#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3n5l s GLN 27 N 0.00 4.57 0.55 -1.24 -2.07 -1.26 -4.99 119.66 115.21 3n5l s GLN 27 Ca 0.00 1.75 -0.22 0.00 -1.82 0.00 0.00 55.36 55.08 3n5l s GLN 27 Cb 0.00 -3.09 -0.05 0.00 -1.09 0.00 0.00 33.01 28.78 3n5l s GLN 27 CO 0.00 0.16 1.35 -2.30 -1.32 0.00 0.00 175.29 173.19 3n5l n PRO 28 N 1.00 1.67 -3.79 9.60 -0.02 -1.26 -4.50 135.00 137.70 3n5l n PRO 28 Ca -0.00 0.62 -0.36 0.00 -2.02 0.00 0.00 63.50 61.73 3n5l n PRO 28 Cb 0.46 -2.57 -0.07 0.00 -0.02 0.00 0.00 33.50 31.30 3n5l n PRO 28 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3n5l s VAL 29 N -1.29 5.45 -0.22 -1.45 1.01 -1.26 -1.36 120.40 121.28 3n5l s VAL 29 Ca 0.72 0.21 -0.04 0.00 0.00 0.00 0.00 61.98 62.87 3n5l s VAL 29 Cb -0.42 -3.44 -0.01 0.00 0.00 0.00 0.00 36.38 32.51 3n5l s VAL 29 CO 0.49 0.52 -0.05 -0.63 0.00 0.00 0.00 175.10 175.44 3n5l s ILE 30 N -0.27 3.36 -0.34 2.22 -1.09 -0.17 -4.93 121.20 119.97 3n5l s ILE 30 Ca 0.11 -0.50 -0.18 0.00 -2.23 0.00 0.00 60.65 57.85 3n5l s ILE 30 Cb -0.12 -2.52 -0.01 0.00 -1.58 0.00 0.00 42.46 38.24 3n5l s ILE 30 CO 0.01 0.43 0.53 0.20 -1.23 0.00 0.00 174.94 174.88 3n5l s ASN 31 N 1.46 6.35 -0.36 3.58 0.01 -1.26 -0.61 114.94 124.10 3n5l s ASN 31 Ca 0.06 0.06 -0.10 0.00 -0.71 0.00 0.00 52.86 52.16 3n5l s ASN 31 Cb -0.14 -2.28 0.03 0.00 0.41 0.00 0.00 41.25 39.27 3n5l s ASN 31 CO -0.03 -0.48 0.19 0.12 -1.51 0.00 0.00 177.10 175.39 3n5l s PHE 32 N 2.44 3.24 0.17 2.20 2.19 0.34 -0.73 117.98 127.83 3n5l s PHE 32 Ca 0.20 -1.01 -0.30 0.00 0.33 0.00 0.00 56.93 56.15 3n5l s PHE 32 Cb -0.15 -2.41 -0.07 0.00 -1.31 0.00 0.00 43.02 39.08 3n5l s PHE 32 CO 0.13 -0.65 0.95 0.20 1.83 0.00 0.00 175.22 177.68 3n5l s GLY 33 N 1.53 3.05 -0.19 13.12 0.00 0.56 -0.17 107.32 125.23 3n5l s GLY 33 Ca 0.02 0.59 -0.02 0.00 0.00 0.00 0.00 44.72 45.30 3n5l s GLY 33 CO 0.06 1.33 0.02 -0.42 0.00 0.00 0.00 173.10 174.09 3n5l s ILE 34 N -0.53 0.67 0.68 0.90 1.01 -0.87 -1.48 121.20 121.58 3n5l s ILE 34 Ca 0.44 -0.61 -0.17 0.00 0.00 0.00 0.00 60.65 60.31 3n5l s ILE 34 Cb -0.24 -1.12 0.01 0.00 0.01 0.00 0.00 42.46 41.11 3n5l s ILE 34 CO 0.31 -0.16 1.24 0.27 0.00 0.00 0.00 174.94 176.60 3n5l s ILE 35 N 1.79 2.24 -1.08 2.92 -4.36 -1.21 -4.51 121.20 117.00 3n5l s ILE 35 Ca -0.01 0.13 -0.08 0.00 -0.26 0.00 0.00 60.65 60.43 3n5l s ILE 35 Cb -0.17 -2.90 -0.10 0.00 1.25 0.00 0.00 42.46 40.54 3n5l s ILE 35 CO -0.08 -0.05 3.06 -1.54 0.24 0.00 0.00 174.94 176.58 3n5l n SER 36 N -2.21 7.59 0.19 4.36 3.41 -1.26 -4.56 113.62 121.14 3n5l n SER 36 Ca 0.14 -2.66 0.05 0.00 -0.26 0.00 0.00 58.87 56.14 3n5l n SER 36 Cb 0.49 -1.48 0.38 0.00 -0.26 0.00 0.00 64.21 63.34 3n5l n SER 36 CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 175.04 175.59 3n5l h THR 37 N 2.62 1.05 -4.27 6.66 1.35 -1.96 -3.41 112.91 114.95 3n5l h THR 37 Ca 0.64 -1.38 -0.23 0.00 -0.55 0.00 0.00 66.41 64.89 3n5l h THR 37 Cb 0.64 1.79 -0.12 0.00 -1.73 0.00 0.00 68.15 68.74 3n5l h THR 37 CO 1.27 0.37 -0.37 -1.61 -0.25 0.00 0.00 175.52 174.92 3n5l s GLU 38 N -3.90 1.52 0.75 4.72 2.02 -1.26 -2.08 118.70 120.47 3n5l s GLU 38 Ca -0.02 -1.60 -0.15 0.00 0.02 0.00 0.00 54.97 53.22 3n5l s GLU 38 Cb 0.13 0.37 0.05 0.00 0.10 0.00 0.00 34.13 34.77 3n5l s GLU 38 CO 0.70 -0.58 1.23 -1.54 0.02 0.00 0.00 175.26 175.08 3n5l s SER 39 N -3.17 4.00 0.35 -0.19 1.04 -1.26 -4.78 113.70 109.69 3n5l s SER 39 Ca 0.33 2.43 0.06 0.00 0.48 0.00 0.00 55.95 59.24 3n5l s SER 39 Cb 0.03 -2.60 0.64 0.00 0.10 0.00 0.00 66.02 64.19 3n5l s SER 39 CO 0.15 -2.40 1.87 0.77 0.98 0.00 0.00 173.24 174.62 3n5l h SER 40 N -0.39 0.42 -0.31 7.02 4.64 -1.98 -1.16 113.55 121.80 3n5l h SER 40 Ca -0.48 -0.08 0.01 0.00 -0.47 0.00 0.00 61.79 60.77 3n5l h SER 40 Cb 1.31 -0.11 -0.02 0.00 -0.31 0.00 0.00 62.40 63.27 3n5l h SER 40 CO 0.49 0.53 0.19 -0.61 -0.87 0.00 0.00 176.83 176.56 3n5l h GLN 41 N 0.43 0.38 -0.25 4.77 4.15 -2.00 0.37 115.11 122.96 3n5l h GLN 41 Ca 0.09 -0.02 0.01 0.00 0.77 0.00 0.00 58.65 59.49 3n5l h GLN 41 Cb 0.36 -0.09 -0.02 0.00 0.21 0.00 0.00 27.48 27.95 3n5l h GLN 41 CO 0.02 0.25 0.15 -0.91 -1.93 0.00 0.00 178.83 176.41 3n5l h ASN 42 N 0.39 0.25 -0.62 -0.69 4.21 -1.80 -3.11 115.58 114.21 3n5l h ASN 42 Ca 0.12 0.00 -0.03 0.00 1.21 0.00 0.00 56.30 57.59 3n5l h ASN 42 Cb -0.02 -0.05 -0.03 0.00 -1.12 0.00 0.00 38.32 37.10 3n5l h ASN 42 CO -0.04 0.18 0.25 -0.07 -1.29 0.00 0.00 177.43 176.46 3n5l h LEU 43 N 0.31 0.85 -0.86 1.61 3.38 -0.95 -2.76 115.31 116.90 3n5l h LEU 43 Ca 0.10 -0.17 0.11 0.00 0.09 0.00 0.00 57.88 58.01 3n5l h LEU 43 Cb -0.01 -0.22 -0.08 0.00 0.09 0.00 0.00 40.66 40.44 3n5l h LEU 43 CO -0.04 0.79 0.49 0.11 0.09 0.00 0.00 178.44 179.87 3n5l h LYS 44 N 0.86 0.75 -0.36 1.13 1.57 -0.93 0.24 116.57 119.83 3n5l h LYS 44 Ca 0.21 -0.05 -0.00 0.00 -1.87 0.00 0.00 60.65 58.94 3n5l h LYS 44 Cb 0.20 -0.17 -0.02 0.00 0.08 0.00 0.00 32.23 32.32 3n5l h LYS 44 CO -0.02 0.50 0.22 0.66 -0.57 0.00 0.00 179.45 180.24 3n5l h SER 45 N 0.77 0.42 0.15 0.86 4.64 -1.42 0.11 113.55 119.08 3n5l h SER 45 Ca 0.43 -0.02 -0.17 0.00 -0.47 0.00 0.00 61.79 61.57 3n5l h SER 45 Cb 0.47 -0.11 -0.03 0.00 -0.31 0.00 0.00 62.40 62.43 3n5l h SER 45 CO -0.28 0.32 -2.02 2.30 -0.87 0.00 0.00 176.83 176.28 3n5l n ILE 46 N -4.47 0.75 0.06 0.95 -5.35 -0.78 -4.53 119.36 106.00 3n5l n ILE 46 Ca 0.02 -0.67 -0.19 0.00 -0.27 0.00 0.00 62.75 61.64 3n5l n ILE 46 Cb 0.08 -0.31 -0.14 0.00 -1.74 0.00 0.00 39.64 37.52 3n5l n ILE 46 CO 0.00 0.00 0.00 -0.50 -1.76 0.00 0.00 176.55 174.29 3n5l h TRP 47 N 0.00 0.55 -0.73 4.28 4.06 -0.33 -3.37 115.95 120.42 3n5l h TRP 47 Ca -0.24 -0.40 0.07 0.00 2.06 0.00 0.00 58.89 60.38 3n5l h TRP 47 Cb 1.57 -0.02 -0.06 0.00 -1.00 0.00 0.00 29.16 29.65 3n5l h TRP 47 CO 0.00 1.51 0.40 0.93 -3.56 0.00 0.00 178.44 177.73 3n5l h GLU 48 N 0.08 0.70 -0.79 0.49 5.08 -1.17 -0.52 114.58 118.46 3n5l h GLU 48 Ca -0.30 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.02 3n5l h GLU 48 Cb 2.05 -0.16 -0.04 0.00 0.50 0.00 0.00 28.75 31.11 3n5l h GLU 48 CO 0.16 0.46 0.46 -1.35 -1.00 0.00 0.00 179.01 177.75 3n5l h PRO 49 N 0.72 1.07 -0.17 2.33 0.11 -1.79 -0.67 132.00 133.60 3n5l h PRO 49 Ca 0.34 -0.10 -0.02 0.00 0.11 0.00 0.00 66.00 66.33 3n5l h PRO 49 Cb 0.26 -0.22 -0.01 0.00 0.11 0.00 0.00 31.00 31.14 3n5l h PRO 49 CO -0.21 0.76 0.02 0.35 -0.21 0.00 0.00 178.00 178.71 3n5l h PHE 50 N 1.09 0.31 -0.14 0.65 3.57 -1.51 -2.43 116.94 118.47 3n5l h PHE 50 Ca 0.28 -0.05 -0.08 0.00 3.53 0.00 0.00 57.97 61.66 3n5l h PHE 50 Cb -0.03 -0.08 -0.01 0.00 2.79 0.00 0.00 35.95 38.61 3n5l h PHE 50 CO 0.00 0.46 -0.26 -0.07 -2.23 0.00 0.00 178.31 176.22 3n5l h LEU 51 N 0.07 0.25 -0.32 0.59 3.38 -0.92 -2.35 115.31 116.01 3n5l h LEU 51 Ca 0.05 -0.07 -0.02 0.00 0.09 0.00 0.00 57.88 57.92 3n5l h LEU 51 Cb 0.32 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.99 3n5l h LEU 51 CO 0.00 0.51 0.11 0.50 0.09 0.00 0.00 178.44 179.66 3n5l h LYS 52 N 0.23 0.48 -1.37 1.13 3.64 -1.07 0.57 116.57 120.17 3n5l h LYS 52 Ca 0.04 -0.10 0.00 0.00 -1.27 0.00 0.00 60.65 59.32 3n5l h LYS 52 Cb 0.58 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 32.33 3n5l h LYS 52 CO 0.04 0.51 0.00 -0.25 -2.27 0.00 0.00 179.45 177.48 3n5l n ASP 53 N -4.70 0.22 0.00 4.20 8.00 -0.89 -1.21 116.55 122.18 3n5l n ASP 53 Ca -0.02 -0.18 0.00 0.00 0.71 0.00 0.00 54.79 55.30 3n5l n ASP 53 Cb 0.16 -0.05 0.00 0.00 -0.02 0.00 0.00 41.12 41.21 3n5l n ASP 53 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 3n5l n SER 55 N 0.81 0.00 -0.04 -2.24 7.64 0.19 -1.05 113.62 118.92 3n5l n SER 55 Ca 0.00 0.00 -0.09 0.00 1.01 0.00 0.00 58.87 59.79 3n5l n SER 55 Cb 0.04 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.21 3n5l n SER 55 CO 0.00 0.00 0.00 1.56 -3.01 0.00 0.00 175.04 173.59 3n5l h GLN 56 N 0.00 0.20 -0.16 1.43 4.20 -1.40 -0.42 115.11 118.96 3n5l h GLN 56 Ca 0.00 -0.01 -0.22 0.00 0.06 0.00 0.00 58.65 58.48 3n5l h GLN 56 Cb 0.00 -0.05 0.01 0.00 0.30 0.00 0.00 27.48 27.74 3n5l h GLN 56 CO 0.00 0.13 -0.75 1.96 -0.67 0.00 0.00 178.83 179.50 3n5l h GLN 57 N 0.21 0.80 0.00 1.46 1.08 -1.36 -3.29 115.11 114.01 3n5l h GLN 57 Ca 0.08 -0.64 -0.00 0.00 -1.45 0.00 0.00 58.65 56.64 3n5l h GLN 57 Cb 0.03 0.13 -0.00 0.00 -0.05 0.00 0.00 27.48 27.59 3n5l h GLN 57 CO -0.06 1.25 -0.69 1.79 -0.95 0.00 0.00 178.83 180.17 3n5l h THR 58 N 0.54 0.01 0.00 -0.54 1.35 -1.79 -3.48 112.91 109.01 3n5l h THR 58 Ca -0.05 -1.02 0.00 0.00 -0.55 0.00 0.00 66.41 64.79 3n5l h THR 58 Cb 1.38 1.67 0.00 0.00 -1.73 0.00 0.00 68.15 69.47 3n5l h THR 58 CO 0.16 0.01 0.00 0.61 -0.25 0.00 0.00 175.52 176.04 3n5l n GLY 59 N 1.16 0.83 3.88 5.82 0.00 -0.17 -5.05 105.19 111.66 3n5l n GLY 59 Ca 0.01 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.73 3n5l n GLY 59 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3n5l s TYR 60 N -3.42 3.45 -0.36 1.61 2.02 -1.23 -4.66 117.35 114.76 3n5l s TYR 60 Ca 0.00 0.96 -0.24 0.00 -0.37 0.00 0.00 57.07 57.42 3n5l s TYR 60 Cb 0.00 -2.35 0.01 0.00 -0.40 0.00 0.00 41.96 39.22 3n5l s TYR 60 CO 0.00 0.04 0.82 -1.14 -1.57 0.00 0.00 175.55 173.70 3n5l s GLN 61 N -3.51 3.78 -0.25 -0.62 0.74 -0.46 -4.20 119.66 115.14 3n5l s GLN 61 Ca 0.49 0.39 -0.10 0.00 0.05 0.00 0.00 55.36 56.19 3n5l s GLN 61 Cb -0.10 -3.81 -0.05 0.00 1.10 0.00 0.00 33.01 30.15 3n5l s GLN 61 CO 0.27 -0.87 0.15 0.08 -0.55 0.00 0.00 175.29 174.37 3n5l s VAL 62 N 3.20 5.18 -0.07 1.34 1.01 -1.26 -0.99 120.40 128.80 3n5l s VAL 62 Ca 0.33 0.12 0.04 0.00 0.00 0.00 0.00 61.98 62.47 3n5l s VAL 62 Cb -0.13 -3.43 -0.02 0.00 0.00 0.00 0.00 36.38 32.81 3n5l s VAL 62 CO 0.17 0.32 -0.20 -0.54 0.00 0.00 0.00 175.10 174.86 3n5l s LYS 63 N 1.28 2.71 0.35 2.72 1.02 0.22 -4.86 119.74 123.19 3n5l s LYS 63 Ca 0.07 -0.81 -0.28 0.00 0.02 0.00 0.00 55.97 54.97 3n5l s LYS 63 Cb -0.14 -2.31 -0.10 0.00 -0.52 0.00 0.00 37.83 34.75 3n5l s LYS 63 CO 0.06 0.41 1.32 0.00 -0.92 0.00 0.00 175.35 176.22 3n5l s ALA 64 N -0.21 3.44 -0.23 5.17 0.00 -1.26 -0.50 121.76 128.17 3n5l s ALA 64 Ca -0.01 1.27 0.02 0.00 0.00 0.00 0.00 51.96 53.24 3n5l s ALA 64 Cb -0.13 -3.49 0.05 0.00 0.00 0.00 0.00 23.12 19.54 3n5l s ALA 64 CO 0.03 -0.72 -0.13 0.12 0.00 0.00 0.00 175.76 175.06 3n5l s PHE 65 N -1.17 2.95 0.30 0.00 2.19 0.76 -4.77 117.98 118.24 3n5l s PHE 65 Ca 0.51 -1.99 0.07 0.00 0.33 0.00 0.00 56.93 55.86 3n5l s PHE 65 Cb -0.40 -1.86 -0.03 0.00 -1.31 0.00 0.00 43.02 39.42 3n5l s PHE 65 CO 0.53 -0.83 0.27 -0.06 1.83 0.00 0.00 175.22 176.96 3n5l s PHE 66 N 1.22 3.03 0.19 10.12 0.08 -1.26 -2.05 117.98 129.30 3n5l s PHE 66 Ca -0.04 -0.21 -0.13 0.00 0.12 0.00 0.00 56.93 56.67 3n5l s PHE 66 Cb -0.17 -1.65 0.01 0.00 -0.57 0.00 0.00 43.02 40.64 3n5l s PHE 66 CO -0.08 0.31 0.42 0.00 -0.10 0.00 0.00 175.22 175.78 3n5l s ALA 67 N -2.21 -0.46 0.05 5.36 0.00 -1.26 -4.96 121.76 118.28 3n5l s ALA 67 Ca 0.38 -0.59 0.30 0.00 0.00 0.00 0.00 51.96 52.04 3n5l s ALA 67 Cb -0.07 0.89 1.12 0.00 0.00 0.00 0.00 23.12 25.06 3n5l s ALA 67 CO 0.26 -0.75 1.90 -1.00 0.00 0.00 0.00 175.76 176.17 3n5l h PRO 68 N 2.34 0.00 -4.15 0.00 0.13 -1.98 -3.41 132.00 124.93 3n5l h PRO 68 Ca -0.29 0.00 -0.21 0.00 -0.87 0.00 0.00 66.00 64.62 3n5l h PRO 68 Cb 1.25 0.00 -0.10 0.00 0.13 0.00 0.00 31.00 32.27 3n5l h PRO 68 CO 0.41 0.07 -0.29 0.16 -0.23 0.00 0.00 178.00 178.12 3n5l s ASP 69 N -5.90 0.47 0.29 1.44 1.47 -1.26 -4.92 116.67 108.25 3n5l s ASP 69 Ca 0.02 -1.31 0.06 0.00 1.18 0.00 0.00 52.55 52.49 3n5l s ASP 69 Cb 0.09 0.56 0.43 0.00 -0.34 0.00 0.00 42.92 43.66 3n5l s ASP 69 CO 0.59 -1.12 1.69 1.88 0.68 0.00 0.00 175.17 178.89 3n5l h TYR 70 N 2.28 0.33 -0.95 2.11 -1.99 -1.93 -2.66 116.97 114.16 3n5l h TYR 70 Ca -0.29 -0.09 0.19 0.00 2.00 0.00 0.00 58.73 60.54 3n5l h TYR 70 Cb 1.24 -0.07 -0.08 0.00 2.00 0.00 0.00 36.73 39.82 3n5l h TYR 70 CO 0.89 0.65 0.61 0.00 -0.00 0.00 0.00 178.16 180.30 3n5l h ALA 71 N 1.35 1.95 -0.45 3.88 0.00 -1.96 -1.11 119.26 122.91 3n5l h ALA 71 Ca 0.02 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.98 3n5l h ALA 71 Cb 0.82 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.52 3n5l h ALA 71 CO 0.06 -0.26 0.30 0.78 0.00 0.00 0.00 179.25 180.13 3n5l h GLY 72 N 0.59 0.64 0.39 0.00 0.00 -1.86 0.47 103.07 103.30 3n5l h GLY 72 Ca 0.51 -0.24 -0.05 0.00 0.00 0.00 0.00 47.33 47.56 3n5l h GLY 72 CO -0.26 0.23 -0.18 -2.22 0.00 0.00 0.00 176.54 174.12 3n5l h ILE 73 N 0.62 1.57 -0.14 2.60 1.08 -1.36 -1.57 117.51 120.30 3n5l h ILE 73 Ca 0.17 -1.91 0.02 0.00 -0.39 0.00 0.00 64.86 62.75 3n5l h ILE 73 Cb -0.07 2.79 -0.02 0.00 -3.07 0.00 0.00 36.82 36.45 3n5l h ILE 73 CO -0.04 0.52 0.02 0.40 -0.69 0.00 0.00 178.15 178.36 3n5l h ILE 74 N -0.57 0.92 -0.26 -0.67 2.04 -1.16 -2.65 117.51 115.15 3n5l h ILE 74 Ca -0.02 -0.02 -0.13 0.00 1.00 0.00 0.00 64.86 65.68 3n5l h ILE 74 Cb 0.94 0.84 -0.01 0.00 -0.74 0.00 0.00 36.82 37.86 3n5l h ILE 74 CO 0.04 0.01 -0.37 1.56 0.00 0.00 0.00 178.15 179.39 3n5l h GLN 75 N 0.07 0.59 -0.23 2.37 1.08 -1.02 -1.13 115.11 116.85 3n5l h GLN 75 Ca 0.06 -0.29 0.00 0.00 -1.45 0.00 0.00 58.65 56.98 3n5l h GLN 75 Cb 0.07 -0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.49 3n5l h GLN 75 CO -0.10 0.87 0.00 0.41 -0.95 0.00 0.00 178.83 179.07 3n5l n GLY 76 N -0.06 0.00 2.65 3.46 0.00 -0.59 -2.13 105.19 108.51 3n5l n GLY 76 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.01 3n5l n GLY 76 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 3n5l n ARG 78 N 0.49 0.00 -0.89 1.61 0.63 -0.43 -0.57 116.66 117.49 3n5l n ARG 78 Ca 0.00 0.00 -0.05 0.00 -0.92 0.00 0.00 57.85 56.88 3n5l n ARG 78 Cb 0.00 0.00 0.26 0.00 0.45 0.00 0.00 32.46 33.17 3n5l n ARG 78 CO 0.00 0.00 0.00 1.19 -2.51 0.00 0.00 177.63 176.31 3n5l n PHE 79 N 0.00 1.96 -2.11 -0.14 3.72 -0.91 -4.93 117.46 115.06 3n5l n PHE 79 Ca 0.00 -1.30 -0.21 0.00 -0.05 0.00 0.00 57.45 55.89 3n5l n PHE 79 Cb 0.00 -0.61 -0.04 0.00 -0.94 0.00 0.00 39.48 37.89 3n5l n PHE 79 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46 3n5l n ASP 80 N -0.53 -5.80 0.10 4.37 8.00 -0.96 -4.85 116.55 116.87 3n5l n ASP 80 Ca 0.38 0.18 0.12 0.00 0.71 0.00 0.00 54.79 56.18 3n5l n ASP 80 Cb 1.26 -4.93 0.04 0.00 -0.02 0.00 0.00 41.12 37.47 3n5l n ASP 80 CO 0.00 0.00 0.00 0.11 -0.39 0.00 0.00 177.20 176.92 3n5l h LYS 81 N 0.00 0.00 -5.17 -1.24 1.57 -1.17 -3.44 116.57 107.11 3n5l h LYS 81 Ca -0.47 0.00 -0.66 0.00 -1.87 0.00 0.00 60.65 57.65 3n5l h LYS 81 Cb 1.37 0.00 -0.34 0.00 0.08 0.00 0.00 32.23 33.34 3n5l h LYS 81 CO 0.60 0.00 -0.87 0.08 -0.57 0.00 0.00 179.45 178.70 3n5l s VAL 82 N -3.31 1.94 -0.17 0.50 1.01 -1.14 -4.76 120.40 114.47 3n5l s VAL 82 Ca 0.01 -0.93 -0.02 0.00 0.00 0.00 0.00 61.98 61.04 3n5l s VAL 82 Cb 0.10 -1.71 -0.23 0.00 0.00 0.00 0.00 36.38 34.55 3n5l s VAL 82 CO 0.77 0.53 0.15 0.47 0.00 0.00 0.00 175.10 177.03 3n5l n ASP 83 N 3.83 1.98 -3.84 3.32 8.00 0.09 -4.71 116.55 125.22 3n5l n ASP 83 Ca -0.20 0.09 -0.12 0.00 0.71 0.00 0.00 54.79 55.27 3n5l n ASP 83 Cb 0.52 -0.63 -0.09 0.00 -0.02 0.00 0.00 41.12 40.90 3n5l n ASP 83 CO 0.00 0.00 0.00 -0.51 -0.39 0.00 0.00 177.20 176.30 3n5l s ILE 84 N -2.54 0.08 -0.02 0.53 2.07 -1.14 -1.70 121.20 118.47 3n5l s ILE 84 Ca -0.26 -0.66 -0.13 0.00 -1.41 0.00 0.00 60.65 58.18 3n5l s ILE 84 Cb 0.07 -0.51 0.02 0.00 0.13 0.00 0.00 42.46 42.17 3n5l s ILE 84 CO 0.71 -0.36 0.28 0.00 -1.91 0.00 0.00 174.94 173.66 3n5l s ALA 85 N -1.47 -0.72 -0.33 1.50 0.00 0.22 -0.32 121.76 120.64 3n5l s ALA 85 Ca -0.14 0.30 -0.23 0.00 0.00 0.00 0.00 51.96 51.89 3n5l s ALA 85 Cb -0.07 0.04 0.00 0.00 0.00 0.00 0.00 23.12 23.10 3n5l s ALA 85 CO 0.02 -0.24 0.75 -0.46 0.00 0.00 0.00 175.76 175.82 3n5l s TRP 86 N -1.23 3.18 0.20 0.00 -0.00 -0.55 -1.41 118.94 119.13 3n5l s TRP 86 Ca -0.13 0.66 0.10 0.00 -0.00 0.00 0.00 56.10 56.73 3n5l s TRP 86 Cb -0.05 -3.22 -0.04 0.00 -0.00 0.00 0.00 33.47 30.15 3n5l s TRP 86 CO 0.04 -0.60 -0.19 0.71 -0.00 0.00 0.00 176.95 176.91 3n5l s TYR 87 N 2.91 1.99 0.94 5.86 2.02 -1.18 -3.33 117.35 126.56 3n5l s TYR 87 Ca 0.30 -0.44 -0.12 0.00 -0.37 0.00 0.00 57.07 56.44 3n5l s TYR 87 Cb -0.14 -0.95 0.15 0.00 -0.40 0.00 0.00 41.96 40.63 3n5l s TYR 87 CO 0.14 0.45 1.13 0.20 -1.57 0.00 0.00 175.55 175.89 3n5l s GLY 88 N -2.96 1.57 0.21 0.71 0.00 -1.26 -3.64 107.32 101.95 3n5l s GLY 88 Ca 0.21 -0.51 -0.09 0.00 0.00 0.00 0.00 44.72 44.32 3n5l s GLY 88 CO 0.09 0.07 1.82 3.43 0.00 0.00 0.00 173.10 178.50 3n5l h ASN 89 N -1.61 0.97 -0.34 1.64 2.35 -1.90 -0.21 115.58 116.48 3n5l h ASN 89 Ca -0.51 -0.11 -0.03 0.00 -0.55 0.00 0.00 56.30 55.10 3n5l h ASN 89 Cb 1.33 -0.25 -0.01 0.00 0.05 0.00 0.00 38.32 39.44 3n5l h ASN 89 CO 0.60 0.80 0.09 0.50 -1.65 0.00 0.00 177.43 177.77 3n5l h LYS 90 N 1.06 0.54 -0.49 0.81 3.64 -1.91 -2.91 116.57 117.31 3n5l h LYS 90 Ca 0.27 -0.13 -0.07 0.00 -1.27 0.00 0.00 60.65 59.45 3n5l h LYS 90 Cb 0.06 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 31.78 3n5l h LYS 90 CO -0.04 0.60 0.03 0.00 -2.27 0.00 0.00 179.45 177.77 3n5l h ALA 91 N 0.93 1.15 0.00 5.00 0.00 -1.31 -1.84 119.26 123.19 3n5l h ALA 91 Ca 0.11 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.77 3n5l h ALA 91 Cb 0.29 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.89 3n5l h ALA 91 CO 0.00 0.56 0.00 0.00 0.00 0.00 0.00 179.25 179.81 3n5l n ALA 92 N -2.47 1.43 0.00 0.00 0.00 -0.11 -0.62 120.51 118.74 3n5l n ALA 92 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.47 3n5l n ALA 92 Cb 0.28 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.73 3n5l n ALA 92 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 3n5l n GLU 94 N 0.87 0.00 -0.10 0.00 -0.58 -0.69 -0.92 120.64 119.22 3n5l n GLU 94 Ca 0.00 0.00 -0.13 0.00 -0.42 0.00 0.00 57.16 56.61 3n5l n GLU 94 Cb 0.02 0.00 -0.04 0.00 -0.57 0.00 0.00 31.44 30.85 3n5l n GLU 94 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3n5l h ALA 95 N 0.00 0.43 -0.54 0.62 0.00 -1.13 0.36 119.26 118.99 3n5l h ALA 95 Ca 0.00 -0.38 0.01 0.00 0.00 0.00 0.00 54.91 54.53 3n5l h ALA 95 Cb 0.00 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.67 3n5l h ALA 95 CO 0.00 0.41 0.36 0.28 0.00 0.00 0.00 179.25 180.30 3n5l h VAL 96 N 0.43 1.14 0.04 0.00 2.07 -1.21 0.30 116.25 119.02 3n5l h VAL 96 Ca 0.05 -0.25 -0.22 0.00 0.82 0.00 0.00 66.70 67.10 3n5l h VAL 96 Cb 0.81 0.34 -0.01 0.00 -1.52 0.00 0.00 31.29 30.91 3n5l h VAL 96 CO 0.06 0.13 -1.01 0.44 0.02 0.00 0.00 177.57 177.22 3n5l h ASP 97 N 0.73 0.24 0.00 0.57 3.32 -1.76 -3.38 116.42 116.14 3n5l h ASP 97 Ca 0.20 -0.23 0.00 0.00 0.02 0.00 0.00 57.03 57.02 3n5l h ASP 97 Cb -0.08 -0.08 0.00 0.00 0.22 0.00 0.00 39.33 39.39 3n5l h ASP 97 CO -0.04 1.10 -0.15 0.54 -1.72 0.00 0.00 179.24 178.97 3n5l n ARG 98 N -3.55 5.24 -0.34 3.56 1.74 0.12 -4.80 116.66 118.62 3n5l n ARG 98 Ca -0.04 0.00 0.05 0.00 -0.77 0.00 0.00 57.85 57.09 3n5l n ARG 98 Cb 0.90 -0.53 0.07 0.00 -1.02 0.00 0.00 32.46 31.88 3n5l n ARG 98 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3n5l n ALA 99 N -0.96 2.21 -3.47 7.54 0.00 0.94 -4.82 120.51 121.94 3n5l n ALA 99 Ca 0.00 -1.91 -0.25 0.00 0.00 0.00 0.00 53.44 51.28 3n5l n ALA 99 Cb 0.00 -0.45 0.00 0.00 0.00 0.00 0.00 19.45 19.01 3n5l n ALA 99 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.50 175.11 3n5l n HIS 100 N -0.70 -1.89 -2.43 0.00 1.44 -0.95 -4.04 115.22 106.65 3n5l n HIS 100 Ca 0.09 0.57 -0.28 0.00 -2.01 0.00 0.00 57.72 56.08 3n5l n HIS 100 Cb 0.69 -3.29 0.00 0.00 0.12 0.00 0.00 29.99 27.51 3n5l n HIS 100 CO 0.00 0.00 0.00 0.20 -2.81 0.00 0.00 176.34 173.73 3n5l s GLY 101 N -2.85 1.55 -0.08 -1.39 0.00 -0.55 -0.33 107.32 103.67 3n5l s GLY 101 Ca 0.46 -0.38 -0.05 0.00 0.00 0.00 0.00 44.72 44.75 3n5l s GLY 101 CO 0.56 -0.19 0.20 1.85 0.00 0.00 0.00 173.10 175.52 3n5l s GLU 102 N -4.84 0.17 0.08 2.90 2.12 0.37 -4.29 118.70 115.20 3n5l s GLU 102 Ca 0.50 0.43 -0.30 0.00 0.36 0.00 0.00 54.97 55.95 3n5l s GLU 102 Cb -0.10 -0.11 -0.06 0.00 0.26 0.00 0.00 34.13 34.12 3n5l s GLU 102 CO 0.47 -0.14 1.13 0.42 -0.54 0.00 0.00 175.26 176.60 3n5l s ILE 103 N 1.04 4.16 0.00 -3.70 1.01 -1.26 -1.16 121.20 121.29 3n5l s ILE 103 Ca -0.08 1.62 0.00 0.00 0.00 0.00 0.00 60.65 62.19 3n5l s ILE 103 Cb -0.09 -4.03 0.00 0.00 0.01 0.00 0.00 42.46 38.34 3n5l s ILE 103 CO -0.06 0.16 0.00 2.22 0.00 0.00 0.00 174.94 177.26 3n5l n PHE 104 N 3.57 0.00 -3.72 3.97 -1.74 -0.88 -4.17 117.46 114.48 3n5l n PHE 104 Ca 0.07 0.00 -0.10 0.00 -0.56 0.00 0.00 57.45 56.86 3n5l n PHE 104 Cb 0.47 0.00 -0.03 0.00 1.52 0.00 0.00 39.48 41.44 3n5l n PHE 104 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 3n5l s ALA 105 N -0.89 -1.02 -0.01 1.98 0.00 -1.22 -2.91 121.76 117.69 3n5l s ALA 105 Ca 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 51.96 51.79 3n5l s ALA 105 Cb 0.00 0.86 0.01 0.00 0.00 0.00 0.00 23.12 23.99 3n5l s ALA 105 CO 0.00 -0.82 -0.01 -1.14 0.00 0.00 0.00 175.76 173.79 3n5l s GLN 106 N -3.87 0.13 0.50 0.00 0.74 0.76 -0.26 119.66 117.67 3n5l s GLN 106 Ca 0.09 -0.02 -0.20 0.00 0.05 0.00 0.00 55.36 55.28 3n5l s GLN 106 Cb -0.01 -0.18 -0.08 0.00 1.10 0.00 0.00 33.01 33.84 3n5l s GLN 106 CO -0.03 -0.01 1.06 0.95 -0.55 0.00 0.00 175.29 176.71 3n5l s THR 107 N 0.21 3.66 -0.05 -0.34 -4.23 -0.28 -0.85 115.64 113.76 3n5l s THR 107 Ca -0.02 1.03 0.04 0.00 -1.18 0.00 0.00 61.69 61.56 3n5l s THR 107 Cb -0.03 -3.42 -0.00 0.00 1.34 0.00 0.00 72.50 70.39 3n5l s THR 107 CO -0.01 -0.23 -0.17 -0.69 -0.54 0.00 0.00 174.62 172.98 3n5l s VAL 108 N -1.95 1.45 0.47 2.29 1.01 -0.74 -4.46 120.40 118.47 3n5l s VAL 108 Ca 0.68 -0.72 -0.25 0.00 0.00 0.00 0.00 61.98 61.69 3n5l s VAL 108 Cb -0.18 -1.25 -0.08 0.00 0.00 0.00 0.00 36.38 34.88 3n5l s VAL 108 CO 0.22 0.42 1.41 0.00 0.00 0.00 0.00 175.10 177.15 3n5l s ALA 109 N 0.06 3.15 0.35 5.51 0.00 -1.26 -0.92 121.76 128.66 3n5l s ALA 109 Ca -0.04 1.44 0.07 0.00 0.00 0.00 0.00 51.96 53.43 3n5l s ALA 109 Cb -0.12 -3.59 0.77 0.00 0.00 0.00 0.00 23.12 20.19 3n5l s ALA 109 CO 0.02 -1.23 1.89 0.00 0.00 0.00 0.00 175.76 176.44 3n5l h ALA 110 N 2.14 1.77 0.00 0.00 0.00 -1.12 -1.26 119.26 120.80 3n5l h ALA 110 Ca -0.51 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.41 3n5l h ALA 110 Cb 1.27 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.91 3n5l h ALA 110 CO 0.60 0.02 0.00 -1.13 0.00 0.00 0.00 179.25 178.74 3n5l n SER 111 N -4.54 0.41 0.00 0.00 3.41 -1.26 -4.62 113.62 107.02 3n5l n SER 111 Ca 0.16 0.60 0.00 0.00 -0.26 0.00 0.00 58.87 59.37 3n5l n SER 111 Cb 0.40 -0.69 0.00 0.00 -0.26 0.00 0.00 64.21 63.66 3n5l n SER 111 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3n5l n GLY 112 N 0.01 0.96 3.63 5.00 0.00 -0.48 -5.04 105.19 109.28 3n5l n GLY 112 Ca 0.03 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.64 3n5l n GLY 112 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3n5l n ALA 113 N 0.39 0.47 1.26 4.61 0.00 -1.26 -4.88 120.51 121.09 3n5l n ALA 113 Ca 0.00 0.19 0.02 0.00 0.00 0.00 0.00 53.44 53.65 3n5l n ALA 113 Cb 0.00 -2.14 0.07 0.00 0.00 0.00 0.00 19.45 17.38 3n5l n ALA 113 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 3n5l n PRO 114 N -0.12 1.46 -3.44 0.00 -0.04 -1.26 -4.02 135.00 127.58 3n5l n PRO 114 Ca 0.10 -0.53 0.00 0.00 -0.04 0.00 0.00 63.50 63.03 3n5l n PRO 114 Cb 0.41 -1.28 0.00 0.00 -0.04 0.00 0.00 33.50 32.59 3n5l n PRO 114 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3n5l n GLY 115 N 0.52 -0.53 3.34 0.55 0.00 -1.26 -4.18 105.19 103.63 3n5l n GLY 115 Ca 0.05 -0.86 -0.19 0.00 0.00 0.00 0.00 46.02 45.02 3n5l n GLY 115 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3n5l s TYR 116 N -3.02 1.64 0.04 1.61 1.13 -0.08 -4.92 117.35 113.76 3n5l s TYR 116 Ca 0.00 -1.61 0.04 0.00 -1.41 0.00 0.00 57.07 54.09 3n5l s TYR 116 Cb 0.00 -0.58 -0.02 0.00 -1.10 0.00 0.00 41.96 40.26 3n5l s TYR 116 CO 0.00 -0.95 -0.11 -1.58 -2.51 0.00 0.00 175.55 170.39 3n5l s TRP 117 N -3.29 0.98 0.40 -3.49 0.51 -1.26 -0.40 118.94 112.39 3n5l s TRP 117 Ca 0.39 -0.39 -0.19 0.00 -2.12 0.00 0.00 56.10 53.78 3n5l s TRP 117 Cb 0.01 -0.58 -0.10 0.00 -0.81 0.00 0.00 33.47 31.99 3n5l s TRP 117 CO 0.27 0.00 0.89 0.45 -0.51 0.00 0.00 176.95 178.05 3n5l s SER 118 N -1.31 6.89 0.08 2.95 0.15 -1.26 -1.37 113.70 119.83 3n5l s SER 118 Ca -0.03 1.57 0.05 0.00 0.70 0.00 0.00 55.95 58.25 3n5l s SER 118 Cb -0.08 -2.49 -0.03 0.00 -1.71 0.00 0.00 66.02 61.70 3n5l s SER 118 CO 0.01 -0.32 -0.14 -0.76 1.20 0.00 0.00 173.24 173.23 3n5l s LEU 119 N -3.13 2.30 -0.14 3.45 1.43 -0.24 -1.09 118.68 121.26 3n5l s LEU 119 Ca 0.60 -0.66 -0.06 0.00 -1.03 0.00 0.00 54.13 52.98 3n5l s LEU 119 Cb -0.09 -0.54 -0.04 0.00 0.03 0.00 0.00 46.19 45.55 3n5l s LEU 119 CO 0.14 -0.09 0.05 -0.76 0.23 0.00 0.00 176.35 175.93 3n5l s LEU 120 N -1.89 3.83 0.08 1.79 1.43 -0.71 -1.36 118.68 121.85 3n5l s LEU 120 Ca 0.01 0.16 0.09 0.00 -1.03 0.00 0.00 54.13 53.36 3n5l s LEU 120 Cb -0.09 -1.94 -0.03 0.00 0.03 0.00 0.00 46.19 44.16 3n5l s LEU 120 CO 0.02 0.27 -0.23 0.27 0.23 0.00 0.00 176.35 176.91 3n5l s ILE 121 N -0.23 2.44 0.22 -0.59 -4.36 -0.24 -0.97 121.20 117.46 3n5l s ILE 121 Ca 0.08 -1.46 0.01 0.00 -0.26 0.00 0.00 60.65 59.02 3n5l s ILE 121 Cb -0.12 -2.03 -0.05 0.00 1.25 0.00 0.00 42.46 41.51 3n5l s ILE 121 CO 0.01 0.25 0.07 0.00 0.24 0.00 0.00 174.94 175.51 3n5l s ALA 122 N -0.95 1.54 0.43 2.27 0.00 -0.80 -1.62 121.76 122.63 3n5l s ALA 122 Ca 0.14 -1.76 -0.23 0.00 0.00 0.00 0.00 51.96 50.11 3n5l s ALA 122 Cb -0.10 0.92 -0.08 0.00 0.00 0.00 0.00 23.12 23.85 3n5l s ALA 122 CO 0.05 -0.43 1.08 1.21 0.00 0.00 0.00 175.76 177.67 3n5l s ASN 123 N -3.25 6.54 0.59 0.00 3.84 -1.26 -1.00 114.94 120.40 3n5l s ASN 123 Ca 0.33 2.09 0.29 0.00 0.21 0.00 0.00 52.86 55.78 3n5l s ASN 123 Cb 0.07 -2.59 1.64 0.00 -0.55 0.00 0.00 41.25 39.83 3n5l s ASN 123 CO 0.10 -0.65 2.08 0.07 -2.79 0.00 0.00 177.10 175.92 3n5l h LYS 124 N 2.22 0.00 -0.00 0.43 2.10 -0.54 0.09 116.57 120.88 3n5l h LYS 124 Ca -0.49 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.16 3n5l h LYS 124 Cb 1.22 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.55 3n5l h LYS 124 CO 0.61 0.00 -0.14 -0.25 -2.00 0.00 0.00 179.45 177.68 3n5l n ASP 125 N -3.80 0.52 -4.77 7.07 8.00 -1.26 -4.93 116.55 117.38 3n5l n ASP 125 Ca 0.02 -0.56 -0.38 0.00 0.71 0.00 0.00 54.79 54.59 3n5l n ASP 125 Cb 0.35 -0.05 -0.02 0.00 -0.02 0.00 0.00 41.12 41.38 3n5l n ASP 125 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 3n5l s SER 126 N -2.51 6.51 0.00 -2.24 0.15 0.02 -4.93 113.70 110.69 3n5l s SER 126 Ca 0.27 2.26 0.29 0.00 0.70 0.00 0.00 55.95 59.47 3n5l s SER 126 Cb 0.20 -2.60 1.32 0.00 -1.71 0.00 0.00 66.02 63.22 3n5l s SER 126 CO 0.49 -0.68 1.95 0.29 1.20 0.00 0.00 173.24 176.49 3n5l n LYS 127 N -0.08 0.23 -2.56 5.44 5.02 -1.26 -4.67 118.16 120.27 3n5l n LYS 127 Ca 0.05 -0.02 -0.43 0.00 -2.02 0.00 0.00 58.31 55.89 3n5l n LYS 127 Cb 0.48 -1.50 -0.02 0.00 -0.02 0.00 0.00 35.03 33.97 3n5l n LYS 127 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 3n5l s ILE 128 N -2.78 4.37 -0.09 -0.18 -1.09 -1.26 -4.86 121.20 115.31 3n5l s ILE 128 Ca 0.21 1.56 0.01 0.00 -2.23 0.00 0.00 60.65 60.20 3n5l s ILE 128 Cb 0.20 -4.34 0.00 0.00 -1.58 0.00 0.00 42.46 36.73 3n5l s ILE 128 CO 0.51 -0.51 0.32 0.47 -1.23 0.00 0.00 174.94 174.49 3n5l n ASP 129 N 7.17 0.63 -3.73 3.58 8.00 -1.26 -4.92 116.55 126.02 3n5l n ASP 129 Ca 0.13 -0.81 -0.08 0.00 0.71 0.00 0.00 54.79 54.73 3n5l n ASP 129 Cb 0.47 0.44 -0.02 0.00 -0.02 0.00 0.00 41.12 41.99 3n5l n ASP 129 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 3n5l s SER 130 N -0.52 -0.33 0.19 -2.24 1.04 -1.26 -4.76 113.70 105.81 3n5l s SER 130 Ca 0.01 -0.41 -0.12 0.00 0.48 0.00 0.00 55.95 55.90 3n5l s SER 130 Cb 0.01 0.66 0.14 0.00 0.10 0.00 0.00 66.02 66.93 3n5l s SER 130 CO 0.02 -1.18 1.82 0.25 0.98 0.00 0.00 173.24 175.13 3n5l h LEU 131 N 2.00 0.57 -0.82 2.42 5.85 -1.99 -2.57 115.31 120.76 3n5l h LEU 131 Ca -0.23 0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.48 3n5l h LEU 131 Cb 1.26 -0.11 -0.04 0.00 0.37 0.00 0.00 40.66 42.14 3n5l h LEU 131 CO 0.27 0.39 0.45 -0.08 -0.34 0.00 0.00 178.44 179.14 3n5l h GLU 132 N 0.69 1.14 -0.49 1.25 4.81 -1.96 -0.82 114.58 119.21 3n5l h GLU 132 Ca 0.24 -0.13 0.00 0.00 -0.13 0.00 0.00 59.36 59.34 3n5l h GLU 132 Cb 0.04 -0.22 0.00 0.00 0.63 0.00 0.00 28.75 29.20 3n5l h GLU 132 CO -0.11 0.84 0.00 -0.25 -0.73 0.00 0.00 179.01 178.76 3n5l n ASP 133 N -4.40 0.07 0.00 1.04 8.00 -0.97 -1.02 116.55 119.26 3n5l n ASP 133 Ca 0.08 -0.09 0.00 0.00 0.71 0.00 0.00 54.79 55.49 3n5l n ASP 133 Cb 0.09 -0.02 0.00 0.00 -0.02 0.00 0.00 41.12 41.17 3n5l n ASP 133 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 3n5l n LEU 135 N 0.59 0.00 0.20 0.64 4.77 -0.31 -1.97 117.00 120.92 3n5l n LEU 135 Ca 0.00 0.00 0.05 0.00 -0.03 0.00 0.00 56.01 56.03 3n5l n LEU 135 Cb 0.01 0.00 0.51 0.00 -2.33 0.00 0.00 43.42 41.62 3n5l n LEU 135 CO 0.00 0.00 0.96 0.00 -1.33 0.00 0.00 177.39 177.02 3n5l h ALA 136 N 0.00 1.74 -0.25 -1.18 0.00 -1.32 -3.04 119.26 115.21 3n5l h ALA 136 Ca 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.79 3n5l h ALA 136 Cb 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.75 3n5l h ALA 136 CO 0.00 0.19 0.00 0.09 0.00 0.00 0.00 179.25 179.53 3n5l n ASN 137 N -4.38 3.03 -0.24 0.00 3.02 -0.83 -4.84 115.26 111.02 3n5l n ASN 137 Ca -0.02 -2.37 0.05 0.00 -0.03 0.00 0.00 54.58 52.21 3n5l n ASN 137 Cb 0.20 -0.30 0.17 0.00 -0.61 0.00 0.00 39.78 39.24 3n5l n ASN 137 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3n5l h ALA 138 N 1.53 0.92 -0.03 5.41 0.00 -1.79 -0.78 119.26 124.51 3n5l h ALA 138 Ca 0.00 0.16 0.01 0.00 0.00 0.00 0.00 54.91 55.08 3n5l h ALA 138 Cb 0.92 0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.93 3n5l h ALA 138 CO 0.06 -0.33 0.11 1.57 0.00 0.00 0.00 179.25 180.66 3n5l h LYS 139 N 0.27 0.00 -0.03 0.00 2.10 -1.80 0.68 116.57 117.80 3n5l h LYS 139 Ca 0.40 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.05 3n5l h LYS 139 Cb 0.67 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.00 3n5l h LYS 139 CO -0.49 0.00 -0.01 -1.13 -2.00 0.00 0.00 179.45 175.81 3n5l n SER 140 N -3.24 2.77 -4.59 7.07 3.41 -0.30 -3.48 113.62 115.26 3n5l n SER 140 Ca -0.02 -1.92 -0.28 0.00 -0.26 0.00 0.00 58.87 56.39 3n5l n SER 140 Cb 0.18 0.01 -0.09 0.00 -0.26 0.00 0.00 64.21 64.06 3n5l n SER 140 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 3n5l s LEU 141 N -2.01 3.06 -0.16 1.04 1.43 0.23 -4.86 118.68 117.41 3n5l s LEU 141 Ca 0.29 -0.46 -0.09 0.00 -1.03 0.00 0.00 54.13 52.84 3n5l s LEU 141 Cb 0.20 -1.79 -0.05 0.00 0.03 0.00 0.00 46.19 44.59 3n5l s LEU 141 CO 0.31 0.13 0.13 -0.89 0.23 0.00 0.00 176.35 176.27 3n5l s THR 142 N -1.50 5.44 -0.14 5.49 2.01 -1.26 -0.85 115.64 124.83 3n5l s THR 142 Ca 0.24 0.19 0.02 0.00 0.31 0.00 0.00 61.69 62.45 3n5l s THR 142 Cb -0.10 -3.43 0.01 0.00 0.01 0.00 0.00 72.50 68.99 3n5l s THR 142 CO 0.15 0.52 -0.21 0.12 -0.69 0.00 0.00 174.62 174.51 3n5l s PHE 143 N -0.27 2.59 -0.71 4.92 5.36 -0.21 -2.01 117.98 127.65 3n5l s PHE 143 Ca 0.11 -1.33 -0.20 0.00 -0.96 0.00 0.00 56.93 54.55 3n5l s PHE 143 Cb -0.11 -1.78 0.10 0.00 -0.34 0.00 0.00 43.02 40.89 3n5l s PHE 143 CO 0.01 -0.62 0.91 0.20 -1.46 0.00 0.00 175.22 174.25 3n5l s GLY 144 N 0.90 1.71 0.83 13.12 0.00 0.31 -1.71 107.32 122.49 3n5l s GLY 144 Ca -0.05 -2.27 -0.12 0.00 0.00 0.00 0.00 44.72 42.27 3n5l s GLY 144 CO -0.03 1.85 1.18 0.21 0.00 0.00 0.00 173.10 176.31 3n5l s ASN 145 N 3.58 4.27 0.65 1.64 3.84 0.32 -1.67 114.94 127.57 3n5l s ASN 145 Ca 0.21 0.77 0.02 0.00 0.21 0.00 0.00 52.86 54.07 3n5l s ASN 145 Cb -0.16 -1.25 0.12 0.00 -0.55 0.00 0.00 41.25 39.41 3n5l s ASN 145 CO 0.03 -2.06 0.83 0.61 -2.79 0.00 0.00 177.10 173.73 3n5l n GLY 146 N -3.19 0.97 3.70 1.21 0.00 -0.36 -1.93 105.19 105.59 3n5l n GLY 146 Ca 0.08 -2.07 -0.44 0.00 0.00 0.00 0.00 46.02 43.60 3n5l n GLY 146 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3n5l n ASP 147 N -2.80 3.48 0.19 1.61 -0.08 -1.05 -4.15 116.55 113.75 3n5l n ASP 147 Ca 0.14 1.09 0.14 0.00 -1.51 0.00 0.00 54.79 54.65 3n5l n ASP 147 Cb 0.52 -1.50 0.67 0.00 2.34 0.00 0.00 41.12 43.15 3n5l n ASP 147 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 3n5l h PRO 148 N 5.90 0.00 -0.65 -0.67 0.13 -1.94 0.01 132.00 134.78 3n5l h PRO 148 Ca -0.44 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 3n5l h PRO 148 Cb 1.23 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.36 3n5l h PRO 148 CO 0.89 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.75 3n5l n ASN 149 N -2.44 4.47 -4.79 1.44 3.02 -1.26 -4.82 115.26 110.88 3n5l n ASN 149 Ca -0.01 -2.42 -0.38 0.00 -0.03 0.00 0.00 54.58 51.74 3n5l n ASN 149 Cb 0.11 -0.56 -0.06 0.00 -0.61 0.00 0.00 39.78 38.66 3n5l n ASN 149 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 3n5l s SER 150 N -0.86 6.79 -0.01 6.41 0.15 -0.01 -2.76 113.70 123.41 3n5l s SER 150 Ca 0.48 0.93 -0.21 0.00 0.70 0.00 0.00 55.95 57.85 3n5l s SER 150 Cb 0.31 -2.28 -0.12 0.00 -1.71 0.00 0.00 66.02 62.22 3n5l s SER 150 CO 0.23 0.19 0.87 0.74 1.20 0.00 0.00 173.24 176.47 3n5l h THR 151 N 4.09 0.08 0.00 6.45 2.02 -1.93 -1.90 112.91 121.72 3n5l h THR 151 Ca -0.47 -0.50 -0.09 0.00 0.77 0.00 0.00 66.41 66.12 3n5l h THR 151 Cb 1.20 0.12 -0.01 0.00 -1.74 0.00 0.00 68.15 67.72 3n5l h THR 151 CO 0.67 0.02 -0.43 0.77 0.37 0.00 0.00 175.52 176.92 3n5l h SER 152 N -1.16 0.00 0.75 4.18 4.64 -1.95 0.35 113.55 120.37 3n5l h SER 152 Ca -0.07 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.25 3n5l h SER 152 Cb 0.56 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.65 3n5l h SER 152 CO 0.12 0.43 -0.86 0.61 -0.87 0.00 0.00 176.83 176.26 3n5l n GLY 153 N 0.83 -1.36 2.03 -0.77 0.00 -1.25 -4.46 105.19 100.21 3n5l n GLY 153 Ca 0.01 -0.29 0.00 0.00 0.00 0.00 0.00 46.02 45.74 3n5l n GLY 153 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 3n5l n TYR 154 N -2.21 -2.90 0.13 1.61 4.19 -1.04 -1.22 117.16 115.72 3n5l n TYR 154 Ca 0.02 0.62 -0.14 0.00 3.31 0.00 0.00 57.90 61.71 3n5l n TYR 154 Cb 0.47 1.04 -0.08 0.00 0.49 0.00 0.00 39.34 41.26 3n5l n TYR 154 CO 0.00 0.00 0.00 1.25 0.91 0.00 0.00 176.86 179.02 3n5l h LEU 155 N 0.00 -0.24 0.55 2.98 5.85 -1.13 0.11 115.31 123.43 3n5l h LEU 155 Ca 0.00 -0.09 -0.03 0.00 0.84 0.00 0.00 57.88 58.60 3n5l h LEU 155 Cb 0.00 0.06 0.01 0.00 0.37 0.00 0.00 40.66 41.10 3n5l h LEU 155 CO 0.00 -0.06 -0.27 0.58 -0.34 0.00 0.00 178.44 178.35 3n5l h VAL 156 N -0.42 0.37 -0.41 1.05 2.07 -1.20 -0.78 116.25 116.93 3n5l h VAL 156 Ca -0.03 -0.30 -0.04 0.00 0.82 0.00 0.00 66.70 67.15 3n5l h VAL 156 Cb 0.32 0.47 -0.02 0.00 -1.52 0.00 0.00 31.29 30.54 3n5l h VAL 156 CO 0.05 0.04 0.09 1.55 0.02 0.00 0.00 177.57 179.31 3n5l h PRO 157 N -0.95 0.61 -0.99 1.57 0.13 -1.78 -0.60 132.00 129.99 3n5l h PRO 157 Ca -0.08 -0.11 0.17 0.00 -0.87 0.00 0.00 66.00 65.11 3n5l h PRO 157 Cb 0.63 -0.10 -0.10 0.00 0.13 0.00 0.00 31.00 31.56 3n5l h PRO 157 CO 0.12 0.57 0.60 0.78 -0.23 0.00 0.00 178.00 179.84 3n5l h GLY 158 N 0.83 1.72 0.00 1.56 0.00 -0.38 0.12 103.07 106.92 3n5l h GLY 158 Ca 0.14 -0.36 0.00 0.00 0.00 0.00 0.00 47.33 47.10 3n5l h GLY 158 CO -0.00 -0.01 -0.13 -1.82 0.00 0.00 0.00 176.54 174.57 3n5l h TYR 159 N 0.80 0.00 -0.05 5.60 3.20 -0.69 -0.45 116.97 125.39 3n5l h TYR 159 Ca 0.55 0.00 -0.14 0.00 3.14 0.00 0.00 58.73 62.28 3n5l h TYR 159 Cb 0.78 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 39.04 3n5l h TYR 159 CO -0.01 0.00 -0.61 1.88 -1.64 0.00 0.00 178.16 177.78 3n5l h TYR 160 N -0.92 0.22 0.00 -3.82 0.05 -1.06 -0.98 116.97 110.46 3n5l h TYR 160 Ca 0.00 -0.08 -0.18 0.00 0.05 0.00 0.00 58.73 58.52 3n5l h TYR 160 Cb 0.13 -0.04 -0.03 0.00 1.01 0.00 0.00 36.73 37.81 3n5l h TYR 160 CO -0.06 0.73 -1.04 0.28 -1.05 0.00 0.00 178.16 177.03 3n5l h VAL 161 N 0.12 0.81 0.00 -2.88 2.07 -0.98 -3.41 116.25 111.99 3n5l h VAL 161 Ca -0.01 -1.98 -0.05 0.00 0.82 0.00 0.00 66.70 65.48 3n5l h VAL 161 Cb 1.11 1.91 -0.01 0.00 -1.52 0.00 0.00 31.29 32.78 3n5l h VAL 161 CO 0.09 0.28 -0.77 0.49 0.02 0.00 0.00 177.57 177.67 3n5l n PHE 162 N -4.48 0.74 -0.16 1.57 3.72 -0.81 -3.83 117.46 114.21 3n5l n PHE 162 Ca -0.26 0.32 -0.08 0.00 -0.05 0.00 0.00 57.45 57.38 3n5l n PHE 162 Cb 0.59 -0.77 0.01 0.00 -0.94 0.00 0.00 39.48 38.37 3n5l n PHE 162 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3n5l h ALA 163 N -0.94 0.60 -0.01 4.37 0.00 -0.91 -0.98 119.26 121.40 3n5l h ALA 163 Ca -0.07 -0.07 -0.05 0.00 0.00 0.00 0.00 54.91 54.72 3n5l h ALA 163 Cb 0.74 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 3n5l h ALA 163 CO -0.04 0.10 -0.23 0.87 0.00 0.00 0.00 179.25 179.95 3n5l h LYS 164 N 0.63 0.02 -0.47 0.00 1.79 -1.41 -2.34 116.57 114.78 3n5l h LYS 164 Ca 0.17 -0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.63 3n5l h LYS 164 Cb 0.01 -0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.66 3n5l h LYS 164 CO -0.03 0.25 0.00 0.09 -1.08 0.00 0.00 179.45 178.68 3n5l n ASN 165 N -4.26 3.53 -3.83 0.86 3.02 -1.02 -4.98 115.26 108.57 3n5l n ASN 165 Ca -0.02 -1.99 -0.24 0.00 -0.03 0.00 0.00 54.58 52.30 3n5l n ASN 165 Cb 0.29 -0.31 0.00 0.00 -0.61 0.00 0.00 39.78 39.16 3n5l n ASN 165 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 3n5l n ASN 166 N 1.50 -0.79 -4.06 6.41 5.15 -0.47 -5.00 115.26 118.00 3n5l n ASN 166 Ca 0.21 -0.92 -0.28 0.00 -0.60 0.00 0.00 54.58 52.98 3n5l n ASN 166 Cb 0.60 -3.52 -0.17 0.00 -0.53 0.00 0.00 39.78 36.17 3n5l n ASN 166 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 3n5l s VAL 167 N -3.82 1.49 -0.34 3.44 1.01 -0.61 -5.04 120.40 116.53 3n5l s VAL 167 Ca 0.01 -0.64 -0.15 0.00 0.00 0.00 0.00 61.98 61.20 3n5l s VAL 167 Cb -0.00 -1.36 -0.01 0.00 0.00 0.00 0.00 36.38 35.00 3n5l s VAL 167 CO 0.85 0.44 0.35 -0.62 0.00 0.00 0.00 175.10 176.13 3n5l s ASP 168 N 0.95 6.17 0.60 3.32 -1.08 -1.26 -4.35 116.67 121.02 3n5l s ASP 168 Ca -0.07 -0.21 0.38 0.00 -0.52 0.00 0.00 52.55 52.13 3n5l s ASP 168 Cb -0.15 -2.19 1.85 0.00 -1.46 0.00 0.00 42.92 40.97 3n5l s ASP 168 CO -0.01 -0.32 2.15 1.55 0.52 0.00 0.00 175.17 179.06 3n5l h PRO 169 N 8.45 0.00 0.00 4.34 0.13 -1.99 0.92 132.00 143.85 3n5l h PRO 169 Ca -0.30 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.83 3n5l h PRO 169 Cb 1.15 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.28 3n5l h PRO 169 CO 0.69 0.00 0.00 1.33 -0.23 0.00 0.00 178.00 179.79 3n5l n VAL 170 N -3.05 0.36 -0.00 1.56 0.24 -1.26 -4.08 118.33 112.09 3n5l n VAL 170 Ca -0.01 -0.08 -0.00 0.00 -2.04 0.00 0.00 64.34 62.21 3n5l n VAL 170 Cb 0.19 -0.61 -0.00 0.00 -1.47 0.00 0.00 33.84 31.95 3n5l n VAL 170 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 3n5l n LYS 171 N -1.85 2.84 0.10 7.34 5.02 -0.60 -4.86 118.16 126.15 3n5l n LYS 171 Ca 0.06 -0.00 -0.02 0.00 -2.02 0.00 0.00 58.31 56.32 3n5l n LYS 171 Cb 0.36 -1.01 -0.02 0.00 -0.02 0.00 0.00 35.03 34.34 3n5l n LYS 171 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3n5l h ALA 172 N 0.02 0.54 -2.05 7.82 0.00 -1.01 -3.46 119.26 121.12 3n5l h ALA 172 Ca -0.01 -0.69 -0.46 0.00 0.00 0.00 0.00 54.91 53.76 3n5l h ALA 172 Cb 0.74 -0.12 0.01 0.00 0.00 0.00 0.00 17.79 18.42 3n5l h ALA 172 CO 0.00 0.95 -0.25 -0.06 0.00 0.00 0.00 179.25 179.89 3n5l s PHE 173 N -2.91 3.30 0.24 0.00 0.08 -1.26 -2.47 117.98 114.96 3n5l s PHE 173 Ca 0.02 0.08 -0.06 0.00 0.12 0.00 0.00 56.93 57.09 3n5l s PHE 173 Cb 0.09 -1.99 0.30 0.00 -0.57 0.00 0.00 43.02 40.86 3n5l s PHE 173 CO 0.78 0.00 1.88 -0.22 -0.10 0.00 0.00 175.22 177.56 3n5l h LYS 174 N 0.77 1.05 -2.02 0.44 3.64 -1.03 -3.45 116.57 115.97 3n5l h LYS 174 Ca -0.48 -0.06 -0.05 0.00 -1.27 0.00 0.00 60.65 58.79 3n5l h LYS 174 Cb 1.24 -0.24 -0.20 0.00 -0.41 0.00 0.00 32.23 32.62 3n5l h LYS 174 CO 0.58 0.70 0.14 0.50 -2.27 0.00 0.00 179.45 179.09 3n5l s ARG 175 N -6.08 0.90 0.12 1.90 3.52 -1.24 -5.03 118.95 113.04 3n5l s ARG 175 Ca -0.13 0.75 0.07 0.00 -0.13 0.00 0.00 55.73 56.30 3n5l s ARG 175 Cb 0.18 0.43 -0.04 0.00 -1.56 0.00 0.00 34.95 33.97 3n5l s ARG 175 CO 0.80 -0.17 -0.17 0.99 -0.81 0.00 0.00 175.30 175.94 3n5l s THR 176 N -0.12 1.48 0.23 4.11 2.01 -1.26 -1.05 115.64 121.04 3n5l s THR 176 Ca -0.04 -1.63 0.04 0.00 0.31 0.00 0.00 61.69 60.38 3n5l s THR 176 Cb -0.03 -1.51 -0.05 0.00 0.01 0.00 0.00 72.50 70.92 3n5l s THR 176 CO 0.04 -0.27 -0.02 -0.76 -0.69 0.00 0.00 174.62 172.91 3n5l s LEU 177 N -2.22 2.28 -0.12 4.42 1.02 -0.69 -4.97 118.68 118.41 3n5l s LEU 177 Ca 0.07 -1.19 0.00 0.00 0.02 0.00 0.00 54.13 53.03 3n5l s LEU 177 Cb -0.07 -0.35 0.02 0.00 0.02 0.00 0.00 46.19 45.81 3n5l s LEU 177 CO 0.04 -0.46 -0.10 0.20 0.02 0.00 0.00 176.35 176.05 3n5l s ASN 178 N -3.32 2.27 0.11 2.29 0.01 -1.26 -0.52 114.94 114.52 3n5l s ASN 178 Ca 0.27 -0.35 -0.08 0.00 -0.71 0.00 0.00 52.86 52.00 3n5l s ASN 178 Cb 0.05 -0.93 -0.01 0.00 0.41 0.00 0.00 41.25 40.77 3n5l s ASN 178 CO 0.08 -0.08 0.19 -0.44 -1.51 0.00 0.00 177.10 175.35 3n5l s SER 179 N 1.52 0.14 0.99 -1.22 0.01 -0.81 -4.87 113.70 109.46 3n5l s SER 179 Ca 0.02 -0.79 -0.12 0.00 1.31 0.00 0.00 55.95 56.37 3n5l s SER 179 Cb -0.13 0.36 0.19 0.00 0.21 0.00 0.00 66.02 66.64 3n5l s SER 179 CO -0.07 -0.77 1.08 -0.94 0.41 0.00 0.00 173.24 172.95 3n5l s SER 180 N -2.92 2.50 0.15 2.44 1.04 -1.26 -2.54 113.70 113.11 3n5l s SER 180 Ca 0.11 1.63 -0.17 0.00 0.48 0.00 0.00 55.95 58.00 3n5l s SER 180 Cb 0.05 -2.28 0.06 0.00 0.10 0.00 0.00 66.02 63.95 3n5l s SER 180 CO -0.06 -3.27 1.73 0.45 0.98 0.00 0.00 173.24 173.07 3n5l h HIS 181 N -1.99 0.12 -0.55 5.02 3.86 -1.79 -0.96 115.15 118.87 3n5l h HIS 181 Ca -0.52 0.02 -0.11 0.00 -1.16 0.00 0.00 60.37 58.59 3n5l h HIS 181 Cb 1.30 -0.00 -0.02 0.00 1.06 0.00 0.00 27.41 29.75 3n5l h HIS 181 CO 0.38 0.03 -0.10 1.49 0.86 0.00 0.00 177.93 180.59 3n5l h GLU 182 N 0.19 1.03 -0.73 2.45 4.81 -1.73 -0.73 114.58 119.87 3n5l h GLU 182 Ca 0.16 -0.38 -0.03 0.00 -0.13 0.00 0.00 59.36 58.98 3n5l h GLU 182 Cb 0.18 -0.07 -0.03 0.00 0.63 0.00 0.00 28.75 29.46 3n5l h GLU 182 CO -0.21 1.07 0.35 0.28 -0.73 0.00 0.00 179.01 179.77 3n5l h VAL 183 N 0.91 1.24 -0.36 0.32 2.07 -1.79 -1.57 116.25 117.07 3n5l h VAL 183 Ca 0.14 -0.68 -0.00 0.00 0.82 0.00 0.00 66.70 66.98 3n5l h VAL 183 Cb 0.67 0.33 -0.02 0.00 -1.52 0.00 0.00 31.29 30.76 3n5l h VAL 183 CO 0.05 0.28 0.21 0.78 0.02 0.00 0.00 177.57 178.92 3n5l h ASN 184 N 1.03 0.44 -0.60 0.57 2.35 -0.90 -0.68 115.58 117.79 3n5l h ASN 184 Ca 0.25 -0.06 0.02 0.00 -0.55 0.00 0.00 56.30 55.96 3n5l h ASN 184 Cb 0.13 -0.11 -0.04 0.00 0.05 0.00 0.00 38.32 38.35 3n5l h ASN 184 CO -0.03 0.37 0.38 0.00 -1.65 0.00 0.00 177.43 176.50 3n5l h ALA 185 N 1.09 0.78 -0.34 -0.83 0.00 -0.84 -1.20 119.26 117.92 3n5l h ALA 185 Ca 0.13 -0.02 -0.14 0.00 0.00 0.00 0.00 54.91 54.87 3n5l h ALA 185 Cb 0.02 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 3n5l h ALA 185 CO -0.02 0.12 -0.37 -0.07 0.00 0.00 0.00 179.25 178.91 3n5l h LEU 186 N 0.75 0.83 -0.68 0.00 3.38 -1.16 -1.15 115.31 117.28 3n5l h LEU 186 Ca 0.24 -0.37 -0.06 0.00 0.09 0.00 0.00 57.88 57.78 3n5l h LEU 186 Cb 0.00 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.49 3n5l h LEU 186 CO -0.09 1.11 0.18 0.00 0.09 0.00 0.00 178.44 179.73 3n5l h ALA 187 N 0.93 0.89 -0.46 1.53 0.00 -0.68 0.39 119.26 121.86 3n5l h ALA 187 Ca 0.06 -0.23 -0.13 0.00 0.00 0.00 0.00 54.91 54.60 3n5l h ALA 187 Cb 0.92 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.44 3n5l h ALA 187 CO 0.08 0.60 -0.23 0.28 0.00 0.00 0.00 179.25 179.98 3n5l h VAL 188 N 1.00 1.27 -0.84 0.00 2.07 -1.14 0.64 116.25 119.25 3n5l h VAL 188 Ca 0.21 -1.40 -0.03 0.00 0.82 0.00 0.00 66.70 66.30 3n5l h VAL 188 Cb 0.34 1.18 -0.04 0.00 -1.52 0.00 0.00 31.29 31.26 3n5l h VAL 188 CO -0.00 0.48 0.40 0.00 0.02 0.00 0.00 177.57 178.47 3n5l h ALA 189 N 0.85 1.09 -0.32 1.67 0.00 -0.89 -2.75 119.26 118.90 3n5l h ALA 189 Ca 0.10 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.85 3n5l h ALA 189 Cb 0.82 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 18.27 3n5l h ALA 189 CO 0.07 0.65 0.00 0.09 0.00 0.00 0.00 179.25 180.06 3n5l n ASN 190 N -4.31 1.91 -2.77 0.00 3.02 0.10 -4.92 115.26 108.29 3n5l n ASN 190 Ca 0.08 -1.93 -0.21 0.00 -0.03 0.00 0.00 54.58 52.48 3n5l n ASN 190 Cb 0.14 -0.21 0.02 0.00 -0.61 0.00 0.00 39.78 39.12 3n5l n ASN 190 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 3n5l n LYS 191 N 0.52 -3.93 -0.01 3.52 5.02 -0.97 -4.90 118.16 117.41 3n5l n LYS 191 Ca 0.13 0.92 0.00 0.00 -2.02 0.00 0.00 58.31 57.34 3n5l n LYS 191 Cb 0.32 -5.68 -0.12 0.00 -0.02 0.00 0.00 35.03 29.52 3n5l n LYS 191 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 3n5l n GLN 192 N -3.68 0.65 -4.19 1.97 6.02 0.18 -4.92 117.38 113.41 3n5l n GLN 192 Ca -0.15 0.05 -0.16 0.00 -0.01 0.00 0.00 57.00 56.74 3n5l n GLN 192 Cb 0.64 -1.66 -0.13 0.00 1.02 0.00 0.00 30.24 30.11 3n5l n GLN 192 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 177.06 176.19 3n5l s VAL 193 N -2.96 0.65 -0.06 5.09 -7.23 -1.10 -4.99 120.40 109.79 3n5l s VAL 193 Ca -0.06 -0.73 -0.27 0.00 -1.81 0.00 0.00 61.98 59.11 3n5l s VAL 193 Cb 0.09 -0.62 -0.22 0.00 0.56 0.00 0.00 36.38 36.19 3n5l s VAL 193 CO 0.84 -0.08 1.08 0.44 -0.31 0.00 0.00 175.10 177.06 3n5l h ASP 194 N 5.20 0.03 -4.26 4.85 3.32 -1.75 -3.37 116.42 120.44 3n5l h ASP 194 Ca -0.33 -0.69 -0.34 0.00 0.02 0.00 0.00 57.03 55.69 3n5l h ASP 194 Cb 1.19 -0.01 -0.26 0.00 0.22 0.00 0.00 39.33 40.48 3n5l h ASP 194 CO 0.45 0.71 -0.76 0.68 -1.72 0.00 0.00 179.24 178.61 3n5l s VAL 195 N -3.45 0.60 0.15 -1.35 -7.23 -1.01 -4.04 120.40 104.07 3n5l s VAL 195 Ca -0.17 -0.63 -0.08 0.00 -1.81 0.00 0.00 61.98 59.29 3n5l s VAL 195 Cb 0.00 -0.57 -0.01 0.00 0.56 0.00 0.00 36.38 36.36 3n5l s VAL 195 CO 0.69 -0.05 0.24 0.00 -0.31 0.00 0.00 175.10 175.67 3n5l s ALA 196 N -0.64 0.11 0.42 1.32 0.00 -0.64 -0.53 121.76 121.80 3n5l s ALA 196 Ca -0.02 -0.95 -0.11 0.00 0.00 0.00 0.00 51.96 50.89 3n5l s ALA 196 Cb -0.06 0.82 -0.07 0.00 0.00 0.00 0.00 23.12 23.82 3n5l s ALA 196 CO 0.00 -0.61 0.79 0.95 0.00 0.00 0.00 175.76 176.90 3n5l s THR 197 N -3.97 4.76 0.06 0.00 -4.23 -0.67 -1.08 115.64 110.51 3n5l s THR 197 Ca 0.17 0.68 -0.05 0.00 -1.18 0.00 0.00 61.69 61.30 3n5l s THR 197 Cb 0.04 -3.73 0.02 0.00 1.34 0.00 0.00 72.50 70.17 3n5l s THR 197 CO -0.01 -0.54 0.27 0.33 -0.54 0.00 0.00 174.62 174.13 3n5l n PHE 198 N -1.33 -0.89 -3.71 3.99 7.35 -0.46 -4.72 117.46 117.68 3n5l n PHE 198 Ca 0.03 -0.37 -0.10 0.00 -0.76 0.00 0.00 57.45 56.25 3n5l n PHE 198 Cb 0.54 0.18 -0.04 0.00 0.35 0.00 0.00 39.48 40.51 3n5l n PHE 198 CO 0.00 0.00 0.00 0.54 -0.76 0.00 0.00 176.76 176.54 3n5l s ASN 199 N -1.64 -0.23 0.38 -2.13 2.20 -1.26 -1.07 114.94 111.18 3n5l s ASN 199 Ca 0.06 -0.44 0.11 0.00 -0.94 0.00 0.00 52.86 51.65 3n5l s ASN 199 Cb -0.01 0.52 0.74 0.00 -2.00 0.00 0.00 41.25 40.50 3n5l s ASN 199 CO 0.02 -0.96 1.85 0.71 -2.94 0.00 0.00 177.10 175.79 3n5l h THR 200 N 2.29 1.23 -0.17 0.54 1.35 -1.56 -3.02 112.91 113.58 3n5l h THR 200 Ca -0.31 -1.11 -0.10 0.00 -0.55 0.00 0.00 66.41 64.34 3n5l h THR 200 Cb 1.26 1.54 0.00 0.00 -1.73 0.00 0.00 68.15 69.21 3n5l h THR 200 CO 0.42 0.32 -0.30 -0.33 -0.25 0.00 0.00 175.52 175.38 3n5l h GLU 201 N 0.07 0.50 -1.64 4.72 5.08 -1.98 -2.46 114.58 118.88 3n5l h GLU 201 Ca 0.01 -0.32 0.00 0.00 -1.00 0.00 0.00 59.36 58.05 3n5l h GLU 201 Cb 0.57 0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.86 3n5l h GLU 201 CO 0.04 0.92 0.00 0.41 -1.00 0.00 0.00 179.01 179.38 3n5l n GLY 202 N 0.39 0.00 0.32 -3.84 0.00 -1.14 -1.51 105.19 99.41 3n5l n GLY 202 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.96 3n5l n GLY 202 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 3n5l n GLU 204 N 0.90 0.00 -0.22 1.61 2.13 -0.93 -0.78 120.64 123.35 3n5l n GLU 204 Ca 0.00 0.00 -0.07 0.00 0.66 0.00 0.00 57.16 57.75 3n5l n GLU 204 Cb 0.00 0.00 0.04 0.00 0.27 0.00 0.00 31.44 31.75 3n5l n GLU 204 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 3n5l h ARG 205 N 0.00 0.87 -0.34 5.31 2.47 -1.56 -2.59 114.38 118.56 3n5l h ARG 205 Ca 0.00 -0.11 -0.12 0.00 -1.26 0.00 0.00 59.98 58.49 3n5l h ARG 205 Cb 0.00 -0.17 -0.01 0.00 -1.65 0.00 0.00 29.97 28.14 3n5l h ARG 205 CO 0.00 0.68 -0.28 1.25 0.56 0.00 0.00 179.97 182.18 3n5l h LEU 206 N 0.85 0.71 -1.37 3.04 5.85 -1.23 0.72 115.31 123.87 3n5l h LEU 206 Ca 0.22 -0.27 0.02 0.00 0.84 0.00 0.00 57.88 58.68 3n5l h LEU 206 Cb 0.07 -0.20 -0.03 0.00 0.37 0.00 0.00 40.66 40.86 3n5l h LEU 206 CO -0.03 0.95 0.43 -0.33 -0.34 0.00 0.00 178.44 179.13 3n5l h GLU 207 N 0.60 0.82 0.05 1.25 4.39 -1.77 0.37 114.58 120.28 3n5l h GLU 207 Ca 0.08 -0.05 -0.00 0.00 0.34 0.00 0.00 59.36 59.72 3n5l h GLU 207 Cb 0.78 -0.18 0.00 0.00 -0.10 0.00 0.00 28.75 29.24 3n5l h GLU 207 CO 0.06 0.54 -0.02 1.25 -1.16 0.00 0.00 179.01 179.68 3n5l h LEU 208 N 0.84 -0.05 0.16 1.33 5.85 -1.05 -3.28 115.31 119.11 3n5l h LEU 208 Ca 0.25 -0.59 -0.29 0.00 0.84 0.00 0.00 57.88 58.09 3n5l h LEU 208 Cb -0.03 0.01 0.01 0.00 0.37 0.00 0.00 40.66 41.03 3n5l h LEU 208 CO -0.06 0.68 -1.31 0.71 -0.34 0.00 0.00 178.44 178.12 3n5l h THR 209 N -0.92 1.44 -2.01 1.05 1.35 -0.73 -3.40 112.91 109.70 3n5l h THR 209 Ca -0.01 -2.97 -0.53 0.00 -0.55 0.00 0.00 66.41 62.35 3n5l h THR 209 Cb 0.64 2.97 -0.39 0.00 -1.73 0.00 0.00 68.15 69.63 3n5l h THR 209 CO 0.01 0.87 -1.13 0.00 -0.25 0.00 0.00 175.52 175.02 3n5l n GLN 210 N -3.58 0.88 -0.19 4.72 6.02 0.13 -4.98 117.38 120.38 3n5l n GLN 210 Ca -0.11 -3.33 0.17 0.00 -0.01 0.00 0.00 57.00 53.72 3n5l n GLN 210 Cb 1.05 -1.44 0.51 0.00 1.02 0.00 0.00 30.24 31.38 3n5l n GLN 210 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 177.06 175.05 3n5l h PRO 211 N 3.59 0.39 -0.43 -1.09 0.13 -1.59 -0.01 132.00 132.99 3n5l h PRO 211 Ca 0.08 -0.02 -0.00 0.00 -0.87 0.00 0.00 66.00 65.19 3n5l h PRO 211 Cb 0.91 -0.09 -0.02 0.00 0.13 0.00 0.00 31.00 31.93 3n5l h PRO 211 CO 0.49 0.26 0.26 0.93 -0.23 0.00 0.00 178.00 179.70 3n5l h GLU 212 N 0.40 0.57 -0.00 0.86 5.08 -1.91 -0.27 114.58 119.31 3n5l h GLU 212 Ca 0.40 -0.04 -0.20 0.00 -1.00 0.00 0.00 59.36 58.51 3n5l h GLU 212 Cb 0.96 -0.12 0.02 0.00 0.50 0.00 0.00 28.75 30.10 3n5l h GLU 212 CO -0.13 0.40 -0.79 0.87 -1.00 0.00 0.00 179.01 178.36 3n5l h LYS 213 N 0.59 0.54 -0.55 2.33 1.79 -1.38 -3.27 116.57 116.62 3n5l h LYS 213 Ca 0.15 -0.58 0.03 0.00 -2.18 0.00 0.00 60.65 58.07 3n5l h LYS 213 Cb -0.02 0.16 -0.03 0.00 -1.58 0.00 0.00 32.23 30.76 3n5l h LYS 213 CO -0.03 1.20 0.36 0.00 -1.08 0.00 0.00 179.45 179.91 3n5l h ALA 214 N 0.36 1.70 0.00 3.86 0.00 -0.97 -0.62 119.26 123.58 3n5l h ALA 214 Ca -0.10 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.78 3n5l h ALA 214 Cb 1.48 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 19.08 3n5l h ALA 214 CO 0.16 0.25 0.00 0.00 0.00 0.00 0.00 179.25 179.66 3n5l h ARG 215 N 0.66 0.00 -0.00 0.00 3.08 -1.10 -1.76 114.38 115.26 3n5l h ARG 215 Ca 0.22 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.27 3n5l h ARG 215 Cb 0.05 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.10 3n5l h ARG 215 CO -0.05 0.00 -0.26 1.04 -1.07 0.00 0.00 179.97 179.63 3n5l n GLN 216 N -2.88 0.11 -4.08 0.04 1.13 -0.24 -4.86 117.38 106.60 3n5l n GLN 216 Ca -0.01 -0.04 -0.34 0.00 -1.94 0.00 0.00 57.00 54.67 3n5l n GLN 216 Cb 0.18 -1.50 -0.07 0.00 0.11 0.00 0.00 30.24 28.97 3n5l n GLN 216 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 3n5l s LEU 217 N -2.92 4.00 0.13 1.08 1.43 -0.66 0.18 118.68 121.93 3n5l s LEU 217 Ca 0.15 0.25 0.08 0.00 -1.03 0.00 0.00 54.13 53.57 3n5l s LEU 217 Cb 0.18 -2.17 -0.04 0.00 0.03 0.00 0.00 46.19 44.19 3n5l s LEU 217 CO 0.60 0.33 -0.19 -1.59 0.23 0.00 0.00 176.35 175.73 3n5l s LYS 218 N -1.42 1.18 -0.20 1.70 -2.85 -0.17 -4.68 119.74 113.30 3n5l s LYS 218 Ca 0.20 -1.28 -0.14 0.00 -1.00 0.00 0.00 55.97 53.74 3n5l s LYS 218 Cb -0.12 -1.30 -0.04 0.00 -2.06 0.00 0.00 37.83 34.31 3n5l s LYS 218 CO 0.10 0.28 0.33 0.08 0.10 0.00 0.00 175.35 176.24 3n5l s VAL 219 N -1.68 5.25 -0.82 1.79 1.01 -1.26 -1.91 120.40 122.78 3n5l s VAL 219 Ca 0.11 0.58 0.11 0.00 0.00 0.00 0.00 61.98 62.78 3n5l s VAL 219 Cb -0.07 -3.67 -0.05 0.00 0.00 0.00 0.00 36.38 32.59 3n5l s VAL 219 CO 0.05 0.30 0.59 2.30 0.00 0.00 0.00 175.10 178.34 3n5l n ILE 220 N 4.16 0.00 -3.62 2.22 -5.35 -0.15 -4.98 119.36 111.64 3n5l n ILE 220 Ca -0.10 -0.33 -0.15 0.00 -0.27 0.00 0.00 62.75 61.90 3n5l n ILE 220 Cb 0.51 1.08 -0.07 0.00 -1.74 0.00 0.00 39.64 39.42 3n5l n ILE 220 CO 0.00 0.00 0.00 0.86 -1.76 0.00 0.00 176.55 175.65 3n5l s TRP 221 N -1.68 -0.67 -0.03 4.28 -0.00 -1.18 -3.82 118.94 115.84 3n5l s TRP 221 Ca 0.07 1.47 0.02 0.00 -0.00 0.00 0.00 56.10 57.66 3n5l s TRP 221 Cb 0.09 0.28 0.01 0.00 -0.00 0.00 0.00 33.47 33.85 3n5l s TRP 221 CO 0.34 -0.43 -0.08 0.21 -0.00 0.00 0.00 176.95 177.00 3n5l s LYS 222 N -0.22 0.95 0.82 5.86 2.20 -1.26 -1.73 119.74 126.36 3n5l s LYS 222 Ca -0.04 -0.24 -0.10 0.00 -0.36 0.00 0.00 55.97 55.22 3n5l s LYS 222 Cb -0.03 -0.89 0.13 0.00 -1.51 0.00 0.00 37.83 35.53 3n5l s LYS 222 CO 0.04 0.04 1.16 -1.54 -0.36 0.00 0.00 175.35 174.69 3n5l s SER 223 N 0.44 4.03 0.86 1.43 1.04 -0.25 -5.00 113.70 116.24 3n5l s SER 223 Ca -0.07 0.31 -0.11 0.00 0.48 0.00 0.00 55.95 56.57 3n5l s SER 223 Cb -0.11 -0.66 0.11 0.00 0.10 0.00 0.00 66.02 65.47 3n5l s SER 223 CO 0.01 -2.13 1.10 -2.84 0.98 0.00 0.00 173.24 170.36 3n5l s PRO 224 N -5.54 1.55 0.35 4.02 0.02 -1.26 -4.70 135.00 129.45 3n5l s PRO 224 Ca 0.67 1.14 -0.28 0.00 0.02 0.00 0.00 61.00 62.54 3n5l s PRO 224 Cb -0.07 -1.82 -0.12 0.00 0.02 0.00 0.00 34.50 32.51 3n5l s PRO 224 CO 0.49 -2.13 1.43 -0.11 -0.33 0.00 0.00 177.00 176.35 3n5l n LEU 225 N -3.85 4.31 -4.42 -5.54 7.94 -1.26 -4.52 117.00 109.66 3n5l n LEU 225 Ca 0.09 1.21 -0.33 0.00 -1.11 0.00 0.00 56.01 55.87 3n5l n LEU 225 Cb 0.53 -1.57 -0.14 0.00 0.53 0.00 0.00 43.42 42.78 3n5l n LEU 225 CO 0.53 -0.06 -0.46 -0.63 -1.11 0.00 0.00 177.39 175.66 3n5l s ILE 226 N -0.97 2.98 0.84 1.96 1.01 0.46 -4.96 121.20 122.52 3n5l s ILE 226 Ca 0.55 -0.72 -0.11 0.00 0.00 0.00 0.00 60.65 60.38 3n5l s ILE 226 Cb -0.51 -2.20 0.10 0.00 0.01 0.00 0.00 42.46 39.85 3n5l s ILE 226 CO 0.62 0.56 1.10 -2.16 0.00 0.00 0.00 174.94 175.06 3n5l s PRO 227 N -0.22 1.69 0.65 2.79 0.04 -1.26 -0.90 135.00 137.79 3n5l s PRO 227 Ca 0.00 1.17 -0.18 0.00 0.04 0.00 0.00 61.00 62.04 3n5l s PRO 227 Cb -0.13 -1.83 -0.01 0.00 0.04 0.00 0.00 34.50 32.57 3n5l s PRO 227 CO 0.03 -2.04 1.27 0.20 0.04 0.00 0.00 177.00 176.50 3n5l s GLY 228 N -3.21 2.79 0.30 0.56 0.00 -1.26 -4.67 107.32 101.83 3n5l s GLY 228 Ca 0.63 1.15 -0.30 0.00 0.00 0.00 0.00 44.72 46.21 3n5l s GLY 228 CO 0.57 1.57 1.53 0.99 0.00 0.00 0.00 173.10 177.76 3n5l s ASP 229 N -1.48 6.45 0.51 1.64 1.01 -1.26 -4.76 116.67 118.78 3n5l s ASP 229 Ca 0.81 2.88 -0.04 0.00 0.71 0.00 0.00 52.55 56.91 3n5l s ASP 229 Cb -0.36 -2.64 -0.01 0.00 1.01 0.00 0.00 42.92 40.92 3n5l s ASP 229 CO 0.39 -0.84 0.80 -2.16 0.21 0.00 0.00 175.17 173.58 3n5l s PRO 230 N -0.75 3.24 -0.12 8.23 0.04 -1.24 -1.12 135.00 143.27 3n5l s PRO 230 Ca 0.60 0.01 -0.05 0.00 0.04 0.00 0.00 61.00 61.60 3n5l s PRO 230 Cb -0.46 -2.37 -0.04 0.00 0.04 0.00 0.00 34.50 31.67 3n5l s PRO 230 CO 0.49 -0.39 0.05 -0.51 0.04 0.00 0.00 177.00 176.68 3n5l s LEU 231 N -4.79 3.84 -0.02 -3.56 2.01 0.64 -3.09 118.68 113.70 3n5l s LEU 231 Ca 0.50 0.20 0.04 0.00 0.01 0.00 0.00 54.13 54.88 3n5l s LEU 231 Cb -0.10 -1.92 -0.01 0.00 0.01 0.00 0.00 46.19 44.17 3n5l s LEU 231 CO 0.44 0.32 -0.13 -0.69 1.01 0.00 0.00 176.35 177.30 3n5l s VAL 232 N -0.54 1.04 0.25 -1.59 1.01 -0.50 -2.08 120.40 117.99 3n5l s VAL 232 Ca 0.10 -0.55 0.11 0.00 0.00 0.00 0.00 61.98 61.65 3n5l s VAL 232 Cb -0.12 -0.88 -0.05 0.00 0.00 0.00 0.00 36.38 35.33 3n5l s VAL 232 CO 0.02 0.30 -0.15 -1.66 0.00 0.00 0.00 175.10 173.61 3n5l s TRP 233 N -0.18 2.42 0.18 5.22 -2.14 -0.31 -0.61 118.94 123.52 3n5l s TRP 233 Ca 0.03 -0.30 -0.30 0.00 2.66 0.00 0.00 56.10 58.19 3n5l s TRP 233 Cb -0.06 -1.10 -0.08 0.00 -3.10 0.00 0.00 33.47 29.13 3n5l s TRP 233 CO -0.00 0.64 1.22 -0.98 -2.66 0.00 0.00 176.95 175.17 3n5l s ARG 234 N -3.32 4.46 0.00 3.25 1.70 -0.69 -0.48 118.95 123.87 3n5l s ARG 234 Ca 0.28 1.91 0.23 0.00 -0.47 0.00 0.00 55.73 57.68 3n5l s ARG 234 Cb -0.06 -3.24 1.10 0.00 -0.57 0.00 0.00 34.95 32.18 3n5l s ARG 234 CO 0.15 -0.14 1.74 0.27 -1.08 0.00 0.00 175.30 176.24 3n5l n ASN 235 N 2.68 0.00 -1.02 -2.89 0.23 0.55 -1.99 115.26 112.83 3n5l n ASN 235 Ca 0.05 0.11 0.10 0.00 -0.53 0.00 0.00 54.58 54.31 3n5l n ASN 235 Cb 0.44 -0.34 0.26 0.00 -2.08 0.00 0.00 39.78 38.06 3n5l n ASN 235 CO 0.00 0.00 0.00 -0.46 -0.93 0.00 0.00 177.26 175.87 3n5l n ASN 236 N -1.34 2.98 -4.68 0.53 6.94 -1.26 -4.94 115.26 113.48 3n5l n ASN 236 Ca 0.09 -1.97 -0.37 0.00 -0.02 0.00 0.00 54.58 52.31 3n5l n ASN 236 Cb 0.20 -0.33 0.06 0.00 -2.36 0.00 0.00 39.78 37.35 3n5l n ASN 236 CO 0.00 0.00 0.00 -0.11 -1.03 0.00 0.00 177.26 176.12 3n5l n LEU 237 N 1.14 5.03 -4.75 -4.53 7.94 -0.84 -4.96 117.00 116.03 3n5l n LEU 237 Ca 0.19 0.82 -0.34 0.00 -1.11 0.00 0.00 56.01 55.58 3n5l n LEU 237 Cb 0.49 -1.49 0.07 0.00 0.53 0.00 0.00 43.42 43.02 3n5l n LEU 237 CO 0.13 -1.35 0.77 -0.94 -1.11 0.00 0.00 177.39 174.90 3n5l s SER 238 N -1.30 4.70 0.23 1.96 1.04 -1.26 -4.83 113.70 114.23 3n5l s SER 238 Ca 0.79 2.19 -0.07 0.00 0.48 0.00 0.00 55.95 59.34 3n5l s SER 238 Cb -0.40 -2.57 0.37 0.00 0.10 0.00 0.00 66.02 63.52 3n5l s SER 238 CO 0.43 -1.92 1.71 0.44 0.98 0.00 0.00 173.24 174.88 3n5l h ASP 239 N -0.04 0.07 -0.46 7.02 3.32 -1.98 -0.95 116.42 123.40 3n5l h ASP 239 Ca -0.47 0.12 0.02 0.00 0.02 0.00 0.00 57.03 56.72 3n5l h ASP 239 Cb 1.27 0.15 -0.03 0.00 0.22 0.00 0.00 39.33 40.94 3n5l h ASP 239 CO 0.52 0.02 0.27 -0.08 -1.72 0.00 0.00 179.24 178.25 3n5l h GLU 240 N 0.31 0.52 -0.29 3.56 4.81 -1.99 0.52 114.58 122.02 3n5l h GLU 240 Ca 0.36 -0.03 -0.03 0.00 -0.13 0.00 0.00 59.36 59.53 3n5l h GLU 240 Cb 0.56 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 29.81 3n5l h GLU 240 CO -0.43 0.35 0.04 1.96 -0.73 0.00 0.00 179.01 180.20 3n5l h GLN 241 N 0.54 0.47 -0.47 1.92 4.20 -1.77 -1.26 115.11 118.75 3n5l h GLN 241 Ca 0.19 -0.13 0.04 0.00 0.06 0.00 0.00 58.65 58.81 3n5l h GLN 241 Cb 0.03 -0.05 -0.04 0.00 0.30 0.00 0.00 27.48 27.71 3n5l h GLN 241 CO -0.09 0.59 0.23 0.87 -0.67 0.00 0.00 178.83 179.75 3n5l h LYS 242 N 0.29 0.43 -0.40 1.46 1.57 -0.88 -0.14 116.57 118.91 3n5l h LYS 242 Ca 0.09 -0.03 -0.13 0.00 -1.87 0.00 0.00 60.65 58.71 3n5l h LYS 242 Cb 0.34 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.55 3n5l h LYS 242 CO 0.01 0.29 -0.25 -0.91 -0.57 0.00 0.00 179.45 178.01 3n5l h ASN 243 N 0.45 0.91 -0.24 0.86 2.35 -0.74 -0.76 115.58 118.40 3n5l h ASN 243 Ca 0.21 -0.42 -0.10 0.00 -0.55 0.00 0.00 56.30 55.43 3n5l h ASN 243 Cb 0.13 -0.25 -0.02 0.00 0.05 0.00 0.00 38.32 38.23 3n5l h ASN 243 CO -0.15 1.14 -0.18 0.11 -1.65 0.00 0.00 177.43 176.69 3n5l h LYS 244 N 0.68 0.68 -0.39 0.81 1.57 -1.03 -0.99 116.57 117.90 3n5l h LYS 244 Ca 0.08 -0.24 -0.08 0.00 -1.87 0.00 0.00 60.65 58.54 3n5l h LYS 244 Cb 0.82 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 33.07 3n5l h LYS 244 CO 0.07 0.82 -0.05 -0.07 -0.57 0.00 0.00 179.45 179.64 3n5l h LEU 245 N 0.61 0.73 -0.18 2.94 4.07 -0.85 -0.45 115.31 122.17 3n5l h LEU 245 Ca 0.10 -0.34 0.01 0.00 0.08 0.00 0.00 57.88 57.72 3n5l h LEU 245 Cb 0.64 -0.20 -0.01 0.00 1.08 0.00 0.00 40.66 42.17 3n5l h LEU 245 CO 0.05 0.89 0.11 0.03 -1.08 0.00 0.00 178.44 178.44 3n5l h ARG 246 N 0.54 0.22 -0.62 1.13 3.08 -0.99 -1.60 114.38 116.13 3n5l h ARG 246 Ca 0.10 -0.01 0.05 0.00 0.07 0.00 0.00 59.98 60.19 3n5l h ARG 246 Cb 0.55 -0.05 -0.05 0.00 0.08 0.00 0.00 29.97 30.51 3n5l h ARG 246 CO 0.03 0.14 0.35 -0.44 -1.07 0.00 0.00 179.97 178.99 3n5l h ASP 247 N 0.23 0.54 0.25 7.04 3.32 -1.03 -1.97 116.42 124.80 3n5l h ASP 247 Ca 0.07 0.02 -0.01 0.00 0.02 0.00 0.00 57.03 57.13 3n5l h ASP 247 Cb -0.01 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 39.46 3n5l h ASP 247 CO -0.03 0.36 -0.12 0.15 -1.72 0.00 0.00 179.24 177.88 3n5l h PHE 248 N 0.67 -0.31 -0.43 4.55 3.57 -0.71 -2.44 116.94 121.84 3n5l h PHE 248 Ca 0.27 -0.01 -0.04 0.00 3.53 0.00 0.00 57.97 61.72 3n5l h PHE 248 Cb 0.13 0.10 -0.02 0.00 2.79 0.00 0.00 35.95 38.95 3n5l h PHE 248 CO -0.07 -0.11 0.12 0.74 -2.23 0.00 0.00 178.31 176.76 3n5l h PHE 249 N -0.45 0.71 0.00 0.41 0.04 -1.22 -1.90 116.94 114.53 3n5l h PHE 249 Ca -0.03 -0.08 -0.10 0.00 2.80 0.00 0.00 57.97 60.55 3n5l h PHE 249 Cb 0.34 -0.20 -0.01 0.00 2.20 0.00 0.00 35.95 38.27 3n5l h PHE 249 CO -0.03 0.65 -0.50 0.74 -0.60 0.00 0.00 178.31 178.57 3n5l h PHE 250 N 0.56 0.00 -0.00 -0.55 0.04 -1.38 -3.03 116.94 112.57 3n5l h PHE 250 Ca 0.14 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.91 3n5l h PHE 250 Cb 0.29 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.44 3n5l h PHE 250 CO 0.01 0.50 -0.41 1.63 -0.60 0.00 0.00 178.31 179.45 3n5l n LYS 251 N -3.44 0.34 -2.24 1.51 5.02 -0.92 -4.94 118.16 113.49 3n5l n LYS 251 Ca 0.00 -0.20 -0.39 0.00 -2.02 0.00 0.00 58.31 55.71 3n5l n LYS 251 Cb 0.63 -1.50 -0.02 0.00 -0.02 0.00 0.00 35.03 34.13 3n5l n LYS 251 CO 0.00 0.00 0.00 -0.47 -0.52 0.00 0.00 177.40 176.41 3n5l s TYR 252 N -2.80 3.03 0.00 2.13 5.04 -0.72 -4.08 117.35 119.95 3n5l s TYR 252 Ca 0.16 1.52 0.00 0.00 -2.44 0.00 0.00 57.07 56.32 3n5l s TYR 252 Cb 0.18 -3.46 0.00 0.00 0.35 0.00 0.00 41.96 39.03 3n5l s TYR 252 CO 0.63 -1.48 0.00 0.41 -1.34 0.00 0.00 175.55 173.77 3n5l n GLY 253 N 0.68 1.37 0.19 8.97 0.00 -1.26 -4.76 105.19 110.38 3n5l n GLY 253 Ca 0.04 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.18 3n5l n GLY 253 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3n5l h ALA 254 N 0.00 1.00 -4.32 4.61 0.00 -1.93 -3.42 119.26 115.20 3n5l h ALA 254 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 54.91 54.56 3n5l h ALA 254 Cb 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 17.79 17.70 3n5l h ALA 254 CO 0.00 0.00 -0.26 0.27 0.00 0.00 0.00 179.25 179.26 3n5l n ASN 255 N -2.81 -1.09 -0.05 0.00 0.23 -1.26 -5.04 115.26 105.25 3n5l n ASN 255 Ca 0.04 -2.96 -0.09 0.00 -0.53 0.00 0.00 54.58 51.04 3n5l n ASN 255 Cb 0.47 2.16 -0.03 0.00 -2.08 0.00 0.00 39.78 40.30 3n5l n ASN 255 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 3n5l h ALA 256 N 2.03 0.27 -0.41 -2.53 0.00 -1.99 -0.84 119.26 115.79 3n5l h ALA 256 Ca -0.25 0.00 0.07 0.00 0.00 0.00 0.00 54.91 54.73 3n5l h ALA 256 Cb 1.16 -0.04 -0.06 0.00 0.00 0.00 0.00 17.79 18.85 3n5l h ALA 256 CO 0.35 -0.29 0.04 1.49 0.00 0.00 0.00 179.25 180.84 3n5l h GLU 257 N 0.24 0.16 -0.21 0.00 4.22 -1.99 -0.72 114.58 116.29 3n5l h GLU 257 Ca 0.09 -0.01 -0.18 0.00 0.08 0.00 0.00 59.36 59.34 3n5l h GLU 257 Cb 0.02 -0.04 -0.00 0.00 0.50 0.00 0.00 28.75 29.23 3n5l h GLU 257 CO -0.06 0.10 -0.60 1.96 -2.18 0.00 0.00 179.01 178.24 3n5l h GLN 258 N 0.16 0.68 -0.74 1.92 4.20 -1.87 -2.37 115.11 117.10 3n5l h GLN 258 Ca 0.20 -0.46 -0.01 0.00 0.06 0.00 0.00 58.65 58.45 3n5l h GLN 258 Cb 0.27 0.06 -0.04 0.00 0.30 0.00 0.00 27.48 28.07 3n5l h GLN 258 CO -0.30 1.08 0.43 0.87 -0.67 0.00 0.00 178.83 180.25 3n5l h LYS 259 N 0.51 1.00 -0.27 1.46 1.57 -0.90 -0.97 116.57 118.97 3n5l h LYS 259 Ca -0.00 -0.09 -0.04 0.00 -1.87 0.00 0.00 60.65 58.65 3n5l h LYS 259 Cb 1.18 -0.21 -0.01 0.00 0.08 0.00 0.00 32.23 33.27 3n5l h LYS 259 CO 0.12 0.71 0.01 -0.22 -0.57 0.00 0.00 179.45 179.50 3n5l h LYS 260 N 1.02 0.48 -0.35 3.15 3.64 -0.92 -1.03 116.57 122.56 3n5l h LYS 260 Ca 0.26 -0.15 0.06 0.00 -1.27 0.00 0.00 60.65 59.56 3n5l h LYS 260 Cb -0.02 -0.05 -0.06 0.00 -0.41 0.00 0.00 32.23 31.69 3n5l h LYS 260 CO -0.05 0.63 -0.02 0.28 -2.27 0.00 0.00 179.45 178.02 3n5l h VAL 261 N 0.27 0.72 -0.19 2.00 2.07 -1.06 -0.13 116.25 119.92 3n5l h VAL 261 Ca 0.08 -0.02 0.00 0.00 0.82 0.00 0.00 66.70 67.58 3n5l h VAL 261 Cb 0.40 0.64 -0.01 0.00 -1.52 0.00 0.00 31.29 30.80 3n5l h VAL 261 CO 0.01 0.01 0.13 -0.07 0.02 0.00 0.00 177.57 177.67 3n5l h LEU 262 N 0.07 0.22 -0.85 2.57 3.38 -1.07 -2.23 115.31 117.41 3n5l h LEU 262 Ca 0.17 -0.01 0.02 0.00 0.09 0.00 0.00 57.88 58.15 3n5l h LEU 262 Cb 0.24 -0.06 -0.05 0.00 0.09 0.00 0.00 40.66 40.89 3n5l h LEU 262 CO -0.30 0.16 0.55 0.00 0.09 0.00 0.00 178.44 178.94 3n5l h ALA 263 N 1.07 1.10 0.00 1.53 0.00 -0.70 -1.03 119.26 121.23 3n5l h ALA 263 Ca 0.07 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.89 3n5l h ALA 263 Cb -0.03 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.44 3n5l h ALA 263 CO -0.02 0.42 -0.24 -0.44 0.00 0.00 0.00 179.25 178.98 3n5l h ASP 264 N 1.09 0.00 -0.03 0.00 3.32 -0.76 -0.01 116.42 120.03 3n5l h ASP 264 Ca 0.33 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.38 3n5l h ASP 264 Cb -0.05 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.50 3n5l h ASP 264 CO -0.10 0.24 0.00 0.18 -1.72 0.00 0.00 179.24 177.84 3n5l n LEU 265 N -3.67 0.75 -0.95 1.55 4.77 -0.52 -4.93 117.00 114.00 3n5l n LEU 265 Ca -0.01 -0.27 -0.09 0.00 -0.03 0.00 0.00 56.01 55.61 3n5l n LEU 265 Cb 0.36 -0.01 -0.02 0.00 -2.33 0.00 0.00 43.42 41.42 3n5l n LEU 265 CO 0.34 0.13 -0.11 0.00 -1.33 0.00 0.00 177.39 176.42 3n5l n GLN 266 N -0.38 -0.71 -4.42 3.23 6.02 -0.02 -5.00 117.38 116.09 3n5l n GLN 266 Ca 0.20 0.57 -0.25 0.00 -0.01 0.00 0.00 57.00 57.51 3n5l n GLN 266 Cb 0.22 -4.55 -0.10 0.00 1.02 0.00 0.00 30.24 26.82 3n5l n GLN 266 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 177.06 174.47 3n5l s TRP 267 N -2.43 2.36 -0.21 1.08 0.51 -0.51 -0.77 118.94 118.97 3n5l s TRP 267 Ca 0.00 -0.32 0.10 0.00 -2.12 0.00 0.00 56.10 53.76 3n5l s TRP 267 Cb 0.00 -1.08 -0.20 0.00 -0.81 0.00 0.00 33.47 31.38 3n5l s TRP 267 CO 0.00 0.63 -0.06 -1.13 -0.51 0.00 0.00 176.95 175.88 3n5l n SER 268 N -0.32 1.19 -3.62 2.95 3.41 -0.09 -3.30 113.62 113.84 3n5l n SER 268 Ca -0.08 -0.06 -0.01 0.00 -0.26 0.00 0.00 58.87 58.47 3n5l n SER 268 Cb 0.58 0.37 0.00 0.00 -0.26 0.00 0.00 64.21 64.90 3n5l n SER 268 CO 0.00 0.00 0.00 -1.59 -0.16 0.00 0.00 175.04 173.29 3n5l s LYS 269 N -2.46 0.84 0.01 4.33 -2.85 -1.24 -4.98 119.74 113.38 3n5l s LYS 269 Ca -0.19 -0.50 0.05 0.00 -1.00 0.00 0.00 55.97 54.32 3n5l s LYS 269 Cb 0.07 0.26 -0.03 0.00 -2.06 0.00 0.00 37.83 36.07 3n5l s LYS 269 CO 0.67 -0.39 -0.13 -0.06 0.10 0.00 0.00 175.35 175.54 3n5l s PHE 270 N -2.50 2.71 0.22 1.78 0.08 -1.26 -1.78 117.98 117.22 3n5l s PHE 270 Ca 0.18 -0.16 0.05 0.00 0.12 0.00 0.00 56.93 57.13 3n5l s PHE 270 Cb 0.00 -1.55 -0.05 0.00 -0.57 0.00 0.00 43.02 40.85 3n5l s PHE 270 CO 0.01 0.28 -0.07 1.14 -0.10 0.00 0.00 175.22 176.48 3n5l s GLN 271 N -1.27 1.32 0.41 0.44 -2.07 -0.03 -4.75 119.66 113.72 3n5l s GLN 271 Ca 0.15 -1.63 -0.25 0.00 -1.82 0.00 0.00 55.36 51.81 3n5l s GLN 271 Cb -0.11 -0.85 -0.08 0.00 -1.09 0.00 0.00 33.01 30.88 3n5l s GLN 271 CO 0.05 0.04 1.18 0.00 -1.32 0.00 0.00 175.29 175.24 3n5l s ALA 272 N -3.20 3.13 0.35 2.60 0.00 -1.26 -0.17 121.76 123.20 3n5l s ALA 272 Ca 0.25 0.99 -0.04 0.00 0.00 0.00 0.00 51.96 53.15 3n5l s ALA 272 Cb 0.03 -3.39 0.01 0.00 0.00 0.00 0.00 23.12 19.77 3n5l s ALA 272 CO 0.07 -0.59 0.52 0.45 0.00 0.00 0.00 175.76 176.21 3n5l s SER 273 N -1.14 0.80 0.34 0.00 0.15 -1.15 -4.59 113.70 108.11 3n5l s SER 273 Ca 0.58 -1.44 -0.05 0.00 0.70 0.00 0.00 55.95 55.74 3n5l s SER 273 Cb -0.31 0.69 0.02 0.00 -1.71 0.00 0.00 66.02 64.71 3n5l s SER 273 CO 0.39 -1.36 0.54 -0.90 1.20 0.00 0.00 173.24 173.11 3n5l n ASP 274 N -1.42 -1.53 0.30 5.45 5.68 -1.26 -4.00 116.55 119.77 3n5l n ASP 274 Ca -0.00 -2.71 0.16 0.00 -0.50 0.00 0.00 54.79 51.74 3n5l n ASP 274 Cb 0.61 2.74 0.94 0.00 -1.14 0.00 0.00 41.12 44.27 3n5l n ASP 274 CO 0.00 0.00 0.00 0.44 -1.33 0.00 0.00 177.20 176.31 3n5l h ASP 275 N 1.86 0.00 0.57 -1.12 3.32 -1.96 -1.87 116.42 117.23 3n5l h ASP 275 Ca -0.27 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.78 3n5l h ASP 275 Cb 1.13 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.68 3n5l h ASP 275 CO 0.36 0.02 0.00 0.47 -1.72 0.00 0.00 179.24 178.37 3n5l n ASP 276 N -3.66 0.42 -0.27 6.45 8.00 -1.26 -1.73 116.55 124.51 3n5l n ASP 276 Ca -0.03 0.61 0.21 0.00 0.71 0.00 0.00 54.79 56.30 3n5l n ASP 276 Cb 0.11 -0.70 0.54 0.00 -0.02 0.00 0.00 41.12 41.04 3n5l n ASP 276 CO 0.00 0.00 0.00 -0.61 -0.39 0.00 0.00 177.20 176.20 3n5l h GLN 277 N 0.00 0.35 0.00 -1.24 4.15 -1.75 -2.00 115.11 114.61 3n5l h GLN 277 Ca 0.00 -0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.40 3n5l h GLN 277 Cb 0.29 -0.08 0.00 0.00 0.21 0.00 0.00 27.48 27.90 3n5l h GLN 277 CO 0.00 0.23 0.00 1.28 -1.93 0.00 0.00 178.83 178.41 3n5l n LEU 278 N -4.51 0.00 -0.05 -2.39 4.77 -0.70 -4.34 117.00 109.77 3n5l n LEU 278 Ca 0.21 0.28 -0.08 0.00 -0.03 0.00 0.00 56.01 56.40 3n5l n LEU 278 Cb 0.79 -0.28 -0.02 0.00 -2.33 0.00 0.00 43.42 41.58 3n5l n LEU 278 CO 0.30 -0.01 0.81 -0.07 -1.33 0.00 0.00 177.39 177.08 3n5l h LEU 279 N 0.00 -0.28 -1.62 2.23 3.38 -1.54 0.13 115.31 117.61 3n5l h LEU 279 Ca 0.00 0.08 -0.04 0.00 0.09 0.00 0.00 57.88 58.01 3n5l h LEU 279 Cb 0.27 0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.19 3n5l h LEU 279 CO 0.00 -0.10 -0.18 1.55 0.09 0.00 0.00 178.44 179.80 3n5l h PRO 280 N -0.03 0.00 -0.12 1.13 0.13 -1.83 -1.13 132.00 130.15 3n5l h PRO 280 Ca 0.12 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 65.15 3n5l h PRO 280 Cb 0.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.35 3n5l h PRO 280 CO -0.26 0.18 -0.31 0.82 -0.23 0.00 0.00 178.00 178.19 3n5l h ILE 281 N 0.00 1.38 -1.00 -3.56 1.08 -1.47 -1.43 117.51 112.52 3n5l h ILE 281 Ca -0.00 -1.62 0.04 0.00 -0.39 0.00 0.00 64.86 62.89 3n5l h ILE 281 Cb 0.49 2.11 -0.06 0.00 -3.07 0.00 0.00 36.82 36.29 3n5l h ILE 281 CO 0.02 0.48 0.65 0.03 -0.69 0.00 0.00 178.15 178.64 3n5l h ARG 282 N -0.01 1.23 -0.22 2.37 3.08 -0.62 0.58 114.38 120.79 3n5l h ARG 282 Ca -0.01 -0.07 -0.00 0.00 0.07 0.00 0.00 59.98 59.97 3n5l h ARG 282 Cb 0.92 -0.28 -0.01 0.00 0.08 0.00 0.00 29.97 30.68 3n5l h ARG 282 CO 0.07 0.81 0.12 0.37 -1.07 0.00 0.00 179.97 180.27 3n5l h GLN 283 N 1.26 0.30 -0.56 0.04 4.15 -1.07 -0.68 115.11 118.55 3n5l h GLN 283 Ca 0.40 -0.04 -0.01 0.00 0.77 0.00 0.00 58.65 59.77 3n5l h GLN 283 Cb 0.00 -0.06 -0.03 0.00 0.21 0.00 0.00 27.48 27.61 3n5l h GLN 283 CO -0.12 0.29 0.32 1.25 -1.93 0.00 0.00 178.83 178.63 3n5l h LEU 284 N 0.24 0.70 -0.72 -2.39 5.85 -0.93 0.11 115.31 118.17 3n5l h LEU 284 Ca 0.08 -0.08 0.07 0.00 0.84 0.00 0.00 57.88 58.78 3n5l h LEU 284 Cb 0.07 -0.18 -0.06 0.00 0.37 0.00 0.00 40.66 40.86 3n5l h LEU 284 CO -0.01 0.58 0.40 -0.08 -0.34 0.00 0.00 178.44 178.99 3n5l h GLU 285 N 0.76 0.69 -0.05 1.25 4.57 -0.67 -0.29 114.58 120.83 3n5l h GLU 285 Ca 0.20 -0.04 -0.21 0.00 -1.18 0.00 0.00 59.36 58.13 3n5l h GLU 285 Cb 0.03 -0.16 0.00 0.00 -0.16 0.00 0.00 28.75 28.47 3n5l h GLU 285 CO -0.03 0.46 -0.83 -0.07 -1.18 0.00 0.00 179.01 177.35 3n5l h LEU 286 N 0.71 0.58 -0.62 1.64 3.38 -0.62 -1.17 115.31 119.21 3n5l h LEU 286 Ca 0.34 -0.41 0.05 0.00 0.09 0.00 0.00 57.88 57.94 3n5l h LEU 286 Cb 0.26 -0.17 -0.05 0.00 0.09 0.00 0.00 40.66 40.79 3n5l h LEU 286 CO -0.21 1.19 0.35 -0.26 0.09 0.00 0.00 178.44 179.59 3n5l h PHE 287 N 0.30 0.64 0.17 1.13 0.04 -0.41 -0.18 116.94 118.63 3n5l h PHE 287 Ca -0.06 0.02 -0.01 0.00 2.80 0.00 0.00 57.97 60.73 3n5l h PHE 287 Cb 1.44 -0.19 0.00 0.00 2.20 0.00 0.00 35.95 39.39 3n5l h PHE 287 CO 0.06 0.31 -0.08 -0.22 -0.60 0.00 0.00 178.31 177.78 3n5l h LYS 288 N 0.65 -0.23 -0.49 1.51 3.64 -0.87 -1.04 116.57 119.74 3n5l h LYS 288 Ca 0.28 0.02 0.02 0.00 -1.27 0.00 0.00 60.65 59.69 3n5l h LYS 288 Cb 0.15 0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 31.99 3n5l h LYS 288 CO -0.17 -0.07 0.30 1.96 -2.27 0.00 0.00 179.45 179.20 3n5l h GLN 289 N -0.33 0.58 -0.19 1.90 4.20 -1.03 0.18 115.11 120.41 3n5l h GLN 289 Ca -0.02 -0.03 -0.00 0.00 0.06 0.00 0.00 58.65 58.65 3n5l h GLN 289 Cb 0.26 -0.13 -0.01 0.00 0.30 0.00 0.00 27.48 27.90 3n5l h GLN 289 CO 0.04 0.38 0.11 -0.09 -0.67 0.00 0.00 178.83 178.60 3n5l h ARG 290 N 0.59 0.26 -0.45 1.46 2.43 -1.03 -0.92 114.38 116.72 3n5l h ARG 290 Ca 0.20 -0.03 -0.08 0.00 -0.81 0.00 0.00 59.98 59.25 3n5l h ARG 290 Cb 0.01 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 29.49 3n5l h ARG 290 CO -0.09 0.25 -0.05 1.15 -1.51 0.00 0.00 179.97 179.73 3n5l h THR 291 N 0.21 1.27 -0.66 0.20 2.02 -0.98 -0.08 112.91 114.88 3n5l h THR 291 Ca 0.07 -1.13 0.06 0.00 0.77 0.00 0.00 66.41 66.18 3n5l h THR 291 Cb 0.06 1.08 -0.05 0.00 -1.74 0.00 0.00 68.15 67.50 3n5l h THR 291 CO -0.01 0.39 0.37 0.44 0.37 0.00 0.00 175.52 177.08 3n5l h ASP 292 N 0.68 0.55 -0.25 4.18 3.32 -0.51 0.10 116.42 124.48 3n5l h ASP 292 Ca 0.12 0.03 -0.03 0.00 0.02 0.00 0.00 57.03 57.17 3n5l h ASP 292 Cb 0.57 -0.08 -0.01 0.00 0.22 0.00 0.00 39.33 40.03 3n5l h ASP 292 CO 0.03 0.35 0.04 0.58 -1.72 0.00 0.00 179.24 178.53 3n5l h VAL 293 N 0.68 1.23 -0.82 -1.35 2.07 -0.95 -2.63 116.25 114.49 3n5l h VAL 293 Ca 0.30 -0.77 -0.02 0.00 0.82 0.00 0.00 66.70 67.03 3n5l h VAL 293 Cb 0.18 1.25 -0.04 0.00 -1.52 0.00 0.00 31.29 31.16 3n5l h VAL 293 CO -0.18 0.25 0.43 0.00 0.02 0.00 0.00 177.57 178.09 3n5l h ALA 294 N 0.86 1.21 0.00 1.67 0.00 -0.62 -1.76 119.26 120.62 3n5l h ALA 294 Ca 0.08 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.85 3n5l h ALA 294 Cb 0.33 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 17.79 3n5l h ALA 294 CO 0.00 0.62 0.00 -0.91 0.00 0.00 0.00 179.25 178.97 3n5l h ASN 295 N 1.15 0.00 -2.71 0.00 2.35 -0.72 -3.43 115.58 112.22 3n5l h ASN 295 Ca 0.29 0.00 -0.55 0.00 -0.55 0.00 0.00 56.30 55.48 3n5l h ASN 295 Cb 0.06 0.00 -0.08 0.00 0.05 0.00 0.00 38.32 38.34 3n5l h ASN 295 CO -0.04 0.00 0.97 0.21 -1.65 0.00 0.00 177.43 176.92 3n5l s ASN 296 N -4.99 6.27 0.00 5.81 3.84 -0.67 -4.83 114.94 120.37 3n5l s ASN 296 Ca 0.02 -0.30 0.22 0.00 0.21 0.00 0.00 52.86 53.01 3n5l s ASN 296 Cb 0.09 -2.54 1.12 0.00 -0.55 0.00 0.00 41.25 39.37 3n5l s ASN 296 CO 0.45 -1.66 1.71 0.00 -2.79 0.00 0.00 177.10 174.81 3n5l n ALA 297 N 8.84 2.15 0.25 1.71 0.00 -1.26 -3.11 120.51 129.09 3n5l n ALA 297 Ca 0.04 -0.11 0.12 0.00 0.00 0.00 0.00 53.44 53.50 3n5l n ALA 297 Cb 0.49 -1.36 0.16 0.00 0.00 0.00 0.00 19.45 18.74 3n5l n ALA 297 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 3n5l h ASN 298 N 0.00 0.00 -3.86 0.00 4.21 -1.96 -3.46 115.58 110.51 3n5l h ASN 298 Ca 0.00 -0.01 -0.48 0.00 1.21 0.00 0.00 56.30 57.02 3n5l h ASN 298 Cb 0.19 0.00 -0.01 0.00 -1.12 0.00 0.00 38.32 37.38 3n5l h ASN 298 CO 0.00 0.00 0.38 -0.76 -1.29 0.00 0.00 177.43 175.76 3n5l s LEU 299 N -5.83 4.40 0.83 1.61 1.43 -1.18 -5.05 118.68 114.89 3n5l s LEU 299 Ca 0.06 1.96 -0.11 0.00 -1.03 0.00 0.00 54.13 55.00 3n5l s LEU 299 Cb 0.07 -3.91 0.09 0.00 0.03 0.00 0.00 46.19 42.47 3n5l s LEU 299 CO 0.69 -0.11 1.09 -0.83 0.23 0.00 0.00 176.35 177.42 3n5l s GLY 300 N -1.41 1.62 0.18 -3.19 0.00 -1.26 -4.81 107.32 98.45 3n5l s GLY 300 Ca 0.49 -0.12 -0.13 0.00 0.00 0.00 0.00 44.72 44.96 3n5l s GLY 300 CO 0.29 0.33 1.80 0.00 0.00 0.00 0.00 173.10 175.52 3n5l h ALA 301 N -1.27 0.69 0.00 3.20 0.00 -1.99 0.29 119.26 120.18 3n5l h ALA 301 Ca -0.48 0.00 -0.26 0.00 0.00 0.00 0.00 54.91 54.18 3n5l h ALA 301 Cb 1.27 -0.12 0.02 0.00 0.00 0.00 0.00 17.79 18.96 3n5l h ALA 301 CO 0.57 -0.02 -1.01 1.49 0.00 0.00 0.00 179.25 180.28 3n5l h GLU 302 N 0.58 0.68 -0.35 0.00 4.81 -1.99 -1.28 114.58 117.04 3n5l h GLU 302 Ca 0.22 -0.74 0.03 0.00 -0.13 0.00 0.00 59.36 58.74 3n5l h GLU 302 Cb 0.08 0.21 -0.03 0.00 0.63 0.00 0.00 28.75 29.64 3n5l h GLU 302 CO -0.13 1.32 0.16 1.49 -0.73 0.00 0.00 179.01 181.12 3n5l h GLU 303 N 0.36 0.33 -0.23 1.92 4.81 -1.91 -0.89 114.58 118.98 3n5l h GLU 303 Ca -0.13 -0.02 -0.02 0.00 -0.13 0.00 0.00 59.36 59.06 3n5l h GLU 303 Cb 1.67 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 30.97 3n5l h GLU 303 CO 0.20 0.22 0.05 -0.22 -0.73 0.00 0.00 179.01 178.53 3n5l h LYS 304 N 0.34 0.37 -0.93 1.92 3.64 -0.90 -2.10 116.57 118.90 3n5l h LYS 304 Ca 0.15 -0.09 0.00 0.00 -1.27 0.00 0.00 60.65 59.44 3n5l h LYS 304 Cb 0.07 -0.05 -0.05 0.00 -0.41 0.00 0.00 32.23 31.80 3n5l h LYS 304 CO -0.11 0.49 0.59 0.00 -2.27 0.00 0.00 179.45 178.15 3n5l h ALA 305 N 0.86 1.28 -0.13 5.00 0.00 -1.05 -0.55 119.26 124.67 3n5l h ALA 305 Ca 0.07 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 3n5l h ALA 305 Cb 0.29 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 3n5l h ALA 305 CO 0.00 0.64 0.02 0.00 0.00 0.00 0.00 179.25 179.91 3n5l h ALA 306 N 1.37 0.17 -0.29 0.00 0.00 -1.07 -0.61 119.26 118.83 3n5l h ALA 306 Ca 0.34 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 55.07 3n5l h ALA 306 Cb -0.10 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 3n5l h ALA 306 CO -0.07 -0.16 0.14 0.87 0.00 0.00 0.00 179.25 180.03 3n5l h LYS 307 N -0.01 0.42 -0.53 0.00 1.57 -0.99 -2.32 116.57 114.71 3n5l h LYS 307 Ca 0.04 -0.06 -0.07 0.00 -1.87 0.00 0.00 60.65 58.69 3n5l h LYS 307 Cb 0.31 -0.08 -0.02 0.00 0.08 0.00 0.00 32.23 32.52 3n5l h LYS 307 CO 0.00 0.40 0.06 -0.07 -0.57 0.00 0.00 179.45 179.27 3n5l h LEU 308 N 0.34 0.82 -0.24 2.94 3.38 -1.08 -0.38 115.31 121.10 3n5l h LEU 308 Ca 0.10 -0.18 0.01 0.00 0.09 0.00 0.00 57.88 57.90 3n5l h LEU 308 Cb 0.11 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.63 3n5l h LEU 308 CO -0.01 0.85 0.12 0.50 0.09 0.00 0.00 178.44 179.98 3n5l h LYS 309 N 0.81 0.24 -0.12 1.13 3.64 -0.96 0.14 116.57 121.45 3n5l h LYS 309 Ca 0.16 -0.01 0.03 0.00 -1.27 0.00 0.00 60.65 59.56 3n5l h LYS 309 Cb 0.40 -0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 32.14 3n5l h LYS 309 CO 0.01 0.16 -0.04 0.00 -2.27 0.00 0.00 179.45 177.31 3n5l h ALA 310 N 1.12 0.07 -0.79 5.00 0.00 -1.13 -1.02 119.26 122.52 3n5l h ALA 310 Ca 0.10 0.05 -0.02 0.00 0.00 0.00 0.00 54.91 55.04 3n5l h ALA 310 Cb 0.03 0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.89 3n5l h ALA 310 CO -0.07 -0.50 0.41 -0.07 0.00 0.00 0.00 179.25 179.03 3n5l h LEU 311 N -0.02 1.00 -1.21 0.00 3.38 -0.89 -1.85 115.31 115.72 3n5l h LEU 311 Ca 0.06 -0.11 -0.06 0.00 0.09 0.00 0.00 57.88 57.86 3n5l h LEU 311 Cb 0.11 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.59 3n5l h LEU 311 CO -0.14 0.83 -0.15 0.44 0.09 0.00 0.00 178.44 179.52 3n5l h ASP 312 N 1.10 0.35 -0.37 -0.43 3.32 -0.51 -0.41 116.42 119.47 3n5l h ASP 312 Ca 0.27 -0.09 -0.04 0.00 0.02 0.00 0.00 57.03 57.20 3n5l h ASP 312 Cb 0.07 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 39.51 3n5l h ASP 312 CO -0.04 0.52 0.08 -0.33 -1.72 0.00 0.00 179.24 177.75 3n5l h GLU 313 N 0.34 0.60 -0.77 3.56 5.08 -0.70 0.00 114.58 122.69 3n5l h GLU 313 Ca 0.06 -0.15 0.01 0.00 -1.00 0.00 0.00 59.36 58.28 3n5l h GLU 313 Cb 0.46 -0.08 -0.04 0.00 0.50 0.00 0.00 28.75 29.60 3n5l h GLU 313 CO 0.03 0.65 0.51 0.93 -1.00 0.00 0.00 179.01 180.13 3n5l h GLU 314 N 0.45 1.01 -0.61 2.33 5.08 -1.04 -1.37 114.58 120.44 3n5l h GLU 314 Ca 0.11 -0.06 -0.05 0.00 -1.00 0.00 0.00 59.36 58.36 3n5l h GLU 314 Cb 0.32 -0.23 -0.03 0.00 0.50 0.00 0.00 28.75 29.32 3n5l h GLU 314 CO 0.00 0.67 0.18 -0.07 -1.00 0.00 0.00 179.01 178.79 3n5l h LEU 315 N 1.04 0.89 -0.03 1.33 3.38 -0.92 -1.58 115.31 119.41 3n5l h LEU 315 Ca 0.29 -0.21 0.01 0.00 0.09 0.00 0.00 57.88 58.05 3n5l h LEU 315 Cb -0.11 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.40 3n5l h LEU 315 CO -0.07 0.86 -0.01 0.00 0.09 0.00 0.00 178.44 179.32 3n5l h ALA 316 N 1.06 0.02 -0.70 1.53 0.00 -0.68 0.66 119.26 121.16 3n5l h ALA 316 Ca 0.19 0.01 0.06 0.00 0.00 0.00 0.00 54.91 55.17 3n5l h ALA 316 Cb 0.30 0.03 -0.05 0.00 0.00 0.00 0.00 17.79 18.06 3n5l h ALA 316 CO -0.00 -0.50 0.40 0.87 0.00 0.00 0.00 179.25 180.02 3n5l h LYS 317 N -0.00 0.72 -0.34 0.00 6.56 -1.14 -1.40 116.57 120.97 3n5l h LYS 317 Ca 0.02 -0.04 -0.05 0.00 -1.06 0.00 0.00 60.65 59.51 3n5l h LYS 317 Cb 0.03 -0.16 -0.01 0.00 -0.57 0.00 0.00 32.23 31.51 3n5l h LYS 317 CO -0.04 0.48 0.01 1.25 -2.06 0.00 0.00 179.45 179.09 3n5l h LEU 318 N 0.74 0.58 -0.91 2.94 5.85 -0.90 -2.57 115.31 121.04 3n5l h LEU 318 Ca 0.31 -0.30 -0.10 0.00 0.84 0.00 0.00 57.88 58.62 3n5l h LEU 318 Cb 0.17 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 41.03 3n5l h LEU 318 CO -0.17 0.74 -0.48 -0.33 -0.34 0.00 0.00 178.44 177.85 3n5l h GLU 319 N 0.40 0.00 -0.12 1.25 5.08 -0.59 -2.37 114.58 118.23 3n5l h GLU 319 Ca 0.10 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.45 3n5l h GLU 319 Cb 0.44 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.68 3n5l h GLU 319 CO 0.02 0.48 0.06 -0.22 -1.00 0.00 0.00 179.01 178.34 3n5l h LYS 320 N 0.00 0.18 -1.23 2.33 1.63 -1.20 0.40 116.57 118.67 3n5l h LYS 320 Ca -0.00 -0.03 0.00 0.00 -0.85 0.00 0.00 60.65 59.77 3n5l h LYS 320 Cb 0.95 -0.03 0.00 0.00 -0.60 0.00 0.00 32.23 32.55 3n5l h LYS 320 CO 0.06 0.25 0.00 -2.13 -3.45 0.00 0.00 179.45 174.18 3n5l n ARG 321 N -4.92 0.00 0.00 1.90 0.63 -0.89 -0.98 116.66 112.40 3n5l n ARG 321 Ca -0.05 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.88 3n5l n ARG 321 Cb 0.10 -1.31 0.00 0.00 0.45 0.00 0.00 32.46 31.70 3n5l n ARG 321 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 3n5l n ALA 323 N 0.81 0.00 -0.10 5.13 0.00 0.13 -2.03 120.51 124.44 3n5l n ALA 323 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.36 3n5l n ALA 323 Cb 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.45 3n5l n ALA 323 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 3n5l h GLU 324 N 0.00 0.43 -0.38 0.00 5.08 -1.32 -0.94 114.58 117.45 3n5l h GLU 324 Ca 0.00 -0.03 -0.03 0.00 -1.00 0.00 0.00 59.36 58.31 3n5l h GLU 324 Cb 0.00 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.14 3n5l h GLU 324 CO 0.00 0.28 0.14 -0.09 -1.00 0.00 0.00 179.01 178.34 3n5l h ARG 325 N 0.44 0.58 -0.29 2.33 2.43 -1.68 -1.83 114.38 116.36 3n5l h ARG 325 Ca 0.13 -0.11 -0.08 0.00 -0.81 0.00 0.00 59.98 59.11 3n5l h ARG 325 Cb -0.02 -0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 29.42 3n5l h ARG 325 CO -0.05 0.57 -0.14 1.49 -1.51 0.00 0.00 179.97 180.33 3n5l h GLU 326 N 0.47 0.51 0.00 0.20 4.81 -1.81 -2.80 114.58 115.96 3n5l h GLU 326 Ca 0.13 -0.15 -0.09 0.00 -0.13 0.00 0.00 59.36 59.12 3n5l h GLU 326 Cb 0.21 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.53 3n5l h GLU 326 CO -0.01 0.64 -0.41 1.96 -0.73 0.00 0.00 179.01 180.47 3n5l h GLN 327 N 0.47 0.00 -0.02 1.92 4.20 -1.06 -1.54 115.11 119.07 3n5l h GLN 327 Ca 0.08 0.00 -0.17 0.00 0.06 0.00 0.00 58.65 58.62 3n5l h GLN 327 Cb 0.52 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.29 3n5l h GLN 327 CO 0.03 0.41 -0.76 -0.22 -0.67 0.00 0.00 178.83 177.62 3n5l h LYS 328 N 0.00 0.18 -0.03 1.46 3.64 -1.28 -0.08 116.57 120.46 3n5l h LYS 328 Ca -0.00 -0.16 -0.11 0.00 -1.27 0.00 0.00 60.65 59.11 3n5l h LYS 328 Cb 1.19 0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 33.03 3n5l h LYS 328 CO 0.05 0.85 -0.48 1.15 -2.27 0.00 0.00 179.45 178.76 3n5l h THR 329 N 0.12 1.34 0.59 1.00 2.02 -1.42 -3.26 112.91 113.30 3n5l h THR 329 Ca -0.02 -1.66 -0.03 0.00 0.77 0.00 0.00 66.41 65.46 3n5l h THR 329 Cb 1.33 1.86 0.01 0.00 -1.74 0.00 0.00 68.15 69.60 3n5l h THR 329 CO 0.11 0.48 -0.28 0.00 0.37 0.00 0.00 175.52 176.20 3n5l h ALA 330 N 1.45 -0.79 -0.02 6.16 0.00 -1.10 -3.51 119.26 121.43 3n5l h ALA 330 Ca 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.71 3n5l h ALA 330 Cb 0.87 0.31 0.00 0.00 0.00 0.00 0.00 17.79 18.97 3n5l h ALA 330 CO 0.07 -0.79 0.00 0.00 0.00 0.00 0.00 179.25 178.53