#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 2.04 0.47 3.44 -2.85 -1.26 -5.10 119.74 116.49 3dl5 s LYS 4 Ca 0.00 -1.18 -0.21 0.00 -1.00 0.00 0.00 55.97 53.59 3dl5 s LYS 4 Cb 0.00 -2.45 -0.08 0.00 -2.06 0.00 0.00 37.83 33.23 3dl5 s LYS 4 CO 0.00 -1.12 1.05 1.21 0.10 0.00 0.00 175.35 176.59 3dl5 s ASN 5 N -4.64 6.37 -0.28 0.03 2.47 -1.26 -4.94 114.94 112.68 3dl5 s ASN 5 Ca 0.63 1.97 -0.02 0.00 0.42 0.00 0.00 52.86 55.86 3dl5 s ASN 5 Cb -0.07 -2.57 0.09 0.00 -1.45 0.00 0.00 41.25 37.26 3dl5 s ASN 5 CO 0.41 -0.76 0.09 -0.69 -3.72 0.00 0.00 177.10 172.43 3dl5 s VAL 6 N -1.91 0.63 0.03 -5.21 1.01 -1.26 -1.48 120.40 112.21 3dl5 s VAL 6 Ca 0.66 -1.12 0.07 0.00 0.00 0.00 0.00 61.98 61.59 3dl5 s VAL 6 Cb -0.18 -1.42 -0.02 0.00 0.00 0.00 0.00 36.38 34.76 3dl5 s VAL 6 CO 0.22 -0.60 -0.21 -0.94 0.00 0.00 0.00 175.10 173.57 3dl5 s SER 7 N 1.75 2.53 0.39 3.32 1.04 -0.44 0.28 113.70 122.57 3dl5 s SER 7 Ca 0.08 -0.49 -0.23 0.00 0.48 0.00 0.00 55.95 55.79 3dl5 s SER 7 Cb -0.17 -0.23 -0.10 0.00 0.10 0.00 0.00 66.02 65.62 3dl5 s SER 7 CO -0.24 0.19 0.96 -0.63 0.98 0.00 0.00 173.24 174.50 3dl5 s ILE 8 N -0.72 4.26 -0.06 -1.02 1.01 -0.34 -1.58 121.20 122.75 3dl5 s ILE 8 Ca 0.08 1.58 0.02 0.00 0.00 0.00 0.00 60.65 62.32 3dl5 s ILE 8 Cb -0.09 -3.74 0.02 0.00 0.01 0.00 0.00 42.46 38.66 3dl5 s ILE 8 CO 0.01 -0.14 -0.08 -0.69 0.00 0.00 0.00 174.94 174.04 3dl5 s VAL 9 N -1.95 0.83 0.17 2.92 1.01 -0.79 -0.17 120.40 122.43 3dl5 s VAL 9 Ca 0.58 -0.30 -0.24 0.00 0.00 0.00 0.00 61.98 62.03 3dl5 s VAL 9 Cb -0.13 -0.80 0.06 0.00 0.00 0.00 0.00 36.38 35.50 3dl5 s VAL 9 CO 0.18 0.29 0.79 0.54 0.00 0.00 0.00 175.10 176.90 3dl5 s VAL 10 N 0.81 0.00 -0.06 2.92 0.11 -0.14 -4.53 120.40 119.50 3dl5 s VAL 10 Ca -0.12 -0.54 -0.00 0.00 -2.93 0.00 0.00 61.98 58.38 3dl5 s VAL 10 Cb -0.15 -1.64 0.02 0.00 -1.53 0.00 0.00 36.38 33.08 3dl5 s VAL 10 CO 0.02 0.00 -0.03 0.00 -3.33 0.00 0.00 175.10 171.76 3dl5 s ALA 11 N -3.58 0.73 0.05 1.54 0.00 -1.26 -0.21 121.76 119.04 3dl5 s ALA 11 Ca 0.08 -0.12 -0.01 0.00 0.00 0.00 0.00 51.96 51.91 3dl5 s ALA 11 Cb -0.03 -0.60 -0.04 0.00 0.00 0.00 0.00 23.12 22.45 3dl5 s ALA 11 CO -0.01 -0.25 -0.01 0.00 0.00 0.00 0.00 175.76 175.49 3dl5 s ALA 12 N 1.46 0.41 0.49 0.00 0.00 -0.10 -4.52 121.76 119.50 3dl5 s ALA 12 Ca -0.03 -1.10 -0.23 0.00 0.00 0.00 0.00 51.96 50.61 3dl5 s ALA 12 Cb -0.13 0.27 -0.06 0.00 0.00 0.00 0.00 23.12 23.19 3dl5 s ALA 12 CO -0.03 -0.35 1.33 -1.54 0.00 0.00 0.00 175.76 175.17 3dl5 s SER 13 N -2.74 5.68 0.24 0.00 1.04 -0.64 -0.60 113.70 116.68 3dl5 s SER 13 Ca 0.04 2.70 -0.04 0.00 0.48 0.00 0.00 55.95 59.13 3dl5 s SER 13 Cb 0.06 -2.63 0.46 0.00 0.10 0.00 0.00 66.02 64.01 3dl5 s SER 13 CO -0.09 -1.29 1.71 -0.37 0.98 0.00 0.00 173.24 174.18 3dl5 h VAL 14 N 1.81 0.59 0.00 5.02 -1.51 -0.53 -1.91 116.25 119.73 3dl5 h VAL 14 Ca -0.50 -0.13 -0.02 0.00 -1.23 0.00 0.00 66.70 64.83 3dl5 h VAL 14 Cb 1.28 0.20 -0.00 0.00 -2.13 0.00 0.00 31.29 30.63 3dl5 h VAL 14 CO 0.59 0.07 -0.66 0.18 -1.23 0.00 0.00 177.57 176.52 3dl5 n LEU 15 N -5.07 1.84 -0.07 4.19 4.77 -1.26 -4.62 117.00 116.78 3dl5 n LEU 15 Ca 0.14 0.57 0.13 0.00 -0.03 0.00 0.00 56.01 56.82 3dl5 n LEU 15 Cb 0.44 -0.85 0.45 0.00 -2.33 0.00 0.00 43.42 41.13 3dl5 n LEU 15 CO 0.16 -0.39 0.71 -1.54 -1.33 0.00 0.00 177.39 175.00 3dl5 n SER 16 N -4.57 0.46 -2.90 -1.43 3.41 -1.26 -4.95 113.62 102.38 3dl5 n SER 16 Ca -0.10 -0.28 -0.21 0.00 -0.26 0.00 0.00 58.87 58.02 3dl5 n SER 16 Cb 0.34 -0.02 0.04 0.00 -0.26 0.00 0.00 64.21 64.31 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 -1.22 -5.81 -4.74 4.04 7.64 -0.72 -4.79 113.62 108.03 3dl5 n SER 17 Ca 0.09 -0.32 -0.41 0.00 1.01 0.00 0.00 58.87 59.24 3dl5 n SER 17 Cb 0.32 -4.58 -0.04 0.00 -1.01 0.00 0.00 64.21 58.90 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 -2.88 2.81 0.00 0.23 0.00 -1.26 -0.84 107.32 105.38 3dl5 s GLY 18 Ca 0.34 0.87 0.00 0.00 0.00 0.00 0.00 44.72 45.93 3dl5 s GLY 18 CO 0.42 1.71 0.09 0.29 0.00 0.00 0.00 173.10 175.61 3dl5 n ILE 19 N 2.31 0.00 -3.56 0.90 -5.35 0.92 -1.62 119.36 112.95 3dl5 n ILE 19 Ca 0.03 -0.37 -0.11 0.00 -0.27 0.00 0.00 62.75 62.03 3dl5 n ILE 19 Cb 0.45 1.06 -0.04 0.00 -1.74 0.00 0.00 39.64 39.38 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 -0.56 -0.40 -0.19 3.28 0.00 -0.88 -4.52 107.32 104.06 3dl5 s GLY 20 Ca 0.00 0.21 -0.11 0.00 0.00 0.00 0.00 44.72 44.82 3dl5 s GLY 20 CO 0.00 -0.07 0.46 -1.50 0.00 0.00 0.00 173.10 171.99 3dl5 s ILE 21 N -3.57 -0.02 -1.60 0.90 1.10 0.28 -1.41 121.20 116.89 3dl5 s ILE 21 Ca 0.01 0.07 -0.05 0.00 -0.51 0.00 0.00 60.65 60.16 3dl5 s ILE 21 Cb 0.01 -0.68 0.05 0.00 0.15 0.00 0.00 42.46 41.99 3dl5 s ILE 21 CO -0.11 0.03 0.18 0.59 -2.11 0.00 0.00 174.94 173.52 3dl5 n ASN 22 N 4.08 0.18 -0.98 4.50 3.02 -1.26 0.35 115.26 125.14 3dl5 n ASN 22 Ca -0.21 -1.24 -0.12 0.00 -0.03 0.00 0.00 54.58 52.98 3dl5 n ASN 22 Cb 0.56 -1.77 -0.04 0.00 -0.61 0.00 0.00 39.78 37.92 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 -2.21 1.04 3.49 7.41 0.00 -1.26 -4.99 105.19 108.67 3dl5 n GLY 23 Ca -0.23 -0.47 -0.09 0.00 0.00 0.00 0.00 46.02 45.23 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 -3.28 1.39 0.63 1.61 -0.21 0.15 -4.63 119.66 115.32 3dl5 s GLN 24 Ca 0.00 -1.16 -0.17 0.00 0.02 0.00 0.00 55.36 54.04 3dl5 s GLN 24 Cb 0.00 0.45 -0.01 0.00 1.00 0.00 0.00 33.01 34.44 3dl5 s GLN 24 CO 0.00 -0.56 1.17 -0.51 -2.12 0.00 0.00 175.29 173.28 3dl5 s LEU 25 N -2.98 3.54 0.00 2.90 1.43 -1.26 0.10 118.68 122.41 3dl5 s LEU 25 Ca 0.19 2.27 0.15 0.00 -1.03 0.00 0.00 54.13 55.71 3dl5 s LEU 25 Cb 0.01 -4.58 0.60 0.00 0.03 0.00 0.00 46.19 42.25 3dl5 s LEU 25 CO 0.04 -1.70 1.43 -2.65 0.23 0.00 0.00 176.35 173.70 3dl5 n PRO 26 N -1.99 1.57 -3.66 1.29 -0.02 -1.26 -4.65 135.00 126.29 3dl5 n PRO 26 Ca 0.13 -0.87 -0.09 0.00 -2.02 0.00 0.00 63.50 60.64 3dl5 n PRO 26 Cb 0.50 -1.30 -0.02 0.00 -0.02 0.00 0.00 33.50 32.66 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 -1.77 -0.35 -0.24 6.00 -2.14 -1.26 -5.09 118.94 114.10 3dl5 s TRP 27 Ca 0.26 -0.00 0.01 0.00 2.66 0.00 0.00 56.10 59.03 3dl5 s TRP 27 Cb 0.13 0.64 0.06 0.00 -3.10 0.00 0.00 33.47 31.21 3dl5 s TRP 27 CO 0.20 -1.06 -0.06 0.45 -2.66 0.00 0.00 176.95 173.82 3dl5 s SER 28 N -2.84 3.96 -0.24 -2.66 0.15 -1.26 -5.08 113.70 105.73 3dl5 s SER 28 Ca 0.07 -1.24 -0.04 0.00 0.70 0.00 0.00 55.95 55.44 3dl5 s SER 28 Cb -0.04 -1.23 0.08 0.00 -1.71 0.00 0.00 66.02 63.12 3dl5 s SER 28 CO -0.02 -0.24 0.10 -0.63 1.20 0.00 0.00 173.24 173.66 3dl5 s ILE 29 N 1.35 0.05 0.16 6.45 1.01 -1.26 -4.97 121.20 123.99 3dl5 s ILE 29 Ca -0.06 -0.55 -0.14 0.00 0.00 0.00 0.00 60.65 59.90 3dl5 s ILE 29 Cb -0.19 -0.87 0.05 0.00 0.01 0.00 0.00 42.46 41.45 3dl5 s ILE 29 CO -0.06 -0.50 1.77 0.77 0.00 0.00 0.00 174.94 176.92 3dl5 h SER 30 N 8.38 0.62 -0.93 3.58 4.64 -1.99 -2.70 113.55 125.14 3dl5 h SER 30 Ca -0.17 -0.08 0.18 0.00 -0.47 0.00 0.00 61.79 61.24 3dl5 h SER 30 Cb 1.08 -0.16 -0.10 0.00 -0.31 0.00 0.00 62.40 62.90 3dl5 h SER 30 CO 0.37 0.52 0.52 -0.33 -0.87 0.00 0.00 176.83 177.05 3dl5 h GLU 31 N 0.67 0.64 -0.47 4.77 3.07 -1.98 0.30 114.58 121.58 3dl5 h GLU 31 Ca 0.18 -0.04 -0.10 0.00 -0.50 0.00 0.00 59.36 58.90 3dl5 h GLU 31 Cb 0.04 -0.14 -0.02 0.00 -0.84 0.00 0.00 28.75 27.79 3dl5 h GLU 31 CO -0.03 0.42 -0.11 0.22 -1.40 0.00 0.00 179.01 178.11 3dl5 h ASP 32 N 0.66 0.84 -0.10 1.42 3.58 -1.92 0.11 116.42 121.01 3dl5 h ASP 32 Ca 0.53 -0.26 -0.09 0.00 0.42 0.00 0.00 57.03 57.63 3dl5 h ASP 32 Cb 0.83 -0.23 -0.01 0.00 1.72 0.00 0.00 39.33 41.64 3dl5 h ASP 32 CO -0.40 0.97 -0.22 -0.07 -2.88 0.00 0.00 179.24 176.64 3dl5 h LEU 33 N 0.77 0.52 -1.08 2.28 3.38 -0.44 0.80 115.31 121.54 3dl5 h LEU 33 Ca 0.13 -0.17 -0.09 0.00 0.09 0.00 0.00 57.88 57.83 3dl5 h LEU 33 Cb 0.62 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.21 3dl5 h LEU 33 CO 0.04 0.75 -0.36 0.11 0.09 0.00 0.00 178.44 179.07 3dl5 h LYS 34 N 0.46 0.19 0.64 1.13 1.57 0.08 0.32 116.57 120.96 3dl5 h LYS 34 Ca 0.07 -0.08 -0.03 0.00 -1.87 0.00 0.00 60.65 58.74 3dl5 h LYS 34 Cb 0.64 -0.01 0.01 0.00 0.08 0.00 0.00 32.23 32.95 3dl5 h LYS 34 CO 0.05 0.53 -0.31 0.35 -0.57 0.00 0.00 179.45 179.50 3dl5 h PHE 35 N 0.16 -0.79 -0.76 -1.35 3.57 0.31 0.94 116.94 119.01 3dl5 h PHE 35 Ca 0.02 -0.02 0.18 0.00 3.53 0.00 0.00 57.97 61.68 3dl5 h PHE 35 Cb 0.72 0.26 -0.13 0.00 2.79 0.00 0.00 35.95 39.59 3dl5 h PHE 35 CO 0.01 -0.46 0.04 0.35 -2.23 0.00 0.00 178.31 176.02 3dl5 h PHE 36 N -1.15 0.02 0.14 0.41 3.04 -0.71 0.41 116.94 119.09 3dl5 h PHE 36 Ca -0.09 0.05 -0.00 0.00 3.98 0.00 0.00 57.97 61.92 3dl5 h PHE 36 Cb 0.69 0.11 -0.01 0.00 2.56 0.00 0.00 35.95 39.31 3dl5 h PHE 36 CO 0.00 -0.22 -0.10 1.03 -2.02 0.00 0.00 178.31 177.00 3dl5 h SER 37 N 0.13 -0.25 -0.52 0.41 0.87 -0.76 -1.31 113.55 112.11 3dl5 h SER 37 Ca 0.42 0.02 -0.08 0.00 -1.23 0.00 0.00 61.79 60.92 3dl5 h SER 37 Cb 0.76 0.08 -0.02 0.00 -0.44 0.00 0.00 62.40 62.78 3dl5 h SER 37 CO -0.65 -0.16 0.01 0.11 -0.53 0.00 0.00 176.83 175.61 3dl5 h LYS 38 N -0.24 0.91 -0.25 2.24 1.57 0.12 -0.77 116.57 120.15 3dl5 h LYS 38 Ca -0.01 -0.29 -0.07 0.00 -1.87 0.00 0.00 60.65 58.41 3dl5 h LYS 38 Cb 0.21 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.42 3dl5 h LYS 38 CO -0.00 0.93 -0.15 0.97 -0.57 0.00 0.00 179.45 180.63 3dl5 h ILE 39 N 0.78 1.23 0.00 1.86 6.09 -0.23 -1.50 117.51 125.74 3dl5 h ILE 39 Ca 0.15 -1.02 0.00 0.00 -1.37 0.00 0.00 64.86 62.62 3dl5 h ILE 39 Cb 0.52 1.20 0.00 0.00 0.47 0.00 0.00 36.82 39.01 3dl5 h ILE 39 CO 0.03 0.33 -0.44 0.71 -3.07 0.00 0.00 178.15 175.70 3dl5 h THR 40 N 0.40 0.00 -0.17 2.19 1.35 -1.08 -3.23 112.91 112.37 3dl5 h THR 40 Ca 0.07 -0.66 0.00 0.00 -0.55 0.00 0.00 66.41 65.27 3dl5 h THR 40 Cb 0.50 1.39 0.00 0.00 -1.73 0.00 0.00 68.15 68.31 3dl5 h THR 40 CO 0.03 0.00 0.00 0.59 -0.25 0.00 0.00 175.52 175.89 3dl5 n ASN 41 N -2.41 3.15 -4.65 5.36 3.02 -0.31 -4.71 115.26 114.71 3dl5 n ASN 41 Ca 0.03 -1.99 -0.43 0.00 -0.03 0.00 0.00 54.58 52.17 3dl5 n ASN 41 Cb 0.47 -0.10 -0.02 0.00 -0.61 0.00 0.00 39.78 39.52 3dl5 n ASN 41 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 3dl5 s ASN 42 N -1.80 6.82 0.02 6.41 2.47 -0.59 -5.01 114.94 123.26 3dl5 s ASN 42 Ca 0.32 1.59 -0.23 0.00 0.42 0.00 0.00 52.86 54.97 3dl5 s ASN 42 Cb 0.21 -2.54 0.05 0.00 -1.45 0.00 0.00 41.25 37.53 3dl5 s ASN 42 CO 0.31 -0.88 0.52 -1.59 -3.72 0.00 0.00 177.10 171.74 3dl5 s LYS 43 N 3.77 0.99 -0.17 0.43 -2.85 -1.26 -4.96 119.74 115.69 3dl5 s LYS 43 Ca 0.57 -0.13 -0.17 0.00 -1.00 0.00 0.00 55.97 55.25 3dl5 s LYS 43 Cb -0.21 0.45 -0.13 0.00 -2.06 0.00 0.00 37.83 35.88 3dl5 s LYS 43 CO 0.18 -0.34 0.13 0.00 0.10 0.00 0.00 175.35 175.43 3dl5 s ASP 45 N -6.34 6.78 0.00 0.00 -1.08 -1.26 -4.90 116.67 109.88 3dl5 s ASP 45 Ca -0.21 0.78 0.27 0.00 -0.52 0.00 0.00 52.55 52.87 3dl5 s ASP 45 Cb 0.03 -2.50 1.55 0.00 -1.46 0.00 0.00 42.92 40.55 3dl5 s ASP 45 CO 0.44 -0.86 1.96 -1.54 0.52 0.00 0.00 175.17 175.69 3dl5 n SER 46 N 6.80 0.00 -1.27 -0.34 3.41 -1.26 -2.69 113.62 118.27 3dl5 n SER 46 Ca 0.09 -0.61 0.10 0.00 -0.26 0.00 0.00 58.87 58.19 3dl5 n SER 46 Cb 0.48 -0.09 0.30 0.00 -0.26 0.00 0.00 64.21 64.63 3dl5 n SER 46 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 3dl5 n ASN 47 N -1.09 3.71 -4.37 4.04 4.13 -1.26 -4.92 115.26 115.51 3dl5 n ASN 47 Ca 0.18 -2.10 -0.21 0.00 1.68 0.00 0.00 54.58 54.14 3dl5 n ASN 47 Cb 0.13 -0.47 -0.10 0.00 -1.54 0.00 0.00 39.78 37.81 3dl5 n ASN 47 CO 0.00 0.00 0.00 -0.54 0.28 0.00 0.00 177.26 177.00 3dl5 s LYS 48 N -1.29 1.64 0.13 3.52 1.02 -1.10 -4.92 119.74 118.75 3dl5 s LYS 48 Ca 0.44 -1.92 0.04 0.00 0.02 0.00 0.00 55.97 54.55 3dl5 s LYS 48 Cb 0.24 -0.68 -0.04 0.00 -0.52 0.00 0.00 37.83 36.83 3dl5 s LYS 48 CO 0.28 -0.26 -0.09 0.15 -0.92 0.00 0.00 175.35 174.51 3dl5 s LYS 49 N -3.90 1.00 0.36 1.68 1.02 0.21 -4.92 119.74 115.18 3dl5 s LYS 49 Ca 0.35 -1.42 0.01 0.00 0.02 0.00 0.00 55.97 54.93 3dl5 s LYS 49 Cb 0.08 -0.50 -0.03 0.00 -0.52 0.00 0.00 37.83 36.86 3dl5 s LYS 49 CO 0.15 0.05 0.55 -0.80 -0.92 0.00 0.00 175.35 174.38 3dl5 s ASN 50 N -3.13 6.20 -0.04 2.83 0.01 -1.26 -2.22 114.94 117.32 3dl5 s ASN 50 Ca 0.15 0.37 0.07 0.00 -0.71 0.00 0.00 52.86 52.74 3dl5 s ASN 50 Cb 0.03 -1.90 -0.02 0.00 0.41 0.00 0.00 41.25 39.78 3dl5 s ASN 50 CO -0.01 -0.36 -0.24 0.00 -1.51 0.00 0.00 177.10 174.99 3dl5 s ALA 51 N -2.33 2.25 -0.20 0.60 0.00 -1.01 -1.82 121.76 119.25 3dl5 s ALA 51 Ca 0.41 -1.07 0.01 0.00 0.00 0.00 0.00 51.96 51.31 3dl5 s ALA 51 Cb -0.10 -0.67 0.02 0.00 0.00 0.00 0.00 23.12 22.38 3dl5 s ALA 51 CO 0.36 0.49 -0.16 -0.51 0.00 0.00 0.00 175.76 175.94 3dl5 s LEU 52 N -0.46 2.47 0.04 0.00 1.43 -0.38 -1.38 118.68 120.39 3dl5 s LEU 52 Ca 0.05 -0.74 -0.15 0.00 -1.03 0.00 0.00 54.13 52.27 3dl5 s LEU 52 Cb -0.11 -1.53 -0.06 0.00 0.03 0.00 0.00 46.19 44.52 3dl5 s LEU 52 CO 0.01 -0.04 0.45 -0.63 0.23 0.00 0.00 176.35 176.37 3dl5 s ILE 53 N 1.29 4.97 0.07 -0.59 1.01 0.75 -0.17 121.20 128.54 3dl5 s ILE 53 Ca 0.03 0.85 -0.26 0.00 0.00 0.00 0.00 60.65 61.27 3dl5 s ILE 53 Cb -0.14 -3.73 0.07 0.00 0.01 0.00 0.00 42.46 38.66 3dl5 s ILE 53 CO -0.10 0.51 0.63 0.00 0.00 0.00 0.00 174.94 175.97 3dl5 s MET 54 N -1.27 1.19 1.06 2.79 0.23 -0.79 0.76 119.30 123.26 3dl5 s MET 54 Ca 0.27 -0.18 -0.13 0.00 -1.03 0.00 0.00 55.69 54.62 3dl5 s MET 54 Cb -0.17 0.55 0.22 0.00 -1.53 0.00 0.00 34.83 33.91 3dl5 s MET 54 CO 0.15 -0.47 1.08 0.20 -2.03 0.00 0.00 175.02 173.96 3dl5 s GLY 55 N -2.12 1.55 0.25 3.16 0.00 -0.58 -2.00 107.32 107.58 3dl5 s GLY 55 Ca -0.04 -0.39 0.06 0.00 0.00 0.00 0.00 44.72 44.36 3dl5 s GLY 55 CO -0.04 0.28 1.58 -0.09 0.00 0.00 0.00 173.10 174.84 3dl5 h ARG 56 N -2.15 0.16 0.00 2.90 1.12 -1.89 -2.60 114.38 111.92 3dl5 h ARG 56 Ca -0.56 -0.11 -0.09 0.00 -1.11 0.00 0.00 59.98 58.11 3dl5 h ARG 56 Cb 1.33 0.02 -0.01 0.00 -0.01 0.00 0.00 29.97 31.30 3dl5 h ARG 56 CO 0.55 0.71 -0.44 0.87 -3.11 0.00 0.00 179.97 178.55 3dl5 h LYS 57 N 0.12 0.00 -0.03 0.20 1.57 -1.92 -1.99 116.57 114.52 3dl5 h LYS 57 Ca -0.01 0.00 -0.17 0.00 -1.87 0.00 0.00 60.65 58.61 3dl5 h LYS 57 Cb 1.09 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.39 3dl5 h LYS 57 CO 0.09 0.44 -0.72 1.15 -0.57 0.00 0.00 179.45 179.84 3dl5 h THR 58 N 0.00 1.44 -0.90 -0.16 2.02 -1.86 -1.19 112.91 112.26 3dl5 h THR 58 Ca -0.00 -2.27 0.01 0.00 0.77 0.00 0.00 66.41 64.92 3dl5 h THR 58 Cb 0.91 2.21 -0.05 0.00 -1.74 0.00 0.00 68.15 69.49 3dl5 h THR 58 CO 0.06 0.66 0.59 -0.25 0.37 0.00 0.00 175.52 176.95 3dl5 h TRP 59 N 0.14 1.12 0.75 3.16 -0.00 -1.03 -2.53 115.95 117.57 3dl5 h TRP 59 Ca -0.02 0.03 -0.04 0.00 -0.00 0.00 0.00 58.89 58.86 3dl5 h TRP 59 Cb 1.28 -0.38 0.01 0.00 -0.00 0.00 0.00 29.16 30.07 3dl5 h TRP 59 CO 0.02 0.69 -0.36 -0.44 -0.00 0.00 0.00 178.44 178.35 3dl5 h ASP 60 N 1.20 -0.86 -0.27 2.65 3.32 -0.83 -1.56 116.42 120.08 3dl5 h ASP 60 Ca 0.33 0.03 0.08 0.00 0.02 0.00 0.00 57.03 57.49 3dl5 h ASP 60 Cb -0.11 0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.65 3dl5 h ASP 60 CO -0.08 -0.53 0.65 0.77 -1.72 0.00 0.00 179.24 178.33 3dl5 h SER 61 N -1.19 0.00 -0.40 6.45 4.64 -1.04 0.64 113.55 122.66 3dl5 h SER 61 Ca -0.10 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.22 3dl5 h SER 61 Cb 0.78 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.87 3dl5 h SER 61 CO 0.17 0.00 0.00 2.30 -0.87 0.00 0.00 176.83 178.43 3dl5 n ILE 62 N -3.07 0.51 -0.89 0.95 -5.35 -0.97 -4.96 119.36 105.58 3dl5 n ILE 62 Ca 0.05 -0.74 0.00 0.00 -0.27 0.00 0.00 62.75 61.79 3dl5 n ILE 62 Cb 0.76 0.94 0.00 0.00 -1.74 0.00 0.00 39.64 39.60 3dl5 n ILE 62 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3dl5 n GLY 63 N 1.51 0.66 4.10 3.28 0.00 0.22 -4.30 105.19 110.66 3dl5 n GLY 63 Ca 0.20 -0.72 -0.31 0.00 0.00 0.00 0.00 46.02 45.19 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 -2.20 -0.87 -4.67 1.61 1.74 -0.59 -4.92 116.66 106.75 3dl5 n ARG 64 Ca 0.00 0.09 -0.23 0.00 -0.77 0.00 0.00 57.85 56.94 3dl5 n ARG 64 Cb 0.10 -3.47 -0.15 0.00 -1.02 0.00 0.00 32.46 27.92 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 -6.66 1.25 0.67 5.56 0.52 -1.26 -5.12 118.95 113.92 3dl5 s ARG 65 Ca 0.27 -0.65 -0.17 0.00 -0.52 0.00 0.00 55.73 54.66 3dl5 s ARG 65 Cb -0.16 -1.24 0.00 0.00 0.52 0.00 0.00 34.95 34.08 3dl5 s ARG 65 CO 0.88 0.33 1.26 -1.25 0.02 0.00 0.00 175.30 176.54 3dl5 s PRO 66 N -0.61 2.44 -0.16 3.54 0.04 -1.26 -5.02 135.00 133.97 3dl5 s PRO 66 Ca 0.06 1.95 -0.11 0.00 0.04 0.00 0.00 61.00 62.94 3dl5 s PRO 66 Cb -0.07 -1.85 -0.05 0.00 0.04 0.00 0.00 34.50 32.58 3dl5 s PRO 66 CO 0.00 -1.65 0.20 -0.51 0.04 0.00 0.00 177.00 175.08 3dl5 s LEU 67 N -4.61 4.27 0.28 -3.56 1.43 -1.26 -5.05 118.68 110.19 3dl5 s LEU 67 Ca 0.80 0.40 -0.30 0.00 -1.03 0.00 0.00 54.13 54.00 3dl5 s LEU 67 Cb -0.34 -2.20 -0.12 0.00 0.03 0.00 0.00 46.19 43.55 3dl5 s LEU 67 CO 0.41 0.21 1.49 1.17 0.23 0.00 0.00 176.35 179.85 3dl5 n LYS 68 N 3.15 2.39 -0.72 1.70 4.81 -1.26 -2.72 118.16 125.50 3dl5 n LYS 68 Ca -0.15 0.85 0.00 0.00 -0.87 0.00 0.00 58.31 58.13 3dl5 n LYS 68 Cb 0.53 -2.56 0.00 0.00 0.02 0.00 0.00 35.03 33.02 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 1.91 -1.05 -4.54 3.14 5.03 -1.26 -4.95 115.26 113.54 3dl5 n ASN 69 Ca 0.09 0.00 -0.25 0.00 0.87 0.00 0.00 54.58 55.29 3dl5 n ASN 69 Cb 0.35 -1.92 -0.11 0.00 -1.02 0.00 0.00 39.78 37.08 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 -0.84 1.82 -0.22 3.52 0.52 -1.10 -4.43 118.95 118.22 3dl5 s ARG 70 Ca 0.00 -2.02 0.02 0.00 -0.52 0.00 0.00 55.73 53.20 3dl5 s ARG 70 Cb 0.00 -1.27 0.04 0.00 0.52 0.00 0.00 34.95 34.24 3dl5 s ARG 70 CO 0.00 -0.12 -0.13 0.42 0.02 0.00 0.00 175.30 175.49 3dl5 s ILE 71 N -2.99 1.95 0.16 1.52 1.01 -0.76 -4.67 121.20 117.41 3dl5 s ILE 71 Ca 0.35 -1.22 -0.30 0.00 0.00 0.00 0.00 60.65 59.48 3dl5 s ILE 71 Cb 0.09 -1.96 -0.07 0.00 0.01 0.00 0.00 42.46 40.53 3dl5 s ILE 71 CO 0.17 0.19 0.95 -0.63 0.00 0.00 0.00 174.94 175.61 3dl5 s ILE 72 N 1.26 4.35 -0.22 2.92 1.01 -0.25 -1.25 121.20 129.02 3dl5 s ILE 72 Ca -0.02 2.06 0.02 0.00 0.00 0.00 0.00 60.65 62.71 3dl5 s ILE 72 Cb -0.17 -4.32 0.04 0.00 0.01 0.00 0.00 42.46 38.03 3dl5 s ILE 72 CO -0.08 0.39 -0.15 -0.69 0.00 0.00 0.00 174.94 174.41 3dl5 s VAL 73 N -0.44 2.06 -0.20 2.92 1.01 0.76 -1.98 120.40 124.54 3dl5 s VAL 73 Ca 0.44 -1.27 -0.09 0.00 0.00 0.00 0.00 61.98 61.07 3dl5 s VAL 73 Cb -0.24 -2.04 -0.04 0.00 0.00 0.00 0.00 36.38 34.06 3dl5 s VAL 73 CO 0.30 0.24 0.09 -0.69 0.00 0.00 0.00 175.10 175.05 3dl5 s VAL 74 N 1.21 5.03 -0.45 2.92 1.01 -0.00 -1.89 120.40 128.24 3dl5 s VAL 74 Ca -0.02 0.06 -0.17 0.00 0.00 0.00 0.00 61.98 61.85 3dl5 s VAL 74 Cb -0.17 -3.29 0.04 0.00 0.00 0.00 0.00 36.38 32.97 3dl5 s VAL 74 CO -0.09 0.44 0.43 -0.63 0.00 0.00 0.00 175.10 175.25 3dl5 s ILE 75 N 0.48 5.13 -0.04 2.22 -1.09 -0.85 -1.04 121.20 126.02 3dl5 s ILE 75 Ca 0.05 -0.68 -0.10 0.00 -2.23 0.00 0.00 60.65 57.69 3dl5 s ILE 75 Cb -0.12 -4.09 0.02 0.00 -1.58 0.00 0.00 42.46 36.68 3dl5 s ILE 75 CO 0.00 -0.52 0.24 -0.55 -1.23 0.00 0.00 174.94 172.88 3dl5 s SER 76 N 2.20 -0.16 -0.00 3.58 0.15 -0.79 -2.97 113.70 115.71 3dl5 s SER 76 Ca 0.08 0.16 -0.11 0.00 0.70 0.00 0.00 55.95 56.79 3dl5 s SER 76 Cb -0.20 0.36 -0.32 0.00 -1.71 0.00 0.00 66.02 64.15 3dl5 s SER 76 CO 0.10 -0.29 0.85 0.77 1.20 0.00 0.00 173.24 175.88 3dl5 h SER 77 N 4.69 0.66 0.13 5.45 4.64 -1.84 -3.37 113.55 123.92 3dl5 h SER 77 Ca -0.29 -0.83 -0.36 0.00 -0.47 0.00 0.00 61.79 59.84 3dl5 h SER 77 Cb 1.19 -0.21 -0.05 0.00 -0.31 0.00 0.00 62.40 63.02 3dl5 h SER 77 CO 0.38 1.68 -2.16 -1.54 -0.87 0.00 0.00 176.83 174.32 3dl5 n SER 78 N -3.61 1.52 -4.76 4.97 3.41 -1.26 -4.95 113.62 108.94 3dl5 n SER 78 Ca -0.19 0.10 -0.39 0.00 -0.26 0.00 0.00 58.87 58.13 3dl5 n SER 78 Cb 1.08 -0.28 0.01 0.00 -0.26 0.00 0.00 64.21 64.76 3dl5 n SER 78 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 3dl5 s LEU 79 N -6.46 4.06 -0.10 1.04 0.20 -1.26 -4.88 118.68 111.28 3dl5 s LEU 79 Ca -0.21 2.69 -0.03 0.00 0.69 0.00 0.00 54.13 57.27 3dl5 s LEU 79 Cb 0.07 -4.06 -0.03 0.00 -0.43 0.00 0.00 46.19 41.74 3dl5 s LEU 79 CO 0.74 -1.13 0.02 -2.16 -0.29 0.00 0.00 176.35 173.52 3dl5 s PRO 80 N -2.54 3.13 0.00 0.98 0.04 -1.26 -4.88 135.00 130.47 3dl5 s PRO 80 Ca 0.63 -0.38 0.23 0.00 0.04 0.00 0.00 61.00 61.52 3dl5 s PRO 80 Cb -0.39 -2.87 1.37 0.00 0.04 0.00 0.00 34.50 32.65 3dl5 s PRO 80 CO 0.48 0.66 1.88 1.04 0.04 0.00 0.00 177.00 181.10 3dl5 n GLN 81 N 2.29 1.03 -1.33 4.56 6.02 -1.26 -4.87 117.38 123.82 3dl5 n GLN 81 Ca -0.19 -0.05 -0.41 0.00 -0.01 0.00 0.00 57.00 56.35 3dl5 n GLN 81 Cb 0.54 -1.37 0.01 0.00 1.02 0.00 0.00 30.24 30.43 3dl5 n GLN 81 CO 0.00 0.00 0.00 -0.40 -1.01 0.00 0.00 177.06 175.65 3dl5 n ASP 82 N -0.81 -2.55 -0.83 1.08 5.75 -1.26 -4.68 116.55 113.24 3dl5 n ASP 82 Ca 0.17 0.79 0.00 0.00 -0.01 0.00 0.00 54.79 55.74 3dl5 n ASP 82 Cb 0.09 -0.94 0.00 0.00 -1.03 0.00 0.00 41.12 39.24 3dl5 n ASP 82 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 3dl5 n GLU 83 N 1.12 0.73 0.11 0.11 -0.58 -1.26 -4.42 120.64 116.45 3dl5 n GLU 83 Ca 0.11 0.00 -0.02 0.00 -0.42 0.00 0.00 57.16 56.82 3dl5 n GLU 83 Cb 0.42 -1.21 0.06 0.00 -0.57 0.00 0.00 31.44 30.14 3dl5 n GLU 83 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3dl5 h ALA 84 N 1.91 0.69 -3.45 0.62 0.00 -1.88 -3.40 119.26 113.74 3dl5 h ALA 84 Ca 0.00 -0.66 -0.37 0.00 0.00 0.00 0.00 54.91 53.88 3dl5 h ALA 84 Cb 0.61 -0.12 -0.35 0.00 0.00 0.00 0.00 17.79 17.94 3dl5 h ALA 84 CO 0.00 0.90 -0.76 0.34 0.00 0.00 0.00 179.25 179.74 3dl5 s ASP 85 N -6.68 0.72 0.38 0.00 -1.08 -1.26 -5.05 116.67 103.69 3dl5 s ASP 85 Ca 0.01 -0.05 0.12 0.00 -0.52 0.00 0.00 52.55 52.10 3dl5 s ASP 85 Cb 0.11 -0.30 0.74 0.00 -1.46 0.00 0.00 42.92 42.01 3dl5 s ASP 85 CO 0.77 -0.11 1.85 1.55 0.52 0.00 0.00 175.17 179.76 3dl5 h PRO 86 N 7.41 0.07 -0.29 4.34 0.13 -1.97 -2.47 132.00 139.22 3dl5 h PRO 86 Ca -0.37 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.73 3dl5 h PRO 86 Cb 1.14 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.26 3dl5 h PRO 86 CO 0.43 0.37 0.00 0.09 -0.23 0.00 0.00 178.00 178.67 3dl5 n ASN 87 N -4.15 1.39 -3.82 1.44 3.02 -1.26 -4.82 115.26 107.06 3dl5 n ASN 87 Ca -0.02 -2.02 -0.12 0.00 -0.03 0.00 0.00 54.58 52.39 3dl5 n ASN 87 Cb 0.37 -0.19 -0.12 0.00 -0.61 0.00 0.00 39.78 39.22 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 -1.67 0.00 0.07 2.41 1.01 -0.93 -1.09 120.40 120.21 3dl5 s VAL 88 Ca 0.16 -0.01 -0.09 0.00 0.00 0.00 0.00 61.98 62.04 3dl5 s VAL 88 Cb 0.09 -0.22 0.00 0.00 0.00 0.00 0.00 36.38 36.25 3dl5 s VAL 88 CO 0.11 -0.01 0.20 0.68 0.00 0.00 0.00 175.10 176.08 3dl5 s VAL 89 N 0.06 0.13 -0.02 2.92 -7.23 -0.84 -4.57 120.40 110.85 3dl5 s VAL 89 Ca -0.00 -1.06 0.06 0.00 -1.81 0.00 0.00 61.98 59.17 3dl5 s VAL 89 Cb -0.01 -1.20 -0.01 0.00 0.56 0.00 0.00 36.38 35.71 3dl5 s VAL 89 CO 0.00 -0.59 -0.21 -0.69 -0.31 0.00 0.00 175.10 173.31 3dl5 s VAL 90 N -3.45 1.66 0.06 1.32 1.01 -1.26 -0.82 120.40 118.91 3dl5 s VAL 90 Ca 0.02 -0.89 0.06 0.00 0.00 0.00 0.00 61.98 61.17 3dl5 s VAL 90 Cb 0.03 -1.38 -0.03 0.00 0.00 0.00 0.00 36.38 35.00 3dl5 s VAL 90 CO -0.09 0.47 -0.16 -0.36 0.00 0.00 0.00 175.10 174.96 3dl5 s PHE 91 N -0.42 1.36 0.13 5.22 0.08 -0.20 -4.89 117.98 119.26 3dl5 s PHE 91 Ca 0.06 -0.39 0.18 0.00 0.12 0.00 0.00 56.93 56.89 3dl5 s PHE 91 Cb -0.09 -0.78 0.58 0.00 -0.57 0.00 0.00 43.02 42.16 3dl5 s PHE 91 CO -0.00 0.07 1.69 0.00 -0.10 0.00 0.00 175.22 176.87 3dl5 h ARG 92 N 4.63 0.00 -3.30 0.44 2.47 -1.87 -2.10 114.38 114.65 3dl5 h ARG 92 Ca -0.40 0.00 -0.07 0.00 -1.26 0.00 0.00 59.98 58.25 3dl5 h ARG 92 Cb 1.18 0.00 -0.14 0.00 -1.65 0.00 0.00 29.97 29.36 3dl5 h ARG 92 CO 0.42 0.41 -0.12 0.54 0.56 0.00 0.00 179.97 181.78 3dl5 s ASN 93 N -6.46 -0.21 0.29 7.04 4.22 -1.26 -4.52 114.94 114.03 3dl5 s ASN 93 Ca 0.00 -0.23 0.01 0.00 -2.14 0.00 0.00 52.86 50.50 3dl5 s ASN 93 Cb 0.11 0.44 0.53 0.00 1.28 0.00 0.00 41.25 43.60 3dl5 s ASN 93 CO 0.70 -0.76 1.87 0.25 -2.04 0.00 0.00 177.10 177.11 3dl5 h LEU 94 N 2.67 0.94 0.63 3.54 5.85 -1.97 -2.58 115.31 124.39 3dl5 h LEU 94 Ca -0.33 0.03 -0.02 0.00 0.84 0.00 0.00 57.88 58.40 3dl5 h LEU 94 Cb 1.23 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 42.08 3dl5 h LEU 94 CO 0.46 0.55 -0.49 -0.08 -0.34 0.00 0.00 178.44 178.54 3dl5 h GLU 95 N 1.03 -1.04 -0.83 1.25 4.22 -1.96 -2.89 114.58 114.36 3dl5 h GLU 95 Ca 0.46 0.07 0.12 0.00 0.08 0.00 0.00 59.36 60.09 3dl5 h GLU 95 Cb 0.36 0.24 -0.09 0.00 0.50 0.00 0.00 28.75 29.77 3dl5 h GLU 95 CO -0.21 -0.69 0.44 -0.44 -2.18 0.00 0.00 179.01 175.92 3dl5 h ASP 96 N -1.08 0.56 -0.89 1.04 3.45 -1.94 -1.52 116.42 116.03 3dl5 h ASP 96 Ca -0.08 0.08 0.22 0.00 0.43 0.00 0.00 57.03 57.67 3dl5 h ASP 96 Cb 0.90 -0.02 -0.06 0.00 -0.56 0.00 0.00 39.33 39.59 3dl5 h ASP 96 CO 0.02 0.27 0.60 0.77 -1.57 0.00 0.00 179.24 179.34 3dl5 h SER 97 N 0.67 0.28 -0.88 6.45 4.64 -1.26 -3.03 113.55 120.42 3dl5 h SER 97 Ca 0.43 0.03 -0.70 0.00 -0.47 0.00 0.00 61.79 61.08 3dl5 h SER 97 Cb 0.53 -0.02 -0.09 0.00 -0.31 0.00 0.00 62.40 62.51 3dl5 h SER 97 CO -0.32 0.11 2.30 -0.38 -0.87 0.00 0.00 176.83 177.67 3dl5 n ILE 98 N -4.44 3.90 -0.34 0.95 -0.00 -0.57 -3.80 119.36 115.06 3dl5 n ILE 98 Ca 0.19 -3.95 0.00 0.00 -0.00 0.00 0.00 62.75 58.99 3dl5 n ILE 98 Cb 0.77 -2.43 0.00 0.00 -0.00 0.00 0.00 39.64 37.98 3dl5 n ILE 98 CO 0.00 0.00 0.00 -1.84 -0.00 0.00 0.00 176.55 174.71 3dl5 n GLU 99 N 7.07 0.57 0.14 0.38 -0.00 -1.15 -4.56 120.64 123.09 3dl5 n GLU 99 Ca 0.47 -0.03 0.13 0.00 -0.00 0.00 0.00 57.16 57.73 3dl5 n GLU 99 Cb 0.43 -0.27 0.48 0.00 -0.00 0.00 0.00 31.44 32.08 3dl5 n GLU 99 CO 0.00 0.00 0.00 -2.95 0.00 0.00 0.00 177.13 174.18 3dl5 h ASN 100 N 0.00 0.00 0.51 -1.84 -1.07 -1.73 0.39 115.58 111.83 3dl5 h ASN 100 Ca 0.00 0.00 -0.02 0.00 0.07 0.00 0.00 56.30 56.35 3dl5 h ASN 100 Cb 0.17 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 36.42 3dl5 h ASN 100 CO 0.00 0.00 -0.24 -0.07 0.07 0.00 0.00 177.43 177.19 3dl5 h LEU 101 N 0.00 -0.58 0.00 6.14 3.38 -1.87 -3.26 115.31 119.12 3dl5 h LEU 101 Ca 0.00 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.99 3dl5 h LEU 101 Cb 0.50 0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.40 3dl5 h LEU 101 CO 0.00 -0.41 0.08 0.80 0.09 0.00 0.00 178.44 179.00 3dl5 n MET 102 N -3.87 0.00 -1.83 1.13 1.56 0.10 -4.68 117.12 109.54 3dl5 n MET 102 Ca -0.08 0.03 0.00 0.00 -0.27 0.00 0.00 57.70 57.38 3dl5 n MET 102 Cb 0.27 -1.58 0.00 0.00 2.15 0.00 0.00 33.22 34.06 3dl5 n MET 102 CO 0.00 0.00 0.00 -1.71 -0.73 0.00 0.00 175.97 173.53 3dl5 n ASN 103 N -0.76 0.00 -2.00 6.12 2.85 0.68 -5.04 115.26 117.11 3dl5 n ASN 103 Ca 0.00 0.00 -0.10 0.00 -0.11 0.00 0.00 54.58 54.37 3dl5 n ASN 103 Cb 0.08 0.00 0.04 0.00 1.24 0.00 0.00 39.78 41.14 3dl5 n ASN 103 CO 0.00 0.00 0.00 -0.67 -2.11 0.00 0.00 177.26 174.48 3dl5 n ASP 104 N 0.00 -3.14 0.00 1.20 2.03 -1.26 -4.22 116.55 111.16 3dl5 n ASP 104 Ca 0.00 -0.26 0.00 0.00 0.52 0.00 0.00 54.79 55.05 3dl5 n ASP 104 Cb 0.00 -2.59 0.00 0.00 -0.72 0.00 0.00 41.12 37.81 3dl5 n ASP 104 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 3dl5 n ASP 105 N -1.19 0.00 0.03 1.67 8.00 -1.26 0.34 116.55 124.15 3dl5 n ASP 105 Ca -0.06 0.26 0.07 0.00 0.71 0.00 0.00 54.79 55.77 3dl5 n ASP 105 Cb 0.55 -0.26 0.31 0.00 -0.02 0.00 0.00 41.12 41.70 3dl5 n ASP 105 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 3dl5 n SER 106 N -1.24 0.16 -4.42 -2.24 3.41 -1.26 -4.37 113.62 103.65 3dl5 n SER 106 Ca 0.00 0.54 -0.44 0.00 -0.26 0.00 0.00 58.87 58.72 3dl5 n SER 106 Cb 0.20 -0.58 -0.08 0.00 -0.26 0.00 0.00 64.21 63.49 3dl5 n SER 106 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 3dl5 s ILE 107 N -3.09 5.22 -0.09 -1.33 1.09 1.05 0.64 121.20 124.69 3dl5 s ILE 107 Ca 0.05 -0.86 -0.22 0.00 -1.10 0.00 0.00 60.65 58.52 3dl5 s ILE 107 Cb 0.08 -4.06 -0.19 0.00 -1.06 0.00 0.00 42.46 37.23 3dl5 s ILE 107 CO 0.25 -0.49 0.78 -0.08 -0.10 0.00 0.00 174.94 175.31 3dl5 h GLU 108 N 8.72 -0.07 -5.11 2.79 4.81 -1.65 -3.48 114.58 120.60 3dl5 h GLU 108 Ca -0.28 0.00 -0.42 0.00 -0.13 0.00 0.00 59.36 58.54 3dl5 h GLU 108 Cb 1.11 0.02 -0.14 0.00 0.63 0.00 0.00 28.75 30.37 3dl5 h GLU 108 CO 0.83 0.55 -0.62 -0.80 -0.73 0.00 0.00 179.01 178.24 3dl5 s ASN 109 N -5.82 1.93 0.03 1.04 -0.87 -1.26 -4.48 114.94 105.51 3dl5 s ASN 109 Ca -0.14 -1.35 0.04 0.00 -1.57 0.00 0.00 52.86 49.84 3dl5 s ASN 109 Cb -0.01 0.00 -0.02 0.00 -0.02 0.00 0.00 41.25 41.21 3dl5 s ASN 109 CO 0.53 -0.62 -0.13 -0.63 -2.57 0.00 0.00 177.10 173.68 3dl5 s ILE 110 N -3.45 1.01 -0.01 0.60 1.01 -0.55 -2.39 121.20 117.42 3dl5 s ILE 110 Ca 0.35 -0.88 0.02 0.00 0.00 0.00 0.00 60.65 60.15 3dl5 s ILE 110 Cb 0.08 -0.91 -0.00 0.00 0.01 0.00 0.00 42.46 41.63 3dl5 s ILE 110 CO 0.14 0.03 -0.08 -0.36 0.00 0.00 0.00 174.94 174.67 3dl5 s PHE 111 N -0.75 0.77 -0.48 3.97 0.08 -0.48 -1.33 117.98 119.76 3dl5 s PHE 111 Ca 0.01 -0.15 -0.15 0.00 0.12 0.00 0.00 56.93 56.76 3dl5 s PHE 111 Cb -0.07 -0.51 0.08 0.00 -0.57 0.00 0.00 43.02 41.95 3dl5 s PHE 111 CO 0.01 -0.03 0.41 0.08 -0.10 0.00 0.00 175.22 175.58 3dl5 s VAL 112 N -0.09 5.19 -2.21 -0.44 1.01 -0.62 -0.18 120.40 123.07 3dl5 s VAL 112 Ca 0.02 -1.14 0.29 0.00 0.00 0.00 0.00 61.98 61.15 3dl5 s VAL 112 Cb -0.04 -4.14 0.65 0.00 0.00 0.00 0.00 36.38 32.85 3dl5 s VAL 112 CO -0.00 -0.62 1.91 0.00 0.00 0.00 0.00 175.10 176.39 3dl5 n GLY 114 N 1.13 4.41 0.00 0.00 0.00 -1.24 -4.92 105.19 104.57 3dl5 n GLY 114 Ca 0.20 -1.46 0.00 0.00 0.00 0.00 0.00 46.02 44.76 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 -1.94 2.89 0.49 -0.02 0.00 -1.26 -1.53 105.19 103.82 3dl5 n GLY 115 Ca 0.00 -1.01 0.30 0.00 0.00 0.00 0.00 46.02 45.32 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 0.08 0.02 1.61 4.81 -1.96 0.55 114.58 119.69 3dl5 h GLU 116 Ca 0.00 -0.00 -0.23 0.00 -0.13 0.00 0.00 59.36 59.00 3dl5 h GLU 116 Cb 0.00 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.36 3dl5 h GLU 116 CO 0.00 0.05 -0.97 0.66 -0.73 0.00 0.00 179.01 178.02 3dl5 h SER 117 N 0.08 0.47 1.10 1.04 4.64 -1.90 -2.74 113.55 116.24 3dl5 h SER 117 Ca 0.52 -0.40 -0.19 0.00 -0.47 0.00 0.00 61.79 61.26 3dl5 h SER 117 Cb 1.93 -0.15 -0.03 0.00 -0.31 0.00 0.00 62.40 63.84 3dl5 h SER 117 CO -0.06 1.21 -0.91 0.40 -0.87 0.00 0.00 176.83 176.59 3dl5 h ILE 118 N 0.19 1.44 0.19 0.95 1.08 -0.37 -2.99 117.51 118.00 3dl5 h ILE 118 Ca -0.08 -3.07 -0.01 0.00 -0.39 0.00 0.00 64.86 61.31 3dl5 h ILE 118 Cb 1.62 2.71 0.00 0.00 -3.07 0.00 0.00 36.82 38.08 3dl5 h ILE 118 CO 0.16 0.82 -0.09 1.88 -0.69 0.00 0.00 178.15 180.24 3dl5 h TYR 119 N 0.00 -0.23 -1.00 1.37 0.05 -0.40 -1.54 116.97 115.22 3dl5 h TYR 119 Ca -0.02 -0.01 0.13 0.00 0.05 0.00 0.00 58.73 58.88 3dl5 h TYR 119 Cb 1.68 0.08 -0.09 0.00 1.01 0.00 0.00 36.73 39.41 3dl5 h TYR 119 CO 0.00 0.16 0.63 0.00 -1.05 0.00 0.00 178.16 177.89 3dl5 h ARG 120 N -0.70 0.94 -0.00 4.88 3.08 -1.58 -0.63 114.38 120.36 3dl5 h ARG 120 Ca -0.03 -0.06 -0.14 0.00 0.07 0.00 0.00 59.98 59.83 3dl5 h ARG 120 Cb 0.49 -0.21 -0.02 0.00 0.08 0.00 0.00 29.97 30.31 3dl5 h ARG 120 CO 0.04 0.62 -0.64 -0.44 -1.07 0.00 0.00 179.97 178.48 3dl5 h ASP 121 N 0.97 0.01 -0.31 7.04 3.45 -1.52 -1.34 116.42 124.71 3dl5 h ASP 121 Ca 0.50 -0.01 -0.05 0.00 0.43 0.00 0.00 57.03 57.91 3dl5 h ASP 121 Cb 0.53 -0.00 -0.01 0.00 -0.56 0.00 0.00 39.33 39.28 3dl5 h ASP 121 CO -0.28 0.65 0.01 0.00 -1.57 0.00 0.00 179.24 178.05 3dl5 h ALA 122 N 1.35 0.41 -0.03 3.45 0.00 -0.06 -3.09 119.26 121.30 3dl5 h ALA 122 Ca -0.01 -0.23 -0.03 0.00 0.00 0.00 0.00 54.91 54.64 3dl5 h ALA 122 Cb 1.14 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.81 3dl5 h ALA 122 CO 0.08 0.16 -0.11 -0.07 0.00 0.00 0.00 179.25 179.31 3dl5 h LEU 123 N 0.34 0.14 -1.61 0.00 -0.00 -1.38 -2.54 115.31 110.27 3dl5 h LEU 123 Ca 0.09 -0.65 0.19 0.00 -0.00 0.00 0.00 57.88 57.51 3dl5 h LEU 123 Cb 0.42 -0.04 -0.03 0.00 -0.00 0.00 0.00 40.66 41.02 3dl5 h LEU 123 CO 0.01 0.76 0.76 0.11 -0.00 0.00 0.00 178.44 180.09 3dl5 h LYS 124 N -0.48 0.00 -0.07 1.13 1.57 -1.28 0.11 116.57 117.55 3dl5 h LYS 124 Ca -0.01 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.75 3dl5 h LYS 124 Cb 0.75 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.05 3dl5 h LYS 124 CO 0.02 0.00 -0.20 -0.25 -0.57 0.00 0.00 179.45 178.45 3dl5 n ASP 125 N -3.49 2.26 -4.32 0.86 10.43 -1.17 -5.01 116.55 116.11 3dl5 n ASP 125 Ca 0.14 -3.49 -0.34 0.00 2.57 0.00 0.00 54.79 53.67 3dl5 n ASP 125 Cb 0.99 -0.51 -0.08 0.00 1.84 0.00 0.00 41.12 43.37 3dl5 n ASP 125 CO 0.00 0.00 0.00 0.59 -1.07 0.00 0.00 177.20 176.72 3dl5 n ASN 126 N -1.19 -0.43 0.04 -2.24 3.02 0.39 -4.84 115.26 110.00 3dl5 n ASN 126 Ca 0.20 -1.20 0.04 0.00 -0.03 0.00 0.00 54.58 53.59 3dl5 n ASN 126 Cb 0.73 -1.93 -0.08 0.00 -0.61 0.00 0.00 39.78 37.89 3dl5 n ASN 126 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 3dl5 n PHE 127 N -4.40 0.76 -3.40 3.10 0.99 -0.96 -4.87 117.46 108.68 3dl5 n PHE 127 Ca -0.16 0.24 -0.38 0.00 -0.00 0.00 0.00 57.45 57.15 3dl5 n PHE 127 Cb 0.61 -0.96 -0.07 0.00 -1.00 0.00 0.00 39.48 38.06 3dl5 n PHE 127 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.76 177.30 3dl5 s VAL 128 N -3.10 5.21 -0.15 -4.37 0.11 -1.25 -4.58 120.40 112.27 3dl5 s VAL 128 Ca -0.04 0.73 -0.10 0.00 -2.93 0.00 0.00 61.98 59.64 3dl5 s VAL 128 Cb 0.09 -3.73 -0.24 0.00 -1.53 0.00 0.00 36.38 30.98 3dl5 s VAL 128 CO 0.82 0.29 0.28 0.47 -3.33 0.00 0.00 175.10 173.63 3dl5 n ASP 129 N 4.18 2.06 -4.43 3.54 10.43 0.14 -4.88 116.55 127.59 3dl5 n ASP 129 Ca -0.09 0.25 -0.21 0.00 2.57 0.00 0.00 54.79 57.31 3dl5 n ASP 129 Cb 0.51 -0.87 -0.10 0.00 1.84 0.00 0.00 41.12 42.50 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 -2.51 1.56 -0.10 -1.24 3.52 -1.23 -1.92 118.95 117.04 3dl5 s ARG 130 Ca -0.25 -1.79 -0.03 0.00 -0.13 0.00 0.00 55.73 53.53 3dl5 s ARG 130 Cb 0.07 -1.16 0.05 0.00 -1.56 0.00 0.00 34.95 32.34 3dl5 s ARG 130 CO 0.71 0.04 0.12 0.42 -0.81 0.00 0.00 175.30 175.78 3dl5 s ILE 131 N -3.00 -0.19 -0.44 4.11 1.01 -0.40 -1.20 121.20 121.08 3dl5 s ILE 131 Ca 0.30 0.24 -0.16 0.00 0.00 0.00 0.00 60.65 61.02 3dl5 s ILE 131 Cb 0.04 -0.33 0.04 0.00 0.01 0.00 0.00 42.46 42.21 3dl5 s ILE 131 CO 0.12 0.05 0.41 -0.31 0.00 0.00 0.00 174.94 175.21 3dl5 s TYR 132 N 2.23 3.19 -0.18 3.97 1.51 0.76 -0.88 117.35 127.95 3dl5 s TYR 132 Ca 0.04 -0.57 -0.01 0.00 -1.01 0.00 0.00 57.07 55.52 3dl5 s TYR 132 Cb -0.13 -2.94 0.00 0.00 -0.11 0.00 0.00 41.96 38.78 3dl5 s TYR 132 CO -0.06 -0.73 -0.14 -1.17 -1.11 0.00 0.00 175.55 172.34 3dl5 s LEU 133 N 1.96 2.49 -0.31 -1.29 1.98 -0.28 -0.97 118.68 122.26 3dl5 s LEU 133 Ca 0.09 -0.51 -0.13 0.00 -2.89 0.00 0.00 54.13 50.69 3dl5 s LEU 133 Cb -0.19 -1.59 -0.03 0.00 0.66 0.00 0.00 46.19 45.04 3dl5 s LEU 133 CO 0.11 0.03 0.28 -0.89 -1.89 0.00 0.00 176.35 173.99 3dl5 s THR 134 N 1.16 5.24 -0.40 3.68 2.01 0.71 -1.39 115.64 126.65 3dl5 s THR 134 Ca 0.01 0.13 -0.22 0.00 0.31 0.00 0.00 61.69 61.93 3dl5 s THR 134 Cb -0.14 -3.68 0.01 0.00 0.01 0.00 0.00 72.50 68.70 3dl5 s THR 134 CO -0.05 0.08 0.72 -0.13 -0.69 0.00 0.00 174.62 174.55 3dl5 s ARG 135 N 1.88 3.56 -0.17 4.92 0.52 -1.00 -0.92 118.95 127.73 3dl5 s ARG 135 Ca 0.10 0.01 -0.08 0.00 -0.52 0.00 0.00 55.73 55.24 3dl5 s ARG 135 Cb -0.16 -3.87 -0.04 0.00 0.52 0.00 0.00 34.95 31.39 3dl5 s ARG 135 CO 0.11 -0.92 0.09 0.08 0.02 0.00 0.00 175.30 174.67 3dl5 s VAL 136 N 3.01 5.02 -0.13 3.52 1.01 0.24 -1.12 120.40 131.94 3dl5 s VAL 136 Ca 0.28 0.05 -0.03 0.00 0.00 0.00 0.00 61.98 62.27 3dl5 s VAL 136 Cb -0.13 -3.25 -0.07 0.00 0.00 0.00 0.00 36.38 32.93 3dl5 s VAL 136 CO 0.18 0.48 2.81 0.00 0.00 0.00 0.00 175.10 178.58 3dl5 n ALA 137 N 3.26 5.59 -3.96 5.51 0.00 -0.50 0.18 120.51 130.60 3dl5 n ALA 137 Ca -0.17 -1.56 -0.33 0.00 0.00 0.00 0.00 53.44 51.37 3dl5 n ALA 137 Cb 0.53 -1.81 -0.15 0.00 0.00 0.00 0.00 19.45 18.02 3dl5 n ALA 137 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3dl5 s LEU 138 N -0.68 2.95 -0.05 0.00 1.43 -1.26 -4.63 118.68 116.44 3dl5 s LEU 138 Ca 0.43 -0.98 0.01 0.00 -1.03 0.00 0.00 54.13 52.56 3dl5 s LEU 138 Cb 0.24 -1.57 -0.04 0.00 0.03 0.00 0.00 46.19 44.85 3dl5 s LEU 138 CO -0.04 -0.11 -0.04 -0.62 0.23 0.00 0.00 176.35 175.77 3dl5 n GLU 139 N 4.58 0.47 -2.04 1.70 -0.58 -1.26 -4.64 120.64 118.87 3dl5 n GLU 139 Ca -0.17 0.03 -0.41 0.00 -0.42 0.00 0.00 57.16 56.18 3dl5 n GLU 139 Cb 0.46 -1.10 -0.00 0.00 -0.57 0.00 0.00 31.44 30.23 3dl5 n GLU 139 CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 3dl5 n ASP 140 N -2.60 6.02 -3.75 1.62 10.43 -1.26 -4.87 116.55 122.14 3dl5 n ASP 140 Ca -0.09 -3.02 -0.10 0.00 2.57 0.00 0.00 54.79 54.16 3dl5 n ASP 140 Cb 0.60 -1.49 -0.04 0.00 1.84 0.00 0.00 41.12 42.03 3dl5 n ASP 140 CO 0.00 0.00 0.00 0.27 -1.07 0.00 0.00 177.20 176.40 3dl5 s ILE 141 N 0.64 0.03 0.13 0.53 -4.36 -1.26 -5.15 121.20 111.77 3dl5 s ILE 141 Ca 0.48 -0.82 -0.30 0.00 -0.26 0.00 0.00 60.65 59.74 3dl5 s ILE 141 Cb 0.13 -1.57 -0.07 0.00 1.25 0.00 0.00 42.46 42.21 3dl5 s ILE 141 CO -0.04 -0.15 1.19 -1.61 0.24 0.00 0.00 174.94 174.57 3dl5 s GLU 142 N -3.88 4.48 -0.01 0.37 0.41 -1.26 -5.05 118.70 113.76 3dl5 s GLU 142 Ca 0.09 1.82 0.02 0.00 -0.41 0.00 0.00 54.97 56.49 3dl5 s GLU 142 Cb -0.00 -3.29 0.00 0.00 -1.78 0.00 0.00 34.13 29.06 3dl5 s GLU 142 CO -0.03 -0.14 -0.05 -0.06 -0.49 0.00 0.00 175.26 174.48 3dl5 s PHE 143 N 0.39 0.55 0.00 1.61 0.08 -1.26 -4.68 117.98 114.67 3dl5 s PHE 143 Ca 0.55 -0.11 0.00 0.00 0.12 0.00 0.00 56.93 57.49 3dl5 s PHE 143 Cb -0.31 -0.39 0.00 0.00 -0.57 0.00 0.00 43.02 41.75 3dl5 s PHE 143 CO 0.33 -0.04 0.33 -0.40 -0.10 0.00 0.00 175.22 175.34 3dl5 n ASP 144 N 3.19 0.63 -3.67 1.36 5.68 -0.50 -5.00 116.55 118.23 3dl5 n ASP 144 Ca -0.16 -1.05 -0.19 0.00 -0.50 0.00 0.00 54.79 52.89 3dl5 n ASP 144 Cb 0.56 0.00 -0.17 0.00 -1.14 0.00 0.00 41.12 40.37 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 -0.05 -0.15 0.26 2.12 2.01 -1.16 -5.00 115.64 113.68 3dl5 s THR 145 Ca 0.00 0.41 0.11 0.00 0.31 0.00 0.00 61.69 62.51 3dl5 s THR 145 Cb 0.00 -0.19 -0.05 0.00 0.01 0.00 0.00 72.50 72.27 3dl5 s THR 145 CO 0.00 0.17 -0.10 -0.31 -0.69 0.00 0.00 174.62 173.69 3dl5 s TYR 146 N 2.20 2.51 -0.13 4.92 1.51 -1.26 -0.06 117.35 127.05 3dl5 s TYR 146 Ca 0.05 -0.27 -0.19 0.00 -1.01 0.00 0.00 57.07 55.65 3dl5 s TYR 146 Cb -0.12 -1.12 -0.04 0.00 -0.11 0.00 0.00 41.96 40.57 3dl5 s TYR 146 CO -0.04 0.64 0.51 0.12 -1.11 0.00 0.00 175.55 175.67 3dl5 s PHE 147 N -2.30 3.50 0.82 2.71 2.19 -0.02 -4.52 117.98 120.36 3dl5 s PHE 147 Ca 0.30 0.91 -0.14 0.00 0.33 0.00 0.00 56.93 58.33 3dl5 s PHE 147 Cb -0.06 -2.60 0.05 0.00 -1.31 0.00 0.00 43.02 39.10 3dl5 s PHE 147 CO 0.17 0.11 0.89 -0.35 1.83 0.00 0.00 175.22 177.88 3dl5 n PRO 148 N 3.87 0.10 -2.60 10.12 -0.04 -1.26 -4.89 135.00 140.30 3dl5 n PRO 148 Ca -0.06 0.10 -0.40 0.00 -0.04 0.00 0.00 63.50 63.10 3dl5 n PRO 148 Cb 0.51 -2.18 -0.05 0.00 -0.04 0.00 0.00 33.50 31.74 3dl5 n PRO 148 CO 0.00 0.00 0.00 -1.83 -0.04 0.00 0.00 175.50 173.63 3dl5 s GLU 149 N -3.71 4.73 0.20 0.54 -1.05 -1.26 -4.97 118.70 113.17 3dl5 s GLU 149 Ca 0.68 1.66 -0.32 0.00 -0.15 0.00 0.00 54.97 56.84 3dl5 s GLU 149 Cb -0.29 -3.24 -0.11 0.00 -0.44 0.00 0.00 34.13 30.05 3dl5 s GLU 149 CO 0.56 0.33 1.69 0.42 0.95 0.00 0.00 175.26 179.21 3dl5 s ILE 150 N -1.07 2.17 0.57 1.83 1.01 -1.26 -4.97 121.20 119.48 3dl5 s ILE 150 Ca 0.43 0.11 -0.21 0.00 0.00 0.00 0.00 60.65 60.99 3dl5 s ILE 150 Cb -0.29 -3.07 -0.04 0.00 0.01 0.00 0.00 42.46 39.07 3dl5 s ILE 150 CO 0.37 0.01 1.32 -2.84 0.00 0.00 0.00 174.94 173.80 3dl5 s PRO 151 N 1.22 3.01 0.43 2.79 0.02 -1.26 -4.89 135.00 136.32 3dl5 s PRO 151 Ca 0.74 2.14 0.30 0.00 0.02 0.00 0.00 61.00 64.20 3dl5 s PRO 151 Cb -0.48 -2.14 1.38 0.00 0.02 0.00 0.00 34.50 33.28 3dl5 s PRO 151 CO 0.32 -1.26 1.90 0.93 -0.33 0.00 0.00 177.00 178.55 3dl5 h GLU 152 N 1.22 0.00 0.00 5.54 5.08 -2.02 -0.67 114.58 123.72 3dl5 h GLU 152 Ca -0.51 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.85 3dl5 h GLU 152 Cb 1.31 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.56 3dl5 h GLU 152 CO 0.56 0.00 0.00 0.25 -1.00 0.00 0.00 179.01 178.82 3dl5 n THR 153 N -2.64 0.65 -4.60 1.13 -2.24 -1.26 -4.59 114.28 100.73 3dl5 n THR 153 Ca 0.00 0.16 -0.34 0.00 -2.27 0.00 0.00 64.05 61.61 3dl5 n THR 153 Cb 0.19 -0.97 -0.12 0.00 -2.10 0.00 0.00 70.33 67.33 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 -2.53 2.94 -0.03 4.78 0.08 -0.26 -2.81 117.98 120.14 3dl5 s PHE 154 Ca 0.12 -0.11 0.03 0.00 0.12 0.00 0.00 56.93 57.09 3dl5 s PHE 154 Cb 0.08 -1.77 0.00 0.00 -0.57 0.00 0.00 43.02 40.76 3dl5 s PHE 154 CO 0.18 0.20 -0.12 -0.51 -0.10 0.00 0.00 175.22 174.87 3dl5 s LEU 155 N -0.45 1.82 0.32 -0.37 1.43 -0.53 -4.91 118.68 116.00 3dl5 s LEU 155 Ca 0.07 -0.25 -0.29 0.00 -1.03 0.00 0.00 54.13 52.62 3dl5 s LEU 155 Cb -0.12 -0.72 -0.10 0.00 0.03 0.00 0.00 46.19 45.28 3dl5 s LEU 155 CO 0.02 0.09 1.37 -2.16 0.23 0.00 0.00 176.35 175.90 3dl5 s PRO 156 N 0.17 4.29 0.00 1.29 0.04 -1.26 -1.73 135.00 137.81 3dl5 s PRO 156 Ca -0.04 2.30 0.00 0.00 0.04 0.00 0.00 61.00 63.30 3dl5 s PRO 156 Cb -0.10 -3.06 0.00 0.00 0.04 0.00 0.00 34.50 31.38 3dl5 s PRO 156 CO 0.01 -0.30 0.17 1.33 0.04 0.00 0.00 177.00 178.25 3dl5 n VAL 157 N 1.06 0.00 -3.65 -0.36 0.24 -0.38 -2.83 118.33 112.41 3dl5 n VAL 157 Ca 0.02 -0.28 -0.13 0.00 -2.04 0.00 0.00 64.34 61.91 3dl5 n VAL 157 Cb 0.41 1.27 -0.07 0.00 -1.47 0.00 0.00 33.84 33.98 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 -0.22 -0.79 -0.25 6.34 5.04 -1.24 -3.51 117.35 122.72 3dl5 s TYR 158 Ca 0.00 1.84 -0.03 0.00 -2.44 0.00 0.00 57.07 56.44 3dl5 s TYR 158 Cb 0.00 0.32 0.10 0.00 0.35 0.00 0.00 41.96 42.74 3dl5 s TYR 158 CO 0.00 -0.39 0.20 1.41 -1.34 0.00 0.00 175.55 175.43 3dl5 s MET 159 N 0.62 0.22 1.09 4.97 -2.45 -0.72 -2.23 119.30 120.79 3dl5 s MET 159 Ca -0.02 -0.17 -0.12 0.00 -1.25 0.00 0.00 55.69 54.12 3dl5 s MET 159 Cb -0.05 -1.10 0.24 0.00 1.25 0.00 0.00 34.83 35.17 3dl5 s MET 159 CO -0.03 -0.89 1.06 -1.54 1.05 0.00 0.00 175.02 174.66 3dl5 s SER 160 N 2.24 1.69 1.02 1.11 1.04 0.90 0.39 113.70 122.10 3dl5 s SER 160 Ca 0.08 1.50 -0.12 0.00 0.48 0.00 0.00 55.95 57.88 3dl5 s SER 160 Cb -0.15 -2.22 0.20 0.00 0.10 0.00 0.00 66.02 63.95 3dl5 s SER 160 CO -0.26 -3.75 1.09 0.00 0.98 0.00 0.00 173.24 171.29 3dl5 s GLN 161 N -4.63 0.24 0.18 4.02 -2.07 -1.26 -3.52 119.66 112.62 3dl5 s GLN 161 Ca 0.67 0.52 -0.27 0.00 -1.82 0.00 0.00 55.36 54.47 3dl5 s GLN 161 Cb -0.23 -1.71 -0.08 0.00 -1.09 0.00 0.00 33.01 29.90 3dl5 s GLN 161 CO 0.62 -2.86 0.83 0.99 -1.32 0.00 0.00 175.29 173.54 3dl5 s THR 162 N -2.92 4.32 0.36 3.63 2.01 -1.26 -4.62 115.64 117.16 3dl5 s THR 162 Ca 0.66 1.82 0.09 0.00 0.31 0.00 0.00 61.69 64.56 3dl5 s THR 162 Cb -0.19 -4.19 -0.06 0.00 0.01 0.00 0.00 72.50 68.06 3dl5 s THR 162 CO 0.58 0.50 0.01 -0.36 -0.69 0.00 0.00 174.62 174.66 3dl5 s PHE 163 N -1.04 2.52 -0.03 4.92 0.40 -0.64 -4.50 117.98 119.62 3dl5 s PHE 163 Ca 0.38 -0.51 0.02 0.00 -0.60 0.00 0.00 56.93 56.22 3dl5 s PHE 163 Cb -0.24 -1.58 0.01 0.00 0.51 0.00 0.00 43.02 41.73 3dl5 s PHE 163 CO 0.28 0.45 -0.06 0.00 0.70 0.00 0.00 175.22 176.59 3dl5 s THR 165 N 0.47 -0.33 -1.46 0.00 2.01 -0.95 -4.85 115.64 110.53 3dl5 s THR 165 Ca -0.06 0.24 -0.10 0.00 0.31 0.00 0.00 61.69 62.08 3dl5 s THR 165 Cb -0.10 -0.42 0.05 0.00 0.01 0.00 0.00 72.50 72.04 3dl5 s THR 165 CO 0.00 0.07 0.83 0.29 -0.69 0.00 0.00 174.62 175.12 3dl5 n LYS 166 N 5.33 -5.45 -1.08 4.92 5.02 -1.26 -1.04 118.16 124.60 3dl5 n LYS 166 Ca -0.05 0.71 -0.03 0.00 -2.02 0.00 0.00 58.31 56.91 3dl5 n LYS 166 Cb 0.50 -5.59 -0.01 0.00 -0.02 0.00 0.00 35.03 29.90 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 -2.68 -4.25 -4.65 4.39 3.02 -1.26 -5.01 115.26 104.82 3dl5 n ASN 167 Ca -0.02 0.07 -0.35 0.00 -0.03 0.00 0.00 54.58 54.26 3dl5 n ASN 167 Cb 0.56 -2.01 -0.09 0.00 -0.61 0.00 0.00 39.78 37.63 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 -1.81 4.84 0.07 2.41 1.01 -0.21 -4.80 121.20 122.72 3dl5 s ILE 168 Ca 0.00 -0.02 -0.18 0.00 0.00 0.00 0.00 60.65 60.46 3dl5 s ILE 168 Cb 0.00 -3.18 -0.07 0.00 0.01 0.00 0.00 42.46 39.23 3dl5 s ILE 168 CO 0.00 0.47 0.53 -0.44 0.00 0.00 0.00 174.94 175.50 3dl5 s SER 169 N 0.31 6.97 -0.02 3.58 0.01 -1.26 -2.25 113.70 121.05 3dl5 s SER 169 Ca 0.04 1.17 -0.18 0.00 1.31 0.00 0.00 55.95 58.29 3dl5 s SER 169 Cb -0.12 -2.33 0.03 0.00 0.21 0.00 0.00 66.02 63.82 3dl5 s SER 169 CO -0.00 0.26 0.39 -0.72 0.41 0.00 0.00 173.24 173.57 3dl5 s TYR 170 N -1.17 -0.28 0.47 2.43 1.13 -0.91 -1.41 117.35 117.62 3dl5 s TYR 170 Ca 0.29 0.43 0.05 0.00 -1.41 0.00 0.00 57.07 56.44 3dl5 s TYR 170 Cb -0.18 0.16 -0.02 0.00 -1.10 0.00 0.00 41.96 40.82 3dl5 s TYR 170 CO 0.18 -0.44 0.20 -0.51 -2.51 0.00 0.00 175.55 172.47 3dl5 s ASP 171 N -1.34 4.41 -0.06 -0.18 1.01 -0.28 -1.62 116.67 118.62 3dl5 s ASP 171 Ca -0.13 -1.26 -0.02 0.00 0.71 0.00 0.00 52.55 51.85 3dl5 s ASP 171 Cb -0.04 0.02 0.03 0.00 1.01 0.00 0.00 42.92 43.94 3dl5 s ASP 171 CO 0.05 -0.78 0.03 -0.36 0.21 0.00 0.00 175.17 174.32 3dl5 s PHE 172 N -2.72 0.43 0.12 4.23 0.08 -1.26 -2.39 117.98 116.47 3dl5 s PHE 172 Ca 0.31 -0.02 0.05 0.00 0.12 0.00 0.00 56.93 57.38 3dl5 s PHE 172 Cb 0.02 -0.68 -0.04 0.00 -0.57 0.00 0.00 43.02 41.75 3dl5 s PHE 172 CO 0.18 -0.29 -0.11 -1.64 -0.10 0.00 0.00 175.22 173.25 3dl5 s MET 173 N 2.05 0.95 0.02 0.44 -1.94 -0.49 -0.07 119.30 120.27 3dl5 s MET 173 Ca 0.05 -1.25 0.06 0.00 -1.71 0.00 0.00 55.69 52.84 3dl5 s MET 173 Cb -0.12 -0.68 -0.02 0.00 2.01 0.00 0.00 34.83 36.02 3dl5 s MET 173 CO -0.05 0.11 -0.18 0.42 -0.01 0.00 0.00 175.02 175.31 3dl5 s ILE 174 N -2.51 1.45 -0.10 2.53 1.01 -0.95 -1.12 121.20 121.50 3dl5 s ILE 174 Ca 0.09 -0.98 0.01 0.00 0.00 0.00 0.00 60.65 59.77 3dl5 s ILE 174 Cb -0.02 -1.24 0.02 0.00 0.01 0.00 0.00 42.46 41.22 3dl5 s ILE 174 CO 0.01 0.24 -0.11 -0.36 0.00 0.00 0.00 174.94 174.72 3dl5 s PHE 175 N -0.65 1.63 0.20 3.97 0.40 -0.06 -1.25 117.98 122.22 3dl5 s PHE 175 Ca 0.06 -0.75 0.04 0.00 -0.60 0.00 0.00 56.93 55.68 3dl5 s PHE 175 Cb -0.08 -1.25 -0.03 0.00 0.51 0.00 0.00 43.02 42.17 3dl5 s PHE 175 CO 0.01 -0.44 0.30 -1.21 0.70 0.00 0.00 175.22 174.58 3dl5 s GLU 176 N 1.19 3.36 0.11 0.44 0.41 -0.70 -1.28 118.70 122.23 3dl5 s GLU 176 Ca -0.04 -0.72 0.04 0.00 -0.41 0.00 0.00 54.97 53.84 3dl5 s GLU 176 Cb -0.14 -2.88 -0.04 0.00 -1.78 0.00 0.00 34.13 29.29 3dl5 s GLU 176 CO -0.03 0.47 0.05 0.21 -0.49 0.00 0.00 175.26 175.47 3dl5 s LYS 177 N -3.60 2.72 0.55 1.61 2.20 -0.81 -1.45 119.74 120.96 3dl5 s LYS 177 Ca 0.34 -0.81 0.06 0.00 -0.36 0.00 0.00 55.97 55.20 3dl5 s LYS 177 Cb -0.10 -2.61 0.06 0.00 -1.51 0.00 0.00 37.83 33.67 3dl5 s LYS 177 CO 0.28 0.53 0.75 -0.65 -0.36 0.00 0.00 175.35 175.91 3dl5 s GLN 178 N -2.53 2.40 0.54 4.03 -1.52 -1.12 -5.02 119.66 116.42 3dl5 s GLN 178 Ca 0.28 -1.32 0.09 0.00 -1.95 0.00 0.00 55.36 52.46 3dl5 s GLN 178 Cb -0.11 -2.61 0.06 0.00 -0.22 0.00 0.00 33.01 30.13 3dl5 s GLN 178 CO 0.21 -0.75 0.70 -1.21 -0.25 0.00 0.00 175.29 173.98 3dl5 s GLU 179 N -4.66 2.41 0.00 2.91 2.02 -1.26 -5.11 118.70 115.01 3dl5 s GLU 179 Ca 0.60 -1.60 0.00 0.00 0.02 0.00 0.00 54.97 53.99 3dl5 s GLU 179 Cb -0.08 -2.60 0.00 0.00 0.10 0.00 0.00 34.13 31.55 3dl5 s GLU 179 CO 0.38 -0.70 0.00 1.63 0.02 0.00 0.00 175.26 176.59 3dl5 n LYS 180 N -2.09 0.00 0.00 1.61 4.01 -1.26 -5.27 118.16 115.16 3dl5 n LYS 180 Ca 0.12 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.92 3dl5 n LYS 180 Cb 0.61 0.00 0.00 0.00 -0.51 0.00 0.00 35.03 35.13 3dl5 n LYS 180 CO 0.00 0.00 0.00 0.36 -1.11 0.00 0.00 177.40 176.65 3dl5 n LYS 181 N 0.00 3.70 -3.02 1.97 2.85 -1.26 -5.37 118.16 117.04 3dl5 n LYS 181 Ca 0.00 0.00 -0.32 0.00 -1.05 0.00 0.00 58.31 56.94 3dl5 n LYS 181 Cb 0.00 0.00 -0.05 0.00 -0.65 0.00 0.00 35.03 34.33 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 3.97 0.23 -5.58 2.96 -1.26 -5.31 118.68 113.68 3dl5 s LEU 193 Ca 0.00 1.25 -0.13 0.00 -0.22 0.00 0.00 54.13 55.03 3dl5 s LEU 193 Cb 0.00 -4.08 0.29 0.00 0.50 0.00 0.00 46.19 42.90 3dl5 s LEU 193 CO 0.00 -0.28 1.60 0.11 -1.32 0.00 0.00 176.35 176.45 3dl5 h LYS 194 N 1.88 -0.02 -0.49 1.98 6.56 -2.06 -2.83 116.57 121.58 3dl5 h LYS 194 Ca -0.48 0.00 0.04 0.00 -1.06 0.00 0.00 60.65 59.16 3dl5 h LYS 194 Cb 1.18 0.01 -0.06 0.00 -0.57 0.00 0.00 32.23 32.79 3dl5 h LYS 194 CO 0.65 -0.02 -0.29 -1.13 -2.06 0.00 0.00 179.45 176.60 3dl5 n SER 195 N -5.50 -0.52 -4.72 0.86 3.41 -1.26 -2.29 113.62 103.59 3dl5 n SER 195 Ca 0.10 1.20 -0.42 0.00 -0.26 0.00 0.00 58.87 59.49 3dl5 n SER 195 Cb 0.39 -0.28 -0.03 0.00 -0.26 0.00 0.00 64.21 64.03 3dl5 n SER 195 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 3dl5 s ILE 196 N -4.45 3.02 0.00 -1.33 1.09 -1.07 -1.21 121.20 117.25 3dl5 s ILE 196 Ca -0.06 0.77 0.00 0.00 -1.10 0.00 0.00 60.65 60.26 3dl5 s ILE 196 Cb 0.05 -3.49 0.00 0.00 -1.06 0.00 0.00 42.46 37.96 3dl5 s ILE 196 CO 0.31 0.08 0.00 0.47 -0.10 0.00 0.00 174.94 175.70 3dl5 n ASP 197 N 3.45 0.00 -0.07 3.58 8.00 -1.25 -4.58 116.55 125.68 3dl5 n ASP 197 Ca 0.10 0.00 -0.21 0.00 0.71 0.00 0.00 54.79 55.39 3dl5 n ASP 197 Cb 0.41 0.00 -0.12 0.00 -0.02 0.00 0.00 41.12 41.39 3dl5 n ASP 197 CO 0.00 0.00 0.00 0.44 -0.39 0.00 0.00 177.20 177.25 3dl5 h ASP 198 N 0.05 0.13 -0.94 -2.24 3.45 -1.34 -3.27 116.42 112.27 3dl5 h ASP 198 Ca 0.00 -0.66 0.05 0.00 0.43 0.00 0.00 57.03 56.85 3dl5 h ASP 198 Cb 0.00 -0.04 -0.06 0.00 -0.56 0.00 0.00 39.33 38.67 3dl5 h ASP 198 CO 0.00 1.56 0.60 0.74 -1.57 0.00 0.00 179.24 180.57 3dl5 h THR 199 N -0.70 1.12 -0.11 0.35 2.02 -1.40 0.34 112.91 114.52 3dl5 h THR 199 Ca -0.34 -0.39 -0.19 0.00 0.77 0.00 0.00 66.41 66.25 3dl5 h THR 199 Cb 1.49 -0.12 -0.00 0.00 -1.74 0.00 0.00 68.15 67.78 3dl5 h THR 199 CO -0.11 0.21 -0.73 0.58 0.37 0.00 0.00 175.52 175.84 3dl5 h VAL 200 N 1.14 1.34 0.18 3.16 2.07 -1.81 0.10 116.25 122.42 3dl5 h VAL 200 Ca 0.39 -2.06 -0.01 0.00 0.82 0.00 0.00 66.70 65.84 3dl5 h VAL 200 Cb 0.08 2.04 0.00 0.00 -1.52 0.00 0.00 31.29 31.89 3dl5 h VAL 200 CO -0.14 0.63 -0.08 0.44 0.02 0.00 0.00 177.57 178.43 3dl5 h ASP 201 N 0.37 -0.20 -0.24 0.57 3.45 -1.51 -0.44 116.42 118.43 3dl5 h ASP 201 Ca -0.03 -0.17 0.05 0.00 0.43 0.00 0.00 57.03 57.31 3dl5 h ASP 201 Cb 1.32 0.05 -0.04 0.00 -0.56 0.00 0.00 39.33 40.10 3dl5 h ASP 201 CO 0.13 0.06 -0.05 -0.07 -1.57 0.00 0.00 179.24 177.74 3dl5 h LEU 202 N -0.46 -0.20 -2.04 1.55 4.07 -0.94 0.34 115.31 117.63 3dl5 h LEU 202 Ca -0.02 0.07 0.05 0.00 0.08 0.00 0.00 57.88 58.06 3dl5 h LEU 202 Cb 0.36 0.14 -0.01 0.00 1.08 0.00 0.00 40.66 42.23 3dl5 h LEU 202 CO 0.04 -0.07 0.13 0.25 -1.08 0.00 0.00 178.44 177.71 3dl5 h LEU 203 N 0.01 0.00 -0.16 1.67 5.85 -0.88 -1.09 115.31 120.70 3dl5 h LEU 203 Ca 0.11 0.00 -0.23 0.00 0.84 0.00 0.00 57.88 58.60 3dl5 h LEU 203 Cb 0.17 0.00 0.01 0.00 0.37 0.00 0.00 40.66 41.21 3dl5 h LEU 203 CO -0.24 0.00 -0.91 1.23 -0.34 0.00 0.00 178.44 178.19 3dl5 h GLY 204 N 0.00 0.63 1.01 3.75 0.00 0.75 -1.81 103.07 107.39 3dl5 h GLY 204 Ca 0.08 -1.02 -0.03 0.00 0.00 0.00 0.00 47.33 46.36 3dl5 h GLY 204 CO -0.00 0.90 0.28 0.83 0.00 0.00 0.00 176.54 178.55 3dl5 h GLU 205 N 0.34 0.98 -0.49 4.80 5.08 0.09 0.39 114.58 125.77 3dl5 h GLU 205 Ca -0.08 -0.17 -0.11 0.00 -1.00 0.00 0.00 59.36 58.01 3dl5 h GLU 205 Cb 1.54 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 30.61 3dl5 h GLU 205 CO 0.17 0.80 -0.11 0.82 -1.00 0.00 0.00 179.01 179.69 3dl5 h ILE 206 N 0.93 1.27 0.00 3.13 2.04 -1.30 -3.36 117.51 120.22 3dl5 h ILE 206 Ca 0.22 -1.25 -0.12 0.00 1.00 0.00 0.00 64.86 64.71 3dl5 h ILE 206 Cb 0.18 1.06 -0.02 0.00 -0.74 0.00 0.00 36.82 37.30 3dl5 h ILE 206 CO -0.02 0.43 -2.04 0.49 0.00 0.00 0.00 178.15 177.01 3dl5 n PHE 207 N -4.21 0.00 -2.13 1.37 3.72 -0.69 -5.05 117.46 110.48 3dl5 n PHE 207 Ca 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.40 3dl5 n PHE 207 Cb 0.40 -0.62 0.00 0.00 -0.94 0.00 0.00 39.48 38.31 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 1.55 2.46 0.30 1.37 0.00 0.13 -0.61 105.19 110.40 3dl5 n GLY 208 Ca -0.13 -0.26 0.10 0.00 0.00 0.00 0.00 46.02 45.73 3dl5 n GLY 208 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3dl5 h ILE 209 N 0.00 0.00 -0.91 -0.61 2.04 -1.92 -0.10 117.51 116.00 3dl5 h ILE 209 Ca 0.00 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.85 3dl5 h ILE 209 Cb 0.00 0.44 -0.04 0.00 -0.74 0.00 0.00 36.82 36.48 3dl5 h ILE 209 CO 0.00 0.00 0.55 0.03 0.00 0.00 0.00 178.15 178.73 3dl5 h ARG 210 N 0.00 1.24 -5.86 2.37 2.47 -1.26 -3.40 114.38 109.94 3dl5 h ARG 210 Ca 0.00 -0.11 -0.59 0.00 -1.26 0.00 0.00 59.98 58.01 3dl5 h ARG 210 Cb 0.97 -0.26 -0.09 0.00 -1.65 0.00 0.00 29.97 28.95 3dl5 h ARG 210 CO 0.00 0.87 0.53 0.21 0.56 0.00 0.00 179.97 182.14 3dl5 s LYS 211 N -5.96 4.13 0.26 0.04 2.20 -0.05 -4.95 119.74 115.41 3dl5 s LYS 211 Ca -0.13 0.93 -0.02 0.00 -0.36 0.00 0.00 55.97 56.39 3dl5 s LYS 211 Cb 0.17 -3.67 0.55 0.00 -1.51 0.00 0.00 37.83 33.37 3dl5 s LYS 211 CO 0.82 -0.60 1.71 1.98 -0.36 0.00 0.00 175.35 178.90 3dl5 h MET 212 N 7.78 0.38 -1.27 4.03 1.85 -1.85 0.92 114.93 126.78 3dl5 h MET 212 Ca -0.23 -0.02 0.37 0.00 -0.61 0.00 0.00 59.70 59.21 3dl5 h MET 212 Cb 1.09 -0.09 -0.08 0.00 0.43 0.00 0.00 31.60 32.95 3dl5 h MET 212 CO 0.90 0.25 0.87 0.78 -0.40 0.00 0.00 176.91 179.31 3dl5 h GLY 213 N 0.39 0.64 2.00 1.39 0.00 -1.92 0.80 103.07 106.37 3dl5 h GLY 213 Ca 0.47 -0.08 0.00 0.00 0.00 0.00 0.00 47.33 47.71 3dl5 h GLY 213 CO -0.47 -0.13 0.00 3.43 0.00 0.00 0.00 176.54 179.37 3dl5 h ASN 214 N 0.13 0.00 0.86 0.19 2.35 -1.07 -2.42 115.58 115.62 3dl5 h ASN 214 Ca 0.67 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.42 3dl5 h ASN 214 Cb 2.30 0.00 0.00 0.00 0.05 0.00 0.00 38.32 40.67 3dl5 h ASN 214 CO -0.18 0.00 -0.27 0.54 -1.65 0.00 0.00 177.43 175.87 3dl5 n ARG 215 N -2.98 0.08 -3.30 0.81 1.74 0.28 -4.02 116.66 109.27 3dl5 n ARG 215 Ca 0.02 0.04 -0.26 0.00 -0.77 0.00 0.00 57.85 56.89 3dl5 n ARG 215 Cb 0.39 -1.57 -0.07 0.00 -1.02 0.00 0.00 32.46 30.19 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 -1.69 2.31 -2.62 -1.55 8.25 -0.91 -4.91 115.22 114.09 3dl5 n HIS 216 Ca 0.06 -3.95 -0.36 0.00 -0.26 0.00 0.00 57.72 53.21 3dl5 n HIS 216 Cb 0.37 -0.48 -0.05 0.00 1.12 0.00 0.00 29.99 30.94 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 -2.18 4.21 0.27 -0.41 1.02 -1.22 -4.88 119.74 116.56 3dl5 s LYS 217 Ca 0.39 1.41 -0.29 0.00 0.02 0.00 0.00 55.97 57.50 3dl5 s LYS 217 Cb 0.18 -2.49 -0.09 0.00 -0.52 0.00 0.00 37.83 34.90 3dl5 s LYS 217 CO -0.06 -0.08 1.17 0.12 -0.92 0.00 0.00 175.35 175.58 3dl5 s PHE 218 N -1.76 3.42 0.32 3.18 5.36 -1.26 -4.80 117.98 122.45 3dl5 s PHE 218 Ca 0.58 1.58 -0.29 0.00 -0.96 0.00 0.00 56.93 57.84 3dl5 s PHE 218 Cb -0.19 -3.41 -0.11 0.00 -0.34 0.00 0.00 43.02 38.97 3dl5 s PHE 218 CO 0.24 -0.99 1.54 -2.30 -1.46 0.00 0.00 175.22 172.25 3dl5 n PRO 219 N 1.35 2.66 -2.38 10.12 -0.02 -1.26 -4.97 135.00 140.50 3dl5 n PRO 219 Ca 0.00 0.94 -0.38 0.00 -2.02 0.00 0.00 63.50 62.05 3dl5 n PRO 219 Cb 0.44 -2.70 -0.03 0.00 -0.02 0.00 0.00 33.50 31.20 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 -1.13 4.07 0.64 -0.52 1.02 -1.26 -4.85 119.74 117.71 3dl5 s LYS 220 Ca 0.60 1.72 0.36 0.00 0.02 0.00 0.00 55.97 58.67 3dl5 s LYS 220 Cb -0.49 -2.61 2.01 0.00 -0.52 0.00 0.00 37.83 36.22 3dl5 s LYS 220 CO 0.55 -0.27 2.21 1.05 -0.92 0.00 0.00 175.35 177.97 3dl5 h GLU 221 N 2.56 0.00 0.00 1.68 4.11 -1.93 -1.61 114.58 119.38 3dl5 h GLU 221 Ca -0.49 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.94 3dl5 h GLU 221 Cb 1.23 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.48 3dl5 h GLU 221 CO 0.62 0.00 0.00 -0.85 0.07 0.00 0.00 179.01 178.85 3dl5 n GLU 222 N -3.35 0.12 -0.05 1.06 0.00 -1.26 -2.26 120.64 114.89 3dl5 n GLU 222 Ca -0.02 0.38 0.02 0.00 0.00 0.00 0.00 57.16 57.54 3dl5 n GLU 222 Cb 0.19 -1.74 0.04 0.00 0.00 0.00 0.00 31.44 29.93 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 -1.96 0.86 -3.66 3.84 -5.35 -0.61 -5.02 119.36 107.45 3dl5 n ILE 223 Ca 0.02 -0.93 -0.37 0.00 -0.27 0.00 0.00 62.75 61.21 3dl5 n ILE 223 Cb 0.19 0.58 -0.10 0.00 -1.74 0.00 0.00 39.64 38.57 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 -0.90 3.28 0.12 4.28 6.04 -0.96 -4.50 117.35 124.71 3dl5 s TYR 224 Ca 0.07 0.16 -0.31 0.00 0.04 0.00 0.00 57.07 57.03 3dl5 s TYR 224 Cb 0.04 -2.29 -0.09 0.00 -1.04 0.00 0.00 41.96 38.58 3dl5 s TYR 224 CO 0.05 -0.01 1.59 1.21 -1.54 0.00 0.00 175.55 176.86 3dl5 s ASN 225 N 1.24 6.60 -1.19 4.32 3.84 -1.26 -3.40 114.94 125.10 3dl5 s ASN 225 Ca 0.07 2.55 -0.21 0.00 0.21 0.00 0.00 52.86 55.48 3dl5 s ASN 225 Cb -0.14 -2.58 0.00 0.00 -0.55 0.00 0.00 41.25 37.98 3dl5 s ASN 225 CO 0.06 -0.84 0.72 0.41 -2.79 0.00 0.00 177.10 174.66 3dl5 n THR 226 N 4.28 -4.89 -0.42 -5.21 -1.04 -1.26 -4.84 114.28 100.91 3dl5 n THR 226 Ca 0.15 -0.84 0.34 0.00 -2.04 0.00 0.00 64.05 61.66 3dl5 n THR 226 Cb 0.39 -3.72 0.65 0.00 -1.82 0.00 0.00 70.33 65.83 3dl5 n THR 226 CO 0.00 0.00 0.00 1.55 -0.64 0.00 0.00 175.07 175.98 3dl5 h PRO 227 N -2.04 0.14 -0.48 -2.82 0.13 -1.87 -0.95 132.00 124.12 3dl5 h PRO 227 Ca -0.67 -0.01 0.14 0.00 -0.87 0.00 0.00 66.00 64.59 3dl5 h PRO 227 Cb 1.37 -0.03 -0.02 0.00 0.13 0.00 0.00 31.00 32.45 3dl5 h PRO 227 CO 0.51 0.10 0.36 0.66 -0.23 0.00 0.00 178.00 179.39 3dl5 h SER 228 N 0.15 0.00 -2.22 1.44 4.64 -1.88 -3.32 113.55 112.35 3dl5 h SER 228 Ca 0.72 0.00 -0.65 0.00 -0.47 0.00 0.00 61.79 61.40 3dl5 h SER 228 Cb 2.34 0.00 -0.15 0.00 -0.31 0.00 0.00 62.40 64.28 3dl5 h SER 228 CO -0.27 0.00 0.89 -0.63 -0.87 0.00 0.00 176.83 175.95 3dl5 s ILE 229 N -4.97 4.40 -0.17 0.95 1.01 -0.36 -4.51 121.20 117.55 3dl5 s ILE 229 Ca -0.05 -0.97 -0.15 0.00 0.00 0.00 0.00 60.65 59.48 3dl5 s ILE 229 Cb 0.19 -4.82 -0.22 0.00 0.01 0.00 0.00 42.46 37.62 3dl5 s ILE 229 CO 0.71 -1.60 0.29 0.03 0.00 0.00 0.00 174.94 174.37 3dl5 h ARG 230 N 9.29 0.12 -0.01 2.79 3.08 -1.78 -3.41 114.38 124.46 3dl5 h ARG 230 Ca 0.02 -0.21 0.00 0.00 0.07 0.00 0.00 59.98 59.86 3dl5 h ARG 230 Cb 1.04 0.08 0.00 0.00 0.08 0.00 0.00 29.97 31.16 3dl5 h ARG 230 CO 1.20 1.10 -0.13 1.19 -1.07 0.00 0.00 179.97 182.26 3dl5 n PHE 231 N -4.02 0.00 -1.12 3.04 3.72 -1.26 -4.68 117.46 113.14 3dl5 n PHE 231 Ca -0.32 0.00 0.03 0.00 -0.05 0.00 0.00 57.45 57.11 3dl5 n PHE 231 Cb 0.84 0.00 0.25 0.00 -0.94 0.00 0.00 39.48 39.64 3dl5 n PHE 231 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3dl5 n GLY 232 N 0.89 4.18 3.29 1.37 0.00 -1.23 -4.85 105.19 108.85 3dl5 n GLY 232 Ca 0.07 -1.08 -0.43 0.00 0.00 0.00 0.00 46.02 44.58 3dl5 n GLY 232 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 3dl5 n ARG 233 N -0.60 3.10 -0.05 1.61 1.85 -1.26 -1.76 116.66 119.55 3dl5 n ARG 233 Ca 0.28 -3.08 -0.00 0.00 -1.00 0.00 0.00 57.85 54.05 3dl5 n ARG 233 Cb 1.03 -3.41 -0.14 0.00 -1.05 0.00 0.00 32.46 28.89 3dl5 n ARG 233 CO 0.00 0.00 0.00 -1.91 -0.01 0.00 0.00 177.63 175.71 3dl5 n GLU 234 N 7.53 0.93 -1.68 2.89 2.13 -1.10 -4.89 120.64 126.45 3dl5 n GLU 234 Ca 0.50 -0.08 -0.46 0.00 0.66 0.00 0.00 57.16 57.78 3dl5 n GLU 234 Cb 0.44 -1.43 -0.04 0.00 0.27 0.00 0.00 31.44 30.67 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 -2.40 2.38 1.20 4.31 -0.00 0.16 -4.09 115.22 116.78 3dl5 n HIS 235 Ca -0.16 0.14 0.08 0.00 0.46 0.00 0.00 57.72 58.24 3dl5 n HIS 235 Cb 0.78 -2.61 0.30 0.00 -0.12 0.00 0.00 29.99 28.35 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 4.37 0.27 1.55 1.57 4.02 -1.26 -2.25 117.16 125.43 3dl5 n TYR 236 Ca 0.18 -0.14 0.15 0.00 -0.01 0.00 0.00 57.90 58.08 3dl5 n TYR 236 Cb 0.31 0.00 0.68 0.00 -0.02 0.00 0.00 39.34 40.30 3dl5 n TYR 236 CO 0.00 0.00 0.00 -1.91 -1.01 0.00 0.00 176.86 173.94 3dl5 n GLU 237 N 0.28 0.91 0.11 -0.72 2.13 -1.26 -2.88 120.64 119.20 3dl5 n GLU 237 Ca 0.14 -0.29 0.01 0.00 0.66 0.00 0.00 57.16 57.68 3dl5 n GLU 237 Cb 0.29 -1.49 -0.01 0.00 0.27 0.00 0.00 31.44 30.49 3dl5 n GLU 237 CO 0.00 0.00 0.00 0.74 -0.41 0.00 0.00 177.13 177.46 3dl5 h PHE 238 N 0.71 0.00 -0.11 4.31 0.04 -1.82 -2.19 116.94 117.89 3dl5 h PHE 238 Ca 0.00 0.00 0.03 0.00 2.80 0.00 0.00 57.97 60.80 3dl5 h PHE 238 Cb 0.30 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.44 3dl5 h PHE 238 CO 0.00 0.55 0.16 1.96 -0.60 0.00 0.00 178.31 180.38 3dl5 h GLN 239 N 0.00 0.00 0.00 1.51 1.08 -1.75 0.23 115.11 116.18 3dl5 h GLN 239 Ca -0.04 0.00 -0.29 0.00 -1.45 0.00 0.00 58.65 56.87 3dl5 h GLN 239 Cb 1.45 0.00 -0.04 0.00 -0.05 0.00 0.00 27.48 28.84 3dl5 h GLN 239 CO 0.07 0.00 -1.94 0.98 -0.95 0.00 0.00 178.83 176.98 3dl5 n TYR 240 N -3.56 0.00 -0.10 2.96 4.19 -1.16 -3.90 117.16 115.60 3dl5 n TYR 240 Ca -0.00 0.00 0.24 0.00 3.31 0.00 0.00 57.90 61.45 3dl5 n TYR 240 Cb 0.26 -0.78 0.69 0.00 0.49 0.00 0.00 39.34 40.01 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 -0.93 0.03 0.10 2.98 3.38 -1.17 0.13 115.31 119.83 3dl5 h LEU 241 Ca -0.44 0.00 -0.28 0.00 0.09 0.00 0.00 57.88 57.25 3dl5 h LEU 241 Cb 1.36 -0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.10 3dl5 h LEU 241 CO -0.27 0.01 -1.37 0.44 0.09 0.00 0.00 178.44 177.35 3dl5 h ASP 242 N 0.03 0.31 0.23 -0.43 3.32 -0.77 -2.49 116.42 116.62 3dl5 h ASP 242 Ca 0.35 -0.39 -0.06 0.00 0.02 0.00 0.00 57.03 56.95 3dl5 h ASP 242 Cb 1.35 -0.10 -0.01 0.00 0.22 0.00 0.00 39.33 40.79 3dl5 h ASP 242 CO -0.01 1.32 -0.25 0.25 -1.72 0.00 0.00 179.24 178.82 3dl5 h LEU 243 N 0.05 0.04 -0.08 1.55 5.85 -1.16 0.11 115.31 121.67 3dl5 h LEU 243 Ca -0.18 -0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.53 3dl5 h LEU 243 Cb 1.96 -0.01 -0.00 0.00 0.37 0.00 0.00 40.66 42.98 3dl5 h LEU 243 CO 0.16 0.29 0.01 0.25 -0.34 0.00 0.00 178.44 178.82 3dl5 h LEU 244 N 0.04 0.12 -0.74 2.25 5.85 -1.09 -2.56 115.31 119.19 3dl5 h LEU 244 Ca 0.00 -0.25 -0.00 0.00 0.84 0.00 0.00 57.88 58.47 3dl5 h LEU 244 Cb 0.46 -0.03 -0.04 0.00 0.37 0.00 0.00 40.66 41.43 3dl5 h LEU 244 CO 0.03 0.34 0.45 0.28 -0.34 0.00 0.00 178.44 179.21 3dl5 h SER 245 N -0.11 0.88 -0.90 1.25 0.02 -0.85 -1.82 113.55 112.03 3dl5 h SER 245 Ca 0.02 -0.05 0.02 0.00 -0.84 0.00 0.00 61.79 60.94 3dl5 h SER 245 Cb 0.27 -0.22 -0.05 0.00 0.14 0.00 0.00 62.40 62.55 3dl5 h SER 245 CO 0.00 0.67 0.59 0.03 -1.14 0.00 0.00 176.83 176.98 3dl5 h ARG 246 N 1.00 1.15 -0.35 3.45 3.08 -0.70 -1.29 114.38 120.72 3dl5 h ARG 246 Ca 0.27 -0.07 -0.13 0.00 0.07 0.00 0.00 59.98 60.11 3dl5 h ARG 246 Cb -0.05 -0.26 -0.01 0.00 0.08 0.00 0.00 29.97 29.73 3dl5 h ARG 246 CO -0.05 0.76 -0.30 0.28 -1.07 0.00 0.00 179.97 179.59 3dl5 h VAL 247 N 1.19 1.28 0.00 2.04 2.07 -1.21 0.11 116.25 121.73 3dl5 h VAL 247 Ca 0.34 -1.47 0.00 0.00 0.82 0.00 0.00 66.70 66.39 3dl5 h VAL 247 Cb -0.09 1.44 0.00 0.00 -1.52 0.00 0.00 31.29 31.12 3dl5 h VAL 247 CO -0.09 0.48 0.00 -0.07 0.02 0.00 0.00 177.57 177.92 3dl5 h LEU 248 N 0.61 0.00 0.00 2.57 4.07 -0.66 0.54 115.31 122.44 3dl5 h LEU 248 Ca 0.06 0.00 -0.37 0.00 0.08 0.00 0.00 57.88 57.65 3dl5 h LEU 248 Cb 0.88 0.00 -0.06 0.00 1.08 0.00 0.00 40.66 42.57 3dl5 h LEU 248 CO 0.08 0.00 -2.22 1.21 -1.08 0.00 0.00 178.44 176.43 3dl5 n GLU 249 N -2.29 0.52 0.00 1.13 4.07 -0.55 -4.73 120.64 118.78 3dl5 n GLU 249 Ca -0.01 0.23 0.10 0.00 -0.06 0.00 0.00 57.16 57.41 3dl5 n GLU 249 Cb 0.06 -1.37 -0.08 0.00 -0.06 0.00 0.00 31.44 29.99 3dl5 n GLU 249 CO 0.00 0.00 0.00 0.09 -0.06 0.00 0.00 177.13 177.16 3dl5 n ASN 250 N -4.13 1.23 -4.67 4.31 3.02 0.34 -5.00 115.26 110.35 3dl5 n ASN 250 Ca -0.45 -1.11 -0.53 0.00 -0.03 0.00 0.00 54.58 52.46 3dl5 n ASN 250 Cb 0.80 0.84 -0.06 0.00 -0.61 0.00 0.00 39.78 40.75 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 1.43 1.09 3.65 7.41 0.00 0.19 -4.86 105.19 114.10 3dl5 n GLY 251 Ca 0.05 0.90 -0.41 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 4.18 3.61 0.23 4.61 0.00 -0.32 -4.47 121.76 129.60 3dl5 s ALA 252 Ca 0.97 -0.15 -0.32 0.00 0.00 0.00 0.00 51.96 52.46 3dl5 s ALA 252 Cb -0.88 -3.22 -0.12 0.00 0.00 0.00 0.00 23.12 18.90 3dl5 s ALA 252 CO 0.58 -0.83 1.67 0.98 0.00 0.00 0.00 175.76 178.15 3dl5 n TYR 253 N 5.75 2.71 -3.49 0.00 4.19 -1.26 -1.97 117.16 123.09 3dl5 n TYR 253 Ca 0.04 0.13 -0.15 0.00 3.31 0.00 0.00 57.90 61.23 3dl5 n TYR 253 Cb 0.48 -2.63 -0.04 0.00 0.49 0.00 0.00 39.34 37.63 3dl5 n TYR 253 CO 0.00 0.00 0.00 -0.98 0.91 0.00 0.00 176.86 176.79 3dl5 s ARG 254 N 0.67 1.09 0.86 2.98 1.70 -0.67 -4.97 118.95 120.62 3dl5 s ARG 254 Ca 0.72 -0.01 -0.13 0.00 -0.47 0.00 0.00 55.73 55.84 3dl5 s ARG 254 Cb -0.53 0.51 0.12 0.00 -0.57 0.00 0.00 34.95 34.48 3dl5 s ARG 254 CO 0.38 -0.40 1.22 -1.21 -1.08 0.00 0.00 175.30 174.21 3dl5 s GLU 255 N -2.12 1.49 0.21 3.89 8.01 -1.26 -1.93 118.70 126.99 3dl5 s GLU 255 Ca -0.06 -0.03 -0.23 0.00 0.01 0.00 0.00 54.97 54.66 3dl5 s GLU 255 Cb -0.00 -1.91 0.06 0.00 -4.31 0.00 0.00 34.13 27.97 3dl5 s GLU 255 CO 0.01 -1.90 0.93 0.54 0.01 0.00 0.00 175.26 174.85 3dl5 s ASN 256 N -4.63 -0.12 0.46 -0.19 2.20 -1.26 -4.85 114.94 106.55 3dl5 s ASN 256 Ca 0.66 -0.59 0.23 0.00 -0.94 0.00 0.00 52.86 52.21 3dl5 s ASN 256 Cb -0.09 0.57 1.24 0.00 -2.00 0.00 0.00 41.25 40.97 3dl5 s ASN 256 CO 0.50 -1.08 1.86 0.08 -2.94 0.00 0.00 177.10 175.53 3dl5 h ARG 257 N 2.00 0.24 -7.53 3.55 0.11 -1.99 -3.41 114.38 107.34 3dl5 h ARG 257 Ca -0.25 -0.01 -0.46 0.00 0.10 0.00 0.00 59.98 59.35 3dl5 h ARG 257 Cb 1.23 -0.05 0.11 0.00 1.11 0.00 0.00 29.97 32.37 3dl5 h ARG 257 CO 0.30 0.16 0.33 0.95 0.10 0.00 0.00 179.97 181.81 3dl5 s THR 258 N -5.25 2.10 -0.57 0.08 -4.23 -1.26 -4.96 115.64 101.54 3dl5 s THR 258 Ca -0.07 -0.13 0.25 0.00 -1.18 0.00 0.00 61.69 60.56 3dl5 s THR 258 Cb 0.22 -2.96 0.31 0.00 1.34 0.00 0.00 72.50 71.41 3dl5 s THR 258 CO 0.78 0.00 1.73 1.23 -0.54 0.00 0.00 174.62 177.82 3dl5 h GLY 259 N -1.02 0.00 -4.99 3.99 0.00 -1.94 -3.45 103.07 95.66 3dl5 h GLY 259 Ca -0.44 0.00 -0.57 0.00 0.00 0.00 0.00 47.33 46.32 3dl5 h GLY 259 CO 0.55 0.00 -0.03 -0.42 0.00 0.00 0.00 176.54 176.64 3dl5 s ILE 260 N -3.18 4.95 0.52 2.60 1.09 -1.26 -4.97 121.20 120.94 3dl5 s ILE 260 Ca 0.08 1.20 -0.09 0.00 -1.10 0.00 0.00 60.65 60.75 3dl5 s ILE 260 Cb 0.09 -3.91 -0.05 0.00 -1.06 0.00 0.00 42.46 37.54 3dl5 s ILE 260 CO 0.60 0.41 0.88 -0.44 -0.10 0.00 0.00 174.94 176.29 3dl5 s SER 261 N -0.10 6.33 0.38 3.58 0.01 -1.26 -4.54 113.70 118.09 3dl5 s SER 261 Ca 0.30 1.17 0.04 0.00 1.31 0.00 0.00 55.95 58.77 3dl5 s SER 261 Cb -0.18 -2.35 -0.04 0.00 0.21 0.00 0.00 66.02 63.66 3dl5 s SER 261 CO 0.16 -0.64 0.08 0.42 0.41 0.00 0.00 173.24 173.67 3dl5 s THR 262 N -2.81 0.94 -0.15 1.44 -4.23 -0.81 -1.03 115.64 109.00 3dl5 s THR 262 Ca 0.51 -2.00 -0.01 0.00 -1.18 0.00 0.00 61.69 59.02 3dl5 s THR 262 Cb -0.10 -2.56 -0.01 0.00 1.34 0.00 0.00 72.50 71.17 3dl5 s THR 262 CO 0.44 0.00 -0.12 -0.31 -0.54 0.00 0.00 174.62 174.10 3dl5 s TYR 263 N -3.23 2.84 -0.04 3.99 2.02 -0.53 -1.68 117.35 120.73 3dl5 s TYR 263 Ca 0.29 -0.71 0.05 0.00 -0.37 0.00 0.00 57.07 56.33 3dl5 s TYR 263 Cb 0.06 -1.89 -0.01 0.00 -0.40 0.00 0.00 41.96 39.72 3dl5 s TYR 263 CO 0.14 -0.27 -0.18 0.45 -1.57 0.00 0.00 175.55 174.12 3dl5 s SER 264 N 0.55 2.17 0.01 2.29 0.15 -0.83 -2.21 113.70 115.83 3dl5 s SER 264 Ca -0.08 -0.35 0.00 0.00 0.70 0.00 0.00 55.95 56.22 3dl5 s SER 264 Cb -0.15 -0.53 -0.01 0.00 -1.71 0.00 0.00 66.02 63.61 3dl5 s SER 264 CO 0.04 0.17 -0.02 0.27 1.20 0.00 0.00 173.24 174.90 3dl5 s ILE 265 N -0.07 0.08 -0.11 6.45 -4.36 -1.04 -1.17 121.20 120.99 3dl5 s ILE 265 Ca -0.02 -0.59 -0.02 0.00 -0.26 0.00 0.00 60.65 59.77 3dl5 s ILE 265 Cb -0.11 -0.18 -0.03 0.00 1.25 0.00 0.00 42.46 43.40 3dl5 s ILE 265 CO 0.02 -0.32 -0.04 0.12 0.24 0.00 0.00 174.94 174.96 3dl5 s PHE 266 N -0.93 3.03 -0.05 1.37 5.36 -1.26 -1.75 117.98 123.74 3dl5 s PHE 266 Ca -0.10 -0.10 -0.01 0.00 -0.96 0.00 0.00 56.93 55.77 3dl5 s PHE 266 Cb -0.06 -1.84 0.00 0.00 -0.34 0.00 0.00 43.02 40.77 3dl5 s PHE 266 CO -0.01 0.18 0.02 0.41 -1.46 0.00 0.00 175.22 174.37 3dl5 n GLY 267 N 2.83 -2.58 3.24 13.12 0.00 0.44 -5.01 105.19 117.23 3dl5 n GLY 267 Ca -0.18 -0.09 -0.14 0.00 0.00 0.00 0.00 46.02 45.62 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 -0.47 1.31 -0.03 1.61 -1.52 0.50 -4.96 119.66 116.11 3dl5 s GLN 268 Ca 0.01 -1.71 -0.21 0.00 -1.95 0.00 0.00 55.36 51.50 3dl5 s GLN 268 Cb -0.00 0.14 0.04 0.00 -0.22 0.00 0.00 33.01 32.97 3dl5 s GLN 268 CO 0.12 -0.40 0.46 0.00 -0.25 0.00 0.00 175.29 175.22 3dl5 s MET 269 N -4.05 0.83 0.01 2.91 0.23 -1.26 0.10 119.30 118.07 3dl5 s MET 269 Ca 0.39 -0.02 0.04 0.00 -1.03 0.00 0.00 55.69 55.07 3dl5 s MET 269 Cb 0.07 0.38 -0.01 0.00 -1.53 0.00 0.00 34.83 33.73 3dl5 s MET 269 CO 0.14 -0.24 -0.13 -1.64 -2.03 0.00 0.00 175.02 171.12 3dl5 s MET 270 N -1.29 0.92 0.07 3.16 -1.94 0.08 -4.97 119.30 115.33 3dl5 s MET 270 Ca -0.12 -0.58 0.06 0.00 -1.71 0.00 0.00 55.69 53.34 3dl5 s MET 270 Cb -0.03 -0.90 -0.04 0.00 2.01 0.00 0.00 34.83 35.87 3dl5 s MET 270 CO 0.06 0.24 -0.11 1.03 -0.01 0.00 0.00 175.02 176.23 3dl5 s ARG 271 N -0.70 2.20 -0.13 2.03 0.52 -1.26 -0.60 118.95 121.01 3dl5 s ARG 271 Ca 0.03 -0.96 -0.07 0.00 -0.52 0.00 0.00 55.73 54.21 3dl5 s ARG 271 Cb -0.06 -2.32 0.05 0.00 0.52 0.00 0.00 34.95 33.14 3dl5 s ARG 271 CO 0.00 0.53 0.32 -0.06 0.02 0.00 0.00 175.30 176.11 3dl5 s PHE 272 N -1.12 -0.45 0.02 -0.53 0.08 0.22 -4.84 117.98 111.36 3dl5 s PHE 272 Ca 0.19 1.01 -0.20 0.00 0.12 0.00 0.00 56.93 58.05 3dl5 s PHE 272 Cb -0.11 0.14 -0.06 0.00 -0.57 0.00 0.00 43.02 42.42 3dl5 s PHE 272 CO 0.11 -0.28 0.59 0.34 -0.10 0.00 0.00 175.22 175.87 3dl5 s ASP 273 N 1.36 7.00 0.00 1.36 -1.08 -1.26 0.44 116.67 124.49 3dl5 s ASP 273 Ca -0.09 1.19 0.00 0.00 -0.52 0.00 0.00 52.55 53.13 3dl5 s ASP 273 Cb -0.10 -2.36 0.00 0.00 -1.46 0.00 0.00 42.92 39.00 3dl5 s ASP 273 CO -0.10 0.16 0.34 0.23 0.52 0.00 0.00 175.17 176.31 3dl5 n MET 274 N 2.41 1.51 0.15 4.34 2.81 -0.04 -4.40 117.12 123.89 3dl5 n MET 274 Ca -0.08 -0.34 -0.00 0.00 -1.81 0.00 0.00 57.70 55.47 3dl5 n MET 274 Cb 0.51 -0.83 0.24 0.00 -0.71 0.00 0.00 33.22 32.42 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 0.02 0.00 0.03 3.08 -1.67 -3.33 114.38 112.51 3dl5 h ARG 275 Ca 0.00 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.04 3dl5 h ARG 275 Cb 0.01 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.06 3dl5 h ARG 275 CO 0.00 0.54 0.00 0.39 -1.07 0.00 0.00 179.97 179.83 3dl5 n GLU 276 N -3.92 0.65 -3.79 0.04 -0.58 -1.26 -4.95 120.64 106.83 3dl5 n GLU 276 Ca -0.01 -0.39 -0.02 0.00 -0.42 0.00 0.00 57.16 56.31 3dl5 n GLU 276 Cb 0.53 -0.89 0.00 0.00 -0.57 0.00 0.00 31.44 30.51 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 -0.21 -0.08 -0.21 1.62 1.04 -1.25 -3.34 113.70 111.27 3dl5 s SER 277 Ca 0.00 -0.44 -0.03 0.00 0.48 0.00 0.00 55.95 55.96 3dl5 s SER 277 Cb 0.00 0.42 -0.01 0.00 0.10 0.00 0.00 66.02 66.53 3dl5 s SER 277 CO 0.00 -0.79 -0.07 0.12 0.98 0.00 0.00 173.24 173.48 3dl5 s PHE 278 N -2.66 2.93 -0.62 5.02 5.36 -0.41 -4.17 117.98 123.42 3dl5 s PHE 278 Ca 0.17 -1.01 -0.25 0.00 -0.96 0.00 0.00 56.93 54.88 3dl5 s PHE 278 Cb -0.01 -2.07 -0.21 0.00 -0.34 0.00 0.00 43.02 40.39 3dl5 s PHE 278 CO 0.02 -0.56 1.84 -0.35 -1.46 0.00 0.00 175.22 174.71 3dl5 n PRO 279 N 4.72 1.06 -3.86 10.12 -0.04 -1.26 -3.82 135.00 141.92 3dl5 n PRO 279 Ca -0.19 -1.68 -0.36 0.00 -0.04 0.00 0.00 63.50 61.24 3dl5 n PRO 279 Cb 0.51 -2.93 -0.14 0.00 -0.04 0.00 0.00 33.50 30.90 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 2.52 3.21 0.11 1.53 2.96 -1.26 -4.12 118.68 123.62 3dl5 s LEU 280 Ca 0.63 -0.48 -0.35 0.00 -0.22 0.00 0.00 54.13 53.70 3dl5 s LEU 280 Cb 0.12 -1.79 -0.15 0.00 0.50 0.00 0.00 46.19 44.87 3dl5 s LEU 280 CO 0.19 -0.07 1.48 0.18 -1.32 0.00 0.00 176.35 176.81 3dl5 n LEU 281 N 4.82 2.43 0.02 -0.68 4.77 -1.26 -4.68 117.00 122.42 3dl5 n LEU 281 Ca -0.17 1.10 0.11 0.00 -0.03 0.00 0.00 56.01 57.02 3dl5 n LEU 281 Cb 0.50 -1.31 -0.11 0.00 -2.33 0.00 0.00 43.42 40.17 3dl5 n LEU 281 CO 0.29 -0.63 -0.45 0.35 -1.33 0.00 0.00 177.39 175.62 3dl5 n THR 282 N 3.08 0.17 1.02 -5.08 -2.24 -1.26 -4.18 114.28 105.78 3dl5 n THR 282 Ca 0.18 -0.45 0.10 0.00 -2.27 0.00 0.00 64.05 61.61 3dl5 n THR 282 Cb 0.24 0.00 0.54 0.00 -2.10 0.00 0.00 70.33 69.01 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 -2.28 0.33 -3.65 4.28 -2.24 -1.26 -1.07 114.28 108.38 3dl5 n THR 283 Ca -0.02 0.08 -0.15 0.00 -2.27 0.00 0.00 64.05 61.69 3dl5 n THR 283 Cb 0.54 -0.73 -0.08 0.00 -2.10 0.00 0.00 70.33 67.96 3dl5 n THR 283 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 3dl5 s LYS 284 N -2.55 0.80 -0.38 -0.78 2.20 -1.26 -4.58 119.74 113.19 3dl5 s LYS 284 Ca 0.21 0.36 -0.29 0.00 -0.36 0.00 0.00 55.97 55.89 3dl5 s LYS 284 Cb 0.14 0.38 0.02 0.00 -1.51 0.00 0.00 37.83 36.86 3dl5 s LYS 284 CO 0.32 -0.19 1.11 0.21 -0.36 0.00 0.00 175.35 176.44 3dl5 s LYS 285 N -0.61 3.92 -0.22 4.03 2.20 -0.89 -4.61 119.74 123.56 3dl5 s LYS 285 Ca -0.07 0.87 -0.16 0.00 -0.36 0.00 0.00 55.97 56.25 3dl5 s LYS 285 Cb -0.03 -3.81 -0.04 0.00 -1.51 0.00 0.00 37.83 32.44 3dl5 s LYS 285 CO 0.05 -1.11 0.41 0.08 -0.36 0.00 0.00 175.35 174.42 3dl5 s VAL 286 N 4.01 5.18 -1.00 4.02 1.01 -1.26 -4.75 120.40 127.61 3dl5 s VAL 286 Ca 0.47 0.72 -0.23 0.00 0.00 0.00 0.00 61.98 62.93 3dl5 s VAL 286 Cb -0.10 -3.74 -0.01 0.00 0.00 0.00 0.00 36.38 32.52 3dl5 s VAL 286 CO 0.22 0.22 1.77 -0.36 0.00 0.00 0.00 175.10 176.95 3dl5 s PHE 287 N 1.53 2.12 0.31 5.22 0.40 -1.26 -4.82 117.98 121.48 3dl5 s PHE 287 Ca 0.19 -0.00 -0.01 0.00 -0.60 0.00 0.00 56.93 56.50 3dl5 s PHE 287 Cb -0.15 -4.30 0.47 0.00 0.51 0.00 0.00 43.02 39.55 3dl5 s PHE 287 CO 0.08 -1.75 1.97 0.97 0.70 0.00 0.00 175.22 177.19 3dl5 h ILE 288 N 6.89 1.21 0.12 0.64 6.09 -2.01 -3.26 117.51 127.18 3dl5 h ILE 288 Ca 0.17 -0.40 0.02 0.00 -1.37 0.00 0.00 64.86 63.27 3dl5 h ILE 288 Cb 0.99 0.08 -0.05 0.00 0.47 0.00 0.00 36.82 38.31 3dl5 h ILE 288 CO 1.30 0.20 -0.49 -0.09 -3.07 0.00 0.00 178.15 176.01 3dl5 h ARG 289 N 1.06 -0.69 -0.52 2.19 2.43 -2.01 -0.93 114.38 115.91 3dl5 h ARG 289 Ca 0.28 0.05 0.14 0.00 -0.81 0.00 0.00 59.98 59.64 3dl5 h ARG 289 Cb -0.09 0.16 -0.02 0.00 -0.42 0.00 0.00 29.97 29.59 3dl5 h ARG 289 CO -0.06 -0.46 0.37 0.66 -1.51 0.00 0.00 179.97 178.97 3dl5 h SER 290 N -0.72 0.05 -0.36 -3.80 4.64 -1.95 0.72 113.55 112.13 3dl5 h SER 290 Ca 0.01 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.30 3dl5 h SER 290 Cb 0.73 -0.01 -0.02 0.00 -0.31 0.00 0.00 62.40 62.80 3dl5 h SER 290 CO -0.27 0.02 0.13 0.40 -0.87 0.00 0.00 176.83 176.24 3dl5 h ILE 291 N 0.05 1.20 0.24 0.95 2.04 -1.26 -2.20 117.51 118.53 3dl5 h ILE 291 Ca 0.25 -0.64 -0.01 0.00 1.00 0.00 0.00 64.86 65.45 3dl5 h ILE 291 Cb 0.92 0.95 0.00 0.00 -0.74 0.00 0.00 36.82 37.95 3dl5 h ILE 291 CO -0.01 0.22 -0.12 0.15 0.00 0.00 0.00 178.15 178.39 3dl5 h PHE 292 N 0.43 -0.30 -0.85 1.37 3.57 -0.13 -1.79 116.94 119.24 3dl5 h PHE 292 Ca 0.12 -0.01 0.13 0.00 3.53 0.00 0.00 57.97 61.75 3dl5 h PHE 292 Cb 0.23 0.10 -0.06 0.00 2.79 0.00 0.00 35.95 39.00 3dl5 h PHE 292 CO 0.00 -0.14 0.55 0.93 -2.23 0.00 0.00 178.31 177.43 3dl5 h GLU 293 N -0.40 0.63 -0.23 1.11 4.39 -1.32 0.97 114.58 119.74 3dl5 h GLU 293 Ca -0.03 -0.04 -0.09 0.00 0.34 0.00 0.00 59.36 59.54 3dl5 h GLU 293 Cb 0.30 -0.14 -0.00 0.00 -0.10 0.00 0.00 28.75 28.81 3dl5 h GLU 293 CO 0.06 0.42 -0.21 1.49 -1.16 0.00 0.00 179.01 179.61 3dl5 h GLU 294 N 0.65 0.55 0.52 2.33 4.81 -1.19 -1.51 114.58 120.76 3dl5 h GLU 294 Ca 0.42 -0.28 -0.03 0.00 -0.13 0.00 0.00 59.36 59.34 3dl5 h GLU 294 Cb 0.69 0.01 0.01 0.00 0.63 0.00 0.00 28.75 30.08 3dl5 h GLU 294 CO -0.18 0.86 -0.25 1.25 -0.73 0.00 0.00 179.01 179.97 3dl5 h LEU 295 N 0.25 -0.60 -1.92 1.64 6.46 -0.34 -1.47 115.31 119.33 3dl5 h LEU 295 Ca 0.04 -0.04 0.08 0.00 -0.12 0.00 0.00 57.88 57.85 3dl5 h LEU 295 Cb 0.75 0.15 -0.02 0.00 -0.73 0.00 0.00 40.66 40.82 3dl5 h LEU 295 CO 0.05 -0.33 0.24 -0.29 -0.62 0.00 0.00 178.44 177.50 3dl5 h ILE 296 N -0.85 0.87 -0.21 4.05 6.09 -0.94 0.32 117.51 126.85 3dl5 h ILE 296 Ca -0.07 -0.03 -0.09 0.00 -1.37 0.00 0.00 64.86 63.30 3dl5 h ILE 296 Cb 0.60 0.78 -0.01 0.00 0.47 0.00 0.00 36.82 38.65 3dl5 h ILE 296 CO 0.12 0.02 -0.25 -0.25 -3.07 0.00 0.00 178.15 174.71 3dl5 h TRP 297 N 0.09 0.44 0.14 2.19 7.01 -0.87 -1.86 115.95 123.09 3dl5 h TRP 297 Ca 0.16 -0.09 -0.01 0.00 2.11 0.00 0.00 58.89 61.06 3dl5 h TRP 297 Cb 0.52 -0.11 0.00 0.00 -2.10 0.00 0.00 29.16 27.47 3dl5 h TRP 297 CO -0.00 0.62 -0.07 0.74 -2.79 0.00 0.00 178.44 176.94 3dl5 h PHE 298 N 0.35 -0.17 -1.19 2.65 0.04 0.59 -2.68 116.94 116.53 3dl5 h PHE 298 Ca 0.05 -0.00 0.35 0.00 2.80 0.00 0.00 57.97 61.17 3dl5 h PHE 298 Cb 0.63 0.06 -0.10 0.00 2.20 0.00 0.00 35.95 38.74 3dl5 h PHE 298 CO 0.02 0.25 0.78 0.82 -0.60 0.00 0.00 178.31 179.58 3dl5 h ILE 299 N -0.92 0.34 -0.17 -0.55 2.04 -0.86 0.65 117.51 118.04 3dl5 h ILE 299 Ca -0.02 -0.08 -0.08 0.00 1.00 0.00 0.00 64.86 65.69 3dl5 h ILE 299 Cb 0.50 0.11 -0.00 0.00 -0.74 0.00 0.00 36.82 36.69 3dl5 h ILE 299 CO 0.03 0.04 -0.19 0.50 0.00 0.00 0.00 178.15 178.54 3dl5 h LYS 300 N 0.22 0.43 0.00 2.37 1.63 -1.39 -3.47 116.57 116.37 3dl5 h LYS 300 Ca 0.68 -0.23 0.00 0.00 -0.85 0.00 0.00 60.65 60.25 3dl5 h LYS 300 Cb 2.06 0.01 0.00 0.00 -0.60 0.00 0.00 32.23 33.70 3dl5 h LYS 300 CO -0.30 0.80 0.00 0.41 -3.45 0.00 0.00 179.45 176.91 3dl5 n GLY 301 N 0.21 1.30 3.73 5.01 0.00 0.23 -4.91 105.19 110.76 3dl5 n GLY 301 Ca -0.06 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.55 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 -2.00 7.24 -0.00 1.61 -1.08 -1.02 -3.64 116.67 117.78 3dl5 s ASP 302 Ca 0.00 2.06 0.02 0.00 -0.52 0.00 0.00 52.55 54.11 3dl5 s ASP 302 Cb 0.00 -2.60 0.06 0.00 -1.46 0.00 0.00 42.92 38.92 3dl5 s ASP 302 CO 0.00 -0.26 1.05 0.35 0.52 0.00 0.00 175.17 176.82 3dl5 n THR 303 N 2.70 1.03 -2.81 1.71 -2.24 -1.26 -4.52 114.28 108.89 3dl5 n THR 303 Ca 0.04 -1.03 -0.43 0.00 -2.27 0.00 0.00 64.05 60.36 3dl5 n THR 303 Cb 0.46 0.48 -0.04 0.00 -2.10 0.00 0.00 70.33 69.14 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 -1.05 6.23 0.43 3.42 3.84 -1.26 -3.31 114.94 123.23 3dl5 s ASN 304 Ca 0.05 -0.70 0.29 0.00 0.21 0.00 0.00 52.86 52.70 3dl5 s ASN 304 Cb 0.03 -2.44 1.55 0.00 -0.55 0.00 0.00 41.25 39.83 3dl5 s ASN 304 CO 0.03 -1.43 1.88 1.23 -2.79 0.00 0.00 177.10 176.02 3dl5 h GLY 305 N 11.46 0.00 0.95 1.21 0.00 -1.90 -2.85 103.07 111.95 3dl5 h GLY 305 Ca -0.28 0.00 -0.07 0.00 0.00 0.00 0.00 47.33 46.98 3dl5 h GLY 305 CO 1.17 0.00 -0.03 3.43 0.00 0.00 0.00 176.54 181.10 3dl5 h ASN 306 N 0.00 0.71 -1.01 0.19 2.35 -1.91 -2.62 115.58 113.28 3dl5 h ASN 306 Ca 0.00 -0.33 0.30 0.00 -0.55 0.00 0.00 56.30 55.72 3dl5 h ASN 306 Cb 0.02 -0.19 -0.14 0.00 0.05 0.00 0.00 38.32 38.06 3dl5 h ASN 306 CO 0.00 0.87 0.59 0.45 -1.65 0.00 0.00 177.43 177.68 3dl5 h HIS 307 N 0.54 0.94 -0.01 1.19 3.86 -1.92 0.99 115.15 120.73 3dl5 h HIS 307 Ca 0.11 0.04 -0.03 0.00 -1.16 0.00 0.00 60.37 59.32 3dl5 h HIS 307 Cb 0.52 -0.26 0.00 0.00 1.06 0.00 0.00 27.41 28.74 3dl5 h HIS 307 CO 0.04 -0.10 -0.12 -0.07 0.86 0.00 0.00 177.93 178.54 3dl5 h LEU 308 N 0.40 0.11 -0.83 2.43 -0.00 -1.71 -2.91 115.31 112.79 3dl5 h LEU 308 Ca 0.71 -0.74 0.08 0.00 -0.00 0.00 0.00 57.88 57.93 3dl5 h LEU 308 Cb 1.56 -0.03 -0.07 0.00 -0.00 0.00 0.00 40.66 42.12 3dl5 h LEU 308 CO -0.56 0.84 0.49 0.40 -0.00 0.00 0.00 178.44 179.62 3dl5 h ILE 309 N -0.60 0.96 0.00 1.22 1.08 -0.65 0.78 117.51 120.30 3dl5 h ILE 309 Ca -0.01 -0.30 -0.00 0.00 -0.39 0.00 0.00 64.86 64.16 3dl5 h ILE 309 Cb 0.85 0.03 -0.00 0.00 -3.07 0.00 0.00 36.82 34.63 3dl5 h ILE 309 CO 0.02 0.16 -0.01 -0.33 -0.69 0.00 0.00 178.15 177.30 3dl5 h GLU 310 N 0.86 0.00 -0.59 2.37 5.08 0.91 0.56 114.58 123.78 3dl5 h GLU 310 Ca 0.39 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.75 3dl5 h GLU 310 Cb 0.28 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.53 3dl5 h GLU 310 CO -0.22 0.01 0.00 1.63 -1.00 0.00 0.00 179.01 179.44 3dl5 n LYS 311 N -3.54 3.11 -2.94 2.33 5.02 0.12 -4.96 118.16 117.30 3dl5 n LYS 311 Ca -0.03 -2.61 -0.11 0.00 -2.02 0.00 0.00 58.31 53.54 3dl5 n LYS 311 Cb 0.10 -1.62 0.06 0.00 -0.02 0.00 0.00 35.03 33.54 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 1.08 -4.35 -3.83 1.97 5.02 0.19 -5.03 118.16 113.22 3dl5 n LYS 312 Ca 0.22 0.55 -0.30 0.00 -2.02 0.00 0.00 58.31 56.76 3dl5 n LYS 312 Cb 0.68 -4.68 -0.15 0.00 -0.02 0.00 0.00 35.03 30.86 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 -3.23 1.34 -0.36 -0.18 1.01 -0.36 -5.00 120.40 113.62 3dl5 s VAL 313 Ca 0.02 -1.72 0.09 0.00 0.00 0.00 0.00 61.98 60.37 3dl5 s VAL 313 Cb -0.01 -2.01 0.67 0.00 0.00 0.00 0.00 36.38 35.03 3dl5 s VAL 313 CO 0.47 -0.65 1.69 -1.22 0.00 0.00 0.00 175.10 175.39 3dl5 n TYR 314 N 4.65 2.19 0.06 5.22 4.01 -1.26 -3.40 117.16 128.63 3dl5 n TYR 314 Ca -0.00 -1.06 -0.13 0.00 -0.16 0.00 0.00 57.90 56.55 3dl5 n TYR 314 Cb 0.42 -0.63 -0.08 0.00 -0.31 0.00 0.00 39.34 38.74 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 2.45 1.05 -0.22 -0.72 3.07 -1.96 -2.88 117.51 118.30 3dl5 h ILE 315 Ca 0.23 -0.48 0.00 0.00 1.55 0.00 0.00 64.86 66.15 3dl5 h ILE 315 Cb 2.15 1.36 0.00 0.00 -0.27 0.00 0.00 36.82 40.07 3dl5 h ILE 315 CO 0.65 0.12 0.00 0.79 -1.05 0.00 0.00 178.15 178.66 3dl5 n TRP 316 N -5.04 0.30 -0.11 0.16 7.02 -1.26 -3.90 117.44 114.61 3dl5 n TRP 316 Ca -0.08 -0.15 -0.11 0.00 -1.02 0.00 0.00 57.50 56.14 3dl5 n TRP 316 Cb 0.16 0.00 0.02 0.00 -2.42 0.00 0.00 31.31 29.07 3dl5 n TRP 316 CO 0.00 0.00 0.00 1.03 -2.02 0.00 0.00 177.69 176.70 3dl5 h SER 317 N 1.36 0.93 0.57 -0.99 0.87 -1.79 -3.05 113.55 111.46 3dl5 h SER 317 Ca 0.00 -0.39 -0.02 0.00 -1.23 0.00 0.00 61.79 60.15 3dl5 h SER 317 Cb 0.31 -0.26 -0.01 0.00 -0.44 0.00 0.00 62.40 62.00 3dl5 h SER 317 CO 0.00 1.17 -0.43 1.23 -0.53 0.00 0.00 176.83 178.26 3dl5 h GLY 318 N 0.87 -1.11 -2.33 5.77 0.00 -1.72 -2.18 103.07 102.35 3dl5 h GLY 318 Ca 0.08 0.49 -0.10 0.00 0.00 0.00 0.00 47.33 47.80 3dl5 h GLY 318 CO 0.08 -0.37 0.12 0.70 0.00 0.00 0.00 176.54 177.07 3dl5 n ASN 319 N -5.54 3.06 0.00 0.19 4.13 -1.24 -3.20 115.26 112.65 3dl5 n ASN 319 Ca -0.12 -2.31 0.00 0.00 1.68 0.00 0.00 54.58 53.82 3dl5 n ASN 319 Cb 0.44 -0.57 0.00 0.00 -1.54 0.00 0.00 39.78 38.11 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 0.16 0.08 3.77 7.41 0.00 -0.84 -4.88 105.19 110.89 3dl5 n GLY 320 Ca 0.12 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.76 3dl5 n GLY 320 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3dl5 s SER 321 N -0.19 6.37 0.59 1.61 1.04 -1.10 -4.17 113.70 117.85 3dl5 s SER 321 Ca 0.00 2.39 0.31 0.00 0.48 0.00 0.00 55.95 59.13 3dl5 s SER 321 Cb 0.00 -2.61 1.85 0.00 0.10 0.00 0.00 66.02 65.35 3dl5 s SER 321 CO 0.00 -0.78 2.24 0.11 0.98 0.00 0.00 173.24 175.79 3dl5 h LYS 322 N 2.47 0.00 0.00 4.02 1.79 -1.92 0.20 116.57 123.12 3dl5 h LYS 322 Ca -0.49 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 57.98 3dl5 h LYS 322 Cb 1.24 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.89 3dl5 h LYS 322 CO 0.62 0.02 0.00 0.93 -1.08 0.00 0.00 179.45 179.94 3dl5 h GLU 323 N 0.00 0.00 0.14 3.15 3.07 -1.96 -2.59 114.58 116.40 3dl5 h GLU 323 Ca -0.00 0.00 -0.30 0.00 -0.50 0.00 0.00 59.36 58.56 3dl5 h GLU 323 Cb 0.05 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.97 3dl5 h GLU 323 CO 0.00 0.00 -1.53 -0.92 -1.40 0.00 0.00 179.01 175.16 3dl5 h TYR 324 N 0.00 0.54 0.00 4.33 3.20 -0.98 -3.11 116.97 120.96 3dl5 h TYR 324 Ca 0.00 -0.40 0.00 0.00 3.14 0.00 0.00 58.73 61.47 3dl5 h TYR 324 Cb 0.77 -0.02 0.00 0.00 1.54 0.00 0.00 36.73 39.02 3dl5 h TYR 324 CO 0.00 1.60 0.00 1.28 -1.64 0.00 0.00 178.16 179.40 3dl5 n LEU 325 N -3.81 0.00 -0.06 2.82 4.32 -0.71 -2.61 117.00 116.96 3dl5 n LEU 325 Ca -0.25 0.36 -0.06 0.00 -0.02 0.00 0.00 56.01 56.05 3dl5 n LEU 325 Cb 0.96 -0.36 -0.04 0.00 -1.62 0.00 0.00 43.42 42.36 3dl5 n LEU 325 CO 0.45 -0.22 -0.04 -0.08 -1.22 0.00 0.00 177.39 176.29 3dl5 h GLU 326 N 0.00 0.00 0.00 3.23 4.57 -1.46 0.82 114.58 121.74 3dl5 h GLU 326 Ca 0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 3dl5 h GLU 326 Cb 0.15 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.74 3dl5 h GLU 326 CO 0.00 0.29 0.02 0.00 -1.18 0.00 0.00 179.01 178.15 3dl5 h ARG 327 N -1.00 0.00 0.00 1.92 3.08 -1.43 -2.44 114.38 114.51 3dl5 h ARG 327 Ca -0.03 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.02 3dl5 h ARG 327 Cb 0.42 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.47 3dl5 h ARG 327 CO -0.02 0.00 -0.13 0.44 -1.07 0.00 0.00 179.97 179.19 3dl5 n ILE 328 N -2.31 0.96 -2.31 2.04 -5.35 -1.21 -5.01 119.36 106.18 3dl5 n ILE 328 Ca -0.02 -1.12 -0.09 0.00 -0.27 0.00 0.00 62.75 61.26 3dl5 n ILE 328 Cb 0.06 0.27 0.00 0.00 -1.74 0.00 0.00 39.64 38.23 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 -0.68 0.07 0.31 3.28 0.00 -0.92 -4.86 105.19 102.39 3dl5 n GLY 329 Ca 0.06 -0.48 0.05 0.00 0.00 0.00 0.00 46.02 45.65 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 -1.45 2.59 -0.11 0.99 4.77 0.12 -4.83 117.00 119.07 3dl5 n LEU 330 Ca -0.08 -2.38 0.00 0.00 -0.03 0.00 0.00 56.01 53.51 3dl5 n LEU 330 Cb 0.57 -0.23 0.00 0.00 -2.33 0.00 0.00 43.42 41.43 3dl5 n LEU 330 CO 0.15 0.63 0.00 0.61 -1.33 0.00 0.00 177.39 177.45 3dl5 n GLY 331 N -0.45 0.00 0.70 -0.72 0.00 0.26 0.40 105.19 105.39 3dl5 n GLY 331 Ca 0.09 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.20 3dl5 n GLY 331 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 3dl5 n HIS 332 N -0.17 0.00 -2.83 1.61 1.44 -1.26 -4.98 115.22 109.03 3dl5 n HIS 332 Ca 0.00 0.00 -0.24 0.00 -2.01 0.00 0.00 57.72 55.47 3dl5 n HIS 332 Cb 0.00 0.00 0.01 0.00 0.12 0.00 0.00 29.99 30.12 3dl5 n HIS 332 CO 0.00 0.00 0.00 1.03 -2.81 0.00 0.00 176.34 174.56 3dl5 s ARG 333 N -1.53 3.12 1.05 -1.40 3.00 0.16 -5.09 118.95 118.26 3dl5 s ARG 333 Ca 0.21 -0.28 -0.15 0.00 0.00 0.00 0.00 55.73 55.51 3dl5 s ARG 333 Cb 0.15 -2.48 0.21 0.00 0.00 0.00 0.00 34.95 32.84 3dl5 s ARG 333 CO 0.24 -0.33 1.12 -2.00 0.00 0.00 0.00 175.30 174.33 3dl5 s GLU 334 N -4.66 0.02 0.14 3.54 2.12 -1.26 -4.95 118.70 113.64 3dl5 s GLU 334 Ca 0.49 0.20 -0.31 0.00 0.36 0.00 0.00 54.97 55.71 3dl5 s GLU 334 Cb -0.10 -1.72 -0.09 0.00 0.26 0.00 0.00 34.13 32.48 3dl5 s GLU 334 CO 0.40 -2.94 1.52 1.49 -0.54 0.00 0.00 175.26 175.20 3dl5 h GLU 335 N -2.03 -0.21 -0.15 4.30 4.57 -1.99 -3.12 114.58 115.95 3dl5 h GLU 335 Ca -0.50 0.01 0.00 0.00 -1.18 0.00 0.00 59.36 57.69 3dl5 h GLU 335 Cb 1.31 0.05 0.00 0.00 -0.16 0.00 0.00 28.75 29.95 3dl5 h GLU 335 CO 0.50 -0.14 0.00 0.09 -1.18 0.00 0.00 179.01 178.28 3dl5 n ASN 336 N -5.22 3.12 -4.55 1.04 3.02 -1.26 -4.27 115.26 107.15 3dl5 n ASN 336 Ca -0.01 -2.95 -0.35 0.00 -0.03 0.00 0.00 54.58 51.23 3dl5 n ASN 336 Cb 0.29 -0.46 -0.03 0.00 -0.61 0.00 0.00 39.78 38.97 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 -2.23 4.94 0.00 6.41 3.68 -1.18 -2.87 116.67 125.42 3dl5 s ASP 337 Ca 0.35 0.45 0.31 0.00 2.13 0.00 0.00 52.55 55.79 3dl5 s ASP 337 Cb 0.29 -2.52 1.64 0.00 -1.45 0.00 0.00 42.92 40.88 3dl5 s ASP 337 CO 0.06 -2.64 2.10 0.18 0.13 0.00 0.00 175.17 175.01 3dl5 n LEU 338 N 14.10 0.08 0.00 -1.34 4.77 -1.21 -4.75 117.00 128.65 3dl5 n LEU 338 Ca 0.28 0.13 0.00 0.00 -0.03 0.00 0.00 56.01 56.39 3dl5 n LEU 338 Cb 0.52 -0.15 0.00 0.00 -2.33 0.00 0.00 43.42 41.46 3dl5 n LEU 338 CO 0.69 0.01 0.00 0.61 -1.33 0.00 0.00 177.39 177.38 3dl5 n GLY 339 N 1.17 -0.73 2.80 -0.72 0.00 -1.26 -1.11 105.19 105.34 3dl5 n GLY 339 Ca 0.18 -1.72 -0.30 0.00 0.00 0.00 0.00 46.02 44.18 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 -0.72 1.85 0.00 1.61 -0.04 -1.26 -4.83 135.00 131.62 3dl5 n PRO 340 Ca 0.00 -1.62 0.00 0.00 -0.04 0.00 0.00 63.50 61.84 3dl5 n PRO 340 Cb 0.00 -2.64 0.00 0.00 -0.04 0.00 0.00 33.50 30.82 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 4.92 0.00 -0.28 0.52 -5.35 -1.26 -4.38 119.36 113.52 3dl5 n ILE 341 Ca 0.46 0.00 -0.04 0.00 -0.27 0.00 0.00 62.75 62.90 3dl5 n ILE 341 Cb 0.24 -1.89 -0.02 0.00 -1.74 0.00 0.00 39.64 36.23 3dl5 n ILE 341 CO 0.00 0.00 0.00 -1.22 -1.76 0.00 0.00 176.55 173.57 3dl5 n TYR 342 N 0.00 -0.13 -0.01 4.28 4.01 -1.26 -1.15 117.16 122.90 3dl5 n TYR 342 Ca 0.00 0.88 -0.10 0.00 -0.16 0.00 0.00 57.90 58.52 3dl5 n TYR 342 Cb 0.00 -0.67 -0.05 0.00 -0.31 0.00 0.00 39.34 38.32 3dl5 n TYR 342 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 3dl5 h GLY 343 N 0.00 0.10 0.77 2.72 0.00 -1.79 -1.04 103.07 103.83 3dl5 h GLY 343 Ca 0.18 0.02 0.02 0.00 0.00 0.00 0.00 47.33 47.56 3dl5 h GLY 343 CO -0.68 -0.03 -0.02 -2.75 0.00 0.00 0.00 176.54 173.06 3dl5 h PHE 344 N 0.02 -0.04 -0.05 5.60 3.04 -1.20 -2.01 116.94 122.30 3dl5 h PHE 344 Ca 0.05 0.01 -0.02 0.00 3.98 0.00 0.00 57.97 61.99 3dl5 h PHE 344 Cb 0.07 0.04 -0.01 0.00 2.56 0.00 0.00 35.95 38.61 3dl5 h PHE 344 CO -0.15 -0.04 -0.08 1.96 -2.02 0.00 0.00 178.31 177.99 3dl5 h GLN 345 N 0.02 0.08 -0.15 1.11 1.08 -1.13 0.55 115.11 116.68 3dl5 h GLN 345 Ca 0.06 -0.01 -0.04 0.00 -1.45 0.00 0.00 58.65 57.21 3dl5 h GLN 345 Cb 0.08 -0.01 -0.00 0.00 -0.05 0.00 0.00 27.48 27.50 3dl5 h GLN 345 CO -0.12 0.17 -0.08 -1.49 -0.95 0.00 0.00 178.83 176.36 3dl5 h TRP 346 N 0.08 0.36 0.05 2.96 4.06 -0.50 -3.30 115.95 119.66 3dl5 h TRP 346 Ca 0.02 -0.09 -0.30 0.00 2.06 0.00 0.00 58.89 60.57 3dl5 h TRP 346 Cb 0.20 -0.08 -0.03 0.00 -1.00 0.00 0.00 29.16 28.24 3dl5 h TRP 346 CO 0.00 0.65 -1.67 0.54 -3.56 0.00 0.00 178.44 174.40 3dl5 n ARG 347 N -4.63 0.65 -3.88 0.49 5.12 -0.85 -1.98 116.66 111.58 3dl5 n ARG 347 Ca -0.06 0.42 -0.30 0.00 -1.93 0.00 0.00 57.85 55.98 3dl5 n ARG 347 Cb 0.31 -1.71 -0.14 0.00 -1.16 0.00 0.00 32.46 29.75 3dl5 n ARG 347 CO 0.00 0.00 0.00 -1.01 -1.93 0.00 0.00 177.63 174.69 3dl5 s HIS 348 N -2.45 2.82 -0.01 -1.55 3.76 0.19 -1.57 115.29 116.47 3dl5 s HIS 348 Ca -0.27 -2.77 -0.25 0.00 -0.15 0.00 0.00 55.06 51.62 3dl5 s HIS 348 Cb 0.07 -2.46 -0.04 0.00 1.11 0.00 0.00 32.58 31.25 3dl5 s HIS 348 CO 0.66 -0.82 0.76 -0.47 -0.85 0.00 0.00 174.74 174.02 3dl5 s TYR 349 N 0.38 3.65 -1.26 1.40 5.04 0.13 -3.50 117.35 123.18 3dl5 s TYR 349 Ca 0.15 1.39 0.00 0.00 -2.44 0.00 0.00 57.07 56.17 3dl5 s TYR 349 Cb -0.23 -2.85 0.00 0.00 0.35 0.00 0.00 41.96 39.23 3dl5 s TYR 349 CO -0.05 0.15 0.00 0.09 -1.34 0.00 0.00 175.55 174.40 3dl5 n ASN 350 N 3.41 -4.40 -4.80 4.32 5.03 -1.26 -1.75 115.26 115.80 3dl5 n ASN 350 Ca -0.01 0.06 -0.34 0.00 0.87 0.00 0.00 54.58 55.16 3dl5 n ASN 350 Cb 0.51 -3.48 -0.04 0.00 -1.02 0.00 0.00 39.78 35.74 3dl5 n ASN 350 CO 0.00 0.00 0.00 -0.83 -1.83 0.00 0.00 177.26 174.60 3dl5 s GLY 351 N -2.46 2.48 -0.98 7.41 0.00 -1.23 -4.85 107.32 107.69 3dl5 s GLY 351 Ca 0.00 0.56 -0.24 0.00 0.00 0.00 0.00 44.72 45.04 3dl5 s GLY 351 CO 0.00 0.87 1.61 1.85 0.00 0.00 0.00 173.10 177.43 3dl5 s GLU 352 N -3.23 3.25 0.01 2.90 2.56 -1.26 -4.92 118.70 118.01 3dl5 s GLU 352 Ca 0.66 -0.85 -0.30 0.00 0.00 0.00 0.00 54.97 54.48 3dl5 s GLU 352 Cb -0.15 -5.26 -0.05 0.00 2.00 0.00 0.00 34.13 30.67 3dl5 s GLU 352 CO 0.18 -2.59 1.36 -0.47 -0.56 0.00 0.00 175.26 173.18 3dl5 s TYR 353 N 6.64 2.98 0.00 5.30 5.04 -1.26 -4.95 117.35 131.09 3dl5 s TYR 353 Ca 0.54 0.92 0.00 0.00 -2.44 0.00 0.00 57.07 56.09 3dl5 s TYR 353 Cb -0.02 -3.62 0.00 0.00 0.35 0.00 0.00 41.96 38.67 3dl5 s TYR 353 CO -0.07 -2.21 0.00 1.63 -1.34 0.00 0.00 175.55 173.56 3dl5 n LYS 354 N 5.10 0.00 -4.02 4.97 4.76 -1.26 -5.10 118.16 122.60 3dl5 n LYS 354 Ca 0.12 0.00 -0.13 0.00 -2.87 0.00 0.00 58.31 55.43 3dl5 n LYS 354 Cb 0.44 -0.01 -0.03 0.00 -1.84 0.00 0.00 35.03 33.59 3dl5 n LYS 354 CO 0.00 0.00 0.00 0.95 -1.37 0.00 0.00 177.40 176.98 3dl5 s THR 355 N 0.00 0.00 -0.82 -0.18 -4.23 -1.26 -5.04 115.64 104.11 3dl5 s THR 355 Ca 0.00 -1.46 0.16 0.00 -1.18 0.00 0.00 61.69 59.22 3dl5 s THR 355 Cb 0.00 -2.64 0.15 0.00 1.34 0.00 0.00 72.50 71.35 3dl5 s THR 355 CO 0.00 0.00 1.51 1.15 -0.54 0.00 0.00 174.62 176.74 3dl5 n MET 356 N -0.54 0.06 0.00 3.99 0.00 -1.26 -2.85 117.12 116.53 3dl5 n MET 356 Ca -0.01 0.33 0.11 0.00 0.00 0.00 0.00 57.70 58.13 3dl5 n MET 356 Cb 0.61 -1.63 0.08 0.00 0.00 0.00 0.00 33.22 32.28 3dl5 n MET 356 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 175.97 176.69 3dl5 n HIS 357 N -1.75 0.00 -2.31 3.17 8.25 -1.26 -4.75 115.22 116.57 3dl5 n HIS 357 Ca 0.03 0.00 -0.27 0.00 -0.26 0.00 0.00 57.72 57.21 3dl5 n HIS 357 Cb 0.17 0.00 0.03 0.00 1.12 0.00 0.00 29.99 31.31 3dl5 n HIS 357 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 3dl5 s ASP 358 N -1.90 5.67 -0.17 0.41 1.11 -1.13 -5.06 116.67 115.60 3dl5 s ASP 358 Ca 0.25 0.84 -0.07 0.00 0.18 0.00 0.00 52.55 53.75 3dl5 s ASP 358 Cb 0.18 -1.84 -0.04 0.00 1.07 0.00 0.00 42.92 42.29 3dl5 s ASP 358 CO 0.31 -1.05 0.07 -0.62 1.18 0.00 0.00 175.17 175.06 3dl5 s ASP 359 N -4.29 5.70 0.00 0.27 2.15 -1.26 -4.97 116.67 114.27 3dl5 s ASP 359 Ca 0.54 0.13 0.06 0.00 0.43 0.00 0.00 52.55 53.70 3dl5 s ASP 359 Cb -0.11 -1.95 0.12 0.00 -0.30 0.00 0.00 42.92 40.69 3dl5 s ASP 359 CO 0.47 0.21 0.98 -1.22 -0.17 0.00 0.00 175.17 175.43 3dl5 n TYR 360 N 3.30 0.16 -1.60 -5.34 4.01 -1.26 -5.02 117.16 111.40 3dl5 n TYR 360 Ca -0.17 -0.33 -0.55 0.00 -0.16 0.00 0.00 57.90 56.69 3dl5 n TYR 360 Cb 0.52 -0.03 -0.07 0.00 -0.31 0.00 0.00 39.34 39.46 3dl5 n TYR 360 CO 0.00 0.00 0.00 -2.37 -0.46 0.00 0.00 176.86 174.03 3dl5 n THR 361 N 0.12 0.06 -2.17 -0.72 5.66 -1.26 0.84 114.28 116.81 3dl5 n THR 361 Ca 0.05 -0.01 -0.16 0.00 -3.05 0.00 0.00 64.05 60.88 3dl5 n THR 361 Cb 0.27 -0.71 -0.02 0.00 -1.55 0.00 0.00 70.33 68.33 3dl5 n THR 361 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 3dl5 n GLY 362 N 2.72 0.03 3.17 1.09 0.00 -1.26 -5.01 105.19 105.93 3dl5 n GLY 362 Ca 0.21 -0.20 -0.29 0.00 0.00 0.00 0.00 46.02 45.74 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 -2.79 1.75 0.00 1.61 0.11 0.25 -5.03 120.40 116.30 3dl5 s VAL 363 Ca 0.00 -0.86 0.00 0.00 -2.93 0.00 0.00 61.98 58.19 3dl5 s VAL 363 Cb 0.00 -1.52 0.00 0.00 -1.53 0.00 0.00 36.38 33.33 3dl5 s VAL 363 CO 0.00 0.49 0.00 0.61 -3.33 0.00 0.00 175.10 172.87 3dl5 n GLY 364 N 3.42 0.39 2.93 6.54 0.00 -1.26 -4.50 105.19 112.72 3dl5 n GLY 364 Ca -0.19 -1.56 -0.26 0.00 0.00 0.00 0.00 46.02 44.00 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 0.00 1.05 -0.54 1.61 1.01 -0.72 -4.77 120.40 118.05 3dl5 s VAL 365 Ca 0.00 -0.33 -0.19 0.00 0.00 0.00 0.00 61.98 61.46 3dl5 s VAL 365 Cb 0.00 -1.05 0.08 0.00 0.00 0.00 0.00 36.38 35.41 3dl5 s VAL 365 CO 0.00 0.37 0.66 -0.62 0.00 0.00 0.00 175.10 175.50 3dl5 s ASP 366 N 1.50 6.21 -0.04 3.32 3.68 -0.61 0.18 116.67 130.91 3dl5 s ASP 366 Ca 0.01 -1.12 -0.24 0.00 2.13 0.00 0.00 52.55 53.33 3dl5 s ASP 366 Cb -0.13 -2.30 -0.23 0.00 -1.45 0.00 0.00 42.92 38.81 3dl5 s ASP 366 CO -0.06 -0.99 1.06 1.56 0.13 0.00 0.00 175.17 176.87 3dl5 h GLN 367 N 9.08 0.20 -1.00 4.34 4.20 -1.57 -2.88 115.11 127.48 3dl5 h GLN 367 Ca -0.28 -0.20 0.16 0.00 0.06 0.00 0.00 58.65 58.39 3dl5 h GLN 367 Cb 1.09 0.05 -0.10 0.00 0.30 0.00 0.00 27.48 28.83 3dl5 h GLN 367 CO 1.02 0.92 0.62 1.25 -0.67 0.00 0.00 178.83 181.97 3dl5 h LEU 368 N -0.44 0.82 0.56 1.46 5.85 -1.89 0.91 115.31 122.59 3dl5 h LEU 368 Ca -0.03 0.08 -0.03 0.00 0.84 0.00 0.00 57.88 58.74 3dl5 h LEU 368 Cb 1.00 -0.08 0.01 0.00 0.37 0.00 0.00 40.66 41.96 3dl5 h LEU 368 CO 0.05 0.35 -0.27 0.00 -0.34 0.00 0.00 178.44 178.24 3dl5 h ALA 369 N 1.60 -0.76 -0.76 1.25 0.00 -1.86 -1.72 119.26 117.01 3dl5 h ALA 369 Ca 0.54 -0.20 0.07 0.00 0.00 0.00 0.00 54.91 55.33 3dl5 h ALA 369 Cb 0.76 0.29 -0.05 0.00 0.00 0.00 0.00 17.79 18.79 3dl5 h ALA 369 CO -0.33 -0.80 0.50 -0.22 0.00 0.00 0.00 179.25 178.41 3dl5 h LYS 370 N -1.02 0.76 0.11 0.00 3.11 -1.12 -2.42 116.57 116.00 3dl5 h LYS 370 Ca -0.08 -0.05 -0.01 0.00 -2.81 0.00 0.00 60.65 57.71 3dl5 h LYS 370 Cb 0.65 -0.17 0.00 0.00 -1.00 0.00 0.00 32.23 31.71 3dl5 h LYS 370 CO 0.13 0.50 -0.05 1.25 -2.81 0.00 0.00 179.45 178.47 3dl5 h LEU 371 N 0.78 -0.12 -0.04 5.20 7.12 0.91 -0.90 115.31 128.26 3dl5 h LEU 371 Ca 0.33 -0.08 0.03 0.00 0.13 0.00 0.00 57.88 58.29 3dl5 h LEU 371 Cb 0.29 0.03 -0.04 0.00 -0.53 0.00 0.00 40.66 40.42 3dl5 h LEU 371 CO -0.12 0.01 -0.15 0.40 -0.13 0.00 0.00 178.44 178.45 3dl5 h ILE 372 N -0.24 0.61 0.00 4.05 2.04 -0.83 0.11 117.51 123.25 3dl5 h ILE 372 Ca -0.01 0.00 -0.06 0.00 1.00 0.00 0.00 64.86 65.78 3dl5 h ILE 372 Cb 0.20 0.61 -0.01 0.00 -0.74 0.00 0.00 36.82 36.88 3dl5 h ILE 372 CO 0.02 0.00 -0.30 1.05 0.00 0.00 0.00 178.15 178.93 3dl5 h GLU 373 N -0.24 0.00 -0.07 2.37 4.11 -1.46 -2.44 114.58 116.85 3dl5 h GLU 373 Ca 0.06 0.00 -0.19 0.00 0.07 0.00 0.00 59.36 59.30 3dl5 h GLU 373 Cb 0.32 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.57 3dl5 h GLU 373 CO -0.18 0.30 -0.76 1.15 0.07 0.00 0.00 179.01 179.59 3dl5 h THR 374 N 0.00 1.39 -0.10 -1.06 2.02 -0.49 -0.09 112.91 114.58 3dl5 h THR 374 Ca -0.00 -2.19 -0.05 0.00 0.77 0.00 0.00 66.41 64.94 3dl5 h THR 374 Cb 0.62 2.16 -0.01 0.00 -1.74 0.00 0.00 68.15 69.18 3dl5 h THR 374 CO 0.04 0.66 -0.15 -0.07 0.37 0.00 0.00 175.52 176.37 3dl5 h LEU 375 N 0.26 0.15 0.07 2.58 3.38 -0.34 -2.11 115.31 119.29 3dl5 h LEU 375 Ca -0.04 -0.03 -0.36 0.00 0.09 0.00 0.00 57.88 57.55 3dl5 h LEU 375 Cb 1.34 -0.04 -0.04 0.00 0.09 0.00 0.00 40.66 42.02 3dl5 h LEU 375 CO 0.13 0.32 -2.04 2.29 0.09 0.00 0.00 178.44 179.23 3dl5 n LYS 376 N -4.28 0.69 0.02 1.13 2.85 -1.07 -3.78 118.16 113.72 3dl5 n LYS 376 Ca -0.01 0.29 -0.13 0.00 -1.05 0.00 0.00 58.31 57.41 3dl5 n LYS 376 Cb 0.26 -1.65 -0.09 0.00 -0.65 0.00 0.00 35.03 32.90 3dl5 n LYS 376 CO 0.00 0.00 0.00 -0.91 -0.05 0.00 0.00 177.40 176.44 3dl5 h ASN 377 N -0.21 -0.07 -3.52 -5.58 4.21 -1.05 -3.39 115.58 105.96 3dl5 h ASN 377 Ca -0.47 -0.44 -0.62 0.00 1.21 0.00 0.00 56.30 55.98 3dl5 h ASN 377 Cb 1.85 0.02 -0.40 0.00 -1.12 0.00 0.00 38.32 38.67 3dl5 h ASN 377 CO -0.05 0.42 -0.73 0.21 -1.29 0.00 0.00 177.43 176.00 3dl5 s ASN 378 N -5.59 4.18 0.01 5.81 3.04 -0.80 -5.02 114.94 116.56 3dl5 s ASN 378 Ca -0.15 -2.17 -0.20 0.00 0.04 0.00 0.00 52.86 50.38 3dl5 s ASN 378 Cb 0.01 -1.20 -0.22 0.00 -1.54 0.00 0.00 41.25 38.30 3dl5 s ASN 378 CO 0.63 -0.35 1.13 1.55 -3.04 0.00 0.00 177.10 177.01 3dl5 h PRO 379 N 7.46 0.40 0.00 0.43 0.13 -1.66 -3.28 132.00 135.48 3dl5 h PRO 379 Ca -0.07 -0.39 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 3dl5 h PRO 379 Cb 0.98 0.10 0.00 0.00 0.13 0.00 0.00 31.00 32.21 3dl5 h PRO 379 CO 0.51 1.05 0.00 1.63 -0.23 0.00 0.00 178.00 180.96 3dl5 n LYS 380 N -4.27 0.27 -1.68 0.86 5.02 -1.26 -4.29 118.16 112.80 3dl5 n LYS 380 Ca -0.10 0.11 -0.44 0.00 -2.02 0.00 0.00 58.31 55.87 3dl5 n LYS 380 Cb 0.62 -1.50 -0.02 0.00 -0.02 0.00 0.00 35.03 34.11 3dl5 n LYS 380 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 3dl5 n ASP 381 N -1.25 2.84 -1.14 4.39 2.03 -1.24 -4.87 116.55 117.31 3dl5 n ASP 381 Ca 0.08 1.16 0.04 0.00 0.52 0.00 0.00 54.79 56.60 3dl5 n ASP 381 Cb 0.12 -1.46 0.21 0.00 -0.72 0.00 0.00 41.12 39.28 3dl5 n ASP 381 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 3dl5 n ARG 382 N 1.64 2.86 -0.37 -0.67 1.74 -1.26 -4.28 116.66 116.32 3dl5 n ARG 382 Ca 0.09 -1.67 0.08 0.00 -0.77 0.00 0.00 57.85 55.59 3dl5 n ARG 382 Cb 0.33 -1.78 0.23 0.00 -1.02 0.00 0.00 32.46 30.22 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 0.43 2.78 -1.78 5.56 3.00 -1.26 -4.91 116.66 120.48 3dl5 n ARG 383 Ca 0.15 -2.70 -0.29 0.00 -0.01 0.00 0.00 57.85 55.00 3dl5 n ARG 383 Cb 0.67 -1.73 -0.07 0.00 0.00 0.00 0.00 32.46 31.33 3dl5 n ARG 383 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.63 178.35 3dl5 n HIS 384 N -0.46 2.21 -4.34 -1.55 8.25 -1.26 -4.88 115.22 113.18 3dl5 n HIS 384 Ca 0.19 -1.28 -0.31 0.00 -0.26 0.00 0.00 57.72 56.07 3dl5 n HIS 384 Cb 0.80 -2.40 -0.10 0.00 1.12 0.00 0.00 29.99 29.41 3dl5 n HIS 384 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 3dl5 s ILE 385 N 10.93 3.52 -0.27 1.59 -1.09 -1.26 -0.26 121.20 134.35 3dl5 s ILE 385 Ca 0.69 -1.03 -0.03 0.00 -2.23 0.00 0.00 60.65 58.05 3dl5 s ILE 385 Cb 0.02 -2.59 0.09 0.00 -1.58 0.00 0.00 42.46 38.40 3dl5 s ILE 385 CO 0.15 0.24 0.11 -0.22 -1.23 0.00 0.00 174.94 173.99 3dl5 s LEU 386 N -1.84 0.97 0.08 2.97 2.96 0.61 -4.92 118.68 119.51 3dl5 s LEU 386 Ca 0.20 -1.22 0.06 0.00 -0.22 0.00 0.00 54.13 52.95 3dl5 s LEU 386 Cb -0.11 -0.48 -0.04 0.00 0.50 0.00 0.00 46.19 46.06 3dl5 s LEU 386 CO 0.11 -0.41 -0.09 0.28 -1.32 0.00 0.00 176.35 174.92 3dl5 s THR 387 N 1.97 3.43 0.00 3.68 -1.32 -1.26 0.05 115.64 122.19 3dl5 s THR 387 Ca 0.07 -1.15 0.00 0.00 -1.21 0.00 0.00 61.69 59.40 3dl5 s THR 387 Cb -0.16 -2.58 0.00 0.00 -1.51 0.00 0.00 72.50 68.25 3dl5 s THR 387 CO -0.27 0.18 0.05 0.00 -2.21 0.00 0.00 174.62 172.37 3dl5 n ALA 388 N 0.90 1.96 -2.60 11.08 0.00 0.16 -4.74 120.51 127.27 3dl5 n ALA 388 Ca -0.14 -0.05 -0.43 0.00 0.00 0.00 0.00 53.44 52.82 3dl5 n ALA 388 Cb 0.52 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.94 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 -0.85 2.79 -0.38 0.00 -0.11 -1.25 -4.81 118.94 114.32 3dl5 s TRP 389 Ca 0.00 0.35 0.02 0.00 1.22 0.00 0.00 56.10 57.69 3dl5 s TRP 389 Cb 0.00 -4.23 0.11 0.00 -1.50 0.00 0.00 33.47 27.85 3dl5 s TRP 389 CO 0.00 -1.32 0.12 1.21 -4.62 0.00 0.00 176.95 172.34 3dl5 s ASN 390 N 2.62 4.87 0.52 5.86 3.84 -1.26 -4.97 114.94 126.42 3dl5 s ASN 390 Ca 0.39 -2.22 0.22 0.00 0.21 0.00 0.00 52.86 51.46 3dl5 s ASN 390 Cb -0.09 -1.69 1.33 0.00 -0.55 0.00 0.00 41.25 40.25 3dl5 s ASN 390 CO 0.25 -0.41 2.02 -0.65 -2.79 0.00 0.00 177.10 175.53 3dl5 h PRO 391 N 7.61 0.04 -0.30 0.43 0.11 -2.01 -1.04 132.00 136.85 3dl5 h PRO 391 Ca -0.07 -0.00 -0.16 0.00 0.11 0.00 0.00 66.00 65.88 3dl5 h PRO 391 Cb 1.01 -0.01 -0.00 0.00 0.11 0.00 0.00 31.00 32.11 3dl5 h PRO 391 CO 0.59 0.03 -0.46 0.77 -0.21 0.00 0.00 178.00 178.72 3dl5 h SER 392 N 0.04 0.92 0.71 -2.05 0.02 -2.02 -3.32 113.55 107.86 3dl5 h SER 392 Ca 0.21 -0.51 0.00 0.00 -0.84 0.00 0.00 61.79 60.64 3dl5 h SER 392 Cb 0.77 -0.26 0.00 0.00 0.14 0.00 0.00 62.40 63.05 3dl5 h SER 392 CO -0.01 1.25 -0.69 0.00 -1.14 0.00 0.00 176.83 176.24 3dl5 n ALA 393 N -2.55 3.12 -0.40 3.77 0.00 -0.70 -4.55 120.51 119.20 3dl5 n ALA 393 Ca -0.04 -0.30 -0.07 0.00 0.00 0.00 0.00 53.44 53.03 3dl5 n ALA 393 Cb 0.58 -1.12 -0.05 0.00 0.00 0.00 0.00 19.45 18.86 3dl5 n ALA 393 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3dl5 n LEU 394 N -1.98 -0.90 -0.29 0.00 7.99 -0.48 -0.81 117.00 120.54 3dl5 n LEU 394 Ca 0.03 1.73 0.32 0.00 -0.01 0.00 0.00 56.01 58.08 3dl5 n LEU 394 Cb 0.42 -0.28 0.71 0.00 -0.11 0.00 0.00 43.42 44.15 3dl5 n LEU 394 CO 0.37 -1.46 1.29 0.77 -1.51 0.00 0.00 177.39 176.85 3dl5 h SER 395 N 0.00 0.07 0.88 -1.43 4.64 -1.84 0.10 113.55 115.98 3dl5 h SER 395 Ca 0.22 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.55 3dl5 h SER 395 Cb 0.47 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.56 3dl5 h SER 395 CO -0.94 0.01 -0.19 0.00 -0.87 0.00 0.00 176.83 174.84 3dl5 n GLN 396 N -4.27 0.04 -2.09 4.77 6.02 0.01 -4.91 117.38 116.95 3dl5 n GLN 396 Ca 0.24 0.02 -0.31 0.00 -0.01 0.00 0.00 57.00 56.94 3dl5 n GLN 396 Cb 1.12 -1.54 0.00 0.00 1.02 0.00 0.00 30.24 30.84 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 -3.02 3.65 0.18 -1.09 -1.94 0.35 -4.26 119.30 113.17 3dl5 s MET 397 Ca 0.12 0.69 0.13 0.00 -1.71 0.00 0.00 55.69 54.92 3dl5 s MET 397 Cb 0.18 -2.14 -0.07 0.00 2.01 0.00 0.00 34.83 34.81 3dl5 s MET 397 CO 0.60 -0.45 1.27 0.00 -0.01 0.00 0.00 175.02 176.42 3dl5 h ALA 398 N -0.00 0.57 -2.04 3.03 0.00 -1.42 -3.46 119.26 115.95 3dl5 h ALA 398 Ca -0.45 -0.71 -0.03 0.00 0.00 0.00 0.00 54.91 53.72 3dl5 h ALA 398 Cb 1.19 -0.03 -0.21 0.00 0.00 0.00 0.00 17.79 18.74 3dl5 h ALA 398 CO 0.62 0.92 0.09 -1.17 0.00 0.00 0.00 179.25 179.71 3dl5 s LEU 399 N -6.43 -0.73 0.71 0.00 2.96 -1.26 -5.04 118.68 108.89 3dl5 s LEU 399 Ca 0.02 1.43 -0.14 0.00 -0.22 0.00 0.00 54.13 55.22 3dl5 s LEU 399 Cb 0.08 2.40 0.03 0.00 0.50 0.00 0.00 46.19 49.21 3dl5 s LEU 399 CO 0.78 -0.24 1.13 -2.84 -1.32 0.00 0.00 176.35 173.86 3dl5 s PRO 400 N 0.60 2.43 0.11 0.98 0.02 -1.26 -4.94 135.00 132.93 3dl5 s PRO 400 Ca -0.02 1.44 -0.31 0.00 0.02 0.00 0.00 61.00 62.13 3dl5 s PRO 400 Cb -0.05 -1.90 -0.09 0.00 0.02 0.00 0.00 34.50 32.48 3dl5 s PRO 400 CO -0.03 -1.55 1.70 -2.14 -0.33 0.00 0.00 177.00 174.66 3dl5 s PRO 401 N -4.24 4.17 -0.16 5.54 0.02 -1.26 -4.93 135.00 134.14 3dl5 s PRO 401 Ca 0.67 2.44 -0.12 0.00 0.02 0.00 0.00 61.00 64.01 3dl5 s PRO 401 Cb -0.22 -3.49 -0.07 0.00 0.02 0.00 0.00 34.50 30.74 3dl5 s PRO 401 CO 0.46 -0.75 -0.09 0.00 -0.33 0.00 0.00 177.00 176.29 3dl5 s HIS 403 N -2.28 2.51 -0.14 0.00 0.00 -1.26 -1.14 115.29 112.98 3dl5 s HIS 403 Ca -0.19 -0.67 -0.20 0.00 -3.00 0.00 0.00 55.06 51.00 3dl5 s HIS 403 Cb 0.03 -4.64 -0.25 0.00 -4.00 0.00 0.00 32.58 23.72 3dl5 s HIS 403 CO 0.32 -1.94 0.50 0.28 -1.00 0.00 0.00 174.74 172.89 3dl5 h VAL 404 N 6.53 1.14 -3.74 -5.38 2.07 -1.70 -3.45 116.25 111.71 3dl5 h VAL 404 Ca 0.07 -2.33 -0.24 0.00 0.82 0.00 0.00 66.70 65.02 3dl5 h VAL 404 Cb 1.02 2.69 -0.28 0.00 -1.52 0.00 0.00 31.29 33.20 3dl5 h VAL 404 CO 1.37 0.57 -0.72 -0.22 0.02 0.00 0.00 177.57 178.58 3dl5 s LEU 405 N -7.76 1.98 0.12 2.57 0.20 -1.19 -0.67 118.68 113.94 3dl5 s LEU 405 Ca -0.22 -0.01 0.09 0.00 0.69 0.00 0.00 54.13 54.68 3dl5 s LEU 405 Cb 0.03 -0.03 -0.04 0.00 -0.43 0.00 0.00 46.19 45.73 3dl5 s LEU 405 CO 0.70 0.00 -0.23 -0.44 -0.29 0.00 0.00 176.35 176.10 3dl5 s SER 406 N 0.01 2.81 -0.00 3.68 0.01 0.11 -1.76 113.70 118.55 3dl5 s SER 406 Ca 0.00 -0.73 0.02 0.00 1.31 0.00 0.00 55.95 56.55 3dl5 s SER 406 Cb -0.01 -0.17 -0.00 0.00 0.21 0.00 0.00 66.02 66.05 3dl5 s SER 406 CO -0.00 0.09 -0.06 -1.58 0.41 0.00 0.00 173.24 172.10 3dl5 s GLN 407 N -2.05 0.49 0.10 12.44 0.74 0.14 -0.28 119.66 131.24 3dl5 s GLN 407 Ca 0.10 -0.22 0.07 0.00 0.05 0.00 0.00 55.36 55.36 3dl5 s GLN 407 Cb -0.10 -0.48 -0.03 0.00 1.10 0.00 0.00 33.01 33.50 3dl5 s GLN 407 CO 0.05 0.13 -0.17 0.71 -0.55 0.00 0.00 175.29 175.46 3dl5 s TYR 408 N -0.14 1.50 -0.29 1.67 2.02 0.63 -1.08 117.35 121.66 3dl5 s TYR 408 Ca 0.02 -0.46 -0.12 0.00 -0.37 0.00 0.00 57.07 56.14 3dl5 s TYR 408 Cb -0.02 -0.82 0.11 0.00 -0.40 0.00 0.00 41.96 40.83 3dl5 s TYR 408 CO -0.00 0.14 0.67 -0.47 -1.57 0.00 0.00 175.55 174.33 3dl5 s TYR 409 N -1.43 -1.23 -0.27 2.71 5.04 -1.10 -4.23 117.35 116.84 3dl5 s TYR 409 Ca 0.04 2.24 -0.09 0.00 -2.44 0.00 0.00 57.07 56.82 3dl5 s TYR 409 Cb -0.09 0.74 -0.03 0.00 0.35 0.00 0.00 41.96 42.93 3dl5 s TYR 409 CO 0.03 -0.61 0.12 0.08 -1.34 0.00 0.00 175.55 173.83 3dl5 s VAL 410 N 2.43 4.60 0.97 3.14 1.01 -1.26 -0.99 120.40 130.30 3dl5 s VAL 410 Ca -0.07 -0.17 -0.12 0.00 0.00 0.00 0.00 61.98 61.62 3dl5 s VAL 410 Cb -0.09 -3.21 0.17 0.00 0.00 0.00 0.00 36.38 33.24 3dl5 s VAL 410 CO -0.19 0.25 1.08 0.42 0.00 0.00 0.00 175.10 176.66 3dl5 s THR 411 N 1.65 2.38 -0.70 3.92 -4.23 0.77 -4.79 115.64 114.62 3dl5 s THR 411 Ca 0.06 0.12 0.22 0.00 -1.18 0.00 0.00 61.69 60.92 3dl5 s THR 411 Cb -0.16 -2.48 0.22 0.00 1.34 0.00 0.00 72.50 71.43 3dl5 s THR 411 CO 0.06 -0.16 1.68 0.59 -0.54 0.00 0.00 174.62 176.25 3dl5 n ASN 412 N -4.17 0.47 -1.58 3.99 4.13 -1.26 -2.56 115.26 114.28 3dl5 n ASN 412 Ca 0.06 0.59 -0.06 0.00 1.68 0.00 0.00 54.58 56.85 3dl5 n ASN 412 Cb 0.55 -0.70 0.24 0.00 -1.54 0.00 0.00 39.78 38.33 3dl5 n ASN 412 CO 0.00 0.00 0.00 -0.90 0.28 0.00 0.00 177.26 176.64 3dl5 n ASP 413 N -1.99 3.72 -2.94 6.41 5.75 -1.26 -4.96 116.55 121.28 3dl5 n ASP 413 Ca 0.04 -3.43 -0.14 0.00 -0.01 0.00 0.00 54.79 51.24 3dl5 n ASP 413 Cb 0.26 -0.69 0.07 0.00 -1.03 0.00 0.00 41.12 39.73 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 -0.72 -2.43 -4.31 -1.12 3.02 -1.06 -4.93 115.26 103.72 3dl5 n ASN 414 Ca 0.39 -0.49 -0.29 0.00 -0.03 0.00 0.00 54.58 54.16 3dl5 n ASN 414 Cb 1.24 -4.17 -0.15 0.00 -0.61 0.00 0.00 39.78 36.09 3dl5 n ASN 414 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3dl5 s LEU 416 N -1.01 4.12 0.34 0.00 2.96 0.36 -0.16 118.68 125.28 3dl5 s LEU 416 Ca 0.10 -0.59 0.07 0.00 -0.22 0.00 0.00 54.13 53.49 3dl5 s LEU 416 Cb -0.10 -1.98 -0.01 0.00 0.50 0.00 0.00 46.19 44.60 3dl5 s LEU 416 CO 0.01 -0.21 0.43 -0.44 -1.32 0.00 0.00 176.35 174.82 3dl5 s SER 417 N 1.59 5.79 -0.01 3.68 0.01 -0.16 -1.43 113.70 123.18 3dl5 s SER 417 Ca 0.04 -0.27 -0.01 0.00 1.31 0.00 0.00 55.95 57.02 3dl5 s SER 417 Cb -0.17 -1.15 0.01 0.00 0.21 0.00 0.00 66.02 64.91 3dl5 s SER 417 CO 0.06 -0.42 0.02 0.00 0.41 0.00 0.00 173.24 173.31 3dl5 s ASN 419 N 0.14 2.70 -0.09 0.00 0.01 -0.24 -1.43 114.94 116.04 3dl5 s ASN 419 Ca -0.01 -0.48 0.00 0.00 -0.71 0.00 0.00 52.86 51.66 3dl5 s ASN 419 Cb -0.02 -1.18 0.02 0.00 0.41 0.00 0.00 41.25 40.49 3dl5 s ASN 419 CO -0.00 0.13 -0.08 -0.22 -1.51 0.00 0.00 177.10 175.42 3dl5 s LEU 420 N 0.37 1.26 -0.23 0.60 2.96 -0.64 -0.68 118.68 122.33 3dl5 s LEU 420 Ca -0.16 -0.25 -0.10 0.00 -0.22 0.00 0.00 54.13 53.40 3dl5 s LEU 420 Cb -0.17 -0.74 -0.05 0.00 0.50 0.00 0.00 46.19 45.74 3dl5 s LEU 420 CO 0.07 -0.08 0.14 -0.47 -1.32 0.00 0.00 176.35 174.70 3dl5 s TYR 421 N 1.34 3.30 -0.17 5.38 5.04 -0.72 0.17 117.35 131.68 3dl5 s TYR 421 Ca -0.03 0.18 0.01 0.00 -2.44 0.00 0.00 57.07 54.79 3dl5 s TYR 421 Cb -0.14 -2.25 0.02 0.00 0.35 0.00 0.00 41.96 39.95 3dl5 s TYR 421 CO -0.03 0.06 -0.20 -1.14 -1.34 0.00 0.00 175.55 172.90 3dl5 s GLN 422 N 0.99 2.95 0.06 4.97 0.74 0.84 -2.27 119.66 127.96 3dl5 s GLN 422 Ca 0.07 -0.82 -0.26 0.00 0.05 0.00 0.00 55.36 54.40 3dl5 s GLN 422 Cb -0.13 -2.53 -0.17 0.00 1.10 0.00 0.00 33.01 31.28 3dl5 s GLN 422 CO 0.04 -0.19 1.60 0.07 -0.55 0.00 0.00 175.29 176.26 3dl5 h ARG 423 N 7.88 -0.30 -6.14 1.67 0.11 -1.43 -0.93 114.38 115.24 3dl5 h ARG 423 Ca -0.44 0.02 -0.65 0.00 0.10 0.00 0.00 59.98 59.01 3dl5 h ARG 423 Cb 1.15 0.07 -0.30 0.00 1.11 0.00 0.00 29.97 31.99 3dl5 h ARG 423 CO 0.62 -0.14 -0.87 0.45 0.10 0.00 0.00 179.97 180.14 3dl5 s SER 424 N -4.99 2.73 -0.07 0.08 0.15 -1.26 -0.36 113.70 109.98 3dl5 s SER 424 Ca -0.15 -0.43 -0.03 0.00 0.70 0.00 0.00 55.95 56.04 3dl5 s SER 424 Cb 0.04 -0.44 0.04 0.00 -1.71 0.00 0.00 66.02 63.95 3dl5 s SER 424 CO 0.63 0.26 0.14 0.00 1.20 0.00 0.00 173.24 175.48 3dl5 s ASP 426 N 1.99 6.27 0.65 0.00 3.68 -1.26 -2.00 116.67 125.99 3dl5 s ASP 426 Ca 0.00 -1.22 0.33 0.00 2.13 0.00 0.00 52.55 53.79 3dl5 s ASP 426 Cb -0.12 -2.42 1.80 0.00 -1.45 0.00 0.00 42.92 40.73 3dl5 s ASP 426 CO -0.05 -1.37 2.05 -0.07 0.13 0.00 0.00 175.17 175.86 3dl5 h LEU 427 N 11.21 0.00 0.05 -1.34 -0.00 -1.60 -0.91 115.31 122.72 3dl5 h LEU 427 Ca -0.18 0.00 -0.27 0.00 -0.00 0.00 0.00 57.88 57.42 3dl5 h LEU 427 Cb 1.06 0.00 -0.03 0.00 -0.00 0.00 0.00 40.66 41.69 3dl5 h LEU 427 CO 1.18 0.00 -1.47 1.23 -0.00 0.00 0.00 178.44 179.37 3dl5 h GLY 428 N 0.00 0.11 0.00 0.83 0.00 -1.91 -3.42 103.07 98.68 3dl5 h GLY 428 Ca 0.04 -0.29 -0.23 0.00 0.00 0.00 0.00 47.33 46.85 3dl5 h GLY 428 CO -0.00 0.25 -1.76 -0.10 0.00 0.00 0.00 176.54 174.93 3dl5 n LEU 429 N -4.12 1.91 0.06 3.11 7.94 -1.11 -4.75 117.00 120.05 3dl5 n LEU 429 Ca -0.31 0.33 -0.15 0.00 -1.11 0.00 0.00 56.01 54.76 3dl5 n LEU 429 Cb 0.80 -0.76 -0.06 0.00 0.53 0.00 0.00 43.42 43.93 3dl5 n LEU 429 CO 0.28 0.15 0.15 1.23 -1.11 0.00 0.00 177.39 178.09 3dl5 h GLY 430 N -0.97 0.56 0.95 -3.96 0.00 -1.56 -3.36 103.07 94.72 3dl5 h GLY 430 Ca -0.35 -0.98 0.00 0.00 0.00 0.00 0.00 47.33 46.00 3dl5 h GLY 430 CO -0.21 0.87 -0.05 0.23 0.00 0.00 0.00 176.54 177.37 3dl5 h SER 431 N 0.28 -0.13 -1.01 0.19 0.87 -1.47 -1.43 113.55 110.86 3dl5 h SER 431 Ca -0.09 0.01 0.16 0.00 -1.23 0.00 0.00 61.79 60.64 3dl5 h SER 431 Cb 1.61 0.04 -0.10 0.00 -0.44 0.00 0.00 62.40 63.52 3dl5 h SER 431 CO 0.18 -0.08 0.62 -0.65 -0.53 0.00 0.00 176.83 176.36 3dl5 h PRO 432 N -0.12 0.84 0.10 2.24 0.11 -1.82 -0.93 132.00 132.42 3dl5 h PRO 432 Ca -0.00 -0.05 -0.01 0.00 0.11 0.00 0.00 66.00 66.05 3dl5 h PRO 432 Cb 0.11 -0.19 0.00 0.00 0.11 0.00 0.00 31.00 31.04 3dl5 h PRO 432 CO -0.01 0.55 -0.05 0.74 -0.21 0.00 0.00 178.00 179.03 3dl5 h PHE 433 N 0.86 -0.13 -0.70 0.65 -1.00 -1.61 -2.87 116.94 112.15 3dl5 h PHE 433 Ca 0.55 -0.00 0.00 0.00 2.81 0.00 0.00 57.97 61.33 3dl5 h PHE 433 Cb 0.73 0.04 -0.03 0.00 3.61 0.00 0.00 35.95 40.30 3dl5 h PHE 433 CO -0.00 0.01 0.46 -0.91 -1.61 0.00 0.00 178.31 176.25 3dl5 h ASN 434 N -0.24 0.81 0.34 2.17 4.21 -0.27 0.19 115.58 122.79 3dl5 h ASN 434 Ca -0.01 -0.03 -0.01 0.00 1.21 0.00 0.00 56.30 57.46 3dl5 h ASN 434 Cb 0.20 -0.20 -0.00 0.00 -1.12 0.00 0.00 38.32 37.19 3dl5 h ASN 434 CO 0.02 0.60 -0.20 0.40 -1.29 0.00 0.00 177.43 176.96 3dl5 h ILE 435 N 0.96 0.57 -0.48 2.81 2.04 -1.10 -1.58 117.51 120.72 3dl5 h ILE 435 Ca 0.26 0.00 -0.07 0.00 1.00 0.00 0.00 64.86 66.05 3dl5 h ILE 435 Cb -0.09 0.57 -0.02 0.00 -0.74 0.00 0.00 36.82 36.54 3dl5 h ILE 435 CO -0.05 0.00 0.04 0.00 0.00 0.00 0.00 178.15 178.13 3dl5 h ALA 436 N 0.12 0.65 0.14 1.87 0.00 -1.30 -2.83 119.26 117.91 3dl5 h ALA 436 Ca -0.04 -0.26 -0.00 0.00 0.00 0.00 0.00 54.91 54.61 3dl5 h ALA 436 Cb 0.43 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 3dl5 h ALA 436 CO 0.04 0.42 -0.14 1.03 0.00 0.00 0.00 179.25 180.59 3dl5 h SER 437 N 0.69 -0.39 0.29 0.00 0.87 -0.44 -0.81 113.55 113.76 3dl5 h SER 437 Ca 0.14 0.03 0.00 0.00 -1.23 0.00 0.00 61.79 60.73 3dl5 h SER 437 Cb 0.46 0.13 0.00 0.00 -0.44 0.00 0.00 62.40 62.54 3dl5 h SER 437 CO 0.02 -0.19 0.00 -1.22 -0.53 0.00 0.00 176.83 174.91 3dl5 n TYR 438 N -3.16 0.37 -0.05 2.24 4.01 -0.61 -1.28 117.16 118.68 3dl5 n TYR 438 Ca -0.03 0.17 -0.14 0.00 -0.16 0.00 0.00 57.90 57.74 3dl5 n TYR 438 Cb 0.13 -0.77 -0.12 0.00 -0.31 0.00 0.00 39.34 38.26 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 2.18 -0.00 -0.04 -0.72 0.00 -1.21 -2.38 119.26 117.09 3dl5 h ALA 439 Ca 0.00 -0.46 0.00 0.00 0.00 0.00 0.00 54.91 54.45 3dl5 h ALA 439 Cb 0.14 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 17.93 3dl5 h ALA 439 CO 0.00 -0.02 0.01 0.82 0.00 0.00 0.00 179.25 180.06 3dl5 h ILE 440 N -0.85 0.98 -0.85 0.00 2.04 -0.40 -1.38 117.51 117.06 3dl5 h ILE 440 Ca -0.01 -0.01 0.18 0.00 1.00 0.00 0.00 64.86 66.02 3dl5 h ILE 440 Cb 0.95 0.96 -0.06 0.00 -0.74 0.00 0.00 36.82 37.92 3dl5 h ILE 440 CO 0.01 0.00 0.56 0.25 0.00 0.00 0.00 178.15 178.98 3dl5 h LEU 441 N 0.02 0.41 -0.12 1.44 5.85 -1.26 0.18 115.31 121.83 3dl5 h LEU 441 Ca 0.02 0.03 -0.20 0.00 0.84 0.00 0.00 57.88 58.57 3dl5 h LEU 441 Cb 0.01 -0.05 0.01 0.00 0.37 0.00 0.00 40.66 41.01 3dl5 h LEU 441 CO -0.02 0.19 -0.72 0.74 -0.34 0.00 0.00 178.44 178.28 3dl5 h THR 442 N 0.43 1.31 -0.65 1.05 2.02 -0.83 -1.72 112.91 114.51 3dl5 h THR 442 Ca 0.43 -1.96 0.00 0.00 0.77 0.00 0.00 66.41 65.65 3dl5 h THR 442 Cb 1.02 2.10 -0.03 0.00 -1.74 0.00 0.00 68.15 69.50 3dl5 h THR 442 CO -0.15 0.61 0.41 0.24 0.37 0.00 0.00 175.52 177.00 3dl5 h MET 443 N 0.39 0.87 0.64 6.66 2.86 0.09 0.10 114.93 126.54 3dl5 h MET 443 Ca -0.06 -0.07 -0.03 0.00 -2.06 0.00 0.00 59.70 57.49 3dl5 h MET 443 Cb 1.36 -0.19 0.00 0.00 0.06 0.00 0.00 31.60 32.83 3dl5 h MET 443 CO 0.15 0.60 -0.35 0.52 1.06 0.00 0.00 176.91 178.89 3dl5 h MET 444 N 0.89 -0.88 -1.15 1.72 2.07 -0.73 -1.09 114.93 115.76 3dl5 h MET 444 Ca 0.24 0.06 0.33 0.00 -2.07 0.00 0.00 59.70 58.26 3dl5 h MET 444 Cb -0.07 0.20 -0.10 0.00 -1.87 0.00 0.00 31.60 29.76 3dl5 h MET 444 CO -0.05 -0.59 0.75 -0.07 1.07 0.00 0.00 176.91 178.02 3dl5 h LEU 445 N -0.92 0.34 -0.30 1.22 3.38 -1.12 0.21 115.31 118.12 3dl5 h LEU 445 Ca -0.09 0.09 -0.05 0.00 0.09 0.00 0.00 57.88 57.93 3dl5 h LEU 445 Cb 0.72 0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.51 3dl5 h LEU 445 CO 0.11 -0.01 0.01 0.00 0.09 0.00 0.00 178.44 178.64 3dl5 h ALA 446 N 1.59 0.41 -0.05 1.53 0.00 -0.23 -1.53 119.26 120.99 3dl5 h ALA 446 Ca 0.67 -0.23 -0.00 0.00 0.00 0.00 0.00 54.91 55.35 3dl5 h ALA 446 Cb 1.94 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 19.61 3dl5 h ALA 446 CO -0.31 0.15 0.02 0.37 0.00 0.00 0.00 179.25 179.47 3dl5 h GLN 447 N 0.33 0.07 0.00 0.00 4.15 0.63 0.92 115.11 121.21 3dl5 h GLN 447 Ca 0.09 -0.01 -0.01 0.00 0.77 0.00 0.00 58.65 59.49 3dl5 h GLN 447 Cb 0.42 -0.01 -0.00 0.00 0.21 0.00 0.00 27.48 28.10 3dl5 h GLN 447 CO 0.01 0.24 -0.03 0.28 -1.93 0.00 0.00 178.83 177.40 3dl5 h VAL 448 N -0.11 0.18 -0.01 2.39 2.07 -1.22 -2.59 116.25 116.96 3dl5 h VAL 448 Ca 0.01 -0.29 0.00 0.00 0.82 0.00 0.00 66.70 67.25 3dl5 h VAL 448 Cb 0.19 1.24 0.00 0.00 -1.52 0.00 0.00 31.29 31.20 3dl5 h VAL 448 CO -0.00 0.03 -0.34 0.00 0.02 0.00 0.00 177.57 177.28 3dl5 n GLY 450 N 1.13 0.90 3.53 0.00 0.00 0.32 -4.82 105.19 106.24 3dl5 n GLY 450 Ca 0.06 -0.58 -0.25 0.00 0.00 0.00 0.00 46.02 45.25 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 -2.57 1.86 0.07 1.61 1.51 0.29 -5.01 117.35 115.12 3dl5 s TYR 451 Ca 0.00 -1.13 0.04 0.00 -1.01 0.00 0.00 57.07 54.96 3dl5 s TYR 451 Cb 0.00 -1.26 -0.04 0.00 -0.11 0.00 0.00 41.96 40.55 3dl5 s TYR 451 CO 0.00 -0.13 0.02 -1.21 -1.11 0.00 0.00 175.55 173.12 3dl5 s GLU 452 N -3.79 2.67 0.40 -0.62 0.41 -0.39 -4.06 118.70 113.32 3dl5 s GLU 452 Ca 0.26 -0.76 -0.27 0.00 -0.41 0.00 0.00 54.97 53.79 3dl5 s GLU 452 Cb 0.04 -2.61 -0.10 0.00 -1.78 0.00 0.00 34.13 29.69 3dl5 s GLU 452 CO 0.13 0.56 1.41 -1.25 -0.49 0.00 0.00 175.26 175.63 3dl5 s PRO 453 N -2.17 3.98 0.00 0.39 0.04 -1.26 -0.48 135.00 135.49 3dl5 s PRO 453 Ca 0.25 2.40 0.00 0.00 0.04 0.00 0.00 61.00 63.69 3dl5 s PRO 453 Cb -0.12 -2.85 0.00 0.00 0.04 0.00 0.00 34.50 31.58 3dl5 s PRO 453 CO 0.17 -0.57 0.00 0.41 0.04 0.00 0.00 177.00 177.06 3dl5 n GLY 454 N 0.58 1.27 3.67 0.56 0.00 -0.51 -3.98 105.19 106.78 3dl5 n GLY 454 Ca 0.03 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.82 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 2.85 2.40 -0.06 1.61 2.02 -1.26 -0.86 118.70 125.39 3dl5 s GLU 455 Ca 0.00 -1.35 0.02 0.00 0.02 0.00 0.00 54.97 53.66 3dl5 s GLU 455 Cb 0.00 -2.23 0.01 0.00 0.10 0.00 0.00 34.13 32.01 3dl5 s GLU 455 CO 0.00 0.37 -0.12 -1.17 0.02 0.00 0.00 175.26 174.36 3dl5 s LEU 456 N -3.68 1.64 -0.13 1.80 2.96 0.17 -0.94 118.68 120.51 3dl5 s LEU 456 Ca 0.31 -0.29 -0.01 0.00 -0.22 0.00 0.00 54.13 53.92 3dl5 s LEU 456 Cb -0.07 -0.81 0.04 0.00 0.50 0.00 0.00 46.19 45.85 3dl5 s LEU 456 CO 0.21 0.03 -0.02 0.00 -1.32 0.00 0.00 176.35 175.25 3dl5 s ALA 457 N 0.65 1.07 -0.31 5.97 0.00 -0.52 0.68 121.76 129.31 3dl5 s ALA 457 Ca -0.14 -0.50 -0.12 0.00 0.00 0.00 0.00 51.96 51.21 3dl5 s ALA 457 Cb -0.16 -0.96 -0.03 0.00 0.00 0.00 0.00 23.12 21.97 3dl5 s ALA 457 CO 0.04 -0.68 0.21 0.42 0.00 0.00 0.00 175.76 175.74 3dl5 s ILE 458 N 1.82 5.24 -0.21 0.00 -1.09 0.23 -1.61 121.20 125.58 3dl5 s ILE 458 Ca 0.03 -0.04 -0.11 0.00 -2.23 0.00 0.00 60.65 58.30 3dl5 s ILE 458 Cb -0.14 -3.59 -0.05 0.00 -1.58 0.00 0.00 42.46 37.10 3dl5 s ILE 458 CO -0.07 0.13 0.15 -0.36 -1.23 0.00 0.00 174.94 173.56 3dl5 s PHE 459 N 1.73 3.39 0.03 3.97 2.99 0.13 -0.74 117.98 129.48 3dl5 s PHE 459 Ca 0.06 0.33 0.09 0.00 0.00 0.00 0.00 56.93 57.42 3dl5 s PHE 459 Cb -0.17 -2.20 -0.03 0.00 0.00 0.00 0.00 43.02 40.62 3dl5 s PHE 459 CO 0.10 0.23 -0.25 0.42 -0.00 0.00 0.00 175.22 175.72 3dl5 s ILE 460 N 0.54 2.19 0.00 0.64 1.01 0.29 -0.11 121.20 125.76 3dl5 s ILE 460 Ca 0.09 -1.31 0.00 0.00 0.00 0.00 0.00 60.65 59.43 3dl5 s ILE 460 Cb -0.12 -1.84 0.00 0.00 0.01 0.00 0.00 42.46 40.51 3dl5 s ILE 460 CO 0.00 0.41 0.00 0.61 0.00 0.00 0.00 174.94 175.96 3dl5 n GLY 461 N 1.90 0.70 3.47 6.18 0.00 -0.35 -0.37 105.19 116.72 3dl5 n GLY 461 Ca -0.17 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.42 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 6.48 -0.49 1.61 3.68 0.52 -0.42 116.67 127.04 3dl5 s ASP 462 Ca 0.00 -1.65 -0.22 0.00 2.13 0.00 0.00 52.55 52.81 3dl5 s ASP 462 Cb 0.00 -2.43 0.04 0.00 -1.45 0.00 0.00 42.92 39.08 3dl5 s ASP 462 CO 0.00 -1.24 0.77 0.00 0.13 0.00 0.00 175.17 174.83 3dl5 s ALA 463 N 3.43 3.28 0.33 3.66 0.00 -0.72 -1.66 121.76 130.08 3dl5 s ALA 463 Ca 0.32 -1.27 0.06 0.00 0.00 0.00 0.00 51.96 51.06 3dl5 s ALA 463 Cb -0.08 -3.49 -0.07 0.00 0.00 0.00 0.00 23.12 19.48 3dl5 s ALA 463 CO -0.04 -2.06 0.01 -3.38 0.00 0.00 0.00 175.76 170.29 3dl5 s HIS 464 N 3.26 2.10 -0.10 0.00 -0.00 -0.85 -2.48 115.29 117.21 3dl5 s HIS 464 Ca 0.25 -0.80 -0.01 0.00 -0.00 0.00 0.00 55.06 54.50 3dl5 s HIS 464 Cb -0.14 -1.34 0.03 0.00 -0.00 0.00 0.00 32.58 31.13 3dl5 s HIS 464 CO 0.19 0.21 -0.01 0.42 -0.00 0.00 0.00 174.74 175.55 3dl5 s ILE 465 N -3.06 0.54 0.16 -5.38 1.01 -0.94 -1.33 121.20 112.20 3dl5 s ILE 465 Ca 0.34 -0.10 -0.30 0.00 0.00 0.00 0.00 60.65 60.59 3dl5 s ILE 465 Cb 0.07 -0.74 -0.08 0.00 0.01 0.00 0.00 42.46 41.73 3dl5 s ILE 465 CO 0.15 0.19 1.26 -0.31 0.00 0.00 0.00 174.94 176.23 3dl5 s TYR 466 N 1.89 3.35 0.57 3.97 2.02 -1.26 -1.45 117.35 126.44 3dl5 s TYR 466 Ca 0.04 1.26 0.37 0.00 -0.37 0.00 0.00 57.07 58.38 3dl5 s TYR 466 Cb -0.13 -3.52 1.43 0.00 -0.40 0.00 0.00 41.96 39.34 3dl5 s TYR 466 CO -0.06 -1.62 1.61 1.05 -1.57 0.00 0.00 175.55 174.96 3dl5 h GLU 467 N 5.81 0.00 0.11 -0.62 4.11 -1.42 0.16 114.58 122.74 3dl5 h GLU 467 Ca -0.44 0.00 -0.28 0.00 0.07 0.00 0.00 59.36 58.72 3dl5 h GLU 467 Cb 1.21 0.00 0.02 0.00 0.50 0.00 0.00 28.75 30.48 3dl5 h GLU 467 CO 0.78 0.00 -1.20 -2.95 0.07 0.00 0.00 179.01 175.71 3dl5 h ASN 468 N 0.00 0.63 0.15 3.06 7.08 -1.90 -3.17 115.58 121.43 3dl5 h ASN 468 Ca 0.62 -0.60 0.00 0.00 -3.08 0.00 0.00 56.30 53.24 3dl5 h ASN 468 Cb 2.79 -0.20 0.00 0.00 -2.08 0.00 0.00 38.32 38.83 3dl5 h ASN 468 CO -0.01 1.44 0.00 1.41 -2.08 0.00 0.00 177.43 178.19 3dl5 n HIS 469 N -3.68 0.00 -0.11 4.14 8.25 0.04 -3.49 115.22 120.38 3dl5 n HIS 469 Ca -0.10 0.00 -0.05 0.00 -0.26 0.00 0.00 57.72 57.31 3dl5 n HIS 469 Cb 0.98 -0.30 0.02 0.00 1.12 0.00 0.00 29.99 31.81 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 -0.20 -0.49 2.41 4.07 -1.58 0.22 115.31 119.74 3dl5 h LEU 470 Ca 0.00 0.09 -0.03 0.00 0.08 0.00 0.00 57.88 58.02 3dl5 h LEU 470 Cb 0.08 0.17 -0.02 0.00 1.08 0.00 0.00 40.66 41.97 3dl5 h LEU 470 CO 0.00 -0.06 0.17 0.74 -1.08 0.00 0.00 178.44 178.21 3dl5 h THR 471 N 0.08 1.22 0.61 0.22 2.02 -1.83 -2.84 112.91 112.39 3dl5 h THR 471 Ca 0.18 -0.72 -0.03 0.00 0.77 0.00 0.00 66.41 66.62 3dl5 h THR 471 Cb 0.26 0.77 0.01 0.00 -1.74 0.00 0.00 68.15 67.45 3dl5 h THR 471 CO -0.33 0.26 -0.29 1.56 0.37 0.00 0.00 175.52 177.10 3dl5 h GLN 472 N 0.65 -0.79 -0.05 6.66 7.50 -1.61 -2.57 115.11 124.90 3dl5 h GLN 472 Ca 0.16 0.05 0.02 0.00 0.50 0.00 0.00 58.65 59.38 3dl5 h GLN 472 Cb 0.24 0.18 -0.00 0.00 0.05 0.00 0.00 27.48 27.95 3dl5 h GLN 472 CO -0.01 -0.49 0.06 -0.07 -1.50 0.00 0.00 178.83 176.82 3dl5 h LEU 473 N -0.93 0.00 -0.38 1.46 3.38 -0.63 0.41 115.31 118.62 3dl5 h LEU 473 Ca -0.08 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.74 3dl5 h LEU 473 Cb 0.66 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.39 3dl5 h LEU 473 CO 0.14 0.00 -0.69 0.11 0.09 0.00 0.00 178.44 178.09 3dl5 h LYS 474 N 0.00 0.00 -0.17 1.13 1.57 -1.41 -1.05 116.57 116.65 3dl5 h LYS 474 Ca 0.03 0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 58.75 3dl5 h LYS 474 Cb 0.15 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.45 3dl5 h LYS 474 CO -0.00 0.69 -0.12 1.49 -0.57 0.00 0.00 179.45 180.94 3dl5 h GLU 475 N 0.00 0.37 -0.32 3.15 4.57 0.12 -2.92 114.58 119.55 3dl5 h GLU 475 Ca -0.01 -0.18 -0.05 0.00 -1.18 0.00 0.00 59.36 57.94 3dl5 h GLU 475 Cb 1.36 -0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 29.93 3dl5 h GLU 475 CO 0.09 0.72 -0.00 0.37 -1.18 0.00 0.00 179.01 179.01 3dl5 h GLN 476 N 0.03 0.50 0.00 1.92 4.15 -0.78 -2.55 115.11 118.38 3dl5 h GLN 476 Ca 0.03 -0.10 0.00 0.00 0.77 0.00 0.00 58.65 59.35 3dl5 h GLN 476 Cb 0.63 -0.07 0.00 0.00 0.21 0.00 0.00 27.48 28.25 3dl5 h GLN 476 CO 0.03 0.53 0.00 1.28 -1.93 0.00 0.00 178.83 178.74 3dl5 n LEU 477 N -4.29 0.23 -0.01 -2.39 4.77 -0.41 -2.25 117.00 112.65 3dl5 n LEU 477 Ca 0.01 0.54 0.13 0.00 -0.03 0.00 0.00 56.01 56.66 3dl5 n LEU 477 Cb 0.24 -0.50 0.37 0.00 -2.33 0.00 0.00 43.42 41.21 3dl5 n LEU 477 CO 0.39 -0.25 0.62 -1.54 -1.33 0.00 0.00 177.39 175.28 3dl5 n SER 478 N -1.74 0.36 -4.63 -1.43 3.41 -0.96 -4.37 113.62 104.27 3dl5 n SER 478 Ca 0.04 -0.06 -0.39 0.00 -0.26 0.00 0.00 58.87 58.21 3dl5 n SER 478 Cb 0.25 0.02 -0.08 0.00 -0.26 0.00 0.00 64.21 64.14 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 -2.97 4.08 0.19 4.33 3.00 -0.95 -4.95 118.95 121.67 3dl5 s ARG 479 Ca 0.13 0.15 -0.30 0.00 0.00 0.00 0.00 55.73 55.71 3dl5 s ARG 479 Cb 0.18 -3.62 -0.08 0.00 0.00 0.00 0.00 34.95 31.43 3dl5 s ARG 479 CO 0.64 -0.22 1.24 0.99 0.00 0.00 0.00 175.30 177.95 3dl5 s THR 480 N 1.89 3.44 0.77 0.02 2.01 -1.26 -4.90 115.64 117.60 3dl5 s THR 480 Ca 0.17 1.20 -0.14 0.00 0.31 0.00 0.00 61.69 63.23 3dl5 s THR 480 Cb -0.15 -3.76 0.06 0.00 0.01 0.00 0.00 72.50 68.65 3dl5 s THR 480 CO 0.09 0.18 1.22 -2.84 -0.69 0.00 0.00 174.62 172.59 3dl5 s PRO 481 N -0.15 1.86 0.32 4.92 0.02 -1.26 -4.86 135.00 135.85 3dl5 s PRO 481 Ca 0.55 1.81 0.10 0.00 0.02 0.00 0.00 61.00 63.48 3dl5 s PRO 481 Cb -0.34 -1.79 -0.06 0.00 0.02 0.00 0.00 34.50 32.33 3dl5 s PRO 481 CO 0.37 -2.06 -0.08 1.03 -0.33 0.00 0.00 177.00 175.93 3dl5 s ARG 482 N -3.98 1.90 0.26 5.54 0.52 -1.26 -5.06 118.95 116.88 3dl5 s ARG 482 Ca 0.75 -1.81 -0.31 0.00 -0.52 0.00 0.00 55.73 53.84 3dl5 s ARG 482 Cb -0.30 -1.82 -0.12 0.00 0.52 0.00 0.00 34.95 33.23 3dl5 s ARG 482 CO 0.48 0.19 1.61 -0.35 0.02 0.00 0.00 175.30 177.25 3dl5 n PRO 483 N -0.81 2.63 -1.34 3.54 -0.04 -1.26 -4.80 135.00 132.92 3dl5 n PRO 483 Ca -0.05 0.94 -0.35 0.00 -0.04 0.00 0.00 63.50 64.00 3dl5 n PRO 483 Cb 0.62 -2.73 0.09 0.00 -0.04 0.00 0.00 33.50 31.44 3dl5 n PRO 483 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 3dl5 n PHE 484 N 2.65 0.78 -0.95 0.54 3.72 -1.26 -4.82 117.46 118.12 3dl5 n PHE 484 Ca 0.11 0.39 0.00 0.00 -0.05 0.00 0.00 57.45 57.91 3dl5 n PHE 484 Cb 0.35 -2.09 0.00 0.00 -0.94 0.00 0.00 39.48 36.80 3dl5 n PHE 484 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 176.76 176.36 3dl5 n PRO 485 N -2.03 0.60 -4.77 -1.08 -0.04 -1.25 -4.74 135.00 121.70 3dl5 n PRO 485 Ca 0.13 0.00 -0.26 0.00 -0.04 0.00 0.00 63.50 63.33 3dl5 n PRO 485 Cb 0.49 0.00 -0.15 0.00 -0.04 0.00 0.00 33.50 33.81 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 -1.58 1.46 -0.14 0.54 -1.52 0.41 -1.29 119.66 117.53 3dl5 s GLN 486 Ca 0.00 -0.83 -0.01 0.00 -1.95 0.00 0.00 55.36 52.57 3dl5 s GLN 486 Cb 0.00 -1.50 0.04 0.00 -0.22 0.00 0.00 33.01 31.33 3dl5 s GLN 486 CO 0.00 0.39 -0.03 -1.17 -0.25 0.00 0.00 175.29 174.24 3dl5 s LEU 487 N -0.86 1.25 0.13 2.90 0.20 -1.26 0.19 118.68 121.23 3dl5 s LEU 487 Ca 0.07 -0.51 0.08 0.00 0.69 0.00 0.00 54.13 54.46 3dl5 s LEU 487 Cb -0.08 -0.75 -0.04 0.00 -0.43 0.00 0.00 46.19 44.90 3dl5 s LEU 487 CO 0.01 -0.20 -0.19 -0.75 -0.29 0.00 0.00 176.35 174.93 3dl5 s LYS 488 N 1.76 1.15 0.24 1.98 2.36 -0.20 -4.98 119.74 122.05 3dl5 s LYS 488 Ca 0.02 -1.25 -0.12 0.00 -2.55 0.00 0.00 55.97 52.07 3dl5 s LYS 488 Cb -0.14 -1.26 -0.08 0.00 -1.05 0.00 0.00 37.83 35.29 3dl5 s LYS 488 CO -0.07 0.27 0.61 -0.06 1.55 0.00 0.00 175.35 177.65 3dl5 s PHE 489 N -1.63 3.45 -0.10 4.03 0.08 -1.26 -0.82 117.98 121.73 3dl5 s PHE 489 Ca 0.10 1.03 0.12 0.00 0.12 0.00 0.00 56.93 58.30 3dl5 s PHE 489 Cb -0.08 -2.38 -0.24 0.00 -0.57 0.00 0.00 43.02 39.76 3dl5 s PHE 489 CO 0.05 0.25 0.43 1.63 -0.10 0.00 0.00 175.22 177.48 3dl5 n LYS 490 N 0.02 0.66 -4.15 0.44 5.02 0.17 -4.94 118.16 115.37 3dl5 n LYS 490 Ca 0.00 0.20 -0.17 0.00 -2.02 0.00 0.00 58.31 56.33 3dl5 n LYS 490 Cb 0.52 -1.70 -0.12 0.00 -0.02 0.00 0.00 35.03 33.72 3dl5 n LYS 490 CO 0.00 0.00 0.00 -0.98 -0.52 0.00 0.00 177.40 175.90 3dl5 s ARG 491 N -2.56 0.77 0.02 1.97 1.70 -1.26 -5.12 118.95 114.47 3dl5 s ARG 491 Ca -0.09 -0.96 -0.30 0.00 -0.47 0.00 0.00 55.73 53.91 3dl5 s ARG 491 Cb 0.07 -0.68 -0.04 0.00 -0.57 0.00 0.00 34.95 33.74 3dl5 s ARG 491 CO 0.81 0.14 1.00 0.21 -1.08 0.00 0.00 175.30 176.38 3dl5 s LYS 492 N -1.90 4.56 0.48 3.89 2.47 -1.26 -5.03 119.74 122.95 3dl5 s LYS 492 Ca -0.02 1.46 0.02 0.00 -1.56 0.00 0.00 55.97 55.87 3dl5 s LYS 492 Cb -0.09 -3.44 0.01 0.00 -1.46 0.00 0.00 37.83 32.86 3dl5 s LYS 492 CO 0.02 -0.04 0.68 0.14 0.16 0.00 0.00 175.35 176.31 3dl5 s VAL 493 N 0.90 3.27 -0.02 4.02 -7.23 -1.26 -5.07 120.40 115.01 3dl5 s VAL 493 Ca 0.52 -0.69 -0.01 0.00 -1.81 0.00 0.00 61.98 59.98 3dl5 s VAL 493 Cb -0.22 -3.19 -0.00 0.00 0.56 0.00 0.00 36.38 33.52 3dl5 s VAL 493 CO 0.28 -0.12 -0.02 1.21 -0.31 0.00 0.00 175.10 176.14 3dl5 n GLU 494 N -2.12 0.06 -4.07 4.82 4.07 -1.26 -4.96 120.64 117.17 3dl5 n GLU 494 Ca 0.05 0.26 -0.28 0.00 -0.06 0.00 0.00 57.16 57.14 3dl5 n GLU 494 Cb 0.59 -0.85 -0.06 0.00 -0.06 0.00 0.00 31.44 31.06 3dl5 n GLU 494 CO 0.00 0.00 0.00 1.21 -0.06 0.00 0.00 177.13 178.28 3dl5 s ASN 495 N -3.82 5.50 0.32 4.31 3.84 -1.26 -5.02 114.94 118.81 3dl5 s ASN 495 Ca -0.02 -0.09 0.09 0.00 0.21 0.00 0.00 52.86 53.05 3dl5 s ASN 495 Cb 0.00 -1.44 0.84 0.00 -0.55 0.00 0.00 41.25 40.09 3dl5 s ASN 495 CO 0.03 0.11 1.77 -0.29 -2.79 0.00 0.00 177.10 175.92 3dl5 h ILE 496 N 2.26 0.64 0.00 -5.21 6.09 -1.98 0.54 117.51 119.84 3dl5 h ILE 496 Ca -0.47 -0.23 0.00 0.00 -1.37 0.00 0.00 64.86 62.79 3dl5 h ILE 496 Cb 1.19 -0.08 0.00 0.00 0.47 0.00 0.00 36.82 38.40 3dl5 h ILE 496 CO 0.64 0.12 0.01 -0.33 -3.07 0.00 0.00 178.15 175.52 3dl5 h GLU 497 N 0.66 0.00 0.00 2.19 5.08 -1.95 -3.03 114.58 117.53 3dl5 h GLU 497 Ca 0.60 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.95 3dl5 h GLU 497 Cb 1.07 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.32 3dl5 h GLU 497 CO -0.39 0.00 -0.01 -0.44 -1.00 0.00 0.00 179.01 177.17 3dl5 h ASP 498 N 0.00 0.00 -3.52 1.42 3.45 -1.29 -3.46 116.42 113.02 3dl5 h ASP 498 Ca 0.00 0.00 -0.56 0.00 0.43 0.00 0.00 57.03 56.90 3dl5 h ASP 498 Cb 0.01 0.00 0.18 0.00 -0.56 0.00 0.00 39.33 38.96 3dl5 h ASP 498 CO 0.00 0.01 -0.07 0.49 -1.57 0.00 0.00 179.24 178.09 3dl5 n PHE 499 N -3.10 0.18 -3.80 4.55 3.01 -1.15 -5.02 117.46 112.13 3dl5 n PHE 499 Ca 0.01 0.39 -0.11 0.00 1.01 0.00 0.00 57.45 58.75 3dl5 n PHE 499 Cb 0.36 -2.04 -0.08 0.00 -0.01 0.00 0.00 39.48 37.72 3dl5 n PHE 499 CO 0.00 0.00 0.00 0.21 1.01 0.00 0.00 176.76 177.98 3dl5 s LYS 500 N -2.97 0.73 0.26 -1.08 2.47 -1.26 -5.07 119.74 112.83 3dl5 s LYS 500 Ca 0.71 -0.51 -0.03 0.00 -1.56 0.00 0.00 55.97 54.59 3dl5 s LYS 500 Cb -0.37 0.31 0.56 0.00 -1.46 0.00 0.00 37.83 36.87 3dl5 s LYS 500 CO 0.52 -0.22 1.65 2.35 0.16 0.00 0.00 175.35 179.81 3dl5 h TRP 501 N 3.44 0.20 -0.01 4.03 -0.00 -1.97 0.75 115.95 122.39 3dl5 h TRP 501 Ca -0.32 0.05 0.00 0.00 -0.00 0.00 0.00 58.89 58.63 3dl5 h TRP 501 Cb 1.19 0.04 -0.00 0.00 -0.00 0.00 0.00 29.16 30.39 3dl5 h TRP 501 CO 0.49 -0.19 0.02 0.93 -0.00 0.00 0.00 178.44 179.69 3dl5 h GLU 502 N 0.19 0.00 0.00 2.65 3.07 -2.02 -0.51 114.58 117.97 3dl5 h GLU 502 Ca 0.47 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.33 3dl5 h GLU 502 Cb 0.88 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.79 3dl5 h GLU 502 CO -0.62 0.00 0.00 -0.25 -1.40 0.00 0.00 179.01 176.74 3dl5 n ASP 503 N -3.36 0.56 -4.76 1.42 10.43 0.26 -4.77 116.55 116.33 3dl5 n ASP 503 Ca -0.03 0.61 -0.36 0.00 2.57 0.00 0.00 54.79 57.58 3dl5 n ASP 503 Cb 0.10 -0.74 -0.07 0.00 1.84 0.00 0.00 41.12 42.25 3dl5 n ASP 503 CO 0.00 0.00 0.00 -0.63 -1.07 0.00 0.00 177.20 175.50 3dl5 s ILE 504 N -3.20 5.35 -0.23 0.53 1.01 -0.20 -0.66 121.20 123.81 3dl5 s ILE 504 Ca 0.07 0.41 0.01 0.00 0.00 0.00 0.00 60.65 61.13 3dl5 s ILE 504 Cb 0.11 -3.55 0.06 0.00 0.01 0.00 0.00 42.46 39.08 3dl5 s ILE 504 CO 0.44 0.45 -0.07 -0.70 0.00 0.00 0.00 174.94 175.06 3dl5 s GLU 505 N 0.10 1.72 -0.46 2.79 2.12 -0.00 -4.99 118.70 119.98 3dl5 s GLU 505 Ca 0.14 -0.96 -0.19 0.00 0.36 0.00 0.00 54.97 54.32 3dl5 s GLU 505 Cb -0.12 -2.55 0.04 0.00 0.26 0.00 0.00 34.13 31.75 3dl5 s GLU 505 CO 0.03 -0.56 0.55 -1.17 -0.54 0.00 0.00 175.26 173.56 3dl5 s LEU 506 N 1.39 4.88 -0.22 2.70 0.20 -1.26 -1.03 118.68 125.33 3dl5 s LEU 506 Ca -0.05 -0.74 -0.08 0.00 0.69 0.00 0.00 54.13 53.95 3dl5 s LEU 506 Cb -0.18 -2.46 -0.04 0.00 -0.43 0.00 0.00 46.19 43.08 3dl5 s LEU 506 CO -0.07 -0.74 0.09 -0.63 -0.29 0.00 0.00 176.35 174.71 3dl5 s ILE 507 N 2.42 4.73 -0.33 6.68 1.01 0.13 -4.56 121.20 131.27 3dl5 s ILE 507 Ca 0.15 -0.04 -0.00 0.00 0.00 0.00 0.00 60.65 60.75 3dl5 s ILE 507 Cb -0.18 -3.18 0.00 0.00 0.01 0.00 0.00 42.46 39.11 3dl5 s ILE 507 CO 0.14 0.38 0.01 0.61 0.00 0.00 0.00 174.94 176.08 3dl5 n GLY 508 N 4.24 0.22 3.48 6.18 0.00 -1.26 -0.45 105.19 117.61 3dl5 n GLY 508 Ca -0.16 -0.72 -0.43 0.00 0.00 0.00 0.00 46.02 44.72 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 -2.22 2.70 -0.56 1.61 6.04 -1.26 -4.37 117.35 119.29 3dl5 s TYR 509 Ca 0.00 -0.70 0.00 0.00 0.04 0.00 0.00 57.07 56.41 3dl5 s TYR 509 Cb -0.00 -4.39 0.14 0.00 -1.04 0.00 0.00 41.96 36.67 3dl5 s TYR 509 CO 0.00 -1.71 0.34 0.71 -1.54 0.00 0.00 175.55 173.35 3dl5 s TYR 510 N 4.11 3.36 0.50 4.97 2.02 -1.26 -5.10 117.35 125.95 3dl5 s TYR 510 Ca 0.29 -2.88 0.09 0.00 -0.37 0.00 0.00 57.07 54.20 3dl5 s TYR 510 Cb -0.11 -3.05 0.05 0.00 -0.40 0.00 0.00 41.96 38.45 3dl5 s TYR 510 CO 0.04 -0.82 0.68 -1.25 -1.57 0.00 0.00 175.55 172.63 3dl5 s PRO 511 N -0.01 2.55 0.57 -1.71 0.04 -1.26 -4.91 135.00 130.27 3dl5 s PRO 511 Ca 0.16 -1.45 -0.05 0.00 0.04 0.00 0.00 61.00 59.70 3dl5 s PRO 511 Cb -0.22 -2.70 0.01 0.00 0.04 0.00 0.00 34.50 31.63 3dl5 s PRO 511 CO -0.03 -0.58 0.87 0.71 0.04 0.00 0.00 177.00 178.01 3dl5 s TYR 512 N -2.52 3.22 0.90 0.56 1.51 -0.23 -4.90 117.35 115.90 3dl5 s TYR 512 Ca 0.58 0.55 -0.15 0.00 -1.01 0.00 0.00 57.07 57.05 3dl5 s TYR 512 Cb -0.08 -2.69 -0.05 0.00 -0.11 0.00 0.00 41.96 39.03 3dl5 s TYR 512 CO 0.36 -0.78 -0.02 -2.30 -1.11 0.00 0.00 175.55 171.71 3dl5 n PRO 513 N -2.51 -0.08 -1.24 -1.71 -0.02 -1.26 -2.09 135.00 126.08 3dl5 n PRO 513 Ca 0.04 0.00 -0.31 0.00 -2.02 0.00 0.00 63.50 61.22 3dl5 n PRO 513 Cb 0.58 -1.51 0.10 0.00 -0.02 0.00 0.00 33.50 32.64 3dl5 n PRO 513 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 3dl5 s THR 514 N -2.16 3.22 -0.13 3.45 2.01 -1.26 -3.57 115.64 117.20 3dl5 s THR 514 Ca 0.53 0.40 -0.01 0.00 0.31 0.00 0.00 61.69 62.91 3dl5 s THR 514 Cb -0.24 -2.88 0.04 0.00 0.01 0.00 0.00 72.50 69.43 3dl5 s THR 514 CO 0.71 -0.52 -0.04 -0.63 -0.69 0.00 0.00 174.62 173.46 3dl5 s ILE 515 N -2.91 0.87 0.06 1.82 1.01 -1.26 -4.91 121.20 115.88 3dl5 s ILE 515 Ca 0.62 -0.36 -0.30 0.00 0.00 0.00 0.00 60.65 60.60 3dl5 s ILE 515 Cb -0.17 -1.03 -0.05 0.00 0.01 0.00 0.00 42.46 41.22 3dl5 s ILE 515 CO 0.56 0.20 1.14 -1.59 0.00 0.00 0.00 174.94 175.25 3dl5 s LYS 516 N 1.75 4.48 -0.11 2.79 0.00 -1.26 -5.04 119.74 122.35 3dl5 s LYS 516 Ca 0.03 1.68 -0.05 0.00 0.00 0.00 0.00 55.97 57.63 3dl5 s LYS 516 Cb -0.14 -3.36 0.05 0.00 0.00 0.00 0.00 37.83 34.38 3dl5 s LYS 516 CO -0.07 -0.17 0.25 -1.64 0.00 0.00 0.00 175.35 173.72 3dl5 s MET 517 N 0.88 0.18 0.51 1.78 -1.94 -1.26 -4.95 119.30 114.50 3dl5 s MET 517 Ca 0.56 0.61 -0.20 0.00 -1.71 0.00 0.00 55.69 54.95 3dl5 s MET 517 Cb -0.27 -0.09 -0.08 0.00 2.01 0.00 0.00 34.83 36.39 3dl5 s MET 517 CO 0.30 -0.21 1.06 -0.51 -0.01 0.00 0.00 175.02 175.64 3dl5 s ASP 518 N 1.70 6.17 0.37 3.03 1.01 -1.26 -5.03 116.67 122.66 3dl5 s ASP 518 Ca -0.05 1.97 -0.02 0.00 0.71 0.00 0.00 52.55 55.16 3dl5 s ASP 518 Cb -0.11 -2.56 -0.04 0.00 1.01 0.00 0.00 42.92 41.22 3dl5 s ASP 518 CO -0.08 -0.90 0.62 -0.32 0.21 0.00 0.00 175.17 174.69 3dl5 s MET 519 N -3.30 3.54 -0.91 8.23 1.75 -1.26 -4.98 119.30 122.37 3dl5 s MET 519 Ca 0.68 -0.10 -0.23 0.00 -1.25 0.00 0.00 55.69 54.80 3dl5 s MET 519 Cb -0.18 -2.57 0.06 0.00 2.84 0.00 0.00 34.83 34.98 3dl5 s MET 519 CO 0.23 0.06 1.31 0.00 -0.65 0.00 0.00 175.02 175.97 3dl5 s ALA 520 N -2.39 2.87 0.00 4.11 0.00 -1.26 -5.11 121.76 119.98 3dl5 s ALA 520 Ca 0.43 -2.12 0.00 0.00 0.00 0.00 0.00 51.96 50.28 3dl5 s ALA 520 Cb -0.10 -4.33 0.00 0.00 0.00 0.00 0.00 23.12 18.69 3dl5 s ALA 520 CO 0.37 -3.36 0.00 0.28 0.00 0.00 0.00 175.76 173.05