#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dl5 s LYS 4 N 0.00 1.42 0.17 5.31 3.01 -1.26 -5.13 119.74 123.25 3dl5 s LYS 4 Ca 0.00 -1.49 -0.22 0.00 -1.01 0.00 0.00 55.97 53.25 3dl5 s LYS 4 Cb 0.00 -1.60 -0.08 0.00 -1.01 0.00 0.00 37.83 35.14 3dl5 s LYS 4 CO 0.00 0.34 0.73 1.21 0.51 0.00 0.00 175.35 178.13 3dl5 s ASN 5 N -2.72 7.22 -0.24 2.83 2.47 -1.26 -4.96 114.94 118.28 3dl5 s ASN 5 Ca 0.19 1.51 -0.01 0.00 0.42 0.00 0.00 52.86 54.96 3dl5 s ASN 5 Cb -0.07 -2.45 0.07 0.00 -1.45 0.00 0.00 41.25 37.35 3dl5 s ASN 5 CO 0.09 0.16 0.03 0.54 -3.72 0.00 0.00 177.10 174.19 3dl5 s VAL 6 N -1.28 0.88 0.07 -5.21 0.11 -1.26 -0.62 120.40 113.09 3dl5 s VAL 6 Ca 0.37 -0.96 0.07 0.00 -2.93 0.00 0.00 61.98 58.53 3dl5 s VAL 6 Cb -0.20 -1.41 -0.03 0.00 -1.53 0.00 0.00 36.38 33.21 3dl5 s VAL 6 CO 0.23 -0.31 -0.20 -0.94 -3.33 0.00 0.00 175.10 170.55 3dl5 s SER 7 N 1.67 2.45 0.48 3.54 1.04 -0.50 -0.01 113.70 122.37 3dl5 s SER 7 Ca 0.01 -0.58 -0.16 0.00 0.48 0.00 0.00 55.95 55.70 3dl5 s SER 7 Cb -0.18 -0.17 -0.08 0.00 0.10 0.00 0.00 66.02 65.69 3dl5 s SER 7 CO -0.12 0.11 0.93 -0.63 0.98 0.00 0.00 173.24 174.52 3dl5 s ILE 8 N -0.94 4.57 -0.04 -1.02 1.01 -0.60 -1.50 121.20 122.69 3dl5 s ILE 8 Ca 0.07 1.12 -0.00 0.00 0.00 0.00 0.00 60.65 61.83 3dl5 s ILE 8 Cb -0.09 -3.71 0.03 0.00 0.01 0.00 0.00 42.46 38.70 3dl5 s ILE 8 CO 0.03 -0.61 0.01 -0.69 0.00 0.00 0.00 174.94 173.69 3dl5 s VAL 9 N -2.51 0.13 0.10 2.92 1.01 -1.00 -0.83 120.40 120.21 3dl5 s VAL 9 Ca 0.58 0.17 -0.25 0.00 0.00 0.00 0.00 61.98 62.47 3dl5 s VAL 9 Cb -0.10 -0.27 0.08 0.00 0.00 0.00 0.00 36.38 36.10 3dl5 s VAL 9 CO 0.29 0.16 0.76 0.54 0.00 0.00 0.00 175.10 176.85 3dl5 s VAL 10 N 1.36 0.00 -0.09 2.92 0.11 -0.43 -4.54 120.40 119.73 3dl5 s VAL 10 Ca -0.05 -0.11 -0.01 0.00 -2.93 0.00 0.00 61.98 58.89 3dl5 s VAL 10 Cb -0.13 -1.13 0.03 0.00 -1.53 0.00 0.00 36.38 33.62 3dl5 s VAL 10 CO -0.03 0.00 -0.04 0.00 -3.33 0.00 0.00 175.10 171.70 3dl5 s ALA 11 N -3.46 1.02 0.12 1.54 0.00 -1.26 -0.25 121.76 119.47 3dl5 s ALA 11 Ca 0.04 -0.33 0.02 0.00 0.00 0.00 0.00 51.96 51.69 3dl5 s ALA 11 Cb -0.01 -0.81 -0.04 0.00 0.00 0.00 0.00 23.12 22.25 3dl5 s ALA 11 CO -0.09 -0.41 -0.07 0.00 0.00 0.00 0.00 175.76 175.20 3dl5 s ALA 12 N 1.77 1.14 0.46 0.00 0.00 -0.40 -4.51 121.76 120.22 3dl5 s ALA 12 Ca 0.04 -1.42 -0.25 0.00 0.00 0.00 0.00 51.96 50.34 3dl5 s ALA 12 Cb -0.13 0.18 -0.08 0.00 0.00 0.00 0.00 23.12 23.10 3dl5 s ALA 12 CO -0.06 -0.21 1.35 -1.54 0.00 0.00 0.00 175.76 175.30 3dl5 s SER 13 N -3.09 5.91 0.24 0.00 1.04 -0.02 -1.48 113.70 116.30 3dl5 s SER 13 Ca 0.15 2.75 -0.05 0.00 0.48 0.00 0.00 55.95 59.27 3dl5 s SER 13 Cb 0.05 -2.64 0.39 0.00 0.10 0.00 0.00 66.02 63.91 3dl5 s SER 13 CO -0.02 -1.13 1.80 1.62 0.98 0.00 0.00 173.24 176.48 3dl5 h VAL 14 N 2.14 0.87 0.00 5.02 3.04 -1.22 -1.00 116.25 125.10 3dl5 h VAL 14 Ca -0.50 -0.24 -0.02 0.00 -1.01 0.00 0.00 66.70 64.92 3dl5 h VAL 14 Cb 1.26 0.10 -0.00 0.00 -2.01 0.00 0.00 31.29 30.64 3dl5 h VAL 14 CO 0.61 0.13 -0.46 -0.07 -1.01 0.00 0.00 177.57 176.77 3dl5 h LEU 15 N 0.71 0.00 -1.63 3.16 3.38 -1.91 -3.41 115.31 115.62 3dl5 h LEU 15 Ca 0.39 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 58.28 3dl5 h LEU 15 Cb 0.39 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.14 3dl5 h LEU 15 CO -0.26 0.78 0.00 -1.54 0.09 0.00 0.00 178.44 177.50 3dl5 n SER 16 N -4.63 2.52 -1.57 -0.43 3.41 -1.26 -4.97 113.62 106.69 3dl5 n SER 16 Ca -0.08 -1.84 -0.16 0.00 -0.26 0.00 0.00 58.87 56.53 3dl5 n SER 16 Cb 0.25 -0.01 -0.03 0.00 -0.26 0.00 0.00 64.21 64.16 3dl5 n SER 16 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 3dl5 n SER 17 N 0.97 -4.84 -4.74 4.04 7.64 -0.38 -4.76 113.62 111.55 3dl5 n SER 17 Ca 0.16 0.16 -0.41 0.00 1.01 0.00 0.00 58.87 59.78 3dl5 n SER 17 Cb 0.52 -3.87 -0.02 0.00 -1.01 0.00 0.00 64.21 59.83 3dl5 n SER 17 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 3dl5 s GLY 18 N -2.51 2.28 0.00 0.23 0.00 -1.26 -0.84 107.32 105.22 3dl5 s GLY 18 Ca 0.00 1.33 0.02 0.00 0.00 0.00 0.00 44.72 46.06 3dl5 s GLY 18 CO 0.00 2.30 0.33 0.29 0.00 0.00 0.00 173.10 176.02 3dl5 n ILE 19 N 2.42 0.00 -3.61 0.90 -5.35 0.15 -0.84 119.36 113.03 3dl5 n ILE 19 Ca 0.07 -0.48 -0.05 0.00 -0.27 0.00 0.00 62.75 62.02 3dl5 n ILE 19 Cb 0.40 1.02 -0.02 0.00 -1.74 0.00 0.00 39.64 39.31 3dl5 n ILE 19 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 3dl5 s GLY 20 N -0.62 -0.36 -0.18 3.28 0.00 -1.05 -4.52 107.32 103.87 3dl5 s GLY 20 Ca 0.01 0.73 -0.12 0.00 0.00 0.00 0.00 44.72 45.35 3dl5 s GLY 20 CO 0.04 0.22 0.46 -1.50 0.00 0.00 0.00 173.10 172.32 3dl5 s ILE 21 N -3.03 -0.02 -1.49 0.90 1.10 0.76 -1.64 121.20 117.79 3dl5 s ILE 21 Ca 0.09 0.06 -0.07 0.00 -0.51 0.00 0.00 60.65 60.22 3dl5 s ILE 21 Cb -0.00 -0.66 0.01 0.00 0.15 0.00 0.00 42.46 41.95 3dl5 s ILE 21 CO -0.04 0.02 0.13 0.59 -2.11 0.00 0.00 174.94 173.54 3dl5 n ASN 22 N 3.85 -0.02 -0.83 4.50 3.02 -1.26 0.09 115.26 124.62 3dl5 n ASN 22 Ca -0.20 -1.29 -0.11 0.00 -0.03 0.00 0.00 54.58 52.96 3dl5 n ASN 22 Cb 0.56 -1.60 -0.05 0.00 -0.61 0.00 0.00 39.78 38.09 3dl5 n ASN 22 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3dl5 n GLY 23 N -2.50 1.18 3.20 7.41 0.00 -1.26 -4.99 105.19 108.23 3dl5 n GLY 23 Ca -0.29 -0.35 -0.12 0.00 0.00 0.00 0.00 46.02 45.27 3dl5 n GLY 23 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3dl5 s GLN 24 N -2.78 1.09 0.41 1.61 -0.21 0.11 -4.71 119.66 115.18 3dl5 s GLN 24 Ca 0.00 -1.55 -0.24 0.00 0.02 0.00 0.00 55.36 53.59 3dl5 s GLN 24 Cb 0.00 0.13 -0.09 0.00 1.00 0.00 0.00 33.01 34.05 3dl5 s GLN 24 CO 0.00 -0.29 1.04 -0.51 -2.12 0.00 0.00 175.29 173.41 3dl5 s LEU 25 N -3.13 4.11 0.00 2.90 1.43 -1.26 -0.17 118.68 122.55 3dl5 s LEU 25 Ca 0.30 1.99 0.16 0.00 -1.03 0.00 0.00 54.13 55.56 3dl5 s LEU 25 Cb 0.07 -4.24 0.93 0.00 0.03 0.00 0.00 46.19 42.98 3dl5 s LEU 25 CO 0.07 -0.49 1.60 -2.65 0.23 0.00 0.00 176.35 175.11 3dl5 n PRO 26 N -0.16 1.08 -3.69 1.29 -0.02 -1.26 -4.74 135.00 127.49 3dl5 n PRO 26 Ca 0.05 -0.12 -0.09 0.00 -2.02 0.00 0.00 63.50 61.32 3dl5 n PRO 26 Cb 0.50 -1.26 -0.02 0.00 -0.02 0.00 0.00 33.50 32.69 3dl5 n PRO 26 CO 0.00 0.00 0.00 1.67 1.98 0.00 0.00 175.50 179.15 3dl5 s TRP 27 N -1.97 -0.29 -0.31 6.00 -2.14 -1.26 -5.09 118.94 113.88 3dl5 s TRP 27 Ca 0.25 -0.07 0.02 0.00 2.66 0.00 0.00 56.10 58.96 3dl5 s TRP 27 Cb 0.12 0.60 0.09 0.00 -3.10 0.00 0.00 33.47 31.18 3dl5 s TRP 27 CO 0.19 -1.05 0.03 0.45 -2.66 0.00 0.00 176.95 173.91 3dl5 s SER 28 N -2.86 4.36 -0.26 -2.66 0.15 -1.26 -5.07 113.70 106.09 3dl5 s SER 28 Ca 0.08 -1.77 0.00 0.00 0.70 0.00 0.00 55.95 54.96 3dl5 s SER 28 Cb -0.03 -1.32 0.08 0.00 -1.71 0.00 0.00 66.02 63.04 3dl5 s SER 28 CO -0.01 -0.35 0.02 -0.63 1.20 0.00 0.00 173.24 173.47 3dl5 s ILE 29 N 1.22 1.24 0.10 6.45 1.01 -1.26 -4.96 121.20 125.00 3dl5 s ILE 29 Ca 0.06 -1.30 -0.35 0.00 0.00 0.00 0.00 60.65 59.07 3dl5 s ILE 29 Cb -0.19 -1.73 -0.15 0.00 0.01 0.00 0.00 42.46 40.41 3dl5 s ILE 29 CO -0.12 -0.36 1.56 0.28 0.00 0.00 0.00 174.94 176.29 3dl5 h SER 30 N 8.00 -1.60 -1.03 3.58 0.02 -2.00 -2.28 113.55 118.25 3dl5 h SER 30 Ca -0.15 0.17 0.31 0.00 -0.84 0.00 0.00 61.79 61.28 3dl5 h SER 30 Cb 1.06 0.59 -0.14 0.00 0.14 0.00 0.00 62.40 64.04 3dl5 h SER 30 CO 0.43 -0.57 0.60 -0.33 -1.14 0.00 0.00 176.83 175.83 3dl5 h GLU 31 N -0.77 0.35 -0.58 3.45 3.07 -1.97 0.32 114.58 118.46 3dl5 h GLU 31 Ca -0.01 -0.02 -0.11 0.00 -0.50 0.00 0.00 59.36 58.72 3dl5 h GLU 31 Cb 0.77 -0.08 -0.02 0.00 -0.84 0.00 0.00 28.75 28.58 3dl5 h GLU 31 CO -0.28 0.23 -0.06 0.22 -1.40 0.00 0.00 179.01 177.73 3dl5 h ASP 32 N 0.37 1.05 -0.23 1.42 3.58 -1.84 0.27 116.42 121.03 3dl5 h ASP 32 Ca 0.71 -0.33 -0.18 0.00 0.42 0.00 0.00 57.03 57.66 3dl5 h ASP 32 Cb 1.64 -0.28 -0.00 0.00 1.72 0.00 0.00 39.33 42.40 3dl5 h ASP 32 CO -0.54 1.13 -0.53 -0.07 -2.88 0.00 0.00 179.24 176.34 3dl5 h LEU 33 N 0.95 0.91 -1.92 2.28 3.38 -0.41 0.80 115.31 121.30 3dl5 h LEU 33 Ca 0.16 -0.48 -0.01 0.00 0.09 0.00 0.00 57.88 57.64 3dl5 h LEU 33 Cb 0.63 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 41.11 3dl5 h LEU 33 CO 0.04 1.26 -0.02 0.50 0.09 0.00 0.00 178.44 180.31 3dl5 h LYS 34 N 0.63 0.02 0.46 1.13 3.64 -0.22 0.18 116.57 122.41 3dl5 h LYS 34 Ca 0.02 -0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.37 3dl5 h LYS 34 Cb 1.13 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.95 3dl5 h LYS 34 CO 0.12 0.05 -0.22 0.35 -2.27 0.00 0.00 179.45 177.47 3dl5 h PHE 35 N 0.02 -0.58 -0.96 1.91 3.57 0.34 -1.29 116.94 119.96 3dl5 h PHE 35 Ca 0.01 -0.01 0.31 0.00 3.53 0.00 0.00 57.97 61.80 3dl5 h PHE 35 Cb 0.05 0.19 -0.16 0.00 2.79 0.00 0.00 35.95 38.82 3dl5 h PHE 35 CO 0.00 -0.36 0.31 0.35 -2.23 0.00 0.00 178.31 176.38 3dl5 h PHE 36 N -0.98 0.46 0.35 0.41 3.04 -0.21 0.17 116.94 120.17 3dl5 h PHE 36 Ca -0.06 0.05 -0.02 0.00 3.98 0.00 0.00 57.97 61.92 3dl5 h PHE 36 Cb 0.48 -0.04 0.00 0.00 2.56 0.00 0.00 35.95 38.95 3dl5 h PHE 36 CO 0.02 -0.33 -0.17 1.03 -2.02 0.00 0.00 178.31 176.84 3dl5 h SER 37 N 0.12 -0.40 -0.09 0.41 0.87 -0.60 -1.77 113.55 112.10 3dl5 h SER 37 Ca 0.67 -0.11 0.04 0.00 -1.23 0.00 0.00 61.79 61.16 3dl5 h SER 37 Cb 1.53 0.10 -0.06 0.00 -0.44 0.00 0.00 62.40 63.54 3dl5 h SER 37 CO -0.75 -0.11 -0.27 0.11 -0.53 0.00 0.00 176.83 175.28 3dl5 h LYS 38 N -0.70 -0.36 -0.04 2.24 1.79 0.50 -0.74 116.57 119.26 3dl5 h LYS 38 Ca -0.05 0.02 -0.10 0.00 -2.18 0.00 0.00 60.65 58.35 3dl5 h LYS 38 Cb 0.49 0.08 -0.01 0.00 -1.58 0.00 0.00 32.23 31.20 3dl5 h LYS 38 CO 0.08 -0.24 -0.44 0.97 -1.08 0.00 0.00 179.45 178.74 3dl5 h ILE 39 N -0.37 1.32 0.00 1.86 -0.00 -1.28 -2.51 117.51 116.53 3dl5 h ILE 39 Ca 0.09 -1.54 -0.11 0.00 -0.00 0.00 0.00 64.86 63.29 3dl5 h ILE 39 Cb 0.50 1.78 -0.02 0.00 -0.00 0.00 0.00 36.82 39.08 3dl5 h ILE 39 CO -0.30 0.45 -0.54 0.74 -0.00 0.00 0.00 178.15 178.50 3dl5 h THR 40 N 0.08 1.09 -0.00 2.19 2.02 -0.90 -3.10 112.91 114.29 3dl5 h THR 40 Ca 0.00 -2.09 0.00 0.00 0.77 0.00 0.00 66.41 65.10 3dl5 h THR 40 Cb 0.81 2.23 0.00 0.00 -1.74 0.00 0.00 68.15 69.45 3dl5 h THR 40 CO 0.06 0.53 -0.67 0.59 0.37 0.00 0.00 175.52 176.40 3dl5 n ASN 41 N -3.46 0.94 -4.62 4.18 4.13 -0.32 -4.79 115.26 111.31 3dl5 n ASN 41 Ca 0.00 -0.77 -0.43 0.00 1.68 0.00 0.00 54.58 55.06 3dl5 n ASN 41 Cb 0.65 0.56 -0.03 0.00 -1.54 0.00 0.00 39.78 39.42 3dl5 n ASN 41 CO 0.00 0.00 0.00 -3.20 0.28 0.00 0.00 177.26 174.34 3dl5 n ASN 42 N -1.23 3.62 -3.46 6.41 5.15 -0.95 -4.93 115.26 119.87 3dl5 n ASN 42 Ca 0.06 0.54 -0.11 0.00 -0.60 0.00 0.00 54.58 54.47 3dl5 n ASN 42 Cb 0.35 -1.53 -0.02 0.00 -0.53 0.00 0.00 39.78 38.05 3dl5 n ASN 42 CO 0.00 0.00 0.00 -1.59 1.40 0.00 0.00 177.26 177.07 3dl5 s LYS 43 N 5.46 1.09 0.00 1.20 -2.85 -1.26 -4.95 119.74 118.43 3dl5 s LYS 43 Ca 0.96 -0.35 0.09 0.00 -1.00 0.00 0.00 55.97 55.67 3dl5 s LYS 43 Cb -0.41 0.50 0.05 0.00 -2.06 0.00 0.00 37.83 35.91 3dl5 s LYS 43 CO 0.39 -0.47 0.72 0.00 0.10 0.00 0.00 175.35 176.09 3dl5 s ASP 45 N -0.86 5.62 0.21 0.00 -1.08 -1.26 -4.97 116.67 114.34 3dl5 s ASP 45 Ca 0.09 -1.23 -0.10 0.00 -0.52 0.00 0.00 52.55 50.80 3dl5 s ASP 45 Cb 0.07 -1.98 0.30 0.00 -1.46 0.00 0.00 42.92 39.85 3dl5 s ASP 45 CO 0.14 -0.44 1.70 0.28 0.52 0.00 0.00 175.17 177.37 3dl5 h SER 46 N 8.39 -0.01 0.36 -0.34 0.02 -2.02 -0.60 113.55 119.35 3dl5 h SER 46 Ca -0.24 0.11 0.00 0.00 -0.84 0.00 0.00 61.79 60.83 3dl5 h SER 46 Cb 1.09 0.16 0.00 0.00 0.14 0.00 0.00 62.40 63.79 3dl5 h SER 46 CO 0.69 0.00 0.00 0.59 -1.14 0.00 0.00 176.83 176.98 3dl5 n ASN 47 N -5.13 0.00 -4.81 3.07 3.02 -1.26 -4.77 115.26 105.37 3dl5 n ASN 47 Ca 0.09 0.32 -0.23 0.00 -0.03 0.00 0.00 54.58 54.73 3dl5 n ASN 47 Cb 0.33 -0.40 -0.05 0.00 -0.61 0.00 0.00 39.78 39.04 3dl5 n ASN 47 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 3dl5 s LYS 48 N -2.81 2.38 0.11 3.52 1.02 -0.23 -4.91 119.74 118.83 3dl5 s LYS 48 Ca 0.09 -1.69 -0.01 0.00 0.02 0.00 0.00 55.97 54.38 3dl5 s LYS 48 Cb 0.09 -2.19 -0.04 0.00 -0.52 0.00 0.00 37.83 35.17 3dl5 s LYS 48 CO 0.22 -0.17 0.02 0.15 -0.92 0.00 0.00 175.35 174.65 3dl5 s LYS 49 N -4.03 0.85 0.20 1.68 1.02 0.12 -4.88 119.74 114.70 3dl5 s LYS 49 Ca 0.44 -1.38 0.03 0.00 0.02 0.00 0.00 55.97 55.08 3dl5 s LYS 49 Cb 0.00 0.16 -0.03 0.00 -0.52 0.00 0.00 37.83 37.43 3dl5 s LYS 49 CO 0.25 -0.19 0.35 -0.80 -0.92 0.00 0.00 175.35 174.04 3dl5 s ASN 50 N -3.03 6.34 -0.06 2.83 0.01 -1.26 -1.87 114.94 117.90 3dl5 s ASN 50 Ca 0.19 0.20 0.03 0.00 -0.71 0.00 0.00 52.86 52.57 3dl5 s ASN 50 Cb 0.07 -1.92 -0.02 0.00 0.41 0.00 0.00 41.25 39.79 3dl5 s ASN 50 CO -0.02 -0.03 -0.16 0.00 -1.51 0.00 0.00 177.10 175.39 3dl5 s ALA 51 N -1.88 2.59 -0.28 0.60 0.00 -0.86 -1.74 121.76 120.18 3dl5 s ALA 51 Ca 0.36 -0.97 0.03 0.00 0.00 0.00 0.00 51.96 51.37 3dl5 s ALA 51 Cb -0.10 -0.97 0.07 0.00 0.00 0.00 0.00 23.12 22.12 3dl5 s ALA 51 CO 0.29 0.48 -0.05 -0.51 0.00 0.00 0.00 175.76 175.98 3dl5 s LEU 52 N -0.46 3.71 0.24 0.00 1.43 -1.13 -1.54 118.68 120.93 3dl5 s LEU 52 Ca 0.06 -1.61 -0.28 0.00 -1.03 0.00 0.00 54.13 51.26 3dl5 s LEU 52 Cb -0.12 -1.51 -0.09 0.00 0.03 0.00 0.00 46.19 44.50 3dl5 s LEU 52 CO 0.02 -0.26 0.91 -0.63 0.23 0.00 0.00 176.35 176.62 3dl5 s ILE 53 N 1.09 4.15 -0.04 -0.59 1.01 -0.20 -1.04 121.20 125.58 3dl5 s ILE 53 Ca -0.02 1.97 -0.30 0.00 0.00 0.00 0.00 60.65 62.30 3dl5 s ILE 53 Cb -0.19 -4.23 0.07 0.00 0.01 0.00 0.00 42.46 38.11 3dl5 s ILE 53 CO -0.07 0.43 0.66 0.00 0.00 0.00 0.00 174.94 175.96 3dl5 s MET 54 N -1.36 1.05 0.96 2.79 0.23 -0.52 -0.61 119.30 121.84 3dl5 s MET 54 Ca 0.42 0.21 -0.12 0.00 -1.03 0.00 0.00 55.69 55.17 3dl5 s MET 54 Cb -0.24 0.49 0.17 0.00 -1.53 0.00 0.00 34.83 33.72 3dl5 s MET 54 CO 0.29 -0.33 1.09 0.20 -2.03 0.00 0.00 175.02 174.24 3dl5 s GLY 55 N -1.25 1.60 0.09 3.16 0.00 0.37 -2.15 107.32 109.15 3dl5 s GLY 55 Ca -0.11 -0.04 -0.21 0.00 0.00 0.00 0.00 44.72 44.36 3dl5 s GLY 55 CO 0.09 0.50 1.64 -0.09 0.00 0.00 0.00 173.10 175.24 3dl5 h ARG 56 N -1.84 0.24 -0.55 2.90 2.43 -1.86 -2.48 114.38 113.23 3dl5 h ARG 56 Ca -0.52 -0.04 0.07 0.00 -0.81 0.00 0.00 59.98 58.69 3dl5 h ARG 56 Cb 1.30 -0.04 -0.03 0.00 -0.42 0.00 0.00 29.97 30.77 3dl5 h ARG 56 CO 0.53 0.30 0.37 0.87 -1.51 0.00 0.00 179.97 180.52 3dl5 h LYS 57 N 0.12 0.43 -0.19 0.20 1.57 -1.92 0.12 116.57 116.90 3dl5 h LYS 57 Ca 0.05 -0.03 -0.14 0.00 -1.87 0.00 0.00 60.65 58.67 3dl5 h LYS 57 Cb 0.15 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.35 3dl5 h LYS 57 CO -0.01 0.28 -0.48 1.15 -0.57 0.00 0.00 179.45 179.83 3dl5 h THR 58 N 0.44 1.32 -0.66 -0.16 2.02 -1.84 -1.61 112.91 112.43 3dl5 h THR 58 Ca 0.24 -1.69 -0.02 0.00 0.77 0.00 0.00 66.41 65.72 3dl5 h THR 58 Cb 0.39 1.69 -0.03 0.00 -1.74 0.00 0.00 68.15 68.45 3dl5 h THR 58 CO -0.07 0.52 0.32 -0.25 0.37 0.00 0.00 175.52 176.42 3dl5 h TRP 59 N 0.39 0.92 -0.45 3.16 -0.00 -0.37 0.04 115.95 119.64 3dl5 h TRP 59 Ca 0.02 -0.03 -0.11 0.00 -0.00 0.00 0.00 58.89 58.77 3dl5 h TRP 59 Cb 0.98 -0.29 -0.02 0.00 -0.00 0.00 0.00 29.16 29.83 3dl5 h TRP 59 CO 0.04 0.66 -0.16 -0.44 -0.00 0.00 0.00 178.44 178.54 3dl5 h ASP 60 N 0.92 0.86 -0.25 2.65 3.32 -0.47 -2.19 116.42 121.26 3dl5 h ASP 60 Ca 0.23 -0.29 -0.12 0.00 0.02 0.00 0.00 57.03 56.87 3dl5 h ASP 60 Cb 0.08 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.39 3dl5 h ASP 60 CO -0.03 1.01 -0.25 0.28 -1.72 0.00 0.00 179.24 178.53 3dl5 h SER 61 N 0.75 0.75 0.41 6.45 0.02 -0.37 -2.26 113.55 119.32 3dl5 h SER 61 Ca 0.11 -0.28 0.00 0.00 -0.84 0.00 0.00 61.79 60.78 3dl5 h SER 61 Cb 0.68 -0.21 0.00 0.00 0.14 0.00 0.00 62.40 63.01 3dl5 h SER 61 CO 0.05 0.98 0.00 0.00 -1.14 0.00 0.00 176.83 176.72 3dl5 n ILE 62 N -4.10 0.93 -0.85 3.27 3.06 -0.09 -4.85 119.36 116.73 3dl5 n ILE 62 Ca -0.00 0.23 0.00 0.00 -2.50 0.00 0.00 62.75 60.48 3dl5 n ILE 62 Cb 0.45 -1.00 0.00 0.00 0.54 0.00 0.00 39.64 39.63 3dl5 n ILE 62 CO 0.00 0.00 0.00 0.61 -2.50 0.00 0.00 176.55 174.66 3dl5 n GLY 63 N -0.09 0.52 2.45 4.50 0.00 -0.85 -4.13 105.19 107.59 3dl5 n GLY 63 Ca 0.04 -0.50 -0.18 0.00 0.00 0.00 0.00 46.02 45.38 3dl5 n GLY 63 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3dl5 n ARG 64 N -2.85 -2.01 -4.33 1.61 1.74 -0.84 -4.96 116.66 105.03 3dl5 n ARG 64 Ca 0.00 0.86 -0.31 0.00 -0.77 0.00 0.00 57.85 57.63 3dl5 n ARG 64 Cb 0.00 -5.52 -0.10 0.00 -1.02 0.00 0.00 32.46 25.83 3dl5 n ARG 64 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 3dl5 s ARG 65 N -5.08 2.42 0.89 5.56 1.81 -1.26 -5.11 118.95 118.19 3dl5 s ARG 65 Ca 0.02 -0.83 -0.11 0.00 -1.72 0.00 0.00 55.73 53.08 3dl5 s ARG 65 Cb -0.01 -2.45 0.13 0.00 -0.45 0.00 0.00 34.95 32.17 3dl5 s ARG 65 CO 0.02 0.56 1.09 -1.25 -0.68 0.00 0.00 175.30 175.04 3dl5 s PRO 66 N -1.82 1.27 -0.22 3.54 0.04 -1.26 -5.03 135.00 131.52 3dl5 s PRO 66 Ca 0.20 0.90 -0.06 0.00 0.04 0.00 0.00 61.00 62.09 3dl5 s PRO 66 Cb -0.11 -1.80 -0.03 0.00 0.04 0.00 0.00 34.50 32.60 3dl5 s PRO 66 CO 0.11 -2.25 0.02 -0.51 0.04 0.00 0.00 177.00 174.41 3dl5 s LEU 67 N -6.25 3.31 0.23 -3.56 1.43 -1.26 -5.07 118.68 107.52 3dl5 s LEU 67 Ca 0.64 -0.21 -0.30 0.00 -1.03 0.00 0.00 54.13 53.23 3dl5 s LEU 67 Cb -0.18 -1.86 -0.15 0.00 0.03 0.00 0.00 46.19 44.03 3dl5 s LEU 67 CO 0.57 0.03 1.02 1.17 0.23 0.00 0.00 176.35 179.38 3dl5 n LYS 68 N 4.48 1.14 -1.02 1.70 4.81 -1.26 -2.12 118.16 125.89 3dl5 n LYS 68 Ca -0.17 0.40 -0.01 0.00 -0.87 0.00 0.00 58.31 57.67 3dl5 n LYS 68 Cb 0.52 -1.79 -0.00 0.00 0.02 0.00 0.00 35.03 33.77 3dl5 n LYS 68 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 3dl5 n ASN 69 N 1.62 -5.29 -4.35 3.14 5.03 -1.26 -4.96 115.26 109.18 3dl5 n ASN 69 Ca 0.13 0.02 -0.18 0.00 0.87 0.00 0.00 54.58 55.41 3dl5 n ASN 69 Cb 0.28 -2.85 -0.10 0.00 -1.02 0.00 0.00 39.78 36.09 3dl5 n ASN 69 CO 0.00 0.00 0.00 -0.13 -1.83 0.00 0.00 177.26 175.30 3dl5 s ARG 70 N -1.62 1.43 -0.44 3.52 0.52 -0.90 -4.35 118.95 117.11 3dl5 s ARG 70 Ca 0.00 -1.76 0.03 0.00 -0.52 0.00 0.00 55.73 53.48 3dl5 s ARG 70 Cb 0.00 -0.56 0.12 0.00 0.52 0.00 0.00 34.95 35.03 3dl5 s ARG 70 CO 0.00 -0.18 0.19 0.42 0.02 0.00 0.00 175.30 175.75 3dl5 s ILE 71 N -3.50 2.08 0.73 1.52 1.01 -0.71 -4.68 121.20 117.65 3dl5 s ILE 71 Ca 0.33 -2.75 -0.16 0.00 0.00 0.00 0.00 60.65 58.08 3dl5 s ILE 71 Cb 0.07 -2.48 0.01 0.00 0.01 0.00 0.00 42.46 40.07 3dl5 s ILE 71 CO 0.12 -0.77 0.93 -0.38 0.00 0.00 0.00 174.94 174.84 3dl5 n ILE 72 N 3.62 2.63 -3.60 2.92 5.41 -1.07 -2.83 119.36 126.44 3dl5 n ILE 72 Ca 0.05 -0.36 -0.26 0.00 1.00 0.00 0.00 62.75 63.18 3dl5 n ILE 72 Cb 0.36 -1.06 -0.17 0.00 -0.71 0.00 0.00 39.64 38.06 3dl5 n ILE 72 CO 0.00 0.00 0.00 -0.69 0.00 0.00 0.00 176.55 175.86 3dl5 s VAL 73 N -1.85 -0.10 -0.02 1.39 1.01 -0.21 -2.65 120.40 117.97 3dl5 s VAL 73 Ca 0.72 -0.21 -0.11 0.00 0.00 0.00 0.00 61.98 62.39 3dl5 s VAL 73 Cb -0.34 -0.61 -0.05 0.00 0.00 0.00 0.00 36.38 35.38 3dl5 s VAL 73 CO 0.51 -0.32 0.31 -0.69 0.00 0.00 0.00 175.10 174.92 3dl5 s VAL 74 N 2.15 5.21 -0.29 2.92 1.01 -0.06 -1.43 120.40 129.90 3dl5 s VAL 74 Ca 0.03 0.50 -0.08 0.00 0.00 0.00 0.00 61.98 62.43 3dl5 s VAL 74 Cb -0.16 -3.59 -0.01 0.00 0.00 0.00 0.00 36.38 32.62 3dl5 s VAL 74 CO -0.12 0.51 0.12 -0.63 0.00 0.00 0.00 175.10 174.98 3dl5 s ILE 75 N -1.15 4.38 -0.03 2.22 1.09 -0.91 -1.11 121.20 125.68 3dl5 s ILE 75 Ca 0.23 -0.44 -0.20 0.00 -1.10 0.00 0.00 60.65 59.13 3dl5 s ILE 75 Cb -0.14 -3.20 0.04 0.00 -1.06 0.00 0.00 42.46 38.09 3dl5 s ILE 75 CO 0.12 0.12 0.45 -0.55 -0.10 0.00 0.00 174.94 174.98 3dl5 s SER 76 N 1.58 -0.37 0.02 3.58 0.15 -0.71 -2.76 113.70 115.20 3dl5 s SER 76 Ca 0.04 0.35 -0.17 0.00 0.70 0.00 0.00 55.95 56.87 3dl5 s SER 76 Cb -0.17 0.42 -0.31 0.00 -1.71 0.00 0.00 66.02 64.26 3dl5 s SER 76 CO 0.05 -0.49 1.03 0.28 1.20 0.00 0.00 173.24 175.31 3dl5 h SER 77 N 3.64 0.76 -4.08 5.45 0.02 -1.84 -3.36 113.55 114.14 3dl5 h SER 77 Ca -0.29 -0.87 -0.65 0.00 -0.84 0.00 0.00 61.79 59.15 3dl5 h SER 77 Cb 1.16 -0.24 -0.41 0.00 0.14 0.00 0.00 62.40 63.06 3dl5 h SER 77 CO 0.39 1.55 -0.67 -0.94 -1.14 0.00 0.00 176.83 176.02 3dl5 s SER 78 N -7.30 4.46 -0.10 3.07 1.04 -1.26 -4.98 113.70 108.63 3dl5 s SER 78 Ca -0.11 -2.67 -0.30 0.00 0.48 0.00 0.00 55.95 53.36 3dl5 s SER 78 Cb 0.04 -1.61 0.08 0.00 0.10 0.00 0.00 66.02 64.63 3dl5 s SER 78 CO 0.91 -0.29 0.73 -0.22 0.98 0.00 0.00 173.24 175.34 3dl5 s LEU 79 N 0.19 -0.64 0.49 2.42 0.20 -1.26 -5.17 118.68 114.92 3dl5 s LEU 79 Ca 0.15 0.80 -0.23 0.00 0.69 0.00 0.00 54.13 55.54 3dl5 s LEU 79 Cb -0.23 2.44 -0.06 0.00 -0.43 0.00 0.00 46.19 47.91 3dl5 s LEU 79 CO -0.03 -0.51 1.31 -2.16 -0.29 0.00 0.00 176.35 174.66 3dl5 s PRO 80 N -0.90 3.49 -0.27 0.98 0.04 -1.26 -4.95 135.00 132.12 3dl5 s PRO 80 Ca -0.08 2.13 0.11 0.00 0.04 0.00 0.00 61.00 63.20 3dl5 s PRO 80 Cb -0.01 -2.42 0.73 0.00 0.04 0.00 0.00 34.50 32.84 3dl5 s PRO 80 CO 0.07 -0.88 1.72 1.04 0.04 0.00 0.00 177.00 178.99 3dl5 n GLN 81 N -0.61 4.03 -1.16 4.56 3.00 -1.26 -4.74 117.38 121.20 3dl5 n GLN 81 Ca 0.08 -2.92 -0.30 0.00 -0.01 0.00 0.00 57.00 53.85 3dl5 n GLN 81 Cb 0.45 -2.19 0.12 0.00 0.00 0.00 0.00 30.24 28.62 3dl5 n GLN 81 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.06 177.22 3dl5 s ASP 82 N -0.83 3.86 -0.42 1.08 -4.77 -1.26 -4.96 116.67 109.37 3dl5 s ASP 82 Ca 0.52 1.74 0.05 0.00 -3.30 0.00 0.00 52.55 51.55 3dl5 s ASP 82 Cb 0.40 -2.40 0.66 0.00 -1.09 0.00 0.00 42.92 40.50 3dl5 s ASP 82 CO 0.14 -2.43 1.87 -0.62 0.70 0.00 0.00 175.17 174.83 3dl5 n GLU 83 N -3.77 2.37 -0.32 2.11 4.71 -1.26 -4.55 120.64 119.92 3dl5 n GLU 83 Ca 0.08 -3.03 0.15 0.00 -0.01 0.00 0.00 57.16 54.35 3dl5 n GLU 83 Cb 0.54 -2.15 0.34 0.00 -1.01 0.00 0.00 31.44 29.16 3dl5 n GLU 83 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 3dl5 h ALA 84 N 1.17 1.55 -3.16 0.62 0.00 -1.93 -3.32 119.26 114.19 3dl5 h ALA 84 Ca 0.57 0.17 -0.60 0.00 0.00 0.00 0.00 54.91 55.05 3dl5 h ALA 84 Cb 2.72 0.15 -0.36 0.00 0.00 0.00 0.00 17.79 20.30 3dl5 h ALA 84 CO 1.01 -0.38 -0.83 0.34 0.00 0.00 0.00 179.25 179.40 3dl5 s ASP 85 N -5.13 2.72 0.44 0.00 3.68 -1.26 -5.01 116.67 112.11 3dl5 s ASP 85 Ca -0.11 -0.52 0.22 0.00 2.13 0.00 0.00 52.55 54.27 3dl5 s ASP 85 Cb 0.26 -1.15 1.01 0.00 -1.45 0.00 0.00 42.92 41.60 3dl5 s ASP 85 CO 0.78 -0.08 1.89 1.55 0.13 0.00 0.00 175.17 179.45 3dl5 h PRO 86 N 8.06 0.00 -0.90 4.34 0.13 -1.93 -3.07 132.00 138.63 3dl5 h PRO 86 Ca -0.36 0.00 -0.13 0.00 -0.87 0.00 0.00 66.00 64.64 3dl5 h PRO 86 Cb 1.13 0.00 -0.08 0.00 0.13 0.00 0.00 31.00 32.18 3dl5 h PRO 86 CO 0.51 0.25 0.16 0.09 -0.23 0.00 0.00 178.00 178.78 3dl5 n ASN 87 N -3.65 3.34 -3.67 1.44 3.02 -1.26 -4.77 115.26 109.71 3dl5 n ASN 87 Ca -0.01 -2.62 -0.08 0.00 -0.03 0.00 0.00 54.58 51.84 3dl5 n ASN 87 Cb 0.38 -0.63 -0.08 0.00 -0.61 0.00 0.00 39.78 38.83 3dl5 n ASN 87 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 3dl5 s VAL 88 N -1.73 -0.29 0.18 2.41 1.01 -1.16 -2.61 120.40 118.21 3dl5 s VAL 88 Ca 0.27 0.07 0.05 0.00 0.00 0.00 0.00 61.98 62.37 3dl5 s VAL 88 Cb 0.22 -0.79 -0.05 0.00 0.00 0.00 0.00 36.38 35.76 3dl5 s VAL 88 CO 0.07 0.03 -0.09 -0.69 0.00 0.00 0.00 175.10 174.41 3dl5 s VAL 89 N 1.94 1.27 0.05 2.92 1.01 -1.08 -4.78 120.40 121.73 3dl5 s VAL 89 Ca -0.07 -2.09 0.05 0.00 0.00 0.00 0.00 61.98 59.87 3dl5 s VAL 89 Cb -0.09 -1.99 -0.03 0.00 0.00 0.00 0.00 36.38 34.28 3dl5 s VAL 89 CO -0.16 -0.63 -0.15 -0.69 0.00 0.00 0.00 175.10 173.48 3dl5 s VAL 90 N -3.27 1.15 0.06 2.92 1.01 -1.26 -0.88 120.40 120.14 3dl5 s VAL 90 Ca 0.20 -1.15 0.03 0.00 0.00 0.00 0.00 61.98 61.06 3dl5 s VAL 90 Cb 0.03 -1.07 -0.03 0.00 0.00 0.00 0.00 36.38 35.31 3dl5 s VAL 90 CO 0.03 -0.08 -0.09 -0.36 0.00 0.00 0.00 175.10 174.60 3dl5 s PHE 91 N -1.03 0.84 -0.27 5.22 0.08 -0.27 -4.95 117.98 117.60 3dl5 s PHE 91 Ca 0.01 -0.58 0.21 0.00 0.12 0.00 0.00 56.93 56.68 3dl5 s PHE 91 Cb -0.09 -0.49 0.34 0.00 -0.57 0.00 0.00 43.02 42.22 3dl5 s PHE 91 CO 0.02 -0.06 1.59 0.00 -0.10 0.00 0.00 175.22 176.67 3dl5 h ARG 92 N 4.09 0.00 -3.56 0.44 2.47 -1.87 -1.88 114.38 114.07 3dl5 h ARG 92 Ca -0.37 0.00 -0.06 0.00 -1.26 0.00 0.00 59.98 58.29 3dl5 h ARG 92 Cb 1.19 0.00 -0.12 0.00 -1.65 0.00 0.00 29.97 29.39 3dl5 h ARG 92 CO 0.46 0.19 -0.16 0.54 0.56 0.00 0.00 179.97 181.56 3dl5 s ASN 93 N -6.26 -0.11 0.15 7.04 2.20 -1.26 -4.61 114.94 112.08 3dl5 s ASN 93 Ca 0.05 -0.53 -0.08 0.00 -0.94 0.00 0.00 52.86 51.35 3dl5 s ASN 93 Cb 0.06 0.46 -0.02 0.00 -2.00 0.00 0.00 41.25 39.76 3dl5 s ASN 93 CO 0.69 -0.88 1.44 0.25 -2.94 0.00 0.00 177.10 175.66 3dl5 h LEU 94 N 2.44 0.85 -0.24 3.54 5.85 -1.99 -1.97 115.31 123.79 3dl5 h LEU 94 Ca -0.32 -0.46 0.05 0.00 0.84 0.00 0.00 57.88 57.99 3dl5 h LEU 94 Cb 1.24 -0.24 -0.07 0.00 0.37 0.00 0.00 40.66 41.95 3dl5 h LEU 94 CO 0.47 1.23 -0.46 -0.08 -0.34 0.00 0.00 178.44 179.26 3dl5 h GLU 95 N 0.59 -0.44 -0.68 1.25 4.57 -1.97 -1.03 114.58 116.87 3dl5 h GLU 95 Ca 0.01 0.03 -0.02 0.00 -1.18 0.00 0.00 59.36 58.20 3dl5 h GLU 95 Cb 1.14 0.10 -0.03 0.00 -0.16 0.00 0.00 28.75 29.79 3dl5 h GLU 95 CO 0.12 -0.29 0.34 -0.44 -1.18 0.00 0.00 179.01 177.56 3dl5 h ASP 96 N -0.45 0.85 -1.00 1.04 3.32 -1.99 -2.68 116.42 115.51 3dl5 h ASP 96 Ca 0.09 -0.08 0.20 0.00 0.02 0.00 0.00 57.03 57.25 3dl5 h ASP 96 Cb 0.62 -0.22 -0.11 0.00 0.22 0.00 0.00 39.33 39.85 3dl5 h ASP 96 CO -0.48 0.71 0.60 0.77 -1.72 0.00 0.00 179.24 179.13 3dl5 h SER 97 N 0.95 0.76 -4.12 6.45 4.64 -0.40 -3.38 113.55 118.46 3dl5 h SER 97 Ca 0.24 0.10 -0.52 0.00 -0.47 0.00 0.00 61.79 61.14 3dl5 h SER 97 Cb 0.07 -0.03 0.10 0.00 -0.31 0.00 0.00 62.40 62.23 3dl5 h SER 97 CO -0.03 0.25 0.43 -0.63 -0.87 0.00 0.00 176.83 175.98 3dl5 s ILE 98 N -5.85 2.88 0.00 0.95 -1.09 -0.89 -3.96 121.20 113.24 3dl5 s ILE 98 Ca -0.11 0.51 0.00 0.00 -2.23 0.00 0.00 60.65 58.82 3dl5 s ILE 98 Cb 0.25 -3.14 0.00 0.00 -1.58 0.00 0.00 42.46 37.99 3dl5 s ILE 98 CO 0.80 -0.16 0.00 -1.84 -1.23 0.00 0.00 174.94 172.51 3dl5 n GLU 99 N -1.76 0.00 0.14 2.79 -0.00 -1.26 -4.93 120.64 115.62 3dl5 n GLU 99 Ca 0.12 0.00 0.14 0.00 -0.00 0.00 0.00 57.16 57.42 3dl5 n GLU 99 Cb 0.51 0.00 0.67 0.00 -0.00 0.00 0.00 31.44 32.61 3dl5 n GLU 99 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.13 176.22 3dl5 h ASN 100 N 0.00 0.00 0.65 -1.84 4.21 -1.83 -1.83 115.58 114.94 3dl5 h ASN 100 Ca 0.00 0.00 -0.03 0.00 1.21 0.00 0.00 56.30 57.48 3dl5 h ASN 100 Cb 0.00 0.00 0.01 0.00 -1.12 0.00 0.00 38.32 37.21 3dl5 h ASN 100 CO 0.00 0.00 -0.31 -0.07 -1.29 0.00 0.00 177.43 175.76 3dl5 h LEU 101 N 0.00 -0.74 -1.09 1.61 3.38 -1.91 -3.28 115.31 113.28 3dl5 h LEU 101 Ca 0.11 0.03 0.35 0.00 0.09 0.00 0.00 57.88 58.46 3dl5 h LEU 101 Cb 0.46 0.19 -0.15 0.00 0.09 0.00 0.00 40.66 41.25 3dl5 h LEU 101 CO -0.00 -0.40 0.62 0.24 0.09 0.00 0.00 178.44 178.99 3dl5 h MET 102 N -1.12 0.25 0.00 1.13 2.86 -1.91 -3.42 114.93 112.72 3dl5 h MET 102 Ca -0.09 -0.01 -0.30 0.00 -2.06 0.00 0.00 59.70 57.23 3dl5 h MET 102 Cb 0.67 -0.06 -0.06 0.00 0.06 0.00 0.00 31.60 32.21 3dl5 h MET 102 CO 0.15 0.16 -0.23 0.27 1.06 0.00 0.00 176.91 178.32 3dl5 n ASN 103 N -4.99 2.09 -2.88 1.22 0.23 -0.70 -4.98 115.26 105.25 3dl5 n ASN 103 Ca 0.33 -2.08 -0.10 0.00 -0.53 0.00 0.00 54.58 52.21 3dl5 n ASN 103 Cb 1.08 0.30 0.04 0.00 -2.08 0.00 0.00 39.78 39.12 3dl5 n ASN 103 CO 0.00 0.00 0.00 0.47 -0.93 0.00 0.00 177.26 176.80 3dl5 n ASP 104 N -1.39 -5.96 0.00 0.53 9.92 -1.26 -4.66 116.55 113.73 3dl5 n ASP 104 Ca -0.08 -0.47 0.01 0.00 -0.53 0.00 0.00 54.79 53.72 3dl5 n ASP 104 Cb 0.31 -4.35 0.03 0.00 -0.64 0.00 0.00 41.12 36.47 3dl5 n ASP 104 CO 0.00 0.00 0.00 0.47 0.13 0.00 0.00 177.20 177.80 3dl5 n ASP 105 N -2.63 0.00 0.08 -2.24 10.43 -1.26 0.13 116.55 121.06 3dl5 n ASP 105 Ca -0.04 -0.06 0.12 0.00 2.57 0.00 0.00 54.79 57.38 3dl5 n ASP 105 Cb 0.58 0.00 0.09 0.00 1.84 0.00 0.00 41.12 43.62 3dl5 n ASP 105 CO 0.00 0.00 0.00 0.77 -1.07 0.00 0.00 177.20 176.90 3dl5 h SER 106 N 0.00 0.00 -3.88 -2.24 4.64 -1.91 -3.45 113.55 106.72 3dl5 h SER 106 Ca 0.00 -0.14 -0.64 0.00 -0.47 0.00 0.00 61.79 60.54 3dl5 h SER 106 Cb 0.00 0.00 -0.17 0.00 -0.31 0.00 0.00 62.40 61.92 3dl5 h SER 106 CO 0.00 0.07 -0.50 -0.63 -0.87 0.00 0.00 176.83 174.90 3dl5 s ILE 107 N -3.25 5.30 -0.19 0.95 1.01 0.35 0.14 121.20 125.51 3dl5 s ILE 107 Ca 0.03 0.17 -0.23 0.00 0.00 0.00 0.00 60.65 60.62 3dl5 s ILE 107 Cb 0.12 -3.55 -0.21 0.00 0.01 0.00 0.00 42.46 38.83 3dl5 s ILE 107 CO 0.76 0.23 0.37 -0.08 0.00 0.00 0.00 174.94 176.21 3dl5 h GLU 108 N 8.37 0.00 -4.64 2.79 4.81 -1.65 -3.48 114.58 120.78 3dl5 h GLU 108 Ca -0.35 0.00 -0.25 0.00 -0.13 0.00 0.00 59.36 58.63 3dl5 h GLU 108 Cb 1.19 0.00 -0.18 0.00 0.63 0.00 0.00 28.75 30.39 3dl5 h GLU 108 CO 0.56 0.98 -0.72 -0.80 -0.73 0.00 0.00 179.01 178.31 3dl5 s ASN 109 N -6.65 1.05 0.01 1.04 0.01 -1.26 -4.44 114.94 104.69 3dl5 s ASN 109 Ca -0.26 -0.80 0.06 0.00 -0.71 0.00 0.00 52.86 51.15 3dl5 s ASN 109 Cb 0.03 0.06 -0.03 0.00 0.41 0.00 0.00 41.25 41.73 3dl5 s ASN 109 CO 0.61 -0.34 -0.19 -0.63 -1.51 0.00 0.00 177.10 175.04 3dl5 s ILE 110 N -2.61 2.73 -0.02 0.60 1.01 0.20 -2.03 121.20 121.08 3dl5 s ILE 110 Ca 0.02 -1.07 0.02 0.00 0.00 0.00 0.00 60.65 59.63 3dl5 s ILE 110 Cb -0.02 -2.10 0.00 0.00 0.01 0.00 0.00 42.46 40.36 3dl5 s ILE 110 CO -0.02 0.44 -0.08 -0.36 0.00 0.00 0.00 174.94 174.91 3dl5 s PHE 111 N -0.83 0.84 -0.51 3.97 0.08 -0.59 -1.42 117.98 119.53 3dl5 s PHE 111 Ca 0.13 -0.19 -0.15 0.00 0.12 0.00 0.00 56.93 56.84 3dl5 s PHE 111 Cb -0.10 -0.59 0.11 0.00 -0.57 0.00 0.00 43.02 41.87 3dl5 s PHE 111 CO 0.03 -0.07 0.45 0.08 -0.10 0.00 0.00 175.22 175.61 3dl5 s VAL 112 N 0.10 5.07 -2.30 -0.44 1.01 -0.56 -1.03 120.40 122.25 3dl5 s VAL 112 Ca -0.01 -1.43 0.22 0.00 0.00 0.00 0.00 61.98 60.75 3dl5 s VAL 112 Cb -0.07 -4.20 0.47 0.00 0.00 0.00 0.00 36.38 32.58 3dl5 s VAL 112 CO 0.00 -0.78 1.57 0.00 0.00 0.00 0.00 175.10 175.89 3dl5 n GLY 114 N 1.13 0.43 0.00 0.00 0.00 -1.16 -4.89 105.19 100.70 3dl5 n GLY 114 Ca 0.16 -0.84 0.00 0.00 0.00 0.00 0.00 46.02 45.34 3dl5 n GLY 114 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dl5 n GLY 115 N 0.00 -1.54 0.29 -0.02 0.00 -1.26 -0.48 105.19 102.18 3dl5 n GLY 115 Ca 0.00 -1.14 -0.04 0.00 0.00 0.00 0.00 46.02 44.84 3dl5 n GLY 115 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3dl5 h GLU 116 N 0.00 -0.12 -0.68 1.61 4.81 -1.97 0.19 114.58 118.42 3dl5 h GLU 116 Ca 0.00 0.01 0.08 0.00 -0.13 0.00 0.00 59.36 59.32 3dl5 h GLU 116 Cb 0.00 0.03 -0.07 0.00 0.63 0.00 0.00 28.75 29.34 3dl5 h GLU 116 CO 0.00 -0.08 0.34 0.66 -0.73 0.00 0.00 179.01 179.20 3dl5 h SER 117 N -0.13 0.46 -0.08 1.04 4.64 -1.92 -0.42 113.55 117.14 3dl5 h SER 117 Ca 0.23 0.05 -0.11 0.00 -0.47 0.00 0.00 61.79 61.50 3dl5 h SER 117 Cb 0.50 -0.03 -0.01 0.00 -0.31 0.00 0.00 62.40 62.55 3dl5 h SER 117 CO -0.59 0.28 -0.29 0.40 -0.87 0.00 0.00 176.83 175.75 3dl5 h ILE 118 N 0.60 1.28 0.18 0.95 1.08 -0.99 -2.80 117.51 117.81 3dl5 h ILE 118 Ca 0.32 -1.36 -0.01 0.00 -0.39 0.00 0.00 64.86 63.42 3dl5 h ILE 118 Cb 0.30 1.39 0.00 0.00 -3.07 0.00 0.00 36.82 35.45 3dl5 h ILE 118 CO -0.24 0.43 -0.09 1.88 -0.69 0.00 0.00 178.15 179.45 3dl5 h TYR 119 N 0.47 -0.23 0.00 1.37 0.05 -0.28 -1.39 116.97 116.96 3dl5 h TYR 119 Ca 0.06 -0.01 0.00 0.00 0.05 0.00 0.00 58.73 58.84 3dl5 h TYR 119 Cb 0.74 0.08 0.00 0.00 1.01 0.00 0.00 36.73 38.56 3dl5 h TYR 119 CO 0.03 0.13 0.14 -2.13 -1.05 0.00 0.00 178.16 175.27 3dl5 n ARG 120 N -5.03 0.09 -0.09 4.88 0.63 -0.24 -1.31 116.66 115.60 3dl5 n ARG 120 Ca -0.09 0.56 -0.11 0.00 -0.92 0.00 0.00 57.85 57.30 3dl5 n ARG 120 Cb 0.24 -1.94 -0.10 0.00 0.45 0.00 0.00 32.46 31.11 3dl5 n ARG 120 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 3dl5 n ASP 121 N -2.00 1.88 -0.02 6.15 10.43 -1.06 -3.16 116.55 128.77 3dl5 n ASP 121 Ca -0.01 -0.06 -0.00 0.00 2.57 0.00 0.00 54.79 57.29 3dl5 n ASP 121 Cb 0.16 0.25 0.29 0.00 1.84 0.00 0.00 41.12 43.66 3dl5 n ASP 121 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 3dl5 h ALA 122 N 0.36 1.37 0.17 2.24 0.00 -0.28 -1.83 119.26 121.28 3dl5 h ALA 122 Ca -0.43 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.28 3dl5 h ALA 122 Cb 1.81 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 19.44 3dl5 h ALA 122 CO -0.03 0.44 -0.08 -0.07 0.00 0.00 0.00 179.25 179.51 3dl5 h LEU 123 N 0.55 -0.19 -1.14 0.00 4.07 -1.40 -1.33 115.31 115.88 3dl5 h LEU 123 Ca 0.12 -0.20 0.33 0.00 0.08 0.00 0.00 57.88 58.21 3dl5 h LEU 123 Cb 0.30 0.05 -0.14 0.00 1.08 0.00 0.00 40.66 41.95 3dl5 h LEU 123 CO 0.01 0.35 0.64 0.50 -1.08 0.00 0.00 178.44 178.86 3dl5 h LYS 124 N -1.00 0.29 -0.57 1.13 1.63 -1.49 -0.43 116.57 116.13 3dl5 h LYS 124 Ca -0.02 -0.02 0.00 0.00 -0.85 0.00 0.00 60.65 59.76 3dl5 h LYS 124 Cb 0.38 -0.07 0.00 0.00 -0.60 0.00 0.00 32.23 31.95 3dl5 h LYS 124 CO 0.04 0.19 0.00 -0.25 -3.45 0.00 0.00 179.45 175.98 3dl5 n ASP 125 N -4.91 3.20 -2.74 4.20 10.43 -0.70 -4.93 116.55 121.10 3dl5 n ASP 125 Ca 0.32 -2.12 -0.21 0.00 2.57 0.00 0.00 54.79 55.35 3dl5 n ASP 125 Cb 1.04 -0.41 0.01 0.00 1.84 0.00 0.00 41.12 43.60 3dl5 n ASP 125 CO 0.00 0.00 0.00 -3.20 -1.07 0.00 0.00 177.20 172.93 3dl5 n ASN 126 N 0.98 -5.56 0.10 -2.24 2.85 -0.17 -4.89 115.26 106.33 3dl5 n ASN 126 Ca 0.19 -0.13 -0.16 0.00 -0.11 0.00 0.00 54.58 54.37 3dl5 n ASN 126 Cb 0.55 -4.58 -0.12 0.00 1.24 0.00 0.00 39.78 36.87 3dl5 n ASN 126 CO 0.00 0.00 0.00 -0.26 -2.11 0.00 0.00 177.26 174.89 3dl5 h PHE 127 N -0.65 0.54 -3.57 1.20 0.05 -1.45 -3.46 116.94 109.59 3dl5 h PHE 127 Ca -0.48 -0.37 -0.52 0.00 3.82 0.00 0.00 57.97 60.42 3dl5 h PHE 127 Cb 1.34 -0.03 -0.03 0.00 2.00 0.00 0.00 35.95 39.24 3dl5 h PHE 127 CO 0.58 1.27 0.27 0.54 -0.18 0.00 0.00 178.31 180.79 3dl5 s VAL 128 N -2.76 4.40 -0.22 -0.55 0.11 -1.18 -4.74 120.40 115.47 3dl5 s VAL 128 Ca -0.04 1.89 -0.19 0.00 -2.93 0.00 0.00 61.98 60.71 3dl5 s VAL 128 Cb 0.07 -4.24 -0.18 0.00 -1.53 0.00 0.00 36.38 30.51 3dl5 s VAL 128 CO 0.88 0.43 0.08 0.47 -3.33 0.00 0.00 175.10 173.63 3dl5 n ASP 129 N 2.16 1.90 -4.62 3.54 10.43 0.99 -4.94 116.55 126.00 3dl5 n ASP 129 Ca -0.02 0.39 -0.28 0.00 2.57 0.00 0.00 54.79 57.45 3dl5 n ASP 129 Cb 0.49 -0.92 -0.11 0.00 1.84 0.00 0.00 41.12 42.42 3dl5 n ASP 129 CO 0.00 0.00 0.00 -0.60 -1.07 0.00 0.00 177.20 175.53 3dl5 s ARG 130 N -2.41 1.96 -0.16 -1.24 3.52 -1.24 -2.49 118.95 116.89 3dl5 s ARG 130 Ca -0.31 -2.11 -0.05 0.00 -0.13 0.00 0.00 55.73 53.13 3dl5 s ARG 130 Cb 0.08 -1.61 0.08 0.00 -1.56 0.00 0.00 34.95 31.94 3dl5 s ARG 130 CO 0.58 -0.07 0.27 0.42 -0.81 0.00 0.00 175.30 175.69 3dl5 s ILE 131 N -2.74 -0.43 -0.39 4.11 1.01 -0.68 -1.56 121.20 120.53 3dl5 s ILE 131 Ca 0.34 0.16 -0.16 0.00 0.00 0.00 0.00 60.65 61.00 3dl5 s ILE 131 Cb 0.10 -0.54 0.01 0.00 0.01 0.00 0.00 42.46 42.04 3dl5 s ILE 131 CO 0.17 0.03 0.36 -0.31 0.00 0.00 0.00 174.94 175.19 3dl5 s TYR 132 N 2.43 3.21 -0.12 3.97 1.51 -0.01 -1.05 117.35 127.28 3dl5 s TYR 132 Ca 0.03 -0.32 0.03 0.00 -1.01 0.00 0.00 57.07 55.80 3dl5 s TYR 132 Cb -0.13 -2.70 -0.00 0.00 -0.11 0.00 0.00 41.96 39.02 3dl5 s TYR 132 CO -0.10 -0.56 -0.21 -1.17 -1.11 0.00 0.00 175.55 172.40 3dl5 s LEU 133 N 1.93 2.24 -0.33 -1.29 1.98 0.33 -1.32 118.68 122.23 3dl5 s LEU 133 Ca 0.09 -0.52 -0.08 0.00 -2.89 0.00 0.00 54.13 50.73 3dl5 s LEU 133 Cb -0.17 -1.47 0.02 0.00 0.66 0.00 0.00 46.19 45.23 3dl5 s LEU 133 CO 0.12 0.13 0.13 -0.89 -1.89 0.00 0.00 176.35 173.95 3dl5 s THR 134 N 0.51 4.20 -0.13 3.68 2.01 0.65 -0.02 115.64 126.54 3dl5 s THR 134 Ca -0.13 -0.81 -0.22 0.00 0.31 0.00 0.00 61.69 60.84 3dl5 s THR 134 Cb -0.17 -3.26 -0.03 0.00 0.01 0.00 0.00 72.50 69.05 3dl5 s THR 134 CO 0.05 -0.08 0.68 -0.13 -0.69 0.00 0.00 174.62 174.45 3dl5 s ARG 135 N 1.51 4.33 -0.14 4.92 0.52 0.29 -1.27 118.95 129.11 3dl5 s ARG 135 Ca 0.02 0.79 -0.01 0.00 -0.52 0.00 0.00 55.73 56.00 3dl5 s ARG 135 Cb -0.18 -3.51 -0.02 0.00 0.52 0.00 0.00 34.95 31.76 3dl5 s ARG 135 CO 0.04 -0.09 -0.11 0.08 0.02 0.00 0.00 175.30 175.24 3dl5 s VAL 136 N 1.37 3.16 -0.71 3.52 1.01 -0.55 -2.45 120.40 125.75 3dl5 s VAL 136 Ca 0.34 -0.62 0.00 0.00 0.00 0.00 0.00 61.98 61.70 3dl5 s VAL 136 Cb -0.17 -2.34 0.00 0.00 0.00 0.00 0.00 36.38 33.87 3dl5 s VAL 136 CO 0.14 0.51 0.43 0.00 0.00 0.00 0.00 175.10 176.18 3dl5 n ALA 137 N 3.63 2.04 -2.55 5.51 0.00 0.19 -0.83 120.51 128.51 3dl5 n ALA 137 Ca -0.18 0.00 -0.40 0.00 0.00 0.00 0.00 53.44 52.86 3dl5 n ALA 137 Cb 0.52 -1.00 -0.10 0.00 0.00 0.00 0.00 19.45 18.88 3dl5 n ALA 137 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 3dl5 s LEU 138 N 0.00 4.41 0.00 0.00 2.96 -1.26 -4.65 118.68 120.13 3dl5 s LEU 138 Ca 0.00 -0.24 0.00 0.00 -0.22 0.00 0.00 54.13 53.67 3dl5 s LEU 138 Cb 0.00 -2.26 0.00 0.00 0.50 0.00 0.00 46.19 44.43 3dl5 s LEU 138 CO 0.00 -0.27 0.00 1.21 -1.32 0.00 0.00 176.35 175.97 3dl5 n GLU 139 N 5.27 0.00 -3.26 1.98 0.00 -1.26 -4.54 120.64 118.82 3dl5 n GLU 139 Ca -0.11 0.00 -0.45 0.00 0.00 0.00 0.00 57.16 56.60 3dl5 n GLU 139 Cb 0.50 -0.54 -0.01 0.00 0.00 0.00 0.00 31.44 31.38 3dl5 n GLU 139 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.13 176.62 3dl5 s ASP 140 N -4.76 7.07 0.00 4.31 1.11 -1.26 -4.87 116.67 118.27 3dl5 s ASP 140 Ca 0.00 -3.13 0.00 0.00 0.18 0.00 0.00 52.55 49.60 3dl5 s ASP 140 Cb 0.00 -2.24 0.00 0.00 1.07 0.00 0.00 42.92 41.75 3dl5 s ASP 140 CO 0.00 -0.48 0.00 2.30 1.18 0.00 0.00 175.17 178.17 3dl5 n ILE 141 N 3.52 0.00 -2.60 0.77 -5.35 -1.26 -5.14 119.36 109.30 3dl5 n ILE 141 Ca 0.22 0.00 -0.43 0.00 -0.27 0.00 0.00 62.75 62.27 3dl5 n ILE 141 Cb 0.43 0.00 -0.02 0.00 -1.74 0.00 0.00 39.64 38.31 3dl5 n ILE 141 CO 0.00 0.00 0.00 -1.61 -1.76 0.00 0.00 176.55 173.18 3dl5 s GLU 142 N -2.00 4.24 -0.03 6.28 0.41 -1.26 -5.03 118.70 121.31 3dl5 s GLU 142 Ca 0.00 1.42 0.03 0.00 -0.41 0.00 0.00 54.97 56.01 3dl5 s GLU 142 Cb 0.00 -3.68 -0.03 0.00 -1.78 0.00 0.00 34.13 28.64 3dl5 s GLU 142 CO 0.00 -0.67 -0.12 -0.06 -0.49 0.00 0.00 175.26 173.93 3dl5 s PHE 143 N 3.31 2.77 -0.06 1.61 0.08 -1.26 -4.64 117.98 119.79 3dl5 s PHE 143 Ca 0.47 -0.10 0.06 0.00 0.12 0.00 0.00 56.93 57.47 3dl5 s PHE 143 Cb -0.16 -1.62 -0.09 0.00 -0.57 0.00 0.00 43.02 40.57 3dl5 s PHE 143 CO 0.09 0.27 0.16 -0.40 -0.10 0.00 0.00 175.22 175.23 3dl5 n ASP 144 N 2.03 2.97 -4.16 1.36 5.68 -0.65 -5.01 116.55 118.77 3dl5 n ASP 144 Ca -0.17 -0.12 -0.30 0.00 -0.50 0.00 0.00 54.79 53.70 3dl5 n ASP 144 Cb 0.52 1.23 -0.17 0.00 -1.14 0.00 0.00 41.12 41.57 3dl5 n ASP 144 CO 0.00 0.00 0.00 -0.89 -1.33 0.00 0.00 177.20 174.98 3dl5 s THR 145 N -2.27 1.81 0.23 2.12 2.01 -1.04 -5.02 115.64 113.47 3dl5 s THR 145 Ca -0.01 -0.87 0.09 0.00 0.31 0.00 0.00 61.69 61.21 3dl5 s THR 145 Cb 0.04 -1.58 -0.05 0.00 0.01 0.00 0.00 72.50 70.93 3dl5 s THR 145 CO 0.26 0.50 -0.17 -0.31 -0.69 0.00 0.00 174.62 174.21 3dl5 s TYR 146 N 0.44 1.95 -0.01 4.92 2.02 -1.26 0.33 117.35 125.74 3dl5 s TYR 146 Ca -0.17 -0.47 -0.20 0.00 -0.37 0.00 0.00 57.07 55.85 3dl5 s TYR 146 Cb -0.17 -0.89 -0.05 0.00 -0.40 0.00 0.00 41.96 40.45 3dl5 s TYR 146 CO 0.07 0.49 0.59 0.12 -1.57 0.00 0.00 175.55 175.26 3dl5 s PHE 147 N -2.67 3.68 0.51 2.71 2.19 -0.02 -4.63 117.98 119.75 3dl5 s PHE 147 Ca 0.24 1.19 -0.23 0.00 0.33 0.00 0.00 56.93 58.47 3dl5 s PHE 147 Cb -0.03 -2.61 -0.06 0.00 -1.31 0.00 0.00 43.02 39.01 3dl5 s PHE 147 CO 0.10 0.35 1.39 -2.30 1.83 0.00 0.00 175.22 176.58 3dl5 n PRO 148 N 2.76 1.89 -1.67 10.12 -0.02 -1.26 -4.89 135.00 141.93 3dl5 n PRO 148 Ca -0.07 0.69 -0.46 0.00 -2.02 0.00 0.00 63.50 61.64 3dl5 n PRO 148 Cb 0.51 -2.60 -0.04 0.00 -0.02 0.00 0.00 33.50 31.35 3dl5 n PRO 148 CO 0.00 0.00 0.00 -0.85 1.98 0.00 0.00 175.50 176.63 3dl5 n GLU 149 N -0.73 2.14 -2.01 -0.52 0.00 -1.26 -4.87 120.64 113.39 3dl5 n GLU 149 Ca 0.09 0.78 -0.42 0.00 0.00 0.00 0.00 57.16 57.60 3dl5 n GLU 149 Cb 0.43 -2.55 -0.03 0.00 0.00 0.00 0.00 31.44 29.29 3dl5 n GLU 149 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.13 177.55 3dl5 s ILE 150 N 1.31 3.29 0.59 3.84 1.01 -1.26 -4.96 121.20 125.02 3dl5 s ILE 150 Ca 0.81 0.66 -0.20 0.00 0.00 0.00 0.00 60.65 61.92 3dl5 s ILE 150 Cb -0.68 -3.43 -0.03 0.00 0.01 0.00 0.00 42.46 38.33 3dl5 s ILE 150 CO 0.40 -0.01 1.28 -2.16 0.00 0.00 0.00 174.94 174.45 3dl5 s PRO 151 N 2.82 2.90 0.00 2.79 0.04 -1.26 -4.86 135.00 137.43 3dl5 s PRO 151 Ca 0.71 2.04 0.15 0.00 0.04 0.00 0.00 61.00 63.95 3dl5 s PRO 151 Cb -0.37 -2.02 0.87 0.00 0.04 0.00 0.00 34.50 33.03 3dl5 s PRO 151 CO 0.30 -1.32 1.37 0.39 0.04 0.00 0.00 177.00 177.79 3dl5 n GLU 152 N -1.48 0.40 0.00 4.56 1.02 -1.26 -1.71 120.64 122.17 3dl5 n GLU 152 Ca 0.13 0.05 0.16 0.00 -0.02 0.00 0.00 57.16 57.48 3dl5 n GLU 152 Cb 0.48 -1.50 0.89 0.00 -0.02 0.00 0.00 31.44 31.28 3dl5 n GLU 152 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 3dl5 n THR 153 N -1.10 0.00 -4.37 2.62 -2.24 -1.26 -4.80 114.28 103.14 3dl5 n THR 153 Ca 0.10 -0.01 -0.32 0.00 -2.27 0.00 0.00 64.05 61.55 3dl5 n THR 153 Cb 0.08 -0.47 -0.10 0.00 -2.10 0.00 0.00 70.33 67.74 3dl5 n THR 153 CO 0.00 0.00 0.00 -0.36 -0.57 0.00 0.00 175.07 174.14 3dl5 s PHE 154 N -2.14 2.95 -0.03 4.78 0.08 -0.69 -2.05 117.98 120.87 3dl5 s PHE 154 Ca 0.43 -0.00 0.01 0.00 0.12 0.00 0.00 56.93 57.49 3dl5 s PHE 154 Cb 0.22 -1.62 0.01 0.00 -0.57 0.00 0.00 43.02 41.06 3dl5 s PHE 154 CO 0.39 0.41 -0.04 -0.51 -0.10 0.00 0.00 175.22 175.37 3dl5 s LEU 155 N -1.56 1.51 0.35 -0.37 1.43 -0.04 -4.89 118.68 115.12 3dl5 s LEU 155 Ca 0.19 -0.11 -0.28 0.00 -1.03 0.00 0.00 54.13 52.89 3dl5 s LEU 155 Cb -0.11 -0.38 -0.10 0.00 0.03 0.00 0.00 46.19 45.62 3dl5 s LEU 155 CO 0.09 -0.02 1.35 -2.16 0.23 0.00 0.00 176.35 175.84 3dl5 s PRO 156 N 0.61 4.24 0.00 1.29 0.04 -1.26 -1.84 135.00 138.08 3dl5 s PRO 156 Ca -0.08 2.29 0.00 0.00 0.04 0.00 0.00 61.00 63.25 3dl5 s PRO 156 Cb -0.11 -3.00 0.00 0.00 0.04 0.00 0.00 34.50 31.43 3dl5 s PRO 156 CO -0.00 -0.31 0.13 1.33 0.04 0.00 0.00 177.00 178.19 3dl5 n VAL 157 N 0.62 0.00 -3.67 -0.36 0.24 0.33 -2.83 118.33 112.66 3dl5 n VAL 157 Ca 0.01 -0.27 -0.14 0.00 -2.04 0.00 0.00 64.34 61.90 3dl5 n VAL 157 Cb 0.41 1.21 -0.08 0.00 -1.47 0.00 0.00 33.84 33.91 3dl5 n VAL 157 CO 0.00 0.00 0.00 -0.47 -2.14 0.00 0.00 176.83 174.22 3dl5 s TYR 158 N -0.29 -0.65 -0.13 6.34 5.04 -1.22 -3.51 117.35 122.92 3dl5 s TYR 158 Ca 0.00 1.59 -0.04 0.00 -2.44 0.00 0.00 57.07 56.18 3dl5 s TYR 158 Cb 0.00 0.22 0.07 0.00 0.35 0.00 0.00 41.96 42.60 3dl5 s TYR 158 CO 0.00 -0.31 0.21 1.41 -1.34 0.00 0.00 175.55 175.52 3dl5 s MET 159 N 0.32 0.12 0.81 4.97 -2.45 -0.58 -2.23 119.30 120.26 3dl5 s MET 159 Ca -0.00 0.54 -0.11 0.00 -1.25 0.00 0.00 55.69 54.87 3dl5 s MET 159 Cb -0.04 -0.43 0.10 0.00 1.25 0.00 0.00 34.83 35.71 3dl5 s MET 159 CO 0.01 -0.39 1.17 -1.54 1.05 0.00 0.00 175.02 175.31 3dl5 s SER 160 N 2.35 4.29 1.08 1.11 1.04 -0.60 -2.11 113.70 120.85 3dl5 s SER 160 Ca 0.03 0.57 -0.13 0.00 0.48 0.00 0.00 55.95 56.90 3dl5 s SER 160 Cb -0.13 -1.00 0.23 0.00 0.10 0.00 0.00 66.02 65.22 3dl5 s SER 160 CO -0.08 -2.00 1.07 0.00 0.98 0.00 0.00 173.24 173.20 3dl5 s GLN 161 N -5.55 -0.21 0.32 4.02 -2.07 -1.26 -3.67 119.66 111.25 3dl5 s GLN 161 Ca 0.64 0.51 -0.19 0.00 -1.82 0.00 0.00 55.36 54.50 3dl5 s GLN 161 Cb -0.09 -1.66 -0.09 0.00 -1.09 0.00 0.00 33.01 30.07 3dl5 s GLN 161 CO 0.49 -3.16 0.82 0.99 -1.32 0.00 0.00 175.29 173.11 3dl5 s THR 162 N -2.83 4.50 0.22 3.63 2.01 -1.26 -4.65 115.64 117.26 3dl5 s THR 162 Ca 0.67 1.31 0.08 0.00 0.31 0.00 0.00 61.69 64.06 3dl5 s THR 162 Cb -0.20 -3.74 -0.05 0.00 0.01 0.00 0.00 72.50 68.53 3dl5 s THR 162 CO 0.59 -0.06 -0.15 -0.36 -0.69 0.00 0.00 174.62 173.95 3dl5 s PHE 163 N -1.85 1.79 -0.03 4.92 0.40 -0.25 -4.63 117.98 118.32 3dl5 s PHE 163 Ca 0.53 -0.54 0.04 0.00 -0.60 0.00 0.00 56.93 56.35 3dl5 s PHE 163 Cb -0.13 -0.83 -0.00 0.00 0.51 0.00 0.00 43.02 42.57 3dl5 s PHE 163 CO 0.18 0.40 -0.15 0.00 0.70 0.00 0.00 175.22 176.36 3dl5 s THR 165 N 0.00 -0.34 -1.33 0.00 2.01 -0.83 -4.86 115.64 110.30 3dl5 s THR 165 Ca -0.02 0.25 -0.06 0.00 0.31 0.00 0.00 61.69 62.17 3dl5 s THR 165 Cb -0.10 -0.44 0.04 0.00 0.01 0.00 0.00 72.50 72.01 3dl5 s THR 165 CO 0.01 0.10 0.42 0.29 -0.69 0.00 0.00 174.62 174.75 3dl5 n LYS 166 N 5.10 -3.54 -1.18 4.92 5.02 -1.26 -0.22 118.16 126.98 3dl5 n LYS 166 Ca -0.11 0.63 -0.06 0.00 -2.02 0.00 0.00 58.31 56.75 3dl5 n LYS 166 Cb 0.50 -5.36 -0.03 0.00 -0.02 0.00 0.00 35.03 30.13 3dl5 n LYS 166 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 3dl5 n ASN 167 N -2.26 -4.10 -4.54 4.39 3.02 -1.26 -5.02 115.26 105.49 3dl5 n ASN 167 Ca -0.07 0.16 -0.34 0.00 -0.03 0.00 0.00 54.58 54.29 3dl5 n ASN 167 Cb 0.58 -2.16 -0.11 0.00 -0.61 0.00 0.00 39.78 37.48 3dl5 n ASN 167 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3dl5 s ILE 168 N -2.12 4.33 0.28 2.41 1.01 0.69 -4.81 121.20 122.99 3dl5 s ILE 168 Ca 0.00 -0.19 -0.13 0.00 0.00 0.00 0.00 60.65 60.33 3dl5 s ILE 168 Cb 0.00 -2.95 -0.08 0.00 0.01 0.00 0.00 42.46 39.44 3dl5 s ILE 168 CO 0.00 0.45 0.66 -0.44 0.00 0.00 0.00 174.94 175.61 3dl5 s SER 169 N 0.59 6.73 0.11 3.58 0.01 -1.26 -1.96 113.70 121.51 3dl5 s SER 169 Ca 0.01 1.15 -0.16 0.00 1.31 0.00 0.00 55.95 58.26 3dl5 s SER 169 Cb -0.14 -2.32 0.06 0.00 0.21 0.00 0.00 66.02 63.83 3dl5 s SER 169 CO 0.02 -0.14 0.75 0.00 0.41 0.00 0.00 173.24 174.28 3dl5 n TYR 170 N -0.20 -1.00 -3.61 2.43 4.11 -0.87 -0.64 117.16 117.39 3dl5 n TYR 170 Ca 0.02 -0.83 -0.00 0.00 -0.00 0.00 0.00 57.90 57.08 3dl5 n TYR 170 Cb 0.53 0.40 -0.06 0.00 -0.00 0.00 0.00 39.34 40.21 3dl5 n TYR 170 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 176.86 177.20 3dl5 s ASP 171 N -2.75 -0.34 -0.24 9.48 2.15 -1.03 -1.10 116.67 122.84 3dl5 s ASP 171 Ca 0.17 0.54 -0.04 0.00 0.43 0.00 0.00 52.55 53.64 3dl5 s ASP 171 Cb -0.02 1.18 -0.00 0.00 -0.30 0.00 0.00 42.92 43.77 3dl5 s ASP 171 CO 0.03 -0.08 -0.01 -0.36 -0.17 0.00 0.00 175.17 174.58 3dl5 s PHE 172 N 1.36 3.01 0.22 -5.34 0.08 -1.26 -0.55 117.98 115.50 3dl5 s PHE 172 Ca -0.08 -0.94 0.11 0.00 0.12 0.00 0.00 56.93 56.14 3dl5 s PHE 172 Cb -0.03 -2.14 -0.05 0.00 -0.57 0.00 0.00 43.02 40.23 3dl5 s PHE 172 CO -0.13 -0.55 -0.21 -1.64 -0.10 0.00 0.00 175.22 172.59 3dl5 s MET 173 N 1.48 1.62 -0.05 0.44 -1.94 0.98 -1.56 119.30 120.27 3dl5 s MET 173 Ca 0.05 -1.58 0.02 0.00 -1.71 0.00 0.00 55.69 52.47 3dl5 s MET 173 Cb -0.15 -1.85 0.01 0.00 2.01 0.00 0.00 34.83 34.85 3dl5 s MET 173 CO -0.02 0.38 -0.10 0.42 -0.01 0.00 0.00 175.02 175.70 3dl5 s ILE 174 N -1.93 0.92 0.22 2.53 1.01 -0.95 -0.51 121.20 122.49 3dl5 s ILE 174 Ca 0.24 -0.37 0.12 0.00 0.00 0.00 0.00 60.65 60.64 3dl5 s ILE 174 Cb -0.07 -0.85 -0.05 0.00 0.01 0.00 0.00 42.46 41.50 3dl5 s ILE 174 CO 0.12 0.30 -0.22 -0.36 0.00 0.00 0.00 174.94 174.78 3dl5 s PHE 175 N 0.63 2.31 0.05 3.97 0.40 -0.22 -0.51 117.98 124.61 3dl5 s PHE 175 Ca -0.12 -0.34 -0.04 0.00 -0.60 0.00 0.00 56.93 55.83 3dl5 s PHE 175 Cb -0.14 -1.09 -0.02 0.00 0.51 0.00 0.00 43.02 42.28 3dl5 s PHE 175 CO 0.02 0.58 0.06 -1.21 0.70 0.00 0.00 175.22 175.37 3dl5 s GLU 176 N -2.97 0.61 0.38 0.44 2.02 -0.76 -1.69 118.70 116.72 3dl5 s GLU 176 Ca 0.24 -0.92 -0.13 0.00 0.02 0.00 0.00 54.97 54.18 3dl5 s GLU 176 Cb -0.07 0.23 -0.08 0.00 0.10 0.00 0.00 34.13 34.31 3dl5 s GLU 176 CO 0.12 -0.14 0.78 0.15 0.02 0.00 0.00 175.26 176.19 3dl5 s LYS 177 N -3.10 3.90 0.28 1.61 1.02 -1.04 -0.86 119.74 121.56 3dl5 s LYS 177 Ca -0.01 0.62 -0.11 0.00 0.02 0.00 0.00 55.97 56.49 3dl5 s LYS 177 Cb 0.02 -2.37 -0.08 0.00 -0.52 0.00 0.00 37.83 34.88 3dl5 s LYS 177 CO -0.07 0.02 0.63 -0.65 -0.92 0.00 0.00 175.35 174.36 3dl5 s GLN 178 N -3.49 3.86 0.21 1.68 -1.52 -0.87 -4.95 119.66 114.59 3dl5 s GLN 178 Ca 0.54 0.41 -0.14 0.00 -1.95 0.00 0.00 55.36 54.22 3dl5 s GLN 178 Cb -0.10 -2.55 0.01 0.00 -0.22 0.00 0.00 33.01 30.14 3dl5 s GLN 178 CO 0.25 0.23 0.45 -1.83 -0.25 0.00 0.00 175.29 174.14 3dl5 s GLU 179 N -2.99 1.41 0.85 2.91 -1.05 -1.26 -5.09 118.70 113.47 3dl5 s GLU 179 Ca 0.50 -1.11 -0.13 0.00 -0.15 0.00 0.00 54.97 54.08 3dl5 s GLU 179 Cb -0.11 0.47 0.11 0.00 -0.44 0.00 0.00 34.13 34.16 3dl5 s GLU 179 CO 0.21 -0.58 1.21 0.15 0.95 0.00 0.00 175.26 177.21 3dl5 s LYS 180 N -3.96 1.60 4.52 -4.83 3.01 -1.26 -5.32 119.74 113.50 3dl5 s LYS 180 Ca 0.17 -0.01 0.00 0.00 -1.01 0.00 0.00 55.97 55.12 3dl5 s LYS 180 Cb 0.00 -1.92 0.00 0.00 -1.01 0.00 0.00 37.83 34.90 3dl5 s LYS 180 CO 0.03 -1.83 0.00 0.36 0.51 0.00 0.00 175.35 174.42 3dl5 n LYS 181 N -3.45 0.00 -3.00 1.68 2.85 -1.26 -5.34 118.16 109.64 3dl5 n LYS 181 Ca 0.10 0.00 -0.41 0.00 -1.05 0.00 0.00 58.31 56.94 3dl5 n LYS 181 Cb 0.61 0.00 -0.05 0.00 -0.65 0.00 0.00 35.03 34.93 3dl5 n LYS 181 CO 0.00 0.00 0.00 -1.17 -0.05 0.00 0.00 177.40 176.18 3dl5 s LEU 193 N 0.00 4.08 0.38 -5.58 2.96 -1.26 -5.28 118.68 113.99 3dl5 s LEU 193 Ca 0.00 0.75 0.21 0.00 -0.22 0.00 0.00 54.13 54.87 3dl5 s LEU 193 Cb 0.00 -3.01 1.25 0.00 0.50 0.00 0.00 46.19 44.93 3dl5 s LEU 193 CO 0.00 -0.50 1.65 0.11 -1.32 0.00 0.00 176.35 176.29 3dl5 h LYS 194 N 7.94 0.19 -0.91 1.98 1.57 -2.05 -2.83 116.57 122.46 3dl5 h LYS 194 Ca -0.25 -0.01 0.22 0.00 -1.87 0.00 0.00 60.65 58.74 3dl5 h LYS 194 Cb 1.11 -0.04 -0.17 0.00 0.08 0.00 0.00 32.23 33.20 3dl5 h LYS 194 CO 0.84 0.13 -0.07 0.66 -0.57 0.00 0.00 179.45 180.44 3dl5 h SER 195 N 0.20 -0.58 0.11 0.86 4.64 -2.05 0.38 113.55 117.12 3dl5 h SER 195 Ca 0.77 0.26 -0.01 0.00 -0.47 0.00 0.00 61.79 62.34 3dl5 h SER 195 Cb 2.06 0.48 0.00 0.00 -0.31 0.00 0.00 62.40 64.63 3dl5 h SER 195 CO -0.54 -0.29 -0.05 0.40 -0.87 0.00 0.00 176.83 175.47 3dl5 h ILE 196 N 0.03 1.00 -0.88 0.95 2.04 -1.94 -2.18 117.51 116.53 3dl5 h ILE 196 Ca 0.50 -1.28 0.08 0.00 1.00 0.00 0.00 64.86 65.16 3dl5 h ILE 196 Cb 0.92 1.71 -0.07 0.00 -0.74 0.00 0.00 36.82 38.64 3dl5 h ILE 196 CO -0.87 0.27 0.53 0.44 0.00 0.00 0.00 178.15 178.52 3dl5 h ASP 197 N -0.84 0.81 0.07 1.72 3.45 -1.56 0.09 116.42 120.16 3dl5 h ASP 197 Ca -0.02 0.03 -0.00 0.00 0.43 0.00 0.00 57.03 57.47 3dl5 h ASP 197 Cb 0.56 -0.13 0.00 0.00 -0.56 0.00 0.00 39.33 39.20 3dl5 h ASP 197 CO 0.03 0.48 -0.03 0.44 -1.57 0.00 0.00 179.24 178.58 3dl5 h ASP 198 N 0.92 -0.08 -0.34 6.45 3.45 -0.33 0.10 116.42 126.59 3dl5 h ASP 198 Ca 0.41 -0.21 0.05 0.00 0.43 0.00 0.00 57.03 57.71 3dl5 h ASP 198 Cb 0.29 0.02 -0.05 0.00 -0.56 0.00 0.00 39.33 39.04 3dl5 h ASP 198 CO -0.22 0.17 0.07 0.74 -1.57 0.00 0.00 179.24 178.43 3dl5 h THR 199 N -0.33 0.83 -0.83 0.35 2.02 -0.99 -0.30 112.91 113.66 3dl5 h THR 199 Ca -0.01 -0.06 -0.02 0.00 0.77 0.00 0.00 66.41 67.09 3dl5 h THR 199 Cb 0.29 0.63 -0.04 0.00 -1.74 0.00 0.00 68.15 67.29 3dl5 h THR 199 CO 0.02 0.03 0.44 0.58 0.37 0.00 0.00 175.52 176.96 3dl5 h VAL 200 N 0.18 1.25 0.17 3.16 2.07 -0.90 0.78 116.25 122.96 3dl5 h VAL 200 Ca 0.16 -0.64 -0.01 0.00 0.82 0.00 0.00 66.70 67.04 3dl5 h VAL 200 Cb 0.18 0.15 0.00 0.00 -1.52 0.00 0.00 31.29 30.11 3dl5 h VAL 200 CO -0.22 0.28 -0.08 0.44 0.02 0.00 0.00 177.57 178.01 3dl5 h ASP 201 N 1.16 -0.20 -0.52 0.57 3.45 -0.32 0.38 116.42 120.94 3dl5 h ASP 201 Ca 0.29 0.00 0.01 0.00 0.43 0.00 0.00 57.03 57.76 3dl5 h ASP 201 Cb 0.05 0.05 -0.03 0.00 -0.56 0.00 0.00 39.33 38.85 3dl5 h ASP 201 CO -0.04 -0.13 0.34 -0.07 -1.57 0.00 0.00 179.24 177.76 3dl5 h LEU 202 N -0.24 0.57 -2.05 1.55 4.07 -0.86 0.10 115.31 118.45 3dl5 h LEU 202 Ca -0.02 -0.01 -0.00 0.00 0.08 0.00 0.00 57.88 57.92 3dl5 h LEU 202 Cb 0.18 -0.14 -0.00 0.00 1.08 0.00 0.00 40.66 41.79 3dl5 h LEU 202 CO 0.04 0.41 -0.01 0.25 -1.08 0.00 0.00 178.44 178.05 3dl5 h LEU 203 N 0.69 0.00 -0.32 1.67 5.85 -0.64 -0.80 115.31 121.76 3dl5 h LEU 203 Ca 0.20 0.00 -0.20 0.00 0.84 0.00 0.00 57.88 58.72 3dl5 h LEU 203 Cb -0.05 0.00 0.00 0.00 0.37 0.00 0.00 40.66 40.98 3dl5 h LEU 203 CO -0.06 0.01 -0.73 1.23 -0.34 0.00 0.00 178.44 178.56 3dl5 h GLY 204 N 0.04 0.65 1.01 3.75 0.00 0.14 -2.50 103.07 106.16 3dl5 h GLY 204 Ca -0.00 -0.89 -0.08 0.00 0.00 0.00 0.00 47.33 46.36 3dl5 h GLY 204 CO 0.00 0.80 0.00 0.83 0.00 0.00 0.00 176.54 178.17 3dl5 h GLU 205 N 0.41 0.88 -0.24 4.80 5.08 0.29 -0.91 114.58 124.89 3dl5 h GLU 205 Ca -0.03 -0.28 -0.03 0.00 -1.00 0.00 0.00 59.36 58.02 3dl5 h GLU 205 Cb 1.32 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 30.48 3dl5 h GLU 205 CO 0.14 0.91 0.03 0.82 -1.00 0.00 0.00 179.01 179.91 3dl5 h ILE 206 N 0.74 1.23 0.00 3.13 2.04 -1.27 -3.35 117.51 120.04 3dl5 h ILE 206 Ca 0.14 -0.79 0.00 0.00 1.00 0.00 0.00 64.86 65.21 3dl5 h ILE 206 Cb 0.52 1.30 0.00 0.00 -0.74 0.00 0.00 36.82 37.89 3dl5 h ILE 206 CO 0.03 0.25 -1.11 0.49 0.00 0.00 0.00 178.15 177.80 3dl5 n PHE 207 N -4.69 0.39 -4.29 1.37 3.72 -0.94 -5.06 117.46 107.96 3dl5 n PHE 207 Ca -0.04 0.11 0.00 0.00 -0.05 0.00 0.00 57.45 57.48 3dl5 n PHE 207 Cb 0.21 -0.56 0.00 0.00 -0.94 0.00 0.00 39.48 38.19 3dl5 n PHE 207 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3dl5 n GLY 208 N 1.32 2.33 0.00 1.37 0.00 -0.35 -1.28 105.19 108.58 3dl5 n GLY 208 Ca 0.01 -0.41 0.02 0.00 0.00 0.00 0.00 46.02 45.64 3dl5 n GLY 208 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 3dl5 n ILE 209 N 0.00 0.00 0.72 -0.61 -5.35 -1.26 -1.99 119.36 110.87 3dl5 n ILE 209 Ca 0.00 0.00 0.13 0.00 -0.27 0.00 0.00 62.75 62.61 3dl5 n ILE 209 Cb 0.00 -0.32 0.48 0.00 -1.74 0.00 0.00 39.64 38.06 3dl5 n ILE 209 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 3dl5 n ARG 210 N -0.62 0.16 -3.54 6.28 1.74 -0.40 -4.53 116.66 115.74 3dl5 n ARG 210 Ca 0.03 0.17 -0.41 0.00 -0.77 0.00 0.00 57.85 56.87 3dl5 n ARG 210 Cb 0.02 -1.70 -0.10 0.00 -1.02 0.00 0.00 32.46 29.66 3dl5 n ARG 210 CO 0.00 0.00 0.00 0.21 -1.52 0.00 0.00 177.63 176.32 3dl5 s LYS 211 N -3.08 2.82 0.34 5.56 2.20 -0.84 -4.97 119.74 121.76 3dl5 s LYS 211 Ca 0.11 -1.20 0.14 0.00 -0.36 0.00 0.00 55.97 54.66 3dl5 s LYS 211 Cb 0.14 -3.85 1.10 0.00 -1.51 0.00 0.00 37.83 33.72 3dl5 s LYS 211 CO 0.54 -0.82 1.52 -0.12 -0.36 0.00 0.00 175.35 176.12 3dl5 n MET 212 N 5.04 -0.07 -0.29 4.03 0.00 -1.26 0.56 117.12 125.13 3dl5 n MET 212 Ca -0.11 1.38 0.25 0.00 -0.00 0.00 0.00 57.70 59.21 3dl5 n MET 212 Cb 0.45 -2.37 0.57 0.00 0.00 0.00 0.00 33.22 31.87 3dl5 n MET 212 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 175.97 176.75 3dl5 h GLY 213 N 0.00 0.82 2.00 -5.12 0.00 -1.93 0.59 103.07 99.43 3dl5 h GLY 213 Ca 0.74 -0.15 0.00 0.00 0.00 0.00 0.00 47.33 47.92 3dl5 h GLY 213 CO -0.81 -0.07 0.00 3.43 0.00 0.00 0.00 176.54 179.09 3dl5 h ASN 214 N 0.29 0.00 0.88 0.19 2.35 -0.16 -2.30 115.58 116.83 3dl5 h ASN 214 Ca 0.55 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.30 3dl5 h ASN 214 Cb 1.58 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.95 3dl5 h ASN 214 CO -0.20 0.00 -0.42 0.54 -1.65 0.00 0.00 177.43 175.70 3dl5 n ARG 215 N -2.49 0.18 -3.22 0.81 1.74 0.20 -4.09 116.66 109.80 3dl5 n ARG 215 Ca 0.03 0.07 -0.25 0.00 -0.77 0.00 0.00 57.85 56.94 3dl5 n ARG 215 Cb 0.34 -1.64 -0.06 0.00 -1.02 0.00 0.00 32.46 30.08 3dl5 n ARG 215 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 3dl5 n HIS 216 N -1.91 2.07 -2.53 -1.55 8.25 -0.87 -4.95 115.22 113.73 3dl5 n HIS 216 Ca 0.05 -3.90 -0.41 0.00 -0.26 0.00 0.00 57.72 53.19 3dl5 n HIS 216 Cb 0.40 -0.46 -0.04 0.00 1.12 0.00 0.00 29.99 31.00 3dl5 n HIS 216 CO 0.00 0.00 0.00 0.15 0.64 0.00 0.00 176.34 177.13 3dl5 s LYS 217 N -2.34 4.62 0.30 -0.41 1.02 -1.21 -4.88 119.74 116.85 3dl5 s LYS 217 Ca 0.41 1.71 -0.30 0.00 0.02 0.00 0.00 55.97 57.81 3dl5 s LYS 217 Cb 0.22 -3.26 -0.11 0.00 -0.52 0.00 0.00 37.83 34.15 3dl5 s LYS 217 CO -0.08 0.13 1.56 0.12 -0.92 0.00 0.00 175.35 176.17 3dl5 s PHE 218 N -0.45 2.75 0.26 3.18 5.36 -1.26 -4.78 117.98 123.03 3dl5 s PHE 218 Ca 0.48 0.87 -0.30 0.00 -0.96 0.00 0.00 56.93 57.01 3dl5 s PHE 218 Cb -0.29 -4.04 -0.13 0.00 -0.34 0.00 0.00 43.02 38.21 3dl5 s PHE 218 CO 0.36 -3.41 1.33 -2.30 -1.46 0.00 0.00 175.22 169.73 3dl5 n PRO 219 N 1.89 1.93 -2.36 10.12 -0.02 -1.26 -4.95 135.00 140.35 3dl5 n PRO 219 Ca 0.07 0.68 -0.35 0.00 -2.02 0.00 0.00 63.50 61.88 3dl5 n PRO 219 Cb 0.38 -2.29 -0.01 0.00 -0.02 0.00 0.00 33.50 31.56 3dl5 n PRO 219 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 3dl5 s LYS 220 N -0.83 3.52 0.51 -0.52 1.02 -1.26 -4.81 119.74 117.37 3dl5 s LYS 220 Ca 0.65 1.53 0.20 0.00 0.02 0.00 0.00 55.97 58.37 3dl5 s LYS 220 Cb -0.65 -2.05 1.34 0.00 -0.52 0.00 0.00 37.83 35.95 3dl5 s LYS 220 CO 0.54 -0.69 2.12 1.05 -0.92 0.00 0.00 175.35 177.44 3dl5 h GLU 221 N 1.36 0.00 0.00 1.68 4.11 -1.92 -1.90 114.58 117.91 3dl5 h GLU 221 Ca -0.50 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.93 3dl5 h GLU 221 Cb 1.25 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.50 3dl5 h GLU 221 CO 0.58 0.07 0.00 -0.85 0.07 0.00 0.00 179.01 178.88 3dl5 n GLU 222 N -4.19 0.12 0.00 1.06 0.00 -1.26 -1.13 120.64 115.24 3dl5 n GLU 222 Ca -0.03 0.54 0.00 0.00 0.00 0.00 0.00 57.16 57.68 3dl5 n GLU 222 Cb 0.16 -1.83 0.00 0.00 0.00 0.00 0.00 31.44 29.76 3dl5 n GLU 222 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.13 177.57 3dl5 n ILE 223 N -2.07 0.10 -2.90 3.84 -5.35 -0.78 -4.99 119.36 107.21 3dl5 n ILE 223 Ca -0.00 -0.50 -0.41 0.00 -0.27 0.00 0.00 62.75 61.56 3dl5 n ILE 223 Cb 0.08 1.03 -0.04 0.00 -1.74 0.00 0.00 39.64 38.97 3dl5 n ILE 223 CO 0.00 0.00 0.00 -0.47 -1.76 0.00 0.00 176.55 174.32 3dl5 s TYR 224 N -0.10 3.42 0.57 4.28 6.04 -0.28 -4.66 117.35 126.61 3dl5 s TYR 224 Ca 0.00 1.24 -0.21 0.00 0.04 0.00 0.00 57.07 58.14 3dl5 s TYR 224 Cb 0.00 -3.00 -0.04 0.00 -1.04 0.00 0.00 41.96 37.88 3dl5 s TYR 224 CO 0.00 -0.23 1.33 -1.71 -1.54 0.00 0.00 175.55 173.40 3dl5 n ASN 225 N 5.19 2.51 -3.85 4.32 2.85 -1.26 -3.56 115.26 121.47 3dl5 n ASN 225 Ca 0.04 0.95 -0.26 0.00 -0.11 0.00 0.00 54.58 55.20 3dl5 n ASN 225 Cb 0.49 -1.57 -0.01 0.00 1.24 0.00 0.00 39.78 39.93 3dl5 n ASN 225 CO 0.00 0.00 0.00 0.41 -2.11 0.00 0.00 177.26 175.56 3dl5 n THR 226 N -1.21 -1.28 -0.32 -0.44 -1.04 -1.26 -4.70 114.28 104.02 3dl5 n THR 226 Ca 0.12 -0.34 0.21 0.00 -2.04 0.00 0.00 64.05 61.99 3dl5 n THR 226 Cb 0.45 -1.12 0.42 0.00 -1.82 0.00 0.00 70.33 68.26 3dl5 n THR 226 CO 0.00 0.00 0.00 -0.65 -0.64 0.00 0.00 175.07 173.78 3dl5 h PRO 227 N -0.48 0.22 -0.39 -2.82 0.11 -1.88 -0.77 132.00 125.99 3dl5 h PRO 227 Ca -0.42 -0.01 0.11 0.00 0.11 0.00 0.00 66.00 65.79 3dl5 h PRO 227 Cb 0.85 -0.05 -0.02 0.00 0.11 0.00 0.00 31.00 31.90 3dl5 h PRO 227 CO 0.35 0.14 0.39 0.66 -0.21 0.00 0.00 178.00 179.33 3dl5 h SER 228 N 0.22 0.00 -2.17 -2.05 4.64 -1.84 -3.32 113.55 109.03 3dl5 h SER 228 Ca 0.68 0.00 -0.62 0.00 -0.47 0.00 0.00 61.79 61.38 3dl5 h SER 228 Cb 1.54 0.00 -0.13 0.00 -0.31 0.00 0.00 62.40 63.50 3dl5 h SER 228 CO -0.67 0.00 0.94 -0.63 -0.87 0.00 0.00 176.83 175.61 3dl5 s ILE 229 N -4.68 4.22 -0.19 0.95 1.01 -0.30 -4.49 121.20 117.72 3dl5 s ILE 229 Ca -0.04 -0.63 -0.16 0.00 0.00 0.00 0.00 60.65 59.82 3dl5 s ILE 229 Cb 0.16 -4.84 -0.11 0.00 0.01 0.00 0.00 42.46 37.67 3dl5 s ILE 229 CO 0.58 -1.66 -0.02 0.54 0.00 0.00 0.00 174.94 174.37 3dl5 n ARG 230 N 8.00 0.52 -0.41 2.79 1.74 -1.25 -4.57 116.66 123.48 3dl5 n ARG 230 Ca 0.13 0.51 0.08 0.00 -0.77 0.00 0.00 57.85 57.81 3dl5 n ARG 230 Cb 0.48 -1.69 0.26 0.00 -1.02 0.00 0.00 32.46 30.50 3dl5 n ARG 230 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 3dl5 n PHE 231 N -4.49 0.98 -1.82 -1.55 3.01 -1.26 -4.55 117.46 107.78 3dl5 n PHE 231 Ca -0.23 -0.62 0.06 0.00 1.01 0.00 0.00 57.45 57.66 3dl5 n PHE 231 Cb 0.53 -0.16 0.14 0.00 -0.01 0.00 0.00 39.48 39.97 3dl5 n PHE 231 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3dl5 n GLY 232 N 0.62 3.70 3.45 1.37 0.00 -1.23 -4.94 105.19 108.15 3dl5 n GLY 232 Ca 0.20 -1.09 -0.43 0.00 0.00 0.00 0.00 46.02 44.69 3dl5 n GLY 232 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3dl5 n ARG 233 N -0.63 3.26 -0.08 1.61 1.74 -1.26 -1.52 116.66 119.78 3dl5 n ARG 233 Ca 0.14 -3.47 -0.08 0.00 -0.77 0.00 0.00 57.85 53.67 3dl5 n ARG 233 Cb 0.82 -3.28 -0.13 0.00 -1.02 0.00 0.00 32.46 28.85 3dl5 n ARG 233 CO 0.00 0.00 0.00 -1.91 -1.52 0.00 0.00 177.63 174.20 3dl5 n GLU 234 N 6.97 1.36 -1.67 5.56 2.13 -0.93 -4.89 120.64 129.17 3dl5 n GLU 234 Ca 0.44 -0.01 -0.52 0.00 0.66 0.00 0.00 57.16 57.73 3dl5 n GLU 234 Cb 0.44 -1.41 -0.06 0.00 0.27 0.00 0.00 31.44 30.68 3dl5 n GLU 234 CO 0.00 0.00 0.00 1.58 -0.41 0.00 0.00 177.13 178.30 3dl5 n HIS 235 N -2.60 2.04 1.89 4.31 -0.00 -0.90 -4.16 115.22 115.80 3dl5 n HIS 235 Ca -0.26 0.38 0.16 0.00 0.46 0.00 0.00 57.72 58.46 3dl5 n HIS 235 Cb 1.02 -2.50 0.89 0.00 -0.12 0.00 0.00 29.99 29.29 3dl5 n HIS 235 CO 0.00 0.00 0.00 0.66 0.46 0.00 0.00 176.34 177.46 3dl5 n TYR 236 N 4.83 0.00 0.27 1.57 4.02 -1.26 -1.53 117.16 125.05 3dl5 n TYR 236 Ca 0.22 0.00 0.14 0.00 -0.01 0.00 0.00 57.90 58.26 3dl5 n TYR 236 Cb 0.21 -0.04 0.75 0.00 -0.02 0.00 0.00 39.34 40.24 3dl5 n TYR 236 CO 0.00 0.00 0.00 1.49 -1.01 0.00 0.00 176.86 177.34 3dl5 h GLU 237 N 0.16 0.00 0.00 -0.72 4.81 -1.90 -2.53 114.58 114.40 3dl5 h GLU 237 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 3dl5 h GLU 237 Cb 0.07 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.45 3dl5 h GLU 237 CO 0.00 0.10 0.00 1.19 -0.73 0.00 0.00 179.01 179.57 3dl5 n PHE 238 N -3.47 0.72 0.17 0.92 3.72 -0.58 -1.92 117.46 117.01 3dl5 n PHE 238 Ca -0.01 0.26 0.01 0.00 -0.05 0.00 0.00 57.45 57.66 3dl5 n PHE 238 Cb 0.25 -0.93 0.29 0.00 -0.94 0.00 0.00 39.48 38.16 3dl5 n PHE 238 CO 0.00 0.00 0.00 1.96 -0.05 0.00 0.00 176.76 178.67 3dl5 h GLN 239 N 0.00 0.01 0.06 -1.08 1.08 -1.63 -0.74 115.11 112.81 3dl5 h GLN 239 Ca 0.00 -0.01 -0.32 0.00 -1.45 0.00 0.00 58.65 56.88 3dl5 h GLN 239 Cb 0.44 -0.00 -0.03 0.00 -0.05 0.00 0.00 27.48 27.84 3dl5 h GLN 239 CO 0.00 0.46 -1.75 0.98 -0.95 0.00 0.00 178.83 177.57 3dl5 n TYR 240 N -4.00 1.04 -0.32 2.96 4.19 -0.84 -3.66 117.16 116.52 3dl5 n TYR 240 Ca -0.02 0.31 -0.03 0.00 3.31 0.00 0.00 57.90 61.47 3dl5 n TYR 240 Cb 0.47 -1.12 0.11 0.00 0.49 0.00 0.00 39.34 39.29 3dl5 n TYR 240 CO 0.00 0.00 0.00 -0.07 0.91 0.00 0.00 176.86 177.70 3dl5 h LEU 241 N -0.42 1.10 -1.04 2.98 3.38 -1.41 -2.38 115.31 117.53 3dl5 h LEU 241 Ca -0.42 -0.09 -0.03 0.00 0.09 0.00 0.00 57.88 57.43 3dl5 h LEU 241 Cb 1.71 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 42.18 3dl5 h LEU 241 CO -0.07 0.88 -0.16 0.44 0.09 0.00 0.00 178.44 179.62 3dl5 h ASP 242 N 1.24 0.00 -0.12 -0.43 3.32 -1.32 -1.88 116.42 117.24 3dl5 h ASP 242 Ca 0.31 0.00 -0.10 0.00 0.02 0.00 0.00 57.03 57.27 3dl5 h ASP 242 Cb 0.01 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.56 3dl5 h ASP 242 CO -0.05 0.16 -0.32 0.25 -1.72 0.00 0.00 179.24 177.56 3dl5 h LEU 243 N 0.00 0.48 -0.49 1.55 5.85 -1.52 -0.39 115.31 120.79 3dl5 h LEU 243 Ca -0.00 -0.59 0.10 0.00 0.84 0.00 0.00 57.88 58.22 3dl5 h LEU 243 Cb 0.74 -0.14 -0.09 0.00 0.37 0.00 0.00 40.66 41.55 3dl5 h LEU 243 CO 0.02 0.98 -0.06 -0.07 -0.34 0.00 0.00 178.44 178.97 3dl5 h LEU 244 N -0.01 -0.33 -0.34 2.25 4.07 -1.12 -0.97 115.31 118.87 3dl5 h LEU 244 Ca -0.01 0.13 -0.00 0.00 0.08 0.00 0.00 57.88 58.08 3dl5 h LEU 244 Cb 0.93 0.25 -0.02 0.00 1.08 0.00 0.00 40.66 42.91 3dl5 h LEU 244 CO 0.07 -0.12 0.21 0.28 -1.08 0.00 0.00 178.44 177.80 3dl5 h SER 245 N 0.05 0.41 -0.92 -0.43 0.02 -1.23 -1.05 113.55 110.40 3dl5 h SER 245 Ca 0.24 -0.05 0.08 0.00 -0.84 0.00 0.00 61.79 61.22 3dl5 h SER 245 Cb 0.37 -0.10 -0.06 0.00 0.14 0.00 0.00 62.40 62.74 3dl5 h SER 245 CO -0.45 0.34 0.59 0.03 -1.14 0.00 0.00 176.83 176.20 3dl5 h ARG 246 N 0.44 0.96 0.00 3.45 3.08 -0.01 -0.19 114.38 122.10 3dl5 h ARG 246 Ca 0.12 -0.06 -0.22 0.00 0.07 0.00 0.00 59.98 59.90 3dl5 h ARG 246 Cb 0.01 -0.22 -0.03 0.00 0.08 0.00 0.00 29.97 29.81 3dl5 h ARG 246 CO -0.02 0.63 -1.14 -0.39 -1.07 0.00 0.00 179.97 177.98 3dl5 h VAL 247 N 0.99 1.35 0.00 2.04 -1.51 -0.97 -0.44 116.25 117.71 3dl5 h VAL 247 Ca 0.41 -3.05 -0.03 0.00 -1.23 0.00 0.00 66.70 62.80 3dl5 h VAL 247 Cb 0.31 2.66 -0.00 0.00 -2.13 0.00 0.00 31.29 32.12 3dl5 h VAL 247 CO -0.17 0.77 -0.16 -0.07 -1.23 0.00 0.00 177.57 176.71 3dl5 h LEU 248 N 0.00 0.00 0.15 4.19 4.07 -0.44 0.77 115.31 124.05 3dl5 h LEU 248 Ca -0.08 0.00 -0.36 0.00 0.08 0.00 0.00 57.88 57.52 3dl5 h LEU 248 Cb 1.78 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 43.51 3dl5 h LEU 248 CO 0.11 0.16 -1.88 -0.08 -1.08 0.00 0.00 178.44 175.67 3dl5 h GLU 249 N 0.00 0.31 0.00 1.13 4.57 -0.97 -3.42 114.58 116.21 3dl5 h GLU 249 Ca -0.00 -0.53 0.00 0.00 -1.18 0.00 0.00 59.36 57.65 3dl5 h GLU 249 Cb 0.30 0.20 0.00 0.00 -0.16 0.00 0.00 28.75 29.09 3dl5 h GLU 249 CO 0.02 1.25 -1.02 0.09 -1.18 0.00 0.00 179.01 178.17 3dl5 n ASN 250 N -3.56 2.24 -4.66 1.04 3.02 -0.18 -4.97 115.26 108.18 3dl5 n ASN 250 Ca -0.29 -0.23 -0.58 0.00 -0.03 0.00 0.00 54.58 53.45 3dl5 n ASN 250 Cb 1.04 1.24 -0.08 0.00 -0.61 0.00 0.00 39.78 41.38 3dl5 n ASN 250 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3dl5 n GLY 251 N 1.76 0.71 3.74 7.41 0.00 0.27 -4.87 105.19 114.20 3dl5 n GLY 251 Ca -0.00 0.95 -0.40 0.00 0.00 0.00 0.00 46.02 46.56 3dl5 n GLY 251 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dl5 s ALA 252 N 4.04 3.31 0.02 4.61 0.00 -0.73 -4.40 121.76 128.60 3dl5 s ALA 252 Ca 1.01 0.62 -0.30 0.00 0.00 0.00 0.00 51.96 53.29 3dl5 s ALA 252 Cb -1.11 -3.24 -0.05 0.00 0.00 0.00 0.00 23.12 18.71 3dl5 s ALA 252 CO 0.66 0.11 1.25 -0.47 0.00 0.00 0.00 175.76 177.31 3dl5 s TYR 253 N -0.73 3.23 -0.07 0.00 6.14 -1.26 -1.06 117.35 123.60 3dl5 s TYR 253 Ca 0.43 1.15 -0.17 0.00 0.64 0.00 0.00 57.07 59.12 3dl5 s TYR 253 Cb -0.25 -3.49 0.04 0.00 0.42 0.00 0.00 41.96 38.68 3dl5 s TYR 253 CO 0.31 -1.60 0.41 -0.98 0.64 0.00 0.00 175.55 174.33 3dl5 s ARG 254 N 1.70 0.67 0.70 4.97 1.70 -0.58 -4.99 118.95 123.13 3dl5 s ARG 254 Ca 0.59 0.16 -0.11 0.00 -0.47 0.00 0.00 55.73 55.90 3dl5 s ARG 254 Cb -0.29 0.31 0.01 0.00 -0.57 0.00 0.00 34.95 34.41 3dl5 s ARG 254 CO 0.26 -0.16 1.07 -1.83 -1.08 0.00 0.00 175.30 173.56 3dl5 s GLU 255 N -0.76 2.89 0.23 3.89 1.03 -1.26 -1.70 118.70 123.03 3dl5 s GLU 255 Ca -0.08 0.76 -0.21 0.00 0.03 0.00 0.00 54.97 55.46 3dl5 s GLU 255 Cb -0.04 -2.00 0.04 0.00 -0.80 0.00 0.00 34.13 31.33 3dl5 s GLU 255 CO 0.04 -1.08 0.67 0.54 -1.33 0.00 0.00 175.26 174.09 3dl5 s ASN 256 N -4.00 -0.36 0.54 0.83 2.20 -1.26 -4.91 114.94 107.99 3dl5 s ASN 256 Ca 0.58 -0.40 0.45 0.00 -0.94 0.00 0.00 52.86 52.54 3dl5 s ASN 256 Cb -0.13 0.68 1.66 0.00 -2.00 0.00 0.00 41.25 41.46 3dl5 s ASN 256 CO 0.54 -1.20 1.64 0.08 -2.94 0.00 0.00 177.10 175.22 3dl5 h ARG 257 N 2.01 0.01 0.00 3.55 0.11 -1.98 0.09 114.38 118.17 3dl5 h ARG 257 Ca -0.25 -0.00 -0.03 0.00 0.10 0.00 0.00 59.98 59.81 3dl5 h ARG 257 Cb 1.27 -0.00 -0.00 0.00 1.11 0.00 0.00 29.97 32.34 3dl5 h ARG 257 CO 0.29 0.01 -0.13 1.79 0.10 0.00 0.00 179.97 182.03 3dl5 h THR 258 N 0.01 0.25 0.00 0.08 1.35 -1.93 -3.47 112.91 109.20 3dl5 h THR 258 Ca 0.83 -1.12 0.00 0.00 -0.55 0.00 0.00 66.41 65.57 3dl5 h THR 258 Cb 3.26 1.92 0.00 0.00 -1.73 0.00 0.00 68.15 71.60 3dl5 h THR 258 CO -0.06 0.13 0.00 0.61 -0.25 0.00 0.00 175.52 175.95 3dl5 n GLY 259 N 0.70 0.91 3.17 5.82 0.00 0.02 -4.85 105.19 110.96 3dl5 n GLY 259 Ca 0.02 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.69 3dl5 n GLY 259 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3dl5 s ILE 260 N -2.90 3.06 0.82 -0.61 1.01 -1.26 -4.96 121.20 116.36 3dl5 s ILE 260 Ca 0.00 -1.48 -0.10 0.00 0.00 0.00 0.00 60.65 59.07 3dl5 s ILE 260 Cb 0.00 -2.81 0.09 0.00 0.01 0.00 0.00 42.46 39.74 3dl5 s ILE 260 CO 0.00 -0.20 1.11 -0.44 0.00 0.00 0.00 174.94 175.41 3dl5 s SER 261 N 1.33 3.94 0.38 3.58 0.01 -1.26 -4.65 113.70 117.03 3dl5 s SER 261 Ca -0.03 1.94 0.04 0.00 1.31 0.00 0.00 55.95 59.21 3dl5 s SER 261 Cb -0.20 -2.53 -0.03 0.00 0.21 0.00 0.00 66.02 63.46 3dl5 s SER 261 CO -0.01 -2.42 0.11 0.42 0.41 0.00 0.00 173.24 171.75 3dl5 s THR 262 N -2.82 0.70 -0.23 1.44 -4.23 -0.69 -1.04 115.64 108.78 3dl5 s THR 262 Ca 0.63 -2.00 -0.01 0.00 -1.18 0.00 0.00 61.69 59.13 3dl5 s THR 262 Cb -0.19 -2.46 0.02 0.00 1.34 0.00 0.00 72.50 71.21 3dl5 s THR 262 CO 0.57 0.00 -0.09 -0.31 -0.54 0.00 0.00 174.62 174.24 3dl5 s TYR 263 N -3.27 2.98 -0.06 3.99 2.02 -1.03 -1.52 117.35 120.45 3dl5 s TYR 263 Ca 0.27 -1.47 0.05 0.00 -0.37 0.00 0.00 57.07 55.55 3dl5 s TYR 263 Cb 0.04 -2.03 -0.00 0.00 -0.40 0.00 0.00 41.96 39.57 3dl5 s TYR 263 CO 0.15 -0.71 -0.20 0.45 -1.57 0.00 0.00 175.55 173.66 3dl5 s SER 264 N 1.34 2.55 0.25 2.29 0.15 -0.22 -2.52 113.70 117.54 3dl5 s SER 264 Ca 0.02 -0.43 0.11 0.00 0.70 0.00 0.00 55.95 56.35 3dl5 s SER 264 Cb -0.15 -0.81 -0.05 0.00 -1.71 0.00 0.00 66.02 63.30 3dl5 s SER 264 CO -0.06 0.17 -0.19 0.27 1.20 0.00 0.00 173.24 174.63 3dl5 s ILE 265 N 0.07 2.25 -0.18 6.45 -4.36 -0.64 -1.78 121.20 123.00 3dl5 s ILE 265 Ca -0.07 -2.30 -0.01 0.00 -0.26 0.00 0.00 60.65 58.01 3dl5 s ILE 265 Cb -0.13 -2.20 -0.00 0.00 1.25 0.00 0.00 42.46 41.38 3dl5 s ILE 265 CO 0.04 -0.42 -0.12 0.12 0.24 0.00 0.00 174.94 174.80 3dl5 s PHE 266 N -2.52 2.86 0.00 1.37 5.36 -1.26 -0.89 117.98 122.90 3dl5 s PHE 266 Ca 0.27 -1.09 0.00 0.00 -0.96 0.00 0.00 56.93 55.15 3dl5 s PHE 266 Cb -0.04 -1.98 0.00 0.00 -0.34 0.00 0.00 43.02 40.66 3dl5 s PHE 266 CO 0.12 -0.55 0.00 0.41 -1.46 0.00 0.00 175.22 173.74 3dl5 n GLY 267 N 4.42 -0.07 3.74 13.12 0.00 0.14 -5.00 105.19 121.55 3dl5 n GLY 267 Ca -0.19 -0.34 -0.33 0.00 0.00 0.00 0.00 46.02 45.16 3dl5 n GLY 267 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3dl5 s GLN 268 N -1.59 2.18 0.04 1.61 -1.52 0.11 -4.95 119.66 115.54 3dl5 s GLN 268 Ca 0.00 -2.40 -0.11 0.00 -1.95 0.00 0.00 55.36 50.90 3dl5 s GLN 268 Cb 0.00 -1.41 0.01 0.00 -0.22 0.00 0.00 33.01 31.39 3dl5 s GLN 268 CO 0.00 -0.40 0.24 1.41 -0.25 0.00 0.00 175.29 176.29 3dl5 s MET 269 N -3.86 0.75 -0.14 2.91 -2.45 -1.26 -0.82 119.30 114.42 3dl5 s MET 269 Ca 0.06 -0.59 -0.09 0.00 -1.25 0.00 0.00 55.69 53.82 3dl5 s MET 269 Cb 0.01 0.32 0.05 0.00 1.25 0.00 0.00 34.83 36.46 3dl5 s MET 269 CO 0.03 -0.23 0.35 -1.64 1.05 0.00 0.00 175.02 174.58 3dl5 s MET 270 N -2.63 0.34 0.13 4.11 -1.94 -0.51 -4.98 119.30 113.82 3dl5 s MET 270 Ca -0.04 0.65 0.09 0.00 -1.71 0.00 0.00 55.69 54.68 3dl5 s MET 270 Cb -0.01 -0.01 -0.04 0.00 2.01 0.00 0.00 34.83 36.79 3dl5 s MET 270 CO -0.04 -0.14 -0.19 1.03 -0.01 0.00 0.00 175.02 175.67 3dl5 s ARG 271 N 1.11 1.74 -0.05 2.03 0.52 -1.26 -0.16 118.95 122.88 3dl5 s ARG 271 Ca -0.07 -1.23 -0.07 0.00 -0.52 0.00 0.00 55.73 53.84 3dl5 s ARG 271 Cb -0.08 -2.07 0.01 0.00 0.52 0.00 0.00 34.95 33.33 3dl5 s ARG 271 CO -0.09 0.47 0.18 -0.06 0.02 0.00 0.00 175.30 175.82 3dl5 s PHE 272 N -1.20 -0.13 0.10 -0.53 0.08 0.22 -4.85 117.98 111.66 3dl5 s PHE 272 Ca 0.18 0.31 -0.11 0.00 0.12 0.00 0.00 56.93 57.43 3dl5 s PHE 272 Cb -0.10 0.04 -0.06 0.00 -0.57 0.00 0.00 43.02 42.32 3dl5 s PHE 272 CO 0.10 -0.17 0.45 0.34 -0.10 0.00 0.00 175.22 175.84 3dl5 s ASP 273 N -0.40 6.70 0.00 1.36 -1.08 -1.26 0.16 116.67 122.16 3dl5 s ASP 273 Ca -0.05 0.89 0.00 0.00 -0.52 0.00 0.00 52.55 52.87 3dl5 s ASP 273 Cb -0.03 -2.22 0.00 0.00 -1.46 0.00 0.00 42.92 39.21 3dl5 s ASP 273 CO 0.01 0.15 0.28 0.23 0.52 0.00 0.00 175.17 176.36 3dl5 n MET 274 N 0.88 0.55 0.05 4.34 2.81 -0.53 -4.52 117.12 120.70 3dl5 n MET 274 Ca -0.07 -0.28 -0.13 0.00 -1.81 0.00 0.00 57.70 55.41 3dl5 n MET 274 Cb 0.52 -0.75 -0.09 0.00 -0.71 0.00 0.00 33.22 32.19 3dl5 n MET 274 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 3dl5 h ARG 275 N 0.00 -0.16 -0.01 0.03 3.08 -1.69 -3.35 114.38 112.30 3dl5 h ARG 275 Ca 0.00 0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.06 3dl5 h ARG 275 Cb 0.11 0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.19 3dl5 h ARG 275 CO 0.00 0.26 -0.59 0.39 -1.07 0.00 0.00 179.97 178.95 3dl5 n GLU 276 N -4.96 0.48 -3.87 0.04 -0.58 -1.26 -4.97 120.64 105.52 3dl5 n GLU 276 Ca -0.09 -0.35 -0.03 0.00 -0.42 0.00 0.00 57.16 56.27 3dl5 n GLU 276 Cb 0.25 -1.49 0.02 0.00 -0.57 0.00 0.00 31.44 29.64 3dl5 n GLU 276 CO 0.00 0.00 0.00 -1.54 -0.48 0.00 0.00 177.13 175.11 3dl5 s SER 277 N -2.76 -0.01 -0.21 1.62 1.04 -1.26 -3.40 113.70 108.72 3dl5 s SER 277 Ca 0.15 -0.66 -0.02 0.00 0.48 0.00 0.00 55.95 55.90 3dl5 s SER 277 Cb 0.18 0.50 0.00 0.00 0.10 0.00 0.00 66.02 66.80 3dl5 s SER 277 CO 0.68 -0.99 -0.09 0.12 0.98 0.00 0.00 173.24 173.94 3dl5 s PHE 278 N -2.27 2.90 -0.59 5.02 5.36 -0.78 -4.07 117.98 123.55 3dl5 s PHE 278 Ca 0.21 -1.15 -0.13 0.00 -0.96 0.00 0.00 56.93 54.90 3dl5 s PHE 278 Cb -0.02 -2.05 -0.12 0.00 -0.34 0.00 0.00 43.02 40.49 3dl5 s PHE 278 CO 0.05 -0.62 1.79 -0.35 -1.46 0.00 0.00 175.22 174.63 3dl5 n PRO 279 N 4.73 1.27 -3.61 10.12 -0.04 -1.26 -3.97 135.00 142.23 3dl5 n PRO 279 Ca -0.19 -1.36 -0.40 0.00 -0.04 0.00 0.00 63.50 61.51 3dl5 n PRO 279 Cb 0.51 -2.53 -0.11 0.00 -0.04 0.00 0.00 33.50 31.32 3dl5 n PRO 279 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 3dl5 s LEU 280 N 0.41 4.51 0.18 1.53 2.96 -1.26 -4.26 118.68 122.75 3dl5 s LEU 280 Ca 0.42 -0.80 -0.31 0.00 -0.22 0.00 0.00 54.13 53.22 3dl5 s LEU 280 Cb 0.10 -2.03 -0.16 0.00 0.50 0.00 0.00 46.19 44.60 3dl5 s LEU 280 CO 0.07 -0.31 0.93 0.18 -1.32 0.00 0.00 176.35 175.90 3dl5 n LEU 281 N 5.01 0.54 -0.07 -0.68 4.77 -1.26 -4.65 117.00 120.65 3dl5 n LEU 281 Ca -0.12 1.15 -0.04 0.00 -0.03 0.00 0.00 56.01 56.97 3dl5 n LEU 281 Cb 0.47 -1.11 -0.15 0.00 -2.33 0.00 0.00 43.42 40.31 3dl5 n LEU 281 CO 0.36 -1.90 -0.99 0.35 -1.33 0.00 0.00 177.39 173.87 3dl5 n THR 282 N 0.82 0.90 0.15 -5.08 -2.24 -1.26 -4.40 114.28 103.16 3dl5 n THR 282 Ca 0.16 -0.68 0.01 0.00 -2.27 0.00 0.00 64.05 61.27 3dl5 n THR 282 Cb 0.24 -0.36 0.07 0.00 -2.10 0.00 0.00 70.33 68.18 3dl5 n THR 282 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 3dl5 n THR 283 N -2.53 0.53 -3.52 4.28 -2.24 -1.26 0.11 114.28 109.64 3dl5 n THR 283 Ca -0.22 0.13 -0.13 0.00 -2.27 0.00 0.00 64.05 61.56 3dl5 n THR 283 Cb 0.93 -1.09 -0.04 0.00 -2.10 0.00 0.00 70.33 68.03 3dl5 n THR 283 CO 0.00 0.00 0.00 -1.59 -0.57 0.00 0.00 175.07 172.91 3dl5 s LYS 284 N -2.29 0.90 -0.20 -0.78 -2.85 -1.26 -4.59 119.74 108.66 3dl5 s LYS 284 Ca 0.03 0.03 -0.29 0.00 -1.00 0.00 0.00 55.97 54.74 3dl5 s LYS 284 Cb 0.02 0.42 -0.01 0.00 -2.06 0.00 0.00 37.83 36.20 3dl5 s LYS 284 CO 0.04 -0.32 1.24 0.21 0.10 0.00 0.00 175.35 176.62 3dl5 s LYS 285 N -1.84 4.17 -0.15 1.78 2.20 -0.64 -4.62 119.74 120.63 3dl5 s LYS 285 Ca -0.04 1.54 -0.06 0.00 -0.36 0.00 0.00 55.97 57.05 3dl5 s LYS 285 Cb -0.00 -3.77 -0.04 0.00 -1.51 0.00 0.00 37.83 32.50 3dl5 s LYS 285 CO 0.01 -0.79 0.07 0.08 -0.36 0.00 0.00 175.35 174.36 3dl5 s VAL 286 N 3.65 4.85 -0.83 4.02 1.01 -1.26 -4.69 120.40 127.15 3dl5 s VAL 286 Ca 0.54 -0.02 -0.18 0.00 0.00 0.00 0.00 61.98 62.31 3dl5 s VAL 286 Cb -0.20 -3.15 0.14 0.00 0.00 0.00 0.00 36.38 33.18 3dl5 s VAL 286 CO 0.15 0.52 0.97 -0.36 0.00 0.00 0.00 175.10 176.38 3dl5 s PHE 287 N -0.13 3.20 -0.78 5.22 0.40 -1.26 -4.86 117.98 119.78 3dl5 s PHE 287 Ca 0.07 -1.38 0.26 0.00 -0.60 0.00 0.00 56.93 55.28 3dl5 s PHE 287 Cb -0.12 -4.14 0.72 0.00 0.51 0.00 0.00 43.02 39.99 3dl5 s PHE 287 CO 0.01 -1.36 1.63 1.51 0.70 0.00 0.00 175.22 177.71 3dl5 n ILE 288 N 5.21 0.36 0.24 0.64 3.06 -1.26 -2.28 119.36 125.33 3dl5 n ILE 288 Ca 0.14 -0.20 0.11 0.00 -2.50 0.00 0.00 62.75 60.30 3dl5 n ILE 288 Cb 0.47 -0.35 0.72 0.00 0.54 0.00 0.00 39.64 41.02 3dl5 n ILE 288 CO 0.00 0.00 0.00 -0.09 -2.50 0.00 0.00 176.55 173.96 3dl5 h ARG 289 N 0.00 0.00 0.00 9.51 2.43 -2.01 -2.88 114.38 121.43 3dl5 h ARG 289 Ca 0.00 0.00 -0.24 0.00 -0.81 0.00 0.00 59.98 58.93 3dl5 h ARG 289 Cb 0.67 0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 30.18 3dl5 h ARG 289 CO 0.00 0.00 -1.70 0.43 -1.51 0.00 0.00 179.97 177.19 3dl5 n SER 290 N -4.31 0.69 -0.03 -3.80 7.64 -0.97 -3.17 113.62 109.67 3dl5 n SER 290 Ca -0.02 0.32 -0.15 0.00 1.01 0.00 0.00 58.87 60.03 3dl5 n SER 290 Cb 0.15 0.30 -0.10 0.00 -1.01 0.00 0.00 64.21 63.54 3dl5 n SER 290 CO 0.00 0.00 0.00 0.40 -3.01 0.00 0.00 175.04 172.43 3dl5 h ILE 291 N 0.00 1.46 -0.22 0.44 2.04 -1.59 -2.22 117.51 117.42 3dl5 h ILE 291 Ca -0.26 -1.71 -0.02 0.00 1.00 0.00 0.00 64.86 63.87 3dl5 h ILE 291 Cb 1.82 2.42 -0.01 0.00 -0.74 0.00 0.00 36.82 40.31 3dl5 h ILE 291 CO 0.05 0.48 0.06 0.15 0.00 0.00 0.00 178.15 178.89 3dl5 h PHE 292 N -0.30 0.37 -0.88 1.37 3.57 -1.68 -1.56 116.94 117.83 3dl5 h PHE 292 Ca -0.02 -0.04 0.05 0.00 3.53 0.00 0.00 57.97 61.49 3dl5 h PHE 292 Cb 0.91 -0.10 -0.05 0.00 2.79 0.00 0.00 35.95 39.49 3dl5 h PHE 292 CO 0.14 0.45 0.58 1.49 -2.23 0.00 0.00 178.31 178.74 3dl5 h GLU 293 N 0.18 1.03 0.00 1.11 4.57 -1.62 0.51 114.58 120.35 3dl5 h GLU 293 Ca 0.07 -0.06 -0.11 0.00 -1.18 0.00 0.00 59.36 58.08 3dl5 h GLU 293 Cb 0.26 -0.23 -0.02 0.00 -0.16 0.00 0.00 28.75 28.61 3dl5 h GLU 293 CO -0.00 0.68 -0.50 1.49 -1.18 0.00 0.00 179.01 179.50 3dl5 h GLU 294 N 1.06 0.00 0.25 1.92 4.81 -1.28 -2.87 114.58 118.46 3dl5 h GLU 294 Ca 0.36 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.58 3dl5 h GLU 294 Cb 0.10 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.48 3dl5 h GLU 294 CO -0.12 0.50 -0.12 1.25 -0.73 0.00 0.00 179.01 179.79 3dl5 h LEU 295 N 0.00 -0.28 -1.44 1.64 6.46 0.11 -1.07 115.31 120.73 3dl5 h LEU 295 Ca -0.01 -0.23 -0.06 0.00 -0.12 0.00 0.00 57.88 57.47 3dl5 h LEU 295 Cb 1.06 0.07 -0.01 0.00 -0.73 0.00 0.00 40.66 41.06 3dl5 h LEU 295 CO 0.07 0.11 -0.28 0.16 -0.62 0.00 0.00 178.44 177.88 3dl5 h ILE 296 N -0.72 1.00 -0.97 4.05 -0.00 -1.34 0.25 117.51 119.77 3dl5 h ILE 296 Ca -0.03 -1.02 0.02 0.00 -0.00 0.00 0.00 64.86 63.83 3dl5 h ILE 296 Cb 0.49 1.58 -0.05 0.00 -0.00 0.00 0.00 36.82 38.84 3dl5 h ILE 296 CO 0.06 0.27 0.64 -0.25 -0.00 0.00 0.00 178.15 178.87 3dl5 h TRP 297 N 0.00 1.21 0.19 0.16 7.01 -1.40 0.37 115.95 123.48 3dl5 h TRP 297 Ca -0.00 0.03 -0.01 0.00 2.11 0.00 0.00 58.89 61.02 3dl5 h TRP 297 Cb 0.56 -0.41 0.00 0.00 -2.10 0.00 0.00 29.16 27.21 3dl5 h TRP 297 CO 0.00 0.74 -0.09 0.74 -2.79 0.00 0.00 178.44 177.04 3dl5 h PHE 298 N 1.29 -0.23 -1.04 2.65 0.04 0.29 -1.94 116.94 118.00 3dl5 h PHE 298 Ca 0.37 -0.01 0.29 0.00 2.80 0.00 0.00 57.97 61.42 3dl5 h PHE 298 Cb -0.09 0.08 -0.13 0.00 2.20 0.00 0.00 35.95 38.01 3dl5 h PHE 298 CO -0.00 0.18 0.62 0.82 -0.60 0.00 0.00 178.31 179.33 3dl5 h ILE 299 N -0.84 0.43 0.00 -0.55 2.04 -0.03 0.66 117.51 119.22 3dl5 h ILE 299 Ca -0.03 -0.15 0.00 0.00 1.00 0.00 0.00 64.86 65.69 3dl5 h ILE 299 Cb 0.52 -0.03 0.00 0.00 -0.74 0.00 0.00 36.82 36.57 3dl5 h ILE 299 CO 0.04 0.08 0.00 0.29 0.00 0.00 0.00 178.15 178.56 3dl5 n LYS 300 N -4.87 0.62 -1.40 2.37 5.02 0.12 -4.88 118.16 115.15 3dl5 n LYS 300 Ca 0.29 0.01 -0.07 0.00 -2.02 0.00 0.00 58.31 56.51 3dl5 n LYS 300 Cb 0.90 -1.50 -0.03 0.00 -0.02 0.00 0.00 35.03 34.39 3dl5 n LYS 300 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3dl5 n GLY 301 N 1.10 0.76 3.73 0.72 0.00 0.23 -5.00 105.19 106.73 3dl5 n GLY 301 Ca 0.17 -0.70 -0.40 0.00 0.00 0.00 0.00 46.02 45.09 3dl5 n GLY 301 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3dl5 s ASP 302 N -2.87 7.27 -0.01 1.61 -1.08 -0.73 -3.79 116.67 117.06 3dl5 s ASP 302 Ca 0.00 1.52 0.02 0.00 -0.52 0.00 0.00 52.55 53.57 3dl5 s ASP 302 Cb 0.00 -2.50 0.03 0.00 -1.46 0.00 0.00 42.92 38.99 3dl5 s ASP 302 CO 0.00 -0.04 0.99 0.35 0.52 0.00 0.00 175.17 176.99 3dl5 n THR 303 N 3.01 1.04 -3.00 1.71 -2.24 -1.26 -4.53 114.28 109.00 3dl5 n THR 303 Ca -0.00 -1.07 -0.43 0.00 -2.27 0.00 0.00 64.05 60.27 3dl5 n THR 303 Cb 0.50 0.45 -0.05 0.00 -2.10 0.00 0.00 70.33 69.13 3dl5 n THR 303 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 3dl5 s ASN 304 N -1.14 6.28 0.00 3.42 3.84 -1.26 -3.11 114.94 122.97 3dl5 s ASN 304 Ca 0.03 -0.64 0.08 0.00 0.21 0.00 0.00 52.86 52.54 3dl5 s ASN 304 Cb 0.03 -2.36 0.36 0.00 -0.55 0.00 0.00 41.25 38.73 3dl5 s ASN 304 CO 0.00 -1.05 1.18 0.61 -2.79 0.00 0.00 177.10 175.05 3dl5 n GLY 305 N 5.15 -0.66 0.17 1.21 0.00 -0.99 -2.40 105.19 107.67 3dl5 n GLY 305 Ca -0.03 -0.03 -0.11 0.00 0.00 0.00 0.00 46.02 45.85 3dl5 n GLY 305 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 3dl5 h ASN 306 N 0.00 0.53 -0.10 1.61 2.35 -1.91 -2.63 115.58 115.43 3dl5 h ASN 306 Ca 0.00 -0.36 0.03 0.00 -0.55 0.00 0.00 56.30 55.41 3dl5 h ASN 306 Cb 0.10 -0.16 -0.00 0.00 0.05 0.00 0.00 38.32 38.31 3dl5 h ASN 306 CO 0.00 1.12 0.07 0.45 -1.65 0.00 0.00 177.43 177.42 3dl5 h HIS 307 N 0.29 0.01 0.05 1.19 3.86 -1.90 0.31 115.15 118.96 3dl5 h HIS 307 Ca -0.04 0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 59.16 3dl5 h HIS 307 Cb 1.37 -0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.84 3dl5 h HIS 307 CO 0.05 0.01 -0.03 -0.07 0.86 0.00 0.00 177.93 178.75 3dl5 h LEU 308 N 0.01 -0.06 -1.65 2.43 4.07 -1.69 -3.13 115.31 115.29 3dl5 h LEU 308 Ca 0.05 -0.53 0.16 0.00 0.08 0.00 0.00 57.88 57.64 3dl5 h LEU 308 Cb 0.17 0.02 -0.05 0.00 1.08 0.00 0.00 40.66 41.88 3dl5 h LEU 308 CO -0.00 0.65 0.51 0.40 -1.08 0.00 0.00 178.44 178.92 3dl5 h ILE 309 N -0.93 0.76 0.00 1.22 2.04 -1.06 0.16 117.51 119.69 3dl5 h ILE 309 Ca -0.01 -0.12 -0.04 0.00 1.00 0.00 0.00 64.86 65.70 3dl5 h ILE 309 Cb 0.59 0.39 -0.01 0.00 -0.74 0.00 0.00 36.82 37.05 3dl5 h ILE 309 CO 0.01 0.06 -0.19 -0.33 0.00 0.00 0.00 178.15 177.71 3dl5 h GLU 310 N 0.34 0.00 -0.78 2.37 5.08 -0.42 -0.38 114.58 120.79 3dl5 h GLU 310 Ca 0.37 0.00 -0.21 0.00 -1.00 0.00 0.00 59.36 58.52 3dl5 h GLU 310 Cb 0.96 0.00 -0.13 0.00 0.50 0.00 0.00 28.75 30.09 3dl5 h GLU 310 CO -0.11 0.19 0.27 1.63 -1.00 0.00 0.00 179.01 179.99 3dl5 n LYS 311 N -3.97 3.62 -3.88 2.33 5.02 0.49 -4.91 118.16 116.85 3dl5 n LYS 311 Ca -0.02 -2.93 -0.30 0.00 -2.02 0.00 0.00 58.31 53.05 3dl5 n LYS 311 Cb 0.27 -2.18 0.03 0.00 -0.02 0.00 0.00 35.03 33.13 3dl5 n LYS 311 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 3dl5 n LYS 312 N -0.12 -5.80 -4.04 1.97 5.02 -0.15 -4.98 118.16 110.06 3dl5 n LYS 312 Ca 0.39 0.62 -0.33 0.00 -2.02 0.00 0.00 58.31 56.98 3dl5 n LYS 312 Cb 1.35 -5.53 -0.15 0.00 -0.02 0.00 0.00 35.03 30.68 3dl5 n LYS 312 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3dl5 s VAL 313 N -3.31 2.37 -1.01 -0.18 1.01 -0.83 -5.00 120.40 113.45 3dl5 s VAL 313 Ca 0.65 -1.42 0.16 0.00 0.00 0.00 0.00 61.98 61.38 3dl5 s VAL 313 Cb -0.32 -2.31 0.57 0.00 0.00 0.00 0.00 36.38 34.32 3dl5 s VAL 313 CO 0.82 0.07 1.49 -1.22 0.00 0.00 0.00 175.10 176.26 3dl5 n TYR 314 N 4.52 1.06 0.23 5.22 4.01 -1.26 -2.87 117.16 128.06 3dl5 n TYR 314 Ca -0.15 -0.61 0.15 0.00 -0.16 0.00 0.00 57.90 57.13 3dl5 n TYR 314 Cb 0.44 -0.17 0.81 0.00 -0.31 0.00 0.00 39.34 40.11 3dl5 n TYR 314 CO 0.00 0.00 0.00 -0.84 -0.46 0.00 0.00 176.86 175.56 3dl5 h ILE 315 N 3.17 0.00 -0.19 -0.72 3.07 -1.97 -2.18 117.51 118.71 3dl5 h ILE 315 Ca 0.00 0.00 0.00 0.00 1.55 0.00 0.00 64.86 66.41 3dl5 h ILE 315 Cb 1.20 0.66 0.00 0.00 -0.27 0.00 0.00 36.82 38.42 3dl5 h ILE 315 CO 0.14 0.00 0.00 0.79 -1.05 0.00 0.00 178.15 178.03 3dl5 n TRP 316 N -2.56 0.24 -0.00 0.16 7.02 -1.26 -4.64 117.44 116.40 3dl5 n TRP 316 Ca -0.02 -0.25 -0.11 0.00 -1.02 0.00 0.00 57.50 56.10 3dl5 n TRP 316 Cb 0.06 -0.01 -0.05 0.00 -2.42 0.00 0.00 31.31 28.89 3dl5 n TRP 316 CO 0.00 0.00 0.00 0.77 -2.02 0.00 0.00 177.69 176.44 3dl5 h SER 317 N 2.14 0.06 -0.56 -0.99 0.02 -1.73 -2.85 113.55 109.64 3dl5 h SER 317 Ca 0.00 0.01 0.11 0.00 -0.84 0.00 0.00 61.79 61.07 3dl5 h SER 317 Cb 0.60 -0.00 -0.09 0.00 0.14 0.00 0.00 62.40 63.05 3dl5 h SER 317 CO 0.00 0.05 0.04 1.23 -1.14 0.00 0.00 176.83 177.01 3dl5 h GLY 318 N 0.11 0.63 -2.69 -3.77 0.00 -1.82 0.53 103.07 96.05 3dl5 h GLY 318 Ca 0.04 0.04 -0.12 0.00 0.00 0.00 0.00 47.33 47.30 3dl5 h GLY 318 CO -0.04 -0.15 0.15 0.70 0.00 0.00 0.00 176.54 177.20 3dl5 n ASN 319 N -5.22 3.54 0.00 0.19 4.13 -1.17 -3.69 115.26 113.05 3dl5 n ASN 319 Ca 0.08 -2.67 0.00 0.00 1.68 0.00 0.00 54.58 53.67 3dl5 n ASN 319 Cb 0.31 -0.64 0.00 0.00 -1.54 0.00 0.00 39.78 37.91 3dl5 n ASN 319 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3dl5 n GLY 320 N 0.04 0.00 3.35 7.41 0.00 0.07 -4.84 105.19 111.22 3dl5 n GLY 320 Ca 0.22 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.89 3dl5 n GLY 320 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3dl5 n SER 321 N -1.18 -2.54 -0.05 1.61 3.41 -0.58 -4.16 113.62 110.13 3dl5 n SER 321 Ca 0.00 0.42 -0.08 0.00 -0.26 0.00 0.00 58.87 58.95 3dl5 n SER 321 Cb 0.07 -1.11 -0.02 0.00 -0.26 0.00 0.00 64.21 62.89 3dl5 n SER 321 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 3dl5 h LYS 322 N -0.93 0.14 0.56 4.33 1.57 -1.93 -2.51 116.57 117.80 3dl5 h LYS 322 Ca -0.44 -0.01 -0.02 0.00 -1.87 0.00 0.00 60.65 58.31 3dl5 h LYS 322 Cb 1.32 -0.03 -0.00 0.00 0.08 0.00 0.00 32.23 33.60 3dl5 h LYS 322 CO 0.36 0.09 -0.32 0.93 -0.57 0.00 0.00 179.45 179.94 3dl5 h GLU 323 N 0.14 -0.79 -0.01 3.15 3.07 -1.97 0.25 114.58 118.41 3dl5 h GLU 323 Ca 0.10 0.05 0.02 0.00 -0.50 0.00 0.00 59.36 59.03 3dl5 h GLU 323 Cb 0.09 0.18 -0.02 0.00 -0.84 0.00 0.00 28.75 28.16 3dl5 h GLU 323 CO -0.13 -0.53 -0.09 -0.92 -1.40 0.00 0.00 179.01 175.94 3dl5 h TYR 324 N -0.82 -0.24 -0.89 4.33 3.20 -1.87 1.26 116.97 121.94 3dl5 h TYR 324 Ca -0.07 0.01 0.16 0.00 3.14 0.00 0.00 58.73 61.97 3dl5 h TYR 324 Cb 0.66 0.11 -0.10 0.00 1.54 0.00 0.00 36.73 38.94 3dl5 h TYR 324 CO -0.07 -0.15 0.47 -0.07 -1.64 0.00 0.00 178.16 176.71 3dl5 h LEU 325 N -0.16 0.58 -0.34 2.82 4.07 -1.40 0.21 115.31 121.08 3dl5 h LEU 325 Ca 0.04 0.10 -0.08 0.00 0.08 0.00 0.00 57.88 58.01 3dl5 h LEU 325 Cb 0.21 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 41.94 3dl5 h LEU 325 CO -0.11 0.22 -0.11 -0.08 -1.08 0.00 0.00 178.44 177.28 3dl5 h GLU 326 N 0.65 0.69 -0.92 1.13 4.57 0.84 1.10 114.58 122.63 3dl5 h GLU 326 Ca 0.50 -0.28 0.03 0.00 -1.18 0.00 0.00 59.36 58.43 3dl5 h GLU 326 Cb 0.73 -0.03 -0.05 0.00 -0.16 0.00 0.00 28.75 29.24 3dl5 h GLU 326 CO -0.38 0.86 0.61 -0.09 -1.18 0.00 0.00 179.01 178.83 3dl5 h ARG 327 N 0.47 1.14 -0.62 1.92 2.43 0.33 -2.07 114.38 117.98 3dl5 h ARG 327 Ca 0.08 -0.07 0.00 0.00 -0.81 0.00 0.00 59.98 59.18 3dl5 h ARG 327 Cb 0.63 -0.26 0.00 0.00 -0.42 0.00 0.00 29.97 29.92 3dl5 h ARG 327 CO 0.04 0.76 0.00 0.44 -1.51 0.00 0.00 179.97 179.70 3dl5 n ILE 328 N -4.43 1.35 -0.96 1.20 -5.35 0.57 -4.93 119.36 106.81 3dl5 n ILE 328 Ca 0.12 -0.87 0.00 0.00 -0.27 0.00 0.00 62.75 61.72 3dl5 n ILE 328 Cb 0.08 0.03 0.00 0.00 -1.74 0.00 0.00 39.64 38.02 3dl5 n ILE 328 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3dl5 n GLY 329 N 0.94 0.52 0.99 3.28 0.00 -0.78 -4.95 105.19 105.19 3dl5 n GLY 329 Ca 0.19 -0.87 -0.02 0.00 0.00 0.00 0.00 46.02 45.32 3dl5 n GLY 329 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3dl5 n LEU 330 N 0.00 3.38 0.18 0.99 4.77 0.38 -4.80 117.00 121.89 3dl5 n LEU 330 Ca 0.00 -4.09 0.09 0.00 -0.03 0.00 0.00 56.01 51.97 3dl5 n LEU 330 Cb 0.07 -0.50 0.46 0.00 -2.33 0.00 0.00 43.42 41.11 3dl5 n LEU 330 CO 0.00 1.56 0.83 1.23 -1.33 0.00 0.00 177.39 179.68 3dl5 h GLY 331 N 1.27 0.00 2.00 -0.72 0.00 -1.73 -0.90 103.07 102.99 3dl5 h GLY 331 Ca 0.11 0.00 -0.18 0.00 0.00 0.00 0.00 47.33 47.25 3dl5 h GLY 331 CO 0.22 0.00 -0.88 1.12 0.00 0.00 0.00 176.54 177.00 3dl5 h HIS 332 N 0.00 0.00 -3.64 5.60 2.07 -1.90 -3.47 115.15 113.82 3dl5 h HIS 332 Ca 0.00 0.00 -0.51 0.00 -2.85 0.00 0.00 60.37 57.01 3dl5 h HIS 332 Cb 0.43 0.00 0.21 0.00 2.57 0.00 0.00 27.41 30.62 3dl5 h HIS 332 CO 0.00 0.88 -0.25 0.54 -3.07 0.00 0.00 177.93 176.03 3dl5 n ARG 333 N -3.43 -0.68 -2.15 5.12 5.12 -0.34 -5.01 116.66 115.29 3dl5 n ARG 333 Ca -0.00 -0.15 -0.29 0.00 -1.93 0.00 0.00 57.85 55.48 3dl5 n ARG 333 Cb 0.85 -2.08 0.02 0.00 -1.16 0.00 0.00 32.46 30.10 3dl5 n ARG 333 CO 0.00 0.00 0.00 -2.00 -1.93 0.00 0.00 177.63 173.70 3dl5 s GLU 334 N -4.09 3.25 0.37 5.56 2.12 -1.26 -4.94 118.70 119.71 3dl5 s GLU 334 Ca 0.62 0.40 0.27 0.00 0.36 0.00 0.00 54.97 56.62 3dl5 s GLU 334 Cb -0.21 -2.17 1.25 0.00 0.26 0.00 0.00 34.13 33.26 3dl5 s GLU 334 CO 0.63 -0.64 1.30 -1.91 -0.54 0.00 0.00 175.26 174.10 3dl5 n GLU 335 N -2.68 -0.03 -0.49 4.30 4.07 -1.26 -2.20 120.64 122.35 3dl5 n GLU 335 Ca 0.05 1.04 0.04 0.00 -0.06 0.00 0.00 57.16 58.23 3dl5 n GLU 335 Cb 0.56 -2.06 0.06 0.00 -0.06 0.00 0.00 31.44 29.93 3dl5 n GLU 335 CO 0.00 0.00 0.00 0.09 -0.06 0.00 0.00 177.13 177.16 3dl5 n ASN 336 N -4.35 0.96 -4.56 4.31 3.02 -1.26 -3.95 115.26 109.43 3dl5 n ASN 336 Ca 0.34 -2.47 -0.38 0.00 -0.03 0.00 0.00 54.58 52.04 3dl5 n ASN 336 Cb 1.32 -0.31 -0.03 0.00 -0.61 0.00 0.00 39.78 40.15 3dl5 n ASN 336 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3dl5 s ASP 337 N -1.86 5.98 0.00 6.41 3.68 -0.94 -2.36 116.67 127.59 3dl5 s ASP 337 Ca 0.16 -0.82 0.13 0.00 2.13 0.00 0.00 52.55 54.16 3dl5 s ASP 337 Cb 0.16 -2.56 0.67 0.00 -1.45 0.00 0.00 42.92 39.73 3dl5 s ASP 337 CO -0.01 -1.96 1.31 0.18 0.13 0.00 0.00 175.17 174.81 3dl5 n LEU 338 N 10.55 0.00 0.00 -1.34 4.77 -1.18 -4.77 117.00 125.03 3dl5 n LEU 338 Ca 0.25 0.24 0.00 0.00 -0.03 0.00 0.00 56.01 56.48 3dl5 n LEU 338 Cb 0.50 -0.24 0.00 0.00 -2.33 0.00 0.00 43.42 41.35 3dl5 n LEU 338 CO 0.67 -0.14 0.00 0.61 -1.33 0.00 0.00 177.39 177.20 3dl5 n GLY 339 N -0.20 -1.19 2.65 -0.72 0.00 -1.26 -1.42 105.19 103.05 3dl5 n GLY 339 Ca 0.07 -1.57 -0.10 0.00 0.00 0.00 0.00 46.02 44.42 3dl5 n GLY 339 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3dl5 n PRO 340 N -0.95 1.01 0.00 1.61 -0.04 -1.26 -4.86 135.00 130.51 3dl5 n PRO 340 Ca 0.00 -0.82 0.00 0.00 -0.04 0.00 0.00 63.50 62.64 3dl5 n PRO 340 Cb 0.00 -2.07 0.00 0.00 -0.04 0.00 0.00 33.50 31.39 3dl5 n PRO 340 CO 0.00 0.00 0.00 0.44 -0.04 0.00 0.00 175.50 175.90 3dl5 n ILE 341 N 4.03 0.00 -0.32 0.52 -5.35 -1.26 -4.36 119.36 112.62 3dl5 n ILE 341 Ca 0.22 0.00 -0.02 0.00 -0.27 0.00 0.00 62.75 62.68 3dl5 n ILE 341 Cb 0.14 -1.58 0.04 0.00 -1.74 0.00 0.00 39.64 36.50 3dl5 n ILE 341 CO 0.00 0.00 0.00 1.88 -1.76 0.00 0.00 176.55 176.67 3dl5 h TYR 342 N 0.00 -0.97 0.21 4.28 0.05 -1.91 -0.36 116.97 118.27 3dl5 h TYR 342 Ca 0.00 0.09 0.01 0.00 0.05 0.00 0.00 58.73 58.88 3dl5 h TYR 342 Cb 0.00 0.55 -0.03 0.00 1.01 0.00 0.00 36.73 38.26 3dl5 h TYR 342 CO 0.00 -0.40 -0.27 0.78 -1.05 0.00 0.00 178.16 177.22 3dl5 h GLY 343 N -0.05 -0.57 0.47 3.88 0.00 -1.80 -1.32 103.07 103.68 3dl5 h GLY 343 Ca 0.32 0.31 0.08 0.00 0.00 0.00 0.00 47.33 48.04 3dl5 h GLY 343 CO -0.88 -0.24 0.18 -2.75 0.00 0.00 0.00 176.54 172.85 3dl5 h PHE 344 N -0.54 0.31 -0.62 5.60 3.04 -1.17 -1.68 116.94 121.87 3dl5 h PHE 344 Ca 0.01 0.03 -0.06 0.00 3.98 0.00 0.00 57.97 61.92 3dl5 h PHE 344 Cb 0.52 -0.06 -0.03 0.00 2.56 0.00 0.00 35.95 38.94 3dl5 h PHE 344 CO -0.20 0.09 0.13 1.96 -2.02 0.00 0.00 178.31 178.27 3dl5 h GLN 345 N 0.35 0.99 -0.02 1.11 1.08 -1.21 0.95 115.11 118.36 3dl5 h GLN 345 Ca 0.26 -0.23 -0.00 0.00 -1.45 0.00 0.00 58.65 57.23 3dl5 h GLN 345 Cb 0.30 -0.13 -0.00 0.00 -0.05 0.00 0.00 27.48 27.59 3dl5 h GLN 345 CO -0.27 0.89 0.01 -1.49 -0.95 0.00 0.00 178.83 177.02 3dl5 h TRP 346 N 0.94 0.02 0.02 2.96 4.06 -0.59 -2.58 115.95 120.78 3dl5 h TRP 346 Ca 0.20 0.00 -0.29 0.00 2.06 0.00 0.00 58.89 60.86 3dl5 h TRP 346 Cb 0.36 -0.01 -0.04 0.00 -1.00 0.00 0.00 29.16 28.47 3dl5 h TRP 346 CO 0.02 0.05 -1.64 0.00 -3.56 0.00 0.00 178.44 173.31 3dl5 h ARG 347 N -0.01 0.05 -2.08 0.49 2.47 -1.20 -1.29 114.38 112.80 3dl5 h ARG 347 Ca 0.01 -0.08 -0.53 0.00 -1.26 0.00 0.00 59.98 58.12 3dl5 h ARG 347 Cb 0.03 0.03 -0.40 0.00 -1.65 0.00 0.00 29.97 27.98 3dl5 h ARG 347 CO -0.00 0.67 -1.01 0.72 0.56 0.00 0.00 179.97 180.92 3dl5 n HIS 348 N -3.16 1.21 -1.69 3.04 8.25 0.33 -2.97 115.22 120.23 3dl5 n HIS 348 Ca -0.16 -3.83 -0.44 0.00 -0.26 0.00 0.00 57.72 53.02 3dl5 n HIS 348 Cb 1.04 -0.43 -0.03 0.00 1.12 0.00 0.00 29.99 31.69 3dl5 n HIS 348 CO 0.00 0.00 0.00 0.98 0.64 0.00 0.00 176.34 177.96 3dl5 n TYR 349 N 0.47 2.32 -1.38 4.41 9.36 -0.23 -0.97 117.16 131.14 3dl5 n TYR 349 Ca 0.26 0.38 -0.13 0.00 3.32 0.00 0.00 57.90 61.73 3dl5 n TYR 349 Cb 0.55 -2.50 -0.06 0.00 -0.63 0.00 0.00 39.34 36.71 3dl5 n TYR 349 CO 0.00 0.00 0.00 0.09 0.22 0.00 0.00 176.86 177.17 3dl5 n ASN 350 N 2.26 -4.71 -4.80 2.98 3.02 -1.26 -0.84 115.26 111.92 3dl5 n ASN 350 Ca 0.11 0.32 -0.34 0.00 -0.03 0.00 0.00 54.58 54.64 3dl5 n ASN 350 Cb 0.32 -3.35 -0.04 0.00 -0.61 0.00 0.00 39.78 36.11 3dl5 n ASN 350 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 3dl5 s GLY 351 N -2.79 2.54 -0.42 7.41 0.00 -0.15 -4.71 107.32 109.20 3dl5 s GLY 351 Ca 0.00 0.62 -0.25 0.00 0.00 0.00 0.00 44.72 45.09 3dl5 s GLY 351 CO 0.00 0.95 0.89 1.85 0.00 0.00 0.00 173.10 176.79 3dl5 s GLU 352 N -3.13 3.65 -0.08 2.90 2.56 -1.26 -5.00 118.70 118.33 3dl5 s GLU 352 Ca 0.66 0.28 -0.27 0.00 0.00 0.00 0.00 54.97 55.63 3dl5 s GLU 352 Cb -0.17 -3.87 -0.02 0.00 2.00 0.00 0.00 34.13 32.07 3dl5 s GLU 352 CO 0.21 -1.07 0.89 -0.47 -0.56 0.00 0.00 175.26 174.25 3dl5 s TYR 353 N 3.52 3.55 0.00 5.30 5.04 -1.26 -4.99 117.35 128.50 3dl5 s TYR 353 Ca 0.36 1.46 0.00 0.00 -2.44 0.00 0.00 57.07 56.45 3dl5 s TYR 353 Cb -0.11 -3.04 0.00 0.00 0.35 0.00 0.00 41.96 39.16 3dl5 s TYR 353 CO 0.22 -0.10 0.00 1.63 -1.34 0.00 0.00 175.55 175.96 3dl5 n LYS 354 N 4.48 0.00 -4.21 4.97 5.02 -1.26 -5.06 118.16 122.10 3dl5 n LYS 354 Ca 0.05 0.00 -0.15 0.00 -2.02 0.00 0.00 58.31 56.19 3dl5 n LYS 354 Cb 0.50 0.00 -0.08 0.00 -0.02 0.00 0.00 35.03 35.42 3dl5 n LYS 354 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 3dl5 s THR 355 N 0.00 0.00 -1.23 -0.18 -4.23 -1.26 -5.02 115.64 103.72 3dl5 s THR 355 Ca 0.00 -1.92 0.22 0.00 -1.18 0.00 0.00 61.69 58.81 3dl5 s THR 355 Cb 0.00 -2.49 0.29 0.00 1.34 0.00 0.00 72.50 71.64 3dl5 s THR 355 CO 0.00 0.00 1.72 1.15 -0.54 0.00 0.00 174.62 176.95 3dl5 n MET 356 N -0.43 0.17 0.10 3.99 0.00 -1.26 -3.05 117.12 116.64 3dl5 n MET 356 Ca 0.04 0.10 0.12 0.00 0.00 0.00 0.00 57.70 57.95 3dl5 n MET 356 Cb 0.64 -1.50 0.13 0.00 0.00 0.00 0.00 33.22 32.49 3dl5 n MET 356 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 175.97 176.42 3dl5 h HIS 357 N 0.00 0.00 -4.20 3.17 3.86 -2.00 -3.45 115.15 112.53 3dl5 h HIS 357 Ca 0.00 0.00 -0.49 0.00 -1.16 0.00 0.00 60.37 58.72 3dl5 h HIS 357 Cb 0.29 0.00 0.06 0.00 1.06 0.00 0.00 27.41 28.82 3dl5 h HIS 357 CO 0.00 0.00 0.38 -0.51 0.86 0.00 0.00 177.93 178.66 3dl5 s ASP 358 N -4.93 5.88 -0.24 2.45 1.11 -1.17 -5.01 116.67 114.77 3dl5 s ASP 358 Ca 0.04 1.78 -0.20 0.00 0.18 0.00 0.00 52.55 54.35 3dl5 s ASP 358 Cb 0.11 -2.53 -0.02 0.00 1.07 0.00 0.00 42.92 41.55 3dl5 s ASP 358 CO 0.73 -1.10 0.62 -0.62 1.18 0.00 0.00 175.17 175.98 3dl5 s ASP 359 N -2.85 6.59 -0.15 0.27 2.15 -1.26 -4.93 116.67 116.49 3dl5 s ASP 359 Ca 0.63 0.72 0.16 0.00 0.43 0.00 0.00 52.55 54.49 3dl5 s ASP 359 Cb -0.15 -2.33 0.57 0.00 -0.30 0.00 0.00 42.92 40.70 3dl5 s ASP 359 CO 0.37 -0.33 1.48 -1.22 -0.17 0.00 0.00 175.17 175.29 3dl5 n TYR 360 N 5.51 1.13 -1.67 -5.34 4.01 -1.26 -4.97 117.16 114.56 3dl5 n TYR 360 Ca -0.01 -0.76 -0.49 0.00 -0.16 0.00 0.00 57.90 56.48 3dl5 n TYR 360 Cb 0.49 -0.29 -0.05 0.00 -0.31 0.00 0.00 39.34 39.18 3dl5 n TYR 360 CO 0.00 0.00 0.00 2.41 -0.46 0.00 0.00 176.86 178.81 3dl5 n THR 361 N 0.07 0.33 0.00 -0.72 -1.04 -1.26 -1.08 114.28 110.58 3dl5 n THR 361 Ca 0.21 -0.06 0.00 0.00 -2.04 0.00 0.00 64.05 62.17 3dl5 n THR 361 Cb 0.87 -1.60 0.00 0.00 -1.82 0.00 0.00 70.33 67.78 3dl5 n THR 361 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3dl5 n GLY 362 N 3.93 2.91 3.83 3.41 0.00 -1.26 -5.01 105.19 113.00 3dl5 n GLY 362 Ca 0.21 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.86 3dl5 n GLY 362 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3dl5 s VAL 363 N -2.71 4.80 0.03 1.61 0.11 -0.24 -4.93 120.40 119.07 3dl5 s VAL 363 Ca 0.00 1.03 0.00 0.00 -2.93 0.00 0.00 61.98 60.08 3dl5 s VAL 363 Cb 0.00 -3.81 0.00 0.00 -1.53 0.00 0.00 36.38 31.04 3dl5 s VAL 363 CO 0.00 0.41 0.00 0.61 -3.33 0.00 0.00 175.10 172.79 3dl5 n GLY 364 N 1.31 -1.81 3.66 6.54 0.00 -1.26 -4.48 105.19 109.15 3dl5 n GLY 364 Ca -0.08 -1.49 -0.40 0.00 0.00 0.00 0.00 46.02 44.05 3dl5 n GLY 364 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3dl5 s VAL 365 N -1.82 5.02 -0.78 1.61 1.01 -0.02 -4.70 120.40 120.72 3dl5 s VAL 365 Ca 0.00 1.19 -0.23 0.00 0.00 0.00 0.00 61.98 62.95 3dl5 s VAL 365 Cb 0.00 -3.95 0.07 0.00 0.00 0.00 0.00 36.38 32.50 3dl5 s VAL 365 CO 0.00 0.11 1.12 -0.62 0.00 0.00 0.00 175.10 175.71 3dl5 s ASP 366 N 1.20 6.31 0.14 3.32 3.68 -1.16 -1.06 116.67 129.09 3dl5 s ASP 366 Ca 0.29 -1.17 -0.07 0.00 2.13 0.00 0.00 52.55 53.73 3dl5 s ASP 366 Cb -0.16 -2.46 -0.06 0.00 -1.45 0.00 0.00 42.92 38.79 3dl5 s ASP 366 CO 0.10 -1.45 1.36 1.56 0.13 0.00 0.00 175.17 176.87 3dl5 h GLN 367 N 9.54 0.59 -0.44 4.34 4.20 -1.44 -2.66 115.11 129.23 3dl5 h GLN 367 Ca -0.13 -0.50 -0.04 0.00 0.06 0.00 0.00 58.65 58.04 3dl5 h GLN 367 Cb 1.05 0.11 -0.02 0.00 0.30 0.00 0.00 27.48 28.92 3dl5 h GLN 367 CO 1.22 1.12 0.14 1.25 -0.67 0.00 0.00 178.83 181.89 3dl5 h LEU 368 N 0.39 0.64 -0.32 1.46 5.85 -1.86 0.39 115.31 121.86 3dl5 h LEU 368 Ca -0.05 -0.21 0.00 0.00 0.84 0.00 0.00 57.88 58.46 3dl5 h LEU 368 Cb 1.39 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 42.24 3dl5 h LEU 368 CO 0.15 0.68 0.21 0.00 -0.34 0.00 0.00 178.44 179.13 3dl5 h ALA 369 N 0.99 0.41 -0.57 1.25 0.00 -1.87 -1.71 119.26 117.76 3dl5 h ALA 369 Ca 0.14 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.96 3dl5 h ALA 369 Cb 0.27 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.90 3dl5 h ALA 369 CO -0.00 -0.12 0.12 0.87 0.00 0.00 0.00 179.25 180.11 3dl5 h LYS 370 N 0.43 0.89 -0.06 0.00 1.57 -1.12 -1.27 116.57 117.00 3dl5 h LYS 370 Ca 0.12 -0.20 0.02 0.00 -1.87 0.00 0.00 60.65 58.72 3dl5 h LYS 370 Cb -0.03 -0.12 -0.03 0.00 0.08 0.00 0.00 32.23 32.13 3dl5 h LYS 370 CO -0.02 0.81 -0.08 1.25 -0.57 0.00 0.00 179.45 180.84 3dl5 h LEU 371 N 0.85 -0.25 -0.34 2.94 6.46 0.28 0.16 115.31 125.41 3dl5 h LEU 371 Ca 0.18 0.05 -0.01 0.00 -0.12 0.00 0.00 57.88 57.98 3dl5 h LEU 371 Cb 0.34 0.12 -0.02 0.00 -0.73 0.00 0.00 40.66 40.37 3dl5 h LEU 371 CO 0.00 -0.11 0.17 0.40 -0.62 0.00 0.00 178.44 178.28 3dl5 h ILE 372 N -0.11 1.16 0.00 4.05 2.04 -1.09 0.25 117.51 123.81 3dl5 h ILE 372 Ca 0.05 -0.45 -0.06 0.00 1.00 0.00 0.00 64.86 65.41 3dl5 h ILE 372 Cb 0.19 0.82 -0.01 0.00 -0.74 0.00 0.00 36.82 37.08 3dl5 h ILE 372 CO -0.13 0.17 -0.28 1.05 0.00 0.00 0.00 178.15 178.95 3dl5 h GLU 373 N 0.42 0.00 0.14 2.37 4.11 -0.91 -2.63 114.58 118.08 3dl5 h GLU 373 Ca 0.12 0.00 -0.28 0.00 0.07 0.00 0.00 59.36 59.27 3dl5 h GLU 373 Cb 0.11 0.00 0.03 0.00 0.50 0.00 0.00 28.75 29.39 3dl5 h GLU 373 CO -0.02 0.28 -1.19 1.15 0.07 0.00 0.00 179.01 179.31 3dl5 h THR 374 N 0.00 1.32 -0.51 -1.06 2.02 -0.08 -2.44 112.91 112.16 3dl5 h THR 374 Ca -0.00 -2.47 0.03 0.00 0.77 0.00 0.00 66.41 64.74 3dl5 h THR 374 Cb 0.51 2.80 -0.03 0.00 -1.74 0.00 0.00 68.15 69.69 3dl5 h THR 374 CO 0.04 0.74 0.34 -0.07 0.37 0.00 0.00 175.52 176.94 3dl5 h LEU 375 N 0.16 0.49 0.11 2.58 3.38 -0.35 0.89 115.31 122.57 3dl5 h LEU 375 Ca -0.19 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.77 3dl5 h LEU 375 Cb 1.88 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 42.52 3dl5 h LEU 375 CO 0.23 0.34 -0.05 0.11 0.09 0.00 0.00 178.44 179.15 3dl5 h LYS 376 N 0.57 -0.14 0.02 1.13 1.57 -1.52 -3.31 116.57 114.90 3dl5 h LYS 376 Ca 0.21 0.01 -0.00 0.00 -1.87 0.00 0.00 60.65 58.99 3dl5 h LYS 376 Cb 0.11 0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.45 3dl5 h LYS 376 CO -0.05 0.19 -0.01 -0.91 -0.57 0.00 0.00 179.45 178.10 3dl5 h ASN 377 N -0.98 -0.03 -4.15 0.86 2.35 -1.36 -3.39 115.58 108.88 3dl5 h ASN 377 Ca -0.02 -0.56 -0.64 0.00 -0.55 0.00 0.00 56.30 54.54 3dl5 h ASN 377 Cb 0.40 0.01 -0.41 0.00 0.05 0.00 0.00 38.32 38.37 3dl5 h ASN 377 CO 0.02 0.56 -0.66 0.21 -1.65 0.00 0.00 177.43 175.92 3dl5 s ASN 378 N -5.75 4.25 0.12 5.81 2.47 0.30 -4.96 114.94 117.16 3dl5 s ASN 378 Ca -0.16 -2.85 -0.10 0.00 0.42 0.00 0.00 52.86 50.17 3dl5 s ASN 378 Cb 0.01 -1.53 -0.12 0.00 -1.45 0.00 0.00 41.25 38.16 3dl5 s ASN 378 CO 0.65 -0.25 1.32 1.55 -3.72 0.00 0.00 177.10 176.65 3dl5 h PRO 379 N 6.67 0.70 -0.27 0.43 0.13 -1.65 -3.25 132.00 134.76 3dl5 h PRO 379 Ca -0.07 -0.59 0.00 0.00 -0.87 0.00 0.00 66.00 64.47 3dl5 h PRO 379 Cb 0.91 0.13 0.00 0.00 0.13 0.00 0.00 31.00 32.17 3dl5 h PRO 379 CO 0.64 1.20 0.00 1.63 -0.23 0.00 0.00 178.00 181.24 3dl5 n LYS 380 N -3.90 1.55 -2.10 0.86 5.02 -1.26 -4.05 118.16 114.29 3dl5 n LYS 380 Ca -0.07 -0.79 -0.40 0.00 -2.02 0.00 0.00 58.31 55.02 3dl5 n LYS 380 Cb 0.76 -1.21 -0.02 0.00 -0.02 0.00 0.00 35.03 34.54 3dl5 n LYS 380 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 3dl5 s ASP 381 N -0.94 6.65 -0.28 4.39 2.15 -1.23 -4.92 116.67 122.49 3dl5 s ASP 381 Ca 0.15 2.68 0.08 0.00 0.43 0.00 0.00 52.55 55.89 3dl5 s ASP 381 Cb 0.08 -2.65 0.64 0.00 -0.30 0.00 0.00 42.92 40.69 3dl5 s ASP 381 CO 0.10 -0.62 1.65 0.54 -0.17 0.00 0.00 175.17 176.66 3dl5 n ARG 382 N 0.61 3.37 -0.07 4.34 1.74 -1.26 -4.26 116.66 121.13 3dl5 n ARG 382 Ca 0.01 -2.61 0.08 0.00 -0.77 0.00 0.00 57.85 54.56 3dl5 n ARG 382 Cb 0.42 -2.09 0.12 0.00 -1.02 0.00 0.00 32.46 29.89 3dl5 n ARG 382 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 3dl5 n ARG 383 N -0.06 1.69 -2.08 5.56 3.00 -1.26 -4.93 116.66 118.58 3dl5 n ARG 383 Ca 0.35 -2.38 -0.28 0.00 -0.01 0.00 0.00 57.85 55.52 3dl5 n ARG 383 Cb 1.24 -1.42 -0.06 0.00 0.00 0.00 0.00 32.46 32.22 3dl5 n ARG 383 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.63 176.62 3dl5 s HIS 384 N -2.50 1.96 0.10 -1.55 3.76 -1.26 -4.88 115.29 110.92 3dl5 s HIS 384 Ca 0.26 0.42 0.10 0.00 -0.15 0.00 0.00 55.06 55.70 3dl5 s HIS 384 Cb 0.23 -4.03 -0.04 0.00 1.11 0.00 0.00 32.58 29.86 3dl5 s HIS 384 CO 0.03 -1.27 -0.25 0.42 -0.85 0.00 0.00 174.74 172.81 3dl5 s ILE 385 N 10.75 2.34 -0.06 0.60 1.09 -1.26 -0.21 121.20 134.44 3dl5 s ILE 385 Ca 0.68 -1.61 -0.02 0.00 -1.10 0.00 0.00 60.65 58.60 3dl5 s ILE 385 Cb -0.01 -2.01 0.03 0.00 -1.06 0.00 0.00 42.46 39.41 3dl5 s ILE 385 CO 0.12 0.17 0.04 -0.22 -0.10 0.00 0.00 174.94 174.94 3dl5 s LEU 386 N -1.86 0.32 0.12 2.97 2.96 -0.41 -4.89 118.68 117.89 3dl5 s LEU 386 Ca 0.14 -0.03 0.09 0.00 -0.22 0.00 0.00 54.13 54.11 3dl5 s LEU 386 Cb -0.10 -0.25 -0.04 0.00 0.50 0.00 0.00 46.19 46.30 3dl5 s LEU 386 CO 0.06 -0.24 -0.22 0.28 -1.32 0.00 0.00 176.35 174.91 3dl5 s THR 387 N 2.10 1.87 0.00 3.68 -1.32 -1.26 -0.77 115.64 119.93 3dl5 s THR 387 Ca 0.05 -1.68 0.00 0.00 -1.21 0.00 0.00 61.69 58.85 3dl5 s THR 387 Cb -0.12 -1.72 0.00 0.00 -1.51 0.00 0.00 72.50 69.14 3dl5 s THR 387 CO -0.04 -0.08 0.51 0.00 -2.21 0.00 0.00 174.62 172.79 3dl5 n ALA 388 N 0.86 2.26 -2.93 11.08 0.00 -0.86 -4.58 120.51 126.34 3dl5 n ALA 388 Ca -0.18 -0.51 -0.44 0.00 0.00 0.00 0.00 53.44 52.32 3dl5 n ALA 388 Cb 0.54 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.96 3dl5 n ALA 388 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 177.50 177.04 3dl5 s TRP 389 N -0.09 2.85 -0.38 0.00 -0.11 -1.24 -4.73 118.94 115.26 3dl5 s TRP 389 Ca 0.00 -0.85 -0.03 0.00 1.22 0.00 0.00 56.10 56.44 3dl5 s TRP 389 Cb 0.00 -4.23 0.09 0.00 -1.50 0.00 0.00 33.47 27.83 3dl5 s TRP 389 CO 0.00 -1.54 0.15 1.21 -4.62 0.00 0.00 176.95 172.15 3dl5 s ASN 390 N 3.65 5.17 0.38 5.86 3.84 -1.26 -4.98 114.94 127.61 3dl5 s ASN 390 Ca 0.23 -1.79 0.13 0.00 0.21 0.00 0.00 52.86 51.64 3dl5 s ASN 390 Cb -0.15 -1.80 0.96 0.00 -0.55 0.00 0.00 41.25 39.71 3dl5 s ASN 390 CO 0.04 -0.46 1.85 -0.65 -2.79 0.00 0.00 177.10 175.09 3dl5 h PRO 391 N 8.04 0.52 0.00 0.43 0.11 -2.02 -1.09 132.00 138.00 3dl5 h PRO 391 Ca -0.15 -0.03 -0.03 0.00 0.11 0.00 0.00 66.00 65.90 3dl5 h PRO 391 Cb 1.05 -0.12 -0.00 0.00 0.11 0.00 0.00 31.00 32.04 3dl5 h PRO 391 CO 0.65 0.34 -0.12 0.77 -0.21 0.00 0.00 178.00 179.43 3dl5 h SER 392 N 0.54 0.00 -0.00 -2.05 0.02 -2.02 -3.28 113.55 106.75 3dl5 h SER 392 Ca 0.48 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.43 3dl5 h SER 392 Cb 1.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.54 3dl5 h SER 392 CO -0.21 0.12 -0.31 0.00 -1.14 0.00 0.00 176.83 175.29 3dl5 n ALA 393 N -2.20 3.01 -0.33 3.77 0.00 -0.46 -4.76 120.51 119.54 3dl5 n ALA 393 Ca -0.01 -0.36 0.24 0.00 0.00 0.00 0.00 53.44 53.31 3dl5 n ALA 393 Cb 0.31 -0.35 0.47 0.00 0.00 0.00 0.00 19.45 19.89 3dl5 n ALA 393 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 3dl5 h LEU 394 N 0.62 0.52 -1.35 0.00 3.38 -1.49 -0.03 115.31 116.95 3dl5 h LEU 394 Ca 0.00 0.19 -0.01 0.00 0.09 0.00 0.00 57.88 58.15 3dl5 h LEU 394 Cb 0.29 0.14 -0.00 0.00 0.09 0.00 0.00 40.66 41.17 3dl5 h LEU 394 CO 0.00 -0.13 -0.04 0.77 0.09 0.00 0.00 178.44 179.13 3dl5 h SER 395 N 0.33 0.00 0.60 -0.43 4.64 -1.85 -2.91 113.55 113.93 3dl5 h SER 395 Ca 0.73 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 62.05 3dl5 h SER 395 Cb 1.66 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.75 3dl5 h SER 395 CO -0.60 0.04 -0.43 0.00 -0.87 0.00 0.00 176.83 174.97 3dl5 n GLN 396 N -3.15 0.02 -2.92 4.77 6.02 -0.03 -4.90 117.38 117.18 3dl5 n GLN 396 Ca 0.01 0.00 -0.40 0.00 -0.01 0.00 0.00 57.00 56.60 3dl5 n GLN 396 Cb 0.33 -1.51 -0.05 0.00 1.02 0.00 0.00 30.24 30.03 3dl5 n GLN 396 CO 0.00 0.00 0.00 -1.64 -1.01 0.00 0.00 177.06 174.41 3dl5 s MET 397 N -3.01 4.59 0.56 -1.09 -1.94 -1.10 -4.27 119.30 113.05 3dl5 s MET 397 Ca 0.11 1.20 0.24 0.00 -1.71 0.00 0.00 55.69 55.53 3dl5 s MET 397 Cb 0.18 -3.32 1.57 0.00 2.01 0.00 0.00 34.83 35.27 3dl5 s MET 397 CO 0.67 0.41 2.19 0.00 -0.01 0.00 0.00 175.02 178.28 3dl5 h ALA 398 N 4.97 1.79 -2.19 3.03 0.00 -1.57 -3.41 119.26 121.89 3dl5 h ALA 398 Ca -0.45 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.41 3dl5 h ALA 398 Cb 1.21 0.00 -0.22 0.00 0.00 0.00 0.00 17.79 18.78 3dl5 h ALA 398 CO 0.69 -0.06 -0.01 -1.17 0.00 0.00 0.00 179.25 178.70 3dl5 s LEU 399 N -8.26 -0.56 0.36 0.00 2.96 -1.26 -5.04 118.68 106.88 3dl5 s LEU 399 Ca -0.05 1.31 -0.26 0.00 -0.22 0.00 0.00 54.13 54.92 3dl5 s LEU 399 Cb 0.16 2.16 -0.09 0.00 0.50 0.00 0.00 46.19 48.92 3dl5 s LEU 399 CO 0.60 -0.22 1.08 -2.16 -1.32 0.00 0.00 176.35 174.33 3dl5 s PRO 400 N 0.85 4.30 0.05 0.98 0.04 -1.26 -4.93 135.00 135.03 3dl5 s PRO 400 Ca -0.04 1.64 -0.37 0.00 0.04 0.00 0.00 61.00 62.27 3dl5 s PRO 400 Cb -0.05 -2.76 -0.16 0.00 0.04 0.00 0.00 34.50 31.57 3dl5 s PRO 400 CO -0.07 -0.05 1.40 -0.35 0.04 0.00 0.00 177.00 177.97 3dl5 n PRO 401 N 0.34 1.23 -0.09 0.56 -0.04 -1.26 -4.94 135.00 130.79 3dl5 n PRO 401 Ca 0.03 0.44 -0.23 0.00 -0.04 0.00 0.00 63.50 63.70 3dl5 n PRO 401 Cb 0.48 -2.10 -0.12 0.00 -0.04 0.00 0.00 33.50 31.72 3dl5 n PRO 401 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3dl5 s HIS 403 N -2.44 2.81 -0.22 0.00 0.00 -1.26 -0.18 115.29 114.00 3dl5 s HIS 403 Ca -0.30 -0.30 0.03 0.00 -3.00 0.00 0.00 55.06 51.49 3dl5 s HIS 403 Cb 0.08 -4.03 -0.20 0.00 -4.00 0.00 0.00 32.58 24.43 3dl5 s HIS 403 CO 0.61 -1.38 -0.07 0.28 -1.00 0.00 0.00 174.74 173.18 3dl5 n VAL 404 N 5.98 1.52 -3.59 -5.38 0.31 -0.32 -4.79 118.33 112.07 3dl5 n VAL 404 Ca -0.02 -0.63 -0.16 0.00 -0.01 0.00 0.00 64.34 63.52 3dl5 n VAL 404 Cb 0.46 -1.31 -0.07 0.00 -0.91 0.00 0.00 33.84 32.01 3dl5 n VAL 404 CO 0.00 0.00 0.00 -0.22 -1.32 0.00 0.00 176.83 175.29 3dl5 s LEU 405 N -6.43 -0.63 0.02 7.52 0.20 -1.22 -2.03 118.68 116.10 3dl5 s LEU 405 Ca -0.28 1.07 0.05 0.00 0.69 0.00 0.00 54.13 55.65 3dl5 s LEU 405 Cb 0.08 2.44 -0.02 0.00 -0.43 0.00 0.00 46.19 48.26 3dl5 s LEU 405 CO 0.67 -0.41 -0.16 -0.94 -0.29 0.00 0.00 176.35 175.21 3dl5 s SER 406 N -0.38 1.92 0.01 3.68 1.04 0.05 -1.79 113.70 118.23 3dl5 s SER 406 Ca -0.05 -0.41 0.08 0.00 0.48 0.00 0.00 55.95 56.06 3dl5 s SER 406 Cb -0.03 -0.17 -0.02 0.00 0.10 0.00 0.00 66.02 65.90 3dl5 s SER 406 CO 0.05 0.13 -0.26 -1.58 0.98 0.00 0.00 173.24 172.56 3dl5 s GLN 407 N -0.85 1.93 0.09 4.02 0.74 0.61 -1.29 119.66 124.91 3dl5 s GLN 407 Ca 0.05 -0.99 0.09 0.00 0.05 0.00 0.00 55.36 54.56 3dl5 s GLN 407 Cb -0.07 -1.96 -0.03 0.00 1.10 0.00 0.00 33.01 32.04 3dl5 s GLN 407 CO 0.01 0.53 -0.24 0.71 -0.55 0.00 0.00 175.29 175.74 3dl5 s TYR 408 N -0.68 2.09 -0.21 1.67 2.02 0.70 -0.48 117.35 122.46 3dl5 s TYR 408 Ca 0.10 -0.40 -0.05 0.00 -0.37 0.00 0.00 57.07 56.36 3dl5 s TYR 408 Cb -0.10 -1.19 0.10 0.00 -0.40 0.00 0.00 41.96 40.38 3dl5 s TYR 408 CO 0.00 0.21 0.39 -0.47 -1.57 0.00 0.00 175.55 174.11 3dl5 s TYR 409 N -0.97 -0.77 -0.24 2.71 5.04 -0.69 -4.36 117.35 118.06 3dl5 s TYR 409 Ca 0.10 1.23 -0.16 0.00 -2.44 0.00 0.00 57.07 55.80 3dl5 s TYR 409 Cb -0.10 0.17 -0.03 0.00 0.35 0.00 0.00 41.96 42.35 3dl5 s TYR 409 CO 0.04 -0.55 0.44 0.08 -1.34 0.00 0.00 175.55 174.22 3dl5 s VAL 410 N 2.57 5.14 0.80 3.14 1.01 -1.26 -1.04 120.40 130.76 3dl5 s VAL 410 Ca 0.04 0.74 -0.11 0.00 0.00 0.00 0.00 61.98 62.65 3dl5 s VAL 410 Cb -0.13 -3.76 0.07 0.00 0.00 0.00 0.00 36.38 32.56 3dl5 s VAL 410 CO -0.13 0.16 1.10 0.42 0.00 0.00 0.00 175.10 176.64 3dl5 s THR 411 N 1.94 3.06 0.32 3.92 -4.23 0.38 -4.78 115.64 116.26 3dl5 s THR 411 Ca 0.19 0.34 0.06 0.00 -1.18 0.00 0.00 61.69 61.11 3dl5 s THR 411 Cb -0.15 -3.09 0.09 0.00 1.34 0.00 0.00 72.50 70.69 3dl5 s THR 411 CO 0.09 -0.45 1.78 0.78 -0.54 0.00 0.00 174.62 176.28 3dl5 h ASN 412 N -1.09 0.32 -0.34 3.99 4.21 -1.97 -1.51 115.58 119.19 3dl5 h ASN 412 Ca -0.47 -0.10 -0.06 0.00 1.21 0.00 0.00 56.30 56.88 3dl5 h ASN 412 Cb 1.27 -0.09 -0.04 0.00 -1.12 0.00 0.00 38.32 38.35 3dl5 h ASN 412 CO 0.59 0.58 0.08 -0.90 -1.29 0.00 0.00 177.43 176.49 3dl5 n ASP 413 N -4.15 3.39 -0.83 5.81 5.75 -1.26 -4.89 116.55 120.37 3dl5 n ASP 413 Ca -0.01 -2.55 -0.05 0.00 -0.01 0.00 0.00 54.79 52.17 3dl5 n ASP 413 Cb 0.38 -0.61 0.01 0.00 -1.03 0.00 0.00 41.12 39.86 3dl5 n ASP 413 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68 3dl5 n ASN 414 N 0.16 -2.53 -4.74 -1.12 4.13 -0.57 -4.96 115.26 105.65 3dl5 n ASN 414 Ca 0.18 -0.05 -0.25 0.00 1.68 0.00 0.00 54.58 56.13 3dl5 n ASN 414 Cb 0.81 -1.60 -0.06 0.00 -1.54 0.00 0.00 39.78 37.39 3dl5 n ASN 414 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3dl5 s LEU 416 N -3.21 3.92 0.18 0.00 2.96 0.59 -0.47 118.68 122.65 3dl5 s LEU 416 Ca 0.30 -0.99 0.04 0.00 -0.22 0.00 0.00 54.13 53.26 3dl5 s LEU 416 Cb -0.09 -1.81 -0.04 0.00 0.50 0.00 0.00 46.19 44.75 3dl5 s LEU 416 CO 0.21 -0.24 0.23 -0.44 -1.32 0.00 0.00 176.35 174.79 3dl5 s SER 417 N 1.39 5.95 -0.02 3.68 0.01 -0.21 -0.89 113.70 123.61 3dl5 s SER 417 Ca -0.01 -0.00 0.02 0.00 1.31 0.00 0.00 55.95 57.27 3dl5 s SER 417 Cb -0.18 -1.68 0.00 0.00 0.21 0.00 0.00 66.02 64.37 3dl5 s SER 417 CO 0.01 0.03 -0.08 0.00 0.41 0.00 0.00 173.24 173.60 3dl5 s ASN 419 N 0.11 3.61 -0.04 0.00 0.02 0.36 -1.39 114.94 117.62 3dl5 s ASN 419 Ca -0.02 -0.33 -0.02 0.00 -1.02 0.00 0.00 52.86 51.48 3dl5 s ASN 419 Cb -0.07 -0.75 0.03 0.00 0.02 0.00 0.00 41.25 40.48 3dl5 s ASN 419 CO 0.00 0.31 0.05 -0.22 0.02 0.00 0.00 177.10 177.27 3dl5 s LEU 420 N -0.55 0.30 -0.05 0.60 2.96 -0.63 -0.28 118.68 121.02 3dl5 s LEU 420 Ca 0.08 0.07 -0.16 0.00 -0.22 0.00 0.00 54.13 53.90 3dl5 s LEU 420 Cb -0.11 -0.13 -0.05 0.00 0.50 0.00 0.00 46.19 46.39 3dl5 s LEU 420 CO 0.01 -0.23 0.42 -0.47 -1.32 0.00 0.00 176.35 174.75 3dl5 s TYR 421 N 1.99 3.63 -0.32 5.38 5.04 -0.74 -0.69 117.35 131.65 3dl5 s TYR 421 Ca 0.03 0.92 0.00 0.00 -2.44 0.00 0.00 57.07 55.58 3dl5 s TYR 421 Cb -0.12 -2.38 0.10 0.00 0.35 0.00 0.00 41.96 39.91 3dl5 s TYR 421 CO -0.03 0.45 0.09 -1.14 -1.34 0.00 0.00 175.55 173.58 3dl5 s GLN 422 N -0.38 0.88 0.25 4.97 0.74 0.12 -1.18 119.66 125.06 3dl5 s GLN 422 Ca 0.23 -1.25 -0.04 0.00 0.05 0.00 0.00 55.36 54.35 3dl5 s GLN 422 Cb -0.16 -2.25 0.49 0.00 1.10 0.00 0.00 33.01 32.20 3dl5 s GLN 422 CO 0.11 -0.98 1.67 0.07 -0.55 0.00 0.00 175.29 175.62 3dl5 h ARG 423 N 7.98 0.23 -4.40 1.67 0.11 -0.85 -1.48 114.38 117.64 3dl5 h ARG 423 Ca -0.11 -0.01 -0.49 0.00 0.10 0.00 0.00 59.98 59.46 3dl5 h ARG 423 Cb 1.01 -0.05 -0.34 0.00 1.11 0.00 0.00 29.97 31.70 3dl5 h ARG 423 CO 0.48 0.15 -0.80 0.45 0.10 0.00 0.00 179.97 180.35 3dl5 s SER 424 N -5.21 1.65 -0.13 0.08 0.15 -1.22 -0.61 113.70 108.41 3dl5 s SER 424 Ca -0.13 -0.26 -0.03 0.00 0.70 0.00 0.00 55.95 56.23 3dl5 s SER 424 Cb 0.22 -0.75 0.05 0.00 -1.71 0.00 0.00 66.02 63.83 3dl5 s SER 424 CO 0.76 -0.00 0.04 0.00 1.20 0.00 0.00 173.24 175.24 3dl5 s ASP 426 N 2.00 6.18 0.45 0.00 3.68 -1.26 -2.24 116.67 125.48 3dl5 s ASP 426 Ca 0.02 -0.61 0.17 0.00 2.13 0.00 0.00 52.55 54.27 3dl5 s ASP 426 Cb -0.15 -2.53 1.11 0.00 -1.45 0.00 0.00 42.92 39.90 3dl5 s ASP 426 CO -0.07 -1.75 1.94 -0.07 0.13 0.00 0.00 175.17 175.36 3dl5 h LEU 427 N 12.68 0.31 0.04 -1.34 -0.00 -1.67 0.23 115.31 125.56 3dl5 h LEU 427 Ca -0.26 0.02 -0.10 0.00 -0.00 0.00 0.00 57.88 57.54 3dl5 h LEU 427 Cb 1.05 -0.05 0.01 0.00 -0.00 0.00 0.00 40.66 41.67 3dl5 h LEU 427 CO 1.27 0.17 -0.40 1.23 -0.00 0.00 0.00 178.44 180.71 3dl5 h GLY 428 N 0.34 0.23 0.00 0.83 0.00 -1.90 -3.40 103.07 99.17 3dl5 h GLY 428 Ca 0.33 -0.48 -0.35 0.00 0.00 0.00 0.00 47.33 46.84 3dl5 h GLY 428 CO -0.09 0.42 -2.33 1.04 0.00 0.00 0.00 176.54 175.57 3dl5 n LEU 429 N -4.39 2.46 -0.08 3.11 4.32 -1.16 -4.73 117.00 116.53 3dl5 n LEU 429 Ca -0.11 -0.11 -0.11 0.00 -0.02 0.00 0.00 56.01 55.66 3dl5 n LEU 429 Cb 0.61 -0.61 -0.06 0.00 -1.62 0.00 0.00 43.42 41.74 3dl5 n LEU 429 CO 0.42 0.82 -0.37 1.23 -1.22 0.00 0.00 177.39 178.27 3dl5 h GLY 430 N 2.14 0.00 -0.49 -0.72 0.00 -0.85 -3.36 103.07 99.79 3dl5 h GLY 430 Ca -0.52 0.00 0.12 0.00 0.00 0.00 0.00 47.33 46.92 3dl5 h GLY 430 CO -0.06 0.00 -0.32 0.23 0.00 0.00 0.00 176.54 176.39 3dl5 h SER 431 N -1.00 -1.11 -0.70 0.19 0.87 -1.45 0.24 113.55 110.59 3dl5 h SER 431 Ca -0.14 0.23 0.12 0.00 -1.23 0.00 0.00 61.79 60.78 3dl5 h SER 431 Cb 0.81 0.57 -0.09 0.00 -0.44 0.00 0.00 62.40 63.25 3dl5 h SER 431 CO -0.08 -0.29 0.26 -0.65 -0.53 0.00 0.00 176.83 175.54 3dl5 h PRO 432 N -0.12 0.41 -0.21 2.24 0.11 -1.78 0.49 132.00 133.14 3dl5 h PRO 432 Ca 0.26 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 66.35 3dl5 h PRO 432 Cb 0.55 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 31.56 3dl5 h PRO 432 CO -0.72 0.27 0.13 0.74 -0.21 0.00 0.00 178.00 178.20 3dl5 h PHE 433 N 0.42 0.28 -0.85 0.65 -1.00 -1.27 -2.59 116.94 112.57 3dl5 h PHE 433 Ca 0.37 -0.00 0.03 0.00 2.81 0.00 0.00 57.97 61.18 3dl5 h PHE 433 Cb 0.53 -0.09 -0.05 0.00 3.61 0.00 0.00 35.95 39.95 3dl5 h PHE 433 CO -0.17 0.22 0.56 -0.91 -1.61 0.00 0.00 178.31 176.40 3dl5 h ASN 434 N 0.25 0.93 0.33 2.17 4.21 0.47 -0.17 115.58 123.77 3dl5 h ASN 434 Ca 0.08 -0.01 -0.02 0.00 1.21 0.00 0.00 56.30 57.56 3dl5 h ASN 434 Cb 0.03 -0.22 0.00 0.00 -1.12 0.00 0.00 38.32 37.01 3dl5 h ASN 434 CO -0.01 0.65 -0.16 0.40 -1.29 0.00 0.00 177.43 177.01 3dl5 h ILE 435 N 1.08 0.69 -0.84 2.81 2.04 -0.81 -2.37 117.51 120.11 3dl5 h ILE 435 Ca 0.33 -0.40 0.02 0.00 1.00 0.00 0.00 64.86 65.82 3dl5 h ILE 435 Cb -0.01 0.89 -0.05 0.00 -0.74 0.00 0.00 36.82 36.92 3dl5 h ILE 435 CO -0.09 0.08 0.55 0.00 0.00 0.00 0.00 178.15 178.69 3dl5 h ALA 436 N -0.08 1.09 0.58 1.87 0.00 -1.27 -2.72 119.26 118.72 3dl5 h ALA 436 Ca -0.05 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.79 3dl5 h ALA 436 Cb 0.47 -0.32 -0.00 0.00 0.00 0.00 0.00 17.79 17.94 3dl5 h ALA 436 CO 0.07 0.43 -0.35 1.03 0.00 0.00 0.00 179.25 180.43 3dl5 h SER 437 N 1.10 -0.87 0.25 0.00 0.87 -0.98 -0.73 113.55 113.19 3dl5 h SER 437 Ca 0.32 0.05 0.00 0.00 -1.23 0.00 0.00 61.79 60.93 3dl5 h SER 437 Cb -0.06 0.25 0.00 0.00 -0.44 0.00 0.00 62.40 62.15 3dl5 h SER 437 CO -0.09 -0.54 0.00 -1.22 -0.53 0.00 0.00 176.83 174.45 3dl5 n TYR 438 N -4.55 0.08 -0.03 2.24 4.01 -0.90 -0.32 117.16 117.68 3dl5 n TYR 438 Ca -0.11 0.04 -0.18 0.00 -0.16 0.00 0.00 57.90 57.49 3dl5 n TYR 438 Cb 0.36 -0.56 -0.13 0.00 -0.31 0.00 0.00 39.34 38.69 3dl5 n TYR 438 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3dl5 h ALA 439 N 2.23 0.06 -0.23 -0.72 0.00 -1.14 -2.76 119.26 116.70 3dl5 h ALA 439 Ca 0.00 -0.79 -0.00 0.00 0.00 0.00 0.00 54.91 54.12 3dl5 h ALA 439 Cb 0.13 0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 3dl5 h ALA 439 CO 0.00 0.37 0.14 0.82 0.00 0.00 0.00 179.25 180.58 3dl5 h ILE 440 N -0.73 1.08 -0.90 0.00 2.04 -0.10 -1.12 117.51 117.78 3dl5 h ILE 440 Ca -0.15 -0.19 0.08 0.00 1.00 0.00 0.00 64.86 65.59 3dl5 h ILE 440 Cb 1.35 0.80 -0.07 0.00 -0.74 0.00 0.00 36.82 38.16 3dl5 h ILE 440 CO 0.01 0.08 0.56 0.25 0.00 0.00 0.00 178.15 179.05 3dl5 h LEU 441 N 0.29 0.87 -0.68 1.44 5.85 -0.78 0.52 115.31 122.81 3dl5 h LEU 441 Ca 0.08 0.02 -0.10 0.00 0.84 0.00 0.00 57.88 58.73 3dl5 h LEU 441 Cb 0.01 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 40.86 3dl5 h LEU 441 CO -0.02 0.53 -0.06 0.74 -0.34 0.00 0.00 178.44 179.30 3dl5 h THR 442 N 0.99 1.26 -0.08 1.05 2.02 -1.12 0.50 112.91 117.53 3dl5 h THR 442 Ca 0.41 -1.18 -0.01 0.00 0.77 0.00 0.00 66.41 66.40 3dl5 h THR 442 Cb 0.24 0.91 -0.00 0.00 -1.74 0.00 0.00 68.15 67.56 3dl5 h THR 442 CO -0.20 0.42 0.03 0.24 0.37 0.00 0.00 175.52 176.38 3dl5 h MET 443 N 0.88 0.13 -0.18 6.66 2.86 -0.30 0.28 114.93 125.26 3dl5 h MET 443 Ca 0.15 -0.03 0.04 0.00 -2.06 0.00 0.00 59.70 57.80 3dl5 h MET 443 Cb 0.60 -0.02 -0.04 0.00 0.06 0.00 0.00 31.60 32.20 3dl5 h MET 443 CO 0.04 0.29 -0.08 0.52 1.06 0.00 0.00 176.91 178.74 3dl5 h MET 444 N -0.05 -0.05 -0.89 1.72 2.07 -0.76 0.16 114.93 117.13 3dl5 h MET 444 Ca 0.03 0.00 0.10 0.00 -2.07 0.00 0.00 59.70 57.76 3dl5 h MET 444 Cb 0.21 0.01 -0.07 0.00 -1.87 0.00 0.00 31.60 29.88 3dl5 h MET 444 CO -0.00 -0.03 0.53 -0.07 1.07 0.00 0.00 176.91 178.41 3dl5 h LEU 445 N -0.05 0.78 0.05 1.22 3.38 -0.60 -2.17 115.31 117.92 3dl5 h LEU 445 Ca 0.10 0.04 -0.00 0.00 0.09 0.00 0.00 57.88 58.10 3dl5 h LEU 445 Cb 0.20 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.83 3dl5 h LEU 445 CO -0.21 0.45 -0.03 0.00 0.09 0.00 0.00 178.44 178.74 3dl5 h ALA 446 N 1.47 -0.07 -0.16 1.53 0.00 0.99 -1.56 119.26 121.46 3dl5 h ALA 446 Ca 0.42 -0.08 0.03 0.00 0.00 0.00 0.00 54.91 55.29 3dl5 h ALA 446 Cb 0.36 0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.14 3dl5 h ALA 446 CO -0.24 -0.48 -0.05 0.37 0.00 0.00 0.00 179.25 178.85 3dl5 h GLN 447 N -0.20 -0.02 0.00 0.00 4.15 -0.71 0.47 115.11 118.80 3dl5 h GLN 447 Ca -0.01 0.00 -0.01 0.00 0.77 0.00 0.00 58.65 59.41 3dl5 h GLN 447 Cb 0.18 0.00 -0.00 0.00 0.21 0.00 0.00 27.48 27.87 3dl5 h GLN 447 CO 0.01 -0.01 -0.04 0.28 -1.93 0.00 0.00 178.83 177.14 3dl5 h VAL 448 N -0.02 0.70 -0.23 2.39 2.07 -1.36 -2.20 116.25 117.61 3dl5 h VAL 448 Ca 0.08 -0.15 0.00 0.00 0.82 0.00 0.00 66.70 67.45 3dl5 h VAL 448 Cb 0.15 1.09 0.00 0.00 -1.52 0.00 0.00 31.29 31.01 3dl5 h VAL 448 CO -0.18 0.04 0.00 0.00 0.02 0.00 0.00 177.57 177.45 3dl5 n GLY 450 N 1.07 0.31 3.42 0.00 0.00 0.63 -4.84 105.19 105.77 3dl5 n GLY 450 Ca 0.14 -0.33 -0.22 0.00 0.00 0.00 0.00 46.02 45.62 3dl5 n GLY 450 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3dl5 s TYR 451 N -3.11 1.75 0.19 1.61 4.12 0.13 -5.00 117.35 117.04 3dl5 s TYR 451 Ca 0.09 -1.21 0.06 0.00 0.02 0.00 0.00 57.07 56.03 3dl5 s TYR 451 Cb -0.04 -1.08 -0.04 0.00 -1.52 0.00 0.00 41.96 39.29 3dl5 s TYR 451 CO 0.24 -0.29 0.13 -1.21 0.02 0.00 0.00 175.55 174.44 3dl5 s GLU 452 N -3.83 2.81 0.45 -0.62 0.41 -0.99 -4.00 118.70 112.93 3dl5 s GLU 452 Ca 0.32 -0.98 -0.25 0.00 -0.41 0.00 0.00 54.97 53.65 3dl5 s GLU 452 Cb 0.05 -2.56 -0.08 0.00 -1.78 0.00 0.00 34.13 29.77 3dl5 s GLU 452 CO 0.15 0.45 1.34 -2.14 -0.49 0.00 0.00 175.26 174.58 3dl5 s PRO 453 N -3.31 3.72 0.00 0.39 0.02 -1.26 -0.30 135.00 134.26 3dl5 s PRO 453 Ca 0.31 2.23 0.00 0.00 0.02 0.00 0.00 61.00 63.56 3dl5 s PRO 453 Cb -0.09 -2.62 0.00 0.00 0.02 0.00 0.00 34.50 31.81 3dl5 s PRO 453 CO 0.23 -0.72 0.00 0.41 -0.33 0.00 0.00 177.00 176.59 3dl5 n GLY 454 N 0.63 1.04 3.50 0.52 0.00 -0.07 -4.09 105.19 106.71 3dl5 n GLY 454 Ca 0.05 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.83 3dl5 n GLY 454 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3dl5 s GLU 455 N 2.93 1.79 -0.13 1.61 2.02 -1.26 -1.45 118.70 124.20 3dl5 s GLU 455 Ca 0.00 -1.64 0.01 0.00 0.02 0.00 0.00 54.97 53.36 3dl5 s GLU 455 Cb 0.00 -1.88 0.02 0.00 0.10 0.00 0.00 34.13 32.37 3dl5 s GLU 455 CO 0.00 0.35 -0.14 -1.17 0.02 0.00 0.00 175.26 174.32 3dl5 s LEU 456 N -3.36 1.66 -0.11 1.80 2.96 0.12 -1.09 118.68 120.67 3dl5 s LEU 456 Ca 0.28 -0.46 0.02 0.00 -0.22 0.00 0.00 54.13 53.75 3dl5 s LEU 456 Cb -0.06 -1.13 0.01 0.00 0.50 0.00 0.00 46.19 45.51 3dl5 s LEU 456 CO 0.15 -0.04 -0.15 0.00 -1.32 0.00 0.00 176.35 174.99 3dl5 s ALA 457 N 1.36 1.66 -0.18 5.97 0.00 -0.49 0.68 121.76 130.76 3dl5 s ALA 457 Ca 0.02 -0.71 -0.01 0.00 0.00 0.00 0.00 51.96 51.26 3dl5 s ALA 457 Cb -0.13 -0.82 0.00 0.00 0.00 0.00 0.00 23.12 22.17 3dl5 s ALA 457 CO -0.08 -0.07 -0.13 0.42 0.00 0.00 0.00 175.76 175.89 3dl5 s ILE 458 N 0.99 2.71 -0.24 0.00 1.01 0.78 -1.61 121.20 124.83 3dl5 s ILE 458 Ca -0.07 -0.74 -0.08 0.00 0.00 0.00 0.00 60.65 59.76 3dl5 s ILE 458 Cb -0.15 -2.17 -0.04 0.00 0.01 0.00 0.00 42.46 40.12 3dl5 s ILE 458 CO -0.01 0.50 0.09 -0.36 0.00 0.00 0.00 174.94 175.16 3dl5 s PHE 459 N 1.11 3.14 -0.08 3.97 0.40 0.13 -1.42 117.98 125.23 3dl5 s PHE 459 Ca 0.00 -0.21 -0.00 0.00 -0.60 0.00 0.00 56.93 56.12 3dl5 s PHE 459 Cb -0.14 -2.23 -0.03 0.00 0.51 0.00 0.00 43.02 41.12 3dl5 s PHE 459 CO -0.04 -0.21 -0.04 0.42 0.70 0.00 0.00 175.22 176.04 3dl5 s ILE 460 N 1.39 3.93 0.00 0.64 1.01 -0.00 0.16 121.20 128.32 3dl5 s ILE 460 Ca 0.06 -0.39 0.00 0.00 0.00 0.00 0.00 60.65 60.32 3dl5 s ILE 460 Cb -0.15 -2.63 0.00 0.00 0.01 0.00 0.00 42.46 39.69 3dl5 s ILE 460 CO 0.05 0.59 0.00 0.61 0.00 0.00 0.00 174.94 176.19 3dl5 n GLY 461 N 2.27 1.17 3.47 6.18 0.00 -0.56 -0.71 105.19 117.01 3dl5 n GLY 461 Ca -0.18 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.41 3dl5 n GLY 461 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3dl5 s ASP 462 N -1.00 6.36 -0.35 1.61 3.68 0.22 0.26 116.67 127.46 3dl5 s ASP 462 Ca 0.00 -1.36 -0.20 0.00 2.13 0.00 0.00 52.55 53.12 3dl5 s ASP 462 Cb 0.00 -2.44 0.00 0.00 -1.45 0.00 0.00 42.92 39.03 3dl5 s ASP 462 CO 0.00 -1.35 0.61 0.00 0.13 0.00 0.00 175.17 174.56 3dl5 s ALA 463 N 3.84 3.46 0.19 3.66 0.00 -0.07 -1.89 121.76 130.96 3dl5 s ALA 463 Ca 0.29 -0.87 0.01 0.00 0.00 0.00 0.00 51.96 51.39 3dl5 s ALA 463 Cb -0.10 -3.14 -0.05 0.00 0.00 0.00 0.00 23.12 19.83 3dl5 s ALA 463 CO 0.02 -1.30 0.05 -3.38 0.00 0.00 0.00 175.76 171.14 3dl5 s HIS 464 N 2.64 1.25 -0.19 0.00 -0.00 -0.95 -1.63 115.29 116.41 3dl5 s HIS 464 Ca 0.23 -1.12 -0.03 0.00 -0.00 0.00 0.00 55.06 54.14 3dl5 s HIS 464 Cb -0.15 -0.71 0.06 0.00 -0.00 0.00 0.00 32.58 31.78 3dl5 s HIS 464 CO 0.14 -0.32 0.03 0.42 -0.00 0.00 0.00 174.74 175.01 3dl5 s ILE 465 N -3.78 0.56 0.50 -5.38 1.01 -1.05 -1.53 121.20 111.53 3dl5 s ILE 465 Ca 0.29 -0.57 -0.24 0.00 0.00 0.00 0.00 60.65 60.13 3dl5 s ILE 465 Cb 0.07 -1.05 -0.07 0.00 0.01 0.00 0.00 42.46 41.42 3dl5 s ILE 465 CO 0.07 -0.20 1.41 -1.22 0.00 0.00 0.00 174.94 175.00 3dl5 n TYR 466 N 5.04 2.55 0.89 3.97 4.01 -1.26 -2.48 117.16 129.88 3dl5 n TYR 466 Ca -0.09 0.43 0.11 0.00 -0.16 0.00 0.00 57.90 58.19 3dl5 n TYR 466 Cb 0.47 -2.42 0.51 0.00 -0.31 0.00 0.00 39.34 37.59 3dl5 n TYR 466 CO 0.00 0.00 0.00 -0.85 -0.46 0.00 0.00 176.86 175.55 3dl5 n GLU 467 N -0.58 0.15 -0.75 -0.72 0.28 -0.21 -1.05 120.64 117.77 3dl5 n GLU 467 Ca 0.08 0.10 0.08 0.00 -0.16 0.00 0.00 57.16 57.26 3dl5 n GLU 467 Cb 0.43 -1.50 0.37 0.00 1.43 0.00 0.00 31.44 32.17 3dl5 n GLU 467 CO 0.00 0.00 0.00 0.27 -0.16 0.00 0.00 177.13 177.24 3dl5 n ASN 468 N -1.40 5.21 0.00 -1.84 6.94 -1.26 -3.82 115.26 119.09 3dl5 n ASN 468 Ca 0.08 -2.76 0.00 0.00 -0.02 0.00 0.00 54.58 51.88 3dl5 n ASN 468 Cb 0.22 -0.63 0.00 0.00 -2.36 0.00 0.00 39.78 37.01 3dl5 n ASN 468 CO 0.00 0.00 0.00 1.41 -1.03 0.00 0.00 177.26 177.64 3dl5 n HIS 469 N 0.70 0.00 -0.14 -2.53 8.25 -0.21 -4.77 115.22 116.53 3dl5 n HIS 469 Ca 0.26 0.00 -0.04 0.00 -0.26 0.00 0.00 57.72 57.69 3dl5 n HIS 469 Cb 1.06 0.00 0.05 0.00 1.12 0.00 0.00 29.99 32.21 3dl5 n HIS 469 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 3dl5 h LEU 470 N 0.00 0.04 -0.17 2.41 4.07 -1.66 -0.76 115.31 119.24 3dl5 h LEU 470 Ca 0.00 0.07 -0.21 0.00 0.08 0.00 0.00 57.88 57.82 3dl5 h LEU 470 Cb 0.01 0.09 -0.01 0.00 1.08 0.00 0.00 40.66 41.83 3dl5 h LEU 470 CO 0.00 0.05 -0.96 0.71 -1.08 0.00 0.00 178.44 177.17 3dl5 h THR 471 N 0.24 1.56 -0.50 0.22 1.35 -1.88 -2.71 112.91 111.19 3dl5 h THR 471 Ca 0.22 -2.89 -0.09 0.00 -0.55 0.00 0.00 66.41 63.10 3dl5 h THR 471 Cb 0.26 2.63 -0.02 0.00 -1.73 0.00 0.00 68.15 69.30 3dl5 h THR 471 CO -0.27 0.84 -0.04 1.56 -0.25 0.00 0.00 175.52 177.35 3dl5 h GLN 472 N 0.06 0.92 0.00 4.72 7.50 -1.84 -1.64 115.11 124.83 3dl5 h GLN 472 Ca -0.05 -0.31 -0.11 0.00 0.50 0.00 0.00 58.65 58.68 3dl5 h GLN 472 Cb 1.63 -0.07 -0.02 0.00 0.05 0.00 0.00 27.48 29.07 3dl5 h GLN 472 CO 0.14 0.96 -0.54 -0.07 -1.50 0.00 0.00 178.83 177.83 3dl5 h LEU 473 N 0.78 0.00 -0.68 1.46 3.38 -1.20 -1.44 115.31 117.61 3dl5 h LEU 473 Ca 0.14 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 58.02 3dl5 h LEU 473 Cb 0.58 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.30 3dl5 h LEU 473 CO 0.03 0.54 0.08 0.50 0.09 0.00 0.00 178.44 179.68 3dl5 h LYS 474 N 0.00 1.10 0.41 1.13 1.63 -1.24 0.37 116.57 119.97 3dl5 h LYS 474 Ca -0.01 -0.31 -0.02 0.00 -0.85 0.00 0.00 60.65 59.47 3dl5 h LYS 474 Cb 1.02 -0.12 0.00 0.00 -0.60 0.00 0.00 32.23 32.53 3dl5 h LYS 474 CO 0.07 1.02 -0.20 1.49 -3.45 0.00 0.00 179.45 178.39 3dl5 h GLU 475 N 1.02 -0.53 -0.99 1.90 4.57 -0.76 -2.72 114.58 117.08 3dl5 h GLU 475 Ca 0.20 0.04 0.08 0.00 -1.18 0.00 0.00 59.36 58.49 3dl5 h GLU 475 Cb 0.47 0.12 -0.07 0.00 -0.16 0.00 0.00 28.75 29.11 3dl5 h GLU 475 CO 0.02 -0.34 0.63 0.37 -1.18 0.00 0.00 179.01 178.51 3dl5 h GLN 476 N -0.58 1.07 0.00 1.92 4.15 -1.04 -0.75 115.11 119.87 3dl5 h GLN 476 Ca -0.06 -0.06 0.00 0.00 0.77 0.00 0.00 58.65 59.30 3dl5 h GLN 476 Cb 0.44 -0.24 0.00 0.00 0.21 0.00 0.00 27.48 27.89 3dl5 h GLN 476 CO 0.09 0.71 0.00 1.28 -1.93 0.00 0.00 178.83 178.98 3dl5 n LEU 477 N -4.53 0.00 -0.22 -2.39 4.77 0.10 -1.82 117.00 112.92 3dl5 n LEU 477 Ca 0.16 0.49 0.12 0.00 -0.03 0.00 0.00 56.01 56.76 3dl5 n LEU 477 Cb 0.23 -0.49 0.27 0.00 -2.33 0.00 0.00 43.42 41.10 3dl5 n LEU 477 CO 0.31 -0.33 0.53 -1.54 -1.33 0.00 0.00 177.39 175.03 3dl5 n SER 478 N -1.49 1.06 -4.72 -1.43 3.41 -0.29 -4.32 113.62 105.83 3dl5 n SER 478 Ca 0.02 -0.86 -0.35 0.00 -0.26 0.00 0.00 58.87 57.42 3dl5 n SER 478 Cb 0.11 0.25 -0.08 0.00 -0.26 0.00 0.00 64.21 64.24 3dl5 n SER 478 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 3dl5 s ARG 479 N -2.62 4.20 -0.05 4.33 0.52 -0.75 -4.96 118.95 119.61 3dl5 s ARG 479 Ca 0.20 -0.15 -0.30 0.00 -0.52 0.00 0.00 55.73 54.96 3dl5 s ARG 479 Cb 0.19 -3.43 -0.02 0.00 0.52 0.00 0.00 34.95 32.20 3dl5 s ARG 479 CO 0.58 0.27 0.99 0.99 0.02 0.00 0.00 175.30 178.14 3dl5 s THR 480 N 0.45 4.83 0.48 0.02 2.01 -1.26 -4.90 115.64 117.26 3dl5 s THR 480 Ca 0.10 2.04 -0.23 0.00 0.31 0.00 0.00 61.69 63.90 3dl5 s THR 480 Cb -0.12 -4.31 -0.08 0.00 0.01 0.00 0.00 72.50 68.00 3dl5 s THR 480 CO -0.00 0.09 1.20 -0.81 -0.69 0.00 0.00 174.62 174.41 3dl5 n PRO 481 N 4.43 1.64 -3.52 4.92 -0.04 -1.26 -4.91 135.00 136.26 3dl5 n PRO 481 Ca 0.07 0.59 -0.22 0.00 -0.04 0.00 0.00 63.50 63.90 3dl5 n PRO 481 Cb 0.50 -2.34 0.00 0.00 -0.04 0.00 0.00 33.50 31.62 3dl5 n PRO 481 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 3dl5 s ARG 482 N -2.41 2.39 0.36 0.54 0.52 -1.26 -5.06 118.95 114.03 3dl5 s ARG 482 Ca 0.66 -1.73 -0.27 0.00 -0.52 0.00 0.00 55.73 53.87 3dl5 s ARG 482 Cb -0.48 -2.36 -0.09 0.00 0.52 0.00 0.00 34.95 32.53 3dl5 s ARG 482 CO 0.54 -0.53 1.25 -2.14 0.02 0.00 0.00 175.30 174.45 3dl5 s PRO 483 N -4.34 4.23 0.59 3.54 0.02 -1.26 -4.83 135.00 132.96 3dl5 s PRO 483 Ca 0.47 2.08 -0.19 0.00 0.02 0.00 0.00 61.00 63.38 3dl5 s PRO 483 Cb -0.04 -2.93 -0.04 0.00 0.02 0.00 0.00 34.50 31.52 3dl5 s PRO 483 CO 0.29 -0.24 1.21 -0.06 -0.33 0.00 0.00 177.00 177.87 3dl5 s PHE 484 N -1.23 2.37 0.19 6.54 0.08 -1.26 -4.75 117.98 119.92 3dl5 s PHE 484 Ca 0.52 1.51 -0.03 0.00 0.12 0.00 0.00 56.93 59.05 3dl5 s PHE 484 Cb -0.37 -3.50 0.04 0.00 -0.57 0.00 0.00 43.02 38.63 3dl5 s PHE 484 CO 0.48 -2.26 0.26 -0.35 -0.10 0.00 0.00 175.22 173.25 3dl5 n PRO 485 N -1.59 -0.23 -4.38 0.24 -0.04 -1.26 -4.75 135.00 122.99 3dl5 n PRO 485 Ca 0.14 -0.41 -0.28 0.00 -0.04 0.00 0.00 63.50 62.91 3dl5 n PRO 485 Cb 0.49 -0.27 -0.12 0.00 -0.04 0.00 0.00 33.50 33.57 3dl5 n PRO 485 CO 0.00 0.00 0.00 -0.65 -0.04 0.00 0.00 175.50 174.81 3dl5 s GLN 486 N -3.55 1.60 -0.07 0.54 -1.52 0.16 -1.87 119.66 114.95 3dl5 s GLN 486 Ca 0.15 -1.40 0.01 0.00 -1.95 0.00 0.00 55.36 52.16 3dl5 s GLN 486 Cb -0.00 -1.94 0.02 0.00 -0.22 0.00 0.00 33.01 30.87 3dl5 s GLN 486 CO 0.10 0.43 -0.06 -1.17 -0.25 0.00 0.00 175.29 174.34 3dl5 s LEU 487 N -2.47 1.23 0.07 2.90 0.20 -1.26 -0.27 118.68 119.08 3dl5 s LEU 487 Ca 0.19 -0.20 0.03 0.00 0.69 0.00 0.00 54.13 54.85 3dl5 s LEU 487 Cb -0.09 -0.62 -0.03 0.00 -0.43 0.00 0.00 46.19 45.02 3dl5 s LEU 487 CO 0.10 -0.07 -0.10 -0.54 -0.29 0.00 0.00 176.35 175.44 3dl5 s LYS 488 N 1.23 0.71 -0.18 1.98 -0.14 -0.23 -5.00 119.74 118.12 3dl5 s LYS 488 Ca -0.05 -0.96 -0.13 0.00 -1.36 0.00 0.00 55.97 53.46 3dl5 s LYS 488 Cb -0.14 -0.49 -0.05 0.00 -1.68 0.00 0.00 37.83 35.48 3dl5 s LYS 488 CO -0.02 0.09 0.27 -0.06 -0.76 0.00 0.00 175.35 174.87 3dl5 s PHE 489 N -1.81 3.43 0.19 3.18 0.08 -1.26 -0.77 117.98 121.03 3dl5 s PHE 489 Ca -0.02 0.53 0.29 0.00 0.12 0.00 0.00 56.93 57.85 3dl5 s PHE 489 Cb -0.07 -2.33 1.26 0.00 -0.57 0.00 0.00 43.02 41.31 3dl5 s PHE 489 CO 0.00 0.20 1.96 0.87 -0.10 0.00 0.00 175.22 178.15 3dl5 h LYS 490 N 6.83 0.00 -3.65 0.44 1.57 -0.66 -3.45 116.57 117.65 3dl5 h LYS 490 Ca -0.40 0.00 -0.12 0.00 -1.87 0.00 0.00 60.65 58.26 3dl5 h LYS 490 Cb 1.16 0.00 -0.17 0.00 0.08 0.00 0.00 32.23 33.30 3dl5 h LYS 490 CO 0.75 0.11 -0.44 -0.98 -0.57 0.00 0.00 179.45 178.31 3dl5 s ARG 491 N -3.77 0.66 -0.28 3.15 1.70 -1.26 -5.12 118.95 114.02 3dl5 s ARG 491 Ca -0.00 -0.68 -0.18 0.00 -0.47 0.00 0.00 55.73 54.41 3dl5 s ARG 491 Cb 0.10 0.27 -0.02 0.00 -0.57 0.00 0.00 34.95 34.73 3dl5 s ARG 491 CO 0.58 -0.18 0.50 0.21 -1.08 0.00 0.00 175.30 175.33 3dl5 s LYS 492 N -2.59 3.97 0.31 3.89 2.20 -1.26 -5.06 119.74 121.20 3dl5 s LYS 492 Ca -0.05 0.20 0.01 0.00 -0.36 0.00 0.00 55.97 55.77 3dl5 s LYS 492 Cb -0.01 -3.68 -0.03 0.00 -1.51 0.00 0.00 37.83 32.59 3dl5 s LYS 492 CO -0.04 -0.41 0.50 0.14 -0.36 0.00 0.00 175.35 175.18 3dl5 s VAL 493 N 2.32 5.14 -0.10 4.02 -7.23 -1.26 -5.03 120.40 118.26 3dl5 s VAL 493 Ca 0.20 -0.51 0.15 0.00 -1.81 0.00 0.00 61.98 60.01 3dl5 s VAL 493 Cb -0.16 -3.84 -0.23 0.00 0.56 0.00 0.00 36.38 32.71 3dl5 s VAL 493 CO 0.10 -0.47 0.47 -1.84 -0.31 0.00 0.00 175.10 173.05 3dl5 n GLU 494 N -1.56 0.65 -4.89 4.82 0.28 -1.26 -4.79 120.64 113.89 3dl5 n GLU 494 Ca -0.05 0.19 -0.32 0.00 -0.16 0.00 0.00 57.16 56.81 3dl5 n GLU 494 Cb 0.56 -1.70 -0.17 0.00 1.43 0.00 0.00 31.44 31.56 3dl5 n GLU 494 CO 0.00 0.00 0.00 -0.80 -0.16 0.00 0.00 177.13 176.17 3dl5 s ASN 495 N -5.87 3.15 0.53 -1.84 -0.87 -1.26 -5.01 114.94 103.77 3dl5 s ASN 495 Ca -0.06 -0.57 0.29 0.00 -1.57 0.00 0.00 52.86 50.94 3dl5 s ASN 495 Cb 0.07 -1.44 1.43 0.00 -0.02 0.00 0.00 41.25 41.29 3dl5 s ASN 495 CO 0.83 0.12 1.91 -0.29 -2.57 0.00 0.00 177.10 177.10 3dl5 h ILE 496 N 5.76 0.61 0.00 0.60 2.10 -1.95 0.17 117.51 124.80 3dl5 h ILE 496 Ca -0.27 -0.01 0.00 0.00 1.08 0.00 0.00 64.86 65.66 3dl5 h ILE 496 Cb 1.21 0.57 0.00 0.00 -1.09 0.00 0.00 36.82 37.52 3dl5 h ILE 496 CO 0.52 0.01 0.00 -1.84 -1.08 0.00 0.00 178.15 175.76 3dl5 n GLU 497 N -4.31 0.89 0.04 2.19 0.00 -1.26 -3.50 120.64 114.68 3dl5 n GLU 497 Ca 0.16 0.00 0.11 0.00 0.00 0.00 0.00 57.16 57.44 3dl5 n GLU 497 Cb 0.85 -1.09 -0.08 0.00 0.00 0.00 0.00 31.44 31.12 3dl5 n GLU 497 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 3dl5 n ASP 498 N -0.59 0.43 -4.59 -1.84 10.43 0.59 -4.98 116.55 115.99 3dl5 n ASP 498 Ca 0.04 0.09 -0.41 0.00 2.57 0.00 0.00 54.79 57.08 3dl5 n ASP 498 Cb 0.02 1.22 0.01 0.00 1.84 0.00 0.00 41.12 44.20 3dl5 n ASP 498 CO 0.00 0.00 0.00 0.49 -1.07 0.00 0.00 177.20 176.62 3dl5 n PHE 499 N -2.38 0.99 -4.23 1.24 3.01 -1.23 -5.02 117.46 109.84 3dl5 n PHE 499 Ca -0.02 0.57 -0.14 0.00 1.01 0.00 0.00 57.45 58.87 3dl5 n PHE 499 Cb 0.54 -2.20 -0.10 0.00 -0.01 0.00 0.00 39.48 37.71 3dl5 n PHE 499 CO 0.00 0.00 0.00 0.15 1.01 0.00 0.00 176.76 177.92 3dl5 s LYS 500 N -1.97 1.01 0.24 -1.08 -0.14 -1.26 -5.02 119.74 111.52 3dl5 s LYS 500 Ca 0.63 -1.40 -0.05 0.00 -1.36 0.00 0.00 55.97 53.80 3dl5 s LYS 500 Cb -0.57 -0.58 0.38 0.00 -1.68 0.00 0.00 37.83 35.38 3dl5 s LYS 500 CO 0.57 0.07 1.82 2.35 -0.76 0.00 0.00 175.35 179.40 3dl5 h TRP 501 N 2.92 0.88 0.00 3.18 -0.00 -1.96 -1.11 115.95 119.86 3dl5 h TRP 501 Ca -0.37 0.03 -0.00 0.00 -0.00 0.00 0.00 58.89 58.55 3dl5 h TRP 501 Cb 1.19 -0.27 -0.00 0.00 -0.00 0.00 0.00 29.16 30.08 3dl5 h TRP 501 CO 0.64 0.38 -0.01 0.93 -0.00 0.00 0.00 178.44 180.38 3dl5 h GLU 502 N 0.83 0.00 0.00 2.65 3.07 -2.01 -0.34 114.58 118.77 3dl5 h GLU 502 Ca 0.39 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.25 3dl5 h GLU 502 Cb 0.31 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.22 3dl5 h GLU 502 CO -0.23 0.01 0.00 -0.44 -1.40 0.00 0.00 179.01 176.96 3dl5 h ASP 503 N 0.00 0.00 -3.26 1.42 3.45 -1.61 -3.45 116.42 112.98 3dl5 h ASP 503 Ca -0.00 0.00 -0.58 0.00 0.43 0.00 0.00 57.03 56.88 3dl5 h ASP 503 Cb 0.05 0.00 -0.06 0.00 -0.56 0.00 0.00 39.33 38.75 3dl5 h ASP 503 CO 0.00 0.00 -0.11 -0.63 -1.57 0.00 0.00 179.24 176.93 3dl5 s ILE 504 N -3.34 5.05 -0.18 0.35 -1.09 -0.14 0.11 121.20 121.96 3dl5 s ILE 504 Ca 0.05 1.03 -0.00 0.00 -2.23 0.00 0.00 60.65 59.50 3dl5 s ILE 504 Cb 0.09 -3.83 0.05 0.00 -1.58 0.00 0.00 42.46 37.18 3dl5 s ILE 504 CO 0.52 0.41 -0.05 -0.70 -1.23 0.00 0.00 174.94 173.90 3dl5 s GLU 505 N -0.02 1.46 -0.36 2.79 2.12 0.06 -4.94 118.70 119.80 3dl5 s GLU 505 Ca 0.27 -0.63 -0.15 0.00 0.36 0.00 0.00 54.97 54.82 3dl5 s GLU 505 Cb -0.17 -2.17 -0.01 0.00 0.26 0.00 0.00 34.13 32.05 3dl5 s GLU 505 CO 0.13 -0.48 0.32 -1.17 -0.54 0.00 0.00 175.26 173.52 3dl5 s LEU 506 N 1.58 4.61 -0.26 2.70 0.20 -1.26 -1.07 118.68 125.18 3dl5 s LEU 506 Ca -0.01 -0.44 -0.04 0.00 0.69 0.00 0.00 54.13 54.33 3dl5 s LEU 506 Cb -0.16 -2.25 0.01 0.00 -0.43 0.00 0.00 46.19 43.36 3dl5 s LEU 506 CO -0.07 -0.34 0.01 -0.63 -0.29 0.00 0.00 176.35 175.02 3dl5 s ILE 507 N 1.88 3.47 0.00 6.68 1.01 0.63 -4.70 121.20 130.17 3dl5 s ILE 507 Ca 0.09 -0.75 0.00 0.00 0.00 0.00 0.00 60.65 59.99 3dl5 s ILE 507 Cb -0.17 -2.73 0.00 0.00 0.01 0.00 0.00 42.46 39.56 3dl5 s ILE 507 CO 0.11 0.20 0.00 0.61 0.00 0.00 0.00 174.94 175.86 3dl5 n GLY 508 N 4.78 0.81 3.54 6.18 0.00 -1.26 -0.66 105.19 118.59 3dl5 n GLY 508 Ca -0.16 -0.65 -0.41 0.00 0.00 0.00 0.00 46.02 44.79 3dl5 n GLY 508 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3dl5 s TYR 509 N -2.47 3.18 -0.56 1.61 6.04 -1.26 -4.15 117.35 119.74 3dl5 s TYR 509 Ca 0.00 0.06 0.07 0.00 0.04 0.00 0.00 57.07 57.23 3dl5 s TYR 509 Cb 0.00 -2.89 0.25 0.00 -1.04 0.00 0.00 41.96 38.28 3dl5 s TYR 509 CO 0.00 -0.55 0.66 0.66 -1.54 0.00 0.00 175.55 174.78 3dl5 n TYR 510 N 5.68 2.26 -1.40 4.97 4.01 -1.26 -5.06 117.16 126.35 3dl5 n TYR 510 Ca -0.06 -3.95 -0.32 0.00 -0.16 0.00 0.00 57.90 53.41 3dl5 n TYR 510 Cb 0.49 -0.48 0.08 0.00 -0.31 0.00 0.00 39.34 39.12 3dl5 n TYR 510 CO 0.00 0.00 0.00 -1.25 -0.46 0.00 0.00 176.86 175.15 3dl5 s PRO 511 N -1.99 2.38 1.17 -0.72 0.04 -1.26 -4.93 135.00 129.68 3dl5 s PRO 511 Ca 0.38 1.27 -0.14 0.00 0.04 0.00 0.00 61.00 62.55 3dl5 s PRO 511 Cb 0.15 -1.91 0.28 0.00 0.04 0.00 0.00 34.50 33.06 3dl5 s PRO 511 CO -0.05 -1.56 1.03 0.71 0.04 0.00 0.00 177.00 177.17 3dl5 s TYR 512 N -2.69 1.28 0.76 0.56 1.51 0.12 -4.86 117.35 114.03 3dl5 s TYR 512 Ca 0.64 1.00 -0.13 0.00 -1.01 0.00 0.00 57.07 57.57 3dl5 s TYR 512 Cb -0.19 -3.14 0.06 0.00 -0.11 0.00 0.00 41.96 38.58 3dl5 s TYR 512 CO 0.51 -3.80 1.14 -2.14 -1.11 0.00 0.00 175.55 170.15 3dl5 s PRO 513 N -4.70 2.07 0.62 -1.71 0.02 -1.26 -1.62 135.00 128.42 3dl5 s PRO 513 Ca 0.68 1.49 -0.18 0.00 0.02 0.00 0.00 61.00 63.01 3dl5 s PRO 513 Cb -0.21 -1.85 -0.02 0.00 0.02 0.00 0.00 34.50 32.43 3dl5 s PRO 513 CO 0.62 -1.83 1.20 -0.08 -0.33 0.00 0.00 177.00 176.58 3dl5 s THR 514 N -2.43 2.63 -0.21 0.99 -1.32 -1.26 -3.20 115.64 110.84 3dl5 s THR 514 Ca 0.68 0.37 0.01 0.00 -1.21 0.00 0.00 61.69 61.53 3dl5 s THR 514 Cb -0.23 -3.08 0.05 0.00 -1.51 0.00 0.00 72.50 67.73 3dl5 s THR 514 CO 0.50 -0.11 -0.07 -0.63 -2.21 0.00 0.00 174.62 172.10 3dl5 s ILE 515 N -1.72 1.49 0.18 5.08 1.01 -1.26 -4.87 121.20 121.10 3dl5 s ILE 515 Ca 0.76 -1.05 -0.32 0.00 0.00 0.00 0.00 60.65 60.04 3dl5 s ILE 515 Cb -0.29 -1.68 -0.11 0.00 0.01 0.00 0.00 42.46 40.38 3dl5 s ILE 515 CO 0.36 0.02 1.71 -0.54 0.00 0.00 0.00 174.94 176.49 3dl5 s LYS 516 N 1.44 4.14 -0.14 2.79 -0.14 -1.26 -5.00 119.74 121.57 3dl5 s LYS 516 Ca -0.03 2.55 -0.04 0.00 -1.36 0.00 0.00 55.97 57.09 3dl5 s LYS 516 Cb -0.17 -3.20 0.07 0.00 -1.68 0.00 0.00 37.83 32.84 3dl5 s LYS 516 CO -0.07 -0.74 0.20 -1.64 -0.76 0.00 0.00 175.35 172.34 3dl5 s MET 517 N 1.50 0.11 0.16 1.68 -1.94 -1.26 -4.95 119.30 114.60 3dl5 s MET 517 Ca 0.75 0.48 -0.30 0.00 -1.71 0.00 0.00 55.69 54.91 3dl5 s MET 517 Cb -0.48 -0.54 -0.08 0.00 2.01 0.00 0.00 34.83 35.75 3dl5 s MET 517 CO 0.33 -0.42 1.27 -0.51 -0.01 0.00 0.00 175.02 175.68 3dl5 s ASP 518 N 2.33 6.97 0.38 3.03 1.01 -1.26 -5.01 116.67 124.12 3dl5 s ASP 518 Ca 0.04 2.27 -0.23 0.00 0.71 0.00 0.00 52.55 55.34 3dl5 s ASP 518 Cb -0.13 -2.60 -0.10 0.00 1.01 0.00 0.00 42.92 41.09 3dl5 s ASP 518 CO -0.09 -0.50 0.94 -0.32 0.21 0.00 0.00 175.17 175.42 3dl5 s MET 519 N 0.27 4.37 -0.36 8.23 1.75 -1.26 -4.98 119.30 127.32 3dl5 s MET 519 Ca 0.57 1.19 -0.15 0.00 -1.25 0.00 0.00 55.69 56.06 3dl5 s MET 519 Cb -0.34 -2.44 -0.01 0.00 2.84 0.00 0.00 34.83 34.88 3dl5 s MET 519 CO 0.35 0.10 0.34 0.00 -0.65 0.00 0.00 175.02 175.16 3dl5 s ALA 520 N -1.95 3.49 -2.00 4.11 0.00 -1.26 -5.17 121.76 118.99 3dl5 s ALA 520 Ca 0.57 -1.32 0.18 0.00 0.00 0.00 0.00 51.96 51.38 3dl5 s ALA 520 Cb -0.13 -2.82 1.06 0.00 0.00 0.00 0.00 23.12 21.23 3dl5 s ALA 520 CO 0.17 -1.14 1.46 0.28 0.00 0.00 0.00 175.76 176.53