#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hx6 n THR 2 N 0.00 3.36 -0.54 3.17 -2.24 -1.26 -4.97 114.28 111.80 2hx6 n THR 2 Ca 0.00 -4.29 -0.22 0.00 -2.27 0.00 0.00 64.05 57.27 2hx6 n THR 2 Cb 0.00 -1.24 -0.03 0.00 -2.10 0.00 0.00 70.33 66.96 2hx6 n THR 2 CO 0.00 0.00 0.00 -0.38 -0.57 0.00 0.00 175.07 174.12 2hx6 n ILE 3 N -0.57 1.20 1.13 2.28 -0.00 -1.26 -4.74 119.36 117.41 2hx6 n ILE 3 Ca 0.52 -0.80 0.09 0.00 -0.00 0.00 0.00 62.75 62.55 2hx6 n ILE 3 Cb 0.36 -1.94 0.50 0.00 -0.00 0.00 0.00 39.64 38.57 2hx6 n ILE 3 CO 0.00 0.00 0.00 0.59 -0.00 0.00 0.00 176.55 177.14 2hx6 n ASN 4 N 5.71 0.00 0.29 4.38 3.02 -1.26 -3.79 115.26 123.61 2hx6 n ASN 4 Ca 0.31 -0.60 -0.16 0.00 -0.03 0.00 0.00 54.58 54.10 2hx6 n ASN 4 Cb 0.18 0.00 -0.08 0.00 -0.61 0.00 0.00 39.78 39.26 2hx6 n ASN 4 CO 0.00 0.00 0.00 0.74 -2.62 0.00 0.00 177.26 175.38 2hx6 h THR 5 N 0.00 0.47 0.00 3.41 2.02 -1.99 0.29 112.91 117.11 2hx6 h THR 5 Ca 0.00 -0.10 -0.02 0.00 0.77 0.00 0.00 66.41 67.07 2hx6 h THR 5 Cb 0.00 0.52 -0.00 0.00 -1.74 0.00 0.00 68.15 66.93 2hx6 h THR 5 CO 0.00 0.02 -0.07 -0.33 0.37 0.00 0.00 175.52 175.50 2hx6 h GLU 6 N -0.76 0.00 0.19 6.66 5.08 -1.99 -2.15 114.58 121.61 2hx6 h GLU 6 Ca -0.07 0.00 -0.32 0.00 -1.00 0.00 0.00 59.36 57.96 2hx6 h GLU 6 Cb 0.57 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.83 2hx6 h GLU 6 CO 0.12 0.07 -1.53 -0.39 -1.00 0.00 0.00 179.01 176.29 2hx6 h VAL 7 N 0.00 1.20 -0.35 3.13 -1.51 -1.68 -1.30 116.25 115.73 2hx6 h VAL 7 Ca -0.00 -2.74 -0.05 0.00 -1.23 0.00 0.00 66.70 62.68 2hx6 h VAL 7 Cb 0.69 2.89 -0.01 0.00 -2.13 0.00 0.00 31.29 32.73 2hx6 h VAL 7 CO 0.01 0.84 0.02 0.15 -1.23 0.00 0.00 177.57 177.36 2hx6 h PHE 8 N 0.11 0.66 -0.64 5.19 3.57 -0.35 0.27 116.94 125.74 2hx6 h PHE 8 Ca -0.26 -0.11 0.02 0.00 3.53 0.00 0.00 57.97 61.16 2hx6 h PHE 8 Cb 2.09 -0.18 -0.04 0.00 2.79 0.00 0.00 35.95 40.61 2hx6 h PHE 8 CO 0.10 0.70 0.40 0.82 -2.23 0.00 0.00 178.31 178.10 2hx6 h ILE 9 N 0.43 1.10 0.03 1.41 2.04 -1.49 -0.30 117.51 120.73 2hx6 h ILE 9 Ca 0.10 -0.27 -0.00 0.00 1.00 0.00 0.00 64.86 65.69 2hx6 h ILE 9 Cb 0.42 0.23 0.00 0.00 -0.74 0.00 0.00 36.82 36.73 2hx6 h ILE 9 CO 0.01 0.15 -0.01 -0.09 0.00 0.00 0.00 178.15 178.21 2hx6 h ARG 10 N 0.80 -0.03 -0.08 2.37 9.65 -0.60 0.24 114.38 126.72 2hx6 h ARG 10 Ca 0.25 0.00 0.02 0.00 -1.10 0.00 0.00 59.98 59.16 2hx6 h ARG 10 Cb -0.00 0.01 -0.00 0.00 -1.39 0.00 0.00 29.97 28.58 2hx6 h ARG 10 CO -0.10 0.09 0.06 0.00 2.80 0.00 0.00 179.97 182.83 2hx6 h ARG 11 N -0.15 0.00 0.02 0.20 3.08 -0.37 0.17 114.38 117.32 2hx6 h ARG 11 Ca -0.00 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.05 2hx6 h ARG 11 Cb 0.14 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.19 2hx6 h ARG 11 CO 0.01 0.00 -0.01 -0.91 -1.07 0.00 0.00 179.97 177.99 2hx6 h ASN 12 N 0.00 -0.02 -0.24 7.04 2.35 -1.02 -1.42 115.58 122.26 2hx6 h ASN 12 Ca 0.04 -0.74 0.07 0.00 -0.55 0.00 0.00 56.30 55.12 2hx6 h ASN 12 Cb 0.16 0.01 -0.01 0.00 0.05 0.00 0.00 38.32 38.53 2hx6 h ASN 12 CO -0.00 0.78 0.18 0.11 -1.65 0.00 0.00 177.43 176.85 2hx6 h LYS 13 N -0.89 0.00 -0.10 0.81 1.79 -0.85 0.22 116.57 117.55 2hx6 h LYS 13 Ca -0.00 0.00 -0.06 0.00 -2.18 0.00 0.00 60.65 58.41 2hx6 h LYS 13 Cb 0.76 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.41 2hx6 h LYS 13 CO 0.00 0.00 -0.18 1.25 -1.08 0.00 0.00 179.45 179.44 2hx6 h LEU 14 N 0.00 0.33 -0.74 2.94 5.85 -0.71 -0.20 115.31 122.78 2hx6 h LEU 14 Ca 0.11 -0.55 0.09 0.00 0.84 0.00 0.00 57.88 58.37 2hx6 h LEU 14 Cb 0.47 -0.09 -0.07 0.00 0.37 0.00 0.00 40.66 41.34 2hx6 h LEU 14 CO -0.00 0.82 0.40 -0.09 -0.34 0.00 0.00 178.44 179.23 2hx6 h ARG 15 N -0.15 0.67 -0.31 1.25 1.12 0.13 0.75 114.38 117.84 2hx6 h ARG 15 Ca 0.01 -0.04 0.03 0.00 -1.11 0.00 0.00 59.98 58.86 2hx6 h ARG 15 Cb 0.76 -0.15 -0.03 0.00 -0.01 0.00 0.00 29.97 30.54 2hx6 h ARG 15 CO 0.04 0.44 0.13 0.00 -3.11 0.00 0.00 179.97 177.47 2hx6 h ARG 16 N 0.69 0.27 0.01 0.20 2.47 -0.71 0.10 114.38 117.42 2hx6 h ARG 16 Ca 0.36 -0.02 -0.00 0.00 -1.26 0.00 0.00 59.98 59.06 2hx6 h ARG 16 Cb 0.32 -0.06 0.00 0.00 -1.65 0.00 0.00 29.97 28.58 2hx6 h ARG 16 CO -0.24 0.18 -0.01 1.25 0.56 0.00 0.00 179.97 181.71 2hx6 h HIS 17 N 0.28 -0.02 0.11 3.04 2.76 -0.02 0.37 115.15 121.66 2hx6 h HIS 17 Ca 0.13 -0.00 -0.01 0.00 -2.20 0.00 0.00 60.37 58.30 2hx6 h HIS 17 Cb 0.08 0.01 0.00 0.00 1.55 0.00 0.00 27.41 29.05 2hx6 h HIS 17 CO -0.12 0.04 -0.05 0.35 -1.30 0.00 0.00 177.93 176.85 2hx6 h PHE 18 N -0.07 -0.13 -0.10 5.26 3.04 0.42 -2.02 116.94 123.34 2hx6 h PHE 18 Ca -0.00 -0.00 -0.11 0.00 3.98 0.00 0.00 57.97 61.83 2hx6 h PHE 18 Cb 0.06 0.04 0.00 0.00 2.56 0.00 0.00 35.95 38.62 2hx6 h PHE 18 CO -0.06 0.14 -0.38 1.49 -2.02 0.00 0.00 178.31 177.49 2hx6 h GLU 19 N -0.41 0.43 -0.55 1.11 4.81 -0.85 -0.62 114.58 118.50 2hx6 h GLU 19 Ca -0.01 -0.33 -0.04 0.00 -0.13 0.00 0.00 59.36 58.85 2hx6 h GLU 19 Cb 0.34 0.06 -0.02 0.00 0.63 0.00 0.00 28.75 29.76 2hx6 h GLU 19 CO 0.02 0.96 0.19 0.77 -0.73 0.00 0.00 179.01 180.22 2hx6 h SER 20 N -0.01 0.78 0.97 1.04 0.02 -1.04 -1.70 113.55 113.61 2hx6 h SER 20 Ca -0.02 -0.19 -0.15 0.00 -0.84 0.00 0.00 61.79 60.59 2hx6 h SER 20 Cb 1.01 -0.20 -0.02 0.00 0.14 0.00 0.00 62.40 63.33 2hx6 h SER 20 CO 0.08 0.76 -0.70 -0.33 -1.14 0.00 0.00 176.83 175.50 2hx6 h GLU 21 N 0.75 0.00 -0.25 3.45 3.07 -1.50 -2.17 114.58 117.93 2hx6 h GLU 21 Ca 0.18 0.00 -0.00 0.00 -0.50 0.00 0.00 59.36 59.04 2hx6 h GLU 21 Cb 0.25 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.15 2hx6 h GLU 21 CO -0.01 0.70 0.14 0.74 -1.40 0.00 0.00 179.01 179.18 2hx6 h PHE 22 N 0.00 0.32 -0.32 4.33 -1.00 -0.78 0.30 116.94 119.79 2hx6 h PHE 22 Ca -0.01 0.00 -0.04 0.00 2.81 0.00 0.00 57.97 60.74 2hx6 h PHE 22 Cb 1.38 -0.11 -0.01 0.00 3.61 0.00 0.00 35.95 40.82 2hx6 h PHE 22 CO 0.00 0.22 0.05 0.00 -1.61 0.00 0.00 178.31 176.98 2hx6 h ARG 23 N 0.34 0.53 -0.42 1.51 3.08 -1.18 0.19 114.38 118.43 2hx6 h ARG 23 Ca 0.09 -0.14 0.05 0.00 0.07 0.00 0.00 59.98 60.05 2hx6 h ARG 23 Cb 0.00 -0.06 -0.04 0.00 0.08 0.00 0.00 29.97 29.95 2hx6 h ARG 23 CO -0.02 0.62 0.16 0.37 -1.07 0.00 0.00 179.97 180.03 2hx6 h GLN 24 N 0.36 0.33 -0.29 0.04 4.15 -0.50 0.18 115.11 119.38 2hx6 h GLN 24 Ca 0.10 -0.02 -0.09 0.00 0.77 0.00 0.00 58.65 59.41 2hx6 h GLN 24 Cb 0.34 -0.07 -0.01 0.00 0.21 0.00 0.00 27.48 27.95 2hx6 h GLN 24 CO 0.01 0.22 -0.16 0.82 -1.93 0.00 0.00 178.83 177.79 2hx6 h ILE 25 N 0.34 1.30 0.00 2.39 2.04 -0.50 0.21 117.51 123.29 2hx6 h ILE 25 Ca 0.19 -1.26 -0.06 0.00 1.00 0.00 0.00 64.86 64.73 2hx6 h ILE 25 Cb 0.16 1.50 -0.01 0.00 -0.74 0.00 0.00 36.82 37.74 2hx6 h ILE 25 CO -0.18 0.40 -0.27 -0.55 0.00 0.00 0.00 178.15 177.56 2hx6 h ASN 26 N 0.36 0.00 -0.29 1.72 7.08 -0.91 -0.61 115.58 122.92 2hx6 h ASN 26 Ca 0.06 0.00 -0.15 0.00 -3.08 0.00 0.00 56.30 53.13 2hx6 h ASN 26 Cb 0.68 0.00 -0.00 0.00 -2.08 0.00 0.00 38.32 36.92 2hx6 h ASN 26 CO 0.05 0.27 -0.41 -1.13 -2.08 0.00 0.00 177.43 174.12 2hx6 h ASN 27 N 0.00 0.87 -0.41 6.14 -0.00 -0.53 -1.84 115.58 119.81 2hx6 h ASN 27 Ca -0.00 -0.51 -0.09 0.00 -0.00 0.00 0.00 56.30 55.70 2hx6 h ASN 27 Cb 0.87 -0.25 -0.02 0.00 -0.00 0.00 0.00 38.32 38.93 2hx6 h ASN 27 CO 0.03 1.20 -0.05 -0.08 -0.00 0.00 0.00 177.43 178.54 2hx6 h GLU 28 N 0.56 0.84 -0.67 6.67 4.57 -0.45 -1.84 114.58 124.26 2hx6 h GLU 28 Ca 0.03 -0.26 -0.08 0.00 -1.18 0.00 0.00 59.36 57.87 2hx6 h GLU 28 Cb 1.01 -0.08 -0.03 0.00 -0.16 0.00 0.00 28.75 29.49 2hx6 h GLU 28 CO 0.10 0.88 0.11 0.82 -1.18 0.00 0.00 179.01 179.73 2hx6 h ILE 29 N 0.77 1.26 -0.55 2.32 5.03 -1.11 0.26 117.51 125.50 2hx6 h ILE 29 Ca 0.14 -1.04 -0.12 0.00 -0.12 0.00 0.00 64.86 63.72 2hx6 h ILE 29 Cb 0.54 0.64 -0.02 0.00 -3.03 0.00 0.00 36.82 34.95 2hx6 h ILE 29 CO 0.03 0.39 -0.11 0.03 -0.68 0.00 0.00 178.15 177.81 2hx6 h ARG 30 N 1.03 1.05 -0.01 2.37 3.08 -1.20 -0.93 114.38 119.77 2hx6 h ARG 30 Ca 0.20 -0.39 -0.25 0.00 0.07 0.00 0.00 59.98 59.61 2hx6 h ARG 30 Cb 0.44 -0.07 0.01 0.00 0.08 0.00 0.00 29.97 30.44 2hx6 h ARG 30 CO 0.01 1.08 -0.99 0.93 -1.07 0.00 0.00 179.97 179.93 2hx6 h GLU 31 N 0.93 0.61 -0.18 0.04 5.08 -1.21 0.10 114.58 119.95 2hx6 h GLU 31 Ca 0.14 -0.65 -0.09 0.00 -1.00 0.00 0.00 59.36 57.77 2hx6 h GLU 31 Cb 0.68 0.18 -0.00 0.00 0.50 0.00 0.00 28.75 30.11 2hx6 h GLU 31 CO 0.05 1.25 -0.23 0.00 -1.00 0.00 0.00 179.01 179.08 2hx6 h ALA 32 N 0.53 0.27 -0.04 3.43 0.00 -0.55 0.29 119.26 123.19 2hx6 h ALA 32 Ca -0.11 -0.37 -0.13 0.00 0.00 0.00 0.00 54.91 54.30 2hx6 h ALA 32 Cb 1.64 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 19.36 2hx6 h ALA 32 CO 0.19 0.22 -0.57 0.66 0.00 0.00 0.00 179.25 179.75 2hx6 h SER 33 N 0.12 0.14 -0.06 0.00 4.64 -1.20 0.68 113.55 117.87 2hx6 h SER 33 Ca 0.02 -0.07 -0.02 0.00 -0.47 0.00 0.00 61.79 61.24 2hx6 h SER 33 Cb 0.79 -0.04 -0.00 0.00 -0.31 0.00 0.00 62.40 62.84 2hx6 h SER 33 CO 0.05 0.68 -0.06 0.11 -0.87 0.00 0.00 176.83 176.74 2hx6 h LYS 34 N 0.09 0.14 0.00 4.77 1.57 -0.82 0.89 116.57 123.22 2hx6 h LYS 34 Ca -0.00 -0.08 -0.08 0.00 -1.87 0.00 0.00 60.65 58.62 2hx6 h LYS 34 Cb 1.03 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.33 2hx6 h LYS 34 CO 0.08 0.59 -0.38 0.00 -0.57 0.00 0.00 179.45 179.16 2hx6 h ALA 35 N 0.56 1.28 0.00 3.86 0.00 -0.32 -0.77 119.26 123.86 2hx6 h ALA 35 Ca 0.01 -0.35 0.00 0.00 0.00 0.00 0.00 54.91 54.57 2hx6 h ALA 35 Cb 0.56 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.29 2hx6 h ALA 35 CO 0.01 0.48 0.00 0.00 0.00 0.00 0.00 179.25 179.74 2hx6 n ALA 36 N -2.43 1.66 -0.14 0.00 0.00 0.24 -4.92 120.51 114.92 2hx6 n ALA 36 Ca -0.02 0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.48 2hx6 n ALA 36 Cb 0.43 -1.35 0.00 0.00 0.00 0.00 0.00 19.45 18.53 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 -0.01 0.92 3.74 0.00 0.00 -0.30 -5.06 105.19 104.49 2hx6 n GLY 37 Ca 0.02 -0.12 -0.24 0.00 0.00 0.00 0.00 46.02 45.68 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 2.44 0.00 1.61 -7.23 0.30 -5.02 120.40 110.50 2hx6 s VAL 38 Ca 0.00 -1.69 0.00 0.00 -1.81 0.00 0.00 61.98 58.48 2hx6 s VAL 38 Cb 0.00 -2.98 0.00 0.00 0.56 0.00 0.00 36.38 33.96 2hx6 s VAL 38 CO 0.00 -0.03 0.30 -0.24 -0.31 0.00 0.00 175.10 174.82 2hx6 n SER 39 N -1.23 0.00 0.00 4.85 2.88 -1.26 -3.75 113.62 115.11 2hx6 n SER 39 Ca -0.01 0.30 0.00 0.00 -1.33 0.00 0.00 58.87 57.83 2hx6 n SER 39 Cb 0.64 -0.04 0.00 0.00 -0.75 0.00 0.00 64.21 64.05 2hx6 n SER 39 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 2hx6 n SER 40 N -1.06 0.00 -4.37 -3.46 7.64 -1.26 -4.75 113.62 106.36 2hx6 n SER 40 Ca 0.00 0.00 -0.24 0.00 1.01 0.00 0.00 58.87 59.64 2hx6 n SER 40 Cb 0.00 0.00 -0.11 0.00 -1.01 0.00 0.00 64.21 63.09 2hx6 n SER 40 CO 0.00 0.00 0.00 0.72 -3.01 0.00 0.00 175.04 172.75 2hx6 s PHE 41 N -1.69 2.01 -0.03 1.43 -0.71 -1.26 -4.74 117.98 113.00 2hx6 s PHE 41 Ca 0.00 -0.42 -0.03 0.00 -1.04 0.00 0.00 56.93 55.44 2hx6 s PHE 41 Cb 0.00 -1.00 -0.04 0.00 -1.21 0.00 0.00 43.02 40.77 2hx6 s PHE 41 CO 0.00 0.40 0.14 -1.01 -1.34 0.00 0.00 175.22 173.41 2hx6 s HIS 42 N -1.86 3.48 0.21 3.49 3.76 -0.96 -4.79 115.29 118.63 2hx6 s HIS 42 Ca 0.17 0.35 0.08 0.00 -0.15 0.00 0.00 55.06 55.51 2hx6 s HIS 42 Cb -0.07 -1.83 -0.05 0.00 1.11 0.00 0.00 32.58 31.75 2hx6 s HIS 42 CO 0.08 0.64 -0.15 -0.48 -0.85 0.00 0.00 174.74 173.97 2hx6 s LEU 43 N -1.69 2.55 0.21 0.89 0.05 -1.26 -0.06 118.68 119.36 2hx6 s LEU 43 Ca 0.24 -1.01 0.02 0.00 0.05 0.00 0.00 54.13 53.43 2hx6 s LEU 43 Cb -0.12 -0.72 -0.05 0.00 -2.05 0.00 0.00 46.19 43.24 2hx6 s LEU 43 CO 0.14 -0.14 0.02 -0.54 -0.55 0.00 0.00 176.35 175.29 2hx6 s LYS 44 N -3.56 1.24 -0.07 1.48 -0.14 0.37 -4.82 119.74 114.24 2hx6 s LYS 44 Ca 0.23 -1.62 -0.19 0.00 -1.36 0.00 0.00 55.97 53.02 2hx6 s LYS 44 Cb -0.02 -0.36 0.04 0.00 -1.68 0.00 0.00 37.83 35.82 2hx6 s LYS 44 CO 0.08 -0.16 0.44 1.52 -0.76 0.00 0.00 175.35 176.47 2hx6 s TYR 45 N -3.62 -0.39 -0.21 3.18 1.13 -1.26 -0.79 117.35 115.40 2hx6 s TYR 45 Ca 0.28 0.74 -0.15 0.00 -1.41 0.00 0.00 57.07 56.54 2hx6 s TYR 45 Cb 0.06 0.19 -0.04 0.00 -1.10 0.00 0.00 41.96 41.08 2hx6 s TYR 45 CO 0.07 -0.40 0.36 0.45 -2.51 0.00 0.00 175.55 173.52 2hx6 s SER 46 N -0.86 6.38 0.05 -0.18 0.15 -1.26 -4.91 113.70 113.07 2hx6 s SER 46 Ca -0.09 0.44 0.28 0.00 0.70 0.00 0.00 55.95 57.28 2hx6 s SER 46 Cb -0.03 -2.21 1.13 0.00 -1.71 0.00 0.00 66.02 63.19 2hx6 s SER 46 CO 0.05 -0.06 1.88 0.00 1.20 0.00 0.00 173.24 176.30 2hx6 n GLN 47 N 4.50 0.06 0.09 5.44 1.13 -1.26 -2.77 117.38 124.57 2hx6 n GLN 47 Ca -0.09 0.06 -0.19 0.00 -1.94 0.00 0.00 57.00 54.84 2hx6 n GLN 47 Cb 0.51 -1.57 -0.11 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 2.87 0.10 -0.75 -1.58 0.00 -1.97 0.39 119.26 118.34 2hx6 h ALA 48 Ca 0.00 -0.78 -0.03 0.00 0.00 0.00 0.00 54.91 54.10 2hx6 h ALA 48 Cb 0.54 0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.36 2hx6 h ALA 48 CO 0.00 0.77 0.33 1.25 0.00 0.00 0.00 179.25 181.60 2hx6 h LEU 49 N 0.23 1.00 0.04 0.00 5.85 -2.00 -1.73 115.31 118.70 2hx6 h LEU 49 Ca -0.15 -0.15 -0.24 0.00 0.84 0.00 0.00 57.88 58.17 2hx6 h LEU 49 Cb 1.84 -0.26 0.02 0.00 0.37 0.00 0.00 40.66 42.64 2hx6 h LEU 49 CO 0.21 0.88 -0.96 0.25 -0.34 0.00 0.00 178.44 178.48 2hx6 h LEU 50 N 1.06 0.78 -1.18 2.25 6.46 -1.50 -1.99 115.31 121.19 2hx6 h LEU 50 Ca 0.25 -0.78 0.13 0.00 -0.12 0.00 0.00 57.88 57.36 2hx6 h LEU 50 Cb 0.16 -0.24 -0.07 0.00 -0.73 0.00 0.00 40.66 39.78 2hx6 h LEU 50 CO -0.03 1.47 0.59 -0.78 -0.62 0.00 0.00 178.44 179.07 2hx6 h ASP 51 N 0.19 0.77 -0.47 1.25 3.58 -0.20 0.73 116.42 122.27 2hx6 h ASP 51 Ca -0.13 0.04 -0.08 0.00 0.42 0.00 0.00 57.03 57.28 2hx6 h ASP 51 Cb 1.65 -0.12 -0.02 0.00 1.72 0.00 0.00 39.33 42.57 2hx6 h ASP 51 CO 0.19 0.41 -0.00 0.03 -2.88 0.00 0.00 179.24 176.99 2hx6 h ARG 52 N 0.83 0.84 0.00 0.28 3.08 -1.06 0.51 114.38 118.86 2hx6 h ARG 52 Ca 0.46 -0.27 -0.08 0.00 0.07 0.00 0.00 59.98 60.16 2hx6 h ARG 52 Cb 0.58 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.54 2hx6 h ARG 52 CO -0.22 0.89 -0.38 0.00 -1.07 0.00 0.00 179.97 179.19 2hx6 h ALA 53 N 0.92 1.24 -0.34 0.04 0.00 -0.46 0.16 119.26 120.83 2hx6 h ALA 53 Ca 0.13 -0.34 -0.13 0.00 0.00 0.00 0.00 54.91 54.57 2hx6 h ALA 53 Cb 0.51 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 2hx6 h ALA 53 CO 0.02 0.47 -0.27 0.82 0.00 0.00 0.00 179.25 180.30 2hx6 h ILE 54 N 0.00 1.29 0.00 0.00 2.04 0.60 0.07 117.51 121.51 2hx6 h ILE 54 Ca -0.00 -1.43 -0.25 0.00 1.00 0.00 0.00 64.86 64.18 2hx6 h ILE 54 Cb 0.73 1.44 -0.05 0.00 -0.74 0.00 0.00 36.82 38.20 2hx6 h ILE 54 CO 0.05 0.47 -2.01 0.00 0.00 0.00 0.00 178.15 176.66 2hx6 n GLN 55 N -4.22 1.41 0.07 2.37 6.02 0.16 -3.75 117.38 119.44 2hx6 n GLN 55 Ca -0.03 -0.02 -0.02 0.00 -0.01 0.00 0.00 57.00 56.92 2hx6 n GLN 55 Cb 0.47 -1.39 -0.06 0.00 1.02 0.00 0.00 30.24 30.28 2hx6 n GLN 55 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2hx6 h ARG 56 N 0.00 0.00 0.00 -1.09 2.47 -0.82 -3.40 114.38 111.54 2hx6 h ARG 56 Ca -0.36 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.36 2hx6 h ARG 56 Cb 1.80 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 30.12 2hx6 h ARG 56 CO 0.02 0.60 0.00 0.39 0.56 0.00 0.00 179.97 181.54 2hx6 n GLU 57 N -3.16 0.00 0.00 0.04 -0.58 -1.15 -4.48 120.64 111.31 2hx6 n GLU 57 Ca -0.04 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.70 2hx6 n GLU 57 Cb 0.86 -0.41 0.00 0.00 -0.57 0.00 0.00 31.44 31.32 2hx6 n GLU 57 CO 0.00 0.00 0.00 0.44 -0.48 0.00 0.00 177.13 177.09 2hx6 n ILE 58 N -2.49 0.00 -3.51 -3.67 -6.64 -0.00 -1.96 119.36 101.10 2hx6 n ILE 58 Ca 0.00 0.00 -0.20 0.00 -1.77 0.00 0.00 62.75 60.78 2hx6 n ILE 58 Cb 0.00 0.00 -0.06 0.00 -1.44 0.00 0.00 39.64 38.14 2hx6 n ILE 58 CO 0.00 0.00 0.00 -0.90 -1.77 0.00 0.00 176.55 173.88 2hx6 n ASP 59 N -1.44 0.14 -3.75 7.28 5.68 -1.26 -4.67 116.55 118.53 2hx6 n ASP 59 Ca 0.00 -0.75 -0.42 0.00 -0.50 0.00 0.00 54.79 53.12 2hx6 n ASP 59 Cb 0.00 -0.94 0.00 0.00 -1.14 0.00 0.00 41.12 39.04 2hx6 n ASP 59 CO 0.00 0.00 0.00 -1.84 -1.33 0.00 0.00 177.20 174.03 2hx6 n GLU 60 N -2.99 3.03 0.18 0.11 0.28 -1.26 -4.40 120.64 115.59 2hx6 n GLU 60 Ca -0.13 -2.79 0.12 0.00 -0.16 0.00 0.00 57.16 54.20 2hx6 n GLU 60 Cb 0.38 -3.21 0.18 0.00 1.43 0.00 0.00 31.44 30.22 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 3.93 0.00 -0.37 3.84 1.35 -1.96 -3.30 112.91 116.40 2hx6 h THR 61 Ca 0.54 -0.91 -0.07 0.00 -0.55 0.00 0.00 66.41 65.41 2hx6 h THR 61 Cb 0.63 1.83 -0.02 0.00 -1.73 0.00 0.00 68.15 68.86 2hx6 h THR 61 CO 1.83 0.00 -0.07 0.22 -0.25 0.00 0.00 175.52 177.25 2hx6 h TYR 62 N 0.00 0.66 -0.43 4.73 3.20 -1.92 0.29 116.97 123.50 2hx6 h TYR 62 Ca 0.00 -0.10 0.02 0.00 3.14 0.00 0.00 58.73 61.79 2hx6 h TYR 62 Cb 0.95 -0.18 -0.03 0.00 1.54 0.00 0.00 36.73 39.01 2hx6 h TYR 62 CO 0.00 0.68 0.25 0.28 -1.64 0.00 0.00 178.16 177.73 2hx6 h VAL 63 N 0.58 1.03 -0.47 1.81 2.07 -1.93 -0.02 116.25 119.32 2hx6 h VAL 63 Ca 0.11 -0.17 0.00 0.00 0.82 0.00 0.00 66.70 67.46 2hx6 h VAL 63 Cb 0.48 0.49 -0.02 0.00 -1.52 0.00 0.00 31.29 30.71 2hx6 h VAL 63 CO 0.03 0.09 0.29 -0.26 0.02 0.00 0.00 177.57 177.74 2hx6 h PHE 64 N 0.50 0.61 -0.38 1.57 0.04 -1.64 -2.02 116.94 115.62 2hx6 h PHE 64 Ca 0.18 0.00 -0.13 0.00 2.80 0.00 0.00 57.97 60.82 2hx6 h PHE 64 Cb 0.03 -0.20 -0.01 0.00 2.20 0.00 0.00 35.95 37.96 2hx6 h PHE 64 CO -0.08 0.41 -0.27 0.93 -0.60 0.00 0.00 178.31 178.71 2hx6 h GLU 65 N 0.63 0.80 0.18 1.51 5.08 0.18 0.20 114.58 123.17 2hx6 h GLU 65 Ca 0.17 -0.35 -0.01 0.00 -1.00 0.00 0.00 59.36 58.17 2hx6 h GLU 65 Cb -0.03 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.20 2hx6 h GLU 65 CO -0.03 0.98 -0.09 1.25 -1.00 0.00 0.00 179.01 180.11 2hx6 h LEU 66 N 0.69 -0.21 -0.18 1.33 7.12 -1.08 -0.51 115.31 122.47 2hx6 h LEU 66 Ca 0.09 -0.19 0.00 0.00 0.13 0.00 0.00 57.88 57.91 2hx6 h LEU 66 Cb 0.80 0.05 0.00 0.00 -0.53 0.00 0.00 40.66 40.98 2hx6 h LEU 66 CO 0.07 0.08 0.00 2.19 -0.13 0.00 0.00 178.44 180.64 2hx6 h PHE 67 N -0.50 0.00 0.00 1.25 -5.15 -1.24 -0.65 116.94 110.65 2hx6 h PHE 67 Ca -0.02 0.00 -0.06 0.00 -0.20 0.00 0.00 57.97 57.69 2hx6 h PHE 67 Cb 0.38 0.00 -0.01 0.00 0.22 0.00 0.00 35.95 36.54 2hx6 h PHE 67 CO 0.01 0.00 -0.27 0.45 -2.00 0.00 0.00 178.31 176.50 2hx6 h HIS 68 N 0.00 0.00 0.04 6.09 3.86 -0.69 -0.23 115.15 124.23 2hx6 h HIS 68 Ca 0.00 0.00 -0.25 0.00 -1.16 0.00 0.00 60.37 58.96 2hx6 h HIS 68 Cb 0.82 0.00 0.01 0.00 1.06 0.00 0.00 27.41 29.30 2hx6 h HIS 68 CO 0.00 0.27 -1.06 -0.22 0.86 0.00 0.00 177.93 177.78 2hx6 h LYS 69 N 0.00 0.46 -0.00 2.45 3.11 0.39 -3.37 116.57 119.61 2hx6 h LYS 69 Ca -0.00 -0.56 0.00 0.00 -2.81 0.00 0.00 60.65 57.28 2hx6 h LYS 69 Cb 1.11 0.17 0.00 0.00 -1.00 0.00 0.00 32.23 32.51 2hx6 h LYS 69 CO 0.03 1.20 -0.49 0.44 -2.81 0.00 0.00 179.45 177.83 2hx6 n ILE 70 N -3.73 0.00 0.00 2.00 -5.35 -0.62 -4.70 119.36 106.96 2hx6 n ILE 70 Ca -0.09 -0.08 0.00 0.00 -0.27 0.00 0.00 62.75 62.31 2hx6 n ILE 70 Cb 0.90 0.55 0.00 0.00 -1.74 0.00 0.00 39.64 39.35 2hx6 n ILE 70 CO 0.00 0.00 0.00 2.29 -1.76 0.00 0.00 176.55 177.08 2hx6 n LYS 71 N -1.01 0.00 0.04 6.28 2.85 -0.10 0.68 118.16 126.90 2hx6 n LYS 71 Ca 0.08 0.03 -0.22 0.00 -1.05 0.00 0.00 58.31 57.15 2hx6 n LYS 71 Cb 0.36 -1.54 -0.14 0.00 -0.65 0.00 0.00 35.03 33.05 2hx6 n LYS 71 CO 0.00 0.00 0.00 0.22 -0.05 0.00 0.00 177.40 177.57 2hx6 h ASP 72 N 0.00 0.48 0.13 -5.58 3.58 -1.87 -3.40 116.42 109.75 2hx6 h ASP 72 Ca 0.00 -0.90 0.00 0.00 0.42 0.00 0.00 57.03 56.55 2hx6 h ASP 72 Cb 0.09 -0.15 0.00 0.00 1.72 0.00 0.00 39.33 40.98 2hx6 h ASP 72 CO 0.00 1.58 0.00 1.57 -2.88 0.00 0.00 179.24 179.51 2hx6 n HIS 73 N -3.93 0.00 0.33 0.28 -0.00 0.21 -1.67 115.22 110.45 2hx6 n HIS 73 Ca -0.21 0.00 0.22 0.00 0.46 0.00 0.00 57.72 58.19 2hx6 n HIS 73 Cb 0.92 -0.49 1.16 0.00 -0.12 0.00 0.00 29.99 31.46 2hx6 n HIS 73 CO 0.00 0.00 0.00 -0.24 0.46 0.00 0.00 176.34 176.56 2hx6 h VAL 74 N 0.00 0.07 -0.10 3.57 3.04 -1.78 -0.07 116.25 120.99 2hx6 h VAL 74 Ca 0.00 -0.03 -0.18 0.00 -1.01 0.00 0.00 66.70 65.48 2hx6 h VAL 74 Cb 0.06 1.03 -0.01 0.00 -2.01 0.00 0.00 31.29 30.36 2hx6 h VAL 74 CO 0.00 0.00 -0.69 -0.07 -1.01 0.00 0.00 177.57 175.80 2hx6 h LEU 75 N 0.00 0.50 -0.22 3.16 4.07 -1.67 0.18 115.31 121.33 2hx6 h LEU 75 Ca -0.00 -0.31 -0.21 0.00 0.08 0.00 0.00 57.88 57.44 2hx6 h LEU 75 Cb 0.03 -0.15 -0.01 0.00 1.08 0.00 0.00 40.66 41.61 2hx6 h LEU 75 CO 0.00 1.04 -0.92 -0.33 -1.08 0.00 0.00 178.44 177.15 2hx6 h GLU 76 N 0.30 0.18 0.00 1.13 5.08 -1.28 0.21 114.58 120.19 2hx6 h GLU 76 Ca -0.02 -0.21 -0.09 0.00 -1.00 0.00 0.00 59.36 58.03 2hx6 h GLU 76 Cb 1.26 0.06 -0.01 0.00 0.50 0.00 0.00 28.75 30.56 2hx6 h GLU 76 CO 0.12 0.98 -0.44 -0.39 -1.00 0.00 0.00 179.01 178.27 2hx6 h VAL 77 N 0.09 1.31 -0.13 3.13 -1.51 -1.14 -1.72 116.25 116.30 2hx6 h VAL 77 Ca -0.05 -1.53 -0.10 0.00 -1.23 0.00 0.00 66.70 63.80 2hx6 h VAL 77 Cb 1.57 1.83 -0.01 0.00 -2.13 0.00 0.00 31.29 32.55 2hx6 h VAL 77 CO 0.14 0.44 -0.35 0.78 -1.23 0.00 0.00 177.57 177.34 2hx6 h ASN 78 N 0.00 0.26 0.17 4.19 -0.26 -0.54 -1.80 115.58 117.61 2hx6 h ASN 78 Ca -0.00 -0.10 -0.04 0.00 -0.56 0.00 0.00 56.30 55.60 2hx6 h ASN 78 Cb 0.79 -0.07 -0.01 0.00 -1.06 0.00 0.00 38.32 37.97 2hx6 h ASN 78 CO 0.06 0.60 -0.18 -0.33 -1.06 0.00 0.00 177.43 176.52 2hx6 h GLU 79 N 0.22 0.00 -0.14 0.81 5.08 -0.17 -0.77 114.58 119.62 2hx6 h GLU 79 Ca 0.03 -0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.32 2hx6 h GLU 79 Cb 0.73 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.97 2hx6 h GLU 79 CO 0.06 0.18 -0.19 0.35 -1.00 0.00 0.00 179.01 178.40 2hx6 h PHE 80 N 0.00 0.25 -0.77 4.33 3.57 -0.59 -2.84 116.94 120.89 2hx6 h PHE 80 Ca -0.00 -0.04 -0.04 0.00 3.53 0.00 0.00 57.97 61.42 2hx6 h PHE 80 Cb 0.31 -0.07 -0.03 0.00 2.79 0.00 0.00 35.95 38.95 2hx6 h PHE 80 CO 0.00 0.42 0.31 1.25 -2.23 0.00 0.00 178.31 178.06 2hx6 h LEU 81 N 0.21 1.06 0.00 0.59 5.85 -0.37 -3.39 115.31 119.27 2hx6 h LEU 81 Ca 0.04 -0.16 0.00 0.00 0.84 0.00 0.00 57.88 58.60 2hx6 h LEU 81 Cb 0.47 -0.27 0.00 0.00 0.37 0.00 0.00 40.66 41.23 2hx6 h LEU 81 CO 0.03 0.94 0.00 -0.24 -0.34 0.00 0.00 178.44 178.83 2hx6 n SER 82 N -4.28 0.00 -4.72 1.25 2.88 -0.80 -4.69 113.62 103.26 2hx6 n SER 82 Ca 0.07 -0.39 -0.29 0.00 -1.33 0.00 0.00 58.87 56.93 2hx6 n SER 82 Cb 0.18 0.00 0.15 0.00 -0.75 0.00 0.00 64.21 63.79 2hx6 n SER 82 CO 0.00 0.00 0.00 -0.04 -1.23 0.00 0.00 175.04 173.77 2hx6 s MET 83 N -2.00 1.04 0.92 -1.46 -1.94 -1.26 -5.06 119.30 109.55 2hx6 s MET 83 Ca 0.08 0.68 -0.10 0.00 -1.71 0.00 0.00 55.69 54.63 2hx6 s MET 83 Cb 0.04 -1.80 0.15 0.00 2.01 0.00 0.00 34.83 35.23 2hx6 s MET 83 CO 0.06 -2.35 1.13 -2.14 -0.01 0.00 0.00 175.02 171.70 2hx6 s PRO 84 N -4.98 0.98 0.57 2.03 0.02 -1.11 -4.82 135.00 127.68 2hx6 s PRO 84 Ca 0.64 1.40 -0.19 0.00 0.02 0.00 0.00 61.00 62.87 2hx6 s PRO 84 Cb -0.18 -1.73 -0.05 0.00 0.02 0.00 0.00 34.50 32.56 2hx6 s PRO 84 CO 0.57 -2.61 1.14 -2.14 -0.33 0.00 0.00 177.00 173.62 2hx6 s PRO 85 N -4.67 3.22 0.00 5.54 0.02 -1.26 -2.90 135.00 134.95 2hx6 s PRO 85 Ca 0.66 1.60 0.10 0.00 0.02 0.00 0.00 61.00 63.38 2hx6 s PRO 85 Cb -0.22 -1.99 0.55 0.00 0.02 0.00 0.00 34.50 32.86 2hx6 s PRO 85 CO 0.58 -0.95 1.10 0.54 -0.33 0.00 0.00 177.00 177.94 2hx6 n ARG 86 N -1.51 0.24 -0.10 5.54 5.12 -1.26 -3.11 116.66 121.58 2hx6 n ARG 86 Ca 0.12 0.08 -0.04 0.00 -1.93 0.00 0.00 57.85 56.08 2hx6 n ARG 86 Cb 0.51 -1.50 0.00 0.00 -1.16 0.00 0.00 32.46 30.31 2hx6 n ARG 86 CO 0.00 0.00 0.00 -2.30 -1.93 0.00 0.00 177.63 173.40 2hx6 n PRO 87 N -1.12 0.00 0.26 5.56 -0.01 -1.26 -4.76 135.00 133.67 2hx6 n PRO 87 Ca 0.06 0.00 0.13 0.00 -0.01 0.00 0.00 63.50 63.69 2hx6 n PRO 87 Cb 0.05 -0.10 0.69 0.00 -0.01 0.00 0.00 33.50 34.13 2hx6 n PRO 87 CO 0.00 0.00 0.00 -0.44 -0.01 0.00 0.00 175.50 175.05 2hx6 h ASP 88 N -0.10 0.00 -3.10 2.55 3.32 -1.93 -3.35 116.42 113.82 2hx6 h ASP 88 Ca -0.04 0.00 -0.57 0.00 0.02 0.00 0.00 57.03 56.43 2hx6 h ASP 88 Cb 0.13 0.00 -0.05 0.00 0.22 0.00 0.00 39.33 39.63 2hx6 h ASP 88 CO 0.02 0.12 0.76 -0.63 -1.72 0.00 0.00 179.24 177.80 2hx6 s ILE 89 N -3.99 4.63 0.00 0.35 1.01 -1.26 -4.97 121.20 116.97 2hx6 s ILE 89 Ca -0.02 1.95 0.31 0.00 0.00 0.00 0.00 60.65 62.89 2hx6 s ILE 89 Cb 0.12 -4.26 0.33 0.00 0.01 0.00 0.00 42.46 38.66 2hx6 s ILE 89 CO 0.58 -0.13 1.93 -0.78 0.00 0.00 0.00 174.94 176.54 2hx6 h ASP 90 N 7.47 0.00 0.70 3.58 3.58 -1.97 0.48 116.42 130.26 2hx6 h ASP 90 Ca -0.23 0.00 -0.17 0.00 0.42 0.00 0.00 57.03 57.05 2hx6 h ASP 90 Cb 1.09 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 42.12 2hx6 h ASP 90 CO 0.95 0.00 -0.77 1.05 -2.88 0.00 0.00 179.24 177.58 2hx6 h GLU 91 N 0.00 0.06 0.00 0.28 4.11 -1.96 -3.39 114.58 113.67 2hx6 h GLU 91 Ca 0.00 -0.05 0.00 0.00 0.07 0.00 0.00 59.36 59.38 2hx6 h GLU 91 Cb 0.25 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.52 2hx6 h GLU 91 CO 0.00 0.80 -0.43 -0.25 0.07 0.00 0.00 179.01 179.20 2hx6 n ASP 92 N -3.66 0.93 0.00 3.06 8.00 -0.63 -5.00 116.55 119.26 2hx6 n ASP 92 Ca -0.01 0.23 0.00 0.00 0.71 0.00 0.00 54.79 55.72 2hx6 n ASP 92 Cb 0.74 -0.63 0.00 0.00 -0.02 0.00 0.00 41.12 41.21 2hx6 n ASP 92 CO 0.00 0.00 0.00 0.33 -0.39 0.00 0.00 177.20 177.14 2hx6 n PHE 93 N -3.45 0.00 -5.27 1.24 7.35 0.16 -4.24 117.46 113.26 2hx6 n PHE 93 Ca -0.06 0.00 -0.31 0.00 -0.76 0.00 0.00 57.45 56.32 2hx6 n PHE 93 Cb 0.22 0.00 -0.16 0.00 0.35 0.00 0.00 39.48 39.89 2hx6 n PHE 93 CO 0.00 0.00 0.00 0.96 -0.76 0.00 0.00 176.76 176.96 2hx6 s ILE 94 N 0.00 2.07 0.16 -2.13 -4.36 -1.21 -4.22 121.20 111.50 2hx6 s ILE 94 Ca 0.00 -1.07 -0.18 0.00 -0.26 0.00 0.00 60.65 59.14 2hx6 s ILE 94 Cb 0.00 -1.74 0.04 0.00 1.25 0.00 0.00 42.46 42.01 2hx6 s ILE 94 CO 0.00 0.57 0.48 -1.81 0.24 0.00 0.00 174.94 174.42 2hx6 s ASP 95 N -0.24 -0.30 -0.17 4.36 1.01 -1.14 -2.75 116.67 117.44 2hx6 s ASP 95 Ca -0.01 -0.33 0.00 0.00 0.71 0.00 0.00 52.55 52.92 2hx6 s ASP 95 Cb -0.13 0.53 0.00 0.00 1.01 0.00 0.00 42.92 44.33 2hx6 s ASP 95 CO 0.03 -0.95 0.00 0.61 0.21 0.00 0.00 175.17 175.07 2hx6 n GLY 96 N -0.29 -0.09 3.77 0.21 0.00 -1.19 -4.77 105.19 102.82 2hx6 n GLY 96 Ca -0.14 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.49 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 -1.50 2.87 -0.93 1.61 0.11 -1.26 -4.82 120.40 116.47 2hx6 s VAL 97 Ca 0.00 0.79 0.12 0.00 -2.93 0.00 0.00 61.98 59.96 2hx6 s VAL 97 Cb 0.00 -3.47 0.56 0.00 -1.53 0.00 0.00 36.38 31.94 2hx6 s VAL 97 CO 0.00 0.13 1.41 -0.62 -3.33 0.00 0.00 175.10 172.68 2hx6 n GLU 98 N 0.34 3.36 0.02 1.54 -0.58 -1.26 -3.45 120.64 120.59 2hx6 n GLU 98 Ca 0.03 -2.18 0.09 0.00 -0.42 0.00 0.00 57.16 54.68 2hx6 n GLU 98 Cb 0.44 -1.86 -0.12 0.00 -0.57 0.00 0.00 31.44 29.33 2hx6 n GLU 98 CO 0.00 0.00 0.00 0.66 -0.48 0.00 0.00 177.13 177.31 2hx6 n TYR 99 N 0.65 0.31 -4.24 -0.32 4.01 -1.26 -4.82 117.16 111.49 2hx6 n TYR 99 Ca 0.20 0.09 -0.28 0.00 -0.16 0.00 0.00 57.90 57.75 2hx6 n TYR 99 Cb 0.79 -0.68 -0.09 0.00 -0.31 0.00 0.00 39.34 39.05 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 -3.39 2.18 0.23 -0.72 1.81 -1.22 -5.13 118.95 112.71 2hx6 s ARG 100 Ca -0.06 -1.11 -0.30 0.00 -1.72 0.00 0.00 55.73 52.54 2hx6 s ARG 100 Cb 0.12 -2.28 -0.09 0.00 -0.45 0.00 0.00 34.95 32.26 2hx6 s ARG 100 CO 0.87 0.47 1.09 -1.25 -0.68 0.00 0.00 175.30 175.80 2hx6 s PRO 101 N -2.57 4.64 0.00 3.54 0.04 -1.26 -4.88 135.00 134.50 2hx6 s PRO 101 Ca 0.24 1.74 -0.05 0.00 0.04 0.00 0.00 61.00 62.97 2hx6 s PRO 101 Cb -0.10 -3.24 -0.23 0.00 0.04 0.00 0.00 34.50 30.97 2hx6 s PRO 101 CO 0.15 0.18 3.37 0.41 0.04 0.00 0.00 177.00 181.15 2hx6 n GLY 102 N 1.60 2.89 3.03 0.56 0.00 -1.26 -4.79 105.19 107.21 2hx6 n GLY 102 Ca 0.01 -1.05 -0.09 0.00 0.00 0.00 0.00 46.02 44.89 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 0.94 0.40 -0.29 1.61 1.70 -1.26 -0.83 118.95 121.22 2hx6 s ARG 103 Ca 0.58 -0.67 -0.06 0.00 -0.47 0.00 0.00 55.73 55.11 2hx6 s ARG 103 Cb 0.28 0.15 0.02 0.00 -0.57 0.00 0.00 34.95 34.82 2hx6 s ARG 103 CO 0.00 -0.08 0.06 -0.51 -1.08 0.00 0.00 175.30 173.70 2hx6 s LEU 104 N -1.69 3.82 -0.23 -1.89 1.43 0.45 -4.97 118.68 115.60 2hx6 s LEU 104 Ca -0.12 -0.80 -0.00 0.00 -1.03 0.00 0.00 54.13 52.17 2hx6 s LEU 104 Cb -0.07 -1.84 0.06 0.00 0.03 0.00 0.00 46.19 44.37 2hx6 s LEU 104 CO -0.02 -0.20 -0.02 -0.70 0.23 0.00 0.00 176.35 175.64 2hx6 s GLU 105 N 1.46 1.26 0.00 1.70 2.56 -1.26 -1.27 118.70 123.15 2hx6 s GLU 105 Ca 0.01 -0.82 0.01 0.00 0.00 0.00 0.00 54.97 54.18 2hx6 s GLU 105 Cb -0.17 -2.42 -0.01 0.00 2.00 0.00 0.00 34.13 33.53 2hx6 s GLU 105 CO 0.01 -0.64 -0.05 0.96 -0.56 0.00 0.00 175.26 174.99 2hx6 s ILE 106 N 1.55 0.36 -0.20 -3.70 -5.25 -0.94 -5.06 121.20 107.95 2hx6 s ILE 106 Ca -0.03 -0.27 -0.00 0.00 -0.99 0.00 0.00 60.65 59.35 2hx6 s ILE 106 Cb -0.18 -0.32 0.02 0.00 2.95 0.00 0.00 42.46 44.93 2hx6 s ILE 106 CO -0.08 0.05 -0.15 -0.89 -1.79 0.00 0.00 174.94 172.09 2hx6 s THR 107 N -0.23 2.41 -0.03 8.37 2.01 -1.26 -1.99 115.64 124.92 2hx6 s THR 107 Ca 0.00 -0.93 -0.31 0.00 0.31 0.00 0.00 61.69 60.76 2hx6 s THR 107 Cb -0.03 -2.10 0.13 0.00 0.01 0.00 0.00 72.50 70.51 2hx6 s THR 107 CO -0.00 0.42 1.32 -1.81 -0.69 0.00 0.00 174.62 173.87 2hx6 s ASP 108 N 1.31 -0.04 0.00 3.53 1.11 -0.85 -1.94 116.67 119.79 2hx6 s ASP 108 Ca 0.03 -0.11 0.00 0.00 0.18 0.00 0.00 52.55 52.66 2hx6 s ASP 108 Cb -0.14 0.12 0.00 0.00 1.07 0.00 0.00 42.92 43.97 2hx6 s ASP 108 CO -0.09 -0.23 0.00 0.61 1.18 0.00 0.00 175.17 176.63 2hx6 n GLY 109 N -0.51 2.70 0.00 0.21 0.00 -1.26 -1.78 105.19 104.55 2hx6 n GLY 109 Ca -0.08 -0.26 0.00 0.00 0.00 0.00 0.00 46.02 45.68 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 0.72 0.00 -4.77 1.61 3.02 -1.26 -4.45 115.26 110.12 2hx6 n ASN 110 Ca 0.00 0.00 -0.39 0.00 -0.03 0.00 0.00 54.58 54.16 2hx6 n ASN 110 Cb 0.00 0.00 -0.06 0.00 -0.61 0.00 0.00 39.78 39.11 2hx6 n ASN 110 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2hx6 s LEU 111 N 0.00 4.49 -0.61 3.41 1.43 -0.73 -4.55 118.68 122.12 2hx6 s LEU 111 Ca 0.00 1.37 -0.21 0.00 -1.03 0.00 0.00 54.13 54.27 2hx6 s LEU 111 Cb 0.00 -3.09 0.08 0.00 0.03 0.00 0.00 46.19 43.22 2hx6 s LEU 111 CO 0.00 0.14 0.81 0.26 0.23 0.00 0.00 176.35 177.79 2hx6 s TRP 112 N -0.56 2.86 -0.20 0.29 0.52 0.60 -2.01 118.94 120.45 2hx6 s TRP 112 Ca 0.34 -0.73 -0.14 0.00 0.02 0.00 0.00 56.10 55.59 2hx6 s TRP 112 Cb -0.20 -4.09 -0.04 0.00 -1.15 0.00 0.00 33.47 27.98 2hx6 s TRP 112 CO 0.21 -1.42 0.31 -0.51 0.02 0.00 0.00 176.95 175.56 2hx6 s LEU 113 N 3.29 4.17 -0.13 2.99 2.01 -0.84 -2.16 118.68 128.01 2hx6 s LEU 113 Ca 0.17 0.42 0.01 0.00 0.01 0.00 0.00 54.13 54.74 2hx6 s LEU 113 Cb -0.20 -2.38 0.02 0.00 0.01 0.00 0.00 46.19 43.64 2hx6 s LEU 113 CO 0.09 0.01 -0.17 -0.83 1.01 0.00 0.00 176.35 176.46 2hx6 s GLY 114 N 0.86 1.15 -0.11 -3.19 0.00 0.42 -2.23 107.32 104.22 2hx6 s GLY 114 Ca 0.16 -0.88 0.03 0.00 0.00 0.00 0.00 44.72 44.02 2hx6 s GLY 114 CO 0.06 0.25 -0.19 -1.36 0.00 0.00 0.00 173.10 171.86 2hx6 s PHE 115 N 1.09 2.24 -0.11 1.90 0.08 -0.39 0.44 117.98 123.22 2hx6 s PHE 115 Ca -0.03 -1.01 0.03 0.00 0.12 0.00 0.00 56.93 56.04 2hx6 s PHE 115 Cb -0.14 -1.55 0.01 0.00 -0.57 0.00 0.00 43.02 40.76 2hx6 s PHE 115 CO -0.05 -0.46 -0.22 0.99 -0.10 0.00 0.00 175.22 175.38 2hx6 s THR 116 N 0.71 1.93 0.21 0.64 2.01 -0.62 -0.41 115.64 120.11 2hx6 s THR 116 Ca -0.11 -0.93 -0.30 0.00 0.31 0.00 0.00 61.69 60.66 2hx6 s THR 116 Cb -0.16 -1.70 -0.08 0.00 0.01 0.00 0.00 72.50 70.57 2hx6 s THR 116 CO 0.02 0.53 0.94 -0.69 -0.69 0.00 0.00 174.62 174.73 2hx6 s VAL 117 N 0.59 4.19 0.00 3.82 1.01 -0.01 -0.10 120.40 129.89 2hx6 s VAL 117 Ca -0.13 2.06 -0.17 0.00 0.00 0.00 0.00 61.98 63.74 2hx6 s VAL 117 Cb -0.17 -4.32 -0.21 0.00 0.00 0.00 0.00 36.38 31.68 2hx6 s VAL 117 CO 0.04 0.46 1.16 0.00 0.00 0.00 0.00 175.10 176.75 2hx6 n LYS 119 N 6.18 -0.01 -0.70 0.00 4.81 -1.26 -3.57 118.16 123.61 2hx6 n LYS 119 Ca 0.26 0.18 -0.21 0.00 -0.87 0.00 0.00 58.31 57.67 2hx6 n LYS 119 Cb 0.29 -0.30 -0.02 0.00 0.02 0.00 0.00 35.03 35.02 2hx6 n LYS 119 CO 0.00 0.00 0.00 -0.35 1.17 0.00 0.00 177.40 178.22 2hx6 n PRO 120 N -3.82 1.96 0.00 1.64 -0.04 -1.26 -4.79 135.00 128.70 2hx6 n PRO 120 Ca 0.03 -1.41 0.00 0.00 -0.04 0.00 0.00 63.50 62.08 2hx6 n PRO 120 Cb 0.10 -2.43 0.00 0.00 -0.04 0.00 0.00 33.50 31.13 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 4.30 0.00 -0.00 3.54 2.04 -1.23 -5.03 115.26 118.88 2hx6 n ASN 121 Ca 0.42 0.00 -0.00 0.00 -0.44 0.00 0.00 54.58 54.56 2hx6 n ASN 121 Cb 0.13 0.00 -0.00 0.00 -2.53 0.00 0.00 39.78 37.38 2hx6 n ASN 121 CO 0.00 0.00 0.00 -0.08 -0.44 0.00 0.00 177.26 176.74 2hx6 h GLU 122 N 0.00 0.00 0.00 -3.83 4.81 -1.87 -3.47 114.58 110.22 2hx6 h GLU 122 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 2hx6 h GLU 122 Cb 0.00 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.38 2hx6 h GLU 122 CO 0.00 0.00 0.00 1.63 -0.73 0.00 0.00 179.01 179.91 2hx6 n LYS 123 N -2.23 0.00 -0.60 1.92 4.01 -1.26 -4.66 118.16 115.34 2hx6 n LYS 123 Ca -0.00 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.80 2hx6 n LYS 123 Cb 0.01 -0.86 0.00 0.00 -0.51 0.00 0.00 35.03 33.66 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 -0.42 0.00 0.10 2.13 3.72 -1.26 -4.99 117.46 116.73 2hx6 n PHE 124 Ca 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.40 2hx6 n PHE 124 Cb 0.00 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.54 2hx6 n PHE 124 CO 0.00 0.00 0.00 0.36 -0.05 0.00 0.00 176.76 177.07 2hx6 n LYS 125 N 0.00 0.00 -2.93 -1.08 -0.00 -1.26 -3.17 118.16 109.72 2hx6 n LYS 125 Ca 0.00 0.00 -0.44 0.00 -0.00 0.00 0.00 58.31 57.87 2hx6 n LYS 125 Cb 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 35.03 35.02 2hx6 n LYS 125 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.40 177.56 2hx6 s ASP 126 N -2.00 6.84 0.66 -5.58 1.47 -1.26 -3.62 116.67 113.17 2hx6 s ASP 126 Ca 0.00 -2.49 -0.02 0.00 1.18 0.00 0.00 52.55 51.23 2hx6 s ASP 126 Cb 0.00 -2.40 0.10 0.00 -0.34 0.00 0.00 42.92 40.27 2hx6 s ASP 126 CO 0.00 -0.92 0.65 -2.65 0.68 0.00 0.00 175.17 172.93 2hx6 n PRO 127 N 6.18 0.03 -4.72 2.11 -0.02 -1.26 -4.87 135.00 132.45 2hx6 n PRO 127 Ca 0.30 -1.64 -0.33 0.00 -2.02 0.00 0.00 63.50 59.81 2hx6 n PRO 127 Cb 0.46 -0.48 -0.13 0.00 -0.02 0.00 0.00 33.50 33.34 2hx6 n PRO 127 CO 0.00 0.00 0.00 -1.12 1.98 0.00 0.00 175.50 176.36 2hx6 s SER 128 N -3.61 4.30 -0.10 2.55 0.01 -1.26 -2.25 113.70 113.33 2hx6 s SER 128 Ca 0.42 -0.17 -0.06 0.00 1.31 0.00 0.00 55.95 57.45 2hx6 s SER 128 Cb -0.02 -1.26 -0.04 0.00 0.21 0.00 0.00 66.02 64.91 2hx6 s SER 128 CO 0.28 0.28 0.13 -0.76 0.41 0.00 0.00 173.24 173.58 2hx6 s LEU 129 N -0.33 4.30 0.00 2.44 1.02 0.91 -0.17 118.68 126.85 2hx6 s LEU 129 Ca 0.04 0.42 0.23 0.00 0.02 0.00 0.00 54.13 54.84 2hx6 s LEU 129 Cb -0.13 -2.11 0.16 0.00 0.02 0.00 0.00 46.19 44.13 2hx6 s LEU 129 CO 0.02 0.39 1.23 0.00 0.02 0.00 0.00 176.35 178.01 2hx6 n GLN 130 N 1.86 2.16 0.00 1.70 10.64 0.85 -0.48 117.38 134.11 2hx6 n GLN 130 Ca -0.19 -1.80 0.00 0.00 -1.83 0.00 0.00 57.00 53.18 2hx6 n GLN 130 Cb 0.55 -1.46 0.00 0.00 -0.86 0.00 0.00 30.24 28.47 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 0.00 2.39 -0.24 0.00 6.06 0.03 -1.59 118.95 125.61 2hx6 s ARG 132 Ca 0.00 -1.29 -0.08 0.00 -2.50 0.00 0.00 55.73 51.86 2hx6 s ARG 132 Cb 0.00 -3.14 -0.04 0.00 0.06 0.00 0.00 34.95 31.84 2hx6 s ARG 132 CO 0.00 -0.62 0.09 1.41 -2.50 0.00 0.00 175.30 173.68 2hx6 s MET 133 N 1.22 3.80 -0.18 5.12 -2.45 0.17 -4.65 119.30 122.34 2hx6 s MET 133 Ca -0.06 -0.41 -0.01 0.00 -1.25 0.00 0.00 55.69 53.97 2hx6 s MET 133 Cb -0.20 -3.36 0.05 0.00 1.25 0.00 0.00 34.83 32.57 2hx6 s MET 133 CO -0.02 -0.06 -0.04 0.00 1.05 0.00 0.00 175.02 175.95 2hx6 s ALA 134 N 1.31 1.51 0.07 4.11 0.00 -1.26 -0.44 121.76 127.07 2hx6 s ALA 134 Ca 0.05 -0.91 -0.06 0.00 0.00 0.00 0.00 51.96 51.05 2hx6 s ALA 134 Cb -0.15 -1.18 -0.02 0.00 0.00 0.00 0.00 23.12 21.77 2hx6 s ALA 134 CO 0.04 -0.90 0.10 0.42 0.00 0.00 0.00 175.76 175.43 2hx6 s ILE 135 N 1.62 0.17 0.31 0.00 1.01 -0.92 -4.99 121.20 118.40 2hx6 s ILE 135 Ca -0.01 -1.42 0.07 0.00 0.00 0.00 0.00 60.65 59.29 2hx6 s ILE 135 Cb -0.16 -1.41 -0.03 0.00 0.01 0.00 0.00 42.46 40.87 2hx6 s ILE 135 CO -0.07 -0.79 0.27 -0.38 0.00 0.00 0.00 174.94 173.96 2hx6 n ILE 136 N 0.01 0.00 -3.77 2.92 -0.00 -1.26 -0.29 119.36 116.97 2hx6 n ILE 136 Ca -0.15 -2.26 -0.20 0.00 -0.00 0.00 0.00 62.75 60.14 2hx6 n ILE 136 Cb 0.62 1.13 -0.17 0.00 -0.00 0.00 0.00 39.64 41.22 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 -3.17 1.04 0.00 4.38 6.03 -1.26 -4.95 114.94 117.01 2hx6 s ASN 137 Ca 0.37 0.00 0.00 0.00 -1.03 0.00 0.00 52.86 52.20 2hx6 s ASN 137 Cb 0.02 -0.25 0.00 0.00 -3.03 0.00 0.00 41.25 37.99 2hx6 s ASN 137 CO 0.26 -0.19 0.00 -1.20 -2.03 0.00 0.00 177.10 173.94 2hx6 n SER 138 N 4.91 0.00 0.00 3.54 7.64 -1.26 -4.94 113.62 123.50 2hx6 n SER 138 Ca -0.11 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.77 2hx6 n SER 138 Cb 0.50 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.70 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 0.00 0.28 1.43 0.00 -1.26 -4.93 116.66 112.18 2hx6 n ARG 139 Ca 0.00 0.00 0.16 0.00 -0.00 0.00 0.00 57.85 58.01 2hx6 n ARG 139 Cb 0.00 0.00 0.92 0.00 -0.00 0.00 0.00 32.46 33.38 2hx6 n ARG 139 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 177.63 177.70 2hx6 h ARG 140 N 0.00 0.00 -3.05 2.89 0.11 -1.63 -3.38 114.38 109.33 2hx6 h ARG 140 Ca 0.00 0.00 0.24 0.00 0.10 0.00 0.00 59.98 60.32 2hx6 h ARG 140 Cb 0.00 0.00 -0.13 0.00 1.11 0.00 0.00 29.97 30.95 2hx6 h ARG 140 CO 0.00 0.00 -1.05 1.28 0.10 0.00 0.00 179.97 180.30 2hx6 n LEU 141 N -3.74 -1.00 0.26 0.08 4.32 -1.26 -4.82 117.00 110.84 2hx6 n LEU 141 Ca -0.02 2.16 0.16 0.00 -0.02 0.00 0.00 56.01 58.29 2hx6 n LEU 141 Cb 0.15 -2.59 0.56 0.00 -1.62 0.00 0.00 43.42 39.92 2hx6 n LEU 141 CO 0.26 -1.60 0.94 -0.65 -1.22 0.00 0.00 177.39 175.13 2hx6 h PRO 142 N -0.94 0.00 -6.75 3.23 0.11 -1.95 -3.48 132.00 122.22 2hx6 h PRO 142 Ca -0.14 0.00 -0.39 0.00 0.11 0.00 0.00 66.00 65.58 2hx6 h PRO 142 Cb 1.11 0.00 -0.07 0.00 0.11 0.00 0.00 31.00 32.15 2hx6 h PRO 142 CO 0.05 0.02 -0.63 0.41 -0.21 0.00 0.00 178.00 177.64 2hx6 n GLY 143 N 0.27 -0.31 2.91 -0.55 0.00 -1.26 -5.01 105.19 101.24 2hx6 n GLY 143 Ca 0.01 0.16 -0.13 0.00 0.00 0.00 0.00 46.02 46.07 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 -6.19 0.06 0.13 1.61 2.20 -1.26 -4.92 119.74 111.36 2hx6 s LYS 144 Ca 0.16 0.12 0.00 0.00 -0.36 0.00 0.00 55.97 55.89 2hx6 s LYS 144 Cb -0.09 -0.02 0.00 0.00 -1.51 0.00 0.00 37.83 36.21 2hx6 s LYS 144 CO 0.62 -0.04 0.00 0.00 -0.36 0.00 0.00 175.35 175.57 2hx6 n ALA 145 N 3.28 -0.82 -3.57 3.13 0.00 -1.26 -5.06 120.51 116.21 2hx6 n ALA 145 Ca -0.15 0.18 -0.19 0.00 0.00 0.00 0.00 53.44 53.28 2hx6 n ALA 145 Cb 0.58 -0.44 -0.16 0.00 0.00 0.00 0.00 19.45 19.43 2hx6 n ALA 145 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2hx6 s SER 146 N -4.39 0.74 0.00 0.00 0.15 -1.26 -4.51 113.70 104.42 2hx6 s SER 146 Ca 0.00 -0.09 0.00 0.00 0.70 0.00 0.00 55.95 56.56 2hx6 s SER 146 Cb 0.00 -0.34 0.00 0.00 -1.71 0.00 0.00 66.02 63.97 2hx6 s SER 146 CO 0.00 -0.05 0.00 1.17 1.20 0.00 0.00 173.24 175.56 2hx6 n LYS 147 N 3.95 0.00 0.00 5.44 4.81 -1.26 -4.89 118.16 126.21 2hx6 n LYS 147 Ca -0.25 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.19 2hx6 n LYS 147 Cb 0.51 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.56 2hx6 n LYS 147 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2hx6 n ALA 148 N 0.00 0.15 -0.74 3.14 0.00 -1.26 -4.71 120.51 117.09 2hx6 n ALA 148 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2hx6 n ALA 148 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 2hx6 n ALA 148 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2hx6 n VAL 149 N -0.76 0.00 -4.04 0.00 0.31 -1.16 -5.06 118.33 107.61 2hx6 n VAL 149 Ca 0.00 0.10 -0.35 0.00 -0.01 0.00 0.00 64.34 64.08 2hx6 n VAL 149 Cb 0.00 -1.01 -0.09 0.00 -0.91 0.00 0.00 33.84 31.83 2hx6 n VAL 149 CO 0.00 0.00 0.00 -0.51 -1.32 0.00 0.00 176.83 175.00 2hx6 s ILE 150 N -0.26 4.90 -0.32 2.52 -1.16 -0.82 -5.06 121.20 121.00 2hx6 s ILE 150 Ca 0.00 -0.01 -0.29 0.00 -0.51 0.00 0.00 60.65 59.84 2hx6 s ILE 150 Cb 0.00 -3.16 0.01 0.00 0.61 0.00 0.00 42.46 39.92 2hx6 s ILE 150 CO 0.00 0.53 1.20 -0.54 -2.81 0.00 0.00 174.94 173.32 2hx6 s LYS 151 N -0.27 3.96 0.35 3.50 -0.14 -1.26 -4.55 119.74 121.34 2hx6 s LYS 151 Ca 0.09 1.13 -0.26 0.00 -1.36 0.00 0.00 55.97 55.56 2hx6 s LYS 151 Cb -0.12 -3.82 -0.09 0.00 -1.68 0.00 0.00 37.83 32.12 2hx6 s LYS 151 CO 0.01 -1.05 1.05 -0.08 -0.76 0.00 0.00 175.35 174.53 2hx6 s THR 152 N 4.08 3.69 -0.60 2.17 -1.32 -1.26 -5.15 115.64 117.25 2hx6 s THR 152 Ca 0.51 1.43 0.05 0.00 -1.21 0.00 0.00 61.69 62.47 2hx6 s THR 152 Cb -0.14 -3.81 0.04 0.00 -1.51 0.00 0.00 72.50 67.08 2hx6 s THR 152 CO 0.21 0.14 0.65 1.67 -2.21 0.00 0.00 174.62 175.08