#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ig6 s ILE 17 N 0.00 4.89 0.00 1.39 -1.09 -0.31 -3.95 121.20 122.13 3ig6 s ILE 17 Ca 0.00 1.11 0.00 0.00 -2.23 0.00 0.00 60.65 59.53 3ig6 s ILE 17 Cb 0.00 -3.86 0.00 0.00 -1.58 0.00 0.00 42.46 37.02 3ig6 s ILE 17 CO 0.00 0.50 0.00 0.61 -1.23 0.00 0.00 174.94 174.82 3ig6 n GLY 18 N 2.09 0.14 0.99 6.18 0.00 -1.26 -2.10 105.19 111.24 3ig6 n GLY 18 Ca -0.10 -0.92 0.13 0.00 0.00 0.00 0.00 46.02 45.13 3ig6 n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ig6 n GLY 19 N 0.00 -1.71 3.25 -0.02 0.00 -1.26 -4.93 105.19 100.52 3ig6 n GLY 19 Ca 0.00 -1.28 -0.17 0.00 0.00 0.00 0.00 46.02 44.57 3ig6 n GLY 19 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3ig6 s GLU 20 N -1.86 1.06 0.45 1.61 8.01 0.12 -4.94 118.70 123.16 3ig6 s GLU 20 Ca 0.00 -1.31 -0.25 0.00 0.01 0.00 0.00 54.97 53.43 3ig6 s GLU 20 Cb 0.00 -0.89 -0.08 0.00 -4.31 0.00 0.00 34.13 28.85 3ig6 s GLU 20 CO 0.00 0.16 1.37 -0.06 0.01 0.00 0.00 175.26 176.74 3ig6 s PHE 21 N -2.39 2.55 0.27 1.61 2.99 -1.26 -1.13 117.98 120.62 3ig6 s PHE 21 Ca 0.11 1.33 0.03 0.00 0.00 0.00 0.00 56.93 58.41 3ig6 s PHE 21 Cb -0.03 -3.81 -0.04 0.00 0.00 0.00 0.00 43.02 39.14 3ig6 s PHE 21 CO 0.03 -2.64 0.20 -0.08 -0.00 0.00 0.00 175.22 172.74 3ig6 s THR 22 N -1.25 0.03 0.35 0.64 -1.32 -0.23 -4.83 115.64 109.03 3ig6 s THR 22 Ca 0.61 -2.00 0.09 0.00 -1.21 0.00 0.00 61.69 59.18 3ig6 s THR 22 Cb -0.41 -2.50 -0.06 0.00 -1.51 0.00 0.00 72.50 68.02 3ig6 s THR 22 CO 0.52 0.00 -0.04 0.42 -2.21 0.00 0.00 174.62 173.31 3ig6 s THR 23 N -3.77 2.31 0.32 5.08 -4.23 -1.26 -4.18 115.64 109.91 3ig6 s THR 23 Ca 0.40 -2.10 0.20 0.00 -1.18 0.00 0.00 61.69 59.01 3ig6 s THR 23 Cb 0.05 -2.75 0.18 0.00 1.34 0.00 0.00 72.50 71.32 3ig6 s THR 23 CO 0.20 -0.17 1.89 -0.29 -0.54 0.00 0.00 174.62 175.72 3ig6 h ILE 24 N 1.91 0.87 -0.96 2.99 6.09 -1.88 -0.89 117.51 125.63 3ig6 h ILE 24 Ca -0.42 -1.05 0.23 0.00 -1.37 0.00 0.00 64.86 62.24 3ig6 h ILE 24 Cb 1.25 1.63 -0.07 0.00 0.47 0.00 0.00 36.82 40.09 3ig6 h ILE 24 CO 0.71 0.26 0.63 -0.33 -3.07 0.00 0.00 178.15 176.36 3ig6 h GLU 25 N 0.00 0.37 0.00 2.19 3.07 -1.85 0.18 114.58 118.53 3ig6 h GLU 25 Ca -0.00 -0.02 0.00 0.00 -0.50 0.00 0.00 59.36 58.84 3ig6 h GLU 25 Cb 0.60 -0.08 0.00 0.00 -0.84 0.00 0.00 28.75 28.43 3ig6 h GLU 25 CO 0.03 0.24 -0.46 0.09 -1.40 0.00 0.00 179.01 177.52 3ig6 n ASN 26 N -4.53 0.61 -2.79 1.42 3.02 -0.35 -4.27 115.26 108.38 3ig6 n ASN 26 Ca 0.21 0.14 -0.14 0.00 -0.03 0.00 0.00 54.58 54.76 3ig6 n ASN 26 Cb 0.78 -0.00 0.01 0.00 -0.61 0.00 0.00 39.78 39.96 3ig6 n ASN 26 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3ig6 n GLN 27 N -1.95 1.42 0.00 3.52 1.13 0.48 -5.00 117.38 116.99 3ig6 n GLN 27 Ca 0.04 -3.48 0.05 0.00 -1.94 0.00 0.00 57.00 51.68 3ig6 n GLN 27 Cb 0.41 -1.51 0.25 0.00 0.11 0.00 0.00 30.24 29.50 3ig6 n GLN 27 CO 0.00 0.00 0.00 -0.35 -1.44 0.00 0.00 177.06 175.27 3ig6 n PRO 28 N -0.02 0.05 0.00 -1.09 -0.04 -0.32 -0.95 135.00 132.62 3ig6 n PRO 28 Ca 0.17 0.27 0.13 0.00 -0.04 0.00 0.00 63.50 64.03 3ig6 n PRO 28 Cb 0.74 -1.50 0.38 0.00 -0.04 0.00 0.00 33.50 33.08 3ig6 n PRO 28 CO 0.00 0.00 0.00 -2.67 -0.04 0.00 0.00 175.50 172.79 3ig6 n TRP 29 N -1.44 0.00 -2.29 0.54 2.14 -1.17 -1.38 117.44 113.84 3ig6 n TRP 29 Ca 0.03 0.00 -0.41 0.00 2.07 0.00 0.00 57.50 59.19 3ig6 n TRP 29 Cb 0.12 -0.18 -0.03 0.00 -0.81 0.00 0.00 31.31 30.41 3ig6 n TRP 29 CO 0.00 0.00 0.00 0.12 2.07 0.00 0.00 177.69 179.88 3ig6 s PHE 30 N -2.67 3.33 -0.07 -2.67 2.19 -0.13 -0.77 117.98 117.20 3ig6 s PHE 30 Ca 0.20 1.35 0.05 0.00 0.33 0.00 0.00 56.93 58.86 3ig6 s PHE 30 Cb 0.19 -3.52 -0.01 0.00 -1.31 0.00 0.00 43.02 38.37 3ig6 s PHE 30 CO 0.57 -1.51 -0.23 0.00 1.83 0.00 0.00 175.22 175.87 3ig6 s ALA 31 N -0.10 2.23 -0.25 11.12 0.00 0.08 -4.35 121.76 130.49 3ig6 s ALA 31 Ca 0.54 -1.02 -0.09 0.00 0.00 0.00 0.00 51.96 51.39 3ig6 s ALA 31 Cb -0.35 -0.76 -0.04 0.00 0.00 0.00 0.00 23.12 21.97 3ig6 s ALA 31 CO 0.39 0.39 0.12 0.00 0.00 0.00 0.00 175.76 176.65 3ig6 s ALA 32 N -0.06 3.37 -0.18 0.00 0.00 -0.21 -1.01 121.76 123.66 3ig6 s ALA 32 Ca -0.06 -1.04 -0.03 0.00 0.00 0.00 0.00 51.96 50.83 3ig6 s ALA 32 Cb -0.15 -2.22 -0.02 0.00 0.00 0.00 0.00 23.12 20.74 3ig6 s ALA 32 CO 0.05 -0.38 -0.05 0.42 0.00 0.00 0.00 175.76 175.79 3ig6 s ILE 33 N 1.43 3.49 0.30 0.00 1.01 -0.62 -0.23 121.20 126.58 3ig6 s ILE 33 Ca 0.06 -0.48 0.10 0.00 0.00 0.00 0.00 60.65 60.33 3ig6 s ILE 33 Cb -0.15 -2.55 -0.06 0.00 0.01 0.00 0.00 42.46 39.72 3ig6 s ILE 33 CO 0.06 0.46 -0.13 -0.31 0.00 0.00 0.00 174.94 175.02 3ig6 s TYR 34 N 0.94 2.23 -0.10 3.97 2.02 0.24 -0.15 117.35 126.50 3ig6 s TYR 34 Ca -0.01 -0.49 -0.00 0.00 -0.37 0.00 0.00 57.07 56.21 3ig6 s TYR 34 Cb -0.15 -1.16 -0.03 0.00 -0.40 0.00 0.00 41.96 40.23 3ig6 s TYR 34 CO 0.01 0.56 -0.07 0.50 -1.57 0.00 0.00 175.55 174.97 3ig6 s ARG 35 N -3.60 3.06 0.43 -0.62 3.52 0.54 -1.20 118.95 121.08 3ig6 s ARG 35 Ca 0.30 -0.57 -0.13 0.00 -0.13 0.00 0.00 55.73 55.21 3ig6 s ARG 35 Cb 0.00 -2.67 -0.07 0.00 -1.56 0.00 0.00 34.95 30.65 3ig6 s ARG 35 CO 0.14 0.49 0.83 1.03 -0.81 0.00 0.00 175.30 176.98 3ig6 s ARG 36 N -0.35 3.85 0.01 5.12 0.52 0.17 -1.50 118.95 126.77 3ig6 s ARG 36 Ca 0.05 0.62 0.00 0.00 -0.52 0.00 0.00 55.73 55.89 3ig6 s ARG 36 Cb -0.12 -2.32 -0.01 0.00 0.52 0.00 0.00 34.95 33.01 3ig6 s ARG 36 CO 0.02 -0.08 -0.02 -1.01 0.02 0.00 0.00 175.30 174.24 3ig6 s HIS 37 N -2.40 0.15 -0.00 -0.53 3.76 -0.34 -4.93 115.29 111.00 3ig6 s HIS 37 Ca 0.54 -0.20 -0.00 0.00 -0.15 0.00 0.00 55.06 55.24 3ig6 s HIS 37 Cb -0.10 -0.10 -0.00 0.00 1.11 0.00 0.00 32.58 33.48 3ig6 s HIS 37 CO 0.30 -0.07 0.61 2.89 -0.85 0.00 0.00 174.74 177.62 3ig6 n ARG 37 N 2.51 0.00 0.00 1.40 1.85 -1.26 -3.44 116.66 117.72 3ig6 n ARG 37 Ca -0.16 -0.01 0.01 0.00 -1.00 0.00 0.00 57.85 56.68 3ig6 n ARG 37 Cb 0.58 -1.02 0.03 0.00 -1.05 0.00 0.00 32.46 31.01 3ig6 n ARG 37 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 3ig6 n GLY 37 N 3.70 -0.42 3.82 2.89 0.00 -1.26 -5.07 105.19 108.85 3ig6 n GLY 37 Ca 0.00 -0.01 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 3ig6 n GLY 37 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3ig6 s SER 37 N -2.74 6.45 0.16 1.61 1.04 -1.22 -5.08 113.70 113.92 3ig6 s SER 37 Ca 0.01 1.72 0.03 0.00 0.48 0.00 0.00 55.95 58.19 3ig6 s SER 37 Cb 0.01 -2.53 -0.05 0.00 0.10 0.00 0.00 66.02 63.55 3ig6 s SER 37 CO 0.02 -0.71 -0.06 0.68 0.98 0.00 0.00 173.24 174.16 3ig6 s VAL 38 N -2.37 0.99 -0.03 5.02 -7.23 -1.26 -1.19 120.40 114.33 3ig6 s VAL 38 Ca 0.62 -2.02 0.04 0.00 -1.81 0.00 0.00 61.98 58.81 3ig6 s VAL 38 Cb -0.12 -1.98 -0.01 0.00 0.56 0.00 0.00 36.38 34.83 3ig6 s VAL 38 CO 0.26 -0.63 -0.15 0.42 -0.31 0.00 0.00 175.10 174.70 3ig6 s THR 39 N -3.45 1.23 0.42 5.32 -4.23 -0.56 -4.96 115.64 109.41 3ig6 s THR 39 Ca 0.20 -0.63 -0.26 0.00 -1.18 0.00 0.00 61.69 59.82 3ig6 s THR 39 Cb 0.04 -1.04 -0.09 0.00 1.34 0.00 0.00 72.50 72.75 3ig6 s THR 39 CO 0.02 0.35 1.37 -0.47 -0.54 0.00 0.00 174.62 175.35 3ig6 s TYR 40 N -0.13 2.66 -0.02 3.99 5.04 -1.26 -0.34 117.35 127.29 3ig6 s TYR 40 Ca 0.01 1.33 -0.03 0.00 -2.44 0.00 0.00 57.07 55.94 3ig6 s TYR 40 Cb -0.08 -3.80 -0.01 0.00 0.35 0.00 0.00 41.96 38.41 3ig6 s TYR 40 CO 0.01 -2.50 -0.07 0.28 -1.34 0.00 0.00 175.55 171.93 3ig6 n VAL 41 N 0.04 0.44 -3.84 3.14 0.31 0.78 -4.78 118.33 114.43 3ig6 n VAL 41 Ca 0.04 0.28 -0.06 0.00 -0.01 0.00 0.00 64.34 64.59 3ig6 n VAL 41 Cb 0.42 -1.53 -0.01 0.00 -0.91 0.00 0.00 33.84 31.81 3ig6 n VAL 41 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3ig6 s GLY 43 N -2.95 1.76 0.22 0.00 0.00 -0.53 -1.58 107.32 104.24 3ig6 s GLY 43 Ca 0.12 -1.44 -0.21 0.00 0.00 0.00 0.00 44.72 43.19 3ig6 s GLY 43 CO 0.07 -0.93 0.96 -0.32 0.00 0.00 0.00 173.10 172.87 3ig6 s GLY 44 N -4.65 0.08 -0.01 0.20 0.00 -0.18 -3.55 107.32 99.21 3ig6 s GLY 44 Ca 0.64 -0.32 0.01 0.00 0.00 0.00 0.00 44.72 45.05 3ig6 s GLY 44 CO 0.44 1.20 -0.03 -0.56 0.00 0.00 0.00 173.10 174.16 3ig6 s SER 45 N -3.21 0.46 -0.34 1.64 0.01 -0.19 -0.74 113.70 111.32 3ig6 s SER 45 Ca 0.18 -0.06 -0.29 0.00 1.31 0.00 0.00 55.95 57.09 3ig6 s SER 45 Cb -0.03 -0.12 0.02 0.00 0.21 0.00 0.00 66.02 66.10 3ig6 s SER 45 CO 0.06 0.00 1.10 -0.22 0.41 0.00 0.00 173.24 174.59 3ig6 s LEU 46 N 0.27 3.88 -0.01 2.44 2.96 0.05 -0.73 118.68 127.55 3ig6 s LEU 46 Ca -0.03 0.97 0.15 0.00 -0.22 0.00 0.00 54.13 55.00 3ig6 s LEU 46 Cb -0.06 -3.54 -0.19 0.00 0.50 0.00 0.00 46.19 42.90 3ig6 s LEU 46 CO -0.01 -0.96 0.48 2.30 -1.32 0.00 0.00 176.35 176.84 3ig6 n ILE 47 N 6.06 0.00 -3.82 6.68 -5.35 -0.56 -1.65 119.36 120.72 3ig6 n ILE 47 Ca 0.12 -0.25 -0.09 0.00 -0.27 0.00 0.00 62.75 62.27 3ig6 n ILE 47 Cb 0.47 0.60 -0.04 0.00 -1.74 0.00 0.00 39.64 38.93 3ig6 n ILE 47 CO 0.00 0.00 0.00 -0.94 -1.76 0.00 0.00 176.55 173.85 3ig6 s SER 48 N -3.02 -0.23 0.43 7.28 1.04 -1.16 -4.77 113.70 113.28 3ig6 s SER 48 Ca 0.00 -0.60 0.21 0.00 0.48 0.00 0.00 55.95 56.04 3ig6 s SER 48 Cb 0.10 0.62 1.17 0.00 0.10 0.00 0.00 66.02 68.01 3ig6 s SER 48 CO 0.61 -1.14 1.82 -0.65 0.98 0.00 0.00 173.24 174.86 3ig6 h PRO 49 N 2.16 0.32 -0.03 4.02 0.11 -1.95 -2.19 132.00 134.44 3ig6 h PRO 49 Ca -0.26 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.83 3ig6 h PRO 49 Cb 1.26 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.30 3ig6 h PRO 49 CO 0.33 0.21 0.00 0.00 -0.21 0.00 0.00 178.00 178.33 3ig6 s TRP 51 N -1.19 1.47 -0.08 0.00 0.52 -0.82 -1.13 118.94 117.70 3ig6 s TRP 51 Ca 0.17 -0.58 0.01 0.00 0.02 0.00 0.00 56.10 55.72 3ig6 s TRP 51 Cb 0.12 -1.11 -0.03 0.00 -1.15 0.00 0.00 33.47 31.31 3ig6 s TRP 51 CO 0.18 -0.33 -0.10 0.08 0.02 0.00 0.00 176.95 176.81 3ig6 s VAL 52 N 0.88 3.44 -0.06 4.03 1.01 -0.15 -1.50 120.40 128.05 3ig6 s VAL 52 Ca -0.11 -0.56 0.01 0.00 0.00 0.00 0.00 61.98 61.32 3ig6 s VAL 52 Cb -0.15 -2.41 -0.03 0.00 0.00 0.00 0.00 36.38 33.79 3ig6 s VAL 52 CO 0.01 0.58 -0.08 -0.51 0.00 0.00 0.00 175.10 175.10 3ig6 s ILE 53 N -0.50 3.61 0.00 2.22 2.07 0.10 -0.27 121.20 128.42 3ig6 s ILE 53 Ca 0.07 -0.54 0.00 0.00 -1.41 0.00 0.00 60.65 58.77 3ig6 s ILE 53 Cb -0.12 -2.47 0.00 0.00 0.13 0.00 0.00 42.46 40.00 3ig6 s ILE 53 CO 0.02 0.58 0.00 -0.24 -1.91 0.00 0.00 174.94 173.39 3ig6 n SER 54 N 2.18 0.00 -4.40 4.50 2.88 -0.17 -1.02 113.62 117.59 3ig6 n SER 54 Ca -0.18 0.00 -0.32 0.00 -1.33 0.00 0.00 58.87 57.04 3ig6 n SER 54 Cb 0.53 0.00 -0.14 0.00 -0.75 0.00 0.00 64.21 63.85 3ig6 n SER 54 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3ig6 s ALA 55 N -1.52 2.53 0.35 -1.46 0.00 -1.26 -1.16 121.76 119.25 3ig6 s ALA 55 Ca 0.00 -0.98 0.03 0.00 0.00 0.00 0.00 51.96 51.02 3ig6 s ALA 55 Cb 0.00 -0.95 0.65 0.00 0.00 0.00 0.00 23.12 22.82 3ig6 s ALA 55 CO 0.00 0.45 1.96 1.15 0.00 0.00 0.00 175.76 179.33 3ig6 h THR 56 N 4.75 1.17 0.00 0.00 2.02 -1.74 -2.67 112.91 116.43 3ig6 h THR 56 Ca -0.38 -0.47 0.00 0.00 0.77 0.00 0.00 66.41 66.33 3ig6 h THR 56 Cb 1.17 0.54 0.00 0.00 -1.74 0.00 0.00 68.15 68.12 3ig6 h THR 56 CO 0.51 0.19 0.00 0.00 0.37 0.00 0.00 175.52 176.59 3ig6 n HIS 57 N -4.38 0.59 0.30 3.16 1.44 -1.26 -0.94 115.22 114.14 3ig6 n HIS 57 Ca 0.04 0.26 0.16 0.00 -2.01 0.00 0.00 57.72 56.17 3ig6 n HIS 57 Cb 0.12 -0.92 0.61 0.00 0.12 0.00 0.00 29.99 29.93 3ig6 n HIS 57 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 3ig6 n PHE 59 N -2.93 0.00 0.26 0.00 3.72 -0.11 -4.83 117.46 113.58 3ig6 n PHE 59 Ca 0.01 0.00 0.09 0.00 -0.05 0.00 0.00 57.45 57.50 3ig6 n PHE 59 Cb 0.31 0.00 0.67 0.00 -0.94 0.00 0.00 39.48 39.52 3ig6 n PHE 59 CO 0.00 0.00 0.00 0.97 -0.05 0.00 0.00 176.76 177.68 3ig6 h ILE 60 N 0.00 0.94 0.00 4.37 6.09 -1.54 0.16 117.51 127.53 3ig6 h ILE 60 Ca 0.00 -0.05 -0.13 0.00 -1.37 0.00 0.00 64.86 63.31 3ig6 h ILE 60 Cb 0.00 1.03 -0.02 0.00 0.47 0.00 0.00 36.82 38.30 3ig6 h ILE 60 CO 0.00 0.01 -0.62 0.44 -3.07 0.00 0.00 178.15 174.91 3ig6 h ASP 60 N 0.00 0.00 -2.23 2.19 3.32 -1.88 -3.38 116.42 114.44 3ig6 h ASP 60 Ca -0.00 0.00 -0.58 0.00 0.02 0.00 0.00 57.03 56.47 3ig6 h ASP 60 Cb 0.02 0.00 -0.39 0.00 0.22 0.00 0.00 39.33 39.18 3ig6 h ASP 60 CO 0.00 0.62 -0.99 -1.22 -1.72 0.00 0.00 179.24 175.94 3ig6 n TYR 60 N -3.27 -0.10 1.55 4.55 4.02 -0.03 -5.00 117.16 118.89 3ig6 n TYR 60 Ca 0.01 -3.54 0.03 0.00 -0.01 0.00 0.00 57.90 54.39 3ig6 n TYR 60 Cb 0.78 -0.13 0.17 0.00 -0.02 0.00 0.00 39.34 40.14 3ig6 n TYR 60 CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 176.86 175.50 3ig6 n PRO 60 N 2.00 0.78 -2.68 -0.72 -0.04 -0.73 -4.81 135.00 128.79 3ig6 n PRO 60 Ca 0.25 0.00 -0.43 0.00 -0.04 0.00 0.00 63.50 63.28 3ig6 n PRO 60 Cb 0.49 -1.11 -0.02 0.00 -0.04 0.00 0.00 33.50 32.81 3ig6 n PRO 60 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 3ig6 s LYS 61 N -2.00 3.97 0.59 0.54 1.02 -1.26 -4.90 119.74 117.69 3ig6 s LYS 61 Ca 0.09 0.88 0.30 0.00 0.02 0.00 0.00 55.97 57.26 3ig6 s LYS 61 Cb 0.04 -3.77 1.82 0.00 -0.52 0.00 0.00 37.83 35.40 3ig6 s LYS 61 CO 0.07 -0.96 2.24 1.57 -0.92 0.00 0.00 175.35 177.35 3ig6 h LYS 62 N 8.32 0.00 0.00 1.68 2.10 -1.89 -2.46 116.57 124.32 3ig6 h LYS 62 Ca -0.21 0.00 -0.00 0.00 -2.00 0.00 0.00 60.65 58.43 3ig6 h LYS 62 Cb 1.07 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 32.40 3ig6 h LYS 62 CO 1.03 0.01 -0.02 0.93 -2.00 0.00 0.00 179.45 179.40 3ig6 h GLU 62 N 0.00 0.00 -0.00 0.07 3.07 -1.91 -2.96 114.58 112.85 3ig6 h GLU 62 Ca -0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 3ig6 h GLU 62 Cb 0.04 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.95 3ig6 h GLU 62 CO 0.00 0.02 -0.20 -0.25 -1.40 0.00 0.00 179.01 177.17 3ig6 n ASP 63 N -3.14 0.39 -4.64 1.42 10.43 -0.92 -4.91 116.55 115.17 3ig6 n ASP 63 Ca -0.01 -0.21 -0.31 0.00 2.57 0.00 0.00 54.79 56.83 3ig6 n ASP 63 Cb 0.23 -0.08 -0.09 0.00 1.84 0.00 0.00 41.12 43.02 3ig6 n ASP 63 CO 0.00 0.00 0.00 -0.31 -1.07 0.00 0.00 177.20 175.82 3ig6 s TYR 64 N -2.77 2.94 0.08 1.24 1.51 -1.12 0.44 117.35 119.67 3ig6 s TYR 64 Ca 0.19 -0.03 0.06 0.00 -1.01 0.00 0.00 57.07 56.29 3ig6 s TYR 64 Cb 0.19 -1.58 -0.03 0.00 -0.11 0.00 0.00 41.96 40.43 3ig6 s TYR 64 CO 0.56 0.43 -0.17 0.96 -1.11 0.00 0.00 175.55 176.22 3ig6 s ILE 65 N -1.14 1.35 -0.08 2.71 -4.36 -0.34 -3.98 121.20 115.36 3ig6 s ILE 65 Ca 0.21 -1.38 0.04 0.00 -0.26 0.00 0.00 60.65 59.26 3ig6 s ILE 65 Cb -0.11 -1.26 0.00 0.00 1.25 0.00 0.00 42.46 42.34 3ig6 s ILE 65 CO 0.12 -0.15 -0.21 -0.69 0.24 0.00 0.00 174.94 174.26 3ig6 s VAL 66 N -1.21 1.80 -0.11 8.37 1.01 -0.04 -0.59 120.40 129.63 3ig6 s VAL 66 Ca 0.01 -0.88 -0.04 0.00 0.00 0.00 0.00 61.98 61.07 3ig6 s VAL 66 Cb -0.10 -1.56 -0.04 0.00 0.00 0.00 0.00 36.38 34.69 3ig6 s VAL 66 CO 0.03 0.50 0.03 -0.31 0.00 0.00 0.00 175.10 175.36 3ig6 s TYR 67 N 0.29 3.24 0.20 5.22 2.02 0.67 0.67 117.35 129.67 3ig6 s TYR 67 Ca -0.14 0.20 0.10 0.00 -0.37 0.00 0.00 57.07 56.85 3ig6 s TYR 67 Cb -0.16 -1.87 -0.04 0.00 -0.40 0.00 0.00 41.96 39.48 3ig6 s TYR 67 CO 0.06 0.43 -0.11 -0.51 -1.57 0.00 0.00 175.55 173.86 3ig6 s LEU 68 N -0.61 2.91 -1.04 -1.29 1.43 0.30 -1.05 118.68 119.33 3ig6 s LEU 68 Ca 0.11 -0.66 0.00 0.00 -1.03 0.00 0.00 54.13 52.55 3ig6 s LEU 68 Cb -0.12 -1.56 0.00 0.00 0.03 0.00 0.00 46.19 44.54 3ig6 s LEU 68 CO 0.02 0.09 0.00 0.61 0.23 0.00 0.00 176.35 177.30 3ig6 n GLY 69 N -0.12 0.37 3.43 -3.19 0.00 -1.24 -0.06 105.19 104.38 3ig6 n GLY 69 Ca -0.10 -0.45 -0.35 0.00 0.00 0.00 0.00 46.02 45.12 3ig6 n GLY 69 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3ig6 s ARG 70 N -4.00 3.59 -0.01 1.61 3.52 -1.26 -3.72 118.95 118.68 3ig6 s ARG 70 Ca 0.00 -0.53 0.22 0.00 -0.13 0.00 0.00 55.73 55.29 3ig6 s ARG 70 Cb 0.00 -3.11 -0.29 0.00 -1.56 0.00 0.00 34.95 29.99 3ig6 s ARG 70 CO 0.00 -0.05 0.60 0.43 -0.81 0.00 0.00 175.30 175.47 3ig6 n SER 71 N 4.44 0.23 -4.14 -2.12 7.64 -1.26 -4.66 113.62 113.74 3ig6 n SER 71 Ca -0.17 -0.16 -0.18 0.00 1.01 0.00 0.00 58.87 59.37 3ig6 n SER 71 Cb 0.52 1.71 -0.12 0.00 -1.01 0.00 0.00 64.21 65.30 3ig6 n SER 71 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 3ig6 s ARG 72 N -3.41 0.83 0.04 1.43 0.52 -1.26 -1.02 118.95 116.06 3ig6 s ARG 72 Ca -0.05 -0.84 -0.18 0.00 -0.52 0.00 0.00 55.73 54.15 3ig6 s ARG 72 Cb 0.14 -0.81 -0.19 0.00 0.52 0.00 0.00 34.95 34.61 3ig6 s ARG 72 CO 0.89 0.19 1.20 1.25 0.02 0.00 0.00 175.30 178.85 3ig6 h LEU 73 N 4.60 0.62 -2.76 2.53 5.85 -0.81 -3.36 115.31 121.97 3ig6 h LEU 73 Ca -0.39 -0.67 0.00 0.00 0.84 0.00 0.00 57.88 57.66 3ig6 h LEU 73 Cb 1.19 -0.19 0.00 0.00 0.37 0.00 0.00 40.66 42.03 3ig6 h LEU 73 CO 0.42 1.20 -0.08 0.59 -0.34 0.00 0.00 178.44 180.23 3ig6 n ASN 74 N -4.20 1.83 -4.17 1.25 5.03 -1.26 -5.03 115.26 108.70 3ig6 n ASN 74 Ca -0.09 -2.66 -0.12 0.00 0.87 0.00 0.00 54.58 52.58 3ig6 n ASN 74 Cb 0.63 -0.31 -0.10 0.00 -1.02 0.00 0.00 39.78 38.99 3ig6 n ASN 74 CO 0.00 0.00 0.00 -0.94 -1.83 0.00 0.00 177.26 174.49 3ig6 s SER 75 N -2.16 0.21 0.32 6.41 1.04 -1.26 -5.16 113.70 113.10 3ig6 s SER 75 Ca 0.20 -1.40 -0.16 0.00 0.48 0.00 0.00 55.95 55.07 3ig6 s SER 75 Cb 0.18 0.38 -0.09 0.00 0.10 0.00 0.00 66.02 66.59 3ig6 s SER 75 CO 0.02 -0.85 0.75 0.20 0.98 0.00 0.00 173.24 174.35 3ig6 s ASN 76 N -3.17 6.83 -0.06 7.02 0.02 -1.26 -4.51 114.94 119.81 3ig6 s ASN 76 Ca 0.39 1.33 0.05 0.00 -1.02 0.00 0.00 52.86 53.61 3ig6 s ASN 76 Cb 0.07 -2.39 -0.02 0.00 0.02 0.00 0.00 41.25 38.93 3ig6 s ASN 76 CO 0.13 -0.18 -0.21 -0.89 0.02 0.00 0.00 177.10 175.96 3ig6 s THR 77 N -1.94 2.44 0.06 1.60 2.01 -1.26 -4.92 115.64 113.64 3ig6 s THR 77 Ca 0.53 -0.93 -0.33 0.00 0.31 0.00 0.00 61.69 61.27 3ig6 s THR 77 Cb -0.11 -1.92 -0.12 0.00 0.01 0.00 0.00 72.50 70.36 3ig6 s THR 77 CO 0.18 0.57 1.78 0.00 -0.69 0.00 0.00 174.62 176.46 3ig6 n GLN 78 N 2.78 2.40 -0.18 4.92 3.00 -1.26 -1.92 117.38 127.11 3ig6 n GLN 78 Ca -0.17 0.87 0.00 0.00 -0.01 0.00 0.00 57.00 57.69 3ig6 n GLN 78 Cb 0.52 -2.72 0.00 0.00 0.00 0.00 0.00 30.24 28.04 3ig6 n GLN 78 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 3ig6 n GLY 79 N 4.05 0.67 3.75 1.08 0.00 -1.26 -5.02 105.19 108.46 3ig6 n GLY 79 Ca 0.19 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.87 3ig6 n GLY 79 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3ig6 s GLU 80 N -0.74 2.78 -0.05 1.61 -1.05 -0.81 -4.77 118.70 115.66 3ig6 s GLU 80 Ca 0.00 1.65 0.04 0.00 -0.15 0.00 0.00 54.97 56.51 3ig6 s GLU 80 Cb 0.00 -1.92 -0.00 0.00 -0.44 0.00 0.00 34.13 31.76 3ig6 s GLU 80 CO 0.00 -1.32 -0.18 -1.64 0.95 0.00 0.00 175.26 173.07 3ig6 s MET 81 N -3.69 1.91 -0.12 -4.83 -1.94 0.91 -4.98 119.30 106.57 3ig6 s MET 81 Ca 0.73 -0.64 -0.04 0.00 -1.71 0.00 0.00 55.69 54.02 3ig6 s MET 81 Cb -0.26 -1.64 -0.04 0.00 2.01 0.00 0.00 34.83 34.90 3ig6 s MET 81 CO 0.37 0.24 0.05 0.21 -0.01 0.00 0.00 175.02 175.89 3ig6 s LYS 82 N 0.06 3.32 0.09 2.03 2.20 -1.26 -0.54 119.74 125.64 3ig6 s LYS 82 Ca -0.05 -0.31 0.05 0.00 -0.36 0.00 0.00 55.97 55.29 3ig6 s LYS 82 Cb -0.12 -2.99 -0.03 0.00 -1.51 0.00 0.00 37.83 33.17 3ig6 s LYS 82 CO 0.03 0.64 -0.12 -0.06 -0.36 0.00 0.00 175.35 175.47 3ig6 s PHE 83 N -0.67 1.18 0.45 4.03 0.08 0.21 -4.38 117.98 118.87 3ig6 s PHE 83 Ca 0.12 -0.57 0.04 0.00 0.12 0.00 0.00 56.93 56.63 3ig6 s PHE 83 Cb -0.12 -0.64 0.01 0.00 -0.57 0.00 0.00 43.02 41.70 3ig6 s PHE 83 CO 0.02 0.05 0.64 -1.21 -0.10 0.00 0.00 175.22 174.62 3ig6 s GLU 84 N -2.42 2.87 -0.35 0.44 0.41 0.11 -0.86 118.70 118.90 3ig6 s GLU 84 Ca 0.04 -0.84 -0.11 0.00 -0.41 0.00 0.00 54.97 53.65 3ig6 s GLU 84 Cb -0.06 -2.64 0.02 0.00 -1.78 0.00 0.00 34.13 29.67 3ig6 s GLU 84 CO 0.01 -0.33 0.19 0.08 -0.49 0.00 0.00 175.26 174.72 3ig6 s VAL 85 N -2.49 4.59 0.12 2.63 1.01 -1.26 -1.33 120.40 123.67 3ig6 s VAL 85 Ca 0.52 -0.72 -0.02 0.00 0.00 0.00 0.00 61.98 61.76 3ig6 s VAL 85 Cb -0.10 -3.49 -0.22 0.00 0.00 0.00 0.00 36.38 32.57 3ig6 s VAL 85 CO 0.36 -0.14 1.26 -0.33 0.00 0.00 0.00 175.10 176.24 3ig6 h GLU 86 N 8.41 0.27 -2.80 2.72 5.08 -0.53 -3.43 114.58 124.30 3ig6 h GLU 86 Ca -0.28 -0.36 -0.19 0.00 -1.00 0.00 0.00 59.36 57.54 3ig6 h GLU 86 Cb 1.12 0.12 -0.31 0.00 0.50 0.00 0.00 28.75 30.18 3ig6 h GLU 86 CO 0.65 1.11 -0.48 1.21 -1.00 0.00 0.00 179.01 180.49 3ig6 s ASN 87 N -7.04 0.12 -0.38 1.42 3.04 -1.21 -4.97 114.94 105.92 3ig6 s ASN 87 Ca -0.04 0.68 -0.12 0.00 0.04 0.00 0.00 52.86 53.42 3ig6 s ASN 87 Cb 0.08 0.79 0.02 0.00 -1.54 0.00 0.00 41.25 40.60 3ig6 s ASN 87 CO 0.86 -0.23 0.23 -0.22 -3.04 0.00 0.00 177.10 174.71 3ig6 s LEU 88 N 2.26 4.75 -0.34 3.21 2.96 -1.26 -1.03 118.68 129.23 3ig6 s LEU 88 Ca -0.01 -0.86 -0.07 0.00 -0.22 0.00 0.00 54.13 52.96 3ig6 s LEU 88 Cb -0.12 -2.07 0.03 0.00 0.50 0.00 0.00 46.19 44.53 3ig6 s LEU 88 CO -0.10 -0.37 0.12 -0.63 -1.32 0.00 0.00 176.35 174.05 3ig6 s ILE 89 N 1.61 3.94 0.11 6.68 1.01 0.37 -4.99 121.20 129.94 3ig6 s ILE 89 Ca 0.04 -1.02 0.00 0.00 0.00 0.00 0.00 60.65 59.67 3ig6 s ILE 89 Cb -0.19 -3.20 -0.04 0.00 0.01 0.00 0.00 42.46 39.04 3ig6 s ILE 89 CO 0.08 -0.15 0.27 -0.76 0.00 0.00 0.00 174.94 174.38 3ig6 s LEU 90 N 1.44 4.33 0.09 2.97 1.43 -1.26 -0.79 118.68 126.88 3ig6 s LEU 90 Ca -0.00 0.29 -0.31 0.00 -1.03 0.00 0.00 54.13 53.08 3ig6 s LEU 90 Cb -0.19 -3.01 -0.07 0.00 0.03 0.00 0.00 46.19 42.95 3ig6 s LEU 90 CO 0.03 0.10 1.40 -2.28 0.23 0.00 0.00 176.35 175.83 3ig6 s HIS 91 N -1.63 3.12 0.37 0.29 5.65 -1.16 -4.88 115.29 117.05 3ig6 s HIS 91 Ca 0.36 0.90 0.25 0.00 0.25 0.00 0.00 55.06 56.81 3ig6 s HIS 91 Cb -0.12 -3.69 1.27 0.00 -1.18 0.00 0.00 32.58 28.87 3ig6 s HIS 91 CO 0.28 -2.45 2.01 1.57 -0.65 0.00 0.00 174.74 175.50 3ig6 h LYS 92 N 7.11 0.00 -0.66 2.88 -0.00 -1.93 -2.00 116.57 121.97 3ig6 h LYS 92 Ca -0.41 0.00 -0.09 0.00 -0.00 0.00 0.00 60.65 60.15 3ig6 h LYS 92 Cb 1.20 0.00 -0.05 0.00 -0.00 0.00 0.00 32.23 33.38 3ig6 h LYS 92 CO 0.87 0.16 0.12 -0.25 -0.00 0.00 0.00 179.45 180.36 3ig6 n ASP 93 N -3.70 5.39 -4.77 7.07 8.00 -1.26 -4.96 116.55 122.32 3ig6 n ASP 93 Ca -0.02 -3.05 -0.41 0.00 0.71 0.00 0.00 54.79 52.03 3ig6 n ASP 93 Cb 0.28 -0.71 -0.01 0.00 -0.02 0.00 0.00 41.12 40.66 3ig6 n ASP 93 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 3ig6 s TYR 94 N -2.85 2.79 0.26 1.24 5.04 -0.76 -4.62 117.35 118.45 3ig6 s TYR 94 Ca 0.55 1.28 -0.18 0.00 -2.44 0.00 0.00 57.07 56.27 3ig6 s TYR 94 Cb 0.43 -3.87 0.02 0.00 0.35 0.00 0.00 41.96 38.88 3ig6 s TYR 94 CO 0.15 -2.50 0.63 -1.54 -1.34 0.00 0.00 175.55 170.96 3ig6 s SER 95 N -0.29 -0.22 -0.02 4.32 1.04 -1.09 -4.99 113.70 112.45 3ig6 s SER 95 Ca 0.51 -0.67 0.00 0.00 0.48 0.00 0.00 55.95 56.27 3ig6 s SER 95 Cb -0.44 0.67 0.02 0.00 0.10 0.00 0.00 66.02 66.38 3ig6 s SER 95 CO 0.59 -1.26 -0.00 0.00 0.98 0.00 0.00 173.24 173.55 3ig6 s ALA 96 N -3.94 0.21 0.09 5.32 0.00 -1.26 0.56 121.76 122.74 3ig6 s ALA 96 Ca 0.14 0.11 0.00 0.00 0.00 0.00 0.00 51.96 52.21 3ig6 s ALA 96 Cb -0.04 -0.20 0.00 0.00 0.00 0.00 0.00 23.12 22.88 3ig6 s ALA 96 CO 0.06 -0.04 0.00 -0.40 0.00 0.00 0.00 175.76 175.38 3ig6 n ASP 97 N 3.75 0.00 0.10 0.00 5.68 -0.85 -4.99 116.55 120.25 3ig6 n ASP 97 Ca -0.22 0.00 0.13 0.00 -0.50 0.00 0.00 54.79 54.20 3ig6 n ASP 97 Cb 0.53 0.00 0.39 0.00 -1.14 0.00 0.00 41.12 40.90 3ig6 n ASP 97 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 3ig6 n THR 97 N 0.00 0.56 0.00 2.12 -2.24 -1.26 -4.41 114.28 109.06 3ig6 n THR 97 Ca 0.00 -0.28 0.00 0.00 -2.27 0.00 0.00 64.05 61.50 3ig6 n THR 97 Cb 0.00 -0.54 0.00 0.00 -2.10 0.00 0.00 70.33 67.69 3ig6 n THR 97 CO 0.00 0.00 0.00 -0.11 -0.57 0.00 0.00 175.07 174.39 3ig6 n LEU 97 N -2.24 0.96 -4.69 3.22 7.94 -1.26 -5.12 117.00 115.82 3ig6 n LEU 97 Ca 0.05 0.00 -0.28 0.00 -1.11 0.00 0.00 56.01 54.67 3ig6 n LEU 97 Cb 0.43 0.00 -0.08 0.00 0.53 0.00 0.00 43.42 44.30 3ig6 n LEU 97 CO 0.31 0.07 -0.32 0.00 -1.11 0.00 0.00 177.39 176.34 3ig6 s ALA 98 N -1.80 3.30 0.13 1.96 0.00 -1.26 -4.76 121.76 119.33 3ig6 s ALA 98 Ca 0.00 -1.21 -0.16 0.00 0.00 0.00 0.00 51.96 50.59 3ig6 s ALA 98 Cb 0.00 -1.15 -0.07 0.00 0.00 0.00 0.00 23.12 21.90 3ig6 s ALA 98 CO 0.00 0.60 0.56 -1.01 0.00 0.00 0.00 175.76 175.91 3ig6 s HIS 99 N -1.51 3.67 0.04 0.00 3.76 -1.26 -2.00 115.29 117.98 3ig6 s HIS 99 Ca 0.27 1.14 0.06 0.00 -0.15 0.00 0.00 55.06 56.38 3ig6 s HIS 99 Cb -0.11 -2.42 -0.03 0.00 1.11 0.00 0.00 32.58 31.14 3ig6 s HIS 99 CO 0.19 0.48 -0.16 -1.01 -0.85 0.00 0.00 174.74 173.39 3ig6 s HIS 100 N -1.36 2.61 -1.49 1.40 3.76 0.19 -4.69 115.29 115.73 3ig6 s HIS 100 Ca 0.35 -0.22 -0.05 0.00 -0.15 0.00 0.00 55.06 54.99 3ig6 s HIS 100 Cb -0.16 -1.49 0.04 0.00 1.11 0.00 0.00 32.58 32.08 3ig6 s HIS 100 CO 0.19 0.27 0.54 0.09 -0.85 0.00 0.00 174.74 174.99 3ig6 n ASN 101 N 1.53 -1.32 -4.33 1.40 3.02 -1.26 -2.67 115.26 111.63 3ig6 n ASN 101 Ca -0.16 -0.99 -0.43 0.00 -0.03 0.00 0.00 54.58 52.96 3ig6 n ASN 101 Cb 0.52 -3.04 0.00 0.00 -0.61 0.00 0.00 39.78 36.65 3ig6 n ASN 101 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 3ig6 n ASP 102 N -2.90 5.09 -3.72 6.41 2.03 -1.26 -4.44 116.55 117.76 3ig6 n ASP 102 Ca -0.20 -2.99 -0.12 0.00 0.52 0.00 0.00 54.79 52.00 3ig6 n ASP 102 Cb 0.63 -1.59 -0.11 0.00 -0.72 0.00 0.00 41.12 39.34 3ig6 n ASP 102 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 3ig6 s ILE 103 N 1.82 -0.01 0.03 5.18 2.07 -1.26 -4.27 121.20 124.76 3ig6 s ILE 103 Ca 0.44 0.05 0.01 0.00 -1.41 0.00 0.00 60.65 59.73 3ig6 s ILE 103 Cb 0.01 -0.55 -0.02 0.00 0.13 0.00 0.00 42.46 42.03 3ig6 s ILE 103 CO 0.01 0.02 -0.05 0.00 -1.91 0.00 0.00 174.94 173.01 3ig6 s ALA 104 N 0.72 0.32 -0.06 1.50 0.00 -0.30 -2.98 121.76 120.95 3ig6 s ALA 104 Ca -0.04 -0.71 0.06 0.00 0.00 0.00 0.00 51.96 51.27 3ig6 s ALA 104 Cb -0.05 0.12 -0.01 0.00 0.00 0.00 0.00 23.12 23.18 3ig6 s ALA 104 CO -0.05 -0.13 -0.25 -0.51 0.00 0.00 0.00 175.76 174.82 3ig6 s LEU 105 N -1.64 2.07 -0.23 0.00 1.43 0.03 -1.00 118.68 119.34 3ig6 s LEU 105 Ca -0.12 -0.51 0.01 0.00 -1.03 0.00 0.00 54.13 52.48 3ig6 s LEU 105 Cb -0.08 -1.37 0.04 0.00 0.03 0.00 0.00 46.19 44.80 3ig6 s LEU 105 CO -0.01 0.24 -0.13 -0.76 0.23 0.00 0.00 176.35 175.92 3ig6 s LEU 106 N -0.14 2.91 -0.23 1.79 1.02 0.63 -0.48 118.68 124.17 3ig6 s LEU 106 Ca -0.04 -0.97 -0.28 0.00 0.02 0.00 0.00 54.13 52.86 3ig6 s LEU 106 Cb -0.14 -1.56 0.01 0.00 0.02 0.00 0.00 46.19 44.52 3ig6 s LEU 106 CO 0.04 -0.10 0.99 -0.75 0.02 0.00 0.00 176.35 176.54 3ig6 s LYS 107 N 1.24 4.24 0.06 1.70 2.47 -0.20 -0.97 119.74 128.27 3ig6 s LYS 107 Ca -0.01 1.25 0.02 0.00 -1.56 0.00 0.00 55.97 55.67 3ig6 s LYS 107 Cb -0.16 -3.64 -0.04 0.00 -1.46 0.00 0.00 37.83 32.52 3ig6 s LYS 107 CO -0.08 -0.60 0.11 0.96 0.16 0.00 0.00 175.35 175.90 3ig6 s ILE 108 N 3.11 4.76 -0.18 5.43 -4.36 -0.29 0.25 121.20 129.93 3ig6 s ILE 108 Ca 0.42 -0.62 -0.08 0.00 -0.26 0.00 0.00 60.65 60.11 3ig6 s ILE 108 Cb -0.15 -3.28 0.07 0.00 1.25 0.00 0.00 42.46 40.35 3ig6 s ILE 108 CO 0.06 0.17 0.40 -0.60 0.24 0.00 0.00 174.94 175.21 3ig6 s ARG 109 N -2.29 0.34 0.96 0.37 3.52 -0.44 -4.66 118.95 116.74 3ig6 s ARG 109 Ca 0.29 0.88 -0.12 0.00 -0.13 0.00 0.00 55.73 56.66 3ig6 s ARG 109 Cb -0.12 0.12 0.17 0.00 -1.56 0.00 0.00 34.95 33.55 3ig6 s ARG 109 CO 0.22 -0.21 1.09 -1.54 -0.81 0.00 0.00 175.30 174.05 3ig6 s SER 110 N 1.98 2.95 0.44 -2.12 1.04 -0.26 0.07 113.70 117.81 3ig6 s SER 110 Ca -0.05 1.29 0.16 0.00 0.48 0.00 0.00 55.95 57.82 3ig6 s SER 110 Cb -0.10 -1.96 1.08 0.00 0.10 0.00 0.00 66.02 65.14 3ig6 s SER 110 CO -0.12 -2.94 1.96 0.11 0.98 0.00 0.00 173.24 173.23 3ig6 h LYS 110 N -1.76 0.35 -0.01 4.02 1.57 -1.90 0.25 116.57 119.09 3ig6 h LYS 110 Ca -0.53 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.23 3ig6 h LYS 110 Cb 1.31 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 33.54 3ig6 h LYS 110 CO 0.57 0.23 -0.00 -0.85 -0.57 0.00 0.00 179.45 178.83 3ig6 n GLU 110 N -4.46 1.64 -0.31 3.15 0.00 -1.26 -4.94 120.64 114.46 3ig6 n GLU 110 Ca 0.12 -0.93 0.00 0.00 0.00 0.00 0.00 57.16 56.35 3ig6 n GLU 110 Cb 0.46 -1.48 0.00 0.00 0.00 0.00 0.00 31.44 30.42 3ig6 n GLU 110 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 3ig6 n GLY 110 N 1.17 0.84 3.83 -1.84 0.00 0.08 -5.08 105.19 104.19 3ig6 n GLY 110 Ca 0.19 -0.09 -0.22 0.00 0.00 0.00 0.00 46.02 45.90 3ig6 n GLY 110 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3ig6 s ARG 110 N -0.67 2.96 0.00 1.61 3.03 -1.26 -4.76 118.95 119.85 3ig6 s ARG 110 Ca 0.00 -1.01 0.00 0.00 2.03 0.00 0.00 55.73 56.75 3ig6 s ARG 110 Cb 0.00 -2.60 0.00 0.00 -1.03 0.00 0.00 34.95 31.32 3ig6 s ARG 110 CO 0.00 0.41 0.00 0.00 -1.13 0.00 0.00 175.30 174.58 3ig6 s ALA 112 N -3.35 3.09 -0.07 0.00 0.00 0.59 -4.86 121.76 117.17 3ig6 s ALA 112 Ca 0.00 0.84 0.04 0.00 0.00 0.00 0.00 51.96 52.84 3ig6 s ALA 112 Cb 0.00 -3.33 -0.02 0.00 0.00 0.00 0.00 23.12 19.77 3ig6 s ALA 112 CO 0.00 -0.41 -0.17 -0.65 0.00 0.00 0.00 175.76 174.53 3ig6 s GLN 113 N -2.45 2.69 0.61 0.00 -0.21 -1.26 -4.79 119.66 114.26 3ig6 s GLN 113 Ca 0.59 -0.76 -0.19 0.00 0.02 0.00 0.00 55.36 55.02 3ig6 s GLN 113 Cb -0.26 -2.37 -0.03 0.00 1.00 0.00 0.00 33.01 31.35 3ig6 s GLN 113 CO 0.33 0.47 1.25 -1.25 -2.12 0.00 0.00 175.29 173.97 3ig6 s PRO 114 N -0.34 2.80 0.11 2.91 0.04 -1.26 -4.81 135.00 134.44 3ig6 s PRO 114 Ca 0.03 1.95 -0.14 0.00 0.04 0.00 0.00 61.00 62.87 3ig6 s PRO 114 Cb -0.12 -1.91 0.05 0.00 0.04 0.00 0.00 34.50 32.56 3ig6 s PRO 114 CO 0.02 -1.37 0.67 -1.13 0.04 0.00 0.00 177.00 175.23 3ig6 n SER 115 N -1.70 -1.08 0.25 6.66 3.41 -0.57 -4.93 113.62 115.65 3ig6 n SER 115 Ca 0.14 -1.55 0.12 0.00 -0.26 0.00 0.00 58.87 57.32 3ig6 n SER 115 Cb 0.49 1.75 0.62 0.00 -0.26 0.00 0.00 64.21 66.81 3ig6 n SER 115 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 3ig6 h ARG 116 N 0.00 0.00 -0.01 4.33 2.43 -1.99 -3.07 114.38 116.07 3ig6 h ARG 116 Ca -0.17 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.00 3ig6 h ARG 116 Cb 0.76 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.31 3ig6 h ARG 116 CO 0.23 0.17 -0.01 0.25 -1.51 0.00 0.00 179.97 179.10 3ig6 n THR 117 N -3.52 0.00 -3.71 0.20 -2.24 -1.26 -4.62 114.28 99.13 3ig6 n THR 117 Ca -0.01 -0.49 -0.24 0.00 -2.27 0.00 0.00 64.05 61.04 3ig6 n THR 117 Cb 0.32 1.25 -0.17 0.00 -2.10 0.00 0.00 70.33 69.62 3ig6 n THR 117 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 3ig6 s ILE 118 N -1.03 0.20 0.06 2.28 1.01 -1.16 -3.61 121.20 118.95 3ig6 s ILE 118 Ca 0.14 -0.02 -0.09 0.00 0.00 0.00 0.00 60.65 60.67 3ig6 s ILE 118 Cb 0.10 -0.57 0.00 0.00 0.01 0.00 0.00 42.46 42.00 3ig6 s ILE 118 CO 0.16 0.02 0.20 -1.10 0.00 0.00 0.00 174.94 174.22 3ig6 s GLN 119 N 2.03 0.76 0.30 2.79 -1.52 -0.48 -1.51 119.66 122.03 3ig6 s GLN 119 Ca 0.03 -0.75 -0.14 0.00 -1.95 0.00 0.00 55.36 52.56 3ig6 s GLN 119 Cb -0.14 0.31 -0.09 0.00 -0.22 0.00 0.00 33.01 32.88 3ig6 s GLN 119 CO -0.06 -0.23 0.70 0.95 -0.25 0.00 0.00 175.29 176.40 3ig6 s THR 120 N -3.05 4.74 0.23 -0.19 -4.23 -1.26 -3.03 115.64 108.83 3ig6 s THR 120 Ca -0.01 0.84 -0.06 0.00 -1.18 0.00 0.00 61.69 61.27 3ig6 s THR 120 Cb 0.01 -3.61 -0.06 0.00 1.34 0.00 0.00 72.50 70.18 3ig6 s THR 120 CO -0.07 -0.17 0.49 0.27 -0.54 0.00 0.00 174.62 174.61 3ig6 s ILE 121 N -1.96 5.04 0.34 2.99 -5.25 -0.66 -4.87 121.20 116.84 3ig6 s ILE 121 Ca 0.53 0.16 -0.25 0.00 -0.99 0.00 0.00 60.65 60.09 3ig6 s ILE 121 Cb -0.10 -3.67 -0.10 0.00 2.95 0.00 0.00 42.46 41.54 3ig6 s ILE 121 CO 0.18 -0.14 0.95 0.00 -1.79 0.00 0.00 174.94 174.15 3ig6 s LEU 123 N -2.26 3.77 0.95 0.00 1.43 -1.26 -0.27 118.68 121.04 3ig6 s LEU 123 Ca 0.52 1.43 -0.12 0.00 -1.03 0.00 0.00 54.13 54.93 3ig6 s LEU 123 Cb -0.17 -4.33 0.16 0.00 0.03 0.00 0.00 46.19 41.88 3ig6 s LEU 123 CO 0.22 -0.47 1.11 -2.16 0.23 0.00 0.00 176.35 175.28 3ig6 s PRO 124 N -3.79 0.81 0.42 1.29 0.04 -1.26 -4.82 135.00 127.70 3ig6 s PRO 124 Ca 0.57 0.45 -0.08 0.00 0.04 0.00 0.00 61.00 61.97 3ig6 s PRO 124 Cb -0.10 -1.79 -0.05 0.00 0.04 0.00 0.00 34.50 32.60 3ig6 s PRO 124 CO 0.28 -2.46 0.76 0.45 0.04 0.00 0.00 177.00 176.07 3ig6 s SER 125 N -3.69 6.43 0.17 6.66 0.15 -1.26 -4.94 113.70 117.22 3ig6 s SER 125 Ca 0.64 1.04 -0.32 0.00 0.70 0.00 0.00 55.95 58.01 3ig6 s SER 125 Cb -0.17 -2.29 -0.12 0.00 -1.71 0.00 0.00 66.02 61.73 3ig6 s SER 125 CO 0.56 -0.44 1.71 0.23 1.20 0.00 0.00 173.24 176.50 3ig6 n MET 126 N -1.58 2.61 -0.93 5.44 2.81 -1.26 -1.64 117.12 122.58 3ig6 n MET 126 Ca 0.02 0.94 0.00 0.00 -1.81 0.00 0.00 57.70 56.85 3ig6 n MET 126 Cb 0.54 -2.78 0.00 0.00 -0.71 0.00 0.00 33.22 30.27 3ig6 n MET 126 CO 0.00 0.00 0.00 0.66 1.51 0.00 0.00 175.97 178.14 3ig6 n TYR 127 N 4.22 0.00 -3.52 2.03 4.01 -1.12 -4.93 117.16 117.86 3ig6 n TYR 127 Ca 0.17 0.00 -0.42 0.00 -0.16 0.00 0.00 57.90 57.49 3ig6 n TYR 127 Cb 0.34 -1.71 -0.10 0.00 -0.31 0.00 0.00 39.34 37.56 3ig6 n TYR 127 CO 0.00 0.00 0.00 -0.80 -0.46 0.00 0.00 176.86 175.60 3ig6 s ASN 128 N -2.02 5.89 0.11 7.72 0.02 -0.65 -5.06 114.94 120.95 3ig6 s ASN 128 Ca 0.00 -1.20 0.03 0.00 -1.02 0.00 0.00 52.86 50.67 3ig6 s ASN 128 Cb 0.00 -2.08 -0.04 0.00 0.02 0.00 0.00 41.25 39.15 3ig6 s ASN 128 CO 0.00 -0.51 -0.09 -1.81 0.02 0.00 0.00 177.10 174.71 3ig6 s ASP 129 N 2.00 1.47 0.70 -1.22 -0.00 -1.26 -4.29 116.67 114.07 3ig6 s ASP 129 Ca 0.03 -0.90 -0.16 0.00 -0.00 0.00 0.00 52.55 51.52 3ig6 s ASP 129 Cb -0.22 0.02 0.02 0.00 -0.00 0.00 0.00 42.92 42.75 3ig6 s ASP 129 CO 0.06 -0.32 1.25 -2.84 -0.00 0.00 0.00 175.17 173.32 3ig6 s PRO 130 N -3.25 2.27 0.59 8.23 0.02 -1.26 -4.99 135.00 136.62 3ig6 s PRO 130 Ca 0.10 1.91 -0.16 0.00 0.02 0.00 0.00 61.00 62.86 3ig6 s PRO 130 Cb 0.00 -1.83 -0.04 0.00 0.02 0.00 0.00 34.50 32.65 3ig6 s PRO 130 CO -0.01 -1.77 1.07 -0.65 -0.33 0.00 0.00 177.00 175.31 3ig6 s GLN 131 N -3.67 3.29 0.57 5.54 -1.52 -1.26 -4.94 119.66 117.66 3ig6 s GLN 131 Ca 0.78 1.27 -0.19 0.00 -1.95 0.00 0.00 55.36 55.28 3ig6 s GLN 131 Cb -0.33 -2.02 -0.07 0.00 -0.22 0.00 0.00 33.01 30.36 3ig6 s GLN 131 CO 0.43 -0.85 0.79 1.97 -0.25 0.00 0.00 175.29 177.39 3ig6 n PHE 132 N -1.94 0.26 0.00 0.91 -1.74 -1.26 -2.29 117.46 111.39 3ig6 n PHE 132 Ca 0.09 0.46 0.00 0.00 -0.56 0.00 0.00 57.45 57.44 3ig6 n PHE 132 Cb 0.53 -2.07 0.00 0.00 1.52 0.00 0.00 39.48 39.45 3ig6 n PHE 132 CO 0.00 0.00 0.00 0.41 -0.56 0.00 0.00 176.76 176.61 3ig6 n GLY 133 N 1.48 2.84 3.75 4.97 0.00 0.48 -4.95 105.19 113.75 3ig6 n GLY 133 Ca 0.12 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.73 3ig6 n GLY 133 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3ig6 s THR 134 N -2.55 3.16 0.07 2.61 2.01 -0.97 -4.67 115.64 115.31 3ig6 s THR 134 Ca 0.00 1.04 -0.30 0.00 0.31 0.00 0.00 61.69 62.74 3ig6 s THR 134 Cb 0.00 -3.66 -0.05 0.00 0.01 0.00 0.00 72.50 68.80 3ig6 s THR 134 CO 0.00 0.19 0.97 -0.44 -0.69 0.00 0.00 174.62 174.65 3ig6 s SER 135 N -0.06 7.44 0.15 3.53 0.01 -1.26 -1.30 113.70 122.21 3ig6 s SER 135 Ca 0.53 1.74 0.01 0.00 1.31 0.00 0.00 55.95 59.53 3ig6 s SER 135 Cb -0.36 -2.58 -0.04 0.00 0.21 0.00 0.00 66.02 63.24 3ig6 s SER 135 CO 0.42 -0.14 0.01 0.00 0.41 0.00 0.00 173.24 173.94 3ig6 s GLU 137 N -3.95 1.96 0.14 0.00 -1.05 0.62 -0.98 118.70 115.44 3ig6 s GLU 137 Ca 0.22 -1.14 0.09 0.00 -0.15 0.00 0.00 54.97 53.99 3ig6 s GLU 137 Cb 0.07 -2.19 -0.04 0.00 -0.44 0.00 0.00 34.13 31.52 3ig6 s GLU 137 CO 0.02 0.48 -0.21 0.96 0.95 0.00 0.00 175.26 177.47 3ig6 s ILE 138 N -1.26 1.85 0.01 1.83 -4.36 -0.72 -0.32 121.20 118.23 3ig6 s ILE 138 Ca 0.20 -1.75 0.00 0.00 -0.26 0.00 0.00 60.65 58.85 3ig6 s ILE 138 Cb -0.10 -1.75 -0.01 0.00 1.25 0.00 0.00 42.46 41.84 3ig6 s ILE 138 CO 0.12 -0.15 -0.03 0.28 0.24 0.00 0.00 174.94 175.40 3ig6 s THR 139 N -1.55 0.16 0.00 8.37 -1.32 -1.22 -1.92 115.64 118.16 3ig6 s THR 139 Ca 0.12 -0.60 0.00 0.00 -1.21 0.00 0.00 61.69 60.00 3ig6 s THR 139 Cb -0.08 -0.24 0.00 0.00 -1.51 0.00 0.00 72.50 70.67 3ig6 s THR 139 CO 0.06 -0.28 0.00 0.61 -2.21 0.00 0.00 174.62 172.80 3ig6 n GLY 140 N 2.14 0.44 1.23 6.08 0.00 -0.59 -4.41 105.19 110.09 3ig6 n GLY 140 Ca -0.19 -0.90 0.11 0.00 0.00 0.00 0.00 46.02 45.03 3ig6 n GLY 140 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3ig6 n PHE 141 N -0.19 0.88 -0.62 1.61 3.72 -1.26 -1.92 117.46 119.67 3ig6 n PHE 141 Ca 0.00 -0.49 -0.28 0.00 -0.05 0.00 0.00 57.45 56.63 3ig6 n PHE 141 Cb 0.00 -0.01 0.24 0.00 -0.94 0.00 0.00 39.48 38.78 3ig6 n PHE 141 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 3ig6 s GLY 142 N -1.02 1.55 0.53 1.37 0.00 -1.26 -4.01 107.32 104.48 3ig6 s GLY 142 Ca 0.44 -0.15 -0.22 0.00 0.00 0.00 0.00 44.72 44.80 3ig6 s GLY 142 CO 0.30 0.56 1.26 0.28 0.00 0.00 0.00 173.10 175.50 3ig6 n LYS 143 N -4.84 1.58 -0.00 2.90 5.02 -0.09 -2.04 118.16 120.69 3ig6 n LYS 143 Ca 0.03 0.58 0.05 0.00 -2.02 0.00 0.00 58.31 56.95 3ig6 n LYS 143 Cb 0.55 -2.44 0.04 0.00 -0.02 0.00 0.00 35.03 33.15 3ig6 n LYS 143 CO 0.00 0.00 0.00 -0.85 -0.52 0.00 0.00 177.40 176.03 3ig6 n GLU 144 N -0.77 0.37 -3.64 1.97 0.28 -1.25 -1.05 120.64 116.54 3ig6 n GLU 144 Ca 0.10 -1.08 -0.11 0.00 -0.16 0.00 0.00 57.16 55.91 3ig6 n GLU 144 Cb 0.44 -1.18 -0.07 0.00 1.43 0.00 0.00 31.44 32.06 3ig6 n GLU 144 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 177.13 178.18 3ig6 s ASN 145 N -0.78 -0.81 0.44 -1.84 3.84 -1.26 -4.45 114.94 110.08 3ig6 s ASN 145 Ca 0.11 1.43 0.18 0.00 0.21 0.00 0.00 52.86 54.79 3ig6 s ASN 145 Cb 0.08 1.38 1.03 0.00 -0.55 0.00 0.00 41.25 43.18 3ig6 s ASN 145 CO 0.12 -0.24 1.94 0.28 -2.79 0.00 0.00 177.10 176.41 3ig6 h SER 146 N 5.91 0.00 0.52 -4.21 0.02 -2.00 -2.64 113.55 111.15 3ig6 h SER 146 Ca -0.30 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.65 3ig6 h SER 146 Cb 1.19 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.73 3ig6 h SER 146 CO 0.11 0.24 -0.48 0.35 -1.14 0.00 0.00 176.83 175.91 3ig6 n THR 147 N -3.98 0.00 -1.99 -2.27 -2.24 -1.26 -4.89 114.28 97.65 3ig6 n THR 147 Ca -0.02 -0.00 -0.40 0.00 -2.27 0.00 0.00 64.05 61.36 3ig6 n THR 147 Cb 0.31 0.22 -0.00 0.00 -2.10 0.00 0.00 70.33 68.76 3ig6 n THR 147 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 3ig6 s ASP 148 N -3.00 6.26 -0.01 3.42 1.01 -1.00 -4.92 116.67 118.43 3ig6 s ASP 148 Ca 0.11 2.73 0.19 0.00 0.71 0.00 0.00 52.55 56.30 3ig6 s ASP 148 Cb 0.18 -2.64 -0.24 0.00 1.01 0.00 0.00 42.92 41.22 3ig6 s ASP 148 CO 0.69 -0.89 0.64 0.00 0.21 0.00 0.00 175.17 175.82 3ig6 n TYR 149 N 0.13 0.00 -4.06 4.23 4.11 -1.26 -4.96 117.16 115.34 3ig6 n TYR 149 Ca 0.04 0.00 -0.36 0.00 -0.00 0.00 0.00 57.90 57.58 3ig6 n TYR 149 Cb 0.43 -0.19 -0.07 0.00 -0.00 0.00 0.00 39.34 39.51 3ig6 n TYR 149 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.86 176.35 3ig6 s LEU 150 N -3.50 4.07 0.57 -3.48 1.43 -1.26 -5.11 118.68 111.40 3ig6 s LEU 150 Ca 0.01 0.32 -0.14 0.00 -1.03 0.00 0.00 54.13 53.28 3ig6 s LEU 150 Cb 0.13 -2.06 -0.05 0.00 0.03 0.00 0.00 46.19 44.24 3ig6 s LEU 150 CO 0.78 0.37 1.01 -0.31 0.23 0.00 0.00 176.35 178.44 3ig6 s TYR 151 N -1.03 3.43 0.36 0.29 1.51 -1.26 -4.78 117.35 115.86 3ig6 s TYR 151 Ca 0.16 1.41 -0.28 0.00 -1.01 0.00 0.00 57.07 57.35 3ig6 s TYR 151 Cb -0.12 -2.80 -0.11 0.00 -0.11 0.00 0.00 41.96 38.82 3ig6 s TYR 151 CO 0.06 -0.63 1.44 -1.25 -1.11 0.00 0.00 175.55 174.06 3ig6 s PRO 152 N -4.51 4.18 0.23 -1.71 0.04 -1.26 -4.91 135.00 127.06 3ig6 s PRO 152 Ca 0.58 2.47 0.11 0.00 0.04 0.00 0.00 61.00 64.20 3ig6 s PRO 152 Cb -0.11 -3.00 0.14 0.00 0.04 0.00 0.00 34.50 31.57 3ig6 s PRO 152 CO 0.41 -0.44 1.48 0.93 0.04 0.00 0.00 177.00 179.42 3ig6 h GLU 153 N 3.21 0.00 -5.66 4.56 4.39 -1.95 -3.42 114.58 115.71 3ig6 h GLU 153 Ca -0.50 0.00 -0.67 0.00 0.34 0.00 0.00 59.36 58.53 3ig6 h GLU 153 Cb 1.23 0.00 -0.08 0.00 -0.10 0.00 0.00 28.75 29.80 3ig6 h GLU 153 CO 0.65 0.72 -0.50 -1.14 -1.16 0.00 0.00 179.01 177.59 3ig6 s GLN 154 N -3.18 3.42 0.47 2.33 2.00 -1.26 -0.17 119.66 123.27 3ig6 s GLN 154 Ca 0.00 -0.17 -0.23 0.00 -2.00 0.00 0.00 55.36 52.97 3ig6 s GLN 154 Cb 0.11 -3.15 -0.09 0.00 0.80 0.00 0.00 33.01 30.68 3ig6 s GLN 154 CO 0.77 0.75 0.99 -0.11 -0.50 0.00 0.00 175.29 177.19 3ig6 n LEU 155 N 2.07 2.85 -4.37 3.68 7.94 -0.19 -4.85 117.00 124.13 3ig6 n LEU 155 Ca -0.20 0.97 -0.20 0.00 -1.11 0.00 0.00 56.01 55.47 3ig6 n LEU 155 Cb 0.55 -1.36 -0.10 0.00 0.53 0.00 0.00 43.42 43.03 3ig6 n LEU 155 CO 0.31 -1.61 -0.46 -0.54 -1.11 0.00 0.00 177.39 173.98 3ig6 s LYS 156 N -2.20 1.38 0.08 1.96 1.02 -0.81 -1.07 119.74 120.10 3ig6 s LYS 156 Ca 0.66 -1.57 -0.03 0.00 0.02 0.00 0.00 55.97 55.05 3ig6 s LYS 156 Cb -0.51 -1.31 -0.03 0.00 -0.52 0.00 0.00 37.83 35.46 3ig6 s LYS 156 CO 0.54 0.24 0.04 1.41 -0.92 0.00 0.00 175.35 176.67 3ig6 s MET 157 N -3.38 0.76 0.29 1.68 -2.45 -0.28 -1.54 119.30 114.37 3ig6 s MET 157 Ca 0.22 -1.23 -0.11 0.00 -1.25 0.00 0.00 55.69 53.32 3ig6 s MET 157 Cb -0.03 0.25 0.01 0.00 1.25 0.00 0.00 34.83 36.31 3ig6 s MET 157 CO 0.08 -0.19 0.53 -0.08 1.05 0.00 0.00 175.02 176.41 3ig6 s THR 158 N -3.94 0.00 -0.14 10.11 -1.32 -0.81 -0.70 115.64 118.84 3ig6 s THR 158 Ca 0.11 -1.39 0.00 0.00 -1.21 0.00 0.00 61.69 59.21 3ig6 s THR 158 Cb 0.07 -2.40 -0.01 0.00 -1.51 0.00 0.00 72.50 68.66 3ig6 s THR 158 CO -0.07 0.00 -0.15 -0.69 -2.21 0.00 0.00 174.62 171.50 3ig6 s VAL 159 N -3.55 2.77 0.33 5.08 1.01 -1.26 -1.76 120.40 123.03 3ig6 s VAL 159 Ca 0.23 -0.75 0.06 0.00 0.00 0.00 0.00 61.98 61.53 3ig6 s VAL 159 Cb -0.01 -2.16 -0.07 0.00 0.00 0.00 0.00 36.38 34.14 3ig6 s VAL 159 CO 0.12 0.52 -0.02 0.68 0.00 0.00 0.00 175.10 176.41 3ig6 s VAL 160 N 0.55 1.72 -0.05 2.92 -7.23 -0.15 -4.78 120.40 113.38 3ig6 s VAL 160 Ca -0.10 -2.08 0.04 0.00 -1.81 0.00 0.00 61.98 58.04 3ig6 s VAL 160 Cb -0.16 -2.70 -0.03 0.00 0.56 0.00 0.00 36.38 34.05 3ig6 s VAL 160 CO 0.04 -0.14 -0.15 -0.54 -0.31 0.00 0.00 175.10 174.00 3ig6 s LYS 161 N -3.74 2.49 0.31 4.82 -0.14 -0.21 -0.44 119.74 122.83 3ig6 s LYS 161 Ca 0.33 -0.71 -0.29 0.00 -1.36 0.00 0.00 55.97 53.94 3ig6 s LYS 161 Cb 0.06 -2.36 -0.10 0.00 -1.68 0.00 0.00 37.83 33.75 3ig6 s LYS 161 CO 0.15 0.61 1.38 -0.51 -0.76 0.00 0.00 175.35 176.22 3ig6 s LEU 162 N -0.69 4.40 -0.09 3.17 1.02 -0.42 -1.51 118.68 124.56 3ig6 s LEU 162 Ca 0.11 2.75 0.00 0.00 0.02 0.00 0.00 54.13 57.01 3ig6 s LEU 162 Cb -0.11 -3.64 -0.03 0.00 0.02 0.00 0.00 46.19 42.43 3ig6 s LEU 162 CO 0.01 -0.65 -0.08 -0.63 0.02 0.00 0.00 176.35 175.01 3ig6 s ILE 163 N -0.79 3.54 0.73 -0.59 1.01 0.28 -0.39 121.20 124.99 3ig6 s ILE 163 Ca 0.53 -0.53 -0.15 0.00 0.00 0.00 0.00 60.65 60.50 3ig6 s ILE 163 Cb -0.42 -2.46 0.04 0.00 0.01 0.00 0.00 42.46 39.63 3ig6 s ILE 163 CO 0.52 0.57 1.22 -0.94 0.00 0.00 0.00 174.94 176.31 3ig6 s SER 164 N -0.45 4.18 0.33 3.58 1.04 -1.26 -4.22 113.70 116.90 3ig6 s SER 164 Ca 0.06 2.39 0.01 0.00 0.48 0.00 0.00 55.95 58.90 3ig6 s SER 164 Cb -0.12 -2.59 0.56 0.00 0.10 0.00 0.00 66.02 63.97 3ig6 s SER 164 CO 0.02 -2.27 1.94 -0.74 0.98 0.00 0.00 173.24 173.17 3ig6 h HIS 165 N -0.25 0.78 -0.13 5.02 2.76 -1.96 -2.04 115.15 119.34 3ig6 h HIS 165 Ca -0.48 -0.02 -0.14 0.00 -2.20 0.00 0.00 60.37 57.54 3ig6 h HIS 165 Cb 1.30 -0.25 -0.01 0.00 1.55 0.00 0.00 27.41 30.00 3ig6 h HIS 165 CO 0.46 0.57 -0.51 0.07 -1.30 0.00 0.00 177.93 177.22 3ig6 h ARG 166 N 0.80 0.36 -0.26 5.26 -0.00 -1.98 -1.44 114.38 117.12 3ig6 h ARG 166 Ca 0.20 -0.21 -0.06 0.00 -0.00 0.00 0.00 59.98 59.91 3ig6 h ARG 166 Cb 0.07 0.02 -0.01 0.00 -0.00 0.00 0.00 29.97 30.05 3ig6 h ARG 166 CO -0.03 0.78 -0.08 1.49 -0.00 0.00 0.00 179.97 182.14 3ig6 h GLU 167 N 0.28 0.51 0.00 0.08 4.81 -1.84 -3.08 114.58 115.34 3ig6 h GLU 167 Ca 0.01 -0.20 -0.05 0.00 -0.13 0.00 0.00 59.36 58.99 3ig6 h GLU 167 Cb 0.99 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 30.34 3ig6 h GLU 167 CO 0.09 0.74 -0.24 0.00 -0.73 0.00 0.00 179.01 178.86 3ig6 n GLN 169 N -3.55 1.07 -1.96 0.00 6.02 -0.56 -1.41 117.38 116.99 3ig6 n GLN 169 Ca -0.01 -0.39 -0.36 0.00 -0.01 0.00 0.00 57.00 56.23 3ig6 n GLN 169 Cb 0.39 -1.49 0.04 0.00 1.02 0.00 0.00 30.24 30.20 3ig6 n GLN 169 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 3ig6 s GLN 170 N -2.20 2.90 0.36 -1.09 -1.52 -0.78 -3.21 119.66 114.12 3ig6 s GLN 170 Ca 0.37 1.83 0.04 0.00 -1.95 0.00 0.00 55.36 55.65 3ig6 s GLN 170 Cb 0.21 -1.92 0.68 0.00 -0.22 0.00 0.00 33.01 31.76 3ig6 s GLN 170 CO 0.40 -1.26 1.98 -1.00 -0.25 0.00 0.00 175.29 175.16 3ig6 h PRO 170 N 0.78 0.67 -0.01 2.91 0.13 -1.89 -0.89 132.00 133.71 3ig6 h PRO 170 Ca -0.50 -0.07 0.00 0.00 -0.87 0.00 0.00 66.00 64.56 3ig6 h PRO 170 Cb 1.30 -0.14 0.00 0.00 0.13 0.00 0.00 31.00 32.29 3ig6 h PRO 170 CO 0.55 0.51 -0.01 0.72 -0.23 0.00 0.00 178.00 179.53 3ig6 n HIS 170 N -4.40 0.00 0.00 1.56 8.25 -1.26 -4.44 115.22 114.93 3ig6 n HIS 170 Ca 0.04 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.50 3ig6 n HIS 170 Cb 0.11 -0.02 0.00 0.00 1.12 0.00 0.00 29.99 31.20 3ig6 n HIS 170 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 3ig6 n TYR 171 N -0.57 0.00 -0.03 4.41 4.02 -0.42 -4.82 117.16 119.75 3ig6 n TYR 171 Ca 0.21 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 58.10 3ig6 n TYR 171 Cb 0.22 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.54 3ig6 n TYR 171 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 176.86 176.51 3ig6 n TYR 172 N 0.00 0.00 -4.69 -0.72 4.01 -0.50 -4.94 117.16 110.33 3ig6 n TYR 172 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.74 3ig6 n TYR 172 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.03 3ig6 n TYR 172 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3ig6 n GLY 173 N 0.54 3.05 0.00 2.72 0.00 -0.71 -2.01 105.19 108.79 3ig6 n GLY 173 Ca 0.00 -0.35 0.08 0.00 0.00 0.00 0.00 46.02 45.75 3ig6 n GLY 173 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3ig6 n SER 174 N 1.26 0.00 0.18 1.61 3.41 -1.26 -3.34 113.62 115.48 3ig6 n SER 174 Ca 0.00 -1.14 0.06 0.00 -0.26 0.00 0.00 58.87 57.53 3ig6 n SER 174 Cb 0.00 0.00 0.28 0.00 -0.26 0.00 0.00 64.21 64.23 3ig6 n SER 174 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 175.04 174.80 3ig6 h GLU 175 N 0.00 0.00 -5.21 4.33 4.57 -1.78 -3.41 114.58 113.08 3ig6 h GLU 175 Ca 0.00 0.00 -0.61 0.00 -1.18 0.00 0.00 59.36 57.57 3ig6 h GLU 175 Cb 0.00 0.00 -0.13 0.00 -0.16 0.00 0.00 28.75 28.46 3ig6 h GLU 175 CO 0.00 0.36 -0.48 0.14 -1.18 0.00 0.00 179.01 177.86 3ig6 s VAL 176 N -3.42 5.38 0.51 0.32 -7.23 -1.21 -4.86 120.40 109.89 3ig6 s VAL 176 Ca 0.01 0.22 0.08 0.00 -1.81 0.00 0.00 61.98 60.48 3ig6 s VAL 176 Cb 0.10 -3.50 0.04 0.00 0.56 0.00 0.00 36.38 33.58 3ig6 s VAL 176 CO 0.69 0.39 0.55 0.42 -0.31 0.00 0.00 175.10 176.84 3ig6 s THR 177 N 0.69 2.19 -0.67 5.32 -4.23 -1.26 -4.88 115.64 112.79 3ig6 s THR 177 Ca 0.09 -1.24 0.18 0.00 -1.18 0.00 0.00 61.69 59.54 3ig6 s THR 177 Cb -0.12 -2.42 0.18 0.00 1.34 0.00 0.00 72.50 71.47 3ig6 s THR 177 CO 0.01 0.00 1.55 0.35 -0.54 0.00 0.00 174.62 176.00 3ig6 n THR 178 N -1.89 1.03 1.27 3.99 -2.24 -1.26 -1.50 114.28 113.67 3ig6 n THR 178 Ca 0.07 0.32 0.10 0.00 -2.27 0.00 0.00 64.05 62.27 3ig6 n THR 178 Cb 0.62 -1.21 0.36 0.00 -2.10 0.00 0.00 70.33 68.01 3ig6 n THR 178 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 3ig6 n LYS 179 N -1.92 1.66 -4.47 -0.78 4.76 -1.26 -4.85 118.16 111.30 3ig6 n LYS 179 Ca 0.02 -1.00 -0.24 0.00 -2.87 0.00 0.00 58.31 54.22 3ig6 n LYS 179 Cb 0.16 -1.37 -0.10 0.00 -1.84 0.00 0.00 35.03 31.89 3ig6 n LYS 179 CO 0.00 0.00 0.00 -1.64 -1.37 0.00 0.00 177.40 174.39 3ig6 s MET 180 N -1.78 1.69 0.07 1.97 -1.94 -0.56 -1.48 119.30 117.26 3ig6 s MET 180 Ca 0.30 -1.77 0.05 0.00 -1.71 0.00 0.00 55.69 52.56 3ig6 s MET 180 Cb 0.16 -1.77 -0.03 0.00 2.01 0.00 0.00 34.83 35.20 3ig6 s MET 180 CO 0.24 0.33 -0.14 -0.48 -0.01 0.00 0.00 175.02 174.96 3ig6 s LEU 181 N -3.51 2.26 0.05 -0.03 0.05 0.21 -4.72 118.68 113.00 3ig6 s LEU 181 Ca 0.30 -0.59 0.04 0.00 0.05 0.00 0.00 54.13 53.93 3ig6 s LEU 181 Cb -0.05 -0.51 -0.04 0.00 -2.05 0.00 0.00 46.19 43.54 3ig6 s LEU 181 CO 0.15 -0.06 -0.01 0.00 -0.55 0.00 0.00 176.35 175.88 3ig6 s ALA 183 N -1.22 -0.97 0.18 0.00 0.00 -0.74 -0.55 121.76 118.46 3ig6 s ALA 183 Ca 0.23 0.82 -0.19 0.00 0.00 0.00 0.00 51.96 52.83 3ig6 s ALA 183 Cb -0.12 -0.31 0.04 0.00 0.00 0.00 0.00 23.12 22.73 3ig6 s ALA 183 CO 0.15 -0.23 0.54 0.00 0.00 0.00 0.00 175.76 176.21 3ig6 s ALA 184 N -0.53 -1.11 0.17 0.00 0.00 -0.57 -1.19 121.76 118.54 3ig6 s ALA 184 Ca -0.06 -0.04 -0.30 0.00 0.00 0.00 0.00 51.96 51.55 3ig6 s ALA 184 Cb -0.04 0.84 -0.07 0.00 0.00 0.00 0.00 23.12 23.85 3ig6 s ALA 184 CO 0.03 -0.79 1.02 0.34 0.00 0.00 0.00 175.76 176.36 3ig6 s ASP 185 N -2.84 7.41 0.60 0.00 -1.08 -1.25 -1.05 116.67 118.46 3ig6 s ASP 185 Ca 0.07 1.97 0.30 0.00 -0.52 0.00 0.00 52.55 54.37 3ig6 s ASP 185 Cb -0.01 -2.60 1.82 0.00 -1.46 0.00 0.00 42.92 40.67 3ig6 s ASP 185 CO -0.06 -0.10 2.22 -0.65 0.52 0.00 0.00 175.17 177.10 3ig6 h PRO 185 N 5.05 0.00 -0.23 4.34 0.11 -1.94 -0.32 132.00 139.01 3ig6 h PRO 185 Ca -0.44 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.67 3ig6 h PRO 185 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 3ig6 h PRO 185 CO 0.71 0.00 0.00 1.04 -0.21 0.00 0.00 178.00 179.54 3ig6 n GLN 185 N -3.77 2.36 -3.63 1.05 3.00 -1.26 -4.98 117.38 110.14 3ig6 n GLN 185 Ca -0.02 -2.09 -0.23 0.00 -0.01 0.00 0.00 57.00 54.65 3ig6 n GLN 185 Cb 0.15 -1.48 0.06 0.00 0.00 0.00 0.00 30.24 28.98 3ig6 n GLN 185 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.06 177.97 3ig6 n TRP 186 N 1.39 -2.44 -0.02 1.08 7.02 -0.13 -4.90 117.44 119.44 3ig6 n TRP 186 Ca 0.16 0.95 0.03 0.00 -1.02 0.00 0.00 57.50 57.62 3ig6 n TRP 186 Cb 0.59 -4.74 -0.09 0.00 -2.42 0.00 0.00 31.31 24.65 3ig6 n TRP 186 CO 0.00 0.00 0.00 1.63 -2.02 0.00 0.00 177.69 177.30 3ig6 n LYS 187 N -4.60 0.86 -4.20 -0.99 4.76 -1.26 -4.69 118.16 108.04 3ig6 n LYS 187 Ca -0.11 -0.08 -0.16 0.00 -2.87 0.00 0.00 58.31 55.09 3ig6 n LYS 187 Cb 0.60 -1.27 -0.13 0.00 -1.84 0.00 0.00 35.03 32.39 3ig6 n LYS 187 CO 0.00 0.00 0.00 -0.08 -1.37 0.00 0.00 177.40 175.95 3ig6 s THR 188 N -2.64 0.73 -0.02 -0.18 -1.32 -1.26 -4.04 115.64 106.91 3ig6 s THR 188 Ca -0.04 -0.83 -0.30 0.00 -1.21 0.00 0.00 61.69 59.31 3ig6 s THR 188 Cb 0.06 -0.70 0.10 0.00 -1.51 0.00 0.00 72.50 70.46 3ig6 s THR 188 CO 0.46 -0.10 1.02 -0.62 -2.21 0.00 0.00 174.62 173.17 3ig6 s ASP 189 N -1.03 -0.24 0.78 8.08 2.15 -0.89 -3.86 116.67 121.66 3ig6 s ASP 189 Ca -0.02 -0.10 -0.11 0.00 0.43 0.00 0.00 52.55 52.75 3ig6 s ASP 189 Cb -0.07 0.32 0.06 0.00 -0.30 0.00 0.00 42.92 42.93 3ig6 s ASP 189 CO 0.01 -0.55 1.09 -0.94 -0.17 0.00 0.00 175.17 174.61 3ig6 s SER 190 N -2.56 4.44 0.13 -0.34 1.04 -1.26 -1.17 113.70 113.98 3ig6 s SER 190 Ca 0.09 1.79 -0.01 0.00 0.48 0.00 0.00 55.95 58.29 3ig6 s SER 190 Cb -0.00 -2.49 0.00 0.00 0.10 0.00 0.00 66.02 63.63 3ig6 s SER 190 CO -0.05 -2.07 0.19 0.00 0.98 0.00 0.00 173.24 172.29 3ig6 n GLN 192 N -0.21 1.59 0.00 0.00 7.27 -1.26 -0.88 117.38 123.89 3ig6 n GLN 192 Ca -0.00 0.58 0.00 0.00 0.07 0.00 0.00 57.00 57.64 3ig6 n GLN 192 Cb 0.21 -2.29 0.00 0.00 2.41 0.00 0.00 30.24 30.57 3ig6 n GLN 192 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 3ig6 n GLY 193 N 3.41 1.55 0.11 1.69 0.00 -1.26 -0.91 105.19 109.78 3ig6 n GLY 193 Ca 0.20 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.34 3ig6 n GLY 193 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3ig6 h ASP 194 N 0.00 0.00 -3.23 1.61 3.32 -1.36 -3.36 116.42 113.40 3ig6 h ASP 194 Ca 0.00 -0.09 -0.58 0.00 0.02 0.00 0.00 57.03 56.38 3ig6 h ASP 194 Cb 0.00 0.00 0.15 0.00 0.22 0.00 0.00 39.33 39.70 3ig6 h ASP 194 CO 0.00 0.05 0.02 -1.20 -1.72 0.00 0.00 179.24 176.39 3ig6 n SER 195 N -2.44 0.55 0.00 6.45 7.64 -1.26 -1.91 113.62 122.65 3ig6 n SER 195 Ca 0.03 0.88 0.00 0.00 1.01 0.00 0.00 58.87 60.79 3ig6 n SER 195 Cb 0.48 -1.33 0.00 0.00 -1.01 0.00 0.00 64.21 62.36 3ig6 n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3ig6 n GLY 196 N 1.36 3.01 3.81 0.23 0.00 -0.55 -1.45 105.19 111.61 3ig6 n GLY 196 Ca 0.12 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.84 3ig6 n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3ig6 s GLY 197 N -1.72 1.59 0.18 -0.02 0.00 -0.80 -3.35 107.32 103.20 3ig6 s GLY 197 Ca 0.00 -0.46 -0.26 0.00 0.00 0.00 0.00 44.72 44.00 3ig6 s GLY 197 CO 0.00 0.05 0.80 2.56 0.00 0.00 0.00 173.10 176.51 3ig6 s PRO 198 N -5.30 4.61 -0.29 2.90 0.04 -1.26 -1.40 135.00 134.29 3ig6 s PRO 198 Ca 0.62 1.20 -0.10 0.00 0.04 0.00 0.00 61.00 62.77 3ig6 s PRO 198 Cb -0.14 -3.25 -0.02 0.00 0.04 0.00 0.00 34.50 31.13 3ig6 s PRO 198 CO 0.53 0.56 0.15 -1.17 0.04 0.00 0.00 177.00 177.10 3ig6 s LEU 199 N -1.19 3.98 -0.09 -3.56 2.96 0.08 -3.40 118.68 117.46 3ig6 s LEU 199 Ca 0.37 -0.37 0.03 0.00 -0.22 0.00 0.00 54.13 53.94 3ig6 s LEU 199 Cb -0.23 -2.01 -0.01 0.00 0.50 0.00 0.00 46.19 44.43 3ig6 s LEU 199 CO 0.27 -0.14 -0.19 -0.69 -1.32 0.00 0.00 176.35 174.28 3ig6 s VAL 200 N 1.65 2.58 -0.03 1.68 1.01 0.56 -1.35 120.40 126.49 3ig6 s VAL 200 Ca 0.05 -0.85 0.07 0.00 0.00 0.00 0.00 61.98 61.25 3ig6 s VAL 200 Cb -0.16 -2.02 -0.01 0.00 0.00 0.00 0.00 36.38 34.18 3ig6 s VAL 200 CO 0.07 0.55 -0.24 0.00 0.00 0.00 0.00 175.10 175.48 3ig6 s SER 202 N -0.38 6.49 -0.28 0.00 0.15 -1.26 -0.83 113.70 117.59 3ig6 s SER 202 Ca 0.04 0.09 -0.07 0.00 0.70 0.00 0.00 55.95 56.71 3ig6 s SER 202 Cb -0.11 -2.46 -0.00 0.00 -1.71 0.00 0.00 66.02 61.74 3ig6 s SER 202 CO 0.01 -1.09 0.06 -0.76 1.20 0.00 0.00 173.24 172.66 3ig6 s LEU 203 N 3.84 3.65 -1.20 3.45 1.43 0.38 -4.52 118.68 125.70 3ig6 s LEU 203 Ca 0.37 -0.57 -0.05 0.00 -1.03 0.00 0.00 54.13 52.85 3ig6 s LEU 203 Cb -0.10 -1.87 0.03 0.00 0.03 0.00 0.00 46.19 44.28 3ig6 s LEU 203 CO 0.26 -0.14 0.29 0.00 0.23 0.00 0.00 176.35 176.99 3ig6 n GLN 204 N 4.87 -3.06 0.00 1.70 6.02 -1.26 -0.70 117.38 124.95 3ig6 n GLN 204 Ca -0.15 0.57 0.00 0.00 -0.01 0.00 0.00 57.00 57.41 3ig6 n GLN 204 Cb 0.49 -5.25 0.00 0.00 1.02 0.00 0.00 30.24 26.50 3ig6 n GLN 204 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3ig6 n GLY 205 N -1.05 3.05 3.71 1.08 0.00 -1.26 -5.03 105.19 105.70 3ig6 n GLY 205 Ca -0.08 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.55 3ig6 n GLY 205 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3ig6 s ARG 206 N -0.19 4.34 -0.05 1.61 1.70 0.12 -5.01 118.95 121.46 3ig6 s ARG 206 Ca 0.00 0.55 -0.30 0.00 -0.47 0.00 0.00 55.73 55.51 3ig6 s ARG 206 Cb 0.00 -3.46 -0.03 0.00 -0.57 0.00 0.00 34.95 30.89 3ig6 s ARG 206 CO 0.00 0.08 1.18 -1.64 -1.08 0.00 0.00 175.30 173.84 3ig6 s MET 207 N 0.85 4.36 -0.07 3.89 -1.94 -1.26 -0.47 119.30 124.66 3ig6 s MET 207 Ca 0.28 1.65 0.05 0.00 -1.71 0.00 0.00 55.69 55.97 3ig6 s MET 207 Cb -0.16 -3.54 -0.01 0.00 2.01 0.00 0.00 34.83 33.13 3ig6 s MET 207 CO 0.12 -0.42 -0.23 0.99 -0.01 0.00 0.00 175.02 175.47 3ig6 s THR 208 N 2.13 1.91 -0.66 2.05 2.01 -0.01 -2.36 115.64 120.71 3ig6 s THR 208 Ca 0.55 -0.97 -0.27 0.00 0.31 0.00 0.00 61.69 61.31 3ig6 s THR 208 Cb -0.24 -1.63 0.01 0.00 0.01 0.00 0.00 72.50 70.65 3ig6 s THR 208 CO 0.22 0.53 1.49 -0.22 -0.69 0.00 0.00 174.62 175.95 3ig6 s LEU 209 N 0.02 3.26 -0.20 4.42 0.20 0.63 -1.75 118.68 125.26 3ig6 s LEU 209 Ca -0.08 -0.03 -0.03 0.00 0.69 0.00 0.00 54.13 54.69 3ig6 s LEU 209 Cb -0.14 -2.67 -0.21 0.00 -0.43 0.00 0.00 46.19 42.73 3ig6 s LEU 209 CO 0.05 -1.97 0.03 0.41 -0.29 0.00 0.00 176.35 174.58 3ig6 n THR 210 N 6.75 1.62 -4.22 3.68 -1.04 -0.46 -4.05 114.28 116.55 3ig6 n THR 210 Ca 0.11 -0.59 -0.13 0.00 -2.04 0.00 0.00 64.05 61.40 3ig6 n THR 210 Cb 0.50 -1.58 -0.10 0.00 -1.82 0.00 0.00 70.33 67.33 3ig6 n THR 210 CO 0.00 0.00 0.00 -0.83 -0.64 0.00 0.00 175.07 173.60 3ig6 s GLY 211 N -6.05 1.23 -0.10 3.41 0.00 -0.85 -2.12 107.32 102.84 3ig6 s GLY 211 Ca -0.30 -1.60 0.03 0.00 0.00 0.00 0.00 44.72 42.86 3ig6 s GLY 211 CO 0.67 -1.49 -0.19 -0.42 0.00 0.00 0.00 173.10 171.67 3ig6 s ILE 212 N -3.80 1.73 0.08 0.90 1.01 -0.78 -0.75 121.20 119.60 3ig6 s ILE 212 Ca 0.26 -0.81 -0.33 0.00 0.00 0.00 0.00 60.65 59.77 3ig6 s ILE 212 Cb 0.07 -1.53 -0.12 0.00 0.01 0.00 0.00 42.46 40.89 3ig6 s ILE 212 CO 0.05 0.49 1.76 0.52 0.00 0.00 0.00 174.94 177.75 3ig6 n VAL 213 N 3.80 0.29 0.07 2.92 0.31 -0.49 -0.41 118.33 124.81 3ig6 n VAL 213 Ca -0.20 -0.05 0.00 0.00 -0.01 0.00 0.00 64.34 64.08 3ig6 n VAL 213 Cb 0.52 -1.84 0.00 0.00 -0.91 0.00 0.00 33.84 31.61 3ig6 n VAL 213 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 3ig6 n SER 214 N 5.10 0.75 -3.00 4.52 2.88 -0.52 -1.48 113.62 121.87 3ig6 n SER 214 Ca 0.19 0.21 -0.09 0.00 -1.33 0.00 0.00 58.87 57.85 3ig6 n SER 214 Cb 0.32 -0.15 0.02 0.00 -0.75 0.00 0.00 64.21 63.65 3ig6 n SER 214 CO 0.00 0.00 0.00 -1.66 -1.23 0.00 0.00 175.04 172.15 3ig6 s TRP 215 N -2.00 0.18 0.00 0.66 1.48 -0.79 -4.91 118.94 113.55 3ig6 s TRP 215 Ca 0.00 -0.81 0.00 0.00 -1.06 0.00 0.00 56.10 54.23 3ig6 s TRP 215 Cb 0.00 0.76 0.00 0.00 -1.16 0.00 0.00 33.47 33.07 3ig6 s TRP 215 CO 0.00 -1.52 0.00 0.41 -4.06 0.00 0.00 176.95 171.78 3ig6 n GLY 216 N -0.53 1.29 2.82 3.67 0.00 -1.26 0.16 105.19 111.34 3ig6 n GLY 216 Ca -0.07 -0.42 -0.29 0.00 0.00 0.00 0.00 46.02 45.24 3ig6 n GLY 216 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3ig6 s ARG 217 N 1.60 1.05 2.44 1.61 6.06 -1.26 -5.00 118.95 125.45 3ig6 s ARG 217 Ca 0.00 -0.69 0.00 0.00 -2.50 0.00 0.00 55.73 52.54 3ig6 s ARG 217 Cb 0.00 -2.31 0.00 0.00 0.06 0.00 0.00 34.95 32.70 3ig6 s ARG 217 CO 0.00 -0.64 0.00 0.41 -2.50 0.00 0.00 175.30 172.57 3ig6 n GLY 218 N 4.88 -0.18 2.97 8.12 0.00 -1.26 -4.50 105.19 115.22 3ig6 n GLY 218 Ca -0.10 -1.02 -0.26 0.00 0.00 0.00 0.00 46.02 44.64 3ig6 n GLY 218 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ig6 n ALA 221 N 4.39 -1.57 -2.57 0.00 0.00 -1.26 -4.98 120.51 114.52 3ig6 n ALA 221 Ca -0.18 0.12 -0.38 0.00 0.00 0.00 0.00 53.44 53.00 3ig6 n ALA 221 Cb 0.51 -3.81 -0.06 0.00 0.00 0.00 0.00 19.45 16.09 3ig6 n ALA 221 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3ig6 s LEU 222 N -7.03 4.43 0.24 0.00 1.02 -1.26 -4.77 118.68 111.31 3ig6 s LEU 222 Ca 0.40 0.88 -0.31 0.00 0.02 0.00 0.00 54.13 55.12 3ig6 s LEU 222 Cb -0.19 -2.55 -0.13 0.00 0.02 0.00 0.00 46.19 43.34 3ig6 s LEU 222 CO 0.79 0.27 1.47 1.17 0.02 0.00 0.00 176.35 180.08 3ig6 n LYS 223 N 2.19 2.20 -1.20 1.70 4.81 -1.26 -1.70 118.16 124.90 3ig6 n LYS 223 Ca -0.13 0.78 -0.07 0.00 -0.87 0.00 0.00 58.31 58.02 3ig6 n LYS 223 Cb 0.52 -2.48 -0.03 0.00 0.02 0.00 0.00 35.03 33.06 3ig6 n LYS 223 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 3ig6 n ASP 223 N 2.32 -4.85 -3.69 3.14 8.00 -1.26 -4.94 116.55 115.27 3ig6 n ASP 223 Ca 0.12 0.17 -0.28 0.00 0.71 0.00 0.00 54.79 55.51 3ig6 n ASP 223 Cb 0.32 -2.97 -0.11 0.00 -0.02 0.00 0.00 41.12 38.34 3ig6 n ASP 223 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 3ig6 s LYS 224 N -2.25 1.74 0.89 -1.24 -0.14 -0.69 -4.36 119.74 113.69 3ig6 s LYS 224 Ca 0.00 -2.72 -0.10 0.00 -1.36 0.00 0.00 55.97 51.79 3ig6 s LYS 224 Cb 0.00 -2.55 0.13 0.00 -1.68 0.00 0.00 37.83 33.73 3ig6 s LYS 224 CO 0.00 -1.31 1.12 -1.25 -0.76 0.00 0.00 175.35 173.16 3ig6 s PRO 225 N -0.66 1.27 0.48 -1.68 0.04 -1.26 -4.43 135.00 128.75 3ig6 s PRO 225 Ca 0.27 1.36 -0.22 0.00 0.04 0.00 0.00 61.00 62.45 3ig6 s PRO 225 Cb -0.04 -1.77 -0.07 0.00 0.04 0.00 0.00 34.50 32.66 3ig6 s PRO 225 CO -0.16 -2.40 1.14 0.20 0.04 0.00 0.00 177.00 175.83 3ig6 s GLY 226 N -2.91 2.73 -0.07 0.56 0.00 -0.34 -4.51 107.32 102.79 3ig6 s GLY 226 Ca 0.65 0.88 0.05 0.00 0.00 0.00 0.00 44.72 46.30 3ig6 s GLY 226 CO 0.58 1.30 -0.23 0.14 0.00 0.00 0.00 173.10 174.90 3ig6 s VAL 227 N -1.62 2.26 0.10 1.40 1.01 0.12 -1.79 120.40 121.89 3ig6 s VAL 227 Ca 0.65 -0.98 0.08 0.00 0.00 0.00 0.00 61.98 61.73 3ig6 s VAL 227 Cb -0.26 -1.85 -0.04 0.00 0.00 0.00 0.00 36.38 34.23 3ig6 s VAL 227 CO 0.32 0.57 -0.21 -0.31 0.00 0.00 0.00 175.10 175.46 3ig6 s TYR 228 N -0.10 1.80 0.18 5.22 1.51 0.80 -1.44 117.35 125.32 3ig6 s TYR 228 Ca -0.05 -0.42 -0.30 0.00 -1.01 0.00 0.00 57.07 55.29 3ig6 s TYR 228 Cb -0.14 -0.98 -0.09 0.00 -0.11 0.00 0.00 41.96 40.63 3ig6 s TYR 228 CO 0.04 0.21 1.37 0.99 -1.11 0.00 0.00 175.55 177.05 3ig6 s THR 229 N -1.17 3.11 -0.67 -0.71 2.01 0.45 -0.62 115.64 118.05 3ig6 s THR 229 Ca 0.07 0.87 -0.22 0.00 0.31 0.00 0.00 61.69 62.72 3ig6 s THR 229 Cb -0.10 -3.56 0.08 0.00 0.01 0.00 0.00 72.50 68.93 3ig6 s THR 229 CO 0.04 0.11 0.94 -0.60 -0.69 0.00 0.00 174.62 174.42 3ig6 s ARG 230 N 0.24 3.13 0.48 4.92 3.52 -0.55 -1.86 118.95 128.83 3ig6 s ARG 230 Ca 0.60 -0.97 0.15 0.00 -0.13 0.00 0.00 55.73 55.38 3ig6 s ARG 230 Cb -0.38 -4.28 1.13 0.00 -1.56 0.00 0.00 34.95 29.86 3ig6 s ARG 230 CO 0.37 -1.77 2.07 0.28 -0.81 0.00 0.00 175.30 175.43 3ig6 h VAL 231 N 5.96 1.07 0.00 7.11 2.07 -1.72 -1.56 116.25 129.18 3ig6 h VAL 231 Ca -0.26 -0.33 0.00 0.00 0.82 0.00 0.00 66.70 66.93 3ig6 h VAL 231 Cb 1.07 1.18 0.00 0.00 -1.52 0.00 0.00 31.29 32.02 3ig6 h VAL 231 CO 1.17 0.09 0.00 -1.54 0.02 0.00 0.00 177.57 177.31 3ig6 n SER 232 N -4.42 0.00 -0.71 0.57 3.41 -1.26 -1.41 113.62 109.79 3ig6 n SER 232 Ca -0.03 0.25 0.08 0.00 -0.26 0.00 0.00 58.87 58.91 3ig6 n SER 232 Cb 0.17 -0.36 0.10 0.00 -0.26 0.00 0.00 64.21 63.86 3ig6 n SER 232 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 3ig6 n HIS 233 N -1.36 0.14 -0.36 7.33 8.25 -0.59 -2.77 115.22 125.86 3ig6 n HIS 233 Ca 0.05 -0.10 0.04 0.00 -0.26 0.00 0.00 57.72 57.44 3ig6 n HIS 233 Cb 0.12 -0.00 0.08 0.00 1.12 0.00 0.00 29.99 31.30 3ig6 n HIS 233 CO 0.00 0.00 0.00 1.19 0.64 0.00 0.00 176.34 178.17 3ig6 n PHE 234 N 0.93 0.15 -0.30 4.41 3.01 -0.50 -4.79 117.46 120.37 3ig6 n PHE 234 Ca 0.11 -0.65 0.00 0.00 1.01 0.00 0.00 57.45 57.93 3ig6 n PHE 234 Cb 0.43 -0.09 0.13 0.00 -0.01 0.00 0.00 39.48 39.94 3ig6 n PHE 234 CO 0.00 0.00 0.00 -0.07 1.01 0.00 0.00 176.76 177.70 3ig6 h LEU 235 N 0.46 0.79 -0.52 4.37 3.38 -1.75 0.79 115.31 122.83 3ig6 h LEU 235 Ca 0.00 0.02 0.02 0.00 0.09 0.00 0.00 57.88 58.01 3ig6 h LEU 235 Cb 0.73 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 41.30 3ig6 h LEU 235 CO 0.02 0.51 0.32 -0.65 0.09 0.00 0.00 178.44 178.72 3ig6 h PRO 236 N 0.93 0.62 -0.52 1.13 0.11 -1.93 0.14 132.00 132.47 3ig6 h PRO 236 Ca 0.36 -0.04 -0.00 0.00 0.11 0.00 0.00 66.00 66.43 3ig6 h PRO 236 Cb 0.17 -0.14 -0.03 0.00 0.11 0.00 0.00 31.00 31.11 3ig6 h PRO 236 CO -0.17 0.41 0.32 2.35 -0.21 0.00 0.00 178.00 180.70 3ig6 h TRP 237 N 0.63 0.67 -0.01 0.65 7.01 -1.59 -0.68 115.95 122.63 3ig6 h TRP 237 Ca 0.21 0.00 -0.00 0.00 2.11 0.00 0.00 58.89 61.21 3ig6 h TRP 237 Cb 0.01 -0.22 -0.00 0.00 -2.10 0.00 0.00 29.16 26.84 3ig6 h TRP 237 CO -0.06 0.45 0.00 0.82 -2.79 0.00 0.00 178.44 176.87 3ig6 h ILE 238 N 0.70 1.15 -0.62 2.65 2.04 -0.61 -2.19 117.51 120.63 3ig6 h ILE 238 Ca 0.19 -0.44 0.05 0.00 1.00 0.00 0.00 64.86 65.65 3ig6 h ILE 238 Cb -0.03 1.43 -0.05 0.00 -0.74 0.00 0.00 36.82 37.43 3ig6 h ILE 238 CO -0.04 0.12 0.35 -0.09 0.00 0.00 0.00 178.15 178.49 3ig6 h ARG 239 N -0.17 0.64 -0.04 2.37 2.43 -0.55 -1.65 114.38 117.41 3ig6 h ARG 239 Ca 0.00 -0.04 -0.21 0.00 -0.81 0.00 0.00 59.98 58.93 3ig6 h ARG 239 Cb 0.19 -0.14 -0.00 0.00 -0.42 0.00 0.00 29.97 29.59 3ig6 h ARG 239 CO -0.00 0.42 -0.84 0.66 -1.51 0.00 0.00 179.97 178.71 3ig6 h SER 240 N 0.66 0.50 0.56 -3.80 4.64 -1.08 -3.10 113.55 111.94 3ig6 h SER 240 Ca 0.27 -0.37 0.00 0.00 -0.47 0.00 0.00 61.79 61.22 3ig6 h SER 240 Cb 0.13 -0.15 0.00 0.00 -0.31 0.00 0.00 62.40 62.07 3ig6 h SER 240 CO -0.16 1.14 -0.15 1.41 -0.87 0.00 0.00 176.83 178.21 3ig6 n HIS 241 N -3.79 0.00 0.62 4.77 8.25 -0.83 -5.11 115.22 119.14 3ig6 n HIS 241 Ca -0.05 0.00 0.07 0.00 -0.26 0.00 0.00 57.72 57.48 3ig6 n HIS 241 Cb 0.77 -0.28 0.06 0.00 1.12 0.00 0.00 29.99 31.66 3ig6 n HIS 241 CO 0.00 0.00 0.00 2.41 0.64 0.00 0.00 176.34 179.39