#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ilq s TYR 8 N 0.00 2.92 -0.22 3.10 1.51 -1.25 -4.79 117.35 118.62 3ilq s TYR 8 Ca 0.00 0.95 -0.16 0.00 -1.01 0.00 0.00 57.07 56.85 3ilq s TYR 8 Cb 0.00 -3.57 -0.04 0.00 -0.11 0.00 0.00 41.96 38.24 3ilq s TYR 8 CO 0.00 -2.02 0.39 0.99 -1.11 0.00 0.00 175.55 173.80 3ilq s THR 9 N 2.57 5.19 -0.32 -0.71 2.01 -1.26 -1.85 115.64 121.27 3ilq s THR 9 Ca 0.60 0.67 -0.12 0.00 0.31 0.00 0.00 61.69 63.16 3ilq s THR 9 Cb -0.28 -3.72 -0.03 0.00 0.01 0.00 0.00 72.50 68.49 3ilq s THR 9 CO 0.23 0.22 0.22 0.12 -0.69 0.00 0.00 174.62 174.72 3ilq s PHE 10 N 1.54 3.22 -0.15 4.92 5.36 0.94 -0.45 117.98 133.35 3ilq s PHE 10 Ca 0.18 -0.16 0.02 0.00 -0.96 0.00 0.00 56.93 56.01 3ilq s PHE 10 Cb -0.15 -2.44 0.01 0.00 -0.34 0.00 0.00 43.02 40.11 3ilq s PHE 10 CO 0.08 -0.32 -0.21 1.03 -1.46 0.00 0.00 175.22 174.35 3ilq s ARG 11 N 1.72 3.02 -0.26 10.12 0.52 -0.13 -1.82 118.95 132.11 3ilq s ARG 11 Ca 0.06 -0.84 -0.10 0.00 -0.52 0.00 0.00 55.73 54.33 3ilq s ARG 11 Cb -0.17 -2.49 -0.04 0.00 0.52 0.00 0.00 34.95 32.77 3ilq s ARG 11 CO 0.10 -0.08 0.15 0.00 0.02 0.00 0.00 175.30 175.49 3ilq s LEU 13 N 1.57 2.63 -0.11 0.00 1.43 -0.20 -0.82 118.68 123.18 3ilq s LEU 13 Ca 0.07 -0.61 -0.02 0.00 -1.03 0.00 0.00 54.13 52.54 3ilq s LEU 13 Cb -0.15 -1.61 -0.03 0.00 0.03 0.00 0.00 46.19 44.43 3ilq s LEU 13 CO 0.08 -0.03 -0.05 -1.58 0.23 0.00 0.00 176.35 175.00 3ilq s GLN 14 N 1.36 3.22 -0.18 1.70 0.74 -0.13 -1.51 119.66 124.87 3ilq s GLN 14 Ca 0.04 -0.52 0.00 0.00 0.05 0.00 0.00 55.36 54.94 3ilq s GLN 14 Cb -0.14 -2.77 0.04 0.00 1.10 0.00 0.00 33.01 31.24 3ilq s GLN 14 CO -0.08 0.47 -0.10 -1.64 -0.55 0.00 0.00 175.29 173.39 3ilq s MET 15 N -0.26 1.95 -0.10 1.67 -1.94 0.19 -0.89 119.30 119.92 3ilq s MET 15 Ca 0.04 -0.70 0.03 0.00 -1.71 0.00 0.00 55.69 53.35 3ilq s MET 15 Cb -0.13 -2.24 0.01 0.00 2.01 0.00 0.00 34.83 34.48 3ilq s MET 15 CO 0.02 -0.38 -0.20 -1.12 -0.01 0.00 0.00 175.02 173.33 3ilq s SER 16 N 1.47 2.75 -0.13 3.03 0.01 0.58 -0.86 113.70 120.54 3ilq s SER 16 Ca 0.01 -0.50 0.01 0.00 1.31 0.00 0.00 55.95 56.78 3ilq s SER 16 Cb -0.15 -1.26 -0.00 0.00 0.21 0.00 0.00 66.02 64.82 3ilq s SER 16 CO -0.09 0.09 -0.17 -0.44 0.41 0.00 0.00 173.24 173.04 3ilq s SER 17 N 0.63 3.56 -0.23 2.44 0.01 -0.12 0.05 113.70 120.03 3ilq s SER 17 Ca -0.13 -0.47 -0.03 0.00 1.31 0.00 0.00 55.95 56.63 3ilq s SER 17 Cb -0.16 -1.53 0.01 0.00 0.21 0.00 0.00 66.02 64.55 3ilq s SER 17 CO 0.04 0.12 -0.06 -0.36 0.41 0.00 0.00 173.24 173.39 3ilq s PHE 18 N 0.59 3.00 -0.14 2.43 0.40 0.19 -0.76 117.98 123.69 3ilq s PHE 18 Ca -0.10 -1.29 -0.18 0.00 -0.60 0.00 0.00 56.93 54.76 3ilq s PHE 18 Cb -0.16 -2.08 -0.25 0.00 0.51 0.00 0.00 43.02 41.05 3ilq s PHE 18 CO 0.03 -0.66 0.46 0.00 0.70 0.00 0.00 175.22 175.76 3ilq h ALA 19 N 8.06 0.21 -2.42 5.36 0.00 -1.37 0.23 119.26 129.32 3ilq h ALA 19 Ca -0.37 -1.09 -0.00 0.00 0.00 0.00 0.00 54.91 53.44 3ilq h ALA 19 Cb 1.13 0.53 0.00 0.00 0.00 0.00 0.00 17.79 19.45 3ilq h ALA 19 CO 0.60 0.76 0.15 0.27 0.00 0.00 0.00 179.25 181.02 3ilq n ASN 20 N -4.09 -1.08 -3.82 0.00 0.23 -1.22 -4.01 115.26 101.28 3ilq n ASN 20 Ca -0.26 -1.73 -0.42 0.00 -0.53 0.00 0.00 54.58 51.65 3ilq n ASN 20 Cb 0.81 1.79 -0.03 0.00 -2.08 0.00 0.00 39.78 40.27 3ilq n ASN 20 CO 0.00 0.00 0.00 0.54 -0.93 0.00 0.00 177.26 176.87 3ilq n ARG 21 N -0.27 0.00 -2.77 -3.83 1.74 -1.26 -2.76 116.66 107.52 3ilq n ARG 21 Ca -0.04 0.00 -0.06 0.00 -0.77 0.00 0.00 57.85 56.98 3ilq n ARG 21 Cb 0.28 -0.87 -0.01 0.00 -1.02 0.00 0.00 32.46 30.85 3ilq n ARG 21 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 3ilq n SER 22 N 1.75 -1.16 -3.82 0.55 3.41 -1.26 -4.88 113.62 108.20 3ilq n SER 22 Ca 0.15 0.27 -0.25 0.00 -0.26 0.00 0.00 58.87 58.79 3ilq n SER 22 Cb 0.22 -1.12 -0.17 0.00 -0.26 0.00 0.00 64.21 62.88 3ilq n SER 22 CO 0.00 0.00 0.00 0.86 -0.16 0.00 0.00 175.04 175.74 3ilq s TRP 23 N -2.17 1.01 0.26 7.33 -0.00 -1.11 -5.10 118.94 119.15 3ilq s TRP 23 Ca 0.11 -0.42 -0.18 0.00 -0.00 0.00 0.00 56.10 55.61 3ilq s TRP 23 Cb -0.06 -0.98 0.01 0.00 -0.00 0.00 0.00 33.47 32.44 3ilq s TRP 23 CO 0.13 -0.41 0.62 -1.54 -0.00 0.00 0.00 176.95 175.75 3ilq s SER 24 N 1.86 -0.22 0.04 5.86 1.04 -1.26 -1.08 113.70 119.95 3ilq s SER 24 Ca 0.05 -0.68 -0.19 0.00 0.48 0.00 0.00 55.95 55.61 3ilq s SER 24 Cb -0.12 0.66 0.04 0.00 0.10 0.00 0.00 66.02 66.70 3ilq s SER 24 CO -0.06 -1.24 0.44 0.00 0.98 0.00 0.00 173.24 173.36 3ilq s ARG 25 N -3.94 0.94 -0.07 4.02 1.70 0.06 -4.99 118.95 116.66 3ilq s ARG 25 Ca 0.14 -0.30 0.03 0.00 -0.47 0.00 0.00 55.73 55.13 3ilq s ARG 25 Cb -0.04 0.42 0.01 0.00 -0.57 0.00 0.00 34.95 34.77 3ilq s ARG 25 CO 0.06 -0.32 -0.16 0.99 -1.08 0.00 0.00 175.30 174.78 3ilq s THR 26 N -2.35 1.44 0.01 4.99 2.01 -1.26 -0.94 115.64 119.53 3ilq s THR 26 Ca -0.06 -0.67 0.02 0.00 0.31 0.00 0.00 61.69 61.30 3ilq s THR 26 Cb -0.01 -1.27 -0.01 0.00 0.01 0.00 0.00 72.50 71.22 3ilq s THR 26 CO -0.01 0.42 -0.08 -1.81 -0.69 0.00 0.00 174.62 172.45 3ilq s ASP 27 N 0.46 0.93 0.10 3.53 1.11 -0.04 -2.60 116.67 120.15 3ilq s ASP 27 Ca -0.14 -0.22 0.05 0.00 0.18 0.00 0.00 52.55 52.43 3ilq s ASP 27 Cb -0.16 -0.08 -0.04 0.00 1.07 0.00 0.00 42.92 43.72 3ilq s ASP 27 CO 0.05 0.04 -0.13 -0.44 1.18 0.00 0.00 175.17 175.87 3ilq s SER 28 N -0.45 1.83 0.05 0.27 0.01 0.59 -0.63 113.70 115.36 3ilq s SER 28 Ca 0.01 -0.76 0.01 0.00 1.31 0.00 0.00 55.95 56.52 3ilq s SER 28 Cb -0.04 -0.05 -0.03 0.00 0.21 0.00 0.00 66.02 66.11 3ilq s SER 28 CO -0.00 -0.14 -0.06 0.68 0.41 0.00 0.00 173.24 174.12 3ilq s VAL 29 N -1.96 0.45 -0.03 3.43 -7.23 -0.57 -0.44 120.40 114.05 3ilq s VAL 29 Ca 0.06 -1.23 0.03 0.00 -1.81 0.00 0.00 61.98 59.03 3ilq s VAL 29 Cb -0.06 -0.77 -0.00 0.00 0.56 0.00 0.00 36.38 36.11 3ilq s VAL 29 CO 0.02 -0.53 -0.12 -0.69 -0.31 0.00 0.00 175.10 173.47 3ilq s VAL 30 N -1.94 1.04 -0.03 1.32 1.01 -0.67 -1.03 120.40 120.10 3ilq s VAL 30 Ca -0.07 -0.50 0.06 0.00 0.00 0.00 0.00 61.98 61.47 3ilq s VAL 30 Cb -0.06 -0.90 -0.01 0.00 0.00 0.00 0.00 36.38 35.40 3ilq s VAL 30 CO -0.01 0.31 -0.20 0.26 0.00 0.00 0.00 175.10 175.45 3ilq s TRP 31 N 0.10 1.89 -0.31 5.22 0.52 -0.10 -0.00 118.94 126.26 3ilq s TRP 31 Ca -0.03 -0.44 0.01 0.00 0.02 0.00 0.00 56.10 55.66 3ilq s TRP 31 Cb -0.09 -1.24 0.07 0.00 -1.15 0.00 0.00 33.47 31.06 3ilq s TRP 31 CO 0.01 -0.10 0.00 -1.17 0.02 0.00 0.00 176.95 175.71 3ilq s LEU 32 N -0.29 4.15 0.00 2.99 2.96 0.23 -0.96 118.68 127.76 3ilq s LEU 32 Ca 0.03 -1.65 0.00 0.00 -0.22 0.00 0.00 54.13 52.29 3ilq s LEU 32 Cb -0.10 -1.65 0.00 0.00 0.50 0.00 0.00 46.19 44.94 3ilq s LEU 32 CO 0.01 -0.31 0.00 0.61 -1.32 0.00 0.00 176.35 175.34 3ilq n GLY 33 N 4.45 3.71 1.35 7.98 0.00 0.41 -2.11 105.19 120.98 3ilq n GLY 33 Ca -0.07 -0.04 0.08 0.00 0.00 0.00 0.00 46.02 45.98 3ilq n GLY 33 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3ilq n ASP 34 N 5.57 3.96 -4.42 1.61 5.68 -1.26 -4.88 116.55 122.81 3ilq n ASP 34 Ca 0.00 -2.36 -0.33 0.00 -0.50 0.00 0.00 54.79 51.59 3ilq n ASP 34 Cb 0.00 -0.52 -0.13 0.00 -1.14 0.00 0.00 41.12 39.33 3ilq n ASP 34 CO 0.00 0.00 0.00 -0.76 -1.33 0.00 0.00 177.20 175.11 3ilq s LEU 35 N -1.59 2.95 0.01 -2.12 1.43 -0.90 -5.07 118.68 113.39 3ilq s LEU 35 Ca 0.42 -0.25 -0.30 0.00 -1.03 0.00 0.00 54.13 52.96 3ilq s LEU 35 Cb 0.27 -1.70 -0.05 0.00 0.03 0.00 0.00 46.19 44.75 3ilq s LEU 35 CO 0.20 0.15 1.22 -1.58 0.23 0.00 0.00 176.35 176.56 3ilq s GLN 36 N 0.49 4.38 -0.07 1.70 0.74 -1.26 -0.60 119.66 125.04 3ilq s GLN 36 Ca -0.06 1.75 0.11 0.00 0.05 0.00 0.00 55.36 57.21 3ilq s GLN 36 Cb -0.15 -3.46 -0.17 0.00 1.10 0.00 0.00 33.01 30.34 3ilq s GLN 36 CO 0.04 -0.37 0.15 0.25 -0.55 0.00 0.00 175.29 174.81 3ilq n THR 37 N 4.28 0.41 -3.87 -0.34 -2.24 1.00 -4.58 114.28 108.94 3ilq n THR 37 Ca 0.10 -0.39 -0.10 0.00 -2.27 0.00 0.00 64.05 61.39 3ilq n THR 37 Cb 0.46 -0.25 -0.09 0.00 -2.10 0.00 0.00 70.33 68.35 3ilq n THR 37 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 3ilq s HIS 38 N -2.56 0.08 0.08 4.78 3.76 -1.18 -1.55 115.29 118.71 3ilq s HIS 38 Ca -0.05 -0.30 0.04 0.00 -0.15 0.00 0.00 55.06 54.60 3ilq s HIS 38 Cb 0.06 -0.06 -0.03 0.00 1.11 0.00 0.00 32.58 33.66 3ilq s HIS 38 CO 0.49 -0.40 -0.11 -0.98 -0.85 0.00 0.00 174.74 172.90 3ilq s ARG 39 N -2.41 0.78 -0.30 1.40 1.70 -0.86 -1.67 118.95 117.59 3ilq s ARG 39 Ca -0.06 -1.01 -0.02 0.00 -0.47 0.00 0.00 55.73 54.16 3ilq s ARG 39 Cb -0.02 -0.58 0.12 0.00 -0.57 0.00 0.00 34.95 33.89 3ilq s ARG 39 CO -0.03 0.11 0.19 -0.46 -1.08 0.00 0.00 175.30 174.02 3ilq s TRP 40 N -1.85 0.17 0.39 5.89 -0.00 0.41 -0.51 118.94 123.44 3ilq s TRP 40 Ca -0.00 -0.81 -0.25 0.00 -0.00 0.00 0.00 56.10 55.04 3ilq s TRP 40 Cb -0.07 -0.78 -0.09 0.00 -0.00 0.00 0.00 33.47 32.53 3ilq s TRP 40 CO 0.01 -0.86 1.06 0.45 -0.00 0.00 0.00 176.95 177.61 3ilq s SER 41 N 2.00 6.79 0.45 5.86 0.15 -1.26 -0.30 113.70 127.39 3ilq s SER 41 Ca 0.11 2.08 0.18 0.00 0.70 0.00 0.00 55.95 59.01 3ilq s SER 41 Cb -0.16 -2.59 1.13 0.00 -1.71 0.00 0.00 66.02 62.69 3ilq s SER 41 CO -0.30 -0.47 1.95 -1.13 1.20 0.00 0.00 173.24 174.50 3ilq h ASN 42 N 2.64 0.29 0.98 5.45 -0.73 -1.89 -0.94 115.58 121.38 3ilq h ASN 42 Ca -0.48 0.01 0.00 0.00 1.87 0.00 0.00 56.30 57.70 3ilq h ASN 42 Cb 1.22 -0.04 0.00 0.00 0.27 0.00 0.00 38.32 39.76 3ilq h ASN 42 CO 0.63 0.16 0.00 0.44 -0.37 0.00 0.00 177.43 178.28 3ilq h ASP 43 N 0.31 0.00 -3.15 1.15 3.32 -1.92 -3.45 116.42 112.68 3ilq h ASP 43 Ca 0.32 0.00 -0.62 0.00 0.02 0.00 0.00 57.03 56.75 3ilq h ASP 43 Cb 0.83 0.00 -0.12 0.00 0.22 0.00 0.00 39.33 40.26 3ilq h ASP 43 CO -0.08 0.00 -0.50 -0.55 -1.72 0.00 0.00 179.24 176.39 3ilq s SER 44 N -5.63 6.14 0.35 6.45 0.15 -0.36 -4.98 113.70 115.82 3ilq s SER 44 Ca 0.01 0.25 0.06 0.00 0.70 0.00 0.00 55.95 56.97 3ilq s SER 44 Cb 0.09 -2.06 0.65 0.00 -1.71 0.00 0.00 66.02 63.00 3ilq s SER 44 CO 0.53 0.23 1.88 0.00 1.20 0.00 0.00 173.24 177.08 3ilq h ALA 45 N 6.32 1.40 -3.00 5.45 0.00 -1.86 -3.44 119.26 124.13 3ilq h ALA 45 Ca -0.43 -0.21 -0.64 0.00 0.00 0.00 0.00 54.91 53.63 3ilq h ALA 45 Cb 1.17 -0.13 -0.17 0.00 0.00 0.00 0.00 17.79 18.67 3ilq h ALA 45 CO 0.71 0.42 -0.78 0.95 0.00 0.00 0.00 179.25 180.55 3ilq s THR 46 N -4.87 2.63 -0.04 0.00 -4.23 -1.26 -4.93 115.64 102.94 3ilq s THR 46 Ca -0.07 -1.97 -0.30 0.00 -1.18 0.00 0.00 61.69 58.17 3ilq s THR 46 Cb 0.15 -2.29 -0.04 0.00 1.34 0.00 0.00 72.50 71.67 3ilq s THR 46 CO 0.76 -0.16 1.23 -0.63 -0.54 0.00 0.00 174.62 175.28 3ilq s ILE 47 N -1.80 4.17 0.16 2.99 1.01 -1.26 -4.77 121.20 121.70 3ilq s ILE 47 Ca 0.23 1.51 -0.23 0.00 0.00 0.00 0.00 60.65 62.16 3ilq s ILE 47 Cb -0.08 -3.97 -0.08 0.00 0.01 0.00 0.00 42.46 38.35 3ilq s ILE 47 CO 0.12 0.01 0.73 -0.44 0.00 0.00 0.00 174.94 175.35 3ilq s SER 48 N 1.51 7.25 0.13 3.58 0.01 0.33 -4.97 113.70 121.55 3ilq s SER 48 Ca 0.57 1.52 -0.27 0.00 1.31 0.00 0.00 55.95 59.08 3ilq s SER 48 Cb -0.26 -2.45 -0.07 0.00 0.21 0.00 0.00 66.02 63.45 3ilq s SER 48 CO 0.23 0.18 0.84 -0.36 0.41 0.00 0.00 173.24 174.54 3ilq s PHE 49 N -1.23 3.85 -0.71 2.43 0.08 -1.26 -2.03 117.98 119.10 3ilq s PHE 49 Ca 0.36 1.67 0.08 0.00 0.12 0.00 0.00 56.93 59.16 3ilq s PHE 49 Cb -0.21 -2.88 0.18 0.00 -0.57 0.00 0.00 43.02 39.54 3ilq s PHE 49 CO 0.24 0.37 1.09 0.25 -0.10 0.00 0.00 175.22 177.07 3ilq n THR 50 N 2.19 0.80 -4.04 0.64 -2.24 -0.59 -4.86 114.28 106.18 3ilq n THR 50 Ca -0.02 -0.90 -0.08 0.00 -2.27 0.00 0.00 64.05 60.77 3ilq n THR 50 Cb 0.49 0.63 -0.11 0.00 -2.10 0.00 0.00 70.33 69.24 3ilq n THR 50 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 3ilq s LYS 51 N -0.93 0.48 0.63 -0.78 -0.14 -1.25 -4.88 119.74 112.87 3ilq s LYS 51 Ca 0.15 -0.92 0.36 0.00 -1.36 0.00 0.00 55.97 54.20 3ilq s LYS 51 Cb 0.08 0.12 2.07 0.00 -1.68 0.00 0.00 37.83 38.41 3ilq s LYS 51 CO 0.11 -0.07 2.27 -1.35 -0.76 0.00 0.00 175.35 175.55 3ilq h PRO 52 N 3.91 0.00 -0.41 -1.68 0.11 -1.96 -2.93 132.00 129.04 3ilq h PRO 52 Ca -0.33 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.78 3ilq h PRO 52 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 3ilq h PRO 52 CO 0.53 0.00 0.00 -2.67 -0.21 0.00 0.00 178.00 175.65 3ilq n TRP 53 N -3.46 0.76 0.33 0.65 4.27 -1.26 -4.71 117.44 114.02 3ilq n TRP 53 Ca -0.02 -0.60 0.04 0.00 -3.89 0.00 0.00 57.50 53.02 3ilq n TRP 53 Cb 0.12 -0.12 0.18 0.00 -1.36 0.00 0.00 31.31 30.13 3ilq n TRP 53 CO 0.00 0.00 0.00 0.43 -2.29 0.00 0.00 177.69 175.83 3ilq n SER 54 N 0.48 0.00 -0.48 -0.67 7.64 -1.11 -0.48 113.62 119.00 3ilq n SER 54 Ca 0.17 0.29 0.12 0.00 1.01 0.00 0.00 58.87 60.47 3ilq n SER 54 Cb 0.61 -0.36 0.26 0.00 -1.01 0.00 0.00 64.21 63.71 3ilq n SER 54 CO 0.00 0.00 0.00 1.67 -3.01 0.00 0.00 175.04 173.70 3ilq n GLN 55 N -1.36 1.35 0.00 1.43 7.27 -1.26 -4.98 117.38 119.82 3ilq n GLN 55 Ca 0.03 -0.96 0.00 0.00 0.07 0.00 0.00 57.00 56.14 3ilq n GLN 55 Cb 0.07 -1.48 0.00 0.00 2.41 0.00 0.00 30.24 31.24 3ilq n GLN 55 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 3ilq n GLY 56 N 1.33 3.72 1.20 1.69 0.00 0.37 -1.52 105.19 111.97 3ilq n GLY 56 Ca 0.13 -0.04 0.08 0.00 0.00 0.00 0.00 46.02 46.19 3ilq n GLY 56 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3ilq n LYS 57 N 13.85 3.53 -2.99 1.61 4.76 -1.25 -4.81 118.16 132.87 3ilq n LYS 57 Ca 0.00 -2.93 -0.40 0.00 -2.87 0.00 0.00 58.31 52.11 3ilq n LYS 57 Cb 0.00 -1.97 -0.05 0.00 -1.84 0.00 0.00 35.03 31.17 3ilq n LYS 57 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 3ilq s LEU 58 N -2.78 4.52 0.88 -0.35 1.43 -0.58 -5.05 118.68 116.75 3ilq s LEU 58 Ca 0.46 1.54 -0.11 0.00 -1.03 0.00 0.00 54.13 54.99 3ilq s LEU 58 Cb 0.36 -3.26 0.12 0.00 0.03 0.00 0.00 46.19 43.45 3ilq s LEU 58 CO 0.11 0.11 1.11 -0.94 0.23 0.00 0.00 176.35 176.96 3ilq s SER 59 N -0.56 3.44 0.24 2.29 1.04 -1.26 -4.74 113.70 114.15 3ilq s SER 59 Ca 0.37 1.86 -0.05 0.00 0.48 0.00 0.00 55.95 58.61 3ilq s SER 59 Cb -0.22 -2.45 0.34 0.00 0.10 0.00 0.00 66.02 63.80 3ilq s SER 59 CO 0.24 -2.72 1.85 0.78 0.98 0.00 0.00 173.24 174.38 3ilq h ASN 60 N -1.60 0.85 -0.13 7.02 2.35 -1.98 0.87 115.58 122.96 3ilq h ASN 60 Ca -0.46 0.02 -0.02 0.00 -0.55 0.00 0.00 56.30 55.29 3ilq h ASN 60 Cb 1.26 -0.16 -0.00 0.00 0.05 0.00 0.00 38.32 39.47 3ilq h ASN 60 CO 0.48 0.54 0.01 1.56 -1.65 0.00 0.00 177.43 178.37 3ilq h GLN 61 N 0.98 0.22 -0.49 0.81 7.50 -1.99 -1.05 115.11 121.09 3ilq h GLN 61 Ca 0.38 -0.07 -0.07 0.00 0.50 0.00 0.00 58.65 59.40 3ilq h GLN 61 Cb 0.18 -0.02 -0.02 0.00 0.05 0.00 0.00 27.48 27.66 3ilq h GLN 61 CO -0.18 0.44 0.02 1.96 -1.50 0.00 0.00 178.83 179.58 3ilq h GLN 62 N -0.03 0.81 -0.64 1.46 1.08 -1.82 -2.22 115.11 113.75 3ilq h GLN 62 Ca 0.04 -0.21 -0.03 0.00 -1.45 0.00 0.00 58.65 57.00 3ilq h GLN 62 Cb 0.34 -0.10 -0.03 0.00 -0.05 0.00 0.00 27.48 27.64 3ilq h GLN 62 CO 0.01 0.80 0.28 2.35 -0.95 0.00 0.00 178.83 181.31 3ilq h TRP 63 N 0.76 0.95 -0.88 2.96 2.91 -0.77 -2.55 115.95 119.34 3ilq h TRP 63 Ca 0.15 -0.06 0.01 0.00 1.13 0.00 0.00 58.89 60.12 3ilq h TRP 63 Cb 0.42 -0.29 -0.04 0.00 -0.51 0.00 0.00 29.16 28.74 3ilq h TRP 63 CO 0.02 0.74 0.57 1.49 -1.03 0.00 0.00 178.44 180.23 3ilq h GLU 64 N 0.89 1.16 -0.36 2.65 4.57 -0.67 -1.24 114.58 121.58 3ilq h GLU 64 Ca 0.22 -0.08 -0.07 0.00 -1.18 0.00 0.00 59.36 58.25 3ilq h GLU 64 Cb 0.17 -0.26 -0.01 0.00 -0.16 0.00 0.00 28.75 28.49 3ilq h GLU 64 CO -0.02 0.78 -0.07 0.87 -1.18 0.00 0.00 179.01 179.39 3ilq h LYS 65 N 1.19 0.68 -0.29 1.92 1.57 -1.33 -1.65 116.57 118.67 3ilq h LYS 65 Ca 0.32 -0.25 -0.09 0.00 -1.87 0.00 0.00 60.65 58.76 3ilq h LYS 65 Cb -0.12 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.13 3ilq h LYS 65 CO -0.07 0.83 -0.19 1.25 -0.57 0.00 0.00 179.45 180.70 3ilq h LEU 66 N 0.48 0.51 0.07 2.94 5.85 -1.21 -1.45 115.31 122.49 3ilq h LEU 66 Ca 0.09 -0.15 -0.00 0.00 0.84 0.00 0.00 57.88 58.66 3ilq h LEU 66 Cb 0.56 -0.14 0.00 0.00 0.37 0.00 0.00 40.66 41.46 3ilq h LEU 66 CO 0.03 0.71 -0.03 -0.61 -0.34 0.00 0.00 178.44 178.20 3ilq h GLN 67 N 0.47 -0.09 -0.92 1.25 4.15 -1.12 -2.62 115.11 116.23 3ilq h GLN 67 Ca 0.08 0.01 0.13 0.00 0.77 0.00 0.00 58.65 59.64 3ilq h GLN 67 Cb 0.59 0.02 -0.09 0.00 0.21 0.00 0.00 27.48 28.21 3ilq h GLN 67 CO 0.04 0.24 0.54 1.25 -1.93 0.00 0.00 178.83 178.98 3ilq h HIS 68 N -0.42 0.97 -0.45 3.99 2.76 -1.09 0.39 115.15 121.30 3ilq h HIS 68 Ca -0.01 0.03 -0.01 0.00 -2.20 0.00 0.00 60.37 58.18 3ilq h HIS 68 Cb 0.37 -0.30 -0.02 0.00 1.55 0.00 0.00 27.41 29.01 3ilq h HIS 68 CO 0.04 0.33 0.23 1.98 -1.30 0.00 0.00 177.93 179.20 3ilq h MET 69 N 0.82 0.65 -0.26 5.26 1.85 -1.29 -0.28 114.93 121.67 3ilq h MET 69 Ca 0.48 -0.09 -0.05 0.00 -0.61 0.00 0.00 59.70 59.43 3ilq h MET 69 Cb 0.56 -0.12 -0.02 0.00 0.43 0.00 0.00 31.60 32.46 3ilq h MET 69 CO -0.30 0.54 -0.07 0.74 -0.40 0.00 0.00 176.91 177.42 3ilq h PHE 70 N 0.59 0.43 -0.40 1.39 0.04 -0.85 0.57 116.94 118.72 3ilq h PHE 70 Ca 0.16 -0.05 -0.12 0.00 2.80 0.00 0.00 57.97 60.76 3ilq h PHE 70 Cb 0.10 -0.12 -0.01 0.00 2.20 0.00 0.00 35.95 38.12 3ilq h PHE 70 CO -0.01 0.49 -0.23 1.96 -0.60 0.00 0.00 178.31 179.91 3ilq h GLN 71 N 0.39 0.86 -0.51 1.51 4.20 0.14 -0.07 115.11 121.64 3ilq h GLN 71 Ca 0.08 -0.39 -0.10 0.00 0.06 0.00 0.00 58.65 58.29 3ilq h GLN 71 Cb 0.37 -0.01 -0.02 0.00 0.30 0.00 0.00 27.48 28.12 3ilq h GLN 71 CO 0.02 1.04 -0.08 0.28 -0.67 0.00 0.00 178.83 179.41 3ilq h VAL 72 N 0.67 1.27 0.15 -0.54 2.07 -0.85 -2.97 116.25 116.05 3ilq h VAL 72 Ca 0.08 -1.22 0.01 0.00 0.82 0.00 0.00 66.70 66.39 3ilq h VAL 72 Cb 0.80 1.01 -0.02 0.00 -1.52 0.00 0.00 31.29 31.57 3ilq h VAL 72 CO 0.07 0.43 -0.19 0.22 0.02 0.00 0.00 177.57 178.12 3ilq h TYR 73 N 0.82 -0.49 -0.85 1.57 3.20 -0.69 0.82 116.97 121.35 3ilq h TYR 73 Ca 0.13 0.01 0.12 0.00 3.14 0.00 0.00 58.73 62.13 3ilq h TYR 73 Cb 0.64 0.20 -0.08 0.00 1.54 0.00 0.00 36.73 39.02 3ilq h TYR 73 CO 0.05 -0.28 0.47 -0.09 -1.64 0.00 0.00 178.16 176.67 3ilq h ARG 74 N -0.39 0.71 0.14 1.82 2.43 -1.05 0.20 114.38 118.24 3ilq h ARG 74 Ca 0.01 -0.04 -0.01 0.00 -0.81 0.00 0.00 59.98 59.13 3ilq h ARG 74 Cb 0.38 -0.16 0.00 0.00 -0.42 0.00 0.00 29.97 29.77 3ilq h ARG 74 CO -0.07 0.47 -0.07 0.28 -1.51 0.00 0.00 179.97 179.07 3ilq h VAL 75 N 0.73 1.01 -0.63 0.20 2.07 -1.33 -2.89 116.25 115.41 3ilq h VAL 75 Ca 0.44 -0.69 0.10 0.00 0.82 0.00 0.00 66.70 67.37 3ilq h VAL 75 Cb 0.52 1.43 -0.08 0.00 -1.52 0.00 0.00 31.29 31.64 3ilq h VAL 75 CO -0.30 0.16 0.23 0.28 0.02 0.00 0.00 177.57 177.96 3ilq h SER 76 N -0.52 0.22 0.17 0.57 0.02 -0.51 -1.97 113.55 111.54 3ilq h SER 76 Ca -0.02 0.08 0.01 0.00 -0.84 0.00 0.00 61.79 61.02 3ilq h SER 76 Cb 0.41 0.07 -0.02 0.00 0.14 0.00 0.00 62.40 62.99 3ilq h SER 76 CO 0.03 0.13 -0.21 0.15 -1.14 0.00 0.00 176.83 175.79 3ilq h PHE 77 N 0.41 -0.55 -0.03 3.45 3.04 -0.66 0.55 116.94 123.14 3ilq h PHE 77 Ca 0.32 0.01 0.02 0.00 3.98 0.00 0.00 57.97 62.30 3ilq h PHE 77 Cb 0.41 0.22 -0.03 0.00 2.56 0.00 0.00 35.95 39.12 3ilq h PHE 77 CO -0.17 -0.31 -0.12 1.15 -2.02 0.00 0.00 178.31 176.84 3ilq h THR 78 N -0.43 0.69 -0.24 4.41 2.02 -1.28 -0.83 112.91 117.25 3ilq h THR 78 Ca 0.01 0.00 0.03 0.00 0.77 0.00 0.00 66.41 67.22 3ilq h THR 78 Cb 0.42 0.69 -0.03 0.00 -1.74 0.00 0.00 68.15 67.49 3ilq h THR 78 CO -0.08 0.00 0.06 -0.09 0.37 0.00 0.00 175.52 175.78 3ilq h ARG 79 N -0.19 0.15 -0.75 6.66 2.43 -1.26 -2.11 114.38 119.31 3ilq h ARG 79 Ca 0.05 -0.01 0.03 0.00 -0.81 0.00 0.00 59.98 59.25 3ilq h ARG 79 Cb 0.27 -0.03 -0.05 0.00 -0.42 0.00 0.00 29.97 29.74 3ilq h ARG 79 CO -0.14 0.10 0.48 -0.44 -1.51 0.00 0.00 179.97 178.45 3ilq h ASP 80 N 0.16 0.78 -0.25 -3.80 3.32 -0.57 0.15 116.42 116.21 3ilq h ASP 80 Ca 0.11 -0.00 -0.17 0.00 0.02 0.00 0.00 57.03 56.98 3ilq h ASP 80 Cb 0.09 -0.17 0.00 0.00 0.22 0.00 0.00 39.33 39.47 3ilq h ASP 80 CO -0.13 0.54 -0.51 0.40 -1.72 0.00 0.00 179.24 177.83 3ilq h ILE 81 N 0.93 1.29 -0.70 0.35 1.08 -1.03 -0.78 117.51 118.66 3ilq h ILE 81 Ca 0.30 -1.70 -0.07 0.00 -0.39 0.00 0.00 64.86 63.00 3ilq h ILE 81 Cb 0.01 1.73 -0.03 0.00 -3.07 0.00 0.00 36.82 35.46 3ilq h ILE 81 CO -0.11 0.55 0.18 1.56 -0.69 0.00 0.00 178.15 179.63 3ilq h GLN 82 N 0.54 1.10 -0.66 2.37 4.20 -1.03 -1.41 115.11 120.21 3ilq h GLN 82 Ca 0.01 -0.25 -0.08 0.00 0.06 0.00 0.00 58.65 58.39 3ilq h GLN 82 Cb 1.11 -0.15 -0.03 0.00 0.30 0.00 0.00 27.48 28.72 3ilq h GLN 82 CO 0.11 0.96 0.10 0.93 -0.67 0.00 0.00 178.83 180.27 3ilq h GLU 83 N 1.05 1.09 -0.13 1.46 4.39 -0.54 -2.25 114.58 119.65 3ilq h GLU 83 Ca 0.22 -0.30 -0.00 0.00 0.34 0.00 0.00 59.36 59.62 3ilq h GLU 83 Cb 0.35 -0.13 -0.01 0.00 -0.10 0.00 0.00 28.75 28.87 3ilq h GLU 83 CO 0.00 1.01 0.08 1.25 -1.16 0.00 0.00 179.01 180.18 3ilq h LEU 84 N 1.01 0.16 -0.59 1.33 5.85 -0.87 -0.30 115.31 121.90 3ilq h LEU 84 Ca 0.20 -0.06 0.06 0.00 0.84 0.00 0.00 57.88 58.92 3ilq h LEU 84 Cb 0.45 -0.04 -0.05 0.00 0.37 0.00 0.00 40.66 41.38 3ilq h LEU 84 CO 0.01 0.17 0.30 0.58 -0.34 0.00 0.00 178.44 179.17 3ilq h VAL 85 N 0.13 0.93 -0.38 1.05 2.07 -1.26 -0.66 116.25 118.14 3ilq h VAL 85 Ca 0.05 -0.19 0.06 0.00 0.82 0.00 0.00 66.70 67.44 3ilq h VAL 85 Cb 0.04 0.32 -0.05 0.00 -1.52 0.00 0.00 31.29 30.08 3ilq h VAL 85 CO -0.01 0.10 0.04 0.50 0.02 0.00 0.00 177.57 178.23 3ilq h LYS 86 N 0.56 0.15 -0.06 1.57 3.64 -1.12 -0.60 116.57 120.72 3ilq h LYS 86 Ca 0.27 -0.01 -0.06 0.00 -1.27 0.00 0.00 60.65 59.58 3ilq h LYS 86 Cb 0.19 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 31.97 3ilq h LYS 86 CO -0.19 0.10 -0.24 1.98 -2.27 0.00 0.00 179.45 178.83 3ilq h MET 87 N 0.16 0.10 0.00 1.90 4.05 -0.63 -3.17 114.93 117.33 3ilq h MET 87 Ca 0.18 -0.03 -0.19 0.00 -0.28 0.00 0.00 59.70 59.38 3ilq h MET 87 Cb 0.23 -0.01 -0.03 0.00 -0.80 0.00 0.00 31.60 30.99 3ilq h MET 87 CO -0.27 0.34 -1.00 0.52 0.23 0.00 0.00 176.91 176.73 3ilq h MET 88 N 0.09 0.00 -6.16 0.39 2.86 -0.28 -3.48 114.93 108.35 3ilq h MET 88 Ca 0.01 0.00 -0.69 0.00 -2.06 0.00 0.00 59.70 56.97 3ilq h MET 88 Cb 0.48 0.00 0.08 0.00 0.06 0.00 0.00 31.60 32.22 3ilq h MET 88 CO 0.03 0.77 -0.01 0.43 1.06 0.00 0.00 176.91 179.20 3ilq n SER 89 N -3.25 0.30 -0.89 1.22 7.64 -0.31 -1.19 113.62 117.13 3ilq n SER 89 Ca -0.02 1.15 0.09 0.00 1.01 0.00 0.00 58.87 61.09 3ilq n SER 89 Cb 0.90 -1.07 0.24 0.00 -1.01 0.00 0.00 64.21 63.26 3ilq n SER 89 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 3ilq n PRO 90 N 1.44 2.13 -0.03 1.43 -0.04 -1.26 -4.97 135.00 133.71 3ilq n PRO 90 Ca 0.17 -1.75 -0.10 0.00 -0.04 0.00 0.00 63.50 61.78 3ilq n PRO 90 Cb 0.21 -1.40 -0.04 0.00 -0.04 0.00 0.00 33.50 32.23 3ilq n PRO 90 CO 0.00 0.00 0.00 0.87 -0.04 0.00 0.00 175.50 176.33 3ilq h LYS 91 N 2.94 0.20 -5.20 0.54 1.57 -1.52 -3.37 116.57 111.74 3ilq h LYS 91 Ca 0.00 -0.01 -0.63 0.00 -1.87 0.00 0.00 60.65 58.13 3ilq h LYS 91 Cb 0.67 -0.05 -0.20 0.00 0.08 0.00 0.00 32.23 32.73 3ilq h LYS 91 CO 0.00 0.13 -0.63 -1.21 -0.57 0.00 0.00 179.45 177.17 3ilq s GLU 92 N -6.18 3.74 0.11 3.15 0.41 -1.26 -5.10 118.70 113.57 3ilq s GLU 92 Ca -0.13 -0.46 0.08 0.00 -0.41 0.00 0.00 54.97 54.05 3ilq s GLU 92 Cb 0.08 -3.10 -0.04 0.00 -1.78 0.00 0.00 34.13 29.29 3ilq s GLU 92 CO 0.69 0.13 -0.21 -0.51 -0.49 0.00 0.00 175.26 174.86 3ilq s ASP 93 N 0.71 2.62 0.66 -0.19 1.11 -1.26 -4.44 116.67 115.88 3ilq s ASP 93 Ca 0.01 -0.72 -0.17 0.00 0.18 0.00 0.00 52.55 51.85 3ilq s ASP 93 Cb -0.14 -0.15 -0.00 0.00 1.07 0.00 0.00 42.92 43.70 3ilq s ASP 93 CO 0.02 0.06 1.22 -0.31 1.18 0.00 0.00 175.17 177.34 3ilq s TYR 94 N -1.28 2.21 0.43 4.23 1.51 -1.26 -4.55 117.35 118.65 3ilq s TYR 94 Ca 0.08 1.54 -0.19 0.00 -1.01 0.00 0.00 57.07 57.50 3ilq s TYR 94 Cb -0.09 -3.51 -0.10 0.00 -0.11 0.00 0.00 41.96 38.15 3ilq s TYR 94 CO 0.05 -2.49 0.92 -1.25 -1.11 0.00 0.00 175.55 171.67 3ilq s PRO 95 N -3.59 4.11 -0.04 -1.71 0.04 -1.26 -5.01 135.00 127.54 3ilq s PRO 95 Ca 0.77 0.98 0.04 0.00 0.04 0.00 0.00 61.00 62.83 3ilq s PRO 95 Cb -0.31 -2.22 -0.00 0.00 0.04 0.00 0.00 34.50 32.01 3ilq s PRO 95 CO 0.39 -0.06 -0.16 0.42 0.04 0.00 0.00 177.00 177.64 3ilq s ILE 96 N -2.26 1.33 -0.17 0.56 1.01 0.80 -4.99 121.20 117.48 3ilq s ILE 96 Ca 0.60 -0.66 0.01 0.00 0.00 0.00 0.00 60.65 60.59 3ilq s ILE 96 Cb -0.09 -1.15 0.02 0.00 0.01 0.00 0.00 42.46 41.25 3ilq s ILE 96 CO 0.19 0.39 -0.19 -1.61 0.00 0.00 0.00 174.94 173.71 3ilq s GLU 97 N 0.07 2.88 -0.06 2.79 0.41 -1.26 0.55 118.70 124.08 3ilq s GLU 97 Ca -0.04 -0.79 0.05 0.00 -0.41 0.00 0.00 54.97 53.79 3ilq s GLU 97 Cb -0.11 -2.49 -0.02 0.00 -1.78 0.00 0.00 34.13 29.73 3ilq s GLU 97 CO 0.02 -0.21 -0.21 0.42 -0.49 0.00 0.00 175.26 174.79 3ilq s ILE 98 N 1.31 2.41 -0.04 -1.63 1.01 0.11 -1.42 121.20 122.94 3ilq s ILE 98 Ca 0.05 -0.94 0.05 0.00 0.00 0.00 0.00 60.65 59.80 3ilq s ILE 98 Cb -0.13 -1.90 -0.01 0.00 0.01 0.00 0.00 42.46 40.43 3ilq s ILE 98 CO -0.12 0.57 -0.18 -1.10 0.00 0.00 0.00 174.94 174.10 3ilq s GLN 99 N -0.29 1.84 -0.06 2.79 -0.21 -0.75 -0.31 119.66 122.67 3ilq s GLN 99 Ca 0.01 -0.65 0.05 0.00 0.02 0.00 0.00 55.36 54.79 3ilq s GLN 99 Cb -0.13 -1.61 -0.01 0.00 1.00 0.00 0.00 33.01 32.26 3ilq s GLN 99 CO 0.03 0.28 -0.22 -1.17 -2.12 0.00 0.00 175.29 172.09 3ilq s LEU 100 N -0.04 2.00 -0.23 2.90 0.20 -0.07 -0.92 118.68 122.51 3ilq s LEU 100 Ca -0.02 -0.45 0.01 0.00 0.69 0.00 0.00 54.13 54.36 3ilq s LEU 100 Cb -0.11 -1.21 0.06 0.00 -0.43 0.00 0.00 46.19 44.50 3ilq s LEU 100 CO 0.02 0.19 -0.08 -0.55 -0.29 0.00 0.00 176.35 175.64 3ilq s SER 101 N -0.01 3.91 -0.01 3.68 0.15 0.23 -0.95 113.70 120.69 3ilq s SER 101 Ca -0.06 -1.17 0.04 0.00 0.70 0.00 0.00 55.95 55.46 3ilq s SER 101 Cb -0.13 -1.29 -0.01 0.00 -1.71 0.00 0.00 66.02 62.87 3ilq s SER 101 CO 0.04 -0.20 -0.12 0.00 1.20 0.00 0.00 173.24 174.15 3ilq s ALA 102 N 1.31 1.05 0.00 5.45 0.00 -0.00 -0.50 121.76 129.07 3ilq s ALA 102 Ca -0.06 -0.52 0.00 0.00 0.00 0.00 0.00 51.96 51.38 3ilq s ALA 102 Cb -0.19 -0.29 0.00 0.00 0.00 0.00 0.00 23.12 22.65 3ilq s ALA 102 CO -0.06 0.24 0.00 0.41 0.00 0.00 0.00 175.76 176.35 3ilq n GLY 103 N 2.87 -0.69 3.25 0.00 0.00 0.02 0.83 105.19 111.47 3ilq n GLY 103 Ca -0.15 -0.42 -0.12 0.00 0.00 0.00 0.00 46.02 45.32 3ilq n GLY 103 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ilq s GLU 105 N -2.05 3.25 0.28 0.00 2.12 -0.32 -0.04 118.70 121.95 3ilq s GLU 105 Ca -0.08 -0.73 -0.08 0.00 0.36 0.00 0.00 54.97 54.43 3ilq s GLU 105 Cb -0.03 -2.65 -0.06 0.00 0.26 0.00 0.00 34.13 31.65 3ilq s GLU 105 CO -0.00 0.04 0.59 -1.64 -0.54 0.00 0.00 175.26 173.71 3ilq s MET 106 N 0.77 3.75 0.08 4.30 -1.94 -0.77 -2.10 119.30 123.38 3ilq s MET 106 Ca -0.06 0.22 0.00 0.00 -1.71 0.00 0.00 55.69 54.15 3ilq s MET 106 Cb -0.15 -2.60 0.00 0.00 2.01 0.00 0.00 34.83 34.09 3ilq s MET 106 CO 0.01 0.22 0.00 0.66 -0.01 0.00 0.00 175.02 175.90 3ilq n TYR 107 N -0.61 -0.11 -0.82 -0.03 4.01 -1.26 -3.88 117.16 114.45 3ilq n TYR 107 Ca 0.00 0.02 0.06 0.00 -0.16 0.00 0.00 57.90 57.82 3ilq n TYR 107 Cb 0.53 0.04 -0.03 0.00 -0.31 0.00 0.00 39.34 39.57 3ilq n TYR 107 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3ilq n ALA 111 N -3.33 -2.37 -3.32 -0.72 0.00 -1.26 -5.04 120.51 104.46 3ilq n ALA 111 Ca 0.00 0.27 -0.10 0.00 0.00 0.00 0.00 53.44 53.61 3ilq n ALA 111 Cb 0.15 -0.84 -0.03 0.00 0.00 0.00 0.00 19.45 18.72 3ilq n ALA 111 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 3ilq s SER 112 N -4.92 -0.34 -0.01 0.00 1.04 -1.26 -5.03 113.70 103.19 3ilq s SER 112 Ca 0.00 -0.33 0.01 0.00 0.48 0.00 0.00 55.95 56.11 3ilq s SER 112 Cb 0.00 0.58 0.00 0.00 0.10 0.00 0.00 66.02 66.70 3ilq s SER 112 CO 0.00 -1.02 -0.03 -1.61 0.98 0.00 0.00 173.24 171.56 3ilq s GLU 113 N -3.83 0.28 0.24 4.02 0.41 -0.89 -5.00 118.70 113.94 3ilq s GLU 113 Ca 0.06 -0.10 0.09 0.00 -0.41 0.00 0.00 54.97 54.61 3ilq s GLU 113 Cb -0.01 -0.29 -0.04 0.00 -1.78 0.00 0.00 34.13 32.00 3ilq s GLU 113 CO -0.06 0.05 -0.03 -1.12 -0.49 0.00 0.00 175.26 173.60 3ilq s SER 114 N 0.05 4.45 0.02 -0.19 0.01 -1.26 -1.17 113.70 115.61 3ilq s SER 114 Ca -0.00 -0.63 -0.06 0.00 1.31 0.00 0.00 55.95 56.57 3ilq s SER 114 Cb -0.03 -0.81 -0.01 0.00 0.21 0.00 0.00 66.02 65.39 3ilq s SER 114 CO -0.00 0.03 0.11 0.72 0.41 0.00 0.00 173.24 174.51 3ilq s PHE 115 N -2.16 0.12 -0.26 2.43 -0.71 -0.06 -4.97 117.98 112.38 3ilq s PHE 115 Ca 0.30 -0.33 -0.02 0.00 -1.04 0.00 0.00 56.93 55.85 3ilq s PHE 115 Cb -0.07 -0.10 0.13 0.00 -1.21 0.00 0.00 43.02 41.77 3ilq s PHE 115 CO 0.19 -0.32 0.31 -1.17 -1.34 0.00 0.00 175.22 172.88 3ilq s LEU 116 N -1.74 -0.36 -0.04 -1.99 0.20 -1.25 -0.80 118.68 112.69 3ilq s LEU 116 Ca -0.10 -0.36 0.04 0.00 0.69 0.00 0.00 54.13 54.40 3ilq s LEU 116 Cb -0.05 0.68 -0.03 0.00 -0.43 0.00 0.00 46.19 46.37 3ilq s LEU 116 CO -0.01 -0.35 -0.16 -1.00 -0.29 0.00 0.00 176.35 174.54 3ilq s HIS 117 N 2.42 2.66 -0.07 5.38 3.76 0.35 -1.64 115.29 128.14 3ilq s HIS 117 Ca 0.10 -0.19 0.03 0.00 -0.15 0.00 0.00 55.06 54.84 3ilq s HIS 117 Cb -0.15 -1.61 0.01 0.00 1.11 0.00 0.00 32.58 31.95 3ilq s HIS 117 CO -0.24 0.17 -0.15 0.08 -0.85 0.00 0.00 174.74 173.75 3ilq s VAL 118 N -0.73 1.37 0.13 -0.90 1.01 0.85 -0.60 120.40 121.53 3ilq s VAL 118 Ca 0.12 -0.62 0.08 0.00 0.00 0.00 0.00 61.98 61.56 3ilq s VAL 118 Cb -0.11 -1.22 -0.04 0.00 0.00 0.00 0.00 36.38 35.01 3ilq s VAL 118 CO 0.01 0.41 -0.12 0.00 0.00 0.00 0.00 175.10 175.40 3ilq s ALA 119 N 0.57 2.89 -0.05 5.51 0.00 -0.10 -0.65 121.76 129.93 3ilq s ALA 119 Ca -0.15 -1.34 0.00 0.00 0.00 0.00 0.00 51.96 50.47 3ilq s ALA 119 Cb -0.16 -0.79 0.02 0.00 0.00 0.00 0.00 23.12 22.19 3ilq s ALA 119 CO 0.05 0.58 -0.02 0.12 0.00 0.00 0.00 175.76 176.49 3ilq s PHE 120 N -1.34 0.67 -1.45 0.00 5.36 0.64 -1.82 117.98 120.05 3ilq s PHE 120 Ca 0.22 -0.17 -0.07 0.00 -0.96 0.00 0.00 56.93 55.94 3ilq s PHE 120 Cb -0.10 -0.68 0.04 0.00 -0.34 0.00 0.00 43.02 41.93 3ilq s PHE 120 CO 0.13 -0.23 0.62 1.04 -1.46 0.00 0.00 175.22 175.32 3ilq n GLN 121 N 4.44 -4.54 -0.92 10.12 1.13 -0.51 -1.95 117.38 125.16 3ilq n GLN 121 Ca -0.19 0.73 0.00 0.00 -1.94 0.00 0.00 57.00 55.60 3ilq n GLN 121 Cb 0.50 -5.54 0.00 0.00 0.11 0.00 0.00 30.24 25.31 3ilq n GLN 121 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3ilq n GLY 122 N -1.43 0.68 3.16 1.08 0.00 -1.26 -5.02 105.19 102.39 3ilq n GLY 122 Ca -0.06 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.66 3ilq n GLY 122 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3ilq s LYS 123 N -0.08 2.65 -0.02 1.61 2.47 -0.82 -5.06 119.74 120.49 3ilq s LYS 123 Ca 0.00 -0.74 -0.30 0.00 -1.56 0.00 0.00 55.97 53.37 3ilq s LYS 123 Cb 0.00 -2.04 -0.08 0.00 -1.46 0.00 0.00 37.83 34.25 3ilq s LYS 123 CO 0.00 0.13 2.02 0.98 0.16 0.00 0.00 175.35 178.64 3ilq n TYR 124 N 3.61 2.40 0.00 4.03 9.36 -1.26 -0.26 117.16 135.04 3ilq n TYR 124 Ca -0.20 -0.31 0.00 0.00 3.32 0.00 0.00 57.90 60.71 3ilq n TYR 124 Cb 0.53 -2.78 0.00 0.00 -0.63 0.00 0.00 39.34 36.45 3ilq n TYR 124 CO 0.00 0.00 0.00 1.33 0.22 0.00 0.00 176.86 178.41 3ilq n VAL 125 N 5.96 0.00 -3.77 2.97 0.24 0.18 -4.85 118.33 119.05 3ilq n VAL 125 Ca 0.22 0.00 -0.13 0.00 -2.04 0.00 0.00 64.34 62.39 3ilq n VAL 125 Cb 0.41 -0.27 -0.10 0.00 -1.47 0.00 0.00 33.84 32.41 3ilq n VAL 125 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 3ilq s VAL 126 N -1.65 0.03 0.06 3.34 1.01 -0.97 -1.20 120.40 121.02 3ilq s VAL 126 Ca 0.00 -0.25 0.01 0.00 0.00 0.00 0.00 61.98 61.73 3ilq s VAL 126 Cb 0.00 -0.52 -0.04 0.00 0.00 0.00 0.00 36.38 35.83 3ilq s VAL 126 CO 0.00 -0.14 -0.05 0.00 0.00 0.00 0.00 175.10 174.91 3ilq s ARG 127 N -0.58 0.65 -0.16 2.72 1.70 -0.37 -0.10 118.95 122.80 3ilq s ARG 127 Ca -0.07 -1.15 -0.11 0.00 -0.47 0.00 0.00 55.73 53.93 3ilq s ARG 127 Cb -0.04 -0.01 -0.05 0.00 -0.57 0.00 0.00 34.95 34.28 3ilq s ARG 127 CO 0.02 -0.05 0.21 0.12 -1.08 0.00 0.00 175.30 174.52 3ilq s PHE 128 N -3.26 3.47 -0.15 5.89 5.36 -0.65 -0.88 117.98 127.77 3ilq s PHE 128 Ca 0.04 0.49 -0.06 0.00 -0.96 0.00 0.00 56.93 56.45 3ilq s PHE 128 Cb 0.03 -2.21 0.07 0.00 -0.34 0.00 0.00 43.02 40.57 3ilq s PHE 128 CO -0.06 0.34 0.31 -0.46 -1.46 0.00 0.00 175.22 173.89 3ilq s TRP 129 N 0.16 -0.51 0.00 10.12 -0.11 -0.40 -4.37 118.94 123.83 3ilq s TRP 129 Ca 0.13 1.10 0.00 0.00 1.22 0.00 0.00 56.10 58.55 3ilq s TRP 129 Cb -0.12 0.08 0.00 0.00 -1.50 0.00 0.00 33.47 31.93 3ilq s TRP 129 CO 0.02 -0.37 0.00 0.41 -4.62 0.00 0.00 176.95 172.39 3ilq n GLY 130 N 5.13 1.71 0.00 5.86 0.00 -1.26 -3.04 105.19 113.59 3ilq n GLY 130 Ca -0.10 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 45.85 3ilq n GLY 130 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3ilq n THR 131 N 0.00 0.95 -3.64 2.61 -2.24 -1.26 -4.90 114.28 105.80 3ilq n THR 131 Ca 0.00 -0.97 -0.12 0.00 -2.27 0.00 0.00 64.05 60.69 3ilq n THR 131 Cb 0.00 0.53 -0.05 0.00 -2.10 0.00 0.00 70.33 68.70 3ilq n THR 131 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 3ilq s SER 132 N -0.95 -0.29 0.36 3.42 1.04 -1.17 -4.93 113.70 111.19 3ilq s SER 132 Ca 0.00 -0.10 -0.27 0.00 0.48 0.00 0.00 55.95 56.06 3ilq s SER 132 Cb 0.00 0.45 -0.09 0.00 0.10 0.00 0.00 66.02 66.48 3ilq s SER 132 CO 0.00 -0.74 1.13 0.26 0.98 0.00 0.00 173.24 174.87 3ilq s TRP 133 N -2.98 3.27 -0.01 5.02 0.52 -1.26 -1.27 118.94 122.23 3ilq s TRP 133 Ca -0.02 1.61 -0.04 0.00 0.02 0.00 0.00 56.10 57.67 3ilq s TRP 133 Cb 0.00 -3.32 -0.00 0.00 -1.15 0.00 0.00 33.47 29.00 3ilq s TRP 133 CO -0.06 -0.97 0.08 1.14 0.02 0.00 0.00 176.95 177.17 3ilq s GLN 134 N -2.03 0.32 0.58 4.98 -2.07 -0.06 -4.93 119.66 116.45 3ilq s GLN 134 Ca 0.53 -0.28 -0.14 0.00 -1.82 0.00 0.00 55.36 53.64 3ilq s GLN 134 Cb -0.30 0.13 -0.05 0.00 -1.09 0.00 0.00 33.01 31.70 3ilq s GLN 134 CO 0.38 -0.06 1.02 0.95 -1.32 0.00 0.00 175.29 176.25 3ilq s THR 135 N -0.94 4.44 0.13 3.63 -4.23 -1.26 -1.24 115.64 116.18 3ilq s THR 135 Ca -0.10 1.01 0.03 0.00 -1.18 0.00 0.00 61.69 61.45 3ilq s THR 135 Cb -0.06 -3.69 -0.04 0.00 1.34 0.00 0.00 72.50 70.05 3ilq s THR 135 CO 0.00 -0.83 0.18 -0.69 -0.54 0.00 0.00 174.62 172.75 3ilq s VAL 136 N -2.82 4.88 0.31 2.29 1.01 -0.34 -4.88 120.40 120.85 3ilq s VAL 136 Ca 0.58 -0.82 -0.29 0.00 0.00 0.00 0.00 61.98 61.45 3ilq s VAL 136 Cb -0.11 -3.46 -0.12 0.00 0.00 0.00 0.00 36.38 32.68 3ilq s VAL 136 CO 0.42 -0.04 1.43 -2.65 0.00 0.00 0.00 175.10 174.26 3ilq n PRO 137 N -0.21 2.33 0.00 2.72 -0.02 -1.26 -2.02 135.00 136.54 3ilq n PRO 137 Ca -0.07 0.82 0.00 0.00 -2.02 0.00 0.00 63.50 62.23 3ilq n PRO 137 Cb 0.53 -2.50 0.00 0.00 -0.02 0.00 0.00 33.50 31.52 3ilq n PRO 137 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3ilq n GLY 138 N 1.44 1.87 3.77 -1.23 0.00 -1.26 -5.06 105.19 104.72 3ilq n GLY 138 Ca 0.07 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.74 3ilq n GLY 138 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ilq s ALA 139 N -2.35 2.68 0.30 4.61 0.00 -0.86 -4.95 121.76 121.20 3ilq s ALA 139 Ca 0.00 0.80 -0.30 0.00 0.00 0.00 0.00 51.96 52.47 3ilq s ALA 139 Cb 0.00 -3.36 -0.11 0.00 0.00 0.00 0.00 23.12 19.65 3ilq s ALA 139 CO 0.00 -0.81 1.55 -2.14 0.00 0.00 0.00 175.76 174.36 3ilq s PRO 140 N -3.35 4.14 0.57 0.00 0.02 -1.26 -4.89 135.00 130.23 3ilq s PRO 140 Ca 0.72 2.53 0.32 0.00 0.02 0.00 0.00 61.00 64.60 3ilq s PRO 140 Cb -0.24 -3.03 1.71 0.00 0.02 0.00 0.00 34.50 32.97 3ilq s PRO 140 CO 0.28 -0.58 2.16 0.66 -0.33 0.00 0.00 177.00 179.19 3ilq h SER 141 N 4.52 0.00 0.24 2.53 4.64 -2.00 -1.83 113.55 121.64 3ilq h SER 141 Ca -0.48 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.84 3ilq h SER 141 Cb 1.22 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.31 3ilq h SER 141 CO 0.76 0.06 0.00 4.11 -0.87 0.00 0.00 176.83 180.89 3ilq h TRP 142 N 0.00 0.00 0.00 4.77 5.08 -2.04 -1.14 115.95 122.62 3ilq h TRP 142 Ca -0.00 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.97 3ilq h TRP 142 Cb 0.23 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.39 3ilq h TRP 142 CO 0.00 0.00 0.00 -0.07 -1.28 0.00 0.00 178.44 177.09 3ilq h LEU 143 N 0.00 0.00 -0.44 0.11 3.38 -1.70 -3.34 115.31 113.31 3ilq h LEU 143 Ca 0.00 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.93 3ilq h LEU 143 Cb 0.12 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.85 3ilq h LEU 143 CO 0.00 0.00 0.12 0.44 0.09 0.00 0.00 178.44 179.09 3ilq h ASP 144 N 0.00 0.65 -0.22 -0.43 3.32 -1.39 -2.21 116.42 116.14 3ilq h ASP 144 Ca 0.00 -0.22 -0.08 0.00 0.02 0.00 0.00 57.03 56.75 3ilq h ASP 144 Cb 0.57 -0.17 -0.00 0.00 0.22 0.00 0.00 39.33 39.95 3ilq h ASP 144 CO 0.00 0.71 -0.17 0.25 -1.72 0.00 0.00 179.24 178.31 3ilq h LEU 145 N 0.57 0.52 -1.29 1.55 5.85 -1.78 -1.45 115.31 119.28 3ilq h LEU 145 Ca 0.14 -0.45 0.01 0.00 0.84 0.00 0.00 57.88 58.42 3ilq h LEU 145 Cb 0.30 -0.15 -0.04 0.00 0.37 0.00 0.00 40.66 41.15 3ilq h LEU 145 CO -0.00 0.86 0.48 -0.65 -0.34 0.00 0.00 178.44 178.79 3ilq h PRO 146 N 0.18 0.94 -0.50 5.25 0.11 -1.75 -1.33 132.00 134.91 3ilq h PRO 146 Ca 0.04 -0.06 -0.05 0.00 0.11 0.00 0.00 66.00 66.05 3ilq h PRO 146 Cb 0.70 -0.21 -0.02 0.00 0.11 0.00 0.00 31.00 31.57 3ilq h PRO 146 CO 0.04 0.62 0.13 0.82 -0.21 0.00 0.00 178.00 179.41 3ilq h ILE 147 N 0.97 1.24 -0.39 4.15 1.08 -1.29 0.93 117.51 124.19 3ilq h ILE 147 Ca 0.27 -0.82 0.04 0.00 -0.39 0.00 0.00 64.86 63.96 3ilq h ILE 147 Cb -0.08 0.83 -0.04 0.00 -3.07 0.00 0.00 36.82 34.45 3ilq h ILE 147 CO -0.06 0.30 0.15 0.50 -0.69 0.00 0.00 178.15 178.34 3ilq h LYS 148 N 0.68 0.30 0.08 2.37 3.64 -1.05 0.23 116.57 122.82 3ilq h LYS 148 Ca 0.16 -0.02 -0.00 0.00 -1.27 0.00 0.00 60.65 59.51 3ilq h LYS 148 Cb 0.31 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 32.07 3ilq h LYS 148 CO -0.00 0.20 -0.04 0.28 -2.27 0.00 0.00 179.45 177.62 3ilq h VAL 149 N 0.31 0.95 -0.89 2.00 2.07 -1.04 -2.22 116.25 117.42 3ilq h VAL 149 Ca 0.18 -0.08 0.13 0.00 0.82 0.00 0.00 66.70 67.75 3ilq h VAL 149 Cb 0.15 1.00 -0.09 0.00 -1.52 0.00 0.00 31.29 30.83 3ilq h VAL 149 CO -0.17 0.02 0.51 0.25 0.02 0.00 0.00 177.57 178.20 3ilq h LEU 150 N -0.14 0.69 -2.37 2.57 5.85 -0.50 -1.31 115.31 120.10 3ilq h LEU 150 Ca -0.01 0.07 -0.01 0.00 0.84 0.00 0.00 57.88 58.78 3ilq h LEU 150 Cb 0.11 -0.05 -0.00 0.00 0.37 0.00 0.00 40.66 41.09 3ilq h LEU 150 CO 0.02 0.33 -0.03 0.78 -0.34 0.00 0.00 178.44 179.20 3ilq h ASN 151 N 0.77 0.00 1.24 1.25 2.35 0.06 -1.80 115.58 119.44 3ilq h ASN 151 Ca 0.47 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.22 3ilq h ASN 151 Cb 0.57 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.94 3ilq h ASN 151 CO -0.31 0.03 0.00 0.00 -1.65 0.00 0.00 177.43 175.49 3ilq h ALA 152 N 1.97 1.00 -0.78 -0.83 0.00 -0.85 -3.39 119.26 116.38 3ilq h ALA 152 Ca -0.00 0.00 -0.52 0.00 0.00 0.00 0.00 54.91 54.39 3ilq h ALA 152 Cb 0.07 0.00 -0.07 0.00 0.00 0.00 0.00 17.79 17.79 3ilq h ALA 152 CO 0.00 0.00 1.55 0.34 0.00 0.00 0.00 179.25 181.14 3ilq s ASP 153 N -4.91 6.04 0.21 0.00 2.15 -0.68 -4.83 116.67 114.65 3ilq s ASP 153 Ca 0.06 -1.79 -0.09 0.00 0.43 0.00 0.00 52.55 51.16 3ilq s ASP 153 Cb 0.10 -2.58 0.27 0.00 -0.30 0.00 0.00 42.92 40.40 3ilq s ASP 153 CO 0.53 -1.98 1.76 1.56 -0.17 0.00 0.00 175.17 176.88 3ilq h GLN 154 N 9.12 0.48 -0.72 4.34 4.20 -1.86 -1.99 115.11 128.68 3ilq h GLN 154 Ca 0.29 -0.03 0.09 0.00 0.06 0.00 0.00 58.65 59.05 3ilq h GLN 154 Cb 0.94 -0.11 -0.07 0.00 0.30 0.00 0.00 27.48 28.54 3ilq h GLN 154 CO 1.35 0.32 0.38 0.78 -0.67 0.00 0.00 178.83 180.99 3ilq h GLY 155 N 0.49 1.08 0.92 3.46 0.00 -1.97 0.15 103.07 107.20 3ilq h GLY 155 Ca 0.30 -0.24 -0.08 0.00 0.00 0.00 0.00 47.33 47.31 3ilq h GLY 155 CO -0.26 0.09 -0.10 -0.84 0.00 0.00 0.00 176.54 175.43 3ilq h THR 156 N 0.65 1.28 -0.44 4.70 2.02 -1.80 -0.72 112.91 118.60 3ilq h THR 156 Ca 0.35 -1.17 0.01 0.00 0.77 0.00 0.00 66.41 66.37 3ilq h THR 156 Cb 0.33 1.36 -0.03 0.00 -1.74 0.00 0.00 68.15 68.08 3ilq h THR 156 CO -0.25 0.38 0.28 -1.28 0.37 0.00 0.00 175.52 175.02 3ilq h SER 157 N 0.42 0.46 -0.86 4.18 0.87 -1.08 0.18 113.55 117.71 3ilq h SER 157 Ca 0.08 -0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.62 3ilq h SER 157 Cb 0.60 -0.10 -0.04 0.00 -0.44 0.00 0.00 62.40 62.42 3ilq h SER 157 CO 0.04 0.33 0.49 0.00 -0.53 0.00 0.00 176.83 177.15 3ilq h ALA 158 N 1.18 1.22 -0.05 6.23 0.00 -0.89 0.02 119.26 126.97 3ilq h ALA 158 Ca 0.17 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 3ilq h ALA 158 Cb -0.03 -0.35 -0.00 0.00 0.00 0.00 0.00 17.79 17.41 3ilq h ALA 158 CO -0.06 0.64 0.00 1.15 0.00 0.00 0.00 179.25 180.98 3ilq h THR 159 N 1.21 1.23 -0.56 0.00 2.02 -0.43 -1.66 112.91 114.72 3ilq h THR 159 Ca 0.31 -0.71 0.01 0.00 0.77 0.00 0.00 66.41 66.79 3ilq h THR 159 Cb 0.01 1.61 -0.03 0.00 -1.74 0.00 0.00 68.15 68.00 3ilq h THR 159 CO -0.05 0.19 0.37 0.58 0.37 0.00 0.00 175.52 176.99 3ilq h VAL 160 N -0.18 1.14 -0.63 3.16 2.07 -0.48 0.20 116.25 121.53 3ilq h VAL 160 Ca 0.02 -0.26 0.03 0.00 0.82 0.00 0.00 66.70 67.31 3ilq h VAL 160 Cb 0.30 0.31 -0.04 0.00 -1.52 0.00 0.00 31.29 30.34 3ilq h VAL 160 CO 0.00 0.14 0.38 1.56 0.02 0.00 0.00 177.57 179.67 3ilq h GLN 161 N 0.76 0.71 -0.03 1.57 4.20 -1.00 0.46 115.11 121.79 3ilq h GLN 161 Ca 0.21 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.88 3ilq h GLN 161 Cb -0.08 -0.16 -0.00 0.00 0.30 0.00 0.00 27.48 27.53 3ilq h GLN 161 CO -0.05 0.47 0.02 1.98 -0.67 0.00 0.00 178.83 180.58 3ilq h MET 162 N 0.74 0.03 -0.40 1.46 4.05 -0.86 0.16 114.93 120.10 3ilq h MET 162 Ca 0.26 -0.00 0.01 0.00 -0.28 0.00 0.00 59.70 59.68 3ilq h MET 162 Cb 0.05 -0.01 -0.02 0.00 -0.80 0.00 0.00 31.60 30.83 3ilq h MET 162 CO -0.12 0.02 0.27 -0.07 0.23 0.00 0.00 176.91 177.24 3ilq h LEU 163 N 0.03 0.46 -0.03 3.39 3.38 -0.68 0.13 115.31 121.99 3ilq h LEU 163 Ca 0.01 -0.01 -0.04 0.00 0.09 0.00 0.00 57.88 57.93 3ilq h LEU 163 Cb -0.00 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.64 3ilq h LEU 163 CO -0.00 0.33 -0.15 -0.07 0.09 0.00 0.00 178.44 178.64 3ilq h LEU 164 N 0.54 0.18 -0.10 1.67 3.38 -0.86 0.55 115.31 120.68 3ilq h LEU 164 Ca 0.15 -0.66 -0.24 0.00 0.09 0.00 0.00 57.88 57.21 3ilq h LEU 164 Cb -0.06 -0.05 0.01 0.00 0.09 0.00 0.00 40.66 40.65 3ilq h LEU 164 CO -0.04 0.81 -0.96 0.78 0.09 0.00 0.00 178.44 179.13 3ilq h ASN 165 N -0.45 0.78 0.00 -0.43 4.21 -0.71 -3.41 115.58 115.58 3ilq h ASN 165 Ca -0.01 -0.60 0.00 0.00 1.21 0.00 0.00 56.30 56.90 3ilq h ASN 165 Cb 0.81 -0.24 0.00 0.00 -1.12 0.00 0.00 38.32 37.77 3ilq h ASN 165 CO 0.03 1.40 -0.23 0.47 -1.29 0.00 0.00 177.43 177.81 3ilq n ASP 166 N -3.83 1.06 0.09 5.81 8.00 0.33 -4.68 116.55 123.33 3ilq n ASP 166 Ca -0.09 0.15 -0.13 0.00 0.71 0.00 0.00 54.79 55.44 3ilq n ASP 166 Cb 0.84 -0.39 -0.06 0.00 -0.02 0.00 0.00 41.12 41.50 3ilq n ASP 166 CO 0.00 0.00 0.00 0.74 -0.39 0.00 0.00 177.20 177.55 3ilq h THR 167 N -0.23 0.34 0.06 -3.53 2.02 -1.21 -2.17 112.91 108.19 3ilq h THR 167 Ca 0.00 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.20 3ilq h THR 167 Cb 0.23 0.34 -0.05 0.00 -1.74 0.00 0.00 68.15 66.93 3ilq h THR 167 CO 0.00 0.00 -0.52 0.00 0.37 0.00 0.00 175.52 175.37 3ilq h PRO 169 N -0.69 0.61 -0.12 0.00 0.11 -1.78 -1.35 132.00 128.78 3ilq h PRO 169 Ca 0.00 -0.07 -0.02 0.00 0.11 0.00 0.00 66.00 66.02 3ilq h PRO 169 Cb 0.72 -0.12 -0.00 0.00 0.11 0.00 0.00 31.00 31.70 3ilq h PRO 169 CO -0.31 0.49 0.01 1.25 -0.21 0.00 0.00 178.00 179.23 3ilq h LEU 170 N 0.62 0.21 -1.13 2.35 5.85 -0.71 -1.42 115.31 121.07 3ilq h LEU 170 Ca 0.15 -0.29 0.05 0.00 0.84 0.00 0.00 57.88 58.63 3ilq h LEU 170 Cb 0.09 -0.06 -0.06 0.00 0.37 0.00 0.00 40.66 41.01 3ilq h LEU 170 CO -0.02 0.45 0.59 0.15 -0.34 0.00 0.00 178.44 179.27 3ilq h PHE 171 N -0.04 1.08 0.03 1.25 3.57 -0.02 -2.84 116.94 119.96 3ilq h PHE 171 Ca 0.04 0.03 -0.25 0.00 3.53 0.00 0.00 57.97 61.31 3ilq h PHE 171 Cb 0.34 -0.36 0.01 0.00 2.79 0.00 0.00 35.95 38.73 3ilq h PHE 171 CO 0.03 0.60 -1.04 0.28 -2.23 0.00 0.00 178.31 175.94 3ilq h VAL 172 N 1.09 1.36 -0.20 1.41 2.07 -1.13 -0.78 116.25 120.08 3ilq h VAL 172 Ca 0.37 -2.47 -0.02 0.00 0.82 0.00 0.00 66.70 65.41 3ilq h VAL 172 Cb 0.09 2.51 -0.01 0.00 -1.52 0.00 0.00 31.29 32.36 3ilq h VAL 172 CO -0.12 0.74 0.05 0.03 0.02 0.00 0.00 177.57 178.29 3ilq h ARG 173 N 0.26 0.27 -0.36 1.57 3.08 -1.16 0.91 114.38 118.95 3ilq h ARG 173 Ca -0.11 -0.03 -0.12 0.00 0.07 0.00 0.00 59.98 59.78 3ilq h ARG 173 Cb 1.70 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 31.68 3ilq h ARG 173 CO 0.19 0.26 -0.28 0.78 -1.07 0.00 0.00 179.97 179.85 3ilq h GLY 174 N 0.45 0.81 0.63 0.04 0.00 -1.21 -2.48 103.07 101.32 3ilq h GLY 174 Ca 0.07 -0.72 -0.00 0.00 0.00 0.00 0.00 47.33 46.68 3ilq h GLY 174 CO -0.00 0.66 -0.01 1.41 0.00 0.00 0.00 176.54 178.60 3ilq h LEU 175 N 0.64 -0.02 -0.45 3.11 3.38 -0.28 -0.85 115.31 120.85 3ilq h LEU 175 Ca 0.08 -0.36 0.09 0.00 0.09 0.00 0.00 57.88 57.78 3ilq h LEU 175 Cb 0.79 0.00 -0.09 0.00 0.09 0.00 0.00 40.66 41.46 3ilq h LEU 175 CO 0.07 0.35 -0.11 -0.07 0.09 0.00 0.00 178.44 178.77 3ilq h LEU 176 N -0.38 -0.41 0.23 1.67 3.38 -0.88 0.97 115.31 119.88 3ilq h LEU 176 Ca -0.00 0.13 -0.01 0.00 0.09 0.00 0.00 57.88 58.10 3ilq h LEU 176 Cb 0.37 0.28 -0.00 0.00 0.09 0.00 0.00 40.66 41.40 3ilq h LEU 176 CO 0.00 -0.15 -0.14 -0.08 0.09 0.00 0.00 178.44 178.17 3ilq h GLU 177 N 0.00 -0.34 0.00 1.13 4.81 -1.42 -2.56 114.58 116.21 3ilq h GLU 177 Ca 0.22 0.02 -0.10 0.00 -0.13 0.00 0.00 59.36 59.37 3ilq h GLU 177 Cb 0.33 0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.77 3ilq h GLU 177 CO -0.46 -0.22 -0.46 0.00 -0.73 0.00 0.00 179.01 177.13 3ilq h ALA 178 N 0.42 0.94 -0.24 2.92 0.00 -0.53 -3.12 119.26 119.64 3ilq h ALA 178 Ca -0.02 -0.42 0.00 0.00 0.00 0.00 0.00 54.91 54.47 3ilq h ALA 178 Cb 0.29 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.00 3ilq h ALA 178 CO 0.03 0.57 0.00 0.41 0.00 0.00 0.00 179.25 180.26 3ilq n GLY 179 N 0.37 1.03 0.27 0.00 0.00 0.33 -4.65 105.19 102.54 3ilq n GLY 179 Ca -0.00 -0.61 0.05 0.00 0.00 0.00 0.00 46.02 45.46 3ilq n GLY 179 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 3ilq h LYS 180 N 3.61 0.19 -0.91 1.61 3.64 -1.39 0.30 116.57 123.62 3ilq h LYS 180 Ca 0.00 -0.01 0.01 0.00 -1.27 0.00 0.00 60.65 59.38 3ilq h LYS 180 Cb 0.79 -0.04 -0.05 0.00 -0.41 0.00 0.00 32.23 32.52 3ilq h LYS 180 CO 0.00 0.13 0.60 1.03 -2.27 0.00 0.00 179.45 178.93 3ilq h SER 181 N 0.19 1.03 0.17 4.20 0.87 -1.86 -0.45 113.55 117.70 3ilq h SER 181 Ca 0.40 -0.02 -0.31 0.00 -1.23 0.00 0.00 61.79 60.63 3ilq h SER 181 Cb 0.70 -0.25 0.03 0.00 -0.44 0.00 0.00 62.40 62.44 3ilq h SER 181 CO -0.56 0.74 -1.31 0.44 -0.53 0.00 0.00 176.83 175.60 3ilq h ASP 182 N 1.21 0.87 -0.13 6.23 5.19 -1.05 -3.20 116.42 125.54 3ilq h ASP 182 Ca 0.34 -0.84 -0.09 0.00 -0.62 0.00 0.00 57.03 55.82 3ilq h ASP 182 Cb -0.11 -0.28 -0.01 0.00 0.18 0.00 0.00 39.33 39.11 3ilq h ASP 182 CO -0.08 1.64 -0.20 -0.07 -3.12 0.00 0.00 179.24 177.41 3ilq h LEU 183 N 0.24 0.54 -3.41 1.55 3.38 -0.42 -3.05 115.31 114.15 3ilq h LEU 183 Ca -0.21 -0.17 -0.03 0.00 0.09 0.00 0.00 57.88 57.56 3ilq h LEU 183 Cb 1.99 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 42.57 3ilq h LEU 183 CO 0.25 0.75 0.04 -0.62 0.09 0.00 0.00 178.44 178.95 3ilq n GLU 184 N -4.15 4.45 -2.44 1.13 1.02 -0.19 -4.98 120.64 115.49 3ilq n GLU 184 Ca 0.00 -2.91 -0.38 0.00 -0.02 0.00 0.00 57.16 53.84 3ilq n GLU 184 Cb 0.38 -2.21 -0.03 0.00 -0.02 0.00 0.00 31.44 29.56 3ilq n GLU 184 CO 0.00 0.00 0.00 -1.59 1.18 0.00 0.00 177.13 176.72 3ilq s LYS 185 N -2.67 4.30 -0.22 3.49 -2.85 -1.15 -5.02 119.74 115.62 3ilq s LYS 185 Ca 0.51 1.72 -0.04 0.00 -1.00 0.00 0.00 55.97 57.16 3ilq s LYS 185 Cb 0.39 -2.81 -0.01 0.00 -2.06 0.00 0.00 37.83 33.34 3ilq s LYS 185 CO 0.14 -0.08 -0.04 -0.65 0.10 0.00 0.00 175.35 174.83 3ilq s GLN 186 N -2.07 3.39 -0.06 1.78 -1.52 -1.26 -3.85 119.66 116.08 3ilq s GLN 186 Ca 0.53 -0.62 0.05 0.00 -1.95 0.00 0.00 55.36 53.37 3ilq s GLN 186 Cb -0.28 -3.01 -0.02 0.00 -0.22 0.00 0.00 33.01 29.48 3ilq s GLN 186 CO 0.36 -0.18 -0.22 -1.21 -0.25 0.00 0.00 175.29 173.79 3ilq s GLU 187 N 1.44 2.54 0.15 2.91 0.41 0.10 -4.95 118.70 121.29 3ilq s GLU 187 Ca 0.05 -0.85 -0.28 0.00 -0.41 0.00 0.00 54.97 53.48 3ilq s GLU 187 Cb -0.14 -2.22 -0.07 0.00 -1.78 0.00 0.00 34.13 29.91 3ilq s GLU 187 CO -0.03 0.44 0.87 0.15 -0.49 0.00 0.00 175.26 176.20 3ilq s LYS 188 N -0.30 4.67 0.54 1.61 1.02 -1.26 -1.72 119.74 124.30 3ilq s LYS 188 Ca 0.01 1.31 -0.16 0.00 0.02 0.00 0.00 55.97 57.15 3ilq s LYS 188 Cb -0.13 -3.32 -0.07 0.00 -0.52 0.00 0.00 37.83 33.80 3ilq s LYS 188 CO 0.02 0.40 1.01 -1.25 -0.92 0.00 0.00 175.35 174.61 3ilq s PRO 189 N -0.63 3.77 -0.06 -1.68 0.04 -1.26 -4.14 135.00 131.04 3ilq s PRO 189 Ca 0.41 1.01 0.06 0.00 0.04 0.00 0.00 61.00 62.51 3ilq s PRO 189 Cb -0.23 -2.11 -0.01 0.00 0.04 0.00 0.00 34.50 32.19 3ilq s PRO 189 CO 0.28 -0.42 -0.25 0.08 0.04 0.00 0.00 177.00 176.73 3ilq s VAL 190 N -2.61 2.09 0.13 -0.36 1.01 0.86 -4.93 120.40 116.59 3ilq s VAL 190 Ca 0.60 -1.05 0.09 0.00 0.00 0.00 0.00 61.98 61.62 3ilq s VAL 190 Cb -0.11 -1.76 -0.04 0.00 0.00 0.00 0.00 36.38 34.47 3ilq s VAL 190 CO 0.34 0.57 -0.17 0.00 0.00 0.00 0.00 175.10 175.84 3ilq s ALA 191 N -0.12 2.73 0.04 5.51 0.00 -1.26 -1.01 121.76 127.66 3ilq s ALA 191 Ca -0.05 -1.38 -0.14 0.00 0.00 0.00 0.00 51.96 50.39 3ilq s ALA 191 Cb -0.14 -0.66 0.02 0.00 0.00 0.00 0.00 23.12 22.34 3ilq s ALA 191 CO 0.04 0.57 0.31 1.67 0.00 0.00 0.00 175.76 178.35 3ilq s TRP 192 N -1.27 -0.11 0.14 0.00 -2.14 -0.31 -4.97 118.94 110.27 3ilq s TRP 192 Ca 0.19 -0.01 0.07 0.00 2.66 0.00 0.00 56.10 59.01 3ilq s TRP 192 Cb -0.10 0.10 -0.04 0.00 -3.10 0.00 0.00 33.47 30.33 3ilq s TRP 192 CO 0.11 -0.51 -0.05 -0.51 -2.66 0.00 0.00 176.95 173.33 3ilq s LEU 193 N -2.05 3.17 0.00 -4.66 1.43 -1.26 -0.10 118.68 115.21 3ilq s LEU 193 Ca -0.05 -0.40 -0.13 0.00 -1.03 0.00 0.00 54.13 52.52 3ilq s LEU 193 Cb -0.01 -1.89 0.05 0.00 0.03 0.00 0.00 46.19 44.37 3ilq s LEU 193 CO -0.03 0.13 0.73 -1.54 0.23 0.00 0.00 176.35 175.87 3ilq n SER 194 N 0.27 -2.11 -0.27 2.29 3.41 -0.49 -5.00 113.62 111.72 3ilq n SER 194 Ca -0.11 -2.54 0.00 0.00 -0.26 0.00 0.00 58.87 55.96 3ilq n SER 194 Cb 0.54 3.54 0.00 0.00 -0.26 0.00 0.00 64.21 68.03 3ilq n SER 194 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 3ilq n SER 195 N -1.52 0.00 0.00 4.04 3.41 -1.26 -0.47 113.62 117.82 3ilq n SER 195 Ca -0.08 -0.27 0.00 0.00 -0.26 0.00 0.00 58.87 58.26 3ilq n SER 195 Cb 0.56 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.51 3ilq n SER 195 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 3ilq n ARG 204 N 0.00 0.00 -3.88 4.33 1.74 0.26 -4.97 116.66 114.15 3ilq n ARG 204 Ca 0.00 0.00 -0.35 0.00 -0.77 0.00 0.00 57.85 56.73 3ilq n ARG 204 Cb 0.00 0.00 -0.10 0.00 -1.02 0.00 0.00 32.46 31.34 3ilq n ARG 204 CO 0.00 0.00 0.00 -1.14 -1.52 0.00 0.00 177.63 174.97 3ilq s GLN 205 N -3.22 3.93 -0.23 5.56 0.74 -1.26 -0.19 119.66 125.00 3ilq s GLN 205 Ca 0.00 -0.35 -0.10 0.00 0.05 0.00 0.00 55.36 54.96 3ilq s GLN 205 Cb 0.00 -3.32 -0.05 0.00 1.10 0.00 0.00 33.01 30.75 3ilq s GLN 205 CO 0.00 0.13 0.14 -0.51 -0.55 0.00 0.00 175.29 174.50 3ilq s LEU 206 N 0.79 4.05 -0.15 3.68 1.02 0.95 -4.92 118.68 124.11 3ilq s LEU 206 Ca 0.05 0.10 -0.02 0.00 0.02 0.00 0.00 54.13 54.28 3ilq s LEU 206 Cb -0.13 -2.07 -0.02 0.00 0.02 0.00 0.00 46.19 43.98 3ilq s LEU 206 CO 0.02 0.09 -0.08 -0.69 0.02 0.00 0.00 176.35 175.71 3ilq s VAL 207 N 0.91 3.47 -0.27 -1.59 1.01 0.38 -0.48 120.40 123.82 3ilq s VAL 207 Ca 0.07 -0.51 -0.02 0.00 0.00 0.00 0.00 61.98 61.52 3ilq s VAL 207 Cb -0.13 -2.50 0.03 0.00 0.00 0.00 0.00 36.38 33.79 3ilq s VAL 207 CO 0.03 0.50 -0.02 0.00 0.00 0.00 0.00 175.10 175.62 3ilq s HIS 209 N 1.32 3.41 -0.20 0.00 3.76 0.85 -1.01 115.29 123.43 3ilq s HIS 209 Ca -0.02 0.42 -0.01 0.00 -0.15 0.00 0.00 55.06 55.30 3ilq s HIS 209 Cb -0.18 -2.25 0.06 0.00 1.11 0.00 0.00 32.58 31.32 3ilq s HIS 209 CO -0.02 0.23 -0.01 0.08 -0.85 0.00 0.00 174.74 174.17 3ilq s VAL 210 N 0.52 0.94 0.05 -0.90 1.01 0.21 -1.17 120.40 121.07 3ilq s VAL 210 Ca 0.11 -0.76 0.05 0.00 0.00 0.00 0.00 61.98 61.38 3ilq s VAL 210 Cb -0.12 -1.30 -0.03 0.00 0.00 0.00 0.00 36.38 34.93 3ilq s VAL 210 CO 0.01 -0.11 -0.15 -0.55 0.00 0.00 0.00 175.10 174.30 3ilq s SER 211 N 1.68 1.78 0.00 3.32 0.15 -0.18 0.46 113.70 120.91 3ilq s SER 211 Ca -0.02 -0.53 0.00 0.00 0.70 0.00 0.00 55.95 56.10 3ilq s SER 211 Cb -0.17 -0.10 0.00 0.00 -1.71 0.00 0.00 66.02 64.04 3ilq s SER 211 CO -0.07 0.01 0.00 0.61 1.20 0.00 0.00 173.24 174.99 3ilq n GLY 212 N 1.65 0.77 3.87 9.45 0.00 0.23 -0.10 105.19 121.06 3ilq n GLY 212 Ca -0.19 -0.07 -0.31 0.00 0.00 0.00 0.00 46.02 45.45 3ilq n GLY 212 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3ilq s PHE 213 N -2.00 3.43 -0.28 1.61 -0.71 -1.21 -3.99 117.98 114.84 3ilq s PHE 213 Ca 0.00 1.09 -0.22 0.00 -1.04 0.00 0.00 56.93 56.76 3ilq s PHE 213 Cb 0.00 -2.45 0.10 0.00 -1.21 0.00 0.00 43.02 39.46 3ilq s PHE 213 CO 0.00 0.00 0.88 -0.47 -1.34 0.00 0.00 175.22 174.29 3ilq s TYR 214 N -2.18 -0.68 1.13 3.49 6.14 -0.70 -0.76 117.35 123.80 3ilq s TYR 214 Ca 0.52 1.54 -0.18 0.00 0.64 0.00 0.00 57.07 59.59 3ilq s TYR 214 Cb -0.10 0.38 0.26 0.00 0.42 0.00 0.00 41.96 42.91 3ilq s TYR 214 CO 0.25 -0.33 1.15 -1.25 0.64 0.00 0.00 175.55 176.01 3ilq s PRO 215 N 0.69 -0.69 0.22 4.97 0.04 -1.25 0.03 135.00 139.01 3ilq s PRO 215 Ca -0.02 -0.10 -0.08 0.00 0.04 0.00 0.00 61.00 60.85 3ilq s PRO 215 Cb -0.05 -1.66 0.34 0.00 0.04 0.00 0.00 34.50 33.17 3ilq s PRO 215 CO -0.08 -3.35 1.73 -0.22 0.04 0.00 0.00 177.00 175.12 3ilq h LYS 216 N -2.32 0.37 -6.49 4.56 3.64 -1.98 -3.44 116.57 110.92 3ilq h LYS 216 Ca -0.45 -0.02 -0.61 0.00 -1.27 0.00 0.00 60.65 58.30 3ilq h LYS 216 Cb 1.29 -0.08 0.08 0.00 -0.41 0.00 0.00 32.23 33.10 3ilq h LYS 216 CO 0.37 0.24 0.54 -2.30 -2.27 0.00 0.00 179.45 176.04 3ilq n PRO 217 N -5.03 1.77 -3.71 1.90 -0.02 -1.26 -4.95 135.00 123.70 3ilq n PRO 217 Ca 0.10 0.63 -0.10 0.00 -2.02 0.00 0.00 63.50 62.12 3ilq n PRO 217 Cb 0.33 -2.26 -0.04 0.00 -0.02 0.00 0.00 33.50 31.51 3ilq n PRO 217 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 3ilq s VAL 218 N 0.09 0.03 -0.05 -1.45 0.11 -1.26 -4.68 120.40 113.18 3ilq s VAL 218 Ca 0.72 -0.70 -0.00 0.00 -2.93 0.00 0.00 61.98 59.06 3ilq s VAL 218 Cb -0.73 -1.51 0.03 0.00 -1.53 0.00 0.00 36.38 32.64 3ilq s VAL 218 CO 0.48 -0.12 -0.01 0.86 -3.33 0.00 0.00 175.10 172.99 3ilq s TRP 219 N -3.86 0.57 -0.09 1.54 -0.00 -0.58 -5.00 118.94 111.53 3ilq s TRP 219 Ca 0.08 -0.11 -0.00 0.00 -0.00 0.00 0.00 56.10 56.06 3ilq s TRP 219 Cb -0.01 -0.66 0.02 0.00 -0.00 0.00 0.00 33.47 32.82 3ilq s TRP 219 CO -0.04 -0.24 -0.05 0.08 -0.00 0.00 0.00 176.95 176.70 3ilq s VAL 220 N 1.52 0.74 -0.02 5.86 1.01 -1.26 -0.60 120.40 127.65 3ilq s VAL 220 Ca -0.02 -0.13 -0.03 0.00 0.00 0.00 0.00 61.98 61.80 3ilq s VAL 220 Cb -0.13 -0.81 0.00 0.00 0.00 0.00 0.00 36.38 35.45 3ilq s VAL 220 CO -0.03 0.31 0.07 -0.32 0.00 0.00 0.00 175.10 175.13 3ilq s MET 221 N 1.67 0.16 0.05 2.72 0.00 -0.31 -4.94 119.30 118.63 3ilq s MET 221 Ca 0.02 -0.03 -0.26 0.00 0.00 0.00 0.00 55.69 55.41 3ilq s MET 221 Cb -0.13 0.07 -0.05 0.00 0.00 0.00 0.00 34.83 34.72 3ilq s MET 221 CO -0.06 -0.03 0.82 -1.58 0.00 0.00 0.00 175.02 174.18 3ilq s TRP 222 N -0.29 3.73 0.12 4.11 0.52 -1.26 -0.70 118.94 125.17 3ilq s TRP 222 Ca -0.03 1.55 0.08 0.00 0.02 0.00 0.00 56.10 57.71 3ilq s TRP 222 Cb -0.02 -2.90 -0.04 0.00 -1.15 0.00 0.00 33.47 29.36 3ilq s TRP 222 CO 0.00 0.22 -0.18 -1.64 0.02 0.00 0.00 176.95 175.37 3ilq s MET 223 N 0.12 1.11 -0.33 4.98 -1.94 0.26 -0.20 119.30 123.31 3ilq s MET 223 Ca 0.42 -1.23 0.03 0.00 -1.71 0.00 0.00 55.69 53.20 3ilq s MET 223 Cb -0.21 -1.22 0.10 0.00 2.01 0.00 0.00 34.83 35.51 3ilq s MET 223 CO 0.25 0.26 0.05 0.50 -0.01 0.00 0.00 175.02 176.06 3ilq s ARG 224 N -2.30 1.39 7.90 2.03 3.52 -0.47 -1.23 118.95 129.80 3ilq s ARG 224 Ca 0.09 -1.68 0.00 0.00 -0.13 0.00 0.00 55.73 54.01 3ilq s ARG 224 Cb -0.08 -2.96 0.00 0.00 -1.56 0.00 0.00 34.95 30.35 3ilq s ARG 224 CO 0.04 -0.92 0.00 0.41 -0.81 0.00 0.00 175.30 174.03 3ilq n GLY 225 N 4.38 3.62 0.14 8.12 0.00 -1.26 -1.94 105.19 118.25 3ilq n GLY 225 Ca 0.01 -0.06 0.12 0.00 0.00 0.00 0.00 46.02 46.10 3ilq n GLY 225 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3ilq n ASP 226 N 8.40 0.82 -4.60 1.61 8.00 -1.26 -4.89 116.55 124.62 3ilq n ASP 226 Ca 0.00 -0.63 -0.42 0.00 0.71 0.00 0.00 54.79 54.45 3ilq n ASP 226 Cb 0.00 0.22 -0.05 0.00 -0.02 0.00 0.00 41.12 41.27 3ilq n ASP 226 CO 0.00 0.00 0.00 -1.58 -0.39 0.00 0.00 177.20 175.23 3ilq s GLN 227 N -2.73 3.89 0.14 -1.24 0.74 -0.82 -5.01 119.66 114.63 3ilq s GLN 227 Ca 0.18 0.49 -0.32 0.00 0.05 0.00 0.00 55.36 55.76 3ilq s GLN 227 Cb 0.18 -3.75 -0.12 0.00 1.10 0.00 0.00 33.01 30.42 3ilq s GLN 227 CO 0.61 -0.73 1.77 0.39 -0.55 0.00 0.00 175.29 176.78 3ilq n GLU 228 N 6.27 2.67 -2.87 1.67 1.02 -1.26 -1.36 120.64 126.78 3ilq n GLU 228 Ca 0.03 0.97 -0.43 0.00 -0.02 0.00 0.00 57.16 57.72 3ilq n GLU 228 Cb 0.48 -2.83 -0.04 0.00 -0.02 0.00 0.00 31.44 29.03 3ilq n GLU 228 CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 3ilq s GLN 229 N 2.09 3.72 0.35 3.49 -1.52 0.73 -4.93 119.66 123.59 3ilq s GLN 229 Ca 0.80 0.36 0.04 0.00 -1.95 0.00 0.00 55.36 54.61 3ilq s GLN 229 Cb -0.53 -3.84 0.64 0.00 -0.22 0.00 0.00 33.01 29.06 3ilq s GLN 229 CO 0.37 -0.98 1.92 -0.56 -0.25 0.00 0.00 175.29 175.79 3ilq h GLN 230 N 8.62 0.59 0.00 2.91 3.07 -1.93 -2.67 115.11 125.71 3ilq h GLN 230 Ca -0.24 -0.10 0.00 0.00 0.09 0.00 0.00 58.65 58.40 3ilq h GLN 230 Cb 1.08 -0.10 0.00 0.00 0.08 0.00 0.00 27.48 28.54 3ilq h GLN 230 CO 0.96 0.53 0.00 0.41 0.09 0.00 0.00 178.83 180.83 3ilq n GLY 231 N -1.05 -0.51 3.63 0.06 0.00 -1.26 -4.80 105.19 101.25 3ilq n GLY 231 Ca 0.03 -0.09 -0.48 0.00 0.00 0.00 0.00 46.02 45.47 3ilq n GLY 231 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 3ilq n THR 232 N -0.96 0.47 -3.47 2.61 -1.04 -1.01 -4.68 114.28 106.19 3ilq n THR 232 Ca 0.11 -0.18 -0.42 0.00 -2.04 0.00 0.00 64.05 61.52 3ilq n THR 232 Cb 0.05 -1.91 -0.10 0.00 -1.82 0.00 0.00 70.33 66.56 3ilq n THR 232 CO 0.00 0.00 0.00 -1.00 -0.64 0.00 0.00 175.07 173.43 3ilq s HIS 233 N 5.30 3.23 0.17 -1.42 3.76 0.56 -4.93 115.29 121.95 3ilq s HIS 233 Ca 0.97 -0.39 -0.30 0.00 -0.15 0.00 0.00 55.06 55.20 3ilq s HIS 233 Cb -0.69 -2.58 -0.07 0.00 1.11 0.00 0.00 32.58 30.35 3ilq s HIS 233 CO 0.49 -0.50 0.97 0.50 -0.85 0.00 0.00 174.74 175.35 3ilq s ARG 234 N 1.77 4.74 0.20 1.40 3.52 -1.26 -1.06 118.95 128.26 3ilq s ARG 234 Ca 0.07 1.50 -0.02 0.00 -0.13 0.00 0.00 55.73 57.15 3ilq s ARG 234 Cb -0.18 -3.33 0.04 0.00 -1.56 0.00 0.00 34.95 29.92 3ilq s ARG 234 CO 0.11 0.31 0.28 0.41 -0.81 0.00 0.00 175.30 175.59 3ilq n GLY 235 N 1.94 0.03 3.79 8.12 0.00 -0.15 -4.99 105.19 113.93 3ilq n GLY 235 Ca 0.01 -1.87 -0.34 0.00 0.00 0.00 0.00 46.02 43.82 3ilq n GLY 235 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3ilq s ASP 236 N -2.09 5.79 -0.18 1.61 1.01 -1.26 -4.84 116.67 116.71 3ilq s ASP 236 Ca 0.17 1.97 -0.29 0.00 0.71 0.00 0.00 52.55 55.11 3ilq s ASP 236 Cb -0.01 -2.56 0.00 0.00 1.01 0.00 0.00 42.92 41.37 3ilq s ASP 236 CO 0.12 -1.17 1.04 -0.36 0.21 0.00 0.00 175.17 175.01 3ilq s PHE 237 N -2.14 3.38 -0.10 4.23 0.08 -1.26 -4.56 117.98 117.61 3ilq s PHE 237 Ca 0.67 1.50 0.01 0.00 0.12 0.00 0.00 56.93 59.23 3ilq s PHE 237 Cb -0.19 -3.25 -0.02 0.00 -0.57 0.00 0.00 43.02 38.99 3ilq s PHE 237 CO 0.31 -0.44 -0.13 -0.51 -0.10 0.00 0.00 175.22 174.34 3ilq s LEU 238 N 2.77 2.74 0.35 -0.37 1.43 -0.56 -4.96 118.68 120.08 3ilq s LEU 238 Ca 0.46 -0.28 -0.17 0.00 -1.03 0.00 0.00 54.13 53.11 3ilq s LEU 238 Cb -0.17 -1.60 -0.10 0.00 0.03 0.00 0.00 46.19 44.36 3ilq s LEU 238 CO 0.11 0.22 0.81 -2.16 0.23 0.00 0.00 176.35 175.56 3ilq s PRO 239 N -0.00 4.10 0.56 1.29 0.04 -1.26 0.01 135.00 139.74 3ilq s PRO 239 Ca -0.04 0.84 -0.02 0.00 0.04 0.00 0.00 61.00 61.82 3ilq s PRO 239 Cb -0.14 -2.38 0.02 0.00 0.04 0.00 0.00 34.50 32.04 3ilq s PRO 239 CO 0.04 0.11 0.82 -0.80 0.04 0.00 0.00 177.00 177.21 3ilq s ASN 240 N -2.19 5.46 0.00 6.66 0.01 0.98 -4.84 114.94 121.02 3ilq s ASN 240 Ca 0.56 0.36 0.30 0.00 -0.71 0.00 0.00 52.86 53.37 3ilq s ASN 240 Cb -0.10 -1.35 1.46 0.00 0.41 0.00 0.00 41.25 41.66 3ilq s ASN 240 CO 0.16 -1.06 2.02 0.00 -1.51 0.00 0.00 177.10 176.71 3ilq n ALA 241 N -2.43 2.44 -1.44 0.60 0.00 -1.26 -3.53 120.51 114.89 3ilq n ALA 241 Ca 0.05 -0.13 -0.16 0.00 0.00 0.00 0.00 53.44 53.20 3ilq n ALA 241 Cb 0.59 -1.48 0.16 0.00 0.00 0.00 0.00 19.45 18.71 3ilq n ALA 241 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 3ilq n ASP 242 N -1.33 3.73 -3.69 0.00 5.75 -1.26 -4.90 116.55 114.85 3ilq n ASP 242 Ca 0.13 -3.75 -0.25 0.00 -0.01 0.00 0.00 54.79 50.91 3ilq n ASP 242 Cb 0.26 -0.71 0.06 0.00 -1.03 0.00 0.00 41.12 39.70 3ilq n ASP 242 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 3ilq n GLU 243 N -1.07 -7.07 -4.42 0.11 1.02 -1.23 -5.00 120.64 102.99 3ilq n GLU 243 Ca 0.45 0.75 -0.20 0.00 -0.02 0.00 0.00 57.16 58.14 3ilq n GLU 243 Cb 1.15 -5.74 -0.10 0.00 -0.02 0.00 0.00 31.44 26.72 3ilq n GLU 243 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 3ilq s THR 244 N -3.33 0.98 0.26 2.62 -4.23 -1.26 -4.90 115.64 105.78 3ilq s THR 244 Ca 0.56 -2.00 0.08 0.00 -1.18 0.00 0.00 61.69 59.15 3ilq s THR 244 Cb -0.26 -2.72 -0.04 0.00 1.34 0.00 0.00 72.50 70.82 3ilq s THR 244 CO 0.76 0.00 0.13 0.26 -0.54 0.00 0.00 174.62 175.24 3ilq s TRP 245 N -3.42 2.95 -0.01 3.99 0.52 0.06 -0.01 118.94 123.01 3ilq s TRP 245 Ca 0.36 -0.17 0.04 0.00 0.02 0.00 0.00 56.10 56.35 3ilq s TRP 245 Cb 0.08 -1.36 -0.01 0.00 -1.15 0.00 0.00 33.47 31.03 3ilq s TRP 245 CO 0.15 0.53 -0.12 -0.47 0.02 0.00 0.00 176.95 177.06 3ilq s TYR 246 N -2.22 1.09 -0.03 -1.98 5.04 0.10 -0.60 117.35 118.76 3ilq s TYR 246 Ca 0.33 -0.22 -0.08 0.00 -2.44 0.00 0.00 57.07 54.65 3ilq s TYR 246 Cb -0.07 -0.72 0.01 0.00 0.35 0.00 0.00 41.96 41.53 3ilq s TYR 246 CO 0.23 -0.04 0.19 -1.17 -1.34 0.00 0.00 175.55 173.42 3ilq s LEU 247 N -0.18 1.32 0.14 6.97 2.96 0.17 -1.50 118.68 128.55 3ilq s LEU 247 Ca 0.03 0.09 0.10 0.00 -0.22 0.00 0.00 54.13 54.13 3ilq s LEU 247 Cb -0.06 0.77 -0.04 0.00 0.50 0.00 0.00 46.19 47.36 3ilq s LEU 247 CO -0.00 -0.26 -0.23 0.00 -1.32 0.00 0.00 176.35 174.54 3ilq s GLN 248 N -0.76 1.56 -0.08 1.98 -2.07 -1.26 0.68 119.66 119.71 3ilq s GLN 248 Ca -0.08 -1.32 0.02 0.00 -1.82 0.00 0.00 55.36 52.16 3ilq s GLN 248 Cb -0.05 -1.97 0.01 0.00 -1.09 0.00 0.00 33.01 29.92 3ilq s GLN 248 CO 0.01 0.45 -0.13 0.00 -1.32 0.00 0.00 175.29 174.30 3ilq s ALA 249 N -1.20 1.41 0.17 2.60 0.00 -0.18 -0.98 121.76 123.59 3ilq s ALA 249 Ca 0.17 -0.53 0.08 0.00 0.00 0.00 0.00 51.96 51.68 3ilq s ALA 249 Cb -0.10 -0.68 -0.04 0.00 0.00 0.00 0.00 23.12 22.31 3ilq s ALA 249 CO 0.08 0.03 -0.06 0.95 0.00 0.00 0.00 175.76 176.76 3ilq s THR 250 N 0.83 3.43 -0.05 0.00 -4.23 -0.22 -0.61 115.64 114.78 3ilq s THR 250 Ca -0.11 -1.54 -0.02 0.00 -1.18 0.00 0.00 61.69 58.84 3ilq s THR 250 Cb -0.15 -2.70 0.04 0.00 1.34 0.00 0.00 72.50 71.02 3ilq s THR 250 CO 0.02 -0.10 0.09 -0.22 -0.54 0.00 0.00 174.62 173.87 3ilq s LEU 251 N -2.84 0.45 -0.29 4.79 2.96 0.37 -0.32 118.68 123.79 3ilq s LEU 251 Ca 0.26 0.17 -0.28 0.00 -0.22 0.00 0.00 54.13 54.06 3ilq s LEU 251 Cb -0.09 0.07 0.01 0.00 0.50 0.00 0.00 46.19 46.68 3ilq s LEU 251 CO 0.17 -0.20 1.01 -1.81 -1.32 0.00 0.00 176.35 174.20 3ilq s ASP 252 N 1.72 6.93 0.09 3.68 -0.00 -1.26 -0.03 116.67 127.80 3ilq s ASP 252 Ca -0.02 1.08 0.09 0.00 -0.00 0.00 0.00 52.55 53.70 3ilq s ASP 252 Cb -0.12 -2.52 -0.03 0.00 -0.00 0.00 0.00 42.92 40.25 3ilq s ASP 252 CO -0.04 -0.77 -0.23 0.68 -0.00 0.00 0.00 175.17 174.80 3ilq s VAL 253 N 3.40 1.92 0.22 -1.27 -7.23 0.73 -4.97 120.40 113.20 3ilq s VAL 253 Ca 0.43 -1.51 -0.31 0.00 -1.81 0.00 0.00 61.98 58.79 3ilq s VAL 253 Cb -0.13 -1.70 -0.10 0.00 0.56 0.00 0.00 36.38 35.01 3ilq s VAL 253 CO 0.12 0.10 1.49 -1.61 -0.31 0.00 0.00 175.10 174.89 3ilq s GLU 254 N -1.69 4.25 0.00 4.82 2.02 -1.26 -0.57 118.70 126.26 3ilq s GLU 254 Ca 0.10 2.32 -0.00 0.00 0.02 0.00 0.00 54.97 57.41 3ilq s GLU 254 Cb -0.10 -3.13 -0.00 0.00 0.10 0.00 0.00 34.13 31.00 3ilq s GLU 254 CO 0.04 -0.49 0.31 0.00 0.02 0.00 0.00 175.26 175.14 3ilq n ALA 255 N 2.95 1.84 -0.91 5.21 0.00 -1.26 -0.10 120.51 128.24 3ilq n ALA 255 Ca 0.09 -0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.52 3ilq n ALA 255 Cb 0.40 -1.88 0.00 0.00 0.00 0.00 0.00 19.45 17.97 3ilq n ALA 255 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3ilq n GLY 256 N 1.98 0.97 0.00 0.00 0.00 -1.26 -4.94 105.19 101.95 3ilq n GLY 256 Ca 0.00 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.07 3ilq n GLY 256 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3ilq n GLU 257 N -0.00 1.70 -0.34 1.61 1.02 0.86 -4.70 120.64 120.79 3ilq n GLU 257 Ca 0.00 -0.05 0.17 0.00 -0.02 0.00 0.00 57.16 57.26 3ilq n GLU 257 Cb 0.23 -1.10 0.39 0.00 -0.02 0.00 0.00 31.44 30.94 3ilq n GLU 257 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 3ilq h GLU 258 N 0.00 0.59 -6.45 3.49 3.07 -1.92 -3.41 114.58 109.93 3ilq h GLU 258 Ca 0.00 -0.04 -0.57 0.00 -0.50 0.00 0.00 59.36 58.26 3ilq h GLU 258 Cb 0.33 -0.13 0.04 0.00 -0.84 0.00 0.00 28.75 28.15 3ilq h GLU 258 CO 0.00 0.39 1.00 0.00 -1.40 0.00 0.00 179.01 179.00 3ilq n ALA 259 N -2.35 1.62 0.00 3.43 0.00 -1.26 -2.36 120.51 119.59 3ilq n ALA 259 Ca 0.25 0.35 0.00 0.00 0.00 0.00 0.00 53.44 54.05 3ilq n ALA 259 Cb 0.71 -2.49 0.00 0.00 0.00 0.00 0.00 19.45 17.68 3ilq n ALA 259 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3ilq n GLY 260 N 4.00 1.33 3.82 0.00 0.00 -1.26 -5.06 105.19 108.01 3ilq n GLY 260 Ca 0.19 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.88 3ilq n GLY 260 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3ilq s LEU 261 N 0.00 4.00 0.03 0.99 1.43 -1.00 -4.16 118.68 119.97 3ilq s LEU 261 Ca 0.00 1.62 -0.02 0.00 -1.03 0.00 0.00 54.13 54.70 3ilq s LEU 261 Cb 0.00 -4.40 -0.02 0.00 0.03 0.00 0.00 46.19 41.80 3ilq s LEU 261 CO 0.00 -0.31 0.02 0.00 0.23 0.00 0.00 176.35 176.30 3ilq s ALA 262 N -2.10 0.11 -0.19 4.21 0.00 -0.37 -0.49 121.76 122.93 3ilq s ALA 262 Ca 0.59 -0.68 -0.11 0.00 0.00 0.00 0.00 51.96 51.77 3ilq s ALA 262 Cb -0.10 0.20 -0.05 0.00 0.00 0.00 0.00 23.12 23.17 3ilq s ALA 262 CO 0.15 -0.26 0.17 0.00 0.00 0.00 0.00 175.76 175.81 3ilq s ARG 264 N 0.42 2.87 -0.14 0.00 3.52 0.12 -0.44 118.95 125.31 3ilq s ARG 264 Ca 0.10 -0.79 0.02 0.00 -0.13 0.00 0.00 55.73 54.93 3ilq s ARG 264 Cb -0.12 -2.37 0.01 0.00 -1.56 0.00 0.00 34.95 30.91 3ilq s ARG 264 CO -0.01 0.35 -0.22 0.08 -0.81 0.00 0.00 175.30 174.70 3ilq s VAL 265 N -0.05 2.12 -0.10 7.11 1.01 -0.09 -1.17 120.40 129.23 3ilq s VAL 265 Ca -0.05 -0.96 -0.02 0.00 0.00 0.00 0.00 61.98 60.95 3ilq s VAL 265 Cb -0.14 -1.85 -0.03 0.00 0.00 0.00 0.00 36.38 34.36 3ilq s VAL 265 CO 0.04 0.55 -0.00 -0.54 0.00 0.00 0.00 175.10 175.15 3ilq s LYS 266 N 0.78 3.09 -0.18 2.72 1.02 0.23 -2.11 119.74 125.30 3ilq s LYS 266 Ca -0.08 -0.42 -0.22 0.00 0.02 0.00 0.00 55.97 55.26 3ilq s LYS 266 Cb -0.16 -2.81 0.06 0.00 -0.52 0.00 0.00 37.83 34.40 3ilq s LYS 266 CO -0.01 0.63 0.60 -1.58 -0.92 0.00 0.00 175.35 174.07 3ilq s HIS 267 N -0.68 -0.63 0.43 3.18 2.46 -1.26 -1.53 115.29 117.26 3ilq s HIS 267 Ca 0.11 1.43 0.14 0.00 0.47 0.00 0.00 55.06 57.21 3ilq s HIS 267 Cb -0.12 0.25 1.03 0.00 -0.13 0.00 0.00 32.58 33.61 3ilq s HIS 267 CO 0.02 -0.38 1.95 0.66 -2.47 0.00 0.00 174.74 174.53 3ilq h SER 268 N 4.68 0.39 0.27 9.88 4.64 -1.94 -1.52 113.55 129.95 3ilq h SER 268 Ca -0.28 0.01 -0.02 0.00 -0.47 0.00 0.00 61.79 61.04 3ilq h SER 268 Cb 1.16 -0.07 -0.00 0.00 -0.31 0.00 0.00 62.40 63.19 3ilq h SER 268 CO 0.19 0.22 -0.08 0.77 -0.87 0.00 0.00 176.83 177.06 3ilq h SER 269 N 0.43 0.00 1.86 4.97 4.64 -1.85 -3.20 113.55 120.39 3ilq h SER 269 Ca 0.32 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.62 3ilq h SER 269 Cb 0.66 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.75 3ilq h SER 269 CO -0.09 0.08 -0.14 -0.07 -0.87 0.00 0.00 176.83 175.74 3ilq h LEU 270 N 0.00 0.00 -0.83 5.97 3.38 -1.61 -3.47 115.31 118.75 3ilq h LEU 270 Ca -0.00 0.00 -0.31 0.00 0.09 0.00 0.00 57.88 57.66 3ilq h LEU 270 Cb 0.24 0.00 0.11 0.00 0.09 0.00 0.00 40.66 41.09 3ilq h LEU 270 CO 0.01 0.10 -0.52 0.61 0.09 0.00 0.00 178.44 178.73 3ilq n GLY 271 N 1.13 -0.20 1.88 0.83 0.00 -1.21 -2.90 105.19 104.72 3ilq n GLY 271 Ca 0.03 0.04 0.00 0.00 0.00 0.00 0.00 46.02 46.09 3ilq n GLY 271 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ilq n GLY 272 N -1.65 2.84 2.99 -0.02 0.00 -1.26 -4.96 105.19 103.12 3ilq n GLY 272 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 3ilq n GLY 272 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3ilq n GLN 273 N -2.00 3.05 -1.61 1.61 1.13 -1.14 -5.01 117.38 113.41 3ilq n GLN 273 Ca 0.00 -2.93 -0.41 0.00 -1.94 0.00 0.00 57.00 51.72 3ilq n GLN 273 Cb 0.00 -3.29 0.01 0.00 0.11 0.00 0.00 30.24 27.07 3ilq n GLN 273 CO 0.00 0.00 0.00 -0.25 -1.44 0.00 0.00 177.06 175.37 3ilq n ASP 274 N 6.40 1.28 -4.69 1.08 8.00 -1.26 -4.88 116.55 122.47 3ilq n ASP 274 Ca 0.49 1.04 -0.42 0.00 0.71 0.00 0.00 54.79 56.61 3ilq n ASP 274 Cb 0.41 -1.35 -0.03 0.00 -0.02 0.00 0.00 41.12 40.13 3ilq n ASP 274 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3ilq s ILE 275 N -1.27 3.60 -0.19 0.53 -1.09 -0.89 -4.91 121.20 116.98 3ilq s ILE 275 Ca 0.63 1.02 0.01 0.00 -2.23 0.00 0.00 60.65 60.08 3ilq s ILE 275 Cb -0.56 -3.66 0.02 0.00 -1.58 0.00 0.00 42.46 36.68 3ilq s ILE 275 CO 0.57 0.01 -0.18 -0.63 -1.23 0.00 0.00 174.94 173.48 3ilq s ILE 276 N 2.22 2.17 -0.23 2.92 1.01 -1.26 -0.91 121.20 127.13 3ilq s ILE 276 Ca 0.65 -0.97 -0.01 0.00 0.00 0.00 0.00 60.65 60.32 3ilq s ILE 276 Cb -0.33 -1.95 0.02 0.00 0.01 0.00 0.00 42.46 40.21 3ilq s ILE 276 CO 0.28 0.48 -0.09 -0.76 0.00 0.00 0.00 174.94 174.85 3ilq s LEU 277 N 1.29 2.94 0.12 2.97 1.43 0.42 -4.96 118.68 122.89 3ilq s LEU 277 Ca 0.04 -0.79 -0.25 0.00 -1.03 0.00 0.00 54.13 52.10 3ilq s LEU 277 Cb -0.14 -1.63 -0.07 0.00 0.03 0.00 0.00 46.19 44.38 3ilq s LEU 277 CO -0.12 -0.09 0.77 -0.31 0.23 0.00 0.00 176.35 176.84 3ilq s TYR 278 N 1.32 3.85 -2.00 0.29 1.51 -1.26 -0.20 117.35 120.86 3ilq s TYR 278 Ca 0.01 1.58 0.25 0.00 -1.01 0.00 0.00 57.07 57.90 3ilq s TYR 278 Cb -0.16 -2.78 1.48 0.00 -0.11 0.00 0.00 41.96 40.39 3ilq s TYR 278 CO -0.06 0.44 1.84 1.87 -1.11 0.00 0.00 175.55 178.52