#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3naq s SER 29 N 0.00 6.63 0.16 -2.24 0.01 -1.26 -5.01 113.70 111.99 3naq s SER 29 Ca 0.00 2.71 0.11 0.00 1.31 0.00 0.00 55.95 60.08 3naq s SER 29 Cb 0.00 -2.63 -0.04 0.00 0.21 0.00 0.00 66.02 63.56 3naq s SER 29 CO 0.00 -0.71 -0.25 -0.54 0.41 0.00 0.00 173.24 172.15 3naq s LYS 30 N -0.62 1.44 -0.27 12.44 -0.14 -1.26 -5.00 119.74 126.32 3naq s LYS 30 Ca 0.58 -1.43 -0.11 0.00 -1.36 0.00 0.00 55.97 53.65 3naq s LYS 30 Cb -0.42 -1.80 -0.05 0.00 -1.68 0.00 0.00 37.83 33.88 3naq s LYS 30 CO 0.46 0.40 0.18 0.21 -0.76 0.00 0.00 175.35 175.84 3naq s LYS 31 N -2.41 3.93 -0.15 1.68 2.20 -1.26 -1.38 119.74 122.35 3naq s LYS 31 Ca 0.17 -0.33 -0.01 0.00 -0.36 0.00 0.00 55.97 55.44 3naq s LYS 31 Cb -0.09 -3.62 -0.01 0.00 -1.51 0.00 0.00 37.83 32.60 3naq s LYS 31 CO 0.08 -0.16 -0.11 0.42 -0.36 0.00 0.00 175.35 175.22 3naq s ILE 32 N 1.68 3.18 -0.14 5.43 -1.09 0.49 -0.75 121.20 129.99 3naq s ILE 32 Ca 0.07 -0.60 0.01 0.00 -2.23 0.00 0.00 60.65 57.89 3naq s ILE 32 Cb -0.16 -2.36 -0.00 0.00 -1.58 0.00 0.00 42.46 38.36 3naq s ILE 32 CO 0.10 0.50 -0.17 -0.69 -1.23 0.00 0.00 174.94 173.46 3naq s VAL 33 N 0.57 2.59 -0.10 2.92 1.01 0.27 -0.18 120.40 127.47 3naq s VAL 33 Ca -0.07 -0.81 -0.00 0.00 0.00 0.00 0.00 61.98 61.10 3naq s VAL 33 Cb -0.15 -2.08 -0.03 0.00 0.00 0.00 0.00 36.38 34.12 3naq s VAL 33 CO 0.03 0.52 -0.07 -0.83 0.00 0.00 0.00 175.10 174.75 3naq s GLY 34 N 0.70 1.67 -0.18 4.51 0.00 0.94 -0.48 107.32 114.48 3naq s GLY 34 Ca -0.08 -0.87 0.00 0.00 0.00 0.00 0.00 44.72 43.77 3naq s GLY 34 CO 0.01 -0.43 -0.18 0.14 0.00 0.00 0.00 173.10 172.65 3naq s VAL 35 N -0.30 2.29 0.10 1.40 1.01 0.39 -1.07 120.40 124.22 3naq s VAL 35 Ca 0.04 -0.87 -0.07 0.00 0.00 0.00 0.00 61.98 61.08 3naq s VAL 35 Cb -0.13 -1.97 -0.01 0.00 0.00 0.00 0.00 36.38 34.27 3naq s VAL 35 CO 0.02 0.52 0.17 -0.36 0.00 0.00 0.00 175.10 175.46 3naq s PHE 36 N 1.21 0.27 0.66 5.22 0.40 -0.98 -3.94 117.98 120.81 3naq s PHE 36 Ca 0.03 -0.70 -0.11 0.00 -0.60 0.00 0.00 56.93 55.55 3naq s PHE 36 Cb -0.14 -0.12 -0.02 0.00 0.51 0.00 0.00 43.02 43.26 3naq s PHE 36 CO -0.09 -0.55 1.05 1.52 0.70 0.00 0.00 175.22 177.84 3naq s TYR 37 N -3.89 3.39 -0.11 0.36 -0.85 -1.26 -3.50 117.35 111.48 3naq s TYR 37 Ca 0.08 1.34 -0.29 0.00 -0.52 0.00 0.00 57.07 57.68 3naq s TYR 37 Cb 0.05 -2.80 -0.01 0.00 0.38 0.00 0.00 41.96 39.58 3naq s TYR 37 CO -0.08 -0.95 1.00 0.15 -1.52 0.00 0.00 175.55 174.14 3naq s LYS 38 N -5.12 4.41 0.06 -3.49 1.02 -1.26 -0.46 119.74 114.89 3naq s LYS 38 Ca 0.56 1.37 0.24 0.00 0.02 0.00 0.00 55.97 58.16 3naq s LYS 38 Cb -0.12 -3.55 0.26 0.00 -0.52 0.00 0.00 37.83 33.90 3naq s LYS 38 CO 0.54 -0.33 1.22 0.00 -0.92 0.00 0.00 175.35 175.87 3naq n ALA 39 N 5.07 3.33 -0.57 5.17 0.00 -1.26 -4.95 120.51 127.29 3naq n ALA 39 Ca 0.09 -0.35 0.00 0.00 0.00 0.00 0.00 53.44 53.18 3naq n ALA 39 Cb 0.49 -1.07 0.00 0.00 0.00 0.00 0.00 19.45 18.87 3naq n ALA 39 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3naq n ASN 40 N -1.87 0.00 0.30 0.00 3.02 -1.26 -1.33 115.26 114.12 3naq n ASN 40 Ca 0.03 0.00 0.16 0.00 -0.03 0.00 0.00 54.58 54.75 3naq n ASN 40 Cb 0.41 0.00 0.95 0.00 -0.61 0.00 0.00 39.78 40.53 3naq n ASN 40 CO 0.00 0.00 0.00 1.05 -2.62 0.00 0.00 177.26 175.69 3naq h GLU 41 N 0.00 0.00 0.00 3.52 9.09 -2.01 -1.52 114.58 123.66 3naq h GLU 41 Ca 0.00 0.00 -0.04 0.00 0.05 0.00 0.00 59.36 59.37 3naq h GLU 41 Cb 0.00 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 27.09 3naq h GLU 41 CO 0.00 0.02 -0.20 1.88 0.05 0.00 0.00 179.01 180.76 3naq h TYR 42 N 0.00 0.00 -0.03 2.06 0.99 -1.63 0.21 116.97 118.57 3naq h TYR 42 Ca -0.00 0.00 -0.16 0.00 2.00 0.00 0.00 58.73 60.57 3naq h TYR 42 Cb 0.05 0.00 -0.01 0.00 1.00 0.00 0.00 36.73 37.76 3naq h TYR 42 CO 0.00 0.20 -0.71 0.00 -0.00 0.00 0.00 178.16 177.65 3naq h ALA 43 N 1.80 0.75 0.16 3.88 0.00 -1.37 -1.12 119.26 123.36 3naq h ALA 43 Ca -0.00 -0.62 -0.32 0.00 0.00 0.00 0.00 54.91 53.97 3naq h ALA 43 Cb 0.39 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 18.10 3naq h ALA 43 CO 0.03 0.82 -1.52 1.79 0.00 0.00 0.00 179.25 180.36 3naq h THR 44 N 0.12 1.19 -0.44 0.00 1.35 -1.49 -3.13 112.91 110.50 3naq h THR 44 Ca -0.02 -2.76 0.04 0.00 -0.55 0.00 0.00 66.41 63.12 3naq h THR 44 Cb 1.26 2.85 -0.02 0.00 -1.73 0.00 0.00 68.15 70.50 3naq h THR 44 CO 0.11 0.84 0.30 0.11 -0.25 0.00 0.00 175.52 176.62 3naq h LYS 45 N 0.09 0.42 -3.04 4.72 1.57 -0.88 -3.36 116.57 116.09 3naq h LYS 45 Ca -0.25 -0.03 -0.56 0.00 -1.87 0.00 0.00 60.65 57.94 3naq h LYS 45 Cb 2.06 -0.10 -0.40 0.00 0.08 0.00 0.00 32.23 33.87 3naq h LYS 45 CO 0.19 0.28 -0.78 1.21 -0.57 0.00 0.00 179.45 179.79 3naq s ASN 46 N -6.55 3.64 0.01 0.86 3.84 -0.43 -4.99 114.94 111.32 3naq s ASN 46 Ca -0.08 -1.65 0.10 0.00 0.21 0.00 0.00 52.86 51.44 3naq s ASN 46 Cb 0.18 -0.59 0.41 0.00 -0.55 0.00 0.00 41.25 40.71 3naq s ASN 46 CO 0.73 -0.40 1.31 -2.65 -2.79 0.00 0.00 177.10 173.30 3naq n PRO 47 N 4.80 0.01 -0.13 0.43 -0.02 -1.18 -0.87 135.00 138.03 3naq n PRO 47 Ca -0.01 0.35 0.09 0.00 -2.02 0.00 0.00 63.50 61.91 3naq n PRO 47 Cb 0.41 -1.51 0.29 0.00 -0.02 0.00 0.00 33.50 32.66 3naq n PRO 47 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 3naq n ASN 48 N -1.53 2.01 -4.58 2.55 3.02 -1.26 -4.55 115.26 110.93 3naq n ASN 48 Ca 0.02 -1.84 -0.38 0.00 -0.03 0.00 0.00 54.58 52.35 3naq n ASN 48 Cb 0.11 -0.18 -0.02 0.00 -0.61 0.00 0.00 39.78 39.08 3naq n ASN 48 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 3naq s PHE 49 N -1.65 2.48 -0.27 3.10 5.99 -0.05 -4.79 117.98 122.80 3naq s PHE 49 Ca 0.31 -0.87 0.18 0.00 0.00 0.00 0.00 56.93 56.56 3naq s PHE 49 Cb 0.17 -4.53 0.17 0.00 0.00 0.00 0.00 43.02 38.83 3naq s PHE 49 CO 0.24 -1.69 1.49 -0.07 -0.00 0.00 0.00 175.22 175.20 3naq h LEU 50 N 14.15 0.00 -4.51 6.12 3.38 -1.87 -3.37 115.31 129.22 3naq h LEU 50 Ca 0.33 0.00 -0.43 0.00 0.09 0.00 0.00 57.88 57.88 3naq h LEU 50 Cb 0.92 0.00 -0.10 0.00 0.09 0.00 0.00 40.66 41.57 3naq h LEU 50 CO 1.38 0.30 0.74 0.61 0.09 0.00 0.00 178.44 181.57 3naq n GLY 51 N 1.18 3.90 3.38 0.83 0.00 -1.26 -0.49 105.19 112.73 3naq n GLY 51 Ca 0.03 -1.59 -0.09 0.00 0.00 0.00 0.00 46.02 44.36 3naq n GLY 51 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3naq h VAL 53 N 2.47 0.89 -0.16 0.00 2.07 -0.98 0.24 116.25 120.78 3naq h VAL 53 Ca -0.31 -0.29 -0.18 0.00 0.82 0.00 0.00 66.70 66.73 3naq h VAL 53 Cb 1.23 -0.03 -0.00 0.00 -1.52 0.00 0.00 31.29 30.97 3naq h VAL 53 CO 0.46 0.16 -0.65 -0.33 0.02 0.00 0.00 177.57 177.23 3naq h GLU 54 N 0.85 0.60 0.00 1.57 3.07 -1.92 -3.22 114.58 115.53 3naq h GLU 54 Ca 0.45 -0.43 -0.12 0.00 -0.50 0.00 0.00 59.36 58.75 3naq h GLU 54 Cb 0.45 0.07 -0.02 0.00 -0.84 0.00 0.00 28.75 28.41 3naq h GLU 54 CO -0.27 1.05 -2.05 0.09 -1.40 0.00 0.00 179.01 176.43 3naq n ASN 55 N -3.92 0.41 -3.88 1.42 3.02 -1.18 -5.03 115.26 106.09 3naq n ASN 55 Ca -0.04 0.00 -0.25 0.00 -0.03 0.00 0.00 54.58 54.25 3naq n ASN 55 Cb 0.67 1.57 0.00 0.00 -0.61 0.00 0.00 39.78 41.41 3naq n ASN 55 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3naq n ALA 56 N -2.38 -1.89 -0.89 5.41 0.00 0.84 -0.92 120.51 120.68 3naq n ALA 56 Ca -0.13 -0.17 0.00 0.00 0.00 0.00 0.00 53.44 53.13 3naq n ALA 56 Cb 0.73 -2.05 0.00 0.00 0.00 0.00 0.00 19.45 18.14 3naq n ALA 56 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3naq n LEU 57 N -4.38 0.58 -0.91 0.00 4.77 0.36 -3.20 117.00 114.22 3naq n LEU 57 Ca -0.25 0.00 -0.12 0.00 -0.03 0.00 0.00 56.01 55.61 3naq n LEU 57 Cb 0.66 -1.35 -0.05 0.00 -2.33 0.00 0.00 43.42 40.35 3naq n LEU 57 CO 0.74 -0.46 -0.11 0.61 -1.33 0.00 0.00 177.39 176.83 3naq n GLY 58 N -1.20 1.29 0.28 -0.72 0.00 -0.10 -4.84 105.19 99.90 3naq n GLY 58 Ca 0.00 -0.44 0.04 0.00 0.00 0.00 0.00 46.02 45.62 3naq n GLY 58 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 3naq n ILE 59 N -2.64 0.00 0.03 -0.61 -5.35 -1.19 -4.72 119.36 104.88 3naq n ILE 59 Ca -0.12 -0.46 -0.12 0.00 -0.27 0.00 0.00 62.75 61.79 3naq n ILE 59 Cb 0.40 1.15 -0.07 0.00 -1.74 0.00 0.00 39.64 39.38 3naq n ILE 59 CO 0.00 0.00 0.00 -0.09 -1.76 0.00 0.00 176.55 174.70 3naq h ARG 60 N 1.38 0.02 -0.85 6.28 2.43 -1.88 0.02 114.38 121.77 3naq h ARG 60 Ca 0.00 -0.00 0.02 0.00 -0.81 0.00 0.00 59.98 59.19 3naq h ARG 60 Cb 0.34 -0.00 -0.05 0.00 -0.42 0.00 0.00 29.97 29.84 3naq h ARG 60 CO 0.00 0.02 0.56 -0.44 -1.51 0.00 0.00 179.97 178.60 3naq h ASP 61 N 0.01 0.95 -0.06 -3.80 3.32 -1.98 -0.70 116.42 114.15 3naq h ASP 61 Ca 0.00 -0.01 -0.02 0.00 0.02 0.00 0.00 57.03 57.02 3naq h ASP 61 Cb 0.01 -0.22 -0.00 0.00 0.22 0.00 0.00 39.33 39.33 3naq h ASP 61 CO -0.00 0.67 -0.03 -0.25 -1.72 0.00 0.00 179.24 177.91 3naq h TRP 62 N 1.11 0.14 -0.47 4.55 7.01 -1.82 -0.22 115.95 126.26 3naq h TRP 62 Ca 0.33 -0.03 0.04 0.00 2.11 0.00 0.00 58.89 61.33 3naq h TRP 62 Cb -0.06 -0.03 -0.04 0.00 -2.10 0.00 0.00 29.16 26.93 3naq h TRP 62 CO -0.02 0.50 0.23 -0.07 -2.79 0.00 0.00 178.44 176.30 3naq h LEU 63 N -0.26 0.34 -0.82 0.65 3.38 -0.81 -2.26 115.31 115.53 3naq h LEU 63 Ca 0.01 0.03 -0.09 0.00 0.09 0.00 0.00 57.88 57.92 3naq h LEU 63 Cb 0.46 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 41.16 3naq h LEU 63 CO 0.01 0.24 -0.07 -0.33 0.09 0.00 0.00 178.44 178.37 3naq h GLU 64 N 0.46 0.81 0.00 1.13 5.08 -1.07 -1.68 114.58 119.30 3naq h GLU 64 Ca 0.20 -0.25 -0.01 0.00 -1.00 0.00 0.00 59.36 58.30 3naq h GLU 64 Cb 0.11 -0.07 -0.00 0.00 0.50 0.00 0.00 28.75 29.29 3naq h GLU 64 CO -0.14 0.86 -0.05 0.66 -1.00 0.00 0.00 179.01 179.33 3naq h SER 65 N 0.74 0.00 -0.25 1.42 4.64 -0.59 -0.33 113.55 119.19 3naq h SER 65 Ca 0.13 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.45 3naq h SER 65 Cb 0.55 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.64 3naq h SER 65 CO 0.03 0.05 0.00 0.00 -0.87 0.00 0.00 176.83 176.04 3naq n GLN 66 N -3.74 2.01 -0.73 4.77 1.13 -0.79 -4.93 117.38 115.09 3naq n GLN 66 Ca -0.02 -1.52 0.00 0.00 -1.94 0.00 0.00 57.00 53.52 3naq n GLN 66 Cb 0.15 -1.43 0.00 0.00 0.11 0.00 0.00 30.24 29.07 3naq n GLN 66 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3naq n GLY 67 N 1.26 0.75 3.90 1.08 0.00 -0.13 -4.89 105.19 107.15 3naq n GLY 67 Ca 0.17 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.90 3naq n GLY 67 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3naq s HIS 68 N -2.72 3.52 -0.15 1.61 3.76 -0.70 -4.59 115.29 116.02 3naq s HIS 68 Ca 0.00 0.95 -0.09 0.00 -0.15 0.00 0.00 55.06 55.78 3naq s HIS 68 Cb 0.00 -2.55 -0.04 0.00 1.11 0.00 0.00 32.58 31.09 3naq s HIS 68 CO 0.00 -0.55 0.14 -1.14 -0.85 0.00 0.00 174.74 172.34 3naq s GLN 69 N -4.96 3.80 -0.22 1.40 0.74 -0.48 -4.16 119.66 115.78 3naq s GLN 69 Ca 0.51 -0.16 0.01 0.00 0.05 0.00 0.00 55.36 55.78 3naq s GLN 69 Cb -0.11 -3.30 0.05 0.00 1.10 0.00 0.00 33.01 30.76 3naq s GLN 69 CO 0.48 0.55 -0.09 -0.47 -0.55 0.00 0.00 175.29 175.21 3naq s TYR 70 N -0.38 2.60 -0.18 1.67 5.04 -1.26 -0.38 117.35 124.46 3naq s TYR 70 Ca 0.12 -1.79 -0.04 0.00 -2.44 0.00 0.00 57.07 52.93 3naq s TYR 70 Cb -0.12 -1.69 -0.02 0.00 0.35 0.00 0.00 41.96 40.48 3naq s TYR 70 CO 0.01 -0.78 -0.03 0.42 -1.34 0.00 0.00 175.55 173.83 3naq s ILE 71 N 1.33 3.74 -0.06 3.14 -1.09 0.75 -5.00 121.20 124.01 3naq s ILE 71 Ca -0.04 -0.39 0.05 0.00 -2.23 0.00 0.00 60.65 58.04 3naq s ILE 71 Cb -0.18 -2.67 -0.00 0.00 -1.58 0.00 0.00 42.46 38.04 3naq s ILE 71 CO -0.07 0.46 -0.21 -0.69 -1.23 0.00 0.00 174.94 173.20 3naq s VAL 72 N 0.81 1.73 -0.02 2.92 1.01 -1.26 -0.04 120.40 125.54 3naq s VAL 72 Ca -0.01 -0.87 -0.21 0.00 0.00 0.00 0.00 61.98 60.89 3naq s VAL 72 Cb -0.14 -1.48 0.04 0.00 0.00 0.00 0.00 36.38 34.79 3naq s VAL 72 CO 0.02 0.49 0.45 0.28 0.00 0.00 0.00 175.10 176.34 3naq s THR 73 N 0.08 0.04 -2.23 3.92 -1.32 -0.24 -4.98 115.64 110.90 3naq s THR 73 Ca -0.07 -0.30 0.24 0.00 -1.21 0.00 0.00 61.69 60.35 3naq s THR 73 Cb -0.14 -0.79 0.12 0.00 -1.51 0.00 0.00 72.50 70.18 3naq s THR 73 CO 0.04 -0.17 1.25 -0.90 -2.21 0.00 0.00 174.62 172.63 3naq n ASP 74 N 1.06 2.05 -4.37 8.08 5.75 -1.23 -2.33 116.55 125.56 3naq n ASP 74 Ca -0.20 -1.52 -0.46 0.00 -0.01 0.00 0.00 54.79 52.60 3naq n ASP 74 Cb 0.57 0.29 -0.03 0.00 -1.03 0.00 0.00 41.12 40.92 3naq n ASP 74 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 3naq s ASP 75 N -2.35 6.63 0.00 -1.12 2.15 -1.26 -4.80 116.67 115.92 3naq s ASP 75 Ca 0.23 -2.30 0.00 0.00 0.43 0.00 0.00 52.55 50.91 3naq s ASP 75 Cb 0.19 -2.28 0.00 0.00 -0.30 0.00 0.00 42.92 40.53 3naq s ASP 75 CO 0.49 -0.80 0.42 2.29 -0.17 0.00 0.00 175.17 177.39 3naq n LYS 76 N 5.11 -0.77 -5.25 4.34 2.85 -1.26 -1.62 118.16 121.56 3naq n LYS 76 Ca 0.13 -0.42 -0.31 0.00 -1.05 0.00 0.00 58.31 56.66 3naq n LYS 76 Cb 0.47 -0.92 -0.16 0.00 -0.65 0.00 0.00 35.03 33.77 3naq n LYS 76 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 177.40 176.14 3naq s GLU 77 N -0.01 2.50 0.00 -1.58 2.02 -1.26 -4.79 118.70 115.59 3naq s GLU 77 Ca 0.00 -0.90 0.00 0.00 0.02 0.00 0.00 54.97 54.09 3naq s GLU 77 Cb 0.00 -2.13 0.00 0.00 0.10 0.00 0.00 34.13 32.10 3naq s GLU 77 CO 0.00 0.38 0.00 0.41 0.02 0.00 0.00 175.26 176.07 3naq n GLY 78 N 2.94 2.64 0.17 -1.39 0.00 -1.26 -4.38 105.19 103.91 3naq n GLY 78 Ca -0.17 -1.84 0.14 0.00 0.00 0.00 0.00 46.02 44.15 3naq n GLY 78 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3naq h PRO 79 N 0.00 0.00 -0.18 1.61 0.13 -2.02 -2.64 132.00 128.90 3naq h PRO 79 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 3naq h PRO 79 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 3naq h PRO 79 CO 0.00 0.00 0.00 -0.25 -0.23 0.00 0.00 178.00 177.52 3naq n ASP 80 N -2.53 2.94 -4.81 1.44 8.00 -1.26 -4.85 116.55 115.47 3naq n ASP 80 Ca 0.02 -1.88 -0.31 0.00 0.71 0.00 0.00 54.79 53.33 3naq n ASP 80 Cb 0.29 -0.11 0.06 0.00 -0.02 0.00 0.00 41.12 41.34 3naq n ASP 80 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3naq h GLU 82 N -0.79 1.10 -0.90 0.00 4.57 -1.86 -1.82 114.58 114.88 3naq h GLU 82 Ca -0.44 -0.07 0.15 0.00 -1.18 0.00 0.00 59.36 57.83 3naq h GLU 82 Cb 1.21 -0.25 -0.09 0.00 -0.16 0.00 0.00 28.75 29.46 3naq h GLU 82 CO 0.56 0.73 0.50 1.25 -1.18 0.00 0.00 179.01 180.87 3naq h LEU 83 N 1.14 0.65 -1.07 1.64 5.85 -1.66 -0.46 115.31 121.40 3naq h LEU 83 Ca 0.32 0.09 0.00 0.00 0.84 0.00 0.00 57.88 59.12 3naq h LEU 83 Cb -0.10 -0.03 0.00 0.00 0.37 0.00 0.00 40.66 40.90 3naq h LEU 83 CO -0.08 0.28 0.00 -0.33 -0.34 0.00 0.00 178.44 177.97 3naq h GLU 84 N 0.71 0.00 0.00 1.25 4.39 -1.61 0.10 114.58 119.42 3naq h GLU 84 Ca 0.49 0.00 -0.03 0.00 0.34 0.00 0.00 59.36 60.17 3naq h GLU 84 Cb 0.68 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.32 3naq h GLU 84 CO -0.35 0.00 -0.13 0.87 -1.16 0.00 0.00 179.01 178.24 3naq h LYS 85 N 0.00 0.00 0.00 2.33 1.57 -0.99 -3.29 116.57 116.19 3naq h LYS 85 Ca 0.00 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3naq h LYS 85 Cb 0.61 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.92 3naq h LYS 85 CO 0.00 0.13 -1.55 0.72 -0.57 0.00 0.00 179.45 178.18 3naq n HIS 86 N -3.76 0.00 -0.34 -1.35 8.25 -0.10 -4.46 115.22 113.45 3naq n HIS 86 Ca -0.02 0.00 0.19 0.00 -0.26 0.00 0.00 57.72 57.63 3naq n HIS 86 Cb 0.23 -0.28 0.41 0.00 1.12 0.00 0.00 29.99 31.48 3naq n HIS 86 CO 0.00 0.00 0.00 0.82 0.64 0.00 0.00 176.34 177.80 3naq h ILE 87 N 0.00 0.51 0.00 1.59 2.04 -1.28 -0.95 117.51 119.42 3naq h ILE 87 Ca -0.00 -0.18 -0.03 0.00 1.00 0.00 0.00 64.86 65.64 3naq h ILE 87 Cb 0.56 -0.07 -0.00 0.00 -0.74 0.00 0.00 36.82 36.56 3naq h ILE 87 CO 0.00 0.10 -0.16 -0.65 0.00 0.00 0.00 178.15 177.44 3naq h PRO 88 N 0.54 0.00 0.00 2.37 0.11 -1.75 -3.32 132.00 129.94 3naq h PRO 88 Ca 0.65 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.76 3naq h PRO 88 Cb 1.31 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.42 3naq h PRO 88 CO -0.46 0.16 0.00 -0.40 -0.21 0.00 0.00 178.00 177.09 3naq n ASP 89 N -3.82 0.62 -4.76 -2.05 5.68 -0.93 -1.67 116.55 109.61 3naq n ASP 89 Ca -0.02 -1.17 -0.34 0.00 -0.50 0.00 0.00 54.79 52.76 3naq n ASP 89 Cb 0.26 0.00 0.03 0.00 -1.14 0.00 0.00 41.12 40.28 3naq n ASP 89 CO 0.00 0.00 0.00 -1.48 -1.33 0.00 0.00 177.20 174.39 3naq s LEU 90 N -0.17 3.53 -0.17 -2.12 0.05 -0.41 -4.65 118.68 114.74 3naq s LEU 90 Ca 0.00 2.14 0.07 0.00 0.05 0.00 0.00 54.13 56.39 3naq s LEU 90 Cb 0.00 -4.57 -0.22 0.00 -2.05 0.00 0.00 46.19 39.35 3naq s LEU 90 CO 0.00 -1.55 0.15 1.41 -0.55 0.00 0.00 176.35 175.81 3naq n HIS 91 N -1.97 0.43 -4.12 3.48 8.25 0.07 -1.28 115.22 120.08 3naq n HIS 91 Ca 0.11 0.12 -0.18 0.00 -0.26 0.00 0.00 57.72 57.52 3naq n HIS 91 Cb 0.51 -1.07 -0.16 0.00 1.12 0.00 0.00 29.99 30.40 3naq n HIS 91 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 3naq s VAL 92 N -2.53 0.42 -0.15 1.59 1.01 -1.02 -0.78 120.40 118.94 3naq s VAL 92 Ca -0.19 -0.11 0.02 0.00 0.00 0.00 0.00 61.98 61.69 3naq s VAL 92 Cb 0.07 -0.43 0.02 0.00 0.00 0.00 0.00 36.38 36.04 3naq s VAL 92 CO 0.75 0.17 -0.19 -0.22 0.00 0.00 0.00 175.10 175.61 3naq s LEU 93 N 0.58 2.00 -0.10 3.92 2.96 -0.56 -0.57 118.68 126.91 3naq s LEU 93 Ca -0.07 -0.58 0.01 0.00 -0.22 0.00 0.00 54.13 53.27 3naq s LEU 93 Cb -0.10 -1.37 -0.02 0.00 0.50 0.00 0.00 46.19 45.20 3naq s LEU 93 CO -0.00 0.03 -0.12 -0.63 -1.32 0.00 0.00 176.35 174.30 3naq s ILE 94 N 1.09 3.16 0.34 6.68 1.01 0.37 -1.72 121.20 132.14 3naq s ILE 94 Ca -0.01 -0.65 -0.06 0.00 0.00 0.00 0.00 60.65 59.94 3naq s ILE 94 Cb -0.14 -2.30 0.01 0.00 0.01 0.00 0.00 42.46 40.03 3naq s ILE 94 CO -0.07 0.55 0.52 -0.94 0.00 0.00 0.00 174.94 175.00 3naq s SER 95 N -0.07 0.66 0.33 3.58 1.04 -0.88 -0.46 113.70 117.90 3naq s SER 95 Ca -0.02 -1.37 0.10 0.00 0.48 0.00 0.00 55.95 55.14 3naq s SER 95 Cb -0.14 0.68 -0.06 0.00 0.10 0.00 0.00 66.02 66.60 3naq s SER 95 CO 0.04 -1.33 -0.11 0.42 0.98 0.00 0.00 173.24 173.23 3naq s THR 96 N -3.07 2.27 -0.84 2.02 -4.23 -1.25 -0.95 115.64 109.59 3naq s THR 96 Ca 0.27 -2.24 0.14 0.00 -1.18 0.00 0.00 61.69 58.69 3naq s THR 96 Cb -0.01 -2.59 0.13 0.00 1.34 0.00 0.00 72.50 71.38 3naq s THR 96 CO 0.18 -0.24 1.45 -0.81 -0.54 0.00 0.00 174.62 174.66 3naq n PRO 97 N -0.76 0.05 0.21 3.99 -0.04 -1.26 -2.52 135.00 134.67 3naq n PRO 97 Ca -0.05 0.35 0.12 0.00 -0.04 0.00 0.00 63.50 63.89 3naq n PRO 97 Cb 0.63 -1.61 0.22 0.00 -0.04 0.00 0.00 33.50 32.70 3naq n PRO 97 CO 0.00 0.00 0.00 0.74 -0.04 0.00 0.00 175.50 176.20 3naq h PHE 98 N 0.00 0.00 -0.03 0.54 0.04 -1.96 -3.37 116.94 112.16 3naq h PHE 98 Ca 0.00 0.00 -0.23 0.00 2.80 0.00 0.00 57.97 60.54 3naq h PHE 98 Cb 0.22 0.00 -0.15 0.00 2.20 0.00 0.00 35.95 38.22 3naq h PHE 98 CO 0.00 0.00 -0.48 1.58 -0.60 0.00 0.00 178.31 178.81 3naq n HIS 99 N -3.02 -3.09 -2.36 -0.55 -0.00 -1.16 -4.91 115.22 100.13 3naq n HIS 99 Ca 0.04 -1.95 -0.41 0.00 0.46 0.00 0.00 57.72 55.86 3naq n HIS 99 Cb 0.51 1.57 -0.04 0.00 -0.12 0.00 0.00 29.99 31.91 3naq n HIS 99 CO 0.00 0.00 0.00 -1.25 0.46 0.00 0.00 176.34 175.55 3naq s PRO 100 N 0.47 4.53 -0.45 1.57 0.04 -1.05 -4.44 135.00 135.67 3naq s PRO 100 Ca 0.28 1.93 -0.27 0.00 0.04 0.00 0.00 61.00 62.97 3naq s PRO 100 Cb 0.26 -3.17 0.03 0.00 0.04 0.00 0.00 34.50 31.65 3naq s PRO 100 CO -0.16 0.04 1.02 0.00 0.04 0.00 0.00 177.00 177.94 3naq s ALA 101 N -0.88 3.24 0.12 8.56 0.00 -1.26 -5.01 121.76 126.53 3naq s ALA 101 Ca 0.48 -0.58 -0.31 0.00 0.00 0.00 0.00 51.96 51.55 3naq s ALA 101 Cb -0.34 -3.74 -0.08 0.00 0.00 0.00 0.00 23.12 18.96 3naq s ALA 101 CO 0.43 -2.06 1.37 0.71 0.00 0.00 0.00 175.76 176.21 3naq s TYR 102 N 4.01 3.25 -0.65 0.00 2.02 -1.26 -4.85 117.35 119.87 3naq s TYR 102 Ca 0.42 1.00 -0.04 0.00 -0.37 0.00 0.00 57.07 58.08 3naq s TYR 102 Cb -0.09 -3.66 0.17 0.00 -0.40 0.00 0.00 41.96 37.97 3naq s TYR 102 CO 0.27 -2.29 0.48 0.08 -1.57 0.00 0.00 175.55 172.52 3naq s VAL 103 N 0.98 3.89 0.63 0.71 1.01 0.38 -4.98 120.40 123.02 3naq s VAL 103 Ca 0.63 -2.97 -0.08 0.00 0.00 0.00 0.00 61.98 59.57 3naq s VAL 103 Cb -0.37 -3.52 0.01 0.00 0.00 0.00 0.00 36.38 32.51 3naq s VAL 103 CO 0.31 -0.90 0.97 0.42 0.00 0.00 0.00 175.10 175.90 3naq s THR 104 N -0.11 3.56 0.27 3.92 -4.23 -1.26 -0.71 115.64 117.08 3naq s THR 104 Ca 0.17 0.15 -0.03 0.00 -1.18 0.00 0.00 61.69 60.81 3naq s THR 104 Cb -0.19 -3.45 0.27 0.00 1.34 0.00 0.00 72.50 70.47 3naq s THR 104 CO -0.04 -0.51 1.93 0.00 -0.54 0.00 0.00 174.62 175.46 3naq h ALA 105 N -0.35 1.38 -0.66 3.99 0.00 -1.96 -0.26 119.26 121.39 3naq h ALA 105 Ca -0.45 -0.05 0.04 0.00 0.00 0.00 0.00 54.91 54.45 3naq h ALA 105 Cb 1.26 -0.35 -0.05 0.00 0.00 0.00 0.00 17.79 18.65 3naq h ALA 105 CO 0.62 0.54 0.39 1.49 0.00 0.00 0.00 179.25 182.29 3naq h GLU 106 N 1.21 0.73 -0.16 0.00 4.81 -2.00 -0.65 114.58 118.51 3naq h GLU 106 Ca 0.37 -0.04 -0.21 0.00 -0.13 0.00 0.00 59.36 59.34 3naq h GLU 106 Cb -0.02 -0.16 0.01 0.00 0.63 0.00 0.00 28.75 29.20 3naq h GLU 106 CO -0.11 0.48 -0.74 0.00 -0.73 0.00 0.00 179.01 177.91 3naq h ARG 107 N 0.75 0.76 -0.64 1.92 3.08 -1.78 -2.98 114.38 115.49 3naq h ARG 107 Ca 0.28 -0.60 0.07 0.00 0.07 0.00 0.00 59.98 59.81 3naq h ARG 107 Cb 0.09 0.12 -0.06 0.00 0.08 0.00 0.00 29.97 30.20 3naq h ARG 107 CO -0.14 1.21 0.31 0.82 -1.07 0.00 0.00 179.97 181.10 3naq h ILE 108 N 0.53 0.89 0.00 2.04 2.04 -0.80 -2.20 117.51 120.00 3naq h ILE 108 Ca -0.04 -0.19 -0.01 0.00 1.00 0.00 0.00 64.86 65.62 3naq h ILE 108 Cb 1.36 0.27 -0.00 0.00 -0.74 0.00 0.00 36.82 37.71 3naq h ILE 108 CO 0.15 0.10 -0.04 0.50 0.00 0.00 0.00 178.15 178.86 3naq h LYS 109 N 0.56 0.00 -0.00 2.37 3.64 -1.00 -2.00 116.57 120.15 3naq h LYS 109 Ca 0.30 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.68 3naq h LYS 109 Cb 0.27 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.09 3naq h LYS 109 CO -0.23 0.04 -0.23 1.63 -2.27 0.00 0.00 179.45 178.38 3naq n LYS 110 N -4.20 0.18 -3.28 1.90 5.02 -0.84 -4.77 118.16 112.17 3naq n LYS 110 Ca -0.03 -0.07 -0.46 0.00 -2.02 0.00 0.00 58.31 55.73 3naq n LYS 110 Cb 0.12 -1.50 -0.05 0.00 -0.02 0.00 0.00 35.03 33.59 3naq n LYS 110 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3naq s ALA 111 N -2.86 3.61 0.19 7.82 0.00 -0.75 -4.17 121.76 125.59 3naq s ALA 111 Ca 0.16 -2.49 -0.08 0.00 0.00 0.00 0.00 51.96 49.55 3naq s ALA 111 Cb 0.19 -3.31 0.09 0.00 0.00 0.00 0.00 23.12 20.08 3naq s ALA 111 CO 0.59 -2.08 1.63 -0.22 0.00 0.00 0.00 175.76 175.67 3naq h LYS 112 N 8.93 1.00 0.00 0.00 3.64 -1.50 -3.30 116.57 125.34 3naq h LYS 112 Ca -0.30 -0.35 0.00 0.00 -1.27 0.00 0.00 60.65 58.73 3naq h LYS 112 Cb 1.10 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 32.84 3naq h LYS 112 CO 1.05 1.03 -0.78 0.09 -2.27 0.00 0.00 179.45 178.57 3naq n ASN 113 N -4.15 0.76 -4.67 4.20 3.02 -1.26 -4.99 115.26 108.17 3naq n ASN 113 Ca 0.02 -0.82 -0.46 0.00 -0.03 0.00 0.00 54.58 53.29 3naq n ASN 113 Cb 0.39 1.04 -0.04 0.00 -0.61 0.00 0.00 39.78 40.55 3naq n ASN 113 CO 0.00 0.00 0.00 -0.11 -2.62 0.00 0.00 177.26 174.53 3naq n LEU 114 N -1.40 3.24 0.00 3.41 7.94 -0.40 -4.33 117.00 125.45 3naq n LEU 114 Ca 0.03 1.05 0.00 0.00 -1.11 0.00 0.00 56.01 55.98 3naq n LEU 114 Cb 0.25 -1.42 0.00 0.00 0.53 0.00 0.00 43.42 42.78 3naq n LEU 114 CO 0.31 -0.20 -0.49 1.17 -1.11 0.00 0.00 177.39 177.08 3naq n LYS 115 N 4.37 0.77 -4.34 1.96 3.00 0.04 -4.92 118.16 119.03 3naq n LYS 115 Ca 0.18 0.00 -0.26 0.00 -0.00 0.00 0.00 58.31 58.23 3naq n LYS 115 Cb 0.29 -0.99 -0.17 0.00 0.00 0.00 0.00 35.03 34.17 3naq n LYS 115 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.40 176.23 3naq s LEU 116 N -4.75 1.52 -0.21 3.14 2.96 -0.96 -1.22 118.68 119.16 3naq s LEU 116 Ca 0.00 -0.33 -0.03 0.00 -0.22 0.00 0.00 54.13 53.55 3naq s LEU 116 Cb 0.00 -0.89 -0.01 0.00 0.50 0.00 0.00 46.19 45.80 3naq s LEU 116 CO 0.00 -0.02 -0.06 -0.76 -1.32 0.00 0.00 176.35 174.19 3naq s LEU 117 N 1.06 2.83 -0.10 -0.68 1.43 0.25 -1.49 118.68 121.98 3naq s LEU 117 Ca -0.07 -0.41 0.02 0.00 -1.03 0.00 0.00 54.13 52.65 3naq s LEU 117 Cb -0.15 -1.71 -0.01 0.00 0.03 0.00 0.00 46.19 44.35 3naq s LEU 117 CO -0.01 -0.01 -0.17 -0.76 0.23 0.00 0.00 176.35 175.63 3naq s LEU 118 N 1.41 2.54 -0.31 1.79 1.43 -0.70 -1.02 118.68 123.82 3naq s LEU 118 Ca 0.05 -0.36 -0.13 0.00 -1.03 0.00 0.00 54.13 52.67 3naq s LEU 118 Cb -0.14 -1.53 -0.03 0.00 0.03 0.00 0.00 46.19 44.51 3naq s LEU 118 CO -0.04 0.22 0.25 -0.89 0.23 0.00 0.00 176.35 176.12 3naq s THR 119 N 0.02 5.27 -1.31 5.49 2.01 -0.30 -2.07 115.64 124.75 3naq s THR 119 Ca -0.06 0.03 -0.17 0.00 0.31 0.00 0.00 61.69 61.80 3naq s THR 119 Cb -0.15 -3.66 0.07 0.00 0.01 0.00 0.00 72.50 68.78 3naq s THR 119 CO 0.05 0.09 1.77 0.00 -0.69 0.00 0.00 174.62 175.84 3naq n ALA 120 N 5.14 3.78 0.00 7.40 0.00 -0.12 -3.49 120.51 133.22 3naq n ALA 120 Ca -0.12 -3.88 0.00 0.00 0.00 0.00 0.00 53.44 49.43 3naq n ALA 120 Cb 0.51 -3.56 0.00 0.00 0.00 0.00 0.00 19.45 16.39 3naq n ALA 120 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3naq n GLY 121 N 5.17 0.55 3.18 0.00 0.00 -1.26 -4.62 105.19 108.21 3naq n GLY 121 Ca 0.48 -1.67 -0.27 0.00 0.00 0.00 0.00 46.02 44.56 3naq n GLY 121 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3naq s ILE 122 N -2.96 1.58 0.00 -0.61 1.01 -1.26 -1.61 121.20 117.35 3naq s ILE 122 Ca 0.00 -0.82 0.00 0.00 0.00 0.00 0.00 60.65 59.83 3naq s ILE 122 Cb 0.00 -1.34 0.00 0.00 0.01 0.00 0.00 42.46 41.13 3naq s ILE 122 CO 0.00 0.45 0.00 0.61 0.00 0.00 0.00 174.94 176.00 3naq n GLY 123 N 2.94 3.48 0.14 6.18 0.00 -1.26 -4.72 105.19 111.95 3naq n GLY 123 Ca -0.17 -0.82 0.08 0.00 0.00 0.00 0.00 46.02 45.11 3naq n GLY 123 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3naq n SER 124 N 0.00 1.94 0.12 1.61 3.41 -1.26 -4.74 113.62 114.70 3naq n SER 124 Ca 0.00 -2.87 0.10 0.00 -0.26 0.00 0.00 58.87 55.84 3naq n SER 124 Cb 0.00 -0.38 0.47 0.00 -0.26 0.00 0.00 64.21 64.04 3naq n SER 124 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 3naq n ASP 125 N -1.17 0.53 -0.62 4.04 8.00 -1.26 -1.56 116.55 124.51 3naq n ASP 125 Ca 0.13 0.66 0.10 0.00 0.71 0.00 0.00 54.79 56.39 3naq n ASP 125 Cb 0.64 -0.76 0.32 0.00 -0.02 0.00 0.00 41.12 41.30 3naq n ASP 125 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3naq n HIS 126 N -2.12 0.29 -4.89 1.24 1.44 -1.26 -4.85 115.22 105.06 3naq n HIS 126 Ca 0.01 -0.14 -0.33 0.00 -2.01 0.00 0.00 57.72 55.25 3naq n HIS 126 Cb 0.16 0.00 -0.15 0.00 0.12 0.00 0.00 29.99 30.13 3naq n HIS 126 CO 0.00 0.00 0.00 0.42 -2.81 0.00 0.00 176.34 173.95 3naq s ILE 127 N -1.71 2.86 -0.83 0.61 1.01 -0.60 -0.47 121.20 122.07 3naq s ILE 127 Ca 0.31 -0.75 -0.25 0.00 0.00 0.00 0.00 60.65 59.96 3naq s ILE 127 Cb 0.17 -2.16 0.01 0.00 0.01 0.00 0.00 42.46 40.49 3naq s ILE 127 CO 0.25 0.55 1.60 -0.62 0.00 0.00 0.00 174.94 176.71 3naq s ASP 128 N 0.05 5.85 0.28 3.58 3.68 0.11 -4.85 116.67 125.37 3naq s ASP 128 Ca -0.06 -0.63 0.02 0.00 2.13 0.00 0.00 52.55 54.02 3naq s ASP 128 Cb -0.15 -2.56 0.42 0.00 -1.45 0.00 0.00 42.92 39.19 3naq s ASP 128 CO 0.05 -2.05 1.74 -0.07 0.13 0.00 0.00 175.17 174.96 3naq h LEU 129 N 14.72 0.51 -0.24 -1.34 3.38 -1.90 -0.34 115.31 130.10 3naq h LEU 129 Ca -0.05 -0.16 -0.05 0.00 0.09 0.00 0.00 57.88 57.71 3naq h LEU 129 Cb 1.05 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.66 3naq h LEU 129 CO 1.30 0.72 -0.03 1.56 0.09 0.00 0.00 178.44 182.08 3naq h GLN 130 N 0.46 0.45 -0.76 1.13 7.50 -1.95 0.21 115.11 122.16 3naq h GLN 130 Ca 0.07 -0.16 0.00 0.00 0.50 0.00 0.00 58.65 59.07 3naq h GLN 130 Cb 0.62 -0.03 -0.04 0.00 0.05 0.00 0.00 27.48 28.08 3naq h GLN 130 CO 0.04 0.65 0.49 0.00 -1.50 0.00 0.00 178.83 178.51 3naq h ALA 131 N 0.79 0.96 -0.25 3.87 0.00 -1.89 0.20 119.26 122.93 3naq h ALA 131 Ca 0.07 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.92 3naq h ALA 131 Cb 0.46 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 3naq h ALA 131 CO 0.02 0.39 0.16 0.00 0.00 0.00 0.00 179.25 179.82 3naq h ALA 132 N 1.27 0.31 -0.53 0.00 0.00 -0.84 -0.86 119.26 118.60 3naq h ALA 132 Ca 0.28 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.17 3naq h ALA 132 Cb -0.10 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.57 3naq h ALA 132 CO -0.06 -0.22 0.35 0.00 0.00 0.00 0.00 179.25 179.32 3naq h ALA 133 N 1.09 0.68 0.00 0.00 0.00 -0.75 -0.90 119.26 119.38 3naq h ALA 133 Ca 0.09 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 3naq h ALA 133 Cb -0.04 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 17.53 3naq h ALA 133 CO -0.02 0.13 -0.09 0.00 0.00 0.00 0.00 179.25 179.27 3naq h ALA 134 N 1.19 1.79 -0.06 0.00 0.00 -0.59 -0.85 119.26 120.74 3naq h ALA 134 Ca 0.19 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.03 3naq h ALA 134 Cb -0.07 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.71 3naq h ALA 134 CO -0.04 0.11 0.00 0.00 0.00 0.00 0.00 179.25 179.32 3naq n ALA 135 N -2.49 2.58 -1.30 0.00 0.00 -0.36 -4.92 120.51 114.01 3naq n ALA 135 Ca -0.03 -0.41 -0.03 0.00 0.00 0.00 0.00 53.44 52.98 3naq n ALA 135 Cb 0.16 -1.20 -0.01 0.00 0.00 0.00 0.00 19.45 18.40 3naq n ALA 135 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3naq n GLY 136 N 1.10 0.53 3.92 0.00 0.00 -0.32 -4.98 105.19 105.43 3naq n GLY 136 Ca 0.18 -0.90 -0.27 0.00 0.00 0.00 0.00 46.02 45.03 3naq n GLY 136 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3naq s LEU 137 N -0.72 2.89 -0.11 0.99 1.43 -0.40 -3.42 118.68 119.35 3naq s LEU 137 Ca 0.00 0.65 0.01 0.00 -1.03 0.00 0.00 54.13 53.76 3naq s LEU 137 Cb 0.00 -3.34 -0.01 0.00 0.03 0.00 0.00 46.19 42.86 3naq s LEU 137 CO 0.00 -1.47 -0.15 -0.89 0.23 0.00 0.00 176.35 174.07 3naq s THR 138 N -3.24 2.87 -0.11 5.49 2.01 -0.36 -0.68 115.64 121.63 3naq s THR 138 Ca 0.58 -0.74 0.02 0.00 0.31 0.00 0.00 61.69 61.87 3naq s THR 138 Cb -0.11 -2.18 0.01 0.00 0.01 0.00 0.00 72.50 70.24 3naq s THR 138 CO 0.46 0.54 -0.15 -0.69 -0.69 0.00 0.00 174.62 174.09 3naq s VAL 139 N 0.20 1.51 0.06 3.82 1.01 0.17 -0.59 120.40 126.58 3naq s VAL 139 Ca -0.09 -0.65 -0.04 0.00 0.00 0.00 0.00 61.98 61.19 3naq s VAL 139 Cb -0.16 -1.37 -0.02 0.00 0.00 0.00 0.00 36.38 34.83 3naq s VAL 139 CO 0.06 0.44 0.07 0.00 0.00 0.00 0.00 175.10 175.66 3naq s ALA 140 N 0.95 0.17 0.24 5.51 0.00 -0.19 -0.30 121.76 128.14 3naq s ALA 140 Ca -0.07 -0.92 -0.01 0.00 0.00 0.00 0.00 51.96 50.96 3naq s ALA 140 Cb -0.15 0.35 -0.03 0.00 0.00 0.00 0.00 23.12 23.29 3naq s ALA 140 CO -0.01 -0.42 0.23 -1.83 0.00 0.00 0.00 175.76 173.73 3naq s GLU 141 N -3.77 1.40 -1.19 0.00 -1.05 -0.17 -1.15 118.70 112.77 3naq s GLU 141 Ca 0.05 -1.67 -0.11 0.00 -0.15 0.00 0.00 54.97 53.09 3naq s GLU 141 Cb 0.06 0.32 0.21 0.00 -0.44 0.00 0.00 34.13 34.28 3naq s GLU 141 CO -0.10 -0.50 1.41 0.28 0.95 0.00 0.00 175.26 177.31 3naq n VAL 142 N -0.37 4.44 -1.73 1.83 0.31 -0.63 -4.49 118.33 117.68 3naq n VAL 142 Ca 0.03 -4.96 -0.42 0.00 -0.01 0.00 0.00 64.34 58.98 3naq n VAL 142 Cb 0.64 -2.46 -0.02 0.00 -0.91 0.00 0.00 33.84 31.10 3naq n VAL 142 CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 3naq n THR 143 N 3.65 0.60 -0.58 2.52 -1.04 -1.26 -2.77 114.28 115.40 3naq n THR 143 Ca 0.33 -0.15 0.00 0.00 -2.04 0.00 0.00 64.05 62.19 3naq n THR 143 Cb 0.40 -1.94 0.00 0.00 -1.82 0.00 0.00 70.33 66.97 3naq n THR 143 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3naq n GLY 144 N 2.89 0.78 0.03 3.41 0.00 -1.26 -4.90 105.19 106.13 3naq n GLY 144 Ca 0.12 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.27 3naq n GLY 144 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3naq n SER 145 N 0.00 0.32 -0.60 1.61 7.64 -1.11 -3.53 113.62 117.95 3naq n SER 145 Ca 0.00 -0.05 0.10 0.00 1.01 0.00 0.00 58.87 59.93 3naq n SER 145 Cb 0.00 -0.09 0.03 0.00 -1.01 0.00 0.00 64.21 63.14 3naq n SER 145 CO 0.00 0.00 0.00 -0.46 -3.01 0.00 0.00 175.04 171.57 3naq n ASN 146 N -1.38 2.20 -0.11 6.43 6.94 -1.26 -4.75 115.26 123.33 3naq n ASN 146 Ca 0.08 -1.60 -0.14 0.00 -0.02 0.00 0.00 54.58 52.90 3naq n ASN 146 Cb 0.33 0.27 -0.03 0.00 -2.36 0.00 0.00 39.78 37.99 3naq n ASN 146 CO 0.00 0.00 0.00 -0.37 -1.03 0.00 0.00 177.26 175.86 3naq h VAL 147 N 2.92 1.27 -0.48 3.53 -1.51 -1.99 -1.65 116.25 118.34 3naq h VAL 147 Ca 0.00 -1.59 -0.11 0.00 -1.23 0.00 0.00 66.70 63.77 3naq h VAL 147 Cb 0.73 1.43 -0.01 0.00 -2.13 0.00 0.00 31.29 31.31 3naq h VAL 147 CO 0.00 0.53 -0.13 0.58 -1.23 0.00 0.00 177.57 177.32 3naq h VAL 148 N 0.74 1.27 -0.05 7.19 2.07 -1.85 -1.96 116.25 123.66 3naq h VAL 148 Ca 0.05 -1.27 0.02 0.00 0.82 0.00 0.00 66.70 66.32 3naq h VAL 148 Cb 1.02 1.10 -0.03 0.00 -1.52 0.00 0.00 31.29 31.86 3naq h VAL 148 CO 0.10 0.44 -0.10 0.28 0.02 0.00 0.00 177.57 178.31 3naq h SER 149 N 0.78 -0.29 -0.61 0.57 0.02 -1.78 0.05 113.55 112.29 3naq h SER 149 Ca 0.12 0.05 -0.08 0.00 -0.84 0.00 0.00 61.79 61.04 3naq h SER 149 Cb 0.69 0.14 -0.02 0.00 0.14 0.00 0.00 62.40 63.34 3naq h SER 149 CO 0.05 -0.14 0.08 0.58 -1.14 0.00 0.00 176.83 176.27 3naq h VAL 150 N -0.15 1.26 -0.46 2.27 2.07 -1.23 -2.11 116.25 117.90 3naq h VAL 150 Ca 0.05 -1.03 -0.00 0.00 0.82 0.00 0.00 66.70 66.54 3naq h VAL 150 Cb 0.22 0.73 -0.02 0.00 -1.52 0.00 0.00 31.29 30.70 3naq h VAL 150 CO -0.13 0.38 0.29 0.00 0.02 0.00 0.00 177.57 178.12 3naq h ALA 151 N 1.02 0.59 -0.63 1.67 0.00 -0.97 -0.58 119.26 120.35 3naq h ALA 151 Ca 0.18 -0.05 0.06 0.00 0.00 0.00 0.00 54.91 55.10 3naq h ALA 151 Cb 0.45 -0.19 -0.05 0.00 0.00 0.00 0.00 17.79 18.00 3naq h ALA 151 CO 0.02 0.06 0.34 0.93 0.00 0.00 0.00 179.25 180.60 3naq h GLU 152 N 0.62 0.62 -0.28 0.00 5.08 -0.93 -1.67 114.58 118.01 3naq h GLU 152 Ca 0.17 -0.04 -0.10 0.00 -1.00 0.00 0.00 59.36 58.39 3naq h GLU 152 Cb -0.03 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.07 3naq h GLU 152 CO -0.03 0.41 -0.25 0.22 -1.00 0.00 0.00 179.01 178.35 3naq h ASP 153 N 0.64 0.56 0.02 1.42 3.58 -0.77 -0.10 116.42 121.77 3naq h ASP 153 Ca 0.28 -0.20 -0.00 0.00 0.42 0.00 0.00 57.03 57.54 3naq h ASP 153 Cb 0.18 -0.15 0.00 0.00 1.72 0.00 0.00 39.33 41.08 3naq h ASP 153 CO -0.18 0.81 -0.01 -0.33 -2.88 0.00 0.00 179.24 176.64 3naq h GLU 154 N 0.49 -0.03 -0.62 0.28 5.08 -0.80 -1.51 114.58 117.47 3naq h GLU 154 Ca 0.07 0.00 0.02 0.00 -1.00 0.00 0.00 59.36 58.45 3naq h GLU 154 Cb 0.70 0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.92 3naq h GLU 154 CO 0.05 0.04 0.40 1.25 -1.00 0.00 0.00 179.01 179.75 3naq h LEU 155 N -0.08 0.66 -0.58 1.33 6.46 -0.88 -0.80 115.31 121.43 3naq h LEU 155 Ca -0.00 -0.01 0.11 0.00 -0.12 0.00 0.00 57.88 57.86 3naq h LEU 155 Cb 0.08 -0.15 -0.09 0.00 -0.73 0.00 0.00 40.66 39.76 3naq h LEU 155 CO 0.00 0.47 0.06 -0.03 -0.62 0.00 0.00 178.44 178.33 3naq h MET 156 N 0.79 0.18 -0.18 1.25 4.05 -0.83 -1.85 114.93 118.35 3naq h MET 156 Ca 0.24 -0.01 -0.12 0.00 -0.28 0.00 0.00 59.70 59.53 3naq h MET 156 Cb -0.03 -0.04 -0.01 0.00 -0.80 0.00 0.00 31.60 30.71 3naq h MET 156 CO -0.08 0.12 -0.41 0.00 0.23 0.00 0.00 176.91 176.77 3naq h ARG 157 N 0.19 0.40 -0.05 0.39 3.08 -0.66 0.64 114.38 118.36 3naq h ARG 157 Ca 0.30 -0.20 0.02 0.00 0.07 0.00 0.00 59.98 60.17 3naq h ARG 157 Cb 0.46 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.49 3naq h ARG 157 CO -0.44 0.75 -0.07 0.82 -1.07 0.00 0.00 179.97 179.96 3naq h ILE 158 N 0.34 0.81 -0.45 2.04 2.04 -0.43 -0.80 117.51 121.05 3naq h ILE 158 Ca 0.03 0.00 -0.05 0.00 1.00 0.00 0.00 64.86 65.84 3naq h ILE 158 Cb 0.86 0.81 -0.02 0.00 -0.74 0.00 0.00 36.82 37.73 3naq h ILE 158 CO 0.07 0.00 0.09 -0.07 0.00 0.00 0.00 178.15 178.25 3naq h LEU 159 N -0.09 0.69 -0.23 1.44 3.38 -1.03 0.56 115.31 120.03 3naq h LEU 159 Ca 0.05 -0.24 0.04 0.00 0.09 0.00 0.00 57.88 57.81 3naq h LEU 159 Cb 0.16 -0.18 -0.04 0.00 0.09 0.00 0.00 40.66 40.69 3naq h LEU 159 CO -0.11 0.76 -0.01 0.40 0.09 0.00 0.00 178.44 179.57 3naq h ILE 160 N 0.59 0.83 0.10 1.22 2.04 -0.65 0.80 117.51 122.44 3naq h ILE 160 Ca 0.14 -0.02 -0.00 0.00 1.00 0.00 0.00 64.86 65.97 3naq h ILE 160 Cb 0.34 0.76 0.00 0.00 -0.74 0.00 0.00 36.82 37.18 3naq h ILE 160 CO 0.00 0.01 -0.05 -0.07 0.00 0.00 0.00 178.15 178.05 3naq h LEU 161 N 0.07 -0.11 -0.36 1.44 3.38 -1.08 -1.59 115.31 117.05 3naq h LEU 161 Ca 0.11 -0.24 0.02 0.00 0.09 0.00 0.00 57.88 57.86 3naq h LEU 161 Cb 0.14 0.03 -0.03 0.00 0.09 0.00 0.00 40.66 40.90 3naq h LEU 161 CO -0.19 0.18 0.19 -0.03 0.09 0.00 0.00 178.44 178.68 3naq h MET 162 N -0.41 0.38 -0.01 1.13 4.05 -0.66 -2.64 114.93 116.76 3naq h MET 162 Ca -0.01 -0.02 0.00 0.00 -0.28 0.00 0.00 59.70 59.38 3naq h MET 162 Cb 0.34 -0.09 0.00 0.00 -0.80 0.00 0.00 31.60 31.06 3naq h MET 162 CO 0.02 0.25 -0.03 0.54 0.23 0.00 0.00 176.91 177.92 3naq n ARG 163 N -4.92 1.55 -3.44 0.39 1.74 0.26 -0.96 116.66 111.27 3naq n ARG 163 Ca 0.01 -0.89 -0.18 0.00 -0.77 0.00 0.00 57.85 56.01 3naq n ARG 163 Cb 0.08 -1.48 0.08 0.00 -1.02 0.00 0.00 32.46 30.12 3naq n ARG 163 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 3naq n ASN 164 N 0.05 -3.34 -0.10 0.55 5.15 -0.67 -4.65 115.26 112.25 3naq n ASN 164 Ca 0.18 -0.57 -0.08 0.00 -0.60 0.00 0.00 54.58 53.50 3naq n ASN 164 Cb 0.35 -4.94 -0.01 0.00 -0.53 0.00 0.00 39.78 34.65 3naq n ASN 164 CO 0.00 0.00 0.00 0.15 1.40 0.00 0.00 177.26 178.81 3naq h PHE 165 N -2.08 0.40 -0.08 1.20 3.57 -1.64 -3.30 116.94 115.01 3naq h PHE 165 Ca -0.56 0.01 0.01 0.00 3.53 0.00 0.00 57.97 60.96 3naq h PHE 165 Cb 1.34 -0.13 -0.01 0.00 2.79 0.00 0.00 35.95 39.94 3naq h PHE 165 CO 0.44 0.24 0.02 0.28 -2.23 0.00 0.00 178.31 177.06 3naq h VAL 166 N 0.43 0.96 -0.60 1.41 2.07 -1.92 0.13 116.25 118.74 3naq h VAL 166 Ca 0.13 -0.02 -0.00 0.00 0.82 0.00 0.00 66.70 67.63 3naq h VAL 166 Cb -0.02 0.91 -0.03 0.00 -1.52 0.00 0.00 31.29 30.62 3naq h VAL 166 CO -0.05 0.01 0.37 -0.65 0.02 0.00 0.00 177.57 177.27 3naq h PRO 167 N 0.05 0.80 -0.30 1.57 0.11 -1.96 0.45 132.00 132.72 3naq h PRO 167 Ca 0.04 -0.06 -0.02 0.00 0.11 0.00 0.00 66.00 66.07 3naq h PRO 167 Cb 0.03 -0.17 -0.01 0.00 0.11 0.00 0.00 31.00 30.95 3naq h PRO 167 CO -0.05 0.55 0.12 0.78 -0.21 0.00 0.00 178.00 179.20 3naq h GLY 168 N 0.85 0.49 0.98 -0.55 0.00 -1.37 -1.59 103.07 101.87 3naq h GLY 168 Ca 0.22 -0.27 0.01 0.00 0.00 0.00 0.00 47.33 47.29 3naq h GLY 168 CO -0.04 0.25 0.37 -1.82 0.00 0.00 0.00 176.54 175.30 3naq h TYR 169 N 0.34 0.71 -0.22 5.60 3.20 -0.24 -2.69 116.97 123.67 3naq h TYR 169 Ca 0.10 0.02 -0.05 0.00 3.14 0.00 0.00 58.73 61.94 3naq h TYR 169 Cb 0.18 -0.24 -0.01 0.00 1.54 0.00 0.00 36.73 38.20 3naq h TYR 169 CO -0.01 0.44 -0.10 -0.91 -1.64 0.00 0.00 178.16 175.95 3naq h ASN 170 N 0.76 0.33 -0.76 -2.11 2.35 -0.73 -1.54 115.58 113.88 3naq h ASN 170 Ca 0.22 -0.07 -0.03 0.00 -0.55 0.00 0.00 56.30 55.87 3naq h ASN 170 Cb -0.07 -0.09 -0.04 0.00 0.05 0.00 0.00 38.32 38.18 3naq h ASN 170 CO -0.06 0.46 0.36 1.56 -1.65 0.00 0.00 177.43 178.11 3naq h GLN 171 N 0.33 1.11 0.07 0.81 4.20 -1.07 -2.89 115.11 117.67 3naq h GLN 171 Ca 0.07 -0.16 0.01 0.00 0.06 0.00 0.00 58.65 58.62 3naq h GLN 171 Cb 0.38 -0.20 -0.01 0.00 0.30 0.00 0.00 27.48 27.95 3naq h GLN 171 CO 0.02 0.86 -0.11 0.28 -0.67 0.00 0.00 178.83 179.21 3naq h VAL 172 N 1.10 0.75 0.00 -0.54 2.07 -0.96 0.31 116.25 118.97 3naq h VAL 172 Ca 0.26 0.00 -0.08 0.00 0.82 0.00 0.00 66.70 67.70 3naq h VAL 172 Cb 0.13 0.75 -0.01 0.00 -1.52 0.00 0.00 31.29 30.63 3naq h VAL 172 CO -0.03 0.00 -0.38 -0.37 0.02 0.00 0.00 177.57 176.81 3naq h VAL 173 N -0.22 1.26 -0.01 2.57 -1.51 -1.55 -2.62 116.25 114.17 3naq h VAL 173 Ca 0.02 -1.31 0.00 0.00 -1.23 0.00 0.00 66.70 64.17 3naq h VAL 173 Cb 0.23 1.71 0.00 0.00 -2.13 0.00 0.00 31.29 31.10 3naq h VAL 173 CO -0.06 0.37 -0.01 0.29 -1.23 0.00 0.00 177.57 176.94 3naq n LYS 174 N -4.07 1.44 -1.01 5.19 5.02 -1.00 -4.91 118.16 118.83 3naq n LYS 174 Ca -0.02 -0.68 -0.00 0.00 -2.02 0.00 0.00 58.31 55.59 3naq n LYS 174 Cb 0.42 -1.49 -0.00 0.00 -0.02 0.00 0.00 35.03 33.94 3naq n LYS 174 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3naq n GLY 175 N 1.13 0.45 3.94 0.72 0.00 -0.82 -5.03 105.19 105.58 3naq n GLY 175 Ca 0.20 -0.58 -0.25 0.00 0.00 0.00 0.00 46.02 45.39 3naq n GLY 175 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3naq s GLU 176 N -1.11 2.96 -0.36 1.61 2.02 0.03 -5.03 118.70 118.83 3naq s GLU 176 Ca 0.00 -0.27 0.05 0.00 0.02 0.00 0.00 54.97 54.77 3naq s GLU 176 Cb 0.00 -2.41 0.17 0.00 0.10 0.00 0.00 34.13 31.99 3naq s GLU 176 CO 0.00 -0.51 0.51 -0.46 0.02 0.00 0.00 175.26 174.81 3naq s TRP 177 N -2.79 -1.20 -0.40 1.61 -0.11 -1.26 -4.48 118.94 110.31 3naq s TRP 177 Ca 0.52 0.10 0.02 0.00 1.22 0.00 0.00 56.10 57.96 3naq s TRP 177 Cb -0.10 0.01 0.16 0.00 -1.50 0.00 0.00 33.47 32.04 3naq s TRP 177 CO 0.42 -1.07 0.29 1.21 -4.62 0.00 0.00 176.95 173.18 3naq s ASN 178 N 2.03 2.15 0.22 5.86 2.47 -1.26 -5.00 114.94 121.41 3naq s ASN 178 Ca 0.14 -2.75 -0.09 0.00 0.42 0.00 0.00 52.86 50.58 3naq s ASN 178 Cb -0.10 -0.47 0.18 0.00 -1.45 0.00 0.00 41.25 39.41 3naq s ASN 178 CO -0.14 -0.22 1.88 0.58 -3.72 0.00 0.00 177.10 175.48 3naq h VAL 179 N 4.79 1.18 -0.84 -5.21 2.07 -2.00 -2.52 116.25 113.72 3naq h VAL 179 Ca 0.18 -0.36 0.02 0.00 0.82 0.00 0.00 66.70 67.36 3naq h VAL 179 Cb 0.93 0.05 -0.04 0.00 -1.52 0.00 0.00 31.29 30.70 3naq h VAL 179 CO 0.34 0.19 0.56 0.00 0.02 0.00 0.00 177.57 178.68 3naq h ALA 180 N 1.30 1.42 0.00 1.67 0.00 -1.98 0.25 119.26 121.91 3naq h ALA 180 Ca 0.29 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.15 3naq h ALA 180 Cb -0.09 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 17.37 3naq h ALA 180 CO -0.07 0.53 0.00 0.78 0.00 0.00 0.00 179.25 180.49 3naq h GLY 181 N 1.12 0.00 0.00 0.00 0.00 -1.89 -2.46 103.07 99.84 3naq h GLY 181 Ca 0.32 0.00 -0.30 0.00 0.00 0.00 0.00 47.33 47.34 3naq h GLY 181 CO -0.08 0.00 -2.03 1.39 0.00 0.00 0.00 176.54 175.82 3naq n ILE 182 N -2.36 1.02 0.05 2.60 5.41 -0.20 -4.67 119.36 121.21 3naq n ILE 182 Ca -0.00 -0.29 0.09 0.00 1.00 0.00 0.00 62.75 63.55 3naq n ILE 182 Cb 0.13 -1.60 0.53 0.00 -0.71 0.00 0.00 39.64 37.99 3naq n ILE 182 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3naq h ALA 183 N -0.51 1.96 0.00 -1.39 0.00 -0.44 -2.82 119.26 116.06 3naq h ALA 183 Ca -0.45 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.44 3naq h ALA 183 Cb 1.46 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.17 3naq h ALA 183 CO -0.23 -0.02 0.00 0.10 0.00 0.00 0.00 179.25 179.10 3naq h TYR 184 N 0.30 0.00 0.00 0.00 -0.00 -1.69 -1.73 116.97 113.85 3naq h TYR 184 Ca 0.15 0.00 -0.01 0.00 0.00 0.00 0.00 58.73 58.87 3naq h TYR 184 Cb 0.23 0.00 -0.02 0.00 0.00 0.00 0.00 36.73 36.94 3naq h TYR 184 CO -0.00 0.00 -0.22 0.54 -0.00 0.00 0.00 178.16 178.48 3naq n ARG 185 N -2.79 0.99 -4.45 0.10 5.12 -1.07 -5.02 116.66 109.55 3naq n ARG 185 Ca -0.00 -2.32 -0.34 0.00 -1.93 0.00 0.00 57.85 53.27 3naq n ARG 185 Cb 0.20 -1.24 -0.13 0.00 -1.16 0.00 0.00 32.46 30.13 3naq n ARG 185 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 3naq s ALA 186 N -2.19 2.94 0.16 7.54 0.00 -0.65 -4.46 121.76 125.09 3naq s ALA 186 Ca 0.26 -0.84 0.03 0.00 0.00 0.00 0.00 51.96 51.41 3naq s ALA 186 Cb 0.24 -1.51 -0.05 0.00 0.00 0.00 0.00 23.12 21.80 3naq s ALA 186 CO 0.00 0.20 -0.05 0.71 0.00 0.00 0.00 175.76 176.62 3naq s TYR 187 N 0.39 1.21 0.42 0.00 2.02 -0.14 -4.94 117.35 116.32 3naq s TYR 187 Ca -0.05 -0.89 -0.15 0.00 -0.37 0.00 0.00 57.07 55.61 3naq s TYR 187 Cb -0.14 -0.67 -0.08 0.00 -0.40 0.00 0.00 41.96 40.67 3naq s TYR 187 CO 0.03 -0.07 0.85 -0.51 -1.57 0.00 0.00 175.55 174.28 3naq s ASP 188 N -3.16 6.66 0.22 2.29 1.01 -1.26 -3.58 116.67 118.83 3naq s ASP 188 Ca 0.19 1.36 0.04 0.00 0.71 0.00 0.00 52.55 54.86 3naq s ASP 188 Cb 0.05 -2.42 0.18 0.00 1.01 0.00 0.00 42.92 41.74 3naq s ASP 188 CO 0.02 -0.41 1.51 0.25 0.21 0.00 0.00 175.17 176.74 3naq h LEU 189 N 1.44 0.26 -9.26 1.23 5.85 -1.93 -3.44 115.31 109.46 3naq h LEU 189 Ca -0.47 -0.16 -0.68 0.00 0.84 0.00 0.00 57.88 57.40 3naq h LEU 189 Cb 1.18 -0.08 0.06 0.00 0.37 0.00 0.00 40.66 42.20 3naq h LEU 189 CO 0.63 0.86 0.34 1.21 -0.34 0.00 0.00 178.44 181.15 3naq n GLU 190 N -3.81 1.02 -0.36 1.25 2.13 -1.25 -1.97 120.64 117.66 3naq n GLU 190 Ca -0.03 0.37 0.00 0.00 0.66 0.00 0.00 57.16 58.16 3naq n GLU 190 Cb 0.67 -1.94 0.00 0.00 0.27 0.00 0.00 31.44 30.44 3naq n GLU 190 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3naq n GLY 191 N 2.27 1.68 3.86 8.31 0.00 0.05 -4.94 105.19 116.41 3naq n GLY 191 Ca 0.18 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.88 3naq n GLY 191 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3naq s LYS 192 N -0.22 3.92 -0.25 1.61 -0.14 -0.83 -4.55 119.74 119.28 3naq s LYS 192 Ca 0.00 0.62 -0.20 0.00 -1.36 0.00 0.00 55.97 55.04 3naq s LYS 192 Cb 0.00 -2.39 -0.02 0.00 -1.68 0.00 0.00 37.83 33.74 3naq s LYS 192 CO 0.00 0.05 0.59 0.99 -0.76 0.00 0.00 175.35 176.22 3naq s THR 193 N -2.18 5.02 -0.15 2.17 2.01 -1.26 -0.48 115.64 120.76 3naq s THR 193 Ca 0.54 1.05 0.02 0.00 0.31 0.00 0.00 61.69 63.61 3naq s THR 193 Cb -0.10 -3.90 0.01 0.00 0.01 0.00 0.00 72.50 68.52 3naq s THR 193 CO 0.24 0.05 -0.21 -0.63 -0.69 0.00 0.00 174.62 173.38 3naq s ILE 194 N 2.39 2.09 -0.15 1.82 -1.09 -0.20 -0.53 121.20 125.53 3naq s ILE 194 Ca 0.25 -0.96 0.01 0.00 -2.23 0.00 0.00 60.65 57.71 3naq s ILE 194 Cb -0.16 -1.85 -0.00 0.00 -1.58 0.00 0.00 42.46 38.88 3naq s ILE 194 CO 0.09 0.55 -0.16 -0.83 -1.23 0.00 0.00 174.94 173.35 3naq s GLY 195 N 0.96 1.46 -0.20 6.18 0.00 -0.29 -0.59 107.32 114.84 3naq s GLY 195 Ca -0.03 -1.04 -0.10 0.00 0.00 0.00 0.00 44.72 43.54 3naq s GLY 195 CO -0.05 -0.00 0.15 -1.08 0.00 0.00 0.00 173.10 172.12 3naq s THR 196 N 0.77 5.40 -0.51 0.90 -1.32 -0.62 -0.70 115.64 119.57 3naq s THR 196 Ca -0.06 0.23 -0.19 0.00 -1.21 0.00 0.00 61.69 60.46 3naq s THR 196 Cb -0.15 -3.49 0.06 0.00 -1.51 0.00 0.00 72.50 67.41 3naq s THR 196 CO 0.00 0.43 0.62 -0.69 -2.21 0.00 0.00 174.62 172.77 3naq s VAL 197 N 0.38 4.90 0.00 5.08 1.01 0.17 -1.61 120.40 130.32 3naq s VAL 197 Ca 0.09 -0.59 0.00 0.00 0.00 0.00 0.00 61.98 61.48 3naq s VAL 197 Cb -0.11 -4.31 0.00 0.00 0.00 0.00 0.00 36.38 31.96 3naq s VAL 197 CO -0.01 -0.82 0.00 0.61 0.00 0.00 0.00 175.10 174.87 3naq n GLY 198 N 5.18 -0.23 2.52 4.51 0.00 0.28 -0.21 105.19 117.25 3naq n GLY 198 Ca -0.07 -1.39 -0.12 0.00 0.00 0.00 0.00 46.02 44.44 3naq n GLY 198 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3naq n ALA 199 N 0.61 1.57 -1.00 4.61 0.00 -1.25 -4.58 120.51 120.48 3naq n ALA 199 Ca 0.00 -2.52 0.00 0.00 0.00 0.00 0.00 53.44 50.92 3naq n ALA 199 Cb 0.00 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.45 3naq n ALA 199 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3naq n GLY 200 N 0.06 0.14 0.20 0.00 0.00 -1.26 -4.38 105.19 99.96 3naq n GLY 200 Ca 0.12 -1.40 -0.08 0.00 0.00 0.00 0.00 46.02 44.66 3naq n GLY 200 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3naq h ARG 201 N 0.00 0.62 -0.32 1.61 3.08 -1.98 -0.00 114.38 117.38 3naq h ARG 201 Ca 0.00 -0.08 -0.06 0.00 0.07 0.00 0.00 59.98 59.91 3naq h ARG 201 Cb 0.00 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 29.92 3naq h ARG 201 CO 0.00 0.51 -0.03 0.82 -1.07 0.00 0.00 179.97 180.20 3naq h ILE 202 N 0.57 1.27 -0.57 2.04 2.04 -1.91 -1.78 117.51 119.17 3naq h ILE 202 Ca 0.15 -1.02 -0.09 0.00 1.00 0.00 0.00 64.86 64.90 3naq h ILE 202 Cb 0.08 1.29 -0.02 0.00 -0.74 0.00 0.00 36.82 37.42 3naq h ILE 202 CO -0.02 0.33 0.01 1.23 0.00 0.00 0.00 178.15 179.70 3naq h GLY 203 N 0.38 1.05 0.63 5.37 0.00 -1.76 -0.58 103.07 108.16 3naq h GLY 203 Ca 0.09 -0.74 0.04 0.00 0.00 0.00 0.00 47.33 46.72 3naq h GLY 203 CO 0.02 0.68 0.00 0.50 0.00 0.00 0.00 176.54 177.75 3naq h LYS 204 N 0.90 0.08 -0.62 4.80 1.57 -0.91 -0.76 116.57 121.63 3naq h LYS 204 Ca 0.17 -0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 58.90 3naq h LYS 204 Cb 0.51 -0.02 -0.03 0.00 0.08 0.00 0.00 32.23 32.77 3naq h LYS 204 CO 0.02 0.05 0.20 -0.07 -0.57 0.00 0.00 179.45 179.09 3naq h LEU 205 N 0.08 0.86 -0.41 2.94 3.38 -0.82 -1.43 115.31 119.92 3naq h LEU 205 Ca 0.12 -0.14 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 3naq h LEU 205 Cb 0.15 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.65 3naq h LEU 205 CO -0.19 0.81 0.23 0.25 0.09 0.00 0.00 178.44 179.63 3naq h LEU 206 N 0.91 0.51 -0.91 1.67 5.85 -0.89 -1.85 115.31 120.60 3naq h LEU 206 Ca 0.21 -0.08 -0.05 0.00 0.84 0.00 0.00 57.88 58.80 3naq h LEU 206 Cb 0.25 -0.13 -0.03 0.00 0.37 0.00 0.00 40.66 41.12 3naq h LEU 206 CO -0.01 0.44 0.24 -0.07 -0.34 0.00 0.00 178.44 178.70 3naq h LEU 207 N 0.54 0.96 -0.74 2.25 3.38 -0.67 0.11 115.31 121.13 3naq h LEU 207 Ca 0.15 -0.16 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 3naq h LEU 207 Cb 0.04 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 40.50 3naq h LEU 207 CO -0.02 0.88 0.43 1.56 0.09 0.00 0.00 178.44 181.37 3naq h GLN 208 N 1.01 1.02 0.00 1.13 4.20 -1.14 -1.44 115.11 119.87 3naq h GLN 208 Ca 0.23 -0.10 -0.06 0.00 0.06 0.00 0.00 58.65 58.77 3naq h GLN 208 Cb 0.24 -0.21 -0.01 0.00 0.30 0.00 0.00 27.48 27.81 3naq h GLN 208 CO -0.01 0.74 -0.29 0.00 -0.67 0.00 0.00 178.83 178.59 3naq h ARG 209 N 1.02 0.00 0.00 1.46 3.08 -0.42 -3.20 114.38 116.31 3naq h ARG 209 Ca 0.26 0.00 -0.14 0.00 0.07 0.00 0.00 59.98 60.17 3naq h ARG 209 Cb -0.01 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.02 3naq h ARG 209 CO -0.05 0.29 -0.67 -0.07 -1.07 0.00 0.00 179.97 178.40 3naq h LEU 210 N 0.00 0.00 -0.72 3.04 3.38 -0.02 -3.38 115.31 117.61 3naq h LEU 210 Ca -0.00 0.00 0.14 0.00 0.09 0.00 0.00 57.88 58.11 3naq h LEU 210 Cb 0.98 0.00 -0.14 0.00 0.09 0.00 0.00 40.66 41.59 3naq h LEU 210 CO 0.04 0.67 -0.23 0.50 0.09 0.00 0.00 178.44 179.51 3naq h LYS 211 N 0.00 -0.04 0.00 1.13 1.63 -1.29 -0.11 116.57 117.89 3naq h LYS 211 Ca -0.01 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.80 3naq h LYS 211 Cb 1.45 0.01 0.00 0.00 -0.60 0.00 0.00 32.23 33.09 3naq h LYS 211 CO 0.09 -0.03 0.00 -0.35 -3.45 0.00 0.00 179.45 175.71 3naq n PRO 212 N -5.48 0.03 0.06 1.90 -0.04 -1.26 -2.77 135.00 127.45 3naq n PRO 212 Ca 0.09 0.24 0.12 0.00 -0.04 0.00 0.00 63.50 63.91 3naq n PRO 212 Cb 0.38 -1.56 0.47 0.00 -0.04 0.00 0.00 33.50 32.75 3naq n PRO 212 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 3naq n PHE 213 N -1.62 0.48 -2.67 0.54 3.01 -0.05 -4.92 117.46 112.23 3naq n PHE 213 Ca 0.04 0.16 -0.06 0.00 1.01 0.00 0.00 57.45 58.59 3naq n PHE 213 Cb 0.20 -0.76 0.02 0.00 -0.01 0.00 0.00 39.48 38.94 3naq n PHE 213 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3naq n GLY 214 N 0.85 0.40 4.01 1.37 0.00 -1.11 -3.93 105.19 106.77 3naq n GLY 214 Ca 0.05 -0.37 -0.17 0.00 0.00 0.00 0.00 46.02 45.53 3naq n GLY 214 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3naq s ASN 216 N -4.37 6.19 -0.17 0.00 3.04 0.36 -4.87 114.94 115.12 3naq s ASN 216 Ca 0.55 -1.54 -0.15 0.00 0.04 0.00 0.00 52.86 51.76 3naq s ASN 216 Cb -0.09 -2.26 -0.04 0.00 -1.54 0.00 0.00 41.25 37.31 3naq s ASN 216 CO 0.33 -1.00 0.36 -0.76 -3.04 0.00 0.00 177.10 173.00 3naq s LEU 217 N 2.26 4.22 0.09 3.21 1.43 -1.26 -1.04 118.68 127.58 3naq s LEU 217 Ca 0.08 0.56 0.09 0.00 -1.03 0.00 0.00 54.13 53.83 3naq s LEU 217 Cb -0.26 -2.48 -0.03 0.00 0.03 0.00 0.00 46.19 43.45 3naq s LEU 217 CO 0.05 0.02 -0.24 -0.76 0.23 0.00 0.00 176.35 175.65 3naq s LEU 218 N 0.81 2.25 0.02 1.79 1.43 0.24 -0.72 118.68 124.50 3naq s LEU 218 Ca 0.19 -0.65 -0.05 0.00 -1.03 0.00 0.00 54.13 52.58 3naq s LEU 218 Cb -0.14 -1.08 -0.01 0.00 0.03 0.00 0.00 46.19 44.99 3naq s LEU 218 CO 0.06 0.15 0.09 -0.72 0.23 0.00 0.00 176.35 176.17 3naq s TYR 219 N -0.99 0.15 -0.04 0.29 1.13 -0.41 -1.58 117.35 115.89 3naq s TYR 219 Ca 0.10 -0.35 0.03 0.00 -1.41 0.00 0.00 57.07 55.45 3naq s TYR 219 Cb -0.10 -0.11 0.00 0.00 -1.10 0.00 0.00 41.96 40.65 3naq s TYR 219 CO 0.04 -0.29 -0.14 -1.58 -2.51 0.00 0.00 175.55 171.06 3naq s HIS 220 N -1.82 1.50 0.28 -3.49 2.46 -0.63 -0.20 115.29 113.39 3naq s HIS 220 Ca -0.12 -0.45 -0.21 0.00 0.47 0.00 0.00 55.06 54.75 3naq s HIS 220 Cb -0.06 -1.04 0.02 0.00 -0.13 0.00 0.00 32.58 31.38 3naq s HIS 220 CO -0.01 -0.17 0.73 0.34 -2.47 0.00 0.00 174.74 173.16 3naq s ASP 221 N 0.19 -0.25 0.26 9.88 3.68 -1.26 0.10 116.67 129.28 3naq s ASP 221 Ca -0.06 -0.62 0.24 0.00 2.13 0.00 0.00 52.55 54.24 3naq s ASP 221 Cb -0.12 0.72 0.98 0.00 -1.45 0.00 0.00 42.92 43.06 3naq s ASP 221 CO 0.02 -1.34 1.71 0.54 0.13 0.00 0.00 175.17 176.24 3naq n ARG 222 N -0.46 0.20 -3.91 4.34 1.74 -1.26 -4.68 116.66 112.62 3naq n ARG 222 Ca -0.04 0.42 -0.18 0.00 -0.77 0.00 0.00 57.85 57.28 3naq n ARG 222 Cb 0.59 -1.87 -0.16 0.00 -1.02 0.00 0.00 32.46 29.99 3naq n ARG 222 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 3naq s LEU 223 N -4.49 1.03 0.33 0.55 2.96 -1.26 -5.13 118.68 112.67 3naq s LEU 223 Ca 0.04 -0.03 -0.28 0.00 -0.22 0.00 0.00 54.13 53.64 3naq s LEU 223 Cb 0.09 -0.26 -0.10 0.00 0.50 0.00 0.00 46.19 46.43 3naq s LEU 223 CO 0.39 -0.12 1.20 -1.58 -1.32 0.00 0.00 176.35 174.92 3naq s GLN 224 N 1.21 4.38 0.79 1.98 0.74 -1.26 -4.97 119.66 122.53 3naq s GLN 224 Ca -0.07 1.98 -0.11 0.00 0.05 0.00 0.00 55.36 57.21 3naq s GLN 224 Cb -0.13 -3.01 0.07 0.00 1.10 0.00 0.00 33.01 31.03 3naq s GLN 224 CO -0.02 -0.08 1.09 -1.64 -0.55 0.00 0.00 175.29 174.09 3naq s MET 225 N -1.80 2.09 0.44 1.67 -1.94 -1.26 -4.99 119.30 113.50 3naq s MET 225 Ca 0.49 1.06 -0.26 0.00 -1.71 0.00 0.00 55.69 55.28 3naq s MET 225 Cb -0.35 -1.89 -0.09 0.00 2.01 0.00 0.00 34.83 34.52 3naq s MET 225 CO 0.45 -1.73 1.45 0.00 -0.01 0.00 0.00 175.02 175.18 3naq s ALA 226 N -2.93 3.31 0.53 3.03 0.00 -1.26 -4.75 121.76 119.69 3naq s ALA 226 Ca 0.61 1.51 0.24 0.00 0.00 0.00 0.00 51.96 54.32 3naq s ALA 226 Cb -0.17 -3.60 1.40 0.00 0.00 0.00 0.00 23.12 20.74 3naq s ALA 226 CO 0.56 -1.20 2.03 -1.00 0.00 0.00 0.00 175.76 176.15 3naq h PRO 227 N 2.43 0.00 -0.63 0.00 0.13 -1.99 0.27 132.00 132.22 3naq h PRO 227 Ca -0.51 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.61 3naq h PRO 227 Cb 1.26 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.36 3naq h PRO 227 CO 0.62 0.00 0.34 0.93 -0.23 0.00 0.00 178.00 179.65 3naq h GLU 228 N 0.00 0.88 -0.30 0.86 3.07 -1.99 0.46 114.58 117.56 3naq h GLU 228 Ca 0.20 -0.11 -0.18 0.00 -0.50 0.00 0.00 59.36 58.76 3naq h GLU 228 Cb 0.81 -0.17 -0.00 0.00 -0.84 0.00 0.00 28.75 28.55 3naq h GLU 228 CO -0.00 0.68 -0.53 1.25 -1.40 0.00 0.00 179.01 179.00 3naq h LEU 229 N 0.86 0.99 -0.84 1.33 6.46 -0.84 -0.38 115.31 122.89 3naq h LEU 229 Ca 0.22 -0.52 -0.01 0.00 -0.12 0.00 0.00 57.88 57.45 3naq h LEU 229 Cb 0.06 -0.28 -0.04 0.00 -0.73 0.00 0.00 40.66 39.66 3naq h LEU 229 CO -0.03 1.32 0.50 -0.33 -0.62 0.00 0.00 178.44 179.28 3naq h GLU 230 N 0.69 1.14 -0.39 1.25 5.08 -1.26 -0.71 114.58 120.37 3naq h GLU 230 Ca 0.02 -0.11 -0.11 0.00 -1.00 0.00 0.00 59.36 58.16 3naq h GLU 230 Cb 1.14 -0.24 -0.02 0.00 0.50 0.00 0.00 28.75 30.14 3naq h GLU 230 CO 0.12 0.81 -0.20 1.57 -1.00 0.00 0.00 179.01 180.31 3naq h LYS 231 N 1.15 0.76 -0.45 2.33 -0.00 -0.66 0.31 116.57 120.01 3naq h LYS 231 Ca 0.30 -0.29 -0.10 0.00 -0.00 0.00 0.00 60.65 60.56 3naq h LYS 231 Cb -0.04 -0.04 -0.01 0.00 -0.00 0.00 0.00 32.23 32.14 3naq h LYS 231 CO -0.06 0.90 -0.09 0.93 -0.00 0.00 0.00 179.45 181.14 3naq h GLU 232 N 0.67 0.86 0.00 0.07 5.08 -0.70 -2.87 114.58 117.69 3naq h GLU 232 Ca 0.10 -0.32 0.00 0.00 -1.00 0.00 0.00 59.36 58.14 3naq h GLU 232 Cb 0.70 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.89 3naq h GLU 232 CO 0.05 0.96 -0.81 1.79 -1.00 0.00 0.00 179.01 179.99 3naq h THR 233 N 0.70 0.00 -0.10 1.13 1.35 -1.16 -3.48 112.91 111.35 3naq h THR 233 Ca 0.12 -0.85 -0.04 0.00 -0.55 0.00 0.00 66.41 65.09 3naq h THR 233 Cb 0.62 1.41 -0.02 0.00 -1.73 0.00 0.00 68.15 68.43 3naq h THR 233 CO 0.04 0.00 -0.04 0.61 -0.25 0.00 0.00 175.52 175.88 3naq n GLY 234 N 1.22 0.37 3.75 5.82 0.00 0.11 -4.50 105.19 111.96 3naq n GLY 234 Ca 0.01 -0.06 -0.40 0.00 0.00 0.00 0.00 46.02 45.57 3naq n GLY 234 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3naq s ALA 235 N -1.55 3.35 -0.17 4.61 0.00 -1.06 -4.47 121.76 122.47 3naq s ALA 235 Ca 0.00 0.72 -0.03 0.00 0.00 0.00 0.00 51.96 52.64 3naq s ALA 235 Cb 0.00 -3.27 -0.02 0.00 0.00 0.00 0.00 23.12 19.83 3naq s ALA 235 CO 0.00 0.03 -0.05 0.21 0.00 0.00 0.00 175.76 175.95 3naq s LYS 236 N -1.03 3.53 0.16 0.00 2.20 0.10 -4.70 119.74 120.01 3naq s LYS 236 Ca 0.44 -0.58 -0.30 0.00 -0.36 0.00 0.00 55.97 55.16 3naq s LYS 236 Cb -0.28 -2.91 -0.08 0.00 -1.51 0.00 0.00 37.83 33.05 3naq s LYS 236 CO 0.35 0.09 1.32 0.12 -0.36 0.00 0.00 175.35 176.87 3naq s PHE 237 N 0.75 3.27 -0.27 4.03 5.36 -1.26 -1.29 117.98 128.56 3naq s PHE 237 Ca -0.02 1.15 0.02 0.00 -0.96 0.00 0.00 56.93 57.12 3naq s PHE 237 Cb -0.15 -3.61 0.07 0.00 -0.34 0.00 0.00 43.02 39.00 3naq s PHE 237 CO 0.02 -1.97 -0.04 0.08 -1.46 0.00 0.00 175.22 171.85 3naq s VAL 238 N 0.47 1.90 0.20 3.12 1.01 0.72 -4.89 120.40 122.94 3naq s VAL 238 Ca 0.59 -1.65 -0.09 0.00 0.00 0.00 0.00 61.98 60.82 3naq s VAL 238 Cb -0.36 -2.18 0.14 0.00 0.00 0.00 0.00 36.38 33.98 3naq s VAL 238 CO 0.35 -0.23 1.80 -0.08 0.00 0.00 0.00 175.10 176.94 3naq h GLU 239 N 7.81 1.06 -5.31 2.72 4.22 -1.94 -3.40 114.58 119.75 3naq h GLU 239 Ca -0.15 -0.15 -0.65 0.00 0.08 0.00 0.00 59.36 58.49 3naq h GLU 239 Cb 1.04 -0.19 -0.15 0.00 0.50 0.00 0.00 28.75 29.95 3naq h GLU 239 CO 0.46 0.82 0.02 0.34 -2.18 0.00 0.00 179.01 178.48 3naq s ASP 240 N -6.14 6.34 0.26 1.04 -1.08 -1.26 -4.94 116.67 110.88 3naq s ASP 240 Ca -0.13 -0.09 -0.01 0.00 -0.52 0.00 0.00 52.55 51.80 3naq s ASP 240 Cb 0.15 -2.29 0.34 0.00 -1.46 0.00 0.00 42.92 39.65 3naq s ASP 240 CO 0.81 -0.57 1.74 0.25 0.52 0.00 0.00 175.17 177.92 3naq h LEU 241 N 9.28 0.72 -0.86 -1.34 5.85 -2.00 -1.99 115.31 124.96 3naq h LEU 241 Ca -0.27 -0.19 0.00 0.00 0.84 0.00 0.00 57.88 58.26 3naq h LEU 241 Cb 1.11 -0.19 0.00 0.00 0.37 0.00 0.00 40.66 41.95 3naq h LEU 241 CO 0.81 0.82 0.00 0.78 -0.34 0.00 0.00 178.44 180.52 3naq h ASN 242 N 0.68 0.00 -0.04 1.25 2.35 -1.96 -1.21 115.58 116.66 3naq h ASN 242 Ca 0.13 0.00 -0.18 0.00 -0.55 0.00 0.00 56.30 55.70 3naq h ASN 242 Cb 0.51 0.00 0.01 0.00 0.05 0.00 0.00 38.32 38.89 3naq h ASN 242 CO 0.03 0.00 -0.67 -0.08 -1.65 0.00 0.00 177.43 175.05 3naq h GLU 243 N 0.00 0.53 -0.22 0.81 4.81 -1.84 -3.39 114.58 115.28 3naq h GLU 243 Ca 0.00 -0.51 -0.04 0.00 -0.13 0.00 0.00 59.36 58.68 3naq h GLU 243 Cb 0.55 0.13 -0.01 0.00 0.63 0.00 0.00 28.75 30.06 3naq h GLU 243 CO 0.00 1.15 -0.01 1.98 -0.73 0.00 0.00 179.01 181.39 3naq h MET 244 N 0.10 0.40 -0.73 1.92 4.05 -0.64 -3.36 114.93 116.67 3naq h MET 244 Ca -0.07 -0.14 0.01 0.00 -0.28 0.00 0.00 59.70 59.23 3naq h MET 244 Cb 1.35 -0.03 -0.04 0.00 -0.80 0.00 0.00 31.60 32.08 3naq h MET 244 CO 0.13 0.60 0.48 -0.07 0.23 0.00 0.00 176.91 178.29 3naq h LEU 245 N 0.16 0.82 -2.04 3.39 3.38 -1.44 -1.82 115.31 117.75 3naq h LEU 245 Ca 0.06 -0.02 -0.01 0.00 0.09 0.00 0.00 57.88 58.01 3naq h LEU 245 Cb 0.43 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 40.98 3naq h LEU 245 CO 0.01 0.58 -0.04 -0.65 0.09 0.00 0.00 178.44 178.44 3naq h PRO 246 N 0.97 0.00 0.00 1.13 0.11 -1.77 -2.36 132.00 130.07 3naq h PRO 246 Ca 0.27 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.38 3naq h PRO 246 Cb -0.08 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.03 3naq h PRO 246 CO -0.07 0.04 0.00 0.87 -0.21 0.00 0.00 178.00 178.62 3naq h LYS 247 N 0.00 0.00 -6.01 1.05 1.57 -1.49 -3.35 116.57 108.33 3naq h LYS 247 Ca -0.00 0.00 -0.56 0.00 -1.87 0.00 0.00 60.65 58.22 3naq h LYS 247 Cb 0.32 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 32.57 3naq h LYS 247 CO 0.00 0.00 0.06 0.00 -0.57 0.00 0.00 179.45 178.94 3naq h ASP 249 N 6.62 0.39 -3.56 0.00 3.32 -1.14 -3.41 116.42 118.65 3naq h ASP 249 Ca -0.41 -0.29 -0.45 0.00 0.02 0.00 0.00 57.03 55.90 3naq h ASP 249 Cb 1.20 -0.12 -0.33 0.00 0.22 0.00 0.00 39.33 40.30 3naq h ASP 249 CO 0.75 1.05 -0.79 -0.69 -1.72 0.00 0.00 179.24 177.84 3naq s VAL 250 N -3.41 0.82 -0.12 -1.35 1.01 -0.83 -0.98 120.40 115.53 3naq s VAL 250 Ca -0.05 -0.32 0.00 0.00 0.00 0.00 0.00 61.98 61.61 3naq s VAL 250 Cb 0.10 -0.77 -0.02 0.00 0.00 0.00 0.00 36.38 35.70 3naq s VAL 250 CO 0.84 0.28 -0.13 -0.63 0.00 0.00 0.00 175.10 175.45 3naq s ILE 251 N 0.59 3.08 -0.16 2.22 1.01 0.33 -1.13 121.20 127.13 3naq s ILE 251 Ca -0.10 -0.66 0.01 0.00 0.00 0.00 0.00 60.65 59.90 3naq s ILE 251 Cb -0.13 -2.28 0.00 0.00 0.01 0.00 0.00 42.46 40.06 3naq s ILE 251 CO 0.02 0.53 -0.17 -0.69 0.00 0.00 0.00 174.94 174.62 3naq s VAL 252 N 0.22 2.45 -0.23 2.92 1.01 0.13 -0.98 120.40 125.93 3naq s VAL 252 Ca -0.08 -0.84 -0.22 0.00 0.00 0.00 0.00 61.98 60.84 3naq s VAL 252 Cb -0.15 -2.02 -0.02 0.00 0.00 0.00 0.00 36.38 34.18 3naq s VAL 252 CO 0.05 0.52 0.68 -0.63 0.00 0.00 0.00 175.10 175.72 3naq s ILE 253 N 0.93 4.96 -0.29 2.22 -1.09 -0.11 -0.65 121.20 127.16 3naq s ILE 253 Ca -0.04 1.26 0.20 0.00 -2.23 0.00 0.00 60.65 59.85 3naq s ILE 253 Cb -0.15 -3.98 0.49 0.00 -1.58 0.00 0.00 42.46 37.23 3naq s ILE 253 CO -0.03 0.04 1.06 0.59 -1.23 0.00 0.00 174.94 175.38 3naq n ASN 254 N 5.49 1.37 -4.35 3.58 3.02 0.71 -4.13 115.26 120.95 3naq n ASN 254 Ca 0.01 -2.31 -0.18 0.00 -0.03 0.00 0.00 54.58 52.07 3naq n ASN 254 Cb 0.49 -0.44 -0.10 0.00 -0.61 0.00 0.00 39.78 39.12 3naq n ASN 254 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3naq s MET 255 N -3.35 1.39 0.67 3.52 0.23 -1.17 -4.23 119.30 116.35 3naq s MET 255 Ca 0.26 -1.71 -0.11 0.00 -1.03 0.00 0.00 55.69 53.11 3naq s MET 255 Cb 0.38 -0.70 -0.01 0.00 -1.53 0.00 0.00 34.83 32.97 3naq s MET 255 CO -0.01 -0.09 1.05 -1.25 -2.03 0.00 0.00 175.02 172.69 3naq s PRO 256 N -3.85 3.19 -0.36 3.16 0.04 -1.26 -4.58 135.00 131.34 3naq s PRO 256 Ca 0.29 0.79 -0.29 0.00 0.04 0.00 0.00 61.00 61.83 3naq s PRO 256 Cb 0.06 -2.03 0.01 0.00 0.04 0.00 0.00 34.50 32.58 3naq s PRO 256 CO 0.10 -0.88 1.27 -1.17 0.04 0.00 0.00 177.00 176.36 3naq s LEU 257 N -5.37 3.78 0.42 -3.56 2.96 -1.26 -4.74 118.68 110.91 3naq s LEU 257 Ca 0.57 0.98 0.04 0.00 -0.22 0.00 0.00 54.13 55.49 3naq s LEU 257 Cb -0.12 -3.54 -0.02 0.00 0.50 0.00 0.00 46.19 43.00 3naq s LEU 257 CO 0.54 -1.16 0.13 0.42 -1.32 0.00 0.00 176.35 174.95 3naq s THR 258 N 4.53 0.61 0.28 3.68 -4.23 -1.26 -4.95 115.64 114.31 3naq s THR 258 Ca 0.55 -2.00 0.01 0.00 -1.18 0.00 0.00 61.69 59.07 3naq s THR 258 Cb -0.14 -2.33 0.28 0.00 1.34 0.00 0.00 72.50 71.66 3naq s THR 258 CO 0.26 0.00 1.85 1.05 -0.54 0.00 0.00 174.62 177.23 3naq h GLU 259 N 1.75 0.99 -0.46 3.99 9.09 -1.95 -0.01 114.58 127.99 3naq h GLU 259 Ca -0.35 -0.06 -0.08 0.00 0.05 0.00 0.00 59.36 58.91 3naq h GLU 259 Cb 1.28 -0.22 -0.02 0.00 -1.65 0.00 0.00 28.75 28.14 3naq h GLU 259 CO 0.57 0.66 -0.04 1.57 0.05 0.00 0.00 179.01 181.82 3naq h LYS 260 N 1.02 0.84 0.00 1.06 5.09 -1.97 -3.28 116.57 119.33 3naq h LYS 260 Ca 0.48 -0.29 0.00 0.00 0.09 0.00 0.00 60.65 60.94 3naq h LYS 260 Cb 0.44 -0.06 0.00 0.00 0.10 0.00 0.00 32.23 32.70 3naq h LYS 260 CO -0.25 0.91 -0.81 1.79 -2.09 0.00 0.00 179.45 179.00 3naq h THR 261 N 0.68 0.00 -2.56 0.07 1.35 -1.80 -3.42 112.91 107.23 3naq h THR 261 Ca 0.12 -0.62 -0.52 0.00 -0.55 0.00 0.00 66.41 64.84 3naq h THR 261 Cb 0.56 1.12 0.04 0.00 -1.73 0.00 0.00 68.15 68.15 3naq h THR 261 CO 0.03 0.00 1.09 -0.60 -0.25 0.00 0.00 175.52 175.80 3naq s ARG 262 N -3.23 4.14 -1.86 4.72 3.52 -0.04 -1.98 118.95 124.22 3naq s ARG 262 Ca 0.04 2.59 0.00 0.00 -0.13 0.00 0.00 55.73 58.23 3naq s ARG 262 Cb 0.13 -3.52 0.00 0.00 -1.56 0.00 0.00 34.95 30.00 3naq s ARG 262 CO 0.76 -0.83 0.00 0.41 -0.81 0.00 0.00 175.30 174.83 3naq n GLY 263 N 4.19 1.67 0.23 8.12 0.00 0.10 -4.86 105.19 114.64 3naq n GLY 263 Ca 0.17 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.19 3naq n GLY 263 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3naq h MET 264 N 0.00 0.30 -5.23 1.61 -0.00 -0.75 -3.21 114.93 107.66 3naq h MET 264 Ca -0.36 -0.10 -0.71 0.00 -0.00 0.00 0.00 59.70 58.54 3naq h MET 264 Cb 1.28 -0.02 -0.14 0.00 -0.00 0.00 0.00 31.60 32.72 3naq h MET 264 CO 0.53 0.53 1.60 -0.06 -0.00 0.00 0.00 176.91 179.51 3naq s PHE 265 N -4.49 3.17 0.07 -0.10 0.40 -0.96 -4.67 117.98 111.42 3naq s PHE 265 Ca -0.05 -1.83 0.01 0.00 -0.60 0.00 0.00 56.93 54.46 3naq s PHE 265 Cb 0.14 -4.48 0.01 0.00 0.51 0.00 0.00 43.02 39.20 3naq s PHE 265 CO 0.76 -1.57 0.08 0.27 0.70 0.00 0.00 175.22 175.46 3naq n ASN 266 N 6.83 0.69 -0.04 1.36 0.23 -1.21 -1.45 115.26 121.67 3naq n ASN 266 Ca 0.39 -1.22 -0.09 0.00 -0.53 0.00 0.00 54.58 53.14 3naq n ASN 266 Cb 0.45 -0.03 -0.03 0.00 -2.08 0.00 0.00 39.78 38.09 3naq n ASN 266 CO 0.00 0.00 0.00 0.50 -0.93 0.00 0.00 177.26 176.83 3naq h LYS 267 N 0.00 0.07 -0.11 -3.83 3.11 -1.92 0.60 116.57 114.50 3naq h LYS 267 Ca -0.04 -0.00 0.03 0.00 -2.81 0.00 0.00 60.65 57.83 3naq h LYS 267 Cb 0.16 -0.02 -0.03 0.00 -1.00 0.00 0.00 32.23 31.35 3naq h LYS 267 CO 0.06 0.05 -0.09 1.49 -2.81 0.00 0.00 179.45 178.14 3naq h GLU 268 N 0.07 -0.10 -0.25 1.90 4.22 -1.95 0.81 114.58 119.27 3naq h GLU 268 Ca 0.09 0.01 -0.12 0.00 0.08 0.00 0.00 59.36 59.42 3naq h GLU 268 Cb 0.11 0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.38 3naq h GLU 268 CO -0.15 -0.07 -0.30 1.25 -2.18 0.00 0.00 179.01 177.56 3naq h LEU 269 N -0.11 0.71 -1.12 1.64 5.85 -1.76 -2.84 115.31 117.67 3naq h LEU 269 Ca 0.07 -0.49 -0.00 0.00 0.84 0.00 0.00 57.88 58.30 3naq h LEU 269 Cb 0.21 -0.20 -0.04 0.00 0.37 0.00 0.00 40.66 41.00 3naq h LEU 269 CO -0.17 1.06 0.49 0.40 -0.34 0.00 0.00 178.44 179.87 3naq h ILE 270 N 0.37 1.22 -0.84 4.05 2.04 -0.75 -1.47 117.51 122.14 3naq h ILE 270 Ca 0.03 -0.48 0.18 0.00 1.00 0.00 0.00 64.86 65.60 3naq h ILE 270 Cb 0.88 0.08 -0.06 0.00 -0.74 0.00 0.00 36.82 36.98 3naq h ILE 270 CO 0.07 0.23 0.56 1.23 0.00 0.00 0.00 178.15 180.24 3naq h GLY 271 N 1.13 0.77 2.00 5.37 0.00 -0.60 -1.94 103.07 109.80 3naq h GLY 271 Ca 0.29 -0.18 0.00 0.00 0.00 0.00 0.00 47.33 47.44 3naq h GLY 271 CO -0.06 0.02 0.00 0.50 0.00 0.00 0.00 176.54 177.01 3naq h LYS 272 N 0.40 0.00 -7.22 4.80 1.57 -1.10 -3.46 116.57 111.56 3naq h LYS 272 Ca 0.43 0.00 -0.51 0.00 -1.87 0.00 0.00 60.65 58.70 3naq h LYS 272 Cb 1.05 0.00 0.11 0.00 0.08 0.00 0.00 32.23 33.46 3naq h LYS 272 CO -0.15 0.00 0.37 -0.51 -0.57 0.00 0.00 179.45 178.59 3naq s LEU 273 N -5.46 3.34 0.28 2.94 1.43 -0.73 -4.40 118.68 116.08 3naq s LEU 273 Ca 0.08 1.97 -0.29 0.00 -1.03 0.00 0.00 54.13 54.86 3naq s LEU 273 Cb 0.08 -4.55 -0.13 0.00 0.03 0.00 0.00 46.19 41.62 3naq s LEU 273 CO 0.63 -1.68 1.24 0.29 0.23 0.00 0.00 176.35 177.06 3naq n LYS 274 N -2.58 1.81 -1.69 1.70 5.02 -1.26 -4.90 118.16 116.28 3naq n LYS 274 Ca 0.10 0.64 -0.45 0.00 -2.02 0.00 0.00 58.31 56.58 3naq n LYS 274 Cb 0.52 -2.18 -0.04 0.00 -0.02 0.00 0.00 35.03 33.31 3naq n LYS 274 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05 3naq n LYS 275 N 1.14 2.42 -0.52 1.97 4.81 -1.26 -1.39 118.16 125.32 3naq n LYS 275 Ca 0.09 0.88 0.00 0.00 -0.87 0.00 0.00 58.31 58.40 3naq n LYS 275 Cb 0.33 -2.69 0.00 0.00 0.02 0.00 0.00 35.03 32.68 3naq n LYS 275 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3naq n GLY 276 N 3.78 0.75 3.63 3.14 0.00 0.10 -4.96 105.19 111.63 3naq n GLY 276 Ca 0.17 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.79 3naq n GLY 276 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 3naq n VAL 277 N -2.30 2.92 -4.45 1.61 3.14 -0.49 -3.41 118.33 115.35 3naq n VAL 277 Ca 0.00 -0.50 -0.34 0.00 -2.96 0.00 0.00 64.34 60.54 3naq n VAL 277 Cb 0.00 -1.25 -0.12 0.00 -1.06 0.00 0.00 33.84 31.42 3naq n VAL 277 CO 0.00 0.00 0.00 -0.76 -6.46 0.00 0.00 176.83 169.61 3naq s LEU 278 N -1.32 3.25 -0.09 6.55 1.43 -0.16 -0.15 118.68 128.19 3naq s LEU 278 Ca 0.67 -0.09 0.04 0.00 -1.03 0.00 0.00 54.13 53.72 3naq s LEU 278 Cb -0.49 -1.77 0.00 0.00 0.03 0.00 0.00 46.19 43.96 3naq s LEU 278 CO 0.54 0.22 -0.22 -0.63 0.23 0.00 0.00 176.35 176.48 3naq s ILE 279 N 0.07 1.93 -0.10 -0.59 1.01 -0.29 -0.52 121.20 122.72 3naq s ILE 279 Ca -0.00 -0.95 0.04 0.00 0.00 0.00 0.00 60.65 59.73 3naq s ILE 279 Cb -0.13 -1.67 -0.00 0.00 0.01 0.00 0.00 42.46 40.66 3naq s ILE 279 CO 0.03 0.53 -0.22 -0.69 0.00 0.00 0.00 174.94 174.59 3naq s VAL 280 N 0.34 2.26 -0.35 2.92 1.01 -0.15 -0.82 120.40 125.60 3naq s VAL 280 Ca -0.17 -0.96 0.01 0.00 0.00 0.00 0.00 61.98 60.86 3naq s VAL 280 Cb -0.17 -1.87 0.14 0.00 0.00 0.00 0.00 36.38 34.48 3naq s VAL 280 CO 0.08 0.56 0.30 0.21 0.00 0.00 0.00 175.10 176.25 3naq s ASN 281 N 0.24 1.90 -0.25 3.32 2.47 0.19 -0.94 114.94 121.87 3naq s ASN 281 Ca -0.15 -1.62 0.13 0.00 0.42 0.00 0.00 52.86 51.65 3naq s ASN 281 Cb -0.17 0.22 0.69 0.00 -1.45 0.00 0.00 41.25 40.54 3naq s ASN 281 CO 0.07 -0.30 1.64 0.59 -3.72 0.00 0.00 177.10 175.39 3naq n ASN 282 N 4.40 4.66 0.00 -4.21 4.13 -1.26 -3.15 115.26 119.82 3naq n ASN 282 Ca 0.08 -3.11 0.00 0.00 1.68 0.00 0.00 54.58 53.23 3naq n ASN 282 Cb 0.43 -0.66 0.00 0.00 -1.54 0.00 0.00 39.78 38.01 3naq n ASN 282 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3naq n ALA 283 N -0.10 0.00 -3.38 5.41 0.00 -1.26 -4.85 120.51 116.33 3naq n ALA 283 Ca 0.30 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.61 3naq n ALA 283 Cb 1.15 0.00 -0.13 0.00 0.00 0.00 0.00 19.45 20.47 3naq n ALA 283 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 3naq s ARG 284 N 0.00 0.22 0.22 0.00 1.81 -1.26 -4.94 118.95 114.99 3naq s ARG 284 Ca 0.00 0.39 -0.09 0.00 -1.72 0.00 0.00 55.73 54.31 3naq s ARG 284 Cb 0.00 0.01 0.20 0.00 -0.45 0.00 0.00 34.95 34.71 3naq s ARG 284 CO 0.00 -0.09 1.88 0.78 -0.68 0.00 0.00 175.30 177.19 3naq h GLY 285 N 6.42 1.12 1.43 -3.53 0.00 -1.74 -2.84 103.07 103.93 3naq h GLY 285 Ca -0.32 -0.40 0.00 0.00 0.00 0.00 0.00 47.33 46.61 3naq h GLY 285 CO 0.38 0.37 0.00 0.00 0.00 0.00 0.00 176.54 177.28 3naq n ALA 286 N -2.32 2.04 0.23 3.60 0.00 -1.26 -1.56 120.51 121.23 3naq n ALA 286 Ca 0.08 -0.09 0.06 0.00 0.00 0.00 0.00 53.44 53.49 3naq n ALA 286 Cb 0.05 -1.30 0.52 0.00 0.00 0.00 0.00 19.45 18.72 3naq n ALA 286 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 3naq h ILE 287 N 0.00 1.08 -3.26 0.00 2.04 -1.70 0.29 117.51 115.96 3naq h ILE 287 Ca 0.00 -0.67 -0.57 0.00 1.00 0.00 0.00 64.86 64.62 3naq h ILE 287 Cb 0.13 1.37 -0.04 0.00 -0.74 0.00 0.00 36.82 37.53 3naq h ILE 287 CO 0.00 0.19 -0.07 -0.04 0.00 0.00 0.00 178.15 178.23 3naq s MET 288 N -4.55 4.08 -0.26 2.37 -1.94 -0.60 -1.97 119.30 116.42 3naq s MET 288 Ca -0.04 0.60 -0.29 0.00 -1.71 0.00 0.00 55.69 54.26 3naq s MET 288 Cb 0.15 -3.09 0.01 0.00 2.01 0.00 0.00 34.83 33.91 3naq s MET 288 CO 0.69 0.57 1.03 -2.00 -0.01 0.00 0.00 175.02 175.29 3naq s GLU 289 N -1.50 4.18 0.15 2.03 2.12 -0.53 -4.42 118.70 120.72 3naq s GLU 289 Ca 0.33 1.21 -0.17 0.00 0.36 0.00 0.00 54.97 56.69 3naq s GLU 289 Cb -0.17 -3.68 0.05 0.00 0.26 0.00 0.00 34.13 30.59 3naq s GLU 289 CO 0.19 -0.72 1.72 -0.09 -0.54 0.00 0.00 175.26 175.82 3naq h ARG 290 N 7.71 0.13 -0.03 4.30 2.43 -1.89 -2.00 114.38 125.04 3naq h ARG 290 Ca -0.20 -0.01 -0.16 0.00 -0.81 0.00 0.00 59.98 58.81 3naq h ARG 290 Cb 1.06 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 30.57 3naq h ARG 290 CO 0.99 0.09 -0.68 0.37 -1.51 0.00 0.00 179.97 179.22 3naq h GLN 291 N 0.13 0.16 -0.97 0.20 5.75 -1.97 -2.47 115.11 115.94 3naq h GLN 291 Ca 0.15 -0.13 0.01 0.00 -0.15 0.00 0.00 58.65 58.53 3naq h GLN 291 Cb 0.18 0.03 -0.05 0.00 1.07 0.00 0.00 27.48 28.71 3naq h GLN 291 CO -0.22 0.78 0.63 0.00 -2.65 0.00 0.00 178.83 177.37 3naq h ALA 292 N 1.19 1.29 -0.27 3.38 0.00 -1.76 0.12 119.26 123.19 3naq h ALA 292 Ca -0.01 -0.07 -0.05 0.00 0.00 0.00 0.00 54.91 54.77 3naq h ALA 292 Cb 1.22 -0.39 -0.01 0.00 0.00 0.00 0.00 17.79 18.61 3naq h ALA 292 CO 0.10 0.65 -0.01 0.28 0.00 0.00 0.00 179.25 180.27 3naq h VAL 293 N 1.32 1.26 -0.07 0.00 2.07 -1.27 -1.87 116.25 117.69 3naq h VAL 293 Ca 0.35 -0.95 0.01 0.00 0.82 0.00 0.00 66.70 66.93 3naq h VAL 293 Cb -0.14 1.34 -0.01 0.00 -1.52 0.00 0.00 31.29 30.97 3naq h VAL 293 CO -0.07 0.30 0.03 0.58 0.02 0.00 0.00 177.57 178.43 3naq h VAL 294 N 0.27 0.99 -0.75 2.57 2.07 -0.92 -0.52 116.25 119.96 3naq h VAL 294 Ca 0.08 -0.02 0.09 0.00 0.82 0.00 0.00 66.70 67.66 3naq h VAL 294 Cb 0.44 0.92 -0.07 0.00 -1.52 0.00 0.00 31.29 31.06 3naq h VAL 294 CO 0.02 0.01 0.41 0.44 0.02 0.00 0.00 177.57 178.47 3naq h ASP 295 N 0.07 0.57 1.60 0.57 3.45 -0.78 0.19 116.42 122.09 3naq h ASP 295 Ca 0.03 0.05 -0.07 0.00 0.43 0.00 0.00 57.03 57.47 3naq h ASP 295 Cb 0.01 -0.06 -0.01 0.00 -0.56 0.00 0.00 39.33 38.71 3naq h ASP 295 CO -0.03 0.34 -0.33 0.00 -1.57 0.00 0.00 179.24 177.65 3naq h ALA 296 N 1.42 0.80 -0.04 3.45 0.00 -1.09 -0.63 119.26 123.17 3naq h ALA 296 Ca 0.36 -0.30 -0.19 0.00 0.00 0.00 0.00 54.91 54.78 3naq h ALA 296 Cb 0.32 -0.05 0.01 0.00 0.00 0.00 0.00 17.79 18.07 3naq h ALA 296 CO -0.24 0.41 -0.71 0.28 0.00 0.00 0.00 179.25 178.99 3naq h VAL 297 N 0.00 1.36 -0.14 0.00 2.07 -0.78 0.22 116.25 118.98 3naq h VAL 297 Ca -0.00 -2.06 -0.04 0.00 0.82 0.00 0.00 66.70 65.41 3naq h VAL 297 Cb 1.22 2.40 -0.01 0.00 -1.52 0.00 0.00 31.29 33.38 3naq h VAL 297 CO 0.04 0.62 -0.11 -0.33 0.02 0.00 0.00 177.57 177.81 3naq h GLU 298 N 0.13 0.22 -0.00 1.57 5.08 -0.42 -2.48 114.58 118.68 3naq h GLU 298 Ca -0.08 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.23 3naq h GLU 298 Cb 1.39 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.61 3naq h GLU 298 CO 0.14 0.35 -0.14 -1.13 -1.00 0.00 0.00 179.01 177.23 3naq n SER 299 N -4.29 0.38 0.00 1.42 3.41 -0.26 -4.93 113.62 109.35 3naq n SER 299 Ca -0.01 -0.34 0.00 0.00 -0.26 0.00 0.00 58.87 58.26 3naq n SER 299 Cb 0.25 -0.11 0.00 0.00 -0.26 0.00 0.00 64.21 64.09 3naq n SER 299 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3naq n GLY 300 N 1.34 1.20 0.32 5.00 0.00 -0.94 -4.91 105.19 107.21 3naq n GLY 300 Ca 0.12 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.06 3naq n GLY 300 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 3naq h HIS 301 N 0.00 1.20 -3.59 1.61 6.17 -0.96 -3.25 115.15 116.33 3naq h HIS 301 Ca 0.00 -0.16 -0.62 0.00 0.71 0.00 0.00 60.37 60.30 3naq h HIS 301 Cb 0.00 -0.33 -0.13 0.00 2.52 0.00 0.00 27.41 29.47 3naq h HIS 301 CO 0.00 0.99 -0.01 0.42 0.71 0.00 0.00 177.93 180.04 3naq s ILE 302 N -5.24 5.06 0.23 6.26 1.01 0.23 0.02 121.20 128.78 3naq s ILE 302 Ca -0.12 0.85 0.13 0.00 0.00 0.00 0.00 60.65 61.51 3naq s ILE 302 Cb 0.14 -3.84 0.01 0.00 0.01 0.00 0.00 42.46 38.79 3naq s ILE 302 CO 0.85 0.06 1.63 1.23 0.00 0.00 0.00 174.94 178.71 3naq h GLY 303 N 8.81 0.00 -4.51 6.18 0.00 -0.56 -3.38 103.07 109.61 3naq h GLY 303 Ca -0.29 0.00 0.22 0.00 0.00 0.00 0.00 47.33 47.27 3naq h GLY 303 CO 0.72 0.00 0.85 -0.32 0.00 0.00 0.00 176.54 177.79 3naq s GLY 304 N -4.44 -0.08 -0.03 4.60 0.00 -1.21 -4.84 107.32 101.32 3naq s GLY 304 Ca -0.01 2.34 -0.00 0.00 0.00 0.00 0.00 44.72 47.05 3naq s GLY 304 CO 0.74 0.93 0.04 -0.47 0.00 0.00 0.00 173.10 174.34 3naq s TYR 305 N -1.43 0.02 -0.03 1.90 6.14 -1.25 -1.13 117.35 121.56 3naq s TYR 305 Ca 0.07 0.17 -0.02 0.00 0.64 0.00 0.00 57.07 57.93 3naq s TYR 305 Cb -0.01 -0.26 0.02 0.00 0.42 0.00 0.00 41.96 42.13 3naq s TYR 305 CO -0.05 -0.11 0.08 0.45 0.64 0.00 0.00 175.55 176.56 3naq s SER 306 N 1.23 -0.07 0.03 4.32 0.15 -0.00 -1.47 113.70 117.88 3naq s SER 306 Ca -0.07 0.16 -0.28 0.00 0.70 0.00 0.00 55.95 56.47 3naq s SER 306 Cb -0.13 0.13 0.10 0.00 -1.71 0.00 0.00 66.02 64.41 3naq s SER 306 CO -0.03 -0.06 1.23 -0.83 1.20 0.00 0.00 173.24 174.75 3naq s GLY 307 N 0.37 -0.15 0.00 9.45 0.00 -1.26 -0.63 107.32 115.10 3naq s GLY 307 Ca -0.03 0.12 0.00 0.00 0.00 0.00 0.00 44.72 44.82 3naq s GLY 307 CO -0.01 3.53 0.87 2.09 0.00 0.00 0.00 173.10 179.58 3naq n ASP 308 N -0.94 1.59 -4.51 1.64 5.75 -1.19 -1.97 116.55 116.92 3naq n ASP 308 Ca -0.01 -1.76 -0.31 0.00 -0.01 0.00 0.00 54.79 52.70 3naq n ASP 308 Cb 0.60 0.00 -0.12 0.00 -1.03 0.00 0.00 41.12 40.57 3naq n ASP 308 CO 0.00 0.00 0.00 0.68 -0.11 0.00 0.00 177.20 177.77 3naq s VAL 309 N -0.76 3.07 0.11 2.12 -7.23 -1.25 -2.85 120.40 113.61 3naq s VAL 309 Ca 0.00 -1.10 -0.03 0.00 -1.81 0.00 0.00 61.98 59.04 3naq s VAL 309 Cb 0.00 -2.33 -0.03 0.00 0.56 0.00 0.00 36.38 34.58 3naq s VAL 309 CO 0.00 0.32 0.08 0.26 -0.31 0.00 0.00 175.10 175.45 3naq s TRP 310 N -0.98 0.60 -0.12 2.82 0.52 -1.26 -4.27 118.94 116.25 3naq s TRP 310 Ca 0.16 -1.03 -0.03 0.00 0.02 0.00 0.00 56.10 55.21 3naq s TRP 310 Cb -0.11 -0.33 0.05 0.00 -1.15 0.00 0.00 33.47 31.92 3naq s TRP 310 CO 0.07 -0.51 0.07 0.34 0.02 0.00 0.00 176.95 176.93 3naq s ASP 311 N -2.98 1.87 0.84 2.95 2.15 -1.26 -3.88 116.67 116.36 3naq s ASP 311 Ca 0.16 -0.33 -0.12 0.00 0.43 0.00 0.00 52.55 52.69 3naq s ASP 311 Cb 0.07 -0.24 0.10 0.00 -0.30 0.00 0.00 42.92 42.54 3naq s ASP 311 CO -0.04 -0.30 1.11 -2.16 -0.17 0.00 0.00 175.17 173.62 3naq s PRO 312 N 2.12 1.72 -0.03 4.34 0.04 -1.26 -5.00 135.00 136.93 3naq s PRO 312 Ca 0.03 0.53 -0.00 0.00 0.04 0.00 0.00 61.00 61.59 3naq s PRO 312 Cb -0.14 -1.89 0.03 0.00 0.04 0.00 0.00 34.50 32.54 3naq s PRO 312 CO -0.06 -1.85 0.03 -1.14 0.04 0.00 0.00 177.00 174.01 3naq s GLN 313 N -5.19 0.11 0.48 4.56 0.74 -1.25 -3.02 119.66 116.09 3naq s GLN 313 Ca 0.62 0.19 -0.22 0.00 0.05 0.00 0.00 55.36 56.00 3naq s GLN 313 Cb -0.15 -0.44 -0.09 0.00 1.10 0.00 0.00 33.01 33.44 3naq s GLN 313 CO 0.54 -0.21 1.00 -2.30 -0.55 0.00 0.00 175.29 173.77 3naq n PRO 314 N 4.52 1.23 -2.20 1.67 -0.02 -1.26 -5.09 135.00 133.84 3naq n PRO 314 Ca -0.20 0.45 -0.42 0.00 -2.02 0.00 0.00 63.50 61.31 3naq n PRO 314 Cb 0.50 -2.10 -0.03 0.00 -0.02 0.00 0.00 33.50 31.86 3naq n PRO 314 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3naq s ALA 315 N -1.37 3.63 0.80 3.55 0.00 -1.17 -5.00 121.76 122.20 3naq s ALA 315 Ca 0.67 0.75 -0.15 0.00 0.00 0.00 0.00 51.96 53.24 3naq s ALA 315 Cb -0.50 -3.67 0.01 0.00 0.00 0.00 0.00 23.12 18.96 3naq s ALA 315 CO 0.54 -1.23 0.70 -2.30 0.00 0.00 0.00 175.76 173.47 3naq n PRO 316 N 6.62 0.15 -0.01 0.00 -0.02 -1.26 -4.83 135.00 135.64 3naq n PRO 316 Ca 0.15 0.10 0.23 0.00 -2.02 0.00 0.00 63.50 61.96 3naq n PRO 316 Cb 0.44 -2.02 0.72 0.00 -0.02 0.00 0.00 33.50 32.62 3naq n PRO 316 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 3naq h LYS 317 N -0.78 0.00 -0.21 -0.52 3.64 -2.02 -0.01 116.57 116.67 3naq h LYS 317 Ca -0.45 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.93 3naq h LYS 317 Cb 1.32 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.14 3naq h LYS 317 CO 0.42 0.00 0.00 -0.40 -2.27 0.00 0.00 179.45 177.20 3naq n ASP 318 N -4.10 2.08 -4.69 4.20 5.75 -1.26 -4.99 116.55 113.54 3naq n ASP 318 Ca 0.11 -1.78 -0.44 0.00 -0.01 0.00 0.00 54.79 52.67 3naq n ASP 318 Cb 0.71 -0.13 -0.04 0.00 -1.03 0.00 0.00 41.12 40.63 3naq n ASP 318 CO 0.00 0.00 0.00 1.57 -0.11 0.00 0.00 177.20 178.66 3naq n HIS 319 N 0.60 2.51 0.25 2.11 -0.00 -0.02 -4.84 115.22 115.83 3naq n HIS 319 Ca 0.17 0.13 0.11 0.00 0.46 0.00 0.00 57.72 58.58 3naq n HIS 319 Cb 0.40 -2.62 0.63 0.00 -0.12 0.00 0.00 29.99 28.28 3naq n HIS 319 CO 0.00 0.00 0.00 -1.00 0.46 0.00 0.00 176.34 175.80 3naq h PRO 320 N 6.58 0.00 0.00 1.57 0.13 -1.94 -1.95 132.00 136.40 3naq h PRO 320 Ca -0.44 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.67 3naq h PRO 320 Cb 1.23 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.36 3naq h PRO 320 CO 0.92 0.17 -0.10 -1.49 -0.23 0.00 0.00 178.00 177.27 3naq h TRP 321 N 0.00 0.00 -0.25 1.56 4.06 -1.93 -2.25 115.95 117.14 3naq h TRP 321 Ca -0.00 0.00 -0.04 0.00 2.06 0.00 0.00 58.89 60.90 3naq h TRP 321 Cb 0.45 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.59 3naq h TRP 321 CO 0.00 0.10 -0.04 0.00 -3.56 0.00 0.00 178.44 174.94 3naq h ARG 322 N 0.00 0.38 -0.01 0.49 3.08 -1.71 -3.32 114.38 113.29 3naq h ARG 322 Ca -0.00 -0.08 0.00 0.00 0.07 0.00 0.00 59.98 59.97 3naq h ARG 322 Cb 0.37 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.36 3naq h ARG 322 CO 0.01 0.45 0.00 0.66 -1.07 0.00 0.00 179.97 180.02 3naq n TYR 323 N -4.30 0.01 -2.20 3.04 4.02 -0.99 -5.00 117.16 111.74 3naq n TYR 323 Ca 0.00 -0.03 -0.34 0.00 -0.01 0.00 0.00 57.90 57.53 3naq n TYR 323 Cb 0.24 -0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.56 3naq n TYR 323 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 3naq s MET 324 N -0.27 3.40 0.52 -0.72 0.23 -0.88 -4.97 119.30 116.61 3naq s MET 324 Ca 0.03 1.36 -0.23 0.00 -1.03 0.00 0.00 55.69 55.82 3naq s MET 324 Cb 0.02 -2.03 -0.06 0.00 -1.53 0.00 0.00 34.83 31.23 3naq s MET 324 CO 0.03 -0.77 1.38 -2.30 -2.03 0.00 0.00 175.02 171.34 3naq n PRO 325 N -1.63 1.84 -1.16 3.16 -0.02 -1.26 -3.27 135.00 132.66 3naq n PRO 325 Ca 0.10 0.67 -0.06 0.00 -2.02 0.00 0.00 63.50 62.19 3naq n PRO 325 Cb 0.52 -2.60 -0.02 0.00 -0.02 0.00 0.00 33.50 31.38 3naq n PRO 325 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 3naq n ASN 326 N -0.82 -5.16 -4.76 2.55 3.02 -1.26 -4.83 115.26 104.00 3naq n ASN 326 Ca 0.09 0.14 -0.41 0.00 -0.03 0.00 0.00 54.58 54.37 3naq n ASN 326 Cb 0.44 -3.15 -0.03 0.00 -0.61 0.00 0.00 39.78 36.43 3naq n ASN 326 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3naq s GLN 327 N -2.16 4.48 -0.43 3.52 1.03 -1.20 -3.88 119.66 121.02 3naq s GLN 327 Ca 0.00 2.02 0.08 0.00 0.04 0.00 0.00 55.36 57.50 3naq s GLN 327 Cb 0.00 -3.13 0.41 0.00 0.03 0.00 0.00 33.01 30.32 3naq s GLN 327 CO 0.00 -0.02 1.04 0.00 -2.54 0.00 0.00 175.29 173.77 3naq n ALA 328 N 1.16 4.59 -1.90 2.60 0.00 -0.54 -4.97 120.51 121.44 3naq n ALA 328 Ca 0.00 -4.12 -0.31 0.00 0.00 0.00 0.00 53.44 49.02 3naq n ALA 328 Cb 0.43 -0.66 0.02 0.00 0.00 0.00 0.00 19.45 19.24 3naq n ALA 328 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 3naq s MET 329 N -3.41 3.46 0.16 0.00 -1.94 -1.26 -3.98 119.30 112.33 3naq s MET 329 Ca 0.44 0.65 0.00 0.00 -1.71 0.00 0.00 55.69 55.07 3naq s MET 329 Cb 0.39 -2.09 -0.04 0.00 2.01 0.00 0.00 34.83 35.10 3naq s MET 329 CO -0.14 -0.63 0.05 0.95 -0.01 0.00 0.00 175.02 175.24 3naq s THR 330 N -3.18 0.31 1.18 2.05 -4.23 -0.83 -4.94 115.64 105.99 3naq s THR 330 Ca 0.55 -1.94 -0.13 0.00 -1.18 0.00 0.00 61.69 58.98 3naq s THR 330 Cb -0.11 -2.14 0.29 0.00 1.34 0.00 0.00 72.50 71.88 3naq s THR 330 CO 0.53 -0.41 1.02 -2.84 -0.54 0.00 0.00 174.62 172.39 3naq s PRO 331 N -4.01 -1.04 -1.21 3.99 0.02 -1.26 -4.27 135.00 127.22 3naq s PRO 331 Ca 0.26 0.71 -0.19 0.00 0.02 0.00 0.00 61.00 61.80 3naq s PRO 331 Cb 0.07 -1.55 0.07 0.00 0.02 0.00 0.00 34.50 33.11 3naq s PRO 331 CO 0.04 -3.77 1.62 -1.58 -0.33 0.00 0.00 177.00 172.98 3naq s HIS 332 N -2.51 2.77 0.00 6.54 2.46 -1.13 -4.63 115.29 118.80 3naq s HIS 332 Ca 0.68 -1.45 0.00 0.00 0.47 0.00 0.00 55.06 54.77 3naq s HIS 332 Cb -0.24 -4.70 0.00 0.00 -0.13 0.00 0.00 32.58 27.52 3naq s HIS 332 CO 0.64 -1.81 0.14 0.25 -2.47 0.00 0.00 174.74 171.49 3naq n THR 333 N 6.38 0.00 0.27 0.89 -2.24 -1.26 -4.81 114.28 113.50 3naq n THR 333 Ca 0.43 -0.45 0.11 0.00 -2.27 0.00 0.00 64.05 61.87 3naq n THR 333 Cb 0.47 1.03 0.74 0.00 -2.10 0.00 0.00 70.33 70.47 3naq n THR 333 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 3naq h SER 334 N 0.00 0.00 -0.64 3.42 4.64 -1.94 -0.13 113.55 118.90 3naq h SER 334 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3naq h SER 334 Cb 0.02 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.11 3naq h SER 334 CO 0.00 0.04 0.00 0.61 -0.87 0.00 0.00 176.83 176.61 3naq n GLY 335 N -1.27 2.73 1.35 -0.77 0.00 -1.26 -4.16 105.19 101.80 3naq n GLY 335 Ca -0.03 -0.86 0.01 0.00 0.00 0.00 0.00 46.02 45.14 3naq n GLY 335 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 3naq n THR 336 N 1.07 1.36 -0.75 2.61 5.66 -0.06 -4.67 114.28 119.49 3naq n THR 336 Ca 0.26 -2.53 -0.30 0.00 -3.05 0.00 0.00 64.05 58.43 3naq n THR 336 Cb 0.94 0.26 0.18 0.00 -1.55 0.00 0.00 70.33 70.16 3naq n THR 336 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 175.07 172.44 3naq s THR 337 N -2.32 2.21 0.30 1.09 -4.23 -1.23 -4.76 115.64 106.70 3naq s THR 337 Ca 0.37 0.07 -0.01 0.00 -1.18 0.00 0.00 61.69 60.94 3naq s THR 337 Cb 0.38 -2.18 0.22 0.00 1.34 0.00 0.00 72.50 72.26 3naq s THR 337 CO -0.09 -0.09 1.92 0.40 -0.54 0.00 0.00 174.62 176.22 3naq h ILE 338 N -1.99 1.21 -0.43 2.99 1.08 -1.96 -0.33 117.51 118.08 3naq h ILE 338 Ca -0.49 -0.53 -0.11 0.00 -0.39 0.00 0.00 64.86 63.35 3naq h ILE 338 Cb 1.28 0.29 -0.02 0.00 -3.07 0.00 0.00 36.82 35.31 3naq h ILE 338 CO 0.46 0.23 -0.17 0.44 -0.69 0.00 0.00 178.15 178.42 3naq h ASP 339 N 0.95 0.84 -0.22 1.72 5.19 -1.93 -0.07 116.42 122.90 3naq h ASP 339 Ca 0.24 -0.28 -0.02 0.00 -0.62 0.00 0.00 57.03 56.35 3naq h ASP 339 Cb 0.04 -0.23 -0.01 0.00 0.18 0.00 0.00 39.33 39.31 3naq h ASP 339 CO -0.04 1.00 0.06 0.00 -3.12 0.00 0.00 179.24 177.14 3naq h ALA 340 N 1.07 0.29 -0.82 3.45 0.00 -1.72 -2.48 119.26 119.05 3naq h ALA 340 Ca 0.11 -0.15 0.07 0.00 0.00 0.00 0.00 54.91 54.94 3naq h ALA 340 Cb 0.68 -0.09 -0.07 0.00 0.00 0.00 0.00 17.79 18.32 3naq h ALA 340 CO 0.05 -0.06 0.49 1.96 0.00 0.00 0.00 179.25 181.68 3naq h GLN 341 N 0.18 0.83 -0.89 0.00 4.20 -0.62 0.77 115.11 119.59 3naq h GLN 341 Ca 0.07 -0.05 -0.00 0.00 0.06 0.00 0.00 58.65 58.73 3naq h GLN 341 Cb 0.26 -0.19 -0.04 0.00 0.30 0.00 0.00 27.48 27.81 3naq h GLN 341 CO -0.00 0.55 0.56 -0.07 -0.67 0.00 0.00 178.83 179.20 3naq h LEU 342 N 0.86 1.05 -0.58 1.46 3.38 -0.86 0.17 115.31 120.78 3naq h LEU 342 Ca 0.37 -0.05 -0.14 0.00 0.09 0.00 0.00 57.88 58.15 3naq h LEU 342 Cb 0.25 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.73 3naq h LEU 342 CO -0.20 0.79 -0.37 0.03 0.09 0.00 0.00 178.44 178.77 3naq h ARG 343 N 1.22 0.71 -0.26 1.13 3.08 -0.70 -0.63 114.38 118.93 3naq h ARG 343 Ca 0.32 -0.36 -0.04 0.00 0.07 0.00 0.00 59.98 59.97 3naq h ARG 343 Cb -0.08 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 29.96 3naq h ARG 343 CO -0.06 0.97 -0.01 1.88 -1.07 0.00 0.00 179.97 181.68 3naq h TYR 344 N 0.59 0.51 -0.46 3.04 0.05 -0.40 0.51 116.97 120.82 3naq h TYR 344 Ca 0.05 -0.09 0.00 0.00 0.05 0.00 0.00 58.73 58.74 3naq h TYR 344 Cb 0.91 -0.13 -0.02 0.00 1.01 0.00 0.00 36.73 38.49 3naq h TYR 344 CO 0.05 0.64 0.30 0.00 -1.05 0.00 0.00 178.16 178.09 3naq h ALA 345 N 0.81 0.58 -0.70 3.88 0.00 -0.58 -1.11 119.26 122.14 3naq h ALA 345 Ca 0.07 -0.04 -0.07 0.00 0.00 0.00 0.00 54.91 54.87 3naq h ALA 345 Cb 0.44 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.02 3naq h ALA 345 CO 0.02 0.04 0.15 0.00 0.00 0.00 0.00 179.25 179.46 3naq h ALA 346 N 1.16 0.93 -0.63 0.00 0.00 -0.80 -0.55 119.26 119.37 3naq h ALA 346 Ca 0.17 -0.26 -0.05 0.00 0.00 0.00 0.00 54.91 54.77 3naq h ALA 346 Cb -0.05 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.44 3naq h ALA 346 CO -0.03 0.67 0.21 0.78 0.00 0.00 0.00 179.25 180.88 3naq h GLY 347 N 1.07 1.04 1.00 0.00 0.00 -0.79 -0.78 103.07 104.61 3naq h GLY 347 Ca 0.22 -0.61 -0.05 0.00 0.00 0.00 0.00 47.33 46.90 3naq h GLY 347 CO 0.01 0.57 0.18 -0.84 0.00 0.00 0.00 176.54 176.45 3naq h THR 348 N 0.90 1.24 -0.36 4.70 2.02 -0.89 -1.09 112.91 119.42 3naq h THR 348 Ca 0.21 -0.81 -0.05 0.00 0.77 0.00 0.00 66.41 66.53 3naq h THR 348 Cb 0.27 0.69 -0.01 0.00 -1.74 0.00 0.00 68.15 67.36 3naq h THR 348 CO -0.01 0.30 0.04 0.50 0.37 0.00 0.00 175.52 176.73 3naq h LYS 349 N 0.80 0.61 -0.33 6.66 3.64 -0.93 0.23 116.57 127.25 3naq h LYS 349 Ca 0.18 -0.17 0.05 0.00 -1.27 0.00 0.00 60.65 59.44 3naq h LYS 349 Cb 0.29 -0.07 -0.04 0.00 -0.41 0.00 0.00 32.23 32.00 3naq h LYS 349 CO -0.01 0.70 0.07 0.22 -2.27 0.00 0.00 179.45 178.16 3naq h ASP 350 N 0.44 0.02 -0.29 4.20 -0.00 -0.93 -0.22 116.42 119.64 3naq h ASP 350 Ca 0.11 0.05 -0.11 0.00 -0.00 0.00 0.00 57.03 57.08 3naq h ASP 350 Cb 0.39 0.07 -0.01 0.00 -0.00 0.00 0.00 39.33 39.78 3naq h ASP 350 CO 0.01 0.05 -0.20 0.24 -0.00 0.00 0.00 179.24 179.34 3naq h MET 351 N 0.19 0.76 -0.53 0.28 2.86 -0.89 -0.63 114.93 116.96 3naq h MET 351 Ca 0.16 -0.29 0.01 0.00 -2.06 0.00 0.00 59.70 57.51 3naq h MET 351 Cb 0.17 -0.04 -0.03 0.00 0.06 0.00 0.00 31.60 31.76 3naq h MET 351 CO -0.20 0.90 0.35 -0.07 1.06 0.00 0.00 176.91 178.94 3naq h LEU 352 N 0.67 0.60 -0.41 1.22 3.38 -0.56 0.21 115.31 120.42 3naq h LEU 352 Ca 0.10 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.04 3naq h LEU 352 Cb 0.70 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.29 3naq h LEU 352 CO 0.05 0.43 0.21 -0.08 0.09 0.00 0.00 178.44 179.14 3naq h GLU 353 N 0.71 0.58 -0.73 1.13 4.81 -0.69 0.26 114.58 120.64 3naq h GLU 353 Ca 0.20 -0.08 0.02 0.00 -0.13 0.00 0.00 59.36 59.37 3naq h GLU 353 Cb -0.07 -0.11 -0.04 0.00 0.63 0.00 0.00 28.75 29.17 3naq h GLU 353 CO -0.05 0.48 0.48 0.00 -0.73 0.00 0.00 179.01 179.19 3naq h ARG 354 N 0.52 0.93 -0.43 1.92 3.08 -0.89 -1.38 114.38 118.13 3naq h ARG 354 Ca 0.14 -0.06 0.01 0.00 0.07 0.00 0.00 59.98 60.15 3naq h ARG 354 Cb 0.09 -0.21 -0.03 0.00 0.08 0.00 0.00 29.97 29.90 3naq h ARG 354 CO -0.02 0.61 0.27 -0.92 -1.07 0.00 0.00 179.97 178.84 3naq h TYR 355 N 0.96 0.50 -0.17 3.04 3.20 -0.03 0.13 116.97 124.59 3naq h TYR 355 Ca 0.28 0.01 -0.06 0.00 3.14 0.00 0.00 58.73 62.10 3naq h TYR 355 Cb -0.06 -0.16 -0.01 0.00 1.54 0.00 0.00 36.73 38.03 3naq h TYR 355 CO -0.03 0.30 -0.17 0.74 -1.64 0.00 0.00 178.16 177.36 3naq h PHE 356 N 0.54 0.30 -0.01 -3.82 0.05 -0.45 -2.64 116.94 110.90 3naq h PHE 356 Ca 0.17 -0.04 0.00 0.00 3.82 0.00 0.00 57.97 61.92 3naq h PHE 356 Cb -0.01 -0.08 0.00 0.00 2.00 0.00 0.00 35.95 37.85 3naq h PHE 356 CO -0.06 0.45 -0.19 1.63 -0.18 0.00 0.00 178.31 179.96 3naq n LYS 357 N -4.22 1.26 -2.52 1.51 5.02 -0.57 -4.95 118.16 113.68 3naq n LYS 357 Ca -0.01 -0.82 -0.09 0.00 -2.02 0.00 0.00 58.31 55.37 3naq n LYS 357 Cb 0.31 -1.48 0.01 0.00 -0.02 0.00 0.00 35.03 33.85 3naq n LYS 357 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3naq n GLY 358 N 1.30 0.16 3.67 0.72 0.00 0.21 -5.04 105.19 106.21 3naq n GLY 358 Ca 0.14 -0.42 -0.34 0.00 0.00 0.00 0.00 46.02 45.40 3naq n GLY 358 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3naq s GLU 359 N -4.94 2.87 0.51 1.61 2.02 0.17 -5.03 118.70 115.92 3naq s GLU 359 Ca 0.11 -0.51 -0.22 0.00 0.02 0.00 0.00 54.97 54.38 3naq s GLU 359 Cb -0.05 -2.72 -0.06 0.00 0.10 0.00 0.00 34.13 31.41 3naq s GLU 359 CO 0.14 0.67 1.25 -0.51 0.02 0.00 0.00 175.26 176.82 3naq s ASP 360 N -1.14 5.67 0.80 -0.19 1.01 -1.26 -4.26 116.67 117.29 3naq s ASP 360 Ca 0.16 2.50 -0.12 0.00 0.71 0.00 0.00 52.55 55.80 3naq s ASP 360 Cb -0.11 -2.62 0.07 0.00 1.01 0.00 0.00 42.92 41.27 3naq s ASP 360 CO 0.05 -1.28 1.11 -0.36 0.21 0.00 0.00 175.17 174.90 3naq s PHE 361 N -1.46 2.87 0.17 4.23 0.08 -1.26 -4.99 117.98 117.62 3naq s PHE 361 Ca 0.69 1.07 -0.33 0.00 0.12 0.00 0.00 56.93 58.48 3naq s PHE 361 Cb -0.33 -3.17 -0.15 0.00 -0.57 0.00 0.00 43.02 38.79 3naq s PHE 361 CO 0.40 -1.76 1.21 -2.30 -0.10 0.00 0.00 175.22 172.66 3naq n PRO 362 N -3.41 1.28 -0.24 0.24 -0.02 -1.26 -4.84 135.00 126.75 3naq n PRO 362 Ca 0.07 0.46 0.05 0.00 -2.02 0.00 0.00 63.50 62.06 3naq n PRO 362 Cb 0.57 -1.99 0.30 0.00 -0.02 0.00 0.00 33.50 32.36 3naq n PRO 362 CO 0.00 0.00 0.00 1.15 1.98 0.00 0.00 175.50 178.63 3naq h THR 363 N 2.78 1.04 0.00 3.45 2.02 -1.98 -0.49 112.91 119.73 3naq h THR 363 Ca -0.44 -0.30 0.00 0.00 0.77 0.00 0.00 66.41 66.44 3naq h THR 363 Cb 1.33 0.08 0.00 0.00 -1.74 0.00 0.00 68.15 67.82 3naq h THR 363 CO 0.72 0.16 0.00 -1.84 0.37 0.00 0.00 175.52 174.93 3naq n GLU 364 N -4.48 0.12 0.15 6.66 0.00 -1.26 -2.24 120.64 119.58 3naq n GLU 364 Ca 0.12 0.39 0.10 0.00 0.00 0.00 0.00 57.16 57.77 3naq n GLU 364 Cb 0.21 -1.75 0.06 0.00 0.00 0.00 0.00 31.44 29.96 3naq n GLU 364 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.13 176.22 3naq h ASN 365 N 0.00 0.00 -3.40 -1.84 4.21 -1.31 -3.44 115.58 109.81 3naq h ASN 365 Ca 0.00 0.00 -0.53 0.00 1.21 0.00 0.00 56.30 56.98 3naq h ASN 365 Cb 0.29 0.00 -0.01 0.00 -1.12 0.00 0.00 38.32 37.48 3naq h ASN 365 CO 0.00 0.08 0.44 -0.31 -1.29 0.00 0.00 177.43 176.35 3naq s TYR 366 N -3.25 3.61 -0.24 1.19 1.51 -0.95 -1.00 117.35 118.23 3naq s TYR 366 Ca 0.02 1.59 -0.07 0.00 -1.01 0.00 0.00 57.07 57.61 3naq s TYR 366 Cb 0.08 -3.22 -0.12 0.00 -0.11 0.00 0.00 41.96 38.59 3naq s TYR 366 CO 0.74 -0.42 -0.27 -0.89 -1.11 0.00 0.00 175.55 173.60 3naq n ILE 367 N 3.49 1.32 -4.68 2.71 5.41 0.59 -4.83 119.36 123.38 3naq n ILE 367 Ca 0.06 -0.40 -0.24 0.00 1.00 0.00 0.00 62.75 63.16 3naq n ILE 367 Cb 0.49 -1.62 -0.16 0.00 -0.71 0.00 0.00 39.64 37.63 3naq n ILE 367 CO 0.00 0.00 0.00 -0.69 0.00 0.00 0.00 176.55 175.86 3naq s VAL 368 N -2.45 1.22 -0.23 1.39 1.01 -0.64 -0.90 120.40 119.80 3naq s VAL 368 Ca -0.33 -0.59 0.02 0.00 0.00 0.00 0.00 61.98 61.08 3naq s VAL 368 Cb 0.11 -1.06 0.05 0.00 0.00 0.00 0.00 36.38 35.48 3naq s VAL 368 CO 0.47 0.36 -0.09 -0.75 0.00 0.00 0.00 175.10 175.09 3naq s LYS 369 N 0.18 1.97 -1.47 2.72 2.20 0.00 -0.66 119.74 124.69 3naq s LYS 369 Ca -0.06 -1.08 -0.01 0.00 -0.36 0.00 0.00 55.97 54.47 3naq s LYS 369 Cb -0.11 -2.65 0.01 0.00 -1.51 0.00 0.00 37.83 33.56 3naq s LYS 369 CO 0.02 -0.54 0.29 -0.25 -0.36 0.00 0.00 175.35 174.51 3naq n ASP 370 N 4.59 0.01 0.00 1.43 8.00 -1.17 -1.15 116.55 128.26 3naq n ASP 370 Ca -0.14 -1.10 0.00 0.00 0.71 0.00 0.00 54.79 54.26 3naq n ASP 370 Cb 0.44 -2.53 0.00 0.00 -0.02 0.00 0.00 41.12 39.02 3naq n ASP 370 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3naq n GLY 371 N -2.16 1.00 3.44 0.44 0.00 0.15 -4.79 105.19 103.27 3naq n GLY 371 Ca -0.30 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.33 3naq n GLY 371 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3naq s GLU 372 N -0.22 3.31 0.05 1.61 0.41 -0.30 -4.58 118.70 118.98 3naq s GLU 372 Ca 0.00 -0.74 -0.30 0.00 -0.41 0.00 0.00 54.97 53.52 3naq s GLU 372 Cb 0.00 -3.58 -0.05 0.00 -1.78 0.00 0.00 34.13 28.72 3naq s GLU 372 CO 0.00 -0.43 1.13 -1.17 -0.49 0.00 0.00 175.26 174.30 3naq s LEU 373 N 1.61 4.38 0.51 1.80 0.20 -1.26 -0.82 118.68 125.10 3naq s LEU 373 Ca 0.04 1.92 -0.23 0.00 0.69 0.00 0.00 54.13 56.56 3naq s LEU 373 Cb -0.17 -3.58 -0.07 0.00 -0.43 0.00 0.00 46.19 41.94 3naq s LEU 373 CO 0.06 -0.40 1.24 0.00 -0.29 0.00 0.00 176.35 176.97 3naq n ALA 374 N 3.82 1.17 0.24 5.97 0.00 -0.08 -4.81 120.51 126.82 3naq n ALA 374 Ca 0.08 0.16 0.07 0.00 0.00 0.00 0.00 53.44 53.74 3naq n ALA 374 Cb 0.48 -2.27 0.58 0.00 0.00 0.00 0.00 19.45 18.24 3naq n ALA 374 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 3naq h PRO 375 N 1.50 0.02 0.00 0.00 0.13 -1.94 -0.51 132.00 131.21 3naq h PRO 375 Ca -0.49 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 3naq h PRO 375 Cb 1.31 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.44 3naq h PRO 375 CO 0.57 0.08 0.00 1.96 -0.23 0.00 0.00 178.00 180.38 3naq h GLN 376 N 0.02 0.00 -0.02 0.86 7.50 -1.97 -2.51 115.11 119.00 3naq h GLN 376 Ca 0.01 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.16 3naq h GLN 376 Cb 0.11 0.00 0.00 0.00 0.05 0.00 0.00 27.48 27.64 3naq h GLN 376 CO 0.01 0.00 -0.20 0.66 -1.50 0.00 0.00 178.83 177.80 3naq n TYR 377 N -2.67 0.00 1.98 2.96 4.02 -0.20 -5.27 117.16 117.97 3naq n TYR 377 Ca -0.01 0.00 0.16 0.00 -0.01 0.00 0.00 57.90 58.04 3naq n TYR 377 Cb 0.15 0.00 0.93 0.00 -0.02 0.00 0.00 39.34 40.40 3naq n TYR 377 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 176.86 176.39