx6 h ASN 78 Ca -0.00 -0.13 -0.04 0.00 -0.56 0.00 0.00 56.30 55.57 2hx6 h ASN 78 Cb 0.88 -0.07 -0.01 0.00 -1.06 0.00 0.00 38.32 38.06 2hx6 h ASN 78 CO 0.05 0.72 -0.17 -0.33 -1.06 0.00 0.00 177.43 176.64 2hx6 h GLU 79 N 0.19 0.03 -0.76 0.81 4.39 -0.18 0.16 114.58 119.22 2hx6 h GLU 79 Ca 0.01 -0.01 -0.02 0.00 0.34 0.00 0.00 59.36 59.68 2hx6 h GLU 79 Cb 0.96 -0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 29.57 2hx6 h GLU 79 CO 0.08 0.21 0.39 0.35 -1.16 0.00 0.00 179.01 178.87 2hx6 h PHE 80 N 0.03 1.08 0.00 4.33 3.04 -0.64 -3.09 116.94 121.69 2hx6 h PHE 80 Ca 0.00 -0.04 0.00 0.00 3.98 0.00 0.00 57.97 61.91 2hx6 h PHE 80 Cb 0.33 -0.34 0.00 0.00 2.56 0.00 0.00 35.95 38.50 2hx6 h PHE 80 CO 0.00 0.78 0.00 -0.11 -2.02 0.00 0.00 178.31 176.96 2hx6 n LEU 81 N -4.41 0.58 0.00 0.59 -0.00 -0.71 -3.97 117.00 109.09 2hx6 n LEU 81 Ca 0.07 0.59 0.11 0.00 -0.00 0.00 0.00 56.01 56.78 2hx6 n LEU 81 Cb 0.12 -0.45 0.67 0.00 -0.00 0.00 0.00 43.42 43.76 2hx6 n LEU 81 CO 0.39 -0.30 0.91 -1.20 -0.00 0.00 0.00 177.39 177.18 2hx6 n SER 82 N -2.09 0.00 -4.72 1.96 7.64 -0.01 -4.83 113.62 111.57 2hx6 n SER 82 Ca 0.04 -1.18 -0.42 0.00 1.01 0.00 0.00 58.87 58.33 2hx6 n SER 82 Cb 0.32 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.49 2hx6 n SER 82 CO 0.00 0.00 0.00 -0.32 -3.01 0.00 0.00 175.04 171.71 2hx6 s MET 83 N -2.00 4.45 0.68 1.43 -2.45 -1.25 -5.06 119.30 115.09 2hx6 s MET 83 Ca 0.34 1.81 -0.17 0.00 -1.25 0.00 0.00 55.69 56.42 2hx6 s MET 83 Cb 0.15 -3.31 0.01 0.00 1.25 0.00 0.00 34.83 32.93 2hx6 s MET 83 CO 0.26 -0.21 1.25 -2.14 1.05 0.00 0.00 175.02 175.23 2hx6 s PRO 84 N 0.69 2.40 0.26 4.11 0.02 -1.26 -4.87 135.00 136.34 2hx6 s PRO 84 Ca 0.57 1.91 -0.28 0.00 0.02 0.00 0.00 61.00 63.22 2hx6 s PRO 84 Cb -0.31 -1.85 -0.15 0.00 0.02 0.00 0.00 34.50 32.22 2hx6 s PRO 84 CO 0.31 -1.67 0.90 -2.30 -0.33 0.00 0.00 177.00 173.91 2hx6 n PRO 85 N -2.24 1.00 -2.71 5.54 -0.02 -1.26 -4.80 135.00 130.50 2hx6 n PRO 85 Ca 0.15 0.35 -0.42 0.00 -2.02 0.00 0.00 63.50 61.55 2hx6 n PRO 85 Cb 0.49 -1.64 -0.03 0.00 -0.02 0.00 0.00 33.50 32.30 2hx6 n PRO 85 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 2hx6 s ARG 86 N -1.32 3.36 0.35 -0.52 1.81 -1.26 -4.50 118.95 116.87 2hx6 s ARG 86 Ca 0.61 -0.93 0.08 0.00 -1.72 0.00 0.00 55.73 53.77 2hx6 s ARG 86 Cb -0.77 -4.66 -0.05 0.00 -0.45 0.00 0.00 34.95 29.02 2hx6 s ARG 86 CO 0.58 -2.01 0.11 -1.25 -0.68 0.00 0.00 175.30 172.06 2hx6 s PRO 87 N 4.50 2.26 0.52 3.54 0.05 -1.26 -4.64 135.00 139.97 2hx6 s PRO 87 Ca 0.34 -1.65 0.26 0.00 0.05 0.00 0.00 61.00 60.00 2hx6 s PRO 87 Cb -0.07 -2.07 1.45 0.00 0.05 0.00 0.00 34.50 33.85 2hx6 s PRO 87 CO 0.02 0.08 2.09 -0.44 0.05 0.00 0.00 177.00 178.80 2hx6 h ASP 88 N 1.61 0.00 -3.36 6.66 3.32 -1.97 -3.44 116.42 119.24 2hx6 h ASP 88 Ca -0.43 0.00 -0.50 0.00 0.02 0.00 0.00 57.03 56.12 2hx6 h ASP 88 Cb 1.25 0.00 0.01 0.00 0.22 0.00 0.00 39.33 40.81 2hx6 h ASP 88 CO 0.65 0.11 -0.01 0.27 -1.72 0.00 0.00 179.24 178.54 2hx6 s ILE 89 N -4.33 4.95 -0.09 0.35 -4.36 -1.26 -5.05 121.20 111.42 2hx6 s ILE 89 Ca -0.03 0.13 -0.00 0.00 -0.26 0.00 0.00 60.65 60.49 2hx6 s ILE 89 Cb 0.14 -3.80 -0.05 0.00 1.25 0.00 0.00 42.46 39.99 2hx6 s ILE 89 CO 0.59 -0.58 -0.08 0.47 0.24 0.00 0.00 174.94 175.58 2hx6 n ASP 90 N -1.61 2.88 0.16 4.36 8.00 -1.26 -4.69 116.55 124.40 2hx6 n ASP 90 Ca -0.01 -0.02 0.12 0.00 0.71 0.00 0.00 54.79 55.60 2hx6 n ASP 90 Cb 0.55 -0.16 0.18 0.00 -0.02 0.00 0.00 41.12 41.67 2hx6 n ASP 90 CO 0.00 0.00 0.00 1.05 -0.39 0.00 0.00 177.20 177.86 2hx6 h GLU 91 N -0.06 0.00 -0.02 -1.24 4.11 -1.97 -3.23 114.58 112.18 2hx6 h GLU 91 Ca -0.20 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.23 2hx6 h GLU 91 Cb 1.28 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.53 2hx6 h GLU 91 CO -0.05 0.00 -0.27 -0.25 0.07 0.00 0.00 179.01 178.51 2hx6 n ASP 92 N -2.79 1.99 0.15 3.06 8.00 -1.26 -4.87 116.55 120.83 2hx6 n ASP 92 Ca 0.03 -1.49 0.00 0.00 0.71 0.00 0.00 54.79 54.04 2hx6 n ASP 92 Cb 0.51 0.34 0.00 0.00 -0.02 0.00 0.00 41.12 41.95 2hx6 n ASP 92 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 2hx6 n PHE 93 N 0.24 -2.91 -2.85 1.24 3.72 -1.26 -5.05 117.46 110.59 2hx6 n PHE 93 Ca 0.08 0.70 -0.43 0.00 -0.05 0.00 0.00 57.45 57.75 2hx6 n PHE 93 Cb 0.41 1.47 -0.02 0.00 -0.94 0.00 0.00 39.48 40.40 2hx6 n PHE 93 CO 0.00 0.00 0.00 0.96 -0.05 0.00 0.00 176.76 177.67 2hx6 s ILE 94 N -2.00 4.62 -0.11 4.37 -4.36 -1.22 -4.55 121.20 117.95 2hx6 s ILE 94 Ca 0.00 -1.66 0.21 0.00 -0.26 0.00 0.00 60.65 58.93 2hx6 s ILE 94 Cb 0.00 -4.88 -0.24 0.00 1.25 0.00 0.00 42.46 38.59 2hx6 s ILE 94 CO 0.00 -1.63 0.53 -0.67 0.24 0.00 0.00 174.94 173.41 2hx6 n ASP 95 N 6.88 0.26 -0.16 4.36 2.03 -1.26 -3.93 116.55 124.72 2hx6 n ASP 95 Ca 0.29 0.11 0.13 0.00 0.52 0.00 0.00 54.79 55.83 2hx6 n ASP 95 Cb 0.48 1.29 0.31 0.00 -0.72 0.00 0.00 41.12 42.49 2hx6 n ASP 95 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2hx6 n GLY 96 N 1.37 -0.82 3.10 0.27 0.00 -1.26 -4.55 105.19 103.29 2hx6 n GLY 96 Ca -0.10 -0.40 -0.36 0.00 0.00 0.00 0.00 46.02 45.16 2hx6 n GLY 96 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2hx6 s VAL 97 N -2.68 3.48 -0.19 1.61 1.01 -1.25 -4.77 120.40 117.60 2hx6 s VAL 97 Ca 0.19 -2.56 0.15 0.00 0.00 0.00 0.00 61.98 59.76 2hx6 s VAL 97 Cb 0.19 -3.33 0.41 0.00 0.00 0.00 0.00 36.38 33.65 2hx6 s VAL 97 CO 0.59 -0.79 1.28 1.21 0.00 0.00 0.00 175.10 177.39 2hx6 n GLU 98 N 3.98 1.77 -1.40 2.72 2.13 -1.26 -4.89 120.64 123.68 2hx6 n GLU 98 Ca 0.03 -2.92 0.00 0.00 0.66 0.00 0.00 57.16 54.93 2hx6 n GLU 98 Cb 0.39 -1.65 0.00 0.00 0.27 0.00 0.00 31.44 30.45 2hx6 n GLU 98 CO 0.00 0.00 0.00 0.98 -0.41 0.00 0.00 177.13 177.70 2hx6 n TYR 99 N -1.13 0.00 -3.79 4.31 9.36 -1.26 -5.10 117.16 119.55 2hx6 n TYR 99 Ca 0.21 0.00 -0.37 0.00 3.32 0.00 0.00 57.90 61.06 2hx6 n TYR 99 Cb 0.77 -2.03 -0.13 0.00 -0.63 0.00 0.00 39.34 37.33 2hx6 n TYR 99 CO 0.00 0.00 0.00 1.03 0.22 0.00 0.00 176.86 178.11 2hx6 s ARG 100 N -2.97 2.55 0.68 2.98 1.81 -1.26 -5.12 118.95 117.62 2hx6 s ARG 100 Ca 0.00 -1.23 -0.16 0.00 -1.72 0.00 0.00 55.73 52.62 2hx6 s ARG 100 Cb 0.00 -3.39 0.01 0.00 -0.45 0.00 0.00 34.95 31.12 2hx6 s ARG 100 CO 0.00 -0.67 1.21 -2.14 -0.68 0.00 0.00 175.30 173.01 2hx6 s PRO 101 N 1.35 2.45 -0.05 3.54 0.02 -1.26 -4.95 135.00 136.10 2hx6 s PRO 101 Ca -0.02 1.77 -0.02 0.00 0.02 0.00 0.00 61.00 62.75 2hx6 s PRO 101 Cb -0.20 -1.87 -0.06 0.00 0.02 0.00 0.00 34.50 32.39 2hx6 s PRO 101 CO 0.01 -1.60 2.56 0.41 -0.33 0.00 0.00 177.00 178.05 2hx6 n GLY 102 N 0.38 2.89 3.11 0.52 0.00 -1.26 -4.86 105.19 105.97 2hx6 n GLY 102 Ca 0.13 -0.57 -0.18 0.00 0.00 0.00 0.00 46.02 45.40 2hx6 n GLY 102 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2hx6 s ARG 103 N 0.07 0.81 -0.07 1.61 1.70 -1.26 -0.06 118.95 121.74 2hx6 s ARG 103 Ca 0.27 -0.69 0.03 0.00 -0.47 0.00 0.00 55.73 54.87 2hx6 s ARG 103 Cb 0.14 -0.77 -0.02 0.00 -0.57 0.00 0.00 34.95 33.73 2hx6 s ARG 103 CO -0.01 0.19 -0.17 -1.17 -1.08 0.00 0.00 175.30 173.06 2hx6 s LEU 104 N -1.10 2.54 -0.21 -1.89 2.96 -0.10 -5.02 118.68 115.85 2hx6 s LEU 104 Ca -0.00 -0.32 -0.01 0.00 -0.22 0.00 0.00 54.13 53.57 2hx6 s LEU 104 Cb -0.08 -1.52 0.06 0.00 0.50 0.00 0.00 46.19 45.15 2hx6 s LEU 104 CO 0.01 0.27 -0.02 -0.70 -1.32 0.00 0.00 176.35 174.58 2hx6 s GLU 105 N -0.26 1.24 -0.00 1.98 2.12 -1.26 -1.94 118.70 120.58 2hx6 s GLU 105 Ca 0.01 -0.72 0.02 0.00 0.36 0.00 0.00 54.97 54.64 2hx6 s GLU 105 Cb -0.13 -2.34 -0.01 0.00 0.26 0.00 0.00 34.13 31.92 2hx6 s GLU 105 CO 0.03 -0.59 -0.07 0.96 -0.54 0.00 0.00 175.26 175.04 2hx6 s ILE 106 N 1.60 0.57 -0.07 -3.70 -4.36 -0.99 -5.03 121.20 109.22 2hx6 s ILE 106 Ca -0.03 -0.38 0.03 0.00 -0.26 0.00 0.00 60.65 60.00 2hx6 s ILE 106 Cb -0.18 -0.50 0.01 0.00 1.25 0.00 0.00 42.46 43.05 2hx6 s ILE 106 CO -0.07 0.11 -0.14 -0.89 0.24 0.00 0.00 174.94 174.19 2hx6 s THR 107 N -0.28 1.27 -0.04 8.37 2.01 -1.26 -2.24 115.64 123.47 2hx6 s THR 107 Ca 0.02 -0.56 -0.31 0.00 0.31 0.00 0.00 61.69 61.14 2hx6 s THR 107 Cb -0.03 -1.14 0.12 0.00 0.01 0.00 0.00 72.50 71.45 2hx6 s THR 107 CO -0.00 0.38 1.20 -0.62 -0.69 0.00 0.00 174.62 174.89 2hx6 s ASP 108 N 0.56 -0.12 0.00 3.53 2.15 -0.91 -2.06 116.67 119.82 2hx6 s ASP 108 Ca -0.14 -0.12 0.00 0.00 0.43 0.00 0.00 52.55 52.72 2hx6 s ASP 108 Cb -0.16 0.21 0.00 0.00 -0.30 0.00 0.00 42.92 42.68 2hx6 s ASP 108 CO 0.04 -0.38 0.00 0.61 -0.17 0.00 0.00 175.17 175.27 2hx6 n GLY 109 N -0.36 2.29 0.00 2.66 0.00 -1.26 -0.85 105.19 107.67 2hx6 n GLY 109 Ca -0.06 -0.42 0.00 0.00 0.00 0.00 0.00 46.02 45.54 2hx6 n GLY 109 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2hx6 n ASN 110 N 1.28 0.00 -4.73 1.61 3.02 -1.26 -5.05 115.26 110.13 2hx6 n ASN 110 Ca 0.00 0.00 -0.41 0.00 -0.03 0.00 0.00 54.58 54.14 2hx6 n ASN 110 Cb 0.00 0.00 -0.05 0.00 -0.61 0.00 0.00 39.78 39.12 2hx6 n ASN 110 CO 0.00 0.00 0.00 -1.48 -2.62 0.00 0.00 177.26 173.16 2hx6 s LEU 111 N 0.00 4.53 -0.56 3.41 2.34 -0.03 -4.35 118.68 124.02 2hx6 s LEU 111 Ca 0.00 1.88 -0.18 0.00 0.06 0.00 0.00 54.13 55.89 2hx6 s LEU 111 Cb 0.00 -3.60 0.11 0.00 -0.56 0.00 0.00 46.19 42.15 2hx6 s LEU 111 CO 0.00 -0.04 0.60 0.26 -1.06 0.00 0.00 176.35 176.11 2hx6 s TRP 112 N -0.30 3.12 -0.16 3.48 0.52 -0.47 -2.15 118.94 122.98 2hx6 s TRP 112 Ca 0.46 -1.08 0.01 0.00 0.02 0.00 0.00 56.10 55.51 2hx6 s TRP 112 Cb -0.25 -3.86 0.01 0.00 -1.15 0.00 0.00 33.47 28.22 2hx6 s TRP 112 CO 0.31 -1.14 -0.20 -0.48 0.02 0.00 0.00 176.95 175.46 2hx6 s LEU 113 N 2.17 2.19 0.01 2.99 2.34 -0.95 -2.20 118.68 125.23 2hx6 s LEU 113 Ca 0.08 -0.60 0.07 0.00 0.06 0.00 0.00 54.13 53.74 2hx6 s LEU 113 Cb -0.26 -1.48 -0.03 0.00 -0.56 0.00 0.00 46.19 43.85 2hx6 s LEU 113 CO 0.05 0.05 -0.21 -0.83 -1.06 0.00 0.00 176.35 174.35 2hx6 s GLY 114 N 1.01 1.47 0.01 -3.48 0.00 0.10 -2.35 107.32 104.08 2hx6 s GLY 114 Ca -0.02 -1.15 0.04 0.00 0.00 0.00 0.00 44.72 43.58 2hx6 s GLY 114 CO -0.06 -1.01 -0.11 -0.11 0.00 0.00 0.00 173.10 171.81 2hx6 s PHE 115 N -0.80 0.98 -0.08 1.90 -0.71 -0.82 0.52 117.98 118.98 2hx6 s PHE 115 Ca 0.12 -0.24 0.03 0.00 -1.04 0.00 0.00 56.93 55.80 2hx6 s PHE 115 Cb -0.10 -0.61 0.01 0.00 -1.21 0.00 0.00 43.02 41.10 2hx6 s PHE 115 CO 0.02 -0.01 -0.17 0.99 -1.34 0.00 0.00 175.22 174.72 2hx6 s THR 116 N -0.48 1.52 0.48 -4.49 2.01 -1.14 -0.93 115.64 112.61 2hx6 s THR 116 Ca 0.02 -0.70 -0.24 0.00 0.31 0.00 0.00 61.69 61.08 2hx6 s THR 116 Cb -0.05 -1.35 -0.07 0.00 0.01 0.00 0.00 72.50 71.03 2hx6 s THR 116 CO 0.00 0.44 1.36 0.52 -0.69 0.00 0.00 174.62 176.25 2hx6 n VAL 117 N 3.73 3.12 -1.54 3.82 0.31 0.91 0.77 118.33 129.44 2hx6 n VAL 117 Ca -0.21 -0.50 -0.43 0.00 -0.01 0.00 0.00 64.34 63.18 2hx6 n VAL 117 Cb 0.52 -1.71 -0.05 0.00 -0.91 0.00 0.00 33.84 31.70 2hx6 n VAL 117 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2hx6 h LYS 119 N 15.28 0.98 -3.17 0.00 3.64 -1.88 -3.31 116.57 128.11 2hx6 h LYS 119 Ca -0.32 -0.46 -0.50 0.00 -1.27 0.00 0.00 60.65 58.10 2hx6 h LYS 119 Cb 1.27 -0.01 0.02 0.00 -0.41 0.00 0.00 32.23 33.10 2hx6 h LYS 119 CO 1.03 1.13 3.04 -0.35 -2.27 0.00 0.00 179.45 182.03 2hx6 n PRO 120 N -4.09 2.80 0.00 1.90 -0.04 -1.26 -4.64 135.00 129.66 2hx6 n PRO 120 Ca -0.01 -1.76 0.00 0.00 -0.04 0.00 0.00 63.50 61.69 2hx6 n PRO 120 Cb 0.49 -2.58 0.00 0.00 -0.04 0.00 0.00 33.50 31.37 2hx6 n PRO 120 CO 0.00 0.00 0.00 0.27 -0.04 0.00 0.00 175.50 175.73 2hx6 n ASN 121 N 3.83 0.00 -3.05 3.54 2.04 -1.25 -5.12 115.26 115.26 2hx6 n ASN 121 Ca 0.60 0.00 -0.18 0.00 -0.44 0.00 0.00 54.58 54.56 2hx6 n ASN 121 Cb 0.21 0.00 -0.02 0.00 -2.53 0.00 0.00 39.78 37.44 2hx6 n ASN 121 CO 0.00 0.00 0.00 1.21 -0.44 0.00 0.00 177.26 178.03 2hx6 n GLU 122 N 0.00 0.80 -0.36 -3.83 2.13 -1.26 -4.80 120.64 113.33 2hx6 n GLU 122 Ca 0.00 -2.79 0.09 0.00 0.66 0.00 0.00 57.16 55.12 2hx6 n GLU 122 Cb 0.00 -1.35 0.26 0.00 0.27 0.00 0.00 31.44 30.62 2hx6 n GLU 122 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 2hx6 n LYS 123 N 1.15 3.03 -4.23 5.31 4.01 -1.26 -4.79 118.16 121.39 2hx6 n LYS 123 Ca 0.18 -2.50 -0.20 0.00 -0.51 0.00 0.00 58.31 55.28 2hx6 n LYS 123 Cb 0.59 -1.55 -0.12 0.00 -0.51 0.00 0.00 35.03 33.44 2hx6 n LYS 123 CO 0.00 0.00 0.00 -0.06 -1.11 0.00 0.00 177.40 176.23 2hx6 s PHE 124 N -1.36 1.47 -0.25 2.13 0.08 -1.26 -4.69 117.98 114.10 2hx6 s PHE 124 Ca 0.39 -0.46 -0.06 0.00 0.12 0.00 0.00 56.93 56.92 2hx6 s PHE 124 Cb 0.23 -0.80 -0.13 0.00 -0.57 0.00 0.00 43.02 41.74 2hx6 s PHE 124 CO 0.22 0.13 -0.28 1.63 -0.10 0.00 0.00 175.22 176.83 2hx6 n LYS 125 N 1.08 0.56 -3.70 0.44 4.01 -1.26 -4.75 118.16 114.55 2hx6 n LYS 125 Ca -0.20 0.19 -0.36 0.00 -0.51 0.00 0.00 58.31 57.44 2hx6 n LYS 125 Cb 0.54 -1.43 -0.08 0.00 -0.51 0.00 0.00 35.03 33.55 2hx6 n LYS 125 CO 0.00 0.00 0.00 0.34 -1.11 0.00 0.00 177.40 176.63 2hx6 s ASP 126 N -6.85 5.52 0.94 4.39 -1.08 -1.26 -4.03 116.67 114.30 2hx6 s ASP 126 Ca -0.34 -3.32 -0.05 0.00 -0.52 0.00 0.00 52.55 48.33 2hx6 s ASP 126 Cb 0.11 -1.86 0.07 0.00 -1.46 0.00 0.00 42.92 39.78 2hx6 s ASP 126 CO 0.49 -0.26 0.41 -2.65 0.52 0.00 0.00 175.17 173.68 2hx6 n PRO 127 N 2.86 -0.32 -3.78 4.34 -0.02 -1.26 -4.28 135.00 132.54 2hx6 n PRO 127 Ca 0.15 -0.68 -0.37 0.00 -2.02 0.00 0.00 63.50 60.57 2hx6 n PRO 127 Cb 0.37 -0.41 -0.06 0.00 -0.02 0.00 0.00 33.50 33.38 2hx6 n PRO 127 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 2hx6 s SER 128 N -2.52 6.47 -0.16 2.55 1.04 -1.26 -2.31 113.70 117.51 2hx6 s SER 128 Ca 0.24 0.56 -0.08 0.00 0.48 0.00 0.00 55.95 57.15 2hx6 s SER 128 Cb -0.01 -2.11 -0.04 0.00 0.10 0.00 0.00 66.02 63.96 2hx6 s SER 128 CO 0.17 0.36 0.12 -0.76 0.98 0.00 0.00 173.24 174.11 2hx6 s LEU 129 N -0.89 4.22 -1.16 2.42 1.43 0.55 0.40 118.68 125.66 2hx6 s LEU 129 Ca 0.16 0.32 -0.05 0.00 -1.03 0.00 0.00 54.13 53.53 2hx6 s LEU 129 Cb -0.13 -2.06 0.25 0.00 0.03 0.00 0.00 46.19 44.28 2hx6 s LEU 129 CO 0.06 0.29 1.79 0.00 0.23 0.00 0.00 176.35 178.71 2hx6 n GLN 130 N 2.77 4.48 0.00 1.70 10.64 0.23 -2.26 117.38 134.94 2hx6 n GLN 130 Ca -0.18 -4.15 0.00 0.00 -1.83 0.00 0.00 57.00 50.84 2hx6 n GLN 130 Cb 0.53 -2.63 0.00 0.00 -0.86 0.00 0.00 30.24 27.29 2hx6 n GLN 130 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 2hx6 s ARG 132 N -4.14 3.27 -0.41 0.00 3.52 -1.26 -2.91 118.95 117.02 2hx6 s ARG 132 Ca 0.00 -0.71 -0.12 0.00 -0.13 0.00 0.00 55.73 54.77 2hx6 s ARG 132 Cb 0.00 -2.73 0.04 0.00 -1.56 0.00 0.00 34.95 30.70 2hx6 s ARG 132 CO 0.00 -0.03 0.27 1.41 -0.81 0.00 0.00 175.30 176.14 2hx6 s MET 133 N 0.96 2.85 -0.21 5.12 -2.45 0.19 -4.86 119.30 120.89 2hx6 s MET 133 Ca -0.02 -1.19 0.02 0.00 -1.25 0.00 0.00 55.69 53.25 2hx6 s MET 133 Cb -0.15 -3.88 0.04 0.00 1.25 0.00 0.00 34.83 32.10 2hx6 s MET 133 CO -0.02 -0.82 -0.14 0.00 1.05 0.00 0.00 175.02 175.10 2hx6 s ALA 134 N 1.58 2.26 -0.01 4.11 0.00 -1.26 0.02 121.76 128.46 2hx6 s ALA 134 Ca 0.03 -1.36 0.00 0.00 0.00 0.00 0.00 51.96 50.63 2hx6 s ALA 134 Cb -0.21 -1.33 0.01 0.00 0.00 0.00 0.00 23.12 21.59 2hx6 s ALA 134 CO 0.07 -0.77 -0.00 0.42 0.00 0.00 0.00 175.76 175.48 2hx6 s ILE 135 N 1.28 0.07 0.38 0.00 -1.09 -0.93 -4.65 121.20 116.26 2hx6 s ILE 135 Ca -0.01 0.03 0.05 0.00 -2.23 0.00 0.00 60.65 58.49 2hx6 s ILE 135 Cb -0.16 -0.11 -0.02 0.00 -1.58 0.00 0.00 42.46 40.59 2hx6 s ILE 135 CO -0.09 0.06 0.19 -0.38 -1.23 0.00 0.00 174.94 173.48 2hx6 n ILE 136 N 3.45 0.00 -4.08 2.92 -0.00 -1.26 -1.36 119.36 119.03 2hx6 n ILE 136 Ca -0.18 -2.35 -0.14 0.00 -0.00 0.00 0.00 62.75 60.09 2hx6 n ILE 136 Cb 0.56 0.95 -0.12 0.00 -0.00 0.00 0.00 39.64 41.04 2hx6 n ILE 136 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.55 177.09 2hx6 s ASN 137 N -3.40 0.92 0.00 4.38 6.03 -1.26 -4.60 114.94 117.01 2hx6 s ASN 137 Ca 0.26 -0.53 0.00 0.00 -1.03 0.00 0.00 52.86 51.56 2hx6 s ASN 137 Cb 0.01 0.02 0.00 0.00 -3.03 0.00 0.00 41.25 38.26 2hx6 s ASN 137 CO 0.19 -0.18 0.00 -1.20 -2.03 0.00 0.00 177.10 173.88 2hx6 n SER 138 N 1.52 0.00 0.01 3.54 7.64 -1.26 -4.75 113.62 120.32 2hx6 n SER 138 Ca -0.22 0.00 -0.00 0.00 1.01 0.00 0.00 58.87 59.66 2hx6 n SER 138 Cb 0.55 0.00 -0.00 0.00 -1.01 0.00 0.00 64.21 63.75 2hx6 n SER 138 CO 0.00 0.00 0.00 -2.11 -3.01 0.00 0.00 175.04 169.92 2hx6 n ARG 139 N 0.00 0.02 -0.06 1.43 0.00 -1.26 -4.75 116.66 112.04 2hx6 n ARG 139 Ca 0.00 0.01 0.09 0.00 -0.00 0.00 0.00 57.85 57.94 2hx6 n ARG 139 Cb 0.00 -0.23 0.11 0.00 -0.00 0.00 0.00 32.46 32.34 2hx6 n ARG 139 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.63 180.52 2hx6 n ARG 140 N -2.86 1.69 -2.91 2.89 1.85 -1.26 -5.05 116.66 111.00 2hx6 n ARG 140 Ca -0.00 -1.70 -0.38 0.00 -1.00 0.00 0.00 57.85 54.76 2hx6 n ARG 140 Cb 0.02 -1.35 -0.06 0.00 -1.05 0.00 0.00 32.46 30.02 2hx6 n ARG 140 CO 0.00 0.00 0.00 -0.51 -0.01 0.00 0.00 177.63 177.11 2hx6 s LEU 141 N -1.34 4.46 0.23 2.89 2.01 -1.26 -4.84 118.68 120.83 2hx6 s LEU 141 Ca 0.23 1.69 -0.13 0.00 0.01 0.00 0.00 54.13 55.94 2hx6 s LEU 141 Cb 0.15 -3.64 0.29 0.00 0.01 0.00 0.00 46.19 43.00 2hx6 s LEU 141 CO 0.22 0.07 1.60 -0.65 1.01 0.00 0.00 176.35 178.61 2hx6 h PRO 142 N 3.71 -0.01 0.00 1.29 0.11 -1.83 -3.41 132.00 131.85 2hx6 h PRO 142 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 2hx6 h PRO 142 Cb 1.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 2hx6 h PRO 142 CO 0.66 -0.01 0.00 0.41 -0.21 0.00 0.00 178.00 178.85 2hx6 n GLY 143 N -1.49 5.41 3.32 -0.55 0.00 -1.26 -5.11 105.19 105.51 2hx6 n GLY 143 Ca 0.10 -1.94 -0.12 0.00 0.00 0.00 0.00 46.02 44.06 2hx6 n GLY 143 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2hx6 s LYS 144 N -0.65 0.48 0.00 1.61 2.47 -1.26 -4.29 119.74 118.10 2hx6 s LYS 144 Ca 0.00 0.68 0.00 0.00 -1.56 0.00 0.00 55.97 55.09 2hx6 s LYS 144 Cb 0.00 0.16 0.00 0.00 -1.46 0.00 0.00 37.83 36.53 2hx6 s LYS 144 CO 0.00 -0.09 0.00 0.00 0.16 0.00 0.00 175.35 175.42 2hx6 n ALA 145 N 3.32 0.00 -3.66 3.13 0.00 -1.26 -5.10 120.51 116.94 2hx6 n ALA 145 Ca -0.17 0.00 -0.18 0.00 0.00 0.00 0.00 53.44 53.09 2hx6 n ALA 145 Cb 0.56 0.00 -0.17 0.00 0.00 0.00 0.00 19.45 19.85 2hx6 n ALA 145 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 2hx6 s SER 146 N 0.00 0.96 -0.45 0.00 0.01 -1.26 -4.87 113.70 108.08 2hx6 s SER 146 Ca 0.00 0.20 0.05 0.00 1.31 0.00 0.00 55.95 57.50 2hx6 s SER 146 Cb 0.00 0.08 0.19 0.00 0.21 0.00 0.00 66.02 66.50 2hx6 s SER 146 CO 0.00 -0.25 0.77 -0.75 0.41 0.00 0.00 173.24 173.42 2hx6 s LYS 147 N 2.24 0.84 0.00 12.44 2.47 -1.26 -5.13 119.74 131.34 2hx6 s LYS 147 Ca 0.04 -0.67 0.00 0.00 -1.56 0.00 0.00 55.97 53.78 2hx6 s LYS 147 Cb -0.12 0.00 0.00 0.00 -1.46 0.00 0.00 37.83 36.25 2hx6 s LYS 147 CO -0.05 -1.09 0.00 0.00 0.16 0.00 0.00 175.35 174.37 2hx6 n ALA 148 N 3.37 0.00 -3.40 3.13 0.00 -1.26 -5.16 120.51 117.19 2hx6 n ALA 148 Ca 0.14 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.45 2hx6 n ALA 148 Cb 0.58 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.93 2hx6 n ALA 148 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 2hx6 s VAL 149 N -1.49 -0.49 0.05 0.00 -7.23 -1.26 -4.80 120.40 105.18 2hx6 s VAL 149 Ca 0.00 -0.15 0.05 0.00 -1.81 0.00 0.00 61.98 60.07 2hx6 s VAL 149 Cb 0.00 -0.80 -0.02 0.00 0.56 0.00 0.00 36.38 36.11 2hx6 s VAL 149 CO 0.00 -0.20 -0.15 0.27 -0.31 0.00 0.00 175.10 174.71 2hx6 s ILE 150 N 2.45 1.20 -0.04 -0.62 -4.36 -0.88 -5.05 121.20 113.91 2hx6 s ILE 150 Ca 0.10 -1.10 -0.15 0.00 -0.26 0.00 0.00 60.65 59.24 2hx6 s ILE 150 Cb -0.15 -1.10 -0.05 0.00 1.25 0.00 0.00 42.46 42.41 2hx6 s ILE 150 CO -0.18 -0.02 0.40 -0.54 0.24 0.00 0.00 174.94 174.85 2hx6 s LYS 151 N -1.29 4.02 -0.32 0.37 1.02 -1.26 -4.15 119.74 118.14 2hx6 s LYS 151 Ca 0.02 0.38 -0.29 0.00 0.02 0.00 0.00 55.97 56.10 2hx6 s LYS 151 Cb -0.08 -3.28 0.01 0.00 -0.52 0.00 0.00 37.83 33.96 2hx6 s LYS 151 CO 0.02 0.55 1.12 -0.08 -0.92 0.00 0.00 175.35 176.03 2hx6 s THR 152 N -0.60 4.43 -1.47 2.17 -1.32 -1.26 -5.06 115.64 112.53 2hx6 s THR 152 Ca 0.23 1.64 0.00 0.00 -1.21 0.00 0.00 61.69 62.36 2hx6 s THR 152 Cb -0.16 -4.37 0.00 0.00 -1.51 0.00 0.00 72.50 66.46 2hx6 s THR 152 CO 0.12 -0.49 0.37 1.67 -2.21 0.00 0.00 174.62 174.08