#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 -0.01 -0.48 3.17 2.01 -1.26 -5.07 115.64 114.01 2hx6 s THR 2 Ca 0.00 0.02 -0.04 0.00 0.31 0.00 0.00 61.69 61.98 2hx6 s THR 2 Cb 0.00 -0.85 0.05 0.00 0.01 0.00 0.00 72.50 71.71 2hx6 s THR 2 CO 0.00 0.01 2.79 -0.38 -0.69 0.00 0.00 174.62 176.35 2hx6 n ILE 3 N 3.79 3.39 0.00 1.82 2.08 -1.26 -4.80 119.36 124.38 2hx6 n ILE 3 Ca -0.19 -3.00 0.00 0.00 0.56 0.00 0.00 62.75 60.12 2hx6 n ILE 3 Cb 0.57 -1.63 0.00 0.00 -0.75 0.00 0.00 39.64 37.83 2hx6 n ILE 3 CO 0.00 0.00 0.00 -3.20 0.56 0.00 0.00 176.55 173.91 2hx6 n ASN 4 N 0.96 0.00 0.21 4.38 2.85 -1.26 -2.15 115.26 120.25 2hx6 n ASN 4 Ca 0.49 0.09 -0.09 0.00 -0.11 0.00 0.00 54.58 54.96 2hx6 n ASN 4 Cb 0.55 -0.09 -0.04 0.00 1.24 0.00 0.00 39.78 41.43 2hx6 n ASN 4 CO 0.00 0.00 0.00 0.74 -2.11 0.00 0.00 177.26 175.89 2hx6 h THR 5 N 0.00 0.00 0.00 -0.44 2.02 -1.99 -2.27 112.91 110.23 2hx6 h THR 5 Ca 0.00 -0.48 0.00 0.00 0.77 0.00 0.00 66.41 66.70 2hx6 h THR 5 Cb 0.21 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 66.62 2hx6 h THR 5 CO 0.00 0.00 0.00 -0.33 0.37 0.00 0.00 175.52 175.56 2hx6 h GLU 6 N -1.08 0.00 0.17 6.66 5.08 -1.86 -2.24 114.58 121.30 2hx6 h GLU 6 Ca -0.06 0.00 -0.30 0.00 -1.00 0.00 0.00 59.36 58.00 2hx6 h GLU 6 Cb 0.46 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.73 2hx6 h GLU 6 CO 0.10 0.00 -1.36 -0.39 -1.00 0.00 0.00 179.01 176.36 2hx6 h VAL 7 N 0.00 1.38 -0.27 3.13 -1.51 -1.66 -1.53 116.25 115.78 2hx6 h VAL 7 Ca 0.00 -2.91 -0.03 0.00 -1.23 0.00 0.00 66.70 62.53 2hx6 h VAL 7 Cb 0.57 2.95 -0.01 0.00 -2.13 0.00 0.00 31.29 32.67 2hx6 h VAL 7 CO 0.00 0.86 0.06 0.15 -1.23 0.00 0.00 177.57 177.41 2hx6 h PHE 8 N 0.10 0.45 -0.75 5.19 3.57 -1.03 0.23 116.94 124.70 2hx6 h PHE 8 Ca -0.19 -0.05 0.10 0.00 3.53 0.00 0.00 57.97 61.35 2hx6 h PHE 8 Cb 2.04 -0.13 -0.07 0.00 2.79 0.00 0.00 35.95 40.58 2hx6 h PHE 8 CO 0.08 0.51 0.39 0.82 -2.23 0.00 0.00 178.31 177.89 2hx6 h ILE 9 N 0.26 0.85 -0.38 1.41 2.04 -1.50 0.14 117.51 120.34 2hx6 h ILE 9 Ca 0.08 -0.22 -0.09 0.00 1.00 0.00 0.00 64.86 65.63 2hx6 h ILE 9 Cb 0.29 0.14 -0.01 0.00 -0.74 0.00 0.00 36.82 36.50 2hx6 h ILE 9 CO 0.00 0.12 -0.10 -0.09 0.00 0.00 0.00 178.15 178.08 2hx6 h ARG 10 N 0.65 0.74 0.00 2.37 2.43 -0.58 0.14 114.38 120.13 2hx6 h ARG 10 Ca 0.37 -0.28 -0.00 0.00 -0.81 0.00 0.00 59.98 59.25 2hx6 h ARG 10 Cb 0.39 -0.04 -0.00 0.00 -0.42 0.00 0.00 29.97 29.90 2hx6 h ARG 10 CO -0.27 0.88 -0.01 0.00 -1.51 0.00 0.00 179.97 179.06 2hx6 h ARG 11 N 0.54 0.00 0.01 0.20 3.08 -0.33 0.69 114.38 118.57 2hx6 h ARG 11 Ca 0.10 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.14 2hx6 h ARG 11 Cb 0.62 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.67 2hx6 h ARG 11 CO 0.04 0.01 -0.01 -0.91 -1.07 0.00 0.00 179.97 178.03 2hx6 h ASN 12 N 0.00 -0.01 -0.25 7.04 -0.26 -0.65 -1.38 115.58 120.07 2hx6 h ASN 12 Ca -0.00 -0.78 0.07 0.00 -0.56 0.00 0.00 56.30 55.03 2hx6 h ASN 12 Cb 0.02 0.00 -0.01 0.00 -1.06 0.00 0.00 38.32 37.27 2hx6 h ASN 12 CO 0.00 0.81 0.19 0.11 -1.06 0.00 0.00 177.43 177.48 2hx6 h LYS 13 N -0.86 0.00 -0.14 0.81 1.79 -0.64 0.11 116.57 117.64 2hx6 h LYS 13 Ca -0.00 0.00 -0.12 0.00 -2.18 0.00 0.00 60.65 58.35 2hx6 h LYS 13 Cb 0.80 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.45 2hx6 h LYS 13 CO 0.00 0.00 -0.37 1.25 -1.08 0.00 0.00 179.45 179.25 2hx6 h LEU 14 N 0.00 0.57 -0.73 2.94 5.85 -0.88 0.34 115.31 123.40 2hx6 h LEU 14 Ca 0.12 -0.58 0.09 0.00 0.84 0.00 0.00 57.88 58.35 2hx6 h LEU 14 Cb 0.51 -0.17 -0.07 0.00 0.37 0.00 0.00 40.66 41.30 2hx6 h LEU 14 CO -0.00 1.05 0.38 0.03 -0.34 0.00 0.00 178.44 179.56 2hx6 h ARG 15 N 0.12 0.63 -0.31 1.25 2.47 0.11 0.60 114.38 119.25 2hx6 h ARG 15 Ca -0.01 -0.04 -0.02 0.00 -1.26 0.00 0.00 59.98 58.66 2hx6 h ARG 15 Cb 0.98 -0.14 -0.01 0.00 -1.65 0.00 0.00 29.97 29.15 2hx6 h ARG 15 CO 0.08 0.42 0.12 0.00 0.56 0.00 0.00 179.97 181.14 2hx6 h ARG 16 N 0.65 0.47 -0.28 0.04 3.08 -0.88 -1.84 114.38 115.61 2hx6 h ARG 16 Ca 0.36 -0.09 0.02 0.00 0.07 0.00 0.00 59.98 60.34 2hx6 h ARG 16 Cb 0.36 -0.07 -0.03 0.00 0.08 0.00 0.00 29.97 30.31 2hx6 h ARG 16 CO -0.26 0.48 0.13 1.25 -1.07 0.00 0.00 179.97 180.50 2hx6 h HIS 17 N 0.35 0.23 -0.25 3.04 2.76 0.37 0.21 115.15 121.86 2hx6 h HIS 17 Ca 0.10 0.01 -0.02 0.00 -2.20 0.00 0.00 60.37 58.27 2hx6 h HIS 17 Cb 0.20 -0.06 -0.01 0.00 1.55 0.00 0.00 27.41 29.08 2hx6 h HIS 17 CO -0.00 0.12 0.08 0.35 -1.30 0.00 0.00 177.93 177.18 2hx6 h PHE 18 N 0.27 0.40 -0.05 5.26 3.04 0.08 -2.03 116.94 123.92 2hx6 h PHE 18 Ca 0.12 -0.04 -0.18 0.00 3.98 0.00 0.00 57.97 61.85 2hx6 h PHE 18 Cb 0.05 -0.12 0.01 0.00 2.56 0.00 0.00 35.95 38.46 2hx6 h PHE 18 CO -0.11 0.44 -0.69 0.93 -2.02 0.00 0.00 178.31 176.87 2hx6 h GLU 19 N 0.24 0.55 -0.33 1.11 5.08 -1.25 -0.55 114.58 119.42 2hx6 h GLU 19 Ca 0.08 -0.53 -0.09 0.00 -1.00 0.00 0.00 59.36 57.82 2hx6 h GLU 19 Cb 0.23 0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.61 2hx6 h GLU 19 CO -0.00 1.16 -0.16 0.77 -1.00 0.00 0.00 179.01 179.78 2hx6 h SER 20 N 0.14 0.72 0.82 1.42 0.02 -0.68 -1.05 113.55 114.93 2hx6 h SER 20 Ca -0.07 -0.40 -0.13 0.00 -0.84 0.00 0.00 61.79 60.34 2hx6 h SER 20 Cb 1.36 -0.20 -0.02 0.00 0.14 0.00 0.00 62.40 63.69 2hx6 h SER 20 CO 0.14 0.96 -0.63 -0.33 -1.14 0.00 0.00 176.83 175.83 2hx6 h GLU 21 N 0.47 0.00 -0.39 3.45 5.08 -1.52 -2.08 114.58 119.58 2hx6 h GLU 21 Ca 0.07 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.43 2hx6 h GLU 21 Cb 0.69 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.92 2hx6 h GLU 21 CO 0.05 0.63 0.22 0.74 -1.00 0.00 0.00 179.01 179.65 2hx6 h PHE 22 N 0.00 0.51 -0.36 4.33 -1.00 -0.86 0.55 116.94 120.11 2hx6 h PHE 22 Ca -0.01 0.00 -0.08 0.00 2.81 0.00 0.00 57.97 60.69 2hx6 h PHE 22 Cb 1.22 -0.17 -0.02 0.00 3.61 0.00 0.00 35.95 40.59 2hx6 h PHE 22 CO 0.00 0.36 -0.13 0.00 -1.61 0.00 0.00 178.31 176.93 2hx6 h ARG 23 N 0.54 0.63 -0.31 1.51 3.08 -0.97 0.28 114.38 119.14 2hx6 h ARG 23 Ca 0.14 -0.20 -0.00 0.00 0.07 0.00 0.00 59.98 59.99 2hx6 h ARG 23 Cb 0.01 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 29.98 2hx6 h ARG 23 CO -0.02 0.74 0.19 0.37 -1.07 0.00 0.00 179.97 180.18 2hx6 h GLN 24 N 0.57 0.42 -0.15 0.04 5.75 -0.52 0.65 115.11 121.87 2hx6 h GLN 24 Ca 0.10 -0.04 -0.09 0.00 -0.15 0.00 0.00 58.65 58.47 2hx6 h GLN 24 Cb 0.56 -0.09 -0.00 0.00 1.07 0.00 0.00 27.48 29.02 2hx6 h GLN 24 CO 0.04 0.32 -0.25 0.82 -2.65 0.00 0.00 178.83 177.10 2hx6 h ILE 25 N 0.40 1.36 0.00 2.39 2.04 -0.82 -1.70 117.51 121.18 2hx6 h ILE 25 Ca 0.11 -1.49 -0.04 0.00 1.00 0.00 0.00 64.86 64.44 2hx6 h ILE 25 Cb 0.01 1.95 -0.01 0.00 -0.74 0.00 0.00 36.82 38.03 2hx6 h ILE 25 CO -0.02 0.44 -0.21 -0.55 0.00 0.00 0.00 178.15 177.82 2hx6 h ASN 26 N 0.07 0.00 0.22 1.72 -1.07 -0.52 -0.54 115.58 115.46 2hx6 h ASN 26 Ca 0.01 0.00 -0.18 0.00 0.07 0.00 0.00 56.30 56.20 2hx6 h ASN 26 Cb 0.83 0.00 -0.00 0.00 -2.07 0.00 0.00 38.32 37.08 2hx6 h ASN 26 CO 0.06 0.21 -0.70 -1.13 0.07 0.00 0.00 177.43 175.93 2hx6 h ASN 27 N 0.00 0.50 -0.57 6.14 -0.73 -0.84 -0.25 115.58 119.83 2hx6 h ASN 27 Ca -0.00 -0.32 -0.10 0.00 1.87 0.00 0.00 56.30 57.75 2hx6 h ASN 27 Cb 0.72 -0.15 -0.02 0.00 0.27 0.00 0.00 38.32 39.15 2hx6 h ASN 27 CO 0.03 1.05 -0.04 -0.08 -0.37 0.00 0.00 177.43 178.02 2hx6 h GLU 28 N 0.30 1.05 -0.33 6.67 4.57 -0.96 -1.59 114.58 124.29 2hx6 h GLU 28 Ca -0.03 -0.35 -0.01 0.00 -1.18 0.00 0.00 59.36 57.79 2hx6 h GLU 28 Cb 1.27 -0.09 -0.02 0.00 -0.16 0.00 0.00 28.75 29.76 2hx6 h GLU 28 CO 0.12 1.05 0.17 0.82 -1.18 0.00 0.00 179.01 179.99 2hx6 h ILE 29 N 0.95 1.15 -1.01 2.32 5.03 -1.05 0.27 117.51 125.17 2hx6 h ILE 29 Ca 0.16 -0.40 0.02 0.00 -0.12 0.00 0.00 64.86 64.52 2hx6 h ILE 29 Cb 0.60 0.82 -0.05 0.00 -3.03 0.00 0.00 36.82 35.16 2hx6 h ILE 29 CO 0.04 0.15 0.66 -0.09 -0.68 0.00 0.00 178.15 178.23 2hx6 h ARG 30 N 0.40 1.29 0.02 2.37 9.65 -0.98 0.28 114.38 127.40 2hx6 h ARG 30 Ca 0.11 -0.08 -0.15 0.00 -1.10 0.00 0.00 59.98 58.77 2hx6 h ARG 30 Cb 0.09 -0.29 0.01 0.00 -1.39 0.00 0.00 29.97 28.39 2hx6 h ARG 30 CO -0.02 0.85 -0.59 0.93 2.80 0.00 0.00 179.97 183.95 2hx6 h GLU 31 N 1.33 0.36 -0.10 0.20 4.39 -1.15 -2.04 114.58 117.57 2hx6 h GLU 31 Ca 0.38 -0.42 -0.11 0.00 0.34 0.00 0.00 59.36 59.55 2hx6 h GLU 31 Cb -0.09 0.12 0.00 0.00 -0.10 0.00 0.00 28.75 28.68 2hx6 h GLU 31 CO -0.10 1.10 -0.37 0.00 -1.16 0.00 0.00 179.01 178.48 2hx6 h ALA 32 N 0.28 0.18 0.00 3.43 0.00 -0.44 0.28 119.26 122.99 2hx6 h ALA 32 Ca -0.08 -0.45 -0.09 0.00 0.00 0.00 0.00 54.91 54.29 2hx6 h ALA 32 Cb 1.32 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 19.09 2hx6 h ALA 32 CO 0.11 0.27 -0.41 1.03 0.00 0.00 0.00 179.25 180.25 2hx6 h SER 33 N -0.01 0.00 -0.01 0.00 0.87 -0.59 0.90 113.55 114.71 2hx6 h SER 33 Ca -0.02 0.00 -0.24 0.00 -1.23 0.00 0.00 61.79 60.30 2hx6 h SER 33 Cb 1.01 0.00 0.02 0.00 -0.44 0.00 0.00 62.40 62.99 2hx6 h SER 33 CO 0.08 0.41 -0.93 0.11 -0.53 0.00 0.00 176.83 175.97 2hx6 h LYS 34 N 0.00 0.64 -0.03 2.24 1.79 -1.34 -0.80 116.57 119.07 2hx6 h LYS 34 Ca -0.00 -0.68 -0.15 0.00 -2.18 0.00 0.00 60.65 57.63 2hx6 h LYS 34 Cb 0.79 0.19 -0.01 0.00 -1.58 0.00 0.00 32.23 31.61 2hx6 h LYS 34 CO 0.05 1.27 -0.68 0.00 -1.08 0.00 0.00 179.45 179.02 2hx6 h ALA 35 N 0.39 0.80 0.00 3.86 0.00 -0.28 -2.40 119.26 121.63 2hx6 h ALA 35 Ca -0.11 -0.60 0.00 0.00 0.00 0.00 0.00 54.91 54.20 2hx6 h ALA 35 Cb 1.59 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.29 2hx6 h ALA 35 CO 0.18 0.80 0.00 0.00 0.00 0.00 0.00 179.25 180.23 2hx6 n ALA 36 N -2.45 2.09 -0.72 0.00 0.00 0.31 -4.94 120.51 114.80 2hx6 n ALA 36 Ca -0.02 -0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.38 2hx6 n ALA 36 Cb 0.67 -1.42 0.00 0.00 0.00 0.00 0.00 19.45 18.70 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 0.94 0.57 4.03 0.00 0.00 -0.90 -5.04 105.19 104.79 2hx6 n GLY 37 Ca 0.05 -0.64 -0.20 0.00 0.00 0.00 0.00 46.02 45.23 2hx6 n GLY 37 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2hx6 s VAL 38 N -2.00 2.11 0.10 1.61 -7.23 -0.32 -5.03 120.40 109.64 2hx6 s VAL 38 Ca 0.00 -0.96 -0.09 0.00 -1.81 0.00 0.00 61.98 59.12 2hx6 s VAL 38 Cb 0.00 -2.15 0.09 0.00 0.56 0.00 0.00 36.38 34.88 2hx6 s VAL 38 CO 0.00 0.00 0.72 -0.24 -0.31 0.00 0.00 175.10 175.27 2hx6 n SER 39 N -2.32 -0.33 -0.80 4.85 2.88 -1.26 -4.58 113.62 112.05 2hx6 n SER 39 Ca 0.16 0.81 0.00 0.00 -1.33 0.00 0.00 58.87 58.51 2hx6 n SER 39 Cb 0.62 -0.17 0.00 0.00 -0.75 0.00 0.00 64.21 63.90 2hx6 n SER 39 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 2hx6 n SER 40 N -4.66 -1.75 -4.63 -3.46 2.88 -1.26 -5.05 113.62 95.68 2hx6 n SER 40 Ca 0.04 0.00 -0.24 0.00 -1.33 0.00 0.00 58.87 57.34 2hx6 n SER 40 Cb 0.17 -0.88 -0.08 0.00 -0.75 0.00 0.00 64.21 62.68 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 0.00 2.69 0.16 0.66 -0.71 -1.26 -4.88 117.98 114.64 2hx6 s PHE 41 Ca 0.00 -0.22 0.03 0.00 -1.04 0.00 0.00 56.93 55.71 2hx6 s PHE 41 Cb 0.00 -1.22 -0.03 0.00 -1.21 0.00 0.00 43.02 40.55 2hx6 s PHE 41 CO 0.00 0.59 0.28 -1.58 -1.34 0.00 0.00 175.22 173.17 2hx6 s HIS 42 N -2.15 3.44 -0.14 3.49 5.65 -0.89 -4.65 115.29 120.04 2hx6 s HIS 42 Ca 0.30 0.08 0.02 0.00 0.25 0.00 0.00 55.06 55.71 2hx6 s HIS 42 Cb -0.07 -1.63 0.01 0.00 -1.18 0.00 0.00 32.58 29.70 2hx6 s HIS 42 CO 0.19 0.51 -0.21 -1.17 -0.65 0.00 0.00 174.74 173.40 2hx6 s LEU 43 N -3.33 2.17 0.41 8.88 1.98 -1.26 -1.91 118.68 125.63 2hx6 s LEU 43 Ca 0.34 -0.57 0.07 0.00 -2.89 0.00 0.00 54.13 51.08 2hx6 s LEU 43 Cb -0.11 -1.46 -0.06 0.00 0.66 0.00 0.00 46.19 45.23 2hx6 s LEU 43 CO 0.28 0.10 0.14 -0.75 -1.89 0.00 0.00 176.35 174.23 2hx6 s LYS 44 N 0.72 2.17 0.45 1.98 2.47 -0.77 -4.94 119.74 121.81 2hx6 s LYS 44 Ca -0.09 -1.90 0.07 0.00 -1.56 0.00 0.00 55.97 52.49 2hx6 s LYS 44 Cb -0.16 -1.91 -0.01 0.00 -1.46 0.00 0.00 37.83 34.30 2hx6 s LYS 44 CO 0.00 -0.10 0.38 0.71 0.16 0.00 0.00 175.35 176.50 2hx6 s TYR 45 N -2.62 2.42 -0.48 4.03 2.02 -1.26 -1.87 117.35 119.59 2hx6 s TYR 45 Ca 0.40 -0.59 0.03 0.00 -0.37 0.00 0.00 57.07 56.55 2hx6 s TYR 45 Cb 0.05 -2.10 0.13 0.00 -0.40 0.00 0.00 41.96 39.64 2hx6 s TYR 45 CO 0.22 -0.20 0.23 -1.12 -1.57 0.00 0.00 175.55 173.10 2hx6 s SER 46 N -4.16 4.22 0.03 2.29 0.01 -1.26 -4.04 113.70 110.79 2hx6 s SER 46 Ca 0.45 -2.80 0.02 0.00 1.31 0.00 0.00 55.95 54.92 2hx6 s SER 46 Cb -0.02 -1.49 0.09 0.00 0.21 0.00 0.00 66.02 64.81 2hx6 s SER 46 CO 0.26 -0.26 0.96 0.00 0.41 0.00 0.00 173.24 174.62 2hx6 n GLN 47 N 3.37 0.01 0.13 12.44 0.00 -1.26 -1.20 117.38 130.86 2hx6 n GLN 47 Ca 0.05 0.43 -0.23 0.00 0.00 0.00 0.00 57.00 57.25 2hx6 n GLN 47 Cb 0.34 -1.64 -0.15 0.00 0.00 0.00 0.00 30.24 28.79 2hx6 n GLN 47 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 2hx6 h ALA 48 N 1.62 -0.07 -0.33 2.61 0.00 -1.97 0.45 119.26 121.58 2hx6 h ALA 48 Ca 0.00 -0.90 -0.01 0.00 0.00 0.00 0.00 54.91 53.99 2hx6 h ALA 48 Cb 0.20 0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 2hx6 h ALA 48 CO 0.00 0.80 0.16 1.25 0.00 0.00 0.00 179.25 181.45 2hx6 h LEU 49 N 0.13 0.44 -1.04 0.00 7.12 -1.60 -2.10 115.31 118.26 2hx6 h LEU 49 Ca -0.24 -0.13 -0.04 0.00 0.13 0.00 0.00 57.88 57.60 2hx6 h LEU 49 Cb 2.12 -0.11 -0.03 0.00 -0.53 0.00 0.00 40.66 42.11 2hx6 h LEU 49 CO 0.25 0.45 0.23 -0.07 -0.13 0.00 0.00 178.44 179.17 2hx6 h LEU 50 N 0.40 0.84 -1.73 2.25 3.38 -1.35 0.16 115.31 119.26 2hx6 h LEU 50 Ca 0.11 -0.12 0.14 0.00 0.09 0.00 0.00 57.88 58.10 2hx6 h LEU 50 Cb 0.13 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 40.63 2hx6 h LEU 50 CO -0.01 0.76 0.44 -0.78 0.09 0.00 0.00 178.44 178.94 2hx6 h ASP 51 N 0.90 0.26 0.21 -0.43 3.58 0.56 0.41 116.42 121.90 2hx6 h ASP 51 Ca 0.21 0.01 -0.01 0.00 0.42 0.00 0.00 57.03 57.66 2hx6 h ASP 51 Cb 0.20 -0.04 0.00 0.00 1.72 0.00 0.00 39.33 41.21 2hx6 h ASP 51 CO -0.02 0.14 -0.10 0.03 -2.88 0.00 0.00 179.24 176.42 2hx6 h ARG 52 N 0.28 -0.27 -0.05 0.28 -0.00 -0.71 -3.25 114.38 110.67 2hx6 h ARG 52 Ca 0.31 0.02 0.01 0.00 -0.50 0.00 0.00 59.98 59.82 2hx6 h ARG 52 Cb 0.83 0.06 -0.00 0.00 0.00 0.00 0.00 29.97 30.86 2hx6 h ARG 52 CO -0.07 -0.03 0.04 0.00 0.00 0.00 0.00 179.97 179.91 2hx6 h ALA 53 N -0.83 1.80 -0.01 0.04 0.00 0.46 0.66 119.26 121.39 2hx6 h ALA 53 Ca -0.03 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.84 2hx6 h ALA 53 Cb 0.36 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.16 2hx6 h ALA 53 CO 0.05 -0.06 -0.13 0.82 0.00 0.00 0.00 179.25 179.92 2hx6 h ILE 54 N 0.00 1.56 0.00 0.00 2.04 -0.45 -3.40 117.51 117.27 2hx6 h ILE 54 Ca 0.02 -1.83 0.00 0.00 1.00 0.00 0.00 64.86 64.05 2hx6 h ILE 54 Cb 0.10 2.74 0.00 0.00 -0.74 0.00 0.00 36.82 38.92 2hx6 h ILE 54 CO -0.00 0.49 -0.88 0.00 0.00 0.00 0.00 178.15 177.76 2hx6 n GLN 55 N -4.61 1.92 0.00 2.37 3.00 -0.86 -3.63 117.38 115.58 2hx6 n GLN 55 Ca -0.09 -0.03 0.14 0.00 -0.01 0.00 0.00 57.00 57.01 2hx6 n GLN 55 Cb 0.44 -1.21 0.77 0.00 0.00 0.00 0.00 30.24 30.24 2hx6 n GLN 55 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.06 174.93 2hx6 n ARG 56 N -1.48 0.60 0.00 -1.09 0.63 0.23 -4.45 116.66 111.10 2hx6 n ARG 56 Ca 0.02 0.01 0.00 0.00 -0.92 0.00 0.00 57.85 56.96 2hx6 n ARG 56 Cb 0.25 -1.50 0.00 0.00 0.45 0.00 0.00 32.46 31.66 2hx6 n ARG 56 CO 0.00 0.00 0.00 -0.85 -2.51 0.00 0.00 177.63 174.27 2hx6 n GLU 57 N -1.17 0.00 0.00 -0.14 -0.00 -1.26 -4.34 120.64 113.72 2hx6 n GLU 57 Ca 0.17 0.00 0.00 0.00 -0.00 0.00 0.00 57.16 57.33 2hx6 n GLU 57 Cb 0.18 -0.01 0.00 0.00 -0.00 0.00 0.00 31.44 31.61 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 -2.40 0.00 -4.11 3.84 -6.64 -1.24 -4.96 119.36 103.85 2hx6 n ILE 58 Ca 0.00 0.00 -0.35 0.00 -1.77 0.00 0.00 62.75 60.63 2hx6 n ILE 58 Cb 0.00 0.00 -0.04 0.00 -1.44 0.00 0.00 39.64 38.16 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 -1.64 -1.09 -3.51 7.28 2.03 -1.26 -4.87 116.55 113.48 2hx6 n ASP 59 Ca 0.00 -1.18 -0.38 0.00 0.52 0.00 0.00 54.79 53.75 2hx6 n ASP 59 Cb 0.00 -1.44 -0.02 0.00 -0.72 0.00 0.00 41.12 38.94 2hx6 n ASP 59 CO 0.00 0.00 0.00 -1.84 -1.92 0.00 0.00 177.20 173.44 2hx6 n GLU 60 N -4.46 2.54 0.15 -0.67 0.28 -1.26 -4.54 120.64 112.68 2hx6 n GLU 60 Ca -0.21 -2.11 0.13 0.00 -0.16 0.00 0.00 57.16 54.81 2hx6 n GLU 60 Cb 0.58 -2.93 0.33 0.00 1.43 0.00 0.00 31.44 30.85 2hx6 n GLU 60 CO 0.00 0.00 0.00 1.79 -0.16 0.00 0.00 177.13 178.76 2hx6 h THR 61 N 3.81 0.00 -0.26 3.84 1.35 -1.98 -2.59 112.91 117.08 2hx6 h THR 61 Ca 0.58 -0.66 -0.07 0.00 -0.55 0.00 0.00 66.41 65.71 2hx6 h THR 61 Cb 0.48 1.65 -0.01 0.00 -1.73 0.00 0.00 68.15 68.53 2hx6 h THR 61 CO 1.81 0.00 -0.14 0.22 -0.25 0.00 0.00 175.52 177.16 2hx6 h TYR 62 N 0.00 0.47 -0.21 4.73 5.03 -1.99 -1.21 116.97 123.79 2hx6 h TYR 62 Ca 0.00 -0.07 -0.03 0.00 2.58 0.00 0.00 58.73 61.21 2hx6 h TYR 62 Cb 0.81 -0.13 -0.01 0.00 1.55 0.00 0.00 36.73 38.96 2hx6 h TYR 62 CO 0.00 0.57 0.02 -0.24 -1.32 0.00 0.00 178.16 177.18 2hx6 h VAL 63 N 0.41 1.24 -0.82 1.81 3.04 -1.83 -0.95 116.25 119.15 2hx6 h VAL 63 Ca 0.08 -0.82 -0.03 0.00 -1.01 0.00 0.00 66.70 64.91 2hx6 h VAL 63 Cb 0.49 1.37 -0.04 0.00 -2.01 0.00 0.00 31.29 31.10 2hx6 h VAL 63 CO 0.03 0.25 0.39 -0.26 -1.01 0.00 0.00 177.57 176.97 2hx6 h PHE 64 N 0.14 1.18 -0.27 3.17 0.04 -1.59 0.17 116.94 119.77 2hx6 h PHE 64 Ca 0.06 -0.06 -0.05 0.00 2.80 0.00 0.00 57.97 60.73 2hx6 h PHE 64 Cb 0.36 -0.37 -0.01 0.00 2.20 0.00 0.00 35.95 38.14 2hx6 h PHE 64 CO 0.03 0.86 -0.02 1.49 -0.60 0.00 0.00 178.31 180.07 2hx6 h GLU 65 N 1.17 0.49 -0.05 1.51 4.22 -0.66 0.20 114.58 121.46 2hx6 h GLU 65 Ca 0.28 -0.17 -0.01 0.00 0.08 0.00 0.00 59.36 59.55 2hx6 h GLU 65 Cb 0.13 -0.04 -0.00 0.00 0.50 0.00 0.00 28.75 29.33 2hx6 h GLU 65 CO -0.03 0.67 0.01 1.25 -2.18 0.00 0.00 179.01 178.72 2hx6 h LEU 66 N 0.27 0.08 -0.36 1.64 7.12 -1.19 -0.90 115.31 121.97 2hx6 h LEU 66 Ca 0.08 -0.24 0.00 0.00 0.13 0.00 0.00 57.88 57.85 2hx6 h LEU 66 Cb 0.45 -0.02 0.00 0.00 -0.53 0.00 0.00 40.66 40.56 2hx6 h LEU 66 CO 0.02 0.30 0.00 2.19 -0.13 0.00 0.00 178.44 180.81 2hx6 h PHE 67 N -0.15 0.00 0.00 1.25 -5.15 -0.59 0.24 116.94 112.54 2hx6 h PHE 67 Ca 0.02 0.00 -0.15 0.00 -0.20 0.00 0.00 57.97 57.64 2hx6 h PHE 67 Cb 0.25 0.00 -0.02 0.00 0.22 0.00 0.00 35.95 36.40 2hx6 h PHE 67 CO 0.01 0.00 -0.71 0.45 -2.00 0.00 0.00 178.31 176.06 2hx6 h HIS 68 N 0.00 0.00 0.00 6.09 3.86 -0.65 0.11 115.15 124.55 2hx6 h HIS 68 Ca 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 2hx6 h HIS 68 Cb 0.68 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.15 2hx6 h HIS 68 CO 0.00 0.71 0.00 0.87 0.86 0.00 0.00 177.93 180.37 2hx6 h LYS 69 N 0.00 0.00 0.00 2.45 1.57 0.42 -3.35 116.57 117.66 2hx6 h LYS 69 Ca -0.01 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 2hx6 h LYS 69 Cb 1.48 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.79 2hx6 h LYS 69 CO 0.09 0.00 -1.43 1.51 -0.57 0.00 0.00 179.45 179.05 2hx6 n ILE 70 N -2.94 0.09 0.00 1.86 3.06 0.66 -4.70 119.36 117.39 2hx6 n ILE 70 Ca 0.04 -0.32 0.00 0.00 -2.50 0.00 0.00 62.75 59.97 2hx6 n ILE 70 Cb 0.51 0.26 0.00 0.00 0.54 0.00 0.00 39.64 40.95 2hx6 n ILE 70 CO 0.00 0.00 0.00 2.29 -2.50 0.00 0.00 176.55 176.34 2hx6 n LYS 71 N -2.04 0.00 0.00 9.51 2.85 0.36 -0.06 118.16 128.79 2hx6 n LYS 71 Ca -0.00 0.13 0.12 0.00 -1.05 0.00 0.00 58.31 57.50 2hx6 n LYS 71 Cb 0.48 -1.58 0.18 0.00 -0.65 0.00 0.00 35.03 33.46 2hx6 n LYS 71 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 177.40 173.88 2hx6 n ASP 72 N -1.01 1.75 0.00 -5.58 2.03 -1.26 -4.38 116.55 108.10 2hx6 n ASP 72 Ca 0.00 -1.35 0.00 0.00 0.52 0.00 0.00 54.79 53.96 2hx6 n ASP 72 Cb 0.08 0.27 0.00 0.00 -0.72 0.00 0.00 41.12 40.75 2hx6 n ASP 72 CO 0.00 0.00 0.00 1.41 -1.92 0.00 0.00 177.20 176.69 2hx6 n HIS 73 N -0.07 0.00 -0.56 -0.67 8.25 0.92 -1.73 115.22 121.36 2hx6 n HIS 73 Ca 0.12 0.00 0.45 0.00 -0.26 0.00 0.00 57.72 58.03 2hx6 n HIS 73 Cb 0.43 -0.36 0.76 0.00 1.12 0.00 0.00 29.99 31.94 2hx6 n HIS 73 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 2hx6 h VAL 74 N 0.00 0.11 0.08 1.59 2.07 -1.83 0.53 116.25 118.79 2hx6 h VAL 74 Ca 0.00 -0.01 -0.27 0.00 0.82 0.00 0.00 66.70 67.24 2hx6 h VAL 74 Cb 0.10 0.08 0.01 0.00 -1.52 0.00 0.00 31.29 29.96 2hx6 h VAL 74 CO 0.00 0.01 -1.13 -0.07 0.02 0.00 0.00 177.57 176.39 2hx6 h LEU 75 N 0.03 0.67 -0.55 2.57 -0.00 -1.63 0.23 115.31 116.63 2hx6 h LEU 75 Ca 0.84 -0.60 -0.16 0.00 -0.00 0.00 0.00 57.88 57.96 2hx6 h LEU 75 Cb 3.14 -0.21 -0.01 0.00 -0.00 0.00 0.00 40.66 43.58 2hx6 h LEU 75 CO -0.15 1.42 -0.54 -0.08 -0.00 0.00 0.00 178.44 179.10 2hx6 h GLU 76 N 0.22 0.52 0.00 1.13 4.22 -1.48 -1.82 114.58 117.38 2hx6 h GLU 76 Ca -0.14 -0.32 -0.11 0.00 0.08 0.00 0.00 59.36 58.87 2hx6 h GLU 76 Cb 1.80 0.03 -0.02 0.00 0.50 0.00 0.00 28.75 31.07 2hx6 h GLU 76 CO 0.20 0.93 -0.53 0.28 -2.18 0.00 0.00 179.01 177.71 2hx6 h VAL 77 N 0.40 1.24 -0.35 0.32 2.07 -1.00 -2.13 116.25 116.80 2hx6 h VAL 77 Ca 0.01 -1.90 -0.07 0.00 0.82 0.00 0.00 66.70 65.56 2hx6 h VAL 77 Cb 1.07 2.06 -0.01 0.00 -1.52 0.00 0.00 31.29 32.89 2hx6 h VAL 77 CO 0.10 0.52 -0.05 0.78 0.02 0.00 0.00 177.57 178.93 2hx6 h ASN 78 N 0.00 0.64 -0.38 0.57 -0.26 -0.33 -1.48 115.58 114.33 2hx6 h ASN 78 Ca -0.01 -0.35 -0.04 0.00 -0.56 0.00 0.00 56.30 55.35 2hx6 h ASN 78 Cb 1.02 -0.18 -0.02 0.00 -1.06 0.00 0.00 38.32 38.09 2hx6 h ASN 78 CO 0.07 0.84 0.10 -0.33 -1.06 0.00 0.00 177.43 177.05 2hx6 h GLU 79 N 0.44 0.69 -0.85 0.81 4.39 -1.24 -1.77 114.58 117.05 2hx6 h GLU 79 Ca 0.09 -0.13 -0.01 0.00 0.34 0.00 0.00 59.36 59.65 2hx6 h GLU 79 Cb 0.54 -0.11 -0.04 0.00 -0.10 0.00 0.00 28.75 29.04 2hx6 h GLU 79 CO 0.03 0.64 0.48 0.35 -1.16 0.00 0.00 179.01 179.34 2hx6 h PHE 80 N 0.67 1.14 0.00 4.33 3.57 -1.27 -2.74 116.94 122.64 2hx6 h PHE 80 Ca 0.15 -0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.63 2hx6 h PHE 80 Cb 0.27 -0.37 0.00 0.00 2.79 0.00 0.00 35.95 38.64 2hx6 h PHE 80 CO 0.01 0.78 0.00 -0.11 -2.23 0.00 0.00 178.31 176.77 2hx6 n LEU 81 N -4.35 0.62 0.00 0.59 -0.00 -0.57 -4.33 117.00 108.96 2hx6 n LEU 81 Ca 0.09 0.60 0.12 0.00 -0.00 0.00 0.00 56.01 56.82 2hx6 n LEU 81 Cb 0.09 -0.45 0.70 0.00 -0.00 0.00 0.00 43.42 43.75 2hx6 n LEU 81 CO 0.38 -0.32 0.91 -1.54 -0.00 0.00 0.00 177.39 176.81 2hx6 n SER 82 N -2.12 0.00 -4.90 1.96 3.41 -0.70 -4.78 113.62 106.49 2hx6 n SER 82 Ca 0.04 -0.58 -0.34 0.00 -0.26 0.00 0.00 58.87 57.73 2hx6 n SER 82 Cb 0.32 -0.07 -0.05 0.00 -0.26 0.00 0.00 64.21 64.15 2hx6 n SER 82 CO 0.00 0.00 0.00 -0.32 -0.16 0.00 0.00 175.04 174.56 2hx6 s MET 83 N -2.15 3.45 0.78 4.33 1.75 -1.26 -5.09 119.30 121.11 2hx6 s MET 83 Ca 0.33 -0.27 -0.13 0.00 -1.25 0.00 0.00 55.69 54.38 2hx6 s MET 83 Cb 0.17 -3.11 0.06 0.00 2.84 0.00 0.00 34.83 34.79 2hx6 s MET 83 CO 0.30 0.69 1.15 -1.25 -0.65 0.00 0.00 175.02 175.26 2hx6 s PRO 84 N -1.76 1.98 0.41 4.11 0.04 -1.26 -4.86 135.00 133.66 2hx6 s PRO 84 Ca 0.25 1.51 -0.23 0.00 0.04 0.00 0.00 61.00 62.56 2hx6 s PRO 84 Cb -0.13 -1.84 -0.12 0.00 0.04 0.00 0.00 34.50 32.46 2hx6 s PRO 84 CO 0.16 -1.90 0.74 -0.35 0.04 0.00 0.00 177.00 175.69 2hx6 n PRO 85 N -3.25 0.87 -3.75 0.56 -0.04 -1.26 -5.02 135.00 123.10 2hx6 n PRO 85 Ca 0.11 0.31 -0.33 0.00 -0.04 0.00 0.00 63.50 63.56 2hx6 n PRO 85 Cb 0.52 -1.72 -0.09 0.00 -0.04 0.00 0.00 33.50 32.17 2hx6 n PRO 85 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 2hx6 s ARG 86 N -1.76 2.89 0.82 0.54 0.52 -0.05 -4.81 118.95 117.11 2hx6 s ARG 86 Ca 0.64 -3.27 -0.11 0.00 -0.52 0.00 0.00 55.73 52.47 2hx6 s ARG 86 Cb -0.59 -3.72 0.08 0.00 0.52 0.00 0.00 34.95 31.24 2hx6 s ARG 86 CO 0.57 -1.27 1.09 -2.14 0.02 0.00 0.00 175.30 173.58 2hx6 s PRO 87 N -1.32 1.87 0.63 3.54 0.02 -1.25 -3.73 135.00 134.76 2hx6 s PRO 87 Ca 0.26 0.84 0.22 0.00 0.02 0.00 0.00 61.00 62.34 2hx6 s PRO 87 Cb -0.07 -1.88 1.09 0.00 0.02 0.00 0.00 34.50 33.66 2hx6 s PRO 87 CO -0.13 -1.82 1.59 -0.44 -0.33 0.00 0.00 177.00 175.86 2hx6 h ASP 88 N -1.25 0.00 -3.00 2.53 3.32 -1.89 -3.24 116.42 112.89 2hx6 h ASP 88 Ca -0.47 0.00 -0.74 0.00 0.02 0.00 0.00 57.03 55.84 2hx6 h ASP 88 Cb 1.26 0.00 -0.22 0.00 0.22 0.00 0.00 39.33 40.59 2hx6 h ASP 88 CO 0.56 0.00 0.61 0.27 -1.72 0.00 0.00 179.24 178.95 2hx6 s ILE 89 N -4.27 5.23 -1.19 0.35 -4.36 -1.26 -4.83 121.20 110.87 2hx6 s ILE 89 Ca -0.03 -2.25 0.15 0.00 -0.26 0.00 0.00 60.65 58.26 2hx6 s ILE 89 Cb 0.09 -4.67 0.19 0.00 1.25 0.00 0.00 42.46 39.33 2hx6 s ILE 89 CO 0.32 -1.32 1.47 0.47 0.24 0.00 0.00 174.94 176.12 2hx6 n ASP 90 N 5.08 0.00 -0.09 4.36 9.92 -1.23 -2.39 116.55 132.20 2hx6 n ASP 90 Ca 0.22 0.30 -0.11 0.00 -0.53 0.00 0.00 54.79 54.67 2hx6 n ASP 90 Cb 0.46 -0.40 -0.15 0.00 -0.64 0.00 0.00 41.12 40.39 2hx6 n ASP 90 CO 0.00 0.00 0.00 -1.84 0.13 0.00 0.00 177.20 175.49 2hx6 n GLU 91 N -1.40 0.68 0.00 -1.24 0.28 -1.26 -3.15 120.64 114.54 2hx6 n GLU 91 Ca 0.05 0.07 0.10 0.00 -0.16 0.00 0.00 57.16 57.23 2hx6 n GLU 91 Cb 0.15 -1.57 -0.06 0.00 1.43 0.00 0.00 31.44 31.40 2hx6 n GLU 91 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 2hx6 n ASP 92 N -2.90 0.83 0.01 -1.84 8.00 -1.12 -4.66 116.55 114.87 2hx6 n ASP 92 Ca -0.33 -0.77 0.00 0.00 0.71 0.00 0.00 54.79 54.41 2hx6 n ASP 92 Cb 1.11 0.93 0.00 0.00 -0.02 0.00 0.00 41.12 43.15 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 -1.58 -0.11 -2.50 1.24 3.01 -1.00 -5.02 117.46 111.50 2hx6 n PHE 93 Ca 0.04 0.02 -0.40 0.00 1.01 0.00 0.00 57.45 58.12 2hx6 n PHE 93 Cb 0.35 0.14 -0.03 0.00 -0.01 0.00 0.00 39.48 39.93 2hx6 n PHE 93 CO 0.00 0.00 0.00 0.42 1.01 0.00 0.00 176.76 178.19 2hx6 s ILE 94 N -2.00 3.78 0.00 4.37 1.01 -1.19 -4.32 121.20 122.86 2hx6 s ILE 94 Ca 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 60.65 60.41 2hx6 s ILE 94 Cb 0.00 -4.88 0.00 0.00 0.01 0.00 0.00 42.46 37.59 2hx6 s ILE 94 CO 0.00 -1.79 0.00 0.47 0.00 0.00 0.00 174.94 173.62 2hx6 n ASP 95 N 9.61 0.16 -1.04 3.58 8.00 -1.26 -4.60 116.55 131.00 2hx6 n ASP 95 Ca 0.21 0.00 0.11 0.00 0.71 0.00 0.00 54.79 55.82 2hx6 n ASP 95 Cb 0.50 0.00 0.27 0.00 -0.02 0.00 0.00 41.12 41.87 2hx6 n ASP 95 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2hx6 n GLY 96 N 1.38 1.52 3.08 0.44 0.00 -1.26 -4.68 105.19 105.67 2hx6 n GLY 96 Ca 0.00 -0.65 -0.36 0.00 0.00 0.00 0.00 46.02 45.01 2hx6 n GLY 96 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2hx6 s VAL 97 N -1.42 3.56 -0.02 1.61 0.11 -1.26 -4.60 120.40 118.38 2hx6 s VAL 97 Ca 0.38 -2.98 0.03 0.00 -2.93 0.00 0.00 61.98 56.49 2hx6 s VAL 97 Cb 0.21 -3.34 0.05 0.00 -1.53 0.00 0.00 36.38 31.77 2hx6 s VAL 97 CO 0.29 -0.86 0.91 1.21 -3.33 0.00 0.00 175.10 173.32 2hx6 n GLU 98 N 3.47 0.44 0.01 1.54 2.13 -1.26 -4.82 120.64 122.15 2hx6 n GLU 98 Ca 0.07 -1.20 0.00 0.00 0.66 0.00 0.00 57.16 56.70 2hx6 n GLU 98 Cb 0.37 -0.71 0.00 0.00 0.27 0.00 0.00 31.44 31.37 2hx6 n GLU 98 CO 0.00 0.00 0.00 0.66 -0.41 0.00 0.00 177.13 177.38 2hx6 n TYR 99 N -0.29 -0.08 -3.51 4.31 4.01 -1.26 -5.07 117.16 115.27 2hx6 n TYR 99 Ca 0.03 0.01 -0.40 0.00 -0.16 0.00 0.00 57.90 57.38 2hx6 n TYR 99 Cb 0.61 0.09 -0.10 0.00 -0.31 0.00 0.00 39.34 39.62 2hx6 n TYR 99 CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 2hx6 s ARG 100 N -2.00 3.55 0.60 -0.72 0.52 -1.26 -5.10 118.95 114.53 2hx6 s ARG 100 Ca 0.00 -0.57 -0.15 0.00 -0.52 0.00 0.00 55.73 54.49 2hx6 s ARG 100 Cb 0.00 -3.79 -0.04 0.00 0.52 0.00 0.00 34.95 31.64 2hx6 s ARG 100 CO 0.00 -0.43 1.04 -1.25 0.02 0.00 0.00 175.30 174.68 2hx6 s PRO 101 N 1.78 3.42 0.00 3.54 0.04 -1.26 -5.00 135.00 137.52 2hx6 s PRO 101 Ca 0.07 1.06 0.21 0.00 0.04 0.00 0.00 61.00 62.39 2hx6 s PRO 101 Cb -0.17 -2.05 0.90 0.00 0.04 0.00 0.00 34.50 33.22 2hx6 s PRO 101 CO 0.11 -0.72 1.68 0.41 0.04 0.00 0.00 177.00 178.52 2hx6 n GLY 102 N -1.45 -1.22 3.06 0.56 0.00 -1.26 -4.73 105.19 100.16 2hx6 n GLY 102 Ca 0.08 -0.07 -0.08 0.00 0.00 0.00 0.00 46.02 45.94 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 -2.99 0.51 -0.06 1.61 1.70 -1.26 -3.20 118.95 115.26 2hx6 s ARG 103 Ca 0.10 -0.87 0.01 0.00 -0.47 0.00 0.00 55.73 54.50 2hx6 s ARG 103 Cb 0.14 0.19 -0.03 0.00 -0.57 0.00 0.00 34.95 34.67 2hx6 s ARG 103 CO 0.38 -0.10 -0.07 -0.51 -1.08 0.00 0.00 175.30 173.92 2hx6 s LEU 104 N -2.20 3.15 -0.21 -1.89 1.43 0.46 -5.01 118.68 114.41 2hx6 s LEU 104 Ca -0.04 -0.04 -0.01 0.00 -1.03 0.00 0.00 54.13 53.01 2hx6 s LEU 104 Cb -0.01 -1.70 0.06 0.00 0.03 0.00 0.00 46.19 44.57 2hx6 s LEU 104 CO -0.05 0.35 -0.02 -0.70 0.23 0.00 0.00 176.35 176.16 2hx6 s GLU 105 N -0.87 1.26 -0.01 1.70 2.12 -1.26 -2.21 118.70 119.43 2hx6 s GLU 105 Ca 0.13 -0.72 0.02 0.00 0.36 0.00 0.00 54.97 54.76 2hx6 s GLU 105 Cb -0.11 -2.33 -0.00 0.00 0.26 0.00 0.00 34.13 31.94 2hx6 s GLU 105 CO 0.02 -0.59 -0.07 0.96 -0.54 0.00 0.00 175.26 175.05 2hx6 s ILE 106 N 1.59 0.52 -0.22 -3.70 -4.36 -1.00 -5.07 121.20 108.97 2hx6 s ILE 106 Ca -0.03 -0.28 0.00 0.00 -0.26 0.00 0.00 60.65 60.08 2hx6 s ILE 106 Cb -0.18 -0.44 0.06 0.00 1.25 0.00 0.00 42.46 43.15 2hx6 s ILE 106 CO -0.07 0.15 -0.05 -0.89 0.24 0.00 0.00 174.94 174.32 2hx6 s THR 107 N -0.12 1.40 0.10 8.37 2.01 -1.26 -1.42 115.64 124.72 2hx6 s THR 107 Ca 0.02 -1.07 0.01 0.00 0.31 0.00 0.00 61.69 60.96 2hx6 s THR 107 Cb -0.03 -1.66 -0.04 0.00 0.01 0.00 0.00 72.50 70.78 2hx6 s THR 107 CO -0.00 -0.05 -0.04 -0.62 -0.69 0.00 0.00 174.62 173.22 2hx6 s ASP 108 N 1.46 0.96 0.00 3.53 -1.08 -0.76 0.46 116.67 121.25 2hx6 s ASP 108 Ca -0.04 -1.05 0.00 0.00 -0.52 0.00 0.00 52.55 50.94 2hx6 s ASP 108 Cb -0.18 0.14 0.00 0.00 -1.46 0.00 0.00 42.92 41.42 2hx6 s ASP 108 CO -0.07 -0.53 0.00 0.61 0.52 0.00 0.00 175.17 175.70 2hx6 n GLY 109 N -0.05 1.68 0.00 2.66 0.00 -1.26 -0.86 105.19 107.36 2hx6 n GLY 109 Ca -0.11 -0.11 0.00 0.00 0.00 0.00 0.00 46.02 45.80 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 3.67 0.00 -4.74 1.61 5.03 -1.26 -5.08 115.26 114.49 2hx6 n ASN 110 Ca 0.00 0.00 -0.41 0.00 0.87 0.00 0.00 54.58 55.04 2hx6 n ASN 110 Cb 0.00 0.00 -0.05 0.00 -1.02 0.00 0.00 39.78 38.71 2hx6 n ASN 110 CO 0.00 0.00 0.00 -1.48 -1.83 0.00 0.00 177.26 173.95 2hx6 s LEU 111 N 0.00 4.57 -0.62 3.41 2.34 -0.04 -4.49 118.68 123.85 2hx6 s LEU 111 Ca 0.00 1.89 -0.22 0.00 0.06 0.00 0.00 54.13 55.87 2hx6 s LEU 111 Cb 0.00 -3.60 0.07 0.00 -0.56 0.00 0.00 46.19 42.10 2hx6 s LEU 111 CO 0.00 0.04 0.88 0.26 -1.06 0.00 0.00 176.35 176.46 2hx6 s TRP 112 N -0.61 2.78 -0.05 3.48 0.52 0.21 -1.83 118.94 123.45 2hx6 s TRP 112 Ca 0.44 -0.57 -0.14 0.00 0.02 0.00 0.00 56.10 55.85 2hx6 s TRP 112 Cb -0.25 -4.14 -0.05 0.00 -1.15 0.00 0.00 33.47 27.87 2hx6 s TRP 112 CO 0.31 -1.49 0.37 -0.51 0.02 0.00 0.00 176.95 175.66 2hx6 s LEU 113 N 3.65 4.41 -0.07 2.99 1.43 -0.51 -2.07 118.68 128.52 2hx6 s LEU 113 Ca 0.20 0.83 0.04 0.00 -1.03 0.00 0.00 54.13 54.18 2hx6 s LEU 113 Cb -0.18 -2.51 -0.00 0.00 0.03 0.00 0.00 46.19 43.52 2hx6 s LEU 113 CO 0.11 0.27 -0.19 -0.83 0.23 0.00 0.00 176.35 175.93 2hx6 s GLY 114 N -0.67 1.08 -0.02 -3.19 0.00 0.79 -2.36 107.32 102.95 2hx6 s GLY 114 Ca 0.22 -0.77 0.08 0.00 0.00 0.00 0.00 44.72 44.24 2hx6 s GLY 114 CO 0.11 -0.30 -0.25 -1.36 0.00 0.00 0.00 173.10 171.29 2hx6 s PHE 115 N 0.22 2.28 0.13 1.90 0.40 -0.94 0.10 117.98 122.07 2hx6 s PHE 115 Ca -0.10 -0.43 0.08 0.00 -0.60 0.00 0.00 56.93 55.88 2hx6 s PHE 115 Cb -0.15 -1.46 -0.04 0.00 0.51 0.00 0.00 43.02 41.88 2hx6 s PHE 115 CO 0.05 -0.03 -0.20 0.99 0.70 0.00 0.00 175.22 176.72 2hx6 s THR 116 N -0.60 1.78 0.63 0.64 2.01 -1.10 -0.41 115.64 118.59 2hx6 s THR 116 Ca 0.10 -1.69 -0.14 0.00 0.31 0.00 0.00 61.69 60.27 2hx6 s THR 116 Cb -0.10 -1.68 -0.02 0.00 0.01 0.00 0.00 72.50 70.72 2hx6 s THR 116 CO -0.01 -0.14 1.06 -0.69 -0.69 0.00 0.00 174.62 174.15 2hx6 s VAL 117 N -1.47 3.86 -0.73 3.82 1.01 -1.19 0.14 120.40 125.84 2hx6 s VAL 117 Ca 0.10 0.78 -0.26 0.00 0.00 0.00 0.00 61.98 62.60 2hx6 s VAL 117 Cb -0.09 -3.37 -0.04 0.00 0.00 0.00 0.00 36.38 32.88 2hx6 s VAL 117 CO 0.05 -0.62 1.97 0.00 0.00 0.00 0.00 175.10 176.50 2hx6 h LYS 119 N 13.72 0.86 -3.26 0.00 3.64 -1.92 -3.38 116.57 126.23 2hx6 h LYS 119 Ca -0.10 -0.59 -0.47 0.00 -1.27 0.00 0.00 60.65 58.22 2hx6 h LYS 119 Cb 1.10 0.09 0.02 0.00 -0.41 0.00 0.00 32.23 33.03 2hx6 h LYS 119 CO 1.20 1.21 2.97 -0.35 -2.27 0.00 0.00 179.45 182.21 2hx6 n PRO 120 N -3.99 2.62 0.00 1.90 -0.04 -1.26 -4.06 135.00 130.17 2hx6 n PRO 120 Ca -0.05 -1.69 0.00 0.00 -0.04 0.00 0.00 63.50 61.72 2hx6 n PRO 120 Cb 0.66 -2.55 0.00 0.00 -0.04 0.00 0.00 33.50 31.57 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 3.95 0.00 -0.57 3.54 0.23 -1.26 -5.15 115.26 116.00 2hx6 n ASN 121 Ca 0.56 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 54.61 2hx6 n ASN 121 Cb 0.18 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 37.88 2hx6 n ASN 121 CO 0.00 0.00 0.00 1.21 -0.93 0.00 0.00 177.26 177.54 2hx6 n GLU 122 N -0.88 0.00 -0.00 -3.83 2.13 -1.26 -4.86 120.64 111.93 2hx6 n GLU 122 Ca 0.00 0.00 0.01 0.00 0.66 0.00 0.00 57.16 57.83 2hx6 n GLU 122 Cb 0.00 0.00 0.01 0.00 0.27 0.00 0.00 31.44 31.72 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 0.40 -0.59 0.00 5.31 4.01 -1.24 -3.46 118.16 122.60 2hx6 n LYS 123 Ca 0.00 -0.65 0.00 0.00 -0.51 0.00 0.00 58.31 57.15 2hx6 n LYS 123 Cb 0.00 -1.03 0.00 0.00 -0.51 0.00 0.00 35.03 33.49 2hx6 n LYS 123 CO 0.00 0.00 0.00 1.19 -1.11 0.00 0.00 177.40 177.48 2hx6 n PHE 124 N 0.07 0.00 0.00 2.13 3.72 -1.25 -4.14 117.46 117.98 2hx6 n PHE 124 Ca 0.01 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.41 2hx6 n PHE 124 Cb 0.05 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.59 2hx6 n PHE 124 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 2hx6 n LYS 125 N 0.00 0.00 -3.30 -1.08 4.01 -1.26 -0.87 118.16 115.66 2hx6 n LYS 125 Ca 0.00 0.00 -0.09 0.00 -0.51 0.00 0.00 58.31 57.71 2hx6 n LYS 125 Cb 0.00 -0.05 -0.05 0.00 -0.51 0.00 0.00 35.03 34.42 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 -2.79 0.07 -0.07 4.39 2.15 -1.26 -4.90 116.67 114.27 2hx6 s ASP 126 Ca 0.00 -1.08 0.10 0.00 0.43 0.00 0.00 52.55 52.00 2hx6 s ASP 126 Cb 0.00 1.15 0.15 0.00 -0.30 0.00 0.00 42.92 43.92 2hx6 s ASP 126 CO 0.00 -0.25 1.03 -0.81 -0.17 0.00 0.00 175.17 174.98 2hx6 n PRO 127 N 4.51 1.29 -3.80 4.34 -0.04 -1.26 -4.82 135.00 135.21 2hx6 n PRO 127 Ca 0.09 -1.87 -0.12 0.00 -0.04 0.00 0.00 63.50 61.56 2hx6 n PRO 127 Cb 0.50 -1.11 -0.10 0.00 -0.04 0.00 0.00 33.50 32.75 2hx6 n PRO 127 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2hx6 s SER 128 N -1.87 -0.13 -0.16 3.54 0.15 -1.26 -2.10 113.70 111.87 2hx6 s SER 128 Ca 0.16 0.07 -0.07 0.00 0.70 0.00 0.00 55.95 56.81 2hx6 s SER 128 Cb 0.14 0.32 -0.04 0.00 -1.71 0.00 0.00 66.02 64.73 2hx6 s SER 128 CO 0.02 -0.36 0.07 -0.76 1.20 0.00 0.00 173.24 173.41 2hx6 s LEU 129 N -1.09 3.90 -0.42 3.45 1.43 -0.80 0.03 118.68 125.19 2hx6 s LEU 129 Ca -0.12 0.17 -0.02 0.00 -1.03 0.00 0.00 54.13 53.13 2hx6 s LEU 129 Cb -0.05 -1.97 0.18 0.00 0.03 0.00 0.00 46.19 44.38 2hx6 s LEU 129 CO 0.03 0.24 2.31 1.67 0.23 0.00 0.00 176.35 180.83 2hx6 n GLN 130 N 3.06 2.14 0.00 1.70 7.27 0.12 -1.85 117.38 129.83 2hx6 n GLN 130 Ca -0.17 -2.09 0.00 0.00 0.07 0.00 0.00 57.00 54.81 2hx6 n GLN 130 Cb 0.53 -1.90 0.00 0.00 2.41 0.00 0.00 30.24 31.28 2hx6 n GLN 130 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 2hx6 s ARG 132 N -4.96 2.36 -0.13 0.00 3.52 -0.78 -2.72 118.95 116.23 2hx6 s ARG 132 Ca 0.00 -1.31 -0.14 0.00 -0.13 0.00 0.00 55.73 54.15 2hx6 s ARG 132 Cb 0.00 -3.12 -0.05 0.00 -1.56 0.00 0.00 34.95 30.22 2hx6 s ARG 132 CO 0.00 -0.62 0.33 1.41 -0.81 0.00 0.00 175.30 175.61 2hx6 s MET 133 N 1.21 4.18 -0.17 5.12 -2.45 0.29 -4.64 119.30 122.84 2hx6 s MET 133 Ca -0.05 0.19 -0.01 0.00 -1.25 0.00 0.00 55.69 54.57 2hx6 s MET 133 Cb -0.20 -3.38 0.04 0.00 1.25 0.00 0.00 34.83 32.54 2hx6 s MET 133 CO -0.02 0.32 -0.05 0.00 1.05 0.00 0.00 175.02 176.32 2hx6 s ALA 134 N 0.19 1.48 -0.04 4.11 0.00 -1.26 -0.15 121.76 126.08 2hx6 s ALA 134 Ca 0.19 -0.83 -0.01 0.00 0.00 0.00 0.00 51.96 51.30 2hx6 s ALA 134 Cb -0.14 -1.13 0.03 0.00 0.00 0.00 0.00 23.12 21.89 2hx6 s ALA 134 CO 0.06 -0.80 0.08 0.42 0.00 0.00 0.00 175.76 175.53 2hx6 s ILE 135 N 1.63 -0.06 0.53 0.00 1.01 -0.88 -4.79 121.20 118.65 2hx6 s ILE 135 Ca 0.01 0.21 0.01 0.00 0.00 0.00 0.00 60.65 60.87 2hx6 s ILE 135 Cb -0.15 -0.15 0.00 0.00 0.01 0.00 0.00 42.46 42.16 2hx6 s ILE 135 CO -0.08 0.08 0.05 -0.63 0.00 0.00 0.00 174.94 174.36 2hx6 s ILE 136 N 1.15 1.12 -0.05 2.92 1.09 -1.26 -0.62 121.20 125.54 2hx6 s ILE 136 Ca -0.09 -1.94 -0.04 0.00 -1.10 0.00 0.00 60.65 57.48 2hx6 s ILE 136 Cb -0.12 -2.06 0.02 0.00 -1.06 0.00 0.00 42.46 39.24 2hx6 s ILE 136 CO -0.04 0.00 0.13 0.54 -0.10 0.00 0.00 174.94 175.47 2hx6 s ASN 137 N -3.94 -0.12 0.00 3.58 2.20 -1.26 -4.88 114.94 110.51 2hx6 s ASN 137 Ca 0.06 0.27 0.00 0.00 -0.94 0.00 0.00 52.86 52.25 2hx6 s ASN 137 Cb 0.00 0.23 0.00 0.00 -2.00 0.00 0.00 41.25 39.48 2hx6 s ASN 137 CO 0.03 -0.09 0.00 -0.24 -2.94 0.00 0.00 177.10 173.87 2hx6 n SER 138 N 3.48 0.00 0.00 3.54 2.88 -1.03 -4.71 113.62 117.78 2hx6 n SER 138 Ca -0.18 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.36 2hx6 n SER 138 Cb 0.56 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.02 2hx6 n SER 138 CO 0.00 0.00 0.00 -2.11 -1.23 0.00 0.00 175.04 171.70 2hx6 n ARG 139 N 0.00 0.00 -0.09 -1.46 0.00 -1.26 -4.74 116.66 109.11 2hx6 n ARG 139 Ca 0.00 0.00 0.06 0.00 -0.00 0.00 0.00 57.85 57.91 2hx6 n ARG 139 Cb 0.00 0.00 0.23 0.00 -0.00 0.00 0.00 32.46 32.69 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 -0.74 1.51 -1.66 2.89 1.85 -1.26 -4.94 116.66 114.30 2hx6 n ARG 140 Ca 0.00 -0.78 -0.30 0.00 -1.00 0.00 0.00 57.85 55.77 2hx6 n ARG 140 Cb 0.00 -1.25 0.07 0.00 -1.05 0.00 0.00 32.46 30.23 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 -1.22 2.80 0.45 2.89 2.01 -1.26 -4.84 118.68 119.51 2hx6 s LEU 141 Ca 0.21 1.32 0.21 0.00 0.01 0.00 0.00 54.13 55.88 2hx6 s LEU 141 Cb 0.11 -4.05 1.18 0.00 0.01 0.00 0.00 46.19 43.45 2hx6 s LEU 141 CO 0.16 -1.66 1.86 -0.65 1.01 0.00 0.00 176.35 177.07 2hx6 h PRO 142 N -0.87 0.30 0.00 1.29 0.11 -1.90 -3.44 132.00 127.48 2hx6 h PRO 142 Ca -0.46 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.63 2hx6 h PRO 142 Cb 1.25 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.29 2hx6 h PRO 142 CO 0.60 0.20 0.00 0.41 -0.21 0.00 0.00 178.00 179.00 2hx6 n GLY 143 N -1.56 1.18 3.37 -0.55 0.00 -1.26 -5.10 105.19 101.27 2hx6 n GLY 143 Ca 0.19 -0.70 -0.28 0.00 0.00 0.00 0.00 46.02 45.23 2hx6 n GLY 143 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2hx6 s LYS 144 N 0.08 1.40 0.00 1.61 -2.85 -1.26 -2.48 119.74 116.24 2hx6 s LYS 144 Ca 0.00 -1.30 0.00 0.00 -1.00 0.00 0.00 55.97 53.67 2hx6 s LYS 144 Cb 0.00 -1.83 0.00 0.00 -2.06 0.00 0.00 37.83 33.94 2hx6 s LYS 144 CO 0.00 0.44 0.00 0.00 0.10 0.00 0.00 175.35 175.89 2hx6 n ALA 145 N 1.03 0.00 -1.93 0.59 0.00 -1.26 -5.05 120.51 113.88 2hx6 n ALA 145 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.26 2hx6 n ALA 145 Cb 0.53 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.98 2hx6 n ALA 145 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2hx6 n SER 146 N 0.00 0.00 -3.15 0.00 3.41 -1.26 -5.15 113.62 107.47 2hx6 n SER 146 Ca 0.00 0.00 0.05 0.00 -0.26 0.00 0.00 58.87 58.66 2hx6 n SER 146 Cb 0.00 0.00 -0.01 0.00 -0.26 0.00 0.00 64.21 63.94 2hx6 n SER 146 CO 0.00 0.00 0.00 -1.59 -0.16 0.00 0.00 175.04 173.29 2hx6 s LYS 147 N 4.52 0.42 -0.10 4.33 -2.85 -1.26 -4.98 119.74 119.82 2hx6 s LYS 147 Ca 0.00 0.72 0.22 0.00 -1.00 0.00 0.00 55.97 55.91 2hx6 s LYS 147 Cb 0.00 0.40 0.44 0.00 -2.06 0.00 0.00 37.83 36.61 2hx6 s LYS 147 CO 0.00 -0.47 1.17 0.00 0.10 0.00 0.00 175.35 176.15 2hx6 n ALA 148 N 5.44 2.77 -1.97 0.59 0.00 -1.26 -5.09 120.51 120.99 2hx6 n ALA 148 Ca -0.03 -2.67 -0.43 0.00 0.00 0.00 0.00 53.44 50.32 2hx6 n ALA 148 Cb 0.52 -0.68 -0.03 0.00 0.00 0.00 0.00 19.45 19.27 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 -1.51 3.50 0.04 0.00 -7.23 -1.26 -4.60 120.40 109.35 2hx6 s VAL 149 Ca 0.34 0.58 -0.11 0.00 -1.81 0.00 0.00 61.98 60.98 2hx6 s VAL 149 Cb 0.37 -3.48 -0.06 0.00 0.56 0.00 0.00 36.38 33.78 2hx6 s VAL 149 CO -0.12 -0.16 0.38 0.27 -0.31 0.00 0.00 175.10 175.16 2hx6 s ILE 150 N 5.17 5.11 0.11 -0.62 -4.36 0.17 -4.98 121.20 121.79 2hx6 s ILE 150 Ca 0.77 0.54 0.10 0.00 -0.26 0.00 0.00 60.65 61.81 2hx6 s ILE 150 Cb -0.30 -3.65 -0.04 0.00 1.25 0.00 0.00 42.46 39.72 2hx6 s ILE 150 CO 0.31 0.40 -0.26 -0.54 0.24 0.00 0.00 174.94 175.09 2hx6 s LYS 151 N -1.61 1.46 0.36 0.37 1.02 -1.26 -3.95 119.74 116.13 2hx6 s LYS 151 Ca 0.29 -1.27 -0.26 0.00 0.02 0.00 0.00 55.97 54.75 2hx6 s LYS 151 Cb -0.15 -1.86 -0.09 0.00 -0.52 0.00 0.00 37.83 35.21 2hx6 s LYS 151 CO 0.16 0.45 1.07 -0.08 -0.92 0.00 0.00 175.35 176.03 2hx6 s THR 152 N -1.01 3.61 -2.69 2.17 -1.32 -1.26 -5.12 115.64 110.02 2hx6 s THR 152 Ca 0.13 1.35 0.22 0.00 -1.21 0.00 0.00 61.69 62.17 2hx6 s THR 152 Cb -0.10 -3.76 0.17 0.00 -1.51 0.00 0.00 72.50 67.31 2hx6 s THR 152 CO 0.05 0.12 1.18 0.00 -2.21 0.00 0.00 174.62 173.76