#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1u5b n TYR 15 N 0.00 3.40 -4.30 -0.32 4.01 -1.26 -5.08 117.16 113.61 1u5b n TYR 15 Ca 0.00 -3.08 0.00 0.00 -0.16 0.00 0.00 57.90 54.66 1u5b n TYR 15 Cb 0.00 -0.14 0.00 0.00 -0.31 0.00 0.00 39.34 38.89 1u5b n TYR 15 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1u5b n GLY 16 N -0.48 -1.57 3.76 2.72 0.00 -1.26 -4.73 105.19 103.63 1u5b n GLY 16 Ca 0.40 -1.27 -0.41 0.00 0.00 0.00 0.00 46.02 44.73 1u5b n GLY 16 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1u5b s GLN 17 N 0.00 4.15 0.38 1.61 0.74 -1.26 -4.88 119.66 120.39 1u5b s GLN 17 Ca 0.00 2.53 0.08 0.00 0.05 0.00 0.00 55.36 58.02 1u5b s GLN 17 Cb 0.00 -3.03 -0.06 0.00 1.10 0.00 0.00 33.01 31.02 1u5b s GLN 17 CO 0.00 -0.57 0.06 0.95 -0.55 0.00 0.00 175.29 175.18 1u5b s THR 18 N -0.26 2.38 0.09 -0.34 -4.23 -1.26 -1.56 115.64 110.46 1u5b s THR 18 Ca 0.60 -1.90 -0.10 0.00 -1.18 0.00 0.00 61.69 59.11 1u5b s THR 18 Cb -0.46 -2.90 0.01 0.00 1.34 0.00 0.00 72.50 70.48 1u5b s THR 18 CO 0.50 -0.09 0.23 0.00 -0.54 0.00 0.00 174.62 174.72 1u5b s GLN 19 N -3.77 0.86 -0.00 3.99 -2.07 -0.51 -4.86 119.66 113.29 1u5b s GLN 19 Ca 0.37 -0.86 -0.30 0.00 -1.82 0.00 0.00 55.36 52.74 1u5b s GLN 19 Cb 0.03 0.36 -0.06 0.00 -1.09 0.00 0.00 33.01 32.25 1u5b s GLN 19 CO 0.20 -0.28 1.54 0.15 -1.32 0.00 0.00 175.29 175.58 1u5b s LYS 20 N -3.65 4.23 -0.00 9.60 1.02 -1.26 -0.24 119.74 129.43 1u5b s LYS 20 Ca 0.03 2.12 0.01 0.00 0.02 0.00 0.00 55.97 58.15 1u5b s LYS 20 Cb 0.04 -3.71 -0.00 0.00 -0.52 0.00 0.00 37.83 33.63 1u5b s LYS 20 CO -0.10 -0.71 -0.04 -1.64 -0.92 0.00 0.00 175.35 171.94 1u5b s MET 21 N 3.00 0.30 0.54 1.68 -1.94 0.03 -4.88 119.30 118.03 1u5b s MET 21 Ca 0.69 -0.15 -0.05 0.00 -1.71 0.00 0.00 55.69 54.47 1u5b s MET 21 Cb -0.34 -0.29 0.12 0.00 2.01 0.00 0.00 34.83 36.33 1u5b s MET 21 CO 0.28 0.08 0.73 0.27 -0.01 0.00 0.00 175.02 176.38 1u5b n ASN 22 N 2.95 0.47 -0.02 3.03 0.23 -1.26 -0.99 115.26 119.67 1u5b n ASN 22 Ca -0.13 -1.52 -0.11 0.00 -0.53 0.00 0.00 54.58 52.29 1u5b n ASN 22 Cb 0.59 -0.52 -0.06 0.00 -2.08 0.00 0.00 39.78 37.70 1u5b n ASN 22 CO 0.00 0.00 0.00 0.25 -0.93 0.00 0.00 177.26 176.58 1u5b h LEU 23 N 0.00 0.15 -1.00 -4.53 5.85 -1.61 -0.71 115.31 113.45 1u5b h LEU 23 Ca -0.24 -0.15 -0.00 0.00 0.84 0.00 0.00 57.88 58.33 1u5b h LEU 23 Cb 0.76 -0.04 -0.04 0.00 0.37 0.00 0.00 40.66 41.71 1u5b h LEU 23 CO 0.21 0.26 0.55 2.19 -0.34 0.00 0.00 178.44 181.31 1u5b h PHE 24 N 0.03 1.20 -0.29 1.25 -5.15 -1.70 -1.65 116.94 110.64 1u5b h PHE 24 Ca 0.04 -0.00 -0.12 0.00 -0.20 0.00 0.00 57.97 57.68 1u5b h PHE 24 Cb 0.15 -0.39 -0.01 0.00 0.22 0.00 0.00 35.95 35.92 1u5b h PHE 24 CO -0.02 0.79 -0.33 1.96 -2.00 0.00 0.00 178.31 178.71 1u5b h GLN 25 N 1.26 0.62 -0.10 6.09 4.20 -1.71 -1.89 115.11 123.58 1u5b h GLN 25 Ca 0.33 -0.28 -0.07 0.00 0.06 0.00 0.00 58.65 58.68 1u5b h GLN 25 Cb -0.06 -0.01 -0.01 0.00 0.30 0.00 0.00 27.48 27.70 1u5b h GLN 25 CO -0.06 0.87 -0.25 0.66 -0.67 0.00 0.00 178.83 179.38 1u5b h SER 26 N 0.53 0.16 0.07 1.46 4.64 -0.43 -0.82 113.55 119.17 1u5b h SER 26 Ca 0.06 -0.05 -0.00 0.00 -0.47 0.00 0.00 61.79 61.33 1u5b h SER 26 Cb 0.82 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 62.87 1u5b h SER 26 CO 0.07 0.42 -0.03 0.58 -0.87 0.00 0.00 176.83 177.00 1u5b h VAL 27 N 0.15 1.13 -0.90 0.95 2.07 -0.94 -1.28 116.25 117.43 1u5b h VAL 27 Ca 0.03 -0.69 0.16 0.00 0.82 0.00 0.00 66.70 67.02 1u5b h VAL 27 Cb 0.53 1.57 -0.10 0.00 -1.52 0.00 0.00 31.29 31.77 1u5b h VAL 27 CO 0.04 0.17 0.49 0.74 0.02 0.00 0.00 177.57 179.02 1u5b h THR 28 N -0.40 0.72 -0.29 2.57 2.02 -0.99 -1.19 112.91 115.35 1u5b h THR 28 Ca -0.01 -0.23 -0.11 0.00 0.77 0.00 0.00 66.41 66.84 1u5b h THR 28 Cb 0.35 -0.00 -0.01 0.00 -1.74 0.00 0.00 68.15 66.75 1u5b h THR 28 CO 0.02 0.12 -0.24 -1.28 0.37 0.00 0.00 175.52 174.51 1u5b h SER 29 N 0.66 0.71 -0.54 4.18 0.87 -1.01 0.03 113.55 118.45 1u5b h SER 29 Ca 0.50 -0.45 0.08 0.00 -1.23 0.00 0.00 61.79 60.68 1u5b h SER 29 Cb 0.73 -0.20 -0.06 0.00 -0.44 0.00 0.00 62.40 62.42 1u5b h SER 29 CO -0.37 1.02 0.19 0.00 -0.53 0.00 0.00 176.83 177.14 1u5b h ALA 30 N 0.72 0.67 -0.24 6.23 0.00 -0.78 0.23 119.26 126.09 1u5b h ALA 30 Ca 0.05 0.07 -0.12 0.00 0.00 0.00 0.00 54.91 54.92 1u5b h ALA 30 Cb 0.79 0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.63 1u5b h ALA 30 CO 0.06 -0.21 -0.31 -0.07 0.00 0.00 0.00 179.25 178.73 1u5b h LEU 31 N 0.37 0.68 -0.26 0.00 3.38 -0.98 -1.45 115.31 117.06 1u5b h LEU 31 Ca 0.26 -0.50 0.02 0.00 0.09 0.00 0.00 57.88 57.75 1u5b h LEU 31 Cb 0.30 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.83 1u5b h LEU 31 CO -0.27 1.05 0.12 -0.78 0.09 0.00 0.00 178.44 178.65 1u5b h ASP 32 N 0.33 0.17 -0.72 -0.43 1.82 -0.86 -0.67 116.42 116.06 1u5b h ASP 32 Ca 0.03 0.01 0.09 0.00 -0.39 0.00 0.00 57.03 56.77 1u5b h ASP 32 Cb 0.88 -0.02 -0.07 0.00 0.68 0.00 0.00 39.33 40.81 1u5b h ASP 32 CO 0.07 0.13 0.37 0.78 -1.61 0.00 0.00 179.24 178.98 1u5b h ASN 33 N 0.26 0.49 -0.29 2.28 -0.26 -0.82 -0.92 115.58 116.32 1u5b h ASN 33 Ca 0.11 0.06 -0.03 0.00 -0.56 0.00 0.00 56.30 55.87 1u5b h ASN 33 Cb 0.04 -0.03 -0.01 0.00 -1.06 0.00 0.00 38.32 37.26 1u5b h ASN 33 CO -0.08 0.28 0.06 0.28 -1.06 0.00 0.00 177.43 176.91 1u5b h SER 34 N 0.63 0.45 -0.68 5.81 0.02 -0.89 -2.06 113.55 116.82 1u5b h SER 34 Ca 0.35 -0.25 -0.03 0.00 -0.84 0.00 0.00 61.79 61.03 1u5b h SER 34 Cb 0.35 -0.12 -0.03 0.00 0.14 0.00 0.00 62.40 62.75 1u5b h SER 34 CO -0.26 0.58 0.31 -0.07 -1.14 0.00 0.00 176.83 176.25 1u5b h LEU 35 N 0.30 0.90 -0.90 5.07 3.38 -0.77 -1.77 115.31 121.51 1u5b h LEU 35 Ca 0.09 -0.14 -0.02 0.00 0.09 0.00 0.00 57.88 57.89 1u5b h LEU 35 Cb 0.31 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 40.79 1u5b h LEU 35 CO 0.00 0.79 0.48 0.00 0.09 0.00 0.00 178.44 179.81 1u5b h ALA 36 N 1.14 1.15 0.00 1.53 0.00 -0.97 -3.18 119.26 118.94 1u5b h ALA 36 Ca 0.23 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1u5b h ALA 36 Cb 0.14 -0.36 0.00 0.00 0.00 0.00 0.00 17.79 17.58 1u5b h ALA 36 CO -0.03 0.67 -1.28 0.36 0.00 0.00 0.00 179.25 178.97 1u5b n LYS 37 N -4.32 0.28 -3.86 0.00 2.85 -0.79 -4.78 118.16 107.53 1u5b n LYS 37 Ca 0.09 -0.06 -0.30 0.00 -1.05 0.00 0.00 58.31 56.99 1u5b n LYS 37 Cb 0.11 -1.54 -0.15 0.00 -0.65 0.00 0.00 35.03 32.80 1u5b n LYS 37 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 177.40 177.69 1u5b s ASP 38 N -3.72 4.32 0.47 -5.58 -1.08 -0.68 -4.99 116.67 105.41 1u5b s ASP 38 Ca 0.02 -1.83 0.32 0.00 -0.52 0.00 0.00 52.55 50.54 1u5b s ASP 38 Cb 0.15 -1.20 1.50 0.00 -1.46 0.00 0.00 42.92 41.91 1u5b s ASP 38 CO 0.86 -0.39 1.95 -0.65 0.52 0.00 0.00 175.17 177.46 1u5b h PRO 39 N 7.88 0.00 0.00 4.34 0.11 -1.86 -2.41 132.00 140.06 1u5b h PRO 39 Ca -0.10 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.01 1u5b h PRO 39 Cb 1.02 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.13 1u5b h PRO 39 CO 0.49 0.00 0.00 0.25 -0.21 0.00 0.00 178.00 178.53 1u5b n THR 40 N -2.72 0.53 -2.47 -1.15 -2.24 -1.26 -4.92 114.28 100.04 1u5b n THR 40 Ca -0.00 -0.23 -0.41 0.00 -2.27 0.00 0.00 64.05 61.14 1u5b n THR 40 Cb 0.18 -0.59 -0.04 0.00 -2.10 0.00 0.00 70.33 67.77 1u5b n THR 40 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1u5b s ALA 41 N -3.09 3.40 0.09 6.98 0.00 -0.91 -3.86 121.76 124.36 1u5b s ALA 41 Ca 0.11 0.88 0.03 0.00 0.00 0.00 0.00 51.96 52.98 1u5b s ALA 41 Cb 0.13 -3.35 -0.03 0.00 0.00 0.00 0.00 23.12 19.87 1u5b s ALA 41 CO 0.58 -0.20 -0.09 0.14 0.00 0.00 0.00 175.76 176.18 1u5b s VAL 42 N -0.69 0.84 -0.05 0.00 -7.23 -0.66 -4.91 120.40 107.70 1u5b s VAL 42 Ca 0.47 -1.60 0.03 0.00 -1.81 0.00 0.00 61.98 59.07 1u5b s VAL 42 Cb -0.31 -1.29 0.01 0.00 0.56 0.00 0.00 36.38 35.34 1u5b s VAL 42 CO 0.38 -0.58 -0.12 -0.63 -0.31 0.00 0.00 175.10 173.84 1u5b s ILE 43 N -2.45 1.08 0.04 -0.62 1.01 0.94 -0.99 121.20 120.21 1u5b s ILE 43 Ca 0.04 -0.49 -0.27 0.00 0.00 0.00 0.00 60.65 59.93 1u5b s ILE 43 Cb -0.03 -0.97 0.07 0.00 0.01 0.00 0.00 42.46 41.54 1u5b s ILE 43 CO -0.01 0.33 0.62 0.72 0.00 0.00 0.00 174.94 176.61 1u5b s PHE 44 N 0.38 -0.57 -5.00 3.97 -0.12 -0.94 -1.46 117.98 114.24 1u5b s PHE 44 Ca -0.08 0.73 0.00 0.00 -0.05 0.00 0.00 56.93 57.53 1u5b s PHE 44 Cb -0.13 0.44 0.00 0.00 -0.63 0.00 0.00 43.02 42.71 1u5b s PHE 44 CO 0.02 -0.69 0.00 0.41 -0.05 0.00 0.00 175.22 174.91 1u5b n GLY 45 N 0.39 -0.99 3.69 1.99 0.00 -1.14 -0.87 105.19 108.26 1u5b n GLY 45 Ca -0.18 -1.29 -0.42 0.00 0.00 0.00 0.00 46.02 44.13 1u5b n GLY 45 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1u5b s GLU 46 N -2.00 4.31 -1.71 1.61 2.02 -1.26 -1.33 118.70 120.34 1u5b s GLU 46 Ca 0.00 1.84 0.00 0.00 0.02 0.00 0.00 54.97 56.83 1u5b s GLU 46 Cb 0.00 -3.57 0.00 0.00 0.10 0.00 0.00 34.13 30.66 1u5b s GLU 46 CO 0.00 -0.52 0.00 -0.25 0.02 0.00 0.00 175.26 174.51 1u5b n ASP 47 N 5.32 -5.45 0.23 -0.19 8.00 -1.26 -4.82 116.55 118.37 1u5b n ASP 47 Ca 0.12 0.40 0.11 0.00 0.71 0.00 0.00 54.79 56.13 1u5b n ASP 47 Cb 0.45 -4.37 0.49 0.00 -0.02 0.00 0.00 41.12 37.66 1u5b n ASP 47 CO 0.00 0.00 0.00 -0.37 -0.39 0.00 0.00 177.20 176.44 1u5b h VAL 48 N 0.00 0.51 -0.52 2.53 -1.51 -1.85 -2.22 116.25 113.19 1u5b h VAL 48 Ca -0.33 -1.04 -0.04 0.00 -1.23 0.00 0.00 66.70 64.06 1u5b h VAL 48 Cb 1.22 1.72 -0.02 0.00 -2.13 0.00 0.00 31.29 32.08 1u5b h VAL 48 CO 0.48 0.20 0.17 0.00 -1.23 0.00 0.00 177.57 177.19 1u5b h ALA 49 N 1.80 0.68 0.00 5.19 0.00 -1.85 -2.35 119.26 122.73 1u5b h ALA 49 Ca -0.00 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.72 1u5b h ALA 49 Cb 0.71 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.30 1u5b h ALA 49 CO 0.03 0.33 0.00 1.97 0.00 0.00 0.00 179.25 181.58 1u5b n PHE 50 N -4.49 0.00 0.00 0.00 -1.74 -1.26 -4.61 117.46 105.37 1u5b n PHE 50 Ca 0.02 0.00 0.00 0.00 -0.56 0.00 0.00 57.45 56.91 1u5b n PHE 50 Cb 0.19 -0.42 0.00 0.00 1.52 0.00 0.00 39.48 40.77 1u5b n PHE 50 CO 0.00 0.00 0.00 0.41 -0.56 0.00 0.00 176.76 176.61 1u5b n GLY 51 N 1.32 0.98 0.00 4.97 0.00 -0.88 -4.76 105.19 106.81 1u5b n GLY 51 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.11 1u5b n GLY 51 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1u5b n GLY 52 N 0.00 -1.03 0.20 -0.02 0.00 -0.84 -1.19 105.19 102.31 1u5b n GLY 52 Ca 0.00 -1.53 0.15 0.00 0.00 0.00 0.00 46.02 44.63 1u5b n GLY 52 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 1u5b h VAL 53 N 0.00 0.00 -0.41 1.61 -1.51 -1.88 -1.55 116.25 112.52 1u5b h VAL 53 Ca 0.00 -0.32 0.00 0.00 -1.23 0.00 0.00 66.70 65.15 1u5b h VAL 53 Cb 0.00 1.17 0.00 0.00 -2.13 0.00 0.00 31.29 30.33 1u5b h VAL 53 CO 0.00 0.00 0.00 0.49 -1.23 0.00 0.00 177.57 176.83 1u5b n PHE 54 N -2.63 0.62 -1.41 5.19 3.72 -1.26 -4.99 117.46 116.70 1u5b n PHE 54 Ca 0.01 -0.54 -0.14 0.00 -0.05 0.00 0.00 57.45 56.74 1u5b n PHE 54 Cb 0.24 -0.06 -0.06 0.00 -0.94 0.00 0.00 39.48 38.67 1u5b n PHE 54 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 1u5b n ARG 55 N 0.61 -0.94 0.18 -1.08 5.12 -0.58 -4.90 116.66 115.07 1u5b n ARG 55 Ca 0.15 0.97 0.14 0.00 -1.93 0.00 0.00 57.85 57.18 1u5b n ARG 55 Cb 0.51 -5.05 0.54 0.00 -1.16 0.00 0.00 32.46 27.31 1u5b n ARG 55 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1u5b n THR 57 N -2.58 2.06 -1.58 0.00 -2.24 -0.33 -3.51 114.28 106.10 1u5b n THR 57 Ca 0.02 -2.30 -0.49 0.00 -2.27 0.00 0.00 64.05 59.01 1u5b n THR 57 Cb 0.28 -0.25 -0.04 0.00 -2.10 0.00 0.00 70.33 68.22 1u5b n THR 57 CO 0.00 0.00 0.00 1.33 -0.57 0.00 0.00 175.07 175.83 1u5b n VAL 58 N -1.16 0.81 0.00 2.28 0.24 -1.15 -2.46 118.33 116.89 1u5b n VAL 58 Ca 0.19 -0.20 0.00 0.00 -2.04 0.00 0.00 64.34 62.28 1u5b n VAL 58 Cb 0.73 -0.88 0.00 0.00 -1.47 0.00 0.00 33.84 32.23 1u5b n VAL 58 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1u5b n GLY 59 N 2.08 2.89 0.16 7.63 0.00 -1.26 -4.84 105.19 111.85 1u5b n GLY 59 Ca 0.15 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 46.01 1u5b n GLY 59 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1u5b h LEU 60 N 0.00 0.63 -0.70 0.99 3.38 -1.83 -1.34 115.31 116.44 1u5b h LEU 60 Ca 0.00 -0.52 0.00 0.00 0.09 0.00 0.00 57.88 57.45 1u5b h LEU 60 Cb 0.00 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.52 1u5b h LEU 60 CO 0.00 1.33 0.44 -0.09 0.09 0.00 0.00 178.44 180.22 1u5b h ARG 61 N 0.26 0.94 -0.62 1.13 2.43 -1.82 0.23 114.38 116.93 1u5b h ARG 61 Ca -0.10 -0.07 -0.10 0.00 -0.81 0.00 0.00 59.98 58.90 1u5b h ARG 61 Cb 1.66 -0.20 -0.02 0.00 -0.42 0.00 0.00 29.97 30.98 1u5b h ARG 61 CO 0.18 0.64 0.01 -0.44 -1.51 0.00 0.00 179.97 178.85 1u5b h ASP 62 N 0.95 1.06 -0.03 -3.80 3.32 -1.85 0.48 116.42 116.56 1u5b h ASP 62 Ca 0.25 -0.30 -0.19 0.00 0.02 0.00 0.00 57.03 56.82 1u5b h ASP 62 Cb -0.07 -0.28 0.00 0.00 0.22 0.00 0.00 39.33 39.19 1u5b h ASP 62 CO -0.05 1.10 -0.67 0.50 -1.72 0.00 0.00 179.24 178.40 1u5b h LYS 63 N 0.99 0.65 0.00 3.56 3.64 -0.95 -3.38 116.57 121.08 1u5b h LYS 63 Ca 0.18 -0.48 0.00 0.00 -1.27 0.00 0.00 60.65 59.08 1u5b h LYS 63 Cb 0.55 0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.45 1u5b h LYS 63 CO 0.03 1.10 -0.73 0.66 -2.27 0.00 0.00 179.45 178.24 1u5b n TYR 64 N -3.93 0.00 0.00 1.91 4.01 0.04 -5.10 117.16 114.10 1u5b n TYR 64 Ca -0.05 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.69 1u5b n TYR 64 Cb 0.68 -0.05 0.00 0.00 -0.31 0.00 0.00 39.34 39.66 1u5b n TYR 64 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1u5b n GLY 65 N 1.74 2.83 0.29 2.72 0.00 0.16 -4.66 105.19 108.26 1u5b n GLY 65 Ca -0.00 -1.81 0.18 0.00 0.00 0.00 0.00 46.02 44.40 1u5b n GLY 65 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 1u5b h LYS 66 N 0.00 0.00 -0.00 1.61 2.10 -1.82 -1.29 116.57 117.17 1u5b h LYS 66 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1u5b h LYS 66 Cb 0.00 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.33 1u5b h LYS 66 CO 0.00 0.00 -0.02 -0.40 -2.00 0.00 0.00 179.45 177.03 1u5b n ASP 67 N -3.05 0.02 -0.01 7.07 5.75 -1.26 -3.97 116.55 121.10 1u5b n ASP 67 Ca -0.00 0.37 0.02 0.00 -0.01 0.00 0.00 54.79 55.17 1u5b n ASP 67 Cb 0.24 -0.44 -0.07 0.00 -1.03 0.00 0.00 41.12 39.83 1u5b n ASP 67 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1u5b n ARG 68 N -1.46 0.90 -3.72 0.11 1.74 -0.53 -4.90 116.66 108.79 1u5b n ARG 68 Ca 0.08 -0.06 -0.28 0.00 -0.77 0.00 0.00 57.85 56.82 1u5b n ARG 68 Cb 0.32 -1.22 -0.16 0.00 -1.02 0.00 0.00 32.46 30.38 1u5b n ARG 68 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1u5b s VAL 69 N -2.52 0.49 0.05 1.55 1.01 -0.94 -0.04 120.40 120.00 1u5b s VAL 69 Ca -0.04 -0.59 -0.15 0.00 0.00 0.00 0.00 61.98 61.20 1u5b s VAL 69 Cb 0.05 -1.04 0.03 0.00 0.00 0.00 0.00 36.38 35.41 1u5b s VAL 69 CO 0.37 -0.26 0.35 0.72 0.00 0.00 0.00 175.10 176.28 1u5b s PHE 70 N 1.87 -0.17 0.21 5.22 -0.71 -0.53 -4.63 117.98 119.24 1u5b s PHE 70 Ca 0.00 0.04 -0.28 0.00 -1.04 0.00 0.00 56.93 55.65 1u5b s PHE 70 Cb -0.17 0.15 -0.08 0.00 -1.21 0.00 0.00 43.02 41.71 1u5b s PHE 70 CO -0.10 -0.55 0.87 -0.80 -1.34 0.00 0.00 175.22 173.30 1u5b s ASN 71 N -2.14 7.54 0.42 1.98 0.01 -1.26 -2.86 114.94 118.63 1u5b s ASN 71 Ca -0.04 1.82 0.08 0.00 -0.71 0.00 0.00 52.86 54.01 1u5b s ASN 71 Cb -0.00 -2.56 -0.01 0.00 0.41 0.00 0.00 41.25 39.08 1u5b s ASN 71 CO -0.04 0.17 0.46 0.42 -1.51 0.00 0.00 177.10 176.60 1u5b s THR 72 N -1.13 2.79 1.05 1.60 -4.23 -0.44 -4.85 115.64 110.43 1u5b s THR 72 Ca 0.39 -1.20 -0.12 0.00 -1.18 0.00 0.00 61.69 59.58 1u5b s THR 72 Cb -0.25 -2.99 0.22 0.00 1.34 0.00 0.00 72.50 70.82 1u5b s THR 72 CO 0.30 0.00 1.08 -2.84 -0.54 0.00 0.00 174.62 172.61 1u5b s PRO 73 N -4.22 0.00 -1.13 3.99 0.02 -1.26 -4.62 135.00 127.78 1u5b s PRO 73 Ca 0.51 1.10 -0.18 0.00 0.02 0.00 0.00 61.00 62.45 1u5b s PRO 73 Cb -0.06 -1.64 0.11 0.00 0.02 0.00 0.00 34.50 32.93 1u5b s PRO 73 CO 0.30 -3.18 1.45 -1.17 -0.33 0.00 0.00 177.00 174.07 1u5b s LEU 74 N -6.89 4.41 -0.29 -5.54 0.20 -1.26 -4.79 118.68 104.51 1u5b s LEU 74 Ca 0.67 -2.32 0.00 0.00 0.69 0.00 0.00 54.13 53.18 1u5b s LEU 74 Cb -0.23 -2.48 0.19 0.00 -0.43 0.00 0.00 46.19 43.24 1u5b s LEU 74 CO 0.61 -1.09 0.72 0.00 -0.29 0.00 0.00 176.35 176.30 1u5b h GLU 76 N 7.84 0.85 -0.97 0.00 3.07 -1.90 -0.02 114.58 123.45 1u5b h GLU 76 Ca -0.07 -0.51 0.04 0.00 -0.50 0.00 0.00 59.36 58.32 1u5b h GLU 76 Cb 1.18 0.05 -0.06 0.00 -0.84 0.00 0.00 28.75 29.08 1u5b h GLU 76 CO 0.10 1.14 0.64 -0.56 -1.40 0.00 0.00 179.01 178.93 1u5b h GLN 77 N 0.67 1.19 -0.45 2.33 3.07 -1.94 -2.17 115.11 117.81 1u5b h GLN 77 Ca 0.03 -0.07 -0.02 0.00 0.09 0.00 0.00 58.65 58.67 1u5b h GLN 77 Cb 1.09 -0.27 -0.02 0.00 0.08 0.00 0.00 27.48 28.36 1u5b h GLN 77 CO 0.11 0.78 0.19 0.78 0.09 0.00 0.00 178.83 180.78 1u5b h GLY 78 N 1.22 0.72 0.84 0.06 0.00 -1.74 -1.64 103.07 102.54 1u5b h GLY 78 Ca 0.39 -0.39 0.02 0.00 0.00 0.00 0.00 47.33 47.35 1u5b h GLY 78 CO -0.12 0.37 0.09 -2.22 0.00 0.00 0.00 176.54 174.65 1u5b h ILE 79 N 0.59 0.96 -0.16 2.60 2.04 -0.46 0.26 117.51 123.33 1u5b h ILE 79 Ca 0.15 -0.07 -0.13 0.00 1.00 0.00 0.00 64.86 65.81 1u5b h ILE 79 Cb 0.18 0.74 0.00 0.00 -0.74 0.00 0.00 36.82 37.00 1u5b h ILE 79 CO -0.01 0.04 -0.39 0.58 0.00 0.00 0.00 178.15 178.36 1u5b h VAL 80 N 0.21 1.35 -0.17 1.67 2.07 -1.42 -1.12 116.25 118.83 1u5b h VAL 80 Ca 0.10 -1.65 0.03 0.00 0.82 0.00 0.00 66.70 66.00 1u5b h VAL 80 Cb 0.05 1.97 -0.03 0.00 -1.52 0.00 0.00 31.29 31.76 1u5b h VAL 80 CO -0.09 0.50 -0.04 1.23 0.02 0.00 0.00 177.57 179.19 1u5b h GLY 81 N 0.20 0.13 0.46 2.17 0.00 -1.08 0.24 103.07 105.17 1u5b h GLY 81 Ca -0.00 0.06 0.08 0.00 0.00 0.00 0.00 47.33 47.47 1u5b h GLY 81 CO 0.09 -0.06 0.24 -2.75 0.00 0.00 0.00 176.54 174.05 1u5b h PHE 82 N 0.00 0.42 -0.45 5.60 3.57 -0.47 -1.54 116.94 124.08 1u5b h PHE 82 Ca 0.08 0.03 -0.13 0.00 3.53 0.00 0.00 57.97 61.48 1u5b h PHE 82 Cb 0.13 -0.10 -0.01 0.00 2.79 0.00 0.00 35.95 38.76 1u5b h PHE 82 CO -0.20 0.13 -0.24 0.78 -2.23 0.00 0.00 178.31 176.55 1u5b h GLY 83 N 0.43 1.01 0.63 2.40 0.00 -0.51 -0.74 103.07 106.30 1u5b h GLY 83 Ca 0.29 -0.91 0.05 0.00 0.00 0.00 0.00 47.33 46.76 1u5b h GLY 83 CO -0.28 0.82 0.07 -2.22 0.00 0.00 0.00 176.54 174.94 1u5b h ILE 84 N 0.80 0.85 -0.65 2.60 2.04 -0.72 -1.82 117.51 120.62 1u5b h ILE 84 Ca 0.10 -0.07 0.03 0.00 1.00 0.00 0.00 64.86 65.93 1u5b h ILE 84 Cb 0.80 0.64 -0.04 0.00 -0.74 0.00 0.00 36.82 37.49 1u5b h ILE 84 CO 0.07 0.04 0.40 1.23 0.00 0.00 0.00 178.15 179.88 1u5b h GLY 85 N 0.19 0.94 0.28 5.37 0.00 -0.67 0.17 103.07 109.35 1u5b h GLY 85 Ca 0.15 -0.30 0.11 0.00 0.00 0.00 0.00 47.33 47.29 1u5b h GLY 85 CO -0.19 0.25 0.19 -2.22 0.00 0.00 0.00 176.54 174.56 1u5b h ILE 86 N 0.78 0.71 -0.01 2.60 2.04 -0.97 -2.80 117.51 119.85 1u5b h ILE 86 Ca 0.26 -0.12 -0.12 0.00 1.00 0.00 0.00 64.86 65.89 1u5b h ILE 86 Cb 0.04 0.33 -0.02 0.00 -0.74 0.00 0.00 36.82 36.43 1u5b h ILE 86 CO -0.11 0.06 -0.55 0.00 0.00 0.00 0.00 178.15 177.56 1u5b h ALA 87 N 1.45 1.09 -0.42 1.87 0.00 -0.49 -2.04 119.26 120.71 1u5b h ALA 87 Ca 0.32 -0.50 0.08 0.00 0.00 0.00 0.00 54.91 54.81 1u5b h ALA 87 Cb 0.44 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 1u5b h ALA 87 CO -0.35 0.68 0.29 0.28 0.00 0.00 0.00 179.25 180.15 1u5b h VAL 88 N 0.01 0.91 -0.00 0.00 2.07 -0.42 -0.51 116.25 118.32 1u5b h VAL 88 Ca -0.00 -0.08 0.00 0.00 0.82 0.00 0.00 66.70 67.43 1u5b h VAL 88 Cb 0.97 0.65 0.00 0.00 -1.52 0.00 0.00 31.29 31.39 1u5b h VAL 88 CO 0.07 0.04 -0.12 0.35 0.02 0.00 0.00 177.57 177.94 1u5b n THR 89 N -4.46 0.00 -0.00 2.57 -2.24 -0.78 -4.74 114.28 104.62 1u5b n THR 89 Ca 0.06 -0.01 0.00 0.00 -2.27 0.00 0.00 64.05 61.83 1u5b n THR 89 Cb 0.33 -0.30 0.00 0.00 -2.10 0.00 0.00 70.33 68.26 1u5b n THR 89 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1u5b n GLY 90 N 1.45 0.53 3.83 3.38 0.00 -0.20 -5.08 105.19 109.11 1u5b n GLY 90 Ca 0.08 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.75 1u5b n GLY 90 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1u5b s ALA 91 N -2.01 3.45 -0.08 4.61 0.00 -1.17 -4.95 121.76 121.61 1u5b s ALA 91 Ca 0.00 0.05 -0.30 0.00 0.00 0.00 0.00 51.96 51.71 1u5b s ALA 91 Cb 0.00 -2.71 -0.02 0.00 0.00 0.00 0.00 23.12 20.38 1u5b s ALA 91 CO 0.00 0.37 1.12 0.99 0.00 0.00 0.00 175.76 178.24 1u5b s THR 92 N -1.60 4.48 -0.20 0.00 2.01 -1.25 -3.68 115.64 115.40 1u5b s THR 92 Ca 0.44 1.78 0.01 0.00 0.31 0.00 0.00 61.69 64.23 1u5b s THR 92 Cb -0.15 -4.15 0.03 0.00 0.01 0.00 0.00 72.50 68.24 1u5b s THR 92 CO 0.20 -0.00 -0.18 0.00 -0.69 0.00 0.00 174.62 173.95 1u5b s ALA 93 N 2.16 2.38 -0.48 7.40 0.00 -0.37 -1.66 121.76 131.19 1u5b s ALA 93 Ca 0.52 -1.35 -0.03 0.00 0.00 0.00 0.00 51.96 51.11 1u5b s ALA 93 Cb -0.22 -1.27 0.13 0.00 0.00 0.00 0.00 23.12 21.76 1u5b s ALA 93 CO 0.20 -0.55 0.29 0.42 0.00 0.00 0.00 175.76 176.12 1u5b s ILE 94 N 1.25 3.43 0.21 0.00 1.01 -0.16 -1.04 121.20 125.89 1u5b s ILE 94 Ca 0.02 -2.38 -0.17 0.00 0.00 0.00 0.00 60.65 58.12 1u5b s ILE 94 Cb -0.15 -3.31 -0.08 0.00 0.01 0.00 0.00 42.46 38.94 1u5b s ILE 94 CO -0.11 -0.76 0.67 0.00 0.00 0.00 0.00 174.94 174.74 1u5b s ALA 95 N 0.71 3.46 -0.06 9.38 0.00 0.10 -2.22 121.76 133.14 1u5b s ALA 95 Ca 0.11 0.05 0.03 0.00 0.00 0.00 0.00 51.96 52.15 1u5b s ALA 95 Cb -0.22 -2.71 -0.02 0.00 0.00 0.00 0.00 23.12 20.17 1u5b s ALA 95 CO -0.04 0.37 -0.16 -2.00 0.00 0.00 0.00 175.76 173.93 1u5b s GLU 96 N -2.12 2.65 -0.15 0.00 2.12 -0.05 -0.76 118.70 120.40 1u5b s GLU 96 Ca 0.43 -0.74 -0.01 0.00 0.36 0.00 0.00 54.97 55.02 1u5b s GLU 96 Cb -0.15 -2.38 -0.01 0.00 0.26 0.00 0.00 34.13 31.85 1u5b s GLU 96 CO 0.20 0.51 -0.12 0.42 -0.54 0.00 0.00 175.26 175.73 1u5b s ILE 97 N -0.44 3.05 0.33 -3.70 -1.09 -0.44 -4.38 121.20 114.52 1u5b s ILE 97 Ca 0.05 -0.65 0.03 0.00 -2.23 0.00 0.00 60.65 57.85 1u5b s ILE 97 Cb -0.12 -2.30 0.17 0.00 -1.58 0.00 0.00 42.46 38.63 1u5b s ILE 97 CO 0.02 0.51 1.88 -0.61 -1.23 0.00 0.00 174.94 175.51 1u5b h GLN 98 N 7.04 0.64 -3.74 2.79 4.15 -1.91 -3.37 115.11 120.72 1u5b h GLN 98 Ca -0.30 -0.12 -0.17 0.00 0.77 0.00 0.00 58.65 58.83 1u5b h GLN 98 Cb 1.20 -0.10 -0.22 0.00 0.21 0.00 0.00 27.48 28.56 1u5b h GLN 98 CO 0.57 0.60 -0.62 -0.06 -1.93 0.00 0.00 178.83 177.39 1u5b s PHE 99 N -5.14 0.12 0.40 3.99 0.40 -1.26 -4.36 117.98 112.12 1u5b s PHE 99 Ca -0.08 -0.25 0.23 0.00 -0.60 0.00 0.00 56.93 56.22 1u5b s PHE 99 Cb 0.16 -0.10 1.23 0.00 0.51 0.00 0.00 43.02 44.82 1u5b s PHE 99 CO 0.77 -0.19 2.01 0.00 0.70 0.00 0.00 175.22 178.51 1u5b h ALA 100 N 4.82 1.35 -0.06 5.36 0.00 -1.21 -0.37 119.26 129.15 1u5b h ALA 100 Ca -0.30 -0.16 0.02 0.00 0.00 0.00 0.00 54.91 54.47 1u5b h ALA 100 Cb 1.20 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.96 1u5b h ALA 100 CO 0.42 0.22 0.08 -0.44 0.00 0.00 0.00 179.25 179.53 1u5b h ASP 101 N 0.00 0.00 -0.52 0.00 5.19 -1.83 -1.87 116.42 117.39 1u5b h ASP 101 Ca -0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 1u5b h ASP 101 Cb 0.40 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.91 1u5b h ASP 101 CO 0.02 0.00 0.00 -1.22 -3.12 0.00 0.00 179.24 174.92 1u5b n TYR 102 N -3.72 1.61 0.32 4.55 4.01 -0.15 -4.26 117.16 119.51 1u5b n TYR 102 Ca -0.01 -0.72 0.12 0.00 -0.16 0.00 0.00 57.90 57.13 1u5b n TYR 102 Cb 0.17 -0.37 0.25 0.00 -0.31 0.00 0.00 39.34 39.07 1u5b n TYR 102 CO 0.00 0.00 0.00 0.97 -0.46 0.00 0.00 176.86 177.37 1u5b h ILE 103 N 3.49 0.00 -0.48 -0.72 2.10 -1.41 -3.37 117.51 117.12 1u5b h ILE 103 Ca 0.00 -0.86 -0.03 0.00 1.08 0.00 0.00 64.86 65.06 1u5b h ILE 103 Cb 1.67 1.85 -0.02 0.00 -1.09 0.00 0.00 36.82 39.23 1u5b h ILE 103 CO 0.34 0.00 0.19 -0.26 -1.08 0.00 0.00 178.15 177.34 1u5b h PHE 104 N 0.00 0.68 -0.24 2.19 0.04 -1.79 -0.50 116.94 117.33 1u5b h PHE 104 Ca 0.00 -0.03 0.07 0.00 2.80 0.00 0.00 57.97 60.81 1u5b h PHE 104 Cb 0.92 -0.21 -0.01 0.00 2.20 0.00 0.00 35.95 38.84 1u5b h PHE 104 CO 0.00 0.54 0.24 -1.35 -0.60 0.00 0.00 178.31 177.14 1u5b h PRO 105 N 0.68 0.00 -0.62 1.51 0.11 -1.92 -0.07 132.00 131.69 1u5b h PRO 105 Ca 0.17 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.28 1u5b h PRO 105 Cb 0.14 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.25 1u5b h PRO 105 CO -0.02 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 177.77 1u5b n ALA 106 N -2.38 2.66 -0.15 -0.75 0.00 -0.20 -4.24 120.51 115.45 1u5b n ALA 106 Ca 0.03 -1.18 -0.06 0.00 0.00 0.00 0.00 53.44 52.24 1u5b n ALA 106 Cb 0.38 -0.98 0.12 0.00 0.00 0.00 0.00 19.45 18.96 1u5b n ALA 106 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 1u5b h PHE 107 N 3.52 0.96 -0.37 0.00 3.57 -0.96 -0.34 116.94 123.32 1u5b h PHE 107 Ca 0.00 -0.14 -0.06 0.00 3.53 0.00 0.00 57.97 61.30 1u5b h PHE 107 Cb 1.00 -0.26 -0.01 0.00 2.79 0.00 0.00 35.95 39.47 1u5b h PHE 107 CO 0.51 0.86 -0.02 0.22 -2.23 0.00 0.00 178.31 177.65 1u5b h ASP 108 N 0.84 0.66 -0.34 0.41 3.58 -1.80 0.15 116.42 119.93 1u5b h ASP 108 Ca 0.16 -0.32 -0.03 0.00 0.42 0.00 0.00 57.03 57.26 1u5b h ASP 108 Cb 0.46 -0.18 -0.02 0.00 1.72 0.00 0.00 39.33 41.31 1u5b h ASP 108 CO 0.02 0.82 0.11 1.56 -2.88 0.00 0.00 179.24 178.87 1u5b h GLN 109 N 0.48 0.60 0.04 0.28 1.08 -1.74 -0.26 115.11 115.59 1u5b h GLN 109 Ca 0.10 -0.10 -0.00 0.00 -1.45 0.00 0.00 58.65 57.20 1u5b h GLN 109 Cb 0.49 -0.10 0.00 0.00 -0.05 0.00 0.00 27.48 27.82 1u5b h GLN 109 CO 0.02 0.54 -0.02 0.82 -0.95 0.00 0.00 178.83 179.24 1u5b h ILE 110 N 0.59 1.34 0.07 2.54 2.04 -0.73 0.10 117.51 123.46 1u5b h ILE 110 Ca 0.14 -1.41 -0.10 0.00 1.00 0.00 0.00 64.86 64.49 1u5b h ILE 110 Cb 0.21 2.25 0.01 0.00 -0.74 0.00 0.00 36.82 38.55 1u5b h ILE 110 CO -0.01 0.35 -0.43 0.58 0.00 0.00 0.00 178.15 178.64 1u5b h VAL 111 N -0.70 1.63 0.00 1.67 2.07 -0.67 -1.08 116.25 119.18 1u5b h VAL 111 Ca -0.01 -2.39 -0.08 0.00 0.82 0.00 0.00 66.70 65.04 1u5b h VAL 111 Cb 0.61 3.22 -0.01 0.00 -1.52 0.00 0.00 31.29 33.58 1u5b h VAL 111 CO 0.01 0.65 -0.95 0.78 0.02 0.00 0.00 177.57 178.08 1u5b h ASN 112 N -0.63 0.00 0.00 0.57 2.35 -1.22 -3.39 115.58 113.27 1u5b h ASN 112 Ca -0.07 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.68 1u5b h ASN 112 Cb 1.31 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.68 1u5b h ASN 112 CO 0.08 0.31 -0.02 -0.62 -1.65 0.00 0.00 177.43 175.53 1u5b n GLU 113 N -2.91 0.01 -0.11 0.81 -0.58 -1.13 -4.50 120.64 112.23 1u5b n GLU 113 Ca -0.03 0.00 -0.05 0.00 -0.42 0.00 0.00 57.16 56.67 1u5b n GLU 113 Cb 0.69 -0.30 0.02 0.00 -0.57 0.00 0.00 31.44 31.29 1u5b n GLU 113 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1u5b h ALA 114 N -1.08 0.37 -0.06 0.62 0.00 -0.66 -0.95 119.26 117.49 1u5b h ALA 114 Ca 0.00 0.10 -0.08 0.00 0.00 0.00 0.00 54.91 54.93 1u5b h ALA 114 Cb 0.02 0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 1u5b h ALA 114 CO 0.00 -0.37 -0.33 0.00 0.00 0.00 0.00 179.25 178.54 1u5b h ALA 115 N 1.32 1.33 -0.02 0.00 0.00 -1.38 -3.09 119.26 117.42 1u5b h ALA 115 Ca 0.19 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.76 1u5b h ALA 115 Cb 0.25 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.97 1u5b h ALA 115 CO -0.29 0.48 -0.16 1.63 0.00 0.00 0.00 179.25 180.91 1u5b n LYS 116 N -4.11 1.82 -0.02 0.00 5.02 -0.86 -4.27 118.16 115.73 1u5b n LYS 116 Ca -0.02 -1.51 -0.09 0.00 -2.02 0.00 0.00 58.31 54.67 1u5b n LYS 116 Cb 0.40 -1.43 -0.03 0.00 -0.02 0.00 0.00 35.03 33.95 1u5b n LYS 116 CO 0.00 0.00 0.00 -0.92 -0.52 0.00 0.00 177.40 175.96 1u5b h TYR 117 N 3.62 -0.10 -0.04 2.13 3.20 -1.10 -0.37 116.97 124.31 1u5b h TYR 117 Ca 0.00 0.02 -0.03 0.00 3.14 0.00 0.00 58.73 61.86 1u5b h TYR 117 Cb 0.85 0.07 0.00 0.00 1.54 0.00 0.00 36.73 39.19 1u5b h TYR 117 CO 0.00 -0.08 -0.08 -0.09 -1.64 0.00 0.00 178.16 176.27 1u5b h ARG 118 N -0.01 0.13 0.06 1.82 2.43 -1.82 -3.16 114.38 113.83 1u5b h ARG 118 Ca 0.08 -0.08 0.02 0.00 -0.81 0.00 0.00 59.98 59.18 1u5b h ARG 118 Cb 0.13 0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 29.67 1u5b h ARG 118 CO -0.17 0.66 -0.17 -0.92 -1.51 0.00 0.00 179.97 177.86 1u5b h TYR 119 N -0.38 -0.43 0.00 2.20 3.20 -1.83 -0.31 116.97 119.41 1u5b h TYR 119 Ca 0.00 0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.88 1u5b h TYR 119 Cb 0.66 0.18 0.00 0.00 1.54 0.00 0.00 36.73 39.11 1u5b h TYR 119 CO 0.12 -0.24 0.00 2.89 -1.64 0.00 0.00 178.16 179.28 1u5b n ARG 120 N -5.29 0.22 -0.03 1.82 1.85 -0.16 -1.78 116.66 113.29 1u5b n ARG 120 Ca -0.06 0.39 0.12 0.00 -1.00 0.00 0.00 57.85 57.30 1u5b n ARG 120 Cb 0.21 -1.88 0.13 0.00 -1.05 0.00 0.00 32.46 29.87 1u5b n ARG 120 CO 0.00 0.00 0.00 -1.13 -0.01 0.00 0.00 177.63 176.49 1u5b n SER 121 N -2.29 3.03 -1.76 2.89 3.41 -1.06 -4.93 113.62 112.91 1u5b n SER 121 Ca 0.03 -1.99 -0.17 0.00 -0.26 0.00 0.00 58.87 56.48 1u5b n SER 121 Cb 0.28 -0.04 -0.03 0.00 -0.26 0.00 0.00 64.21 64.16 1u5b n SER 121 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1u5b n GLY 122 N 1.37 0.30 2.22 5.00 0.00 -0.73 -2.27 105.19 111.07 1u5b n GLY 122 Ca 0.15 -0.17 -0.05 0.00 0.00 0.00 0.00 46.02 45.94 1u5b n GLY 122 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1u5b n ASP 123 N -1.13 -3.82 0.03 1.61 2.03 -0.15 -4.91 116.55 110.21 1u5b n ASP 123 Ca -0.19 0.13 -0.05 0.00 0.52 0.00 0.00 54.79 55.19 1u5b n ASP 123 Cb 0.63 -1.78 0.15 0.00 -0.72 0.00 0.00 41.12 39.39 1u5b n ASP 123 CO 0.00 0.00 0.00 -0.07 -1.92 0.00 0.00 177.20 175.21 1u5b h LEU 124 N 0.00 0.47 -8.20 -2.67 3.38 -1.71 -3.46 115.31 103.12 1u5b h LEU 124 Ca -0.11 -0.21 -0.22 0.00 0.09 0.00 0.00 57.88 57.44 1u5b h LEU 124 Cb 0.40 -0.13 -0.19 0.00 0.09 0.00 0.00 40.66 40.83 1u5b h LEU 124 CO 0.16 0.83 -0.71 -0.36 0.09 0.00 0.00 178.44 178.45 1u5b s PHE 125 N -4.20 0.61 0.22 1.13 0.08 -1.26 -5.14 117.98 109.42 1u5b s PHE 125 Ca -0.06 -0.68 -0.18 0.00 0.12 0.00 0.00 56.93 56.13 1u5b s PHE 125 Cb 0.13 -0.38 0.02 0.00 -0.57 0.00 0.00 43.02 42.22 1u5b s PHE 125 CO 0.81 -0.16 0.56 0.54 -0.10 0.00 0.00 175.22 176.86 1u5b s ASN 126 N -2.06 -0.25 -0.26 1.36 2.20 -1.26 -3.74 114.94 110.92 1u5b s ASN 126 Ca -0.04 -0.54 0.14 0.00 -0.94 0.00 0.00 52.86 51.47 1u5b s ASN 126 Cb -0.04 0.61 0.47 0.00 -2.00 0.00 0.00 41.25 40.29 1u5b s ASN 126 CO -0.02 -1.12 1.16 0.00 -2.94 0.00 0.00 177.10 174.18 1u5b h GLY 128 N 2.18 0.57 -0.84 0.00 0.00 -1.82 -2.27 103.07 100.88 1u5b h GLY 128 Ca 0.14 -0.17 0.00 0.00 0.00 0.00 0.00 47.33 47.30 1u5b h GLY 128 CO 0.47 0.11 0.00 -1.14 0.00 0.00 0.00 176.54 175.99 1u5b n SER 129 N -4.47 1.03 -4.77 0.19 3.41 -1.26 -2.50 113.62 105.25 1u5b n SER 129 Ca 0.09 -2.06 -0.37 0.00 -0.26 0.00 0.00 58.87 56.27 1u5b n SER 129 Cb 0.33 -0.31 -0.06 0.00 -0.26 0.00 0.00 64.21 63.90 1u5b n SER 129 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 1u5b s LEU 130 N -0.62 4.33 -0.04 1.04 2.96 -0.85 -1.23 118.68 124.26 1u5b s LEU 130 Ca 0.06 0.69 0.04 0.00 -0.22 0.00 0.00 54.13 54.70 1u5b s LEU 130 Cb 0.04 -2.47 -0.00 0.00 0.50 0.00 0.00 46.19 44.25 1u5b s LEU 130 CO 0.03 0.17 -0.16 -0.89 -1.32 0.00 0.00 176.35 174.18 1u5b s THR 131 N -0.06 1.34 -0.24 3.68 2.01 -0.21 -2.52 115.64 119.65 1u5b s THR 131 Ca 0.20 -0.67 -0.04 0.00 0.31 0.00 0.00 61.69 61.50 1u5b s THR 131 Cb -0.14 -1.16 0.00 0.00 0.01 0.00 0.00 72.50 71.21 1u5b s THR 131 CO 0.08 0.39 -0.03 -0.63 -0.69 0.00 0.00 174.62 173.74 1u5b s ILE 132 N 0.07 3.36 -0.00 1.82 1.01 0.90 -0.72 121.20 127.64 1u5b s ILE 132 Ca -0.04 -0.62 0.03 0.00 0.00 0.00 0.00 60.65 60.02 1u5b s ILE 132 Cb -0.11 -2.59 -0.03 0.00 0.01 0.00 0.00 42.46 39.74 1u5b s ILE 132 CO 0.02 0.33 -0.06 0.00 0.00 0.00 0.00 174.94 175.24 1u5b s ARG 133 N 1.45 2.60 -0.20 2.79 1.70 0.06 0.20 118.95 127.56 1u5b s ARG 133 Ca 0.04 -0.69 -0.15 0.00 -0.47 0.00 0.00 55.73 54.46 1u5b s ARG 133 Cb -0.15 -2.53 0.06 0.00 -0.57 0.00 0.00 34.95 31.76 1u5b s ARG 133 CO -0.03 0.61 0.50 0.45 -1.08 0.00 0.00 175.30 175.75 1u5b s SER 134 N -1.39 -0.58 0.53 -2.89 0.15 -0.45 -1.33 113.70 107.74 1u5b s SER 134 Ca 0.17 1.04 -0.23 0.00 0.70 0.00 0.00 55.95 57.64 1u5b s SER 134 Cb -0.11 1.00 -0.06 0.00 -1.71 0.00 0.00 66.02 65.14 1u5b s SER 134 CO 0.07 -0.19 1.38 -2.65 1.20 0.00 0.00 173.24 173.06 1u5b n PRO 135 N 3.46 1.83 -3.78 5.44 -0.02 -1.26 -1.04 135.00 139.64 1u5b n PRO 135 Ca -0.17 0.67 -0.12 0.00 -2.02 0.00 0.00 63.50 61.86 1u5b n PRO 135 Cb 0.56 -2.60 -0.08 0.00 -0.02 0.00 0.00 33.50 31.37 1u5b n PRO 135 CO 0.00 0.00 0.00 -0.46 1.98 0.00 0.00 175.50 177.02 1u5b s TRP 136 N -1.26 -0.09 0.00 6.00 -0.00 0.58 -0.80 118.94 123.36 1u5b s TRP 136 Ca 0.69 -0.02 0.00 0.00 -0.00 0.00 0.00 56.10 56.78 1u5b s TRP 136 Cb -0.42 0.07 0.00 0.00 -0.00 0.00 0.00 33.47 33.11 1u5b s TRP 136 CO 0.51 -0.46 0.00 0.41 -0.00 0.00 0.00 176.95 177.41 1u5b n GLY 137 N 0.79 -0.69 3.77 5.86 0.00 -0.60 -1.23 105.19 113.09 1u5b n GLY 137 Ca -0.19 -1.71 -0.32 0.00 0.00 0.00 0.00 46.02 43.80 1u5b n GLY 137 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1u5b n VAL 139 N -3.01 0.00 0.00 0.00 3.14 -1.26 -4.06 118.33 113.14 1u5b n VAL 139 Ca 0.09 -0.08 0.00 0.00 -2.96 0.00 0.00 64.34 61.39 1u5b n VAL 139 Cb 0.53 0.43 0.00 0.00 -1.06 0.00 0.00 33.84 33.73 1u5b n VAL 139 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1u5b n GLY 140 N 0.04 2.67 0.80 7.55 0.00 -1.26 -4.37 105.19 110.61 1u5b n GLY 140 Ca -0.00 -0.65 -0.01 0.00 0.00 0.00 0.00 46.02 45.36 1u5b n GLY 140 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 1u5b n HIS 141 N 0.00 0.00 0.36 1.61 -0.00 -1.26 -4.83 115.22 111.10 1u5b n HIS 141 Ca 0.00 -0.21 0.13 0.00 -0.00 0.00 0.00 57.72 57.65 1u5b n HIS 141 Cb 0.00 0.17 0.56 0.00 -0.00 0.00 0.00 29.99 30.72 1u5b n HIS 141 CO 0.00 0.00 0.00 0.78 -0.00 0.00 0.00 176.34 177.12 1u5b h GLY 142 N 0.17 0.00 0.00 -1.39 0.00 -1.82 -3.48 103.07 96.55 1u5b h GLY 142 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.15 1u5b h GLY 142 CO -0.05 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.49 1u5b n ALA 143 N -1.86 0.00 0.14 3.60 0.00 -1.26 -2.22 120.51 118.91 1u5b n ALA 143 Ca 0.01 0.00 -0.00 0.00 0.00 0.00 0.00 53.44 53.45 1u5b n ALA 143 Cb 0.24 0.00 0.16 0.00 0.00 0.00 0.00 19.45 19.85 1u5b n ALA 143 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1u5b h LEU 144 N 0.00 0.00 -1.81 0.00 4.07 -1.45 -3.31 115.31 112.81 1u5b h LEU 144 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 1u5b h LEU 144 Cb 0.00 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.74 1u5b h LEU 144 CO 0.00 0.61 0.00 -1.22 -1.08 0.00 0.00 178.44 176.75 1u5b n TYR 145 N -3.64 0.00 -1.33 1.13 4.01 -1.24 -4.52 117.16 111.56 1u5b n TYR 145 Ca -0.01 -0.22 0.08 0.00 -0.16 0.00 0.00 57.90 57.59 1u5b n TYR 145 Cb 0.64 -0.02 0.13 0.00 -0.31 0.00 0.00 39.34 39.78 1u5b n TYR 145 CO 0.00 0.00 0.00 0.72 -0.46 0.00 0.00 176.86 177.12 1u5b n HIS 146 N -0.22 0.00 -0.26 -0.72 8.25 -0.94 -4.60 115.22 116.72 1u5b n HIS 146 Ca 0.00 -0.94 0.00 0.00 -0.26 0.00 0.00 57.72 56.52 1u5b n HIS 146 Cb 0.17 -0.15 0.00 0.00 1.12 0.00 0.00 29.99 31.12 1u5b n HIS 146 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 1u5b n SER 147 N -1.13 0.13 -4.76 0.41 7.64 -1.24 -4.64 113.62 110.03 1u5b n SER 147 Ca 0.14 -0.49 -0.33 0.00 1.01 0.00 0.00 58.87 59.21 1u5b n SER 147 Cb 0.67 0.20 0.07 0.00 -1.01 0.00 0.00 64.21 64.14 1u5b n SER 147 CO 0.00 0.00 0.00 -1.10 -3.01 0.00 0.00 175.04 170.93 1u5b s GLN 148 N -0.20 2.53 -0.58 1.43 -0.21 -1.26 -2.99 119.66 118.38 1u5b s GLN 148 Ca 0.00 1.41 0.04 0.00 0.02 0.00 0.00 55.36 56.83 1u5b s GLN 148 Cb 0.00 -1.91 0.15 0.00 1.00 0.00 0.00 33.01 32.25 1u5b s GLN 148 CO 0.00 -1.46 0.37 -1.12 -2.12 0.00 0.00 175.29 170.96 1u5b s SER 149 N -2.65 4.16 0.00 5.90 0.01 -1.26 -1.56 113.70 118.30 1u5b s SER 149 Ca 0.67 -3.35 0.08 0.00 1.31 0.00 0.00 55.95 54.66 1u5b s SER 149 Cb -0.21 -1.42 0.46 0.00 0.21 0.00 0.00 66.02 65.05 1u5b s SER 149 CO 0.45 -0.16 1.30 -2.65 0.41 0.00 0.00 173.24 172.59 1u5b n PRO 150 N 2.62 1.10 -0.27 12.44 -0.02 -1.26 -4.57 135.00 145.03 1u5b n PRO 150 Ca 0.15 -0.15 0.16 0.00 -2.02 0.00 0.00 63.50 61.64 1u5b n PRO 150 Cb 0.35 -1.14 0.44 0.00 -0.02 0.00 0.00 33.50 33.13 1u5b n PRO 150 CO 0.00 0.00 0.00 1.05 1.98 0.00 0.00 175.50 178.53 1u5b h GLU 151 N 0.26 0.53 0.00 -0.52 9.09 -2.00 -1.34 114.58 120.60 1u5b h GLU 151 Ca 0.00 -0.03 -0.05 0.00 0.05 0.00 0.00 59.36 59.33 1u5b h GLU 151 Cb 0.06 -0.12 -0.01 0.00 -1.65 0.00 0.00 28.75 27.03 1u5b h GLU 151 CO 0.00 0.35 -0.23 0.00 0.05 0.00 0.00 179.01 179.18 1u5b h ALA 152 N 1.61 1.59 -0.56 1.06 0.00 -1.88 0.49 119.26 121.57 1u5b h ALA 152 Ca 0.48 -0.21 -0.08 0.00 0.00 0.00 0.00 54.91 55.10 1u5b h ALA 152 Cb 1.01 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.74 1u5b h ALA 152 CO -0.22 0.29 0.04 0.74 0.00 0.00 0.00 179.25 180.10 1u5b h PHE 153 N 0.00 1.00 0.00 0.00 0.04 -1.56 -2.85 116.94 113.56 1u5b h PHE 153 Ca -0.00 -0.14 -0.00 0.00 2.80 0.00 0.00 57.97 60.62 1u5b h PHE 153 Cb 0.42 -0.27 -0.00 0.00 2.20 0.00 0.00 35.95 38.30 1u5b h PHE 153 CO 0.00 0.88 -0.25 0.74 -0.60 0.00 0.00 178.31 179.08 1u5b h PHE 154 N 0.87 0.00 0.00 -0.55 0.04 -1.29 -3.28 116.94 112.73 1u5b h PHE 154 Ca 0.17 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.92 1u5b h PHE 154 Cb 0.46 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.61 1u5b h PHE 154 CO 0.03 0.01 -0.07 0.00 -0.60 0.00 0.00 178.31 177.68 1u5b h ALA 155 N 1.99 1.35 -0.28 2.45 0.00 -0.70 -1.89 119.26 122.18 1u5b h ALA 155 Ca -0.00 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1u5b h ALA 155 Cb 1.01 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.79 1u5b h ALA 155 CO 0.00 0.09 0.00 1.58 0.00 0.00 0.00 179.25 180.92 1u5b n HIS 156 N -3.68 0.77 -3.92 0.00 -0.00 -1.24 -4.72 115.22 102.43 1u5b n HIS 156 Ca -0.02 -0.29 -0.30 0.00 -0.00 0.00 0.00 57.72 57.11 1u5b n HIS 156 Cb 0.17 -0.20 -0.14 0.00 -0.00 0.00 0.00 29.99 29.83 1u5b n HIS 156 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 1u5b n PRO 158 N 3.11 1.20 0.00 0.00 -0.02 -1.26 -3.25 135.00 134.78 1u5b n PRO 158 Ca 0.06 0.43 0.00 0.00 -2.02 0.00 0.00 63.50 61.97 1u5b n PRO 158 Cb 0.32 -1.97 0.00 0.00 -0.02 0.00 0.00 33.50 31.83 1u5b n PRO 158 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1u5b n GLY 159 N 2.17 1.02 3.53 -1.23 0.00 -1.26 -4.61 105.19 104.81 1u5b n GLY 159 Ca 0.16 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.93 1u5b n GLY 159 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1u5b s ILE 160 N -2.00 2.87 0.11 -0.61 -4.36 -1.20 -4.39 121.20 111.61 1u5b s ILE 160 Ca 0.00 -2.02 0.08 0.00 -0.26 0.00 0.00 60.65 58.45 1u5b s ILE 160 Cb 0.00 -2.46 -0.04 0.00 1.25 0.00 0.00 42.46 41.21 1u5b s ILE 160 CO 0.00 -0.26 -0.14 -0.54 0.24 0.00 0.00 174.94 174.25 1u5b s LYS 161 N -3.19 1.98 -0.09 0.37 1.02 -0.56 -4.57 119.74 114.70 1u5b s LYS 161 Ca 0.27 -1.09 -0.00 0.00 0.02 0.00 0.00 55.97 55.17 1u5b s LYS 161 Cb -0.07 -2.22 0.02 0.00 -0.52 0.00 0.00 37.83 35.04 1u5b s LYS 161 CO 0.15 0.50 -0.05 0.08 -0.92 0.00 0.00 175.35 175.11 1u5b s VAL 162 N -1.18 0.78 -0.02 3.17 1.01 -0.67 -0.20 120.40 123.28 1u5b s VAL 162 Ca 0.20 -0.15 0.03 0.00 0.00 0.00 0.00 61.98 62.06 1u5b s VAL 162 Cb -0.11 -0.83 -0.00 0.00 0.00 0.00 0.00 36.38 35.44 1u5b s VAL 162 CO 0.12 0.32 -0.10 -0.69 0.00 0.00 0.00 175.10 174.75 1u5b s VAL 163 N 1.65 0.87 -0.09 2.92 1.01 -0.13 -0.22 120.40 126.42 1u5b s VAL 163 Ca 0.02 -0.43 -0.03 0.00 0.00 0.00 0.00 61.98 61.54 1u5b s VAL 163 Cb -0.13 -0.75 0.04 0.00 0.00 0.00 0.00 36.38 35.54 1u5b s VAL 163 CO -0.06 0.26 0.06 -0.63 0.00 0.00 0.00 175.10 174.73 1u5b s ILE 164 N -0.00 -0.02 0.46 2.22 1.01 0.54 -1.42 121.20 123.99 1u5b s ILE 164 Ca -0.00 0.18 -0.03 0.00 0.00 0.00 0.00 60.65 60.80 1u5b s ILE 164 Cb -0.07 -0.35 -0.02 0.00 0.01 0.00 0.00 42.46 42.02 1u5b s ILE 164 CO 0.00 0.04 0.72 -2.16 0.00 0.00 0.00 174.94 173.55 1u5b s PRO 165 N 2.12 3.35 0.00 2.79 0.04 -1.26 -4.29 135.00 137.76 1u5b s PRO 165 Ca 0.04 -0.08 0.15 0.00 0.04 0.00 0.00 61.00 61.15 1u5b s PRO 165 Cb -0.13 -2.46 -0.04 0.00 0.04 0.00 0.00 34.50 31.91 1u5b s PRO 165 CO -0.05 -0.20 0.78 2.89 0.04 0.00 0.00 177.00 180.45 1u5b n ARG 166 N -2.16 1.84 -3.63 4.56 1.85 -1.26 -3.98 116.66 113.89 1u5b n ARG 166 Ca -0.00 -0.61 -0.06 0.00 -1.00 0.00 0.00 57.85 56.17 1u5b n ARG 166 Cb 0.56 -1.23 -0.02 0.00 -1.05 0.00 0.00 32.46 30.72 1u5b n ARG 166 CO 0.00 0.00 0.00 -1.54 -0.01 0.00 0.00 177.63 176.08 1u5b s SER 167 N -1.93 -0.29 0.17 2.89 1.04 -1.26 -4.82 113.70 109.50 1u5b s SER 167 Ca 0.11 -0.22 -0.15 0.00 0.48 0.00 0.00 55.95 56.18 1u5b s SER 167 Cb 0.12 0.47 0.11 0.00 0.10 0.00 0.00 66.02 66.81 1u5b s SER 167 CO 0.43 -0.82 1.76 -0.65 0.98 0.00 0.00 173.24 174.93 1u5b h PRO 168 N 2.00 0.32 -0.54 4.02 0.11 -1.87 0.24 132.00 136.28 1u5b h PRO 168 Ca -0.24 -0.02 -0.03 0.00 0.11 0.00 0.00 66.00 65.83 1u5b h PRO 168 Cb 1.24 -0.07 -0.02 0.00 0.11 0.00 0.00 31.00 32.26 1u5b h PRO 168 CO 0.29 0.21 0.24 0.35 -0.21 0.00 0.00 178.00 178.88 1u5b h PHE 169 N 0.33 0.80 -0.56 0.65 3.04 -1.89 -1.89 116.94 117.43 1u5b h PHE 169 Ca 0.20 -0.05 -0.07 0.00 3.98 0.00 0.00 57.97 62.02 1u5b h PHE 169 Cb 0.17 -0.25 -0.02 0.00 2.56 0.00 0.00 35.95 38.42 1u5b h PHE 169 CO -0.14 0.64 0.06 1.96 -2.02 0.00 0.00 178.31 178.81 1u5b h GLN 170 N 0.74 0.95 -0.61 1.11 1.08 -1.91 -2.67 115.11 113.81 1u5b h GLN 170 Ca 0.18 -0.27 -0.03 0.00 -1.45 0.00 0.00 58.65 57.09 1u5b h GLN 170 Cb 0.15 -0.10 -0.03 0.00 -0.05 0.00 0.00 27.48 27.45 1u5b h GLN 170 CO -0.02 0.93 0.28 0.00 -0.95 0.00 0.00 178.83 179.06 1u5b h ALA 171 N 0.99 0.78 -0.21 3.87 0.00 -0.23 -0.36 119.26 124.10 1u5b h ALA 171 Ca 0.17 -0.14 -0.10 0.00 0.00 0.00 0.00 54.91 54.83 1u5b h ALA 171 Cb 0.46 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 18.01 1u5b h ALA 171 CO 0.02 0.36 -0.26 -0.22 0.00 0.00 0.00 179.25 179.15 1u5b h LYS 172 N 0.83 0.54 -0.95 0.00 3.64 -1.32 -1.15 116.57 118.17 1u5b h LYS 172 Ca 0.21 -0.31 -0.01 0.00 -1.27 0.00 0.00 60.65 59.27 1u5b h LYS 172 Cb 0.14 0.02 -0.05 0.00 -0.41 0.00 0.00 32.23 31.94 1u5b h LYS 172 CO -0.02 0.90 0.57 0.78 -2.27 0.00 0.00 179.45 179.41 1u5b h GLY 173 N 0.22 1.38 1.80 5.01 0.00 -1.29 -1.98 103.07 108.21 1u5b h GLY 173 Ca 0.03 -0.57 -0.20 0.00 0.00 0.00 0.00 47.33 46.58 1u5b h GLY 173 CO 0.06 0.56 -0.92 1.41 0.00 0.00 0.00 176.54 177.65 1u5b h LEU 174 N 1.31 0.24 -0.19 3.11 3.38 -1.00 -1.73 115.31 120.43 1u5b h LEU 174 Ca 0.34 -0.20 -0.22 0.00 0.09 0.00 0.00 57.88 57.89 1u5b h LEU 174 Cb -0.06 -0.07 0.01 0.00 0.09 0.00 0.00 40.66 40.63 1u5b h LEU 174 CO -0.06 1.03 -0.78 0.25 0.09 0.00 0.00 178.44 178.97 1u5b h LEU 175 N 0.09 0.89 -0.59 1.67 5.85 -1.12 -0.03 115.31 122.07 1u5b h LEU 175 Ca -0.05 -0.58 -0.11 0.00 0.84 0.00 0.00 57.88 57.98 1u5b h LEU 175 Cb 1.57 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 42.31 1u5b h LEU 175 CO 0.14 1.38 -0.06 -0.07 -0.34 0.00 0.00 178.44 179.49 1u5b h LEU 176 N 0.51 1.06 -0.98 2.25 3.38 -1.35 0.12 115.31 120.29 1u5b h LEU 176 Ca -0.05 -0.33 0.04 0.00 0.09 0.00 0.00 57.88 57.63 1u5b h LEU 176 Cb 1.40 -0.29 -0.06 0.00 0.09 0.00 0.00 40.66 41.81 1u5b h LEU 176 CO 0.16 1.13 0.64 0.28 0.09 0.00 0.00 178.44 180.74 1u5b h SER 177 N 0.96 1.06 -0.35 -0.43 0.02 -1.23 -1.83 113.55 111.75 1u5b h SER 177 Ca 0.16 -0.01 -0.01 0.00 -0.84 0.00 0.00 61.79 61.09 1u5b h SER 177 Cb 0.63 -0.24 -0.02 0.00 0.14 0.00 0.00 62.40 62.91 1u5b h SER 177 CO 0.04 0.71 0.17 0.00 -1.14 0.00 0.00 176.83 176.61 1u5b h ILE 179 N 0.43 1.23 0.00 0.00 2.04 -0.75 -2.90 117.51 117.56 1u5b h ILE 179 Ca 0.12 -0.50 -0.02 0.00 1.00 0.00 0.00 64.86 65.46 1u5b h ILE 179 Cb 0.12 0.05 -0.00 0.00 -0.74 0.00 0.00 36.82 36.25 1u5b h ILE 179 CO -0.01 0.24 -0.75 -0.33 0.00 0.00 0.00 178.15 177.30 1u5b h GLU 180 N 1.15 0.00 -6.95 2.37 5.08 -1.11 -3.46 114.58 111.66 1u5b h GLU 180 Ca 0.30 0.00 -0.53 0.00 -1.00 0.00 0.00 59.36 58.13 1u5b h GLU 180 Cb -0.05 0.00 0.09 0.00 0.50 0.00 0.00 28.75 29.28 1u5b h GLU 180 CO -0.06 0.05 0.63 0.34 -1.00 0.00 0.00 179.01 178.97 1u5b s ASP 181 N -5.69 6.25 -0.25 1.42 2.15 0.23 -4.90 116.67 115.89 1u5b s ASP 181 Ca 0.01 2.70 -0.00 0.00 0.43 0.00 0.00 52.55 55.69 1u5b s ASP 181 Cb 0.08 -2.64 0.21 0.00 -0.30 0.00 0.00 42.92 40.27 1u5b s ASP 181 CO 0.76 -0.90 1.85 0.29 -0.17 0.00 0.00 175.17 177.00 1u5b n LYS 182 N 0.09 1.65 -3.88 4.34 4.76 -1.26 -4.57 118.16 119.28 1u5b n LYS 182 Ca 0.04 -1.32 -0.11 0.00 -2.87 0.00 0.00 58.31 54.05 1u5b n LYS 182 Cb 0.43 -1.52 -0.11 0.00 -1.84 0.00 0.00 35.03 32.00 1u5b n LYS 182 CO 0.00 0.00 0.00 -0.80 -1.37 0.00 0.00 177.40 175.23 1u5b s ASN 183 N 0.33 0.03 0.21 4.39 0.01 -1.04 -4.38 114.94 114.49 1u5b s ASN 183 Ca 0.26 -0.17 -0.31 0.00 -0.71 0.00 0.00 52.86 51.93 1u5b s ASN 183 Cb 0.21 0.20 -0.10 0.00 0.41 0.00 0.00 41.25 41.96 1u5b s ASN 183 CO 0.01 -0.29 1.52 -2.16 -1.51 0.00 0.00 177.10 174.67 1u5b s PRO 184 N -1.09 4.23 0.01 -0.60 0.04 -1.25 -4.70 135.00 131.63 1u5b s PRO 184 Ca -0.12 2.36 0.06 0.00 0.04 0.00 0.00 61.00 63.35 1u5b s PRO 184 Cb -0.07 -3.12 -0.02 0.00 0.04 0.00 0.00 34.50 31.33 1u5b s PRO 184 CO 0.01 -0.54 -0.20 0.00 0.04 0.00 0.00 177.00 176.31 1u5b s ILE 186 N -0.59 3.62 -0.32 0.00 1.01 0.71 -0.07 121.20 125.56 1u5b s ILE 186 Ca 0.07 -0.43 -0.03 0.00 0.00 0.00 0.00 60.65 60.26 1u5b s ILE 186 Cb -0.08 -2.61 0.05 0.00 0.01 0.00 0.00 42.46 39.83 1u5b s ILE 186 CO 0.00 0.45 0.04 0.12 0.00 0.00 0.00 174.94 175.55 1u5b s PHE 187 N 0.96 3.29 -0.27 3.97 5.36 0.13 -0.95 117.98 130.47 1u5b s PHE 187 Ca 0.00 -1.81 -0.13 0.00 -0.96 0.00 0.00 56.93 54.03 1u5b s PHE 187 Cb -0.15 -2.24 -0.04 0.00 -0.34 0.00 0.00 43.02 40.25 1u5b s PHE 187 CO 0.01 -0.80 0.28 -0.06 -1.46 0.00 0.00 175.22 173.18 1u5b s PHE 188 N 1.28 3.24 -0.31 10.12 0.08 -0.51 -1.35 117.98 130.54 1u5b s PHE 188 Ca -0.03 0.27 -0.13 0.00 0.12 0.00 0.00 56.93 57.16 1u5b s PHE 188 Cb -0.20 -2.46 -0.03 0.00 -0.57 0.00 0.00 43.02 39.76 1u5b s PHE 188 CO -0.00 -0.17 0.27 -1.21 -0.10 0.00 0.00 175.22 174.01 1u5b s GLU 189 N 1.82 3.74 -0.40 0.44 2.02 -0.20 -4.08 118.70 122.04 1u5b s GLU 189 Ca 0.11 -0.38 -0.28 0.00 0.02 0.00 0.00 54.97 54.44 1u5b s GLU 189 Cb -0.16 -3.73 -0.02 0.00 0.10 0.00 0.00 34.13 30.32 1u5b s GLU 189 CO 0.10 -0.35 1.83 -2.14 0.02 0.00 0.00 175.26 174.72 1u5b s PRO 190 N 1.86 3.14 0.42 0.39 0.02 -1.26 -0.31 135.00 139.26 1u5b s PRO 190 Ca 0.09 1.25 0.20 0.00 0.02 0.00 0.00 61.00 62.55 1u5b s PRO 190 Cb -0.16 -4.25 0.95 0.00 0.02 0.00 0.00 34.50 31.05 1u5b s PRO 190 CO 0.11 -2.10 1.88 1.57 -0.33 0.00 0.00 177.00 178.13 1u5b h LYS 191 N 13.57 0.00 -0.04 5.54 2.10 -1.45 -0.63 116.57 135.65 1u5b h LYS 191 Ca -0.32 0.00 0.01 0.00 -2.00 0.00 0.00 60.65 58.35 1u5b h LYS 191 Cb 1.17 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 32.50 1u5b h LYS 191 CO 1.08 0.28 0.03 0.97 -2.00 0.00 0.00 179.45 179.81 1u5b h ILE 192 N 0.00 0.85 -0.00 0.07 6.09 -1.80 -2.11 117.51 120.61 1u5b h ILE 192 Ca -0.00 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.49 1u5b h ILE 192 Cb 0.62 0.98 0.00 0.00 0.47 0.00 0.00 36.82 38.89 1u5b h ILE 192 CO 0.04 0.00 -0.16 0.18 -3.07 0.00 0.00 178.15 175.14 1u5b n LEU 193 N -4.34 0.30 -0.23 2.19 4.77 -0.25 -4.30 117.00 115.14 1u5b n LEU 193 Ca -0.02 0.18 0.02 0.00 -0.03 0.00 0.00 56.01 56.16 1u5b n LEU 193 Cb 0.13 -0.31 0.14 0.00 -2.33 0.00 0.00 43.42 41.06 1u5b n LEU 193 CO 0.32 0.06 1.02 1.88 -1.33 0.00 0.00 177.39 179.35 1u5b h TYR 194 N 0.22 0.50 -0.90 -1.77 0.05 -1.40 -1.57 116.97 112.10 1u5b h TYR 194 Ca 0.00 0.03 -0.57 0.00 0.05 0.00 0.00 58.73 58.24 1u5b h TYR 194 Cb 0.43 -0.12 -0.41 0.00 1.01 0.00 0.00 36.73 37.64 1u5b h TYR 194 CO 0.00 0.13 -0.62 0.54 -1.05 0.00 0.00 178.16 177.15 1u5b n ARG 195 N -4.96 3.49 -0.91 4.88 1.74 -1.26 -2.17 116.66 117.47 1u5b n ARG 195 Ca 0.11 -4.13 -0.02 0.00 -0.77 0.00 0.00 57.85 53.05 1u5b n ARG 195 Cb 0.32 -2.28 0.01 0.00 -1.02 0.00 0.00 32.46 29.49 1u5b n ARG 195 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1u5b n ALA 196 N -0.69 0.05 -1.67 7.54 0.00 -0.59 -5.02 120.51 120.11 1u5b n ALA 196 Ca 0.45 -0.16 -0.43 0.00 0.00 0.00 0.00 53.44 53.30 1u5b n ALA 196 Cb 0.89 0.03 -0.01 0.00 0.00 0.00 0.00 19.45 20.36 1u5b n ALA 196 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1u5b n ALA 197 N -2.98 0.99 -1.74 0.00 0.00 -1.26 -4.73 120.51 110.80 1u5b n ALA 197 Ca -0.01 0.38 -0.32 0.00 0.00 0.00 0.00 53.44 53.48 1u5b n ALA 197 Cb 0.05 -2.22 -0.00 0.00 0.00 0.00 0.00 19.45 17.28 1u5b n ALA 197 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1u5b s ALA 198 N -0.91 2.88 0.21 0.00 0.00 -1.26 -4.67 121.76 118.00 1u5b s ALA 198 Ca 0.58 0.26 -0.02 0.00 0.00 0.00 0.00 51.96 52.78 1u5b s ALA 198 Cb -0.61 -3.18 -0.04 0.00 0.00 0.00 0.00 23.12 19.30 1u5b s ALA 198 CO 0.60 -0.62 0.17 -1.83 0.00 0.00 0.00 175.76 174.07 1u5b s GLU 199 N -4.23 1.25 0.08 0.00 -1.05 -0.17 -4.84 118.70 109.75 1u5b s GLU 199 Ca 0.61 -1.61 -0.31 0.00 -0.15 0.00 0.00 54.97 53.51 1u5b s GLU 199 Cb -0.13 0.29 -0.08 0.00 -0.44 0.00 0.00 34.13 33.77 1u5b s GLU 199 CO 0.37 -0.42 1.53 -1.21 0.95 0.00 0.00 175.26 176.48 1u5b s GLU 200 N -4.13 4.24 -0.07 -4.83 0.41 -1.26 -0.79 118.70 112.27 1u5b s GLU 200 Ca 0.38 2.20 0.01 0.00 -0.41 0.00 0.00 54.97 57.14 1u5b s GLU 200 Cb 0.06 -3.44 0.02 0.00 -1.78 0.00 0.00 34.13 28.99 1u5b s GLU 200 CO 0.12 -0.62 -0.07 0.08 -0.49 0.00 0.00 175.26 174.29 1u5b s VAL 201 N 2.02 0.81 0.14 2.63 1.01 0.66 -4.70 120.40 122.98 1u5b s VAL 201 Ca 0.69 -0.24 -0.34 0.00 0.00 0.00 0.00 61.98 62.09 1u5b s VAL 201 Cb -0.38 -0.82 -0.16 0.00 0.00 0.00 0.00 36.38 35.02 1u5b s VAL 201 CO 0.30 0.30 1.22 -2.65 0.00 0.00 0.00 175.10 174.28 1u5b n PRO 202 N 4.34 1.15 0.01 2.72 -0.02 -1.26 -1.43 135.00 140.52 1u5b n PRO 202 Ca -0.19 0.41 -0.07 0.00 -2.02 0.00 0.00 63.50 61.64 1u5b n PRO 202 Cb 0.51 -1.96 0.11 0.00 -0.02 0.00 0.00 33.50 32.14 1u5b n PRO 202 CO 0.00 0.00 0.00 0.82 1.98 0.00 0.00 175.50 178.30 1u5b h ILE 203 N 2.90 1.31 -3.44 4.25 1.08 -1.58 -3.45 117.51 118.58 1u5b h ILE 203 Ca -0.45 -1.63 -0.48 0.00 -0.39 0.00 0.00 64.86 61.91 1u5b h ILE 203 Cb 1.34 1.64 0.04 0.00 -3.07 0.00 0.00 36.82 36.77 1u5b h ILE 203 CO 0.73 0.51 0.08 -1.61 -0.69 0.00 0.00 178.15 177.17 1u5b s GLU 204 N -4.15 3.27 0.53 2.37 0.41 -1.26 -4.93 118.70 114.94 1u5b s GLU 204 Ca -0.07 0.01 -0.21 0.00 -0.41 0.00 0.00 54.97 54.29 1u5b s GLU 204 Cb 0.12 -2.38 -0.06 0.00 -1.78 0.00 0.00 34.13 30.03 1u5b s GLU 204 CO 0.82 -0.35 1.18 -1.25 -0.49 0.00 0.00 175.26 175.17 1u5b s PRO 205 N -4.77 3.36 0.22 0.39 0.04 -1.26 -5.06 135.00 127.92 1u5b s PRO 205 Ca 0.49 1.78 -0.17 0.00 0.04 0.00 0.00 61.00 63.15 1u5b s PRO 205 Cb -0.10 -2.14 0.02 0.00 0.04 0.00 0.00 34.50 32.32 1u5b s PRO 205 CO 0.43 -0.88 0.53 1.52 0.04 0.00 0.00 177.00 178.64 1u5b s TYR 206 N -1.60 0.01 0.02 0.56 1.13 -1.26 -5.12 117.35 111.09 1u5b s TYR 206 Ca 0.71 -0.38 0.05 0.00 -1.41 0.00 0.00 57.07 56.04 1u5b s TYR 206 Cb -0.29 0.37 -0.02 0.00 -1.10 0.00 0.00 41.96 40.93 1u5b s TYR 206 CO 0.33 -0.98 -0.14 -0.80 -2.51 0.00 0.00 175.55 171.45 1u5b s ASN 207 N -2.92 1.66 -0.07 -0.18 -0.87 -1.26 -4.51 114.94 106.79 1u5b s ASN 207 Ca 0.13 -0.38 0.03 0.00 -1.57 0.00 0.00 52.86 51.07 1u5b s ASN 207 Cb -0.01 -0.14 -0.02 0.00 -0.02 0.00 0.00 41.25 41.06 1u5b s ASN 207 CO 0.02 0.09 -0.15 -0.63 -2.57 0.00 0.00 177.10 173.86 1u5b s ILE 208 N -0.64 2.97 0.46 0.60 1.01 -0.70 -4.96 121.20 119.94 1u5b s ILE 208 Ca 0.03 -0.74 -0.24 0.00 0.00 0.00 0.00 60.65 59.71 1u5b s ILE 208 Cb -0.07 -2.18 -0.07 0.00 0.01 0.00 0.00 42.46 40.15 1u5b s ILE 208 CO 0.01 0.57 1.24 -2.16 0.00 0.00 0.00 174.94 174.60 1u5b s PRO 209 N -0.41 3.69 0.50 2.79 0.04 -1.26 -4.54 135.00 135.80 1u5b s PRO 209 Ca 0.05 1.97 -0.12 0.00 0.04 0.00 0.00 61.00 62.94 1u5b s PRO 209 Cb -0.12 -2.48 -0.06 0.00 0.04 0.00 0.00 34.50 31.88 1u5b s PRO 209 CO 0.02 -0.67 0.91 -0.51 0.04 0.00 0.00 177.00 176.79 1u5b s LEU 210 N -2.96 3.60 -1.62 -3.56 1.43 -1.26 -4.19 118.68 110.12 1u5b s LEU 210 Ca 0.63 1.33 -0.03 0.00 -1.03 0.00 0.00 54.13 55.03 1u5b s LEU 210 Cb -0.34 -4.28 0.01 0.00 0.03 0.00 0.00 46.19 41.61 1u5b s LEU 210 CO 0.41 -0.59 0.37 -1.20 0.23 0.00 0.00 176.35 175.57 1u5b n SER 211 N -1.82 -5.93 -3.79 2.29 7.64 -1.26 -4.99 113.62 105.76 1u5b n SER 211 Ca 0.04 -0.18 -0.25 0.00 1.01 0.00 0.00 58.87 59.49 1u5b n SER 211 Cb 0.54 -4.85 -0.17 0.00 -1.01 0.00 0.00 64.21 58.72 1u5b n SER 211 CO 0.00 0.00 0.00 -1.10 -3.01 0.00 0.00 175.04 170.93 1u5b s GLN 212 N -5.46 0.83 0.73 1.43 -1.52 -1.26 -4.20 119.66 110.21 1u5b s GLN 212 Ca 0.19 -0.13 -0.11 0.00 -1.95 0.00 0.00 55.36 53.35 1u5b s GLN 212 Cb -0.08 -1.44 0.03 0.00 -0.22 0.00 0.00 33.01 31.29 1u5b s GLN 212 CO 0.23 -0.39 1.07 0.00 -0.25 0.00 0.00 175.29 175.95 1u5b s ALA 213 N 1.87 2.59 -0.12 6.09 0.00 -1.25 -4.59 121.76 126.35 1u5b s ALA 213 Ca 0.03 -0.08 0.00 0.00 0.00 0.00 0.00 51.96 51.92 1u5b s ALA 213 Cb -0.14 -3.13 0.02 0.00 0.00 0.00 0.00 23.12 19.88 1u5b s ALA 213 CO -0.07 -1.35 -0.11 -2.00 0.00 0.00 0.00 175.76 172.24 1u5b s GLU 214 N -5.13 1.89 -0.50 0.00 2.12 0.89 -4.97 118.70 113.01 1u5b s GLU 214 Ca 0.59 -0.41 -0.29 0.00 0.36 0.00 0.00 54.97 55.22 1u5b s GLU 214 Cb -0.14 -1.78 0.03 0.00 0.26 0.00 0.00 34.13 32.50 1u5b s GLU 214 CO 0.54 -0.20 1.22 0.08 -0.54 0.00 0.00 175.26 176.36 1u5b s VAL 215 N 1.44 4.07 -0.42 3.70 1.01 -1.26 -0.12 120.40 128.82 1u5b s VAL 215 Ca 0.02 1.05 0.23 0.00 0.00 0.00 0.00 61.98 63.27 1u5b s VAL 215 Cb -0.13 -4.57 -0.14 0.00 0.00 0.00 0.00 36.38 31.54 1u5b s VAL 215 CO -0.07 -1.08 0.90 2.30 0.00 0.00 0.00 175.10 177.15 1u5b n ILE 216 N 6.84 0.22 -3.71 2.22 -5.35 -0.13 -4.81 119.36 114.64 1u5b n ILE 216 Ca 0.12 -0.36 -0.13 0.00 -0.27 0.00 0.00 62.75 62.11 1u5b n ILE 216 Cb 0.49 0.08 -0.13 0.00 -1.74 0.00 0.00 39.64 38.33 1u5b n ILE 216 CO 0.00 0.00 0.00 -1.58 -1.76 0.00 0.00 176.55 173.21 1u5b s GLN 217 N -3.30 0.19 0.38 6.28 0.74 -1.15 -4.97 119.66 117.83 1u5b s GLN 217 Ca 0.00 0.60 -0.24 0.00 0.05 0.00 0.00 55.36 55.78 1u5b s GLN 217 Cb 0.13 -0.10 -0.10 0.00 1.10 0.00 0.00 33.01 34.05 1u5b s GLN 217 CO 0.83 -0.20 0.98 -1.21 -0.55 0.00 0.00 175.29 175.13 1u5b s GLU 218 N 1.62 4.34 0.31 1.67 2.02 -1.26 -1.22 118.70 126.18 1u5b s GLU 218 Ca -0.06 1.33 -0.17 0.00 0.02 0.00 0.00 54.97 56.09 1u5b s GLU 218 Cb -0.11 -2.53 0.02 0.00 0.10 0.00 0.00 34.13 31.62 1u5b s GLU 218 CO -0.09 0.05 0.68 0.20 0.02 0.00 0.00 175.26 176.12 1u5b s GLY 219 N -1.77 0.27 0.00 -1.39 0.00 -1.25 -4.60 107.32 98.58 1u5b s GLY 219 Ca 0.56 -0.63 0.00 0.00 0.00 0.00 0.00 44.72 44.65 1u5b s GLY 219 CO 0.22 -0.32 0.00 -1.14 0.00 0.00 0.00 173.10 171.86 1u5b n SER 220 N -0.80 0.75 -0.09 1.64 3.41 -1.14 -4.40 113.62 112.99 1u5b n SER 220 Ca -0.05 -0.31 -0.10 0.00 -0.26 0.00 0.00 58.87 58.16 1u5b n SER 220 Cb 0.60 0.76 -0.13 0.00 -0.26 0.00 0.00 64.21 65.18 1u5b n SER 220 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1u5b n ASP 221 N -0.84 1.05 -3.70 4.04 8.00 0.16 -4.32 116.55 120.94 1u5b n ASP 221 Ca 0.00 -0.03 -0.14 0.00 0.71 0.00 0.00 54.79 55.33 1u5b n ASP 221 Cb 0.00 0.62 -0.09 0.00 -0.02 0.00 0.00 41.12 41.64 1u5b n ASP 221 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1u5b s VAL 222 N -2.43 0.02 -0.16 2.53 0.11 -1.10 -4.40 120.40 114.97 1u5b s VAL 222 Ca -0.14 -0.14 -0.06 0.00 -2.93 0.00 0.00 61.98 58.71 1u5b s VAL 222 Cb 0.06 -0.70 -0.04 0.00 -1.53 0.00 0.00 36.38 34.17 1u5b s VAL 222 CO 0.67 -0.08 0.04 -0.89 -3.33 0.00 0.00 175.10 171.51 1u5b s THR 223 N -0.46 4.59 -0.10 5.04 2.01 -0.44 0.09 115.64 126.38 1u5b s THR 223 Ca -0.06 -0.11 0.03 0.00 0.31 0.00 0.00 61.69 61.86 1u5b s THR 223 Cb -0.03 -3.03 -0.01 0.00 0.01 0.00 0.00 72.50 69.43 1u5b s THR 223 CO 0.03 0.50 -0.19 -0.76 -0.69 0.00 0.00 174.62 173.51 1u5b s LEU 224 N 0.06 2.38 -0.04 4.42 1.43 0.11 -1.05 118.68 125.99 1u5b s LEU 224 Ca 0.04 -0.43 0.04 0.00 -1.03 0.00 0.00 54.13 52.75 1u5b s LEU 224 Cb -0.12 -1.49 -0.00 0.00 0.03 0.00 0.00 46.19 44.60 1u5b s LEU 224 CO 0.01 0.19 -0.17 -0.69 0.23 0.00 0.00 176.35 175.92 1u5b s VAL 225 N 0.17 1.42 0.20 -1.59 1.01 -0.37 -1.04 120.40 120.20 1u5b s VAL 225 Ca -0.11 -0.72 -0.05 0.00 0.00 0.00 0.00 61.98 61.10 1u5b s VAL 225 Cb -0.16 -1.22 0.02 0.00 0.00 0.00 0.00 36.38 35.03 1u5b s VAL 225 CO 0.06 0.41 0.35 0.00 0.00 0.00 0.00 175.10 175.92 1u5b n ALA 226 N 3.06 -0.65 -3.01 5.51 0.00 -1.04 -1.95 120.51 122.42 1u5b n ALA 226 Ca -0.18 -0.72 -0.09 0.00 0.00 0.00 0.00 53.44 52.45 1u5b n ALA 226 Cb 0.53 0.58 -0.05 0.00 0.00 0.00 0.00 19.45 20.51 1u5b n ALA 226 CO 0.00 0.00 0.00 1.67 0.00 0.00 0.00 177.50 179.17 1u5b s TRP 227 N -4.93 0.17 0.00 0.00 -2.14 -1.26 -1.26 118.94 109.53 1u5b s TRP 227 Ca 0.11 -0.53 0.00 0.00 2.66 0.00 0.00 56.10 58.34 1u5b s TRP 227 Cb -0.02 0.16 0.00 0.00 -3.10 0.00 0.00 33.47 30.51 1u5b s TRP 227 CO 0.08 -0.83 0.00 0.41 -2.66 0.00 0.00 176.95 173.95 1u5b n GLY 228 N -0.28 2.04 0.33 3.67 0.00 -1.26 -2.64 105.19 107.04 1u5b n GLY 228 Ca -0.08 -0.47 0.08 0.00 0.00 0.00 0.00 46.02 45.55 1u5b n GLY 228 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1u5b h THR 229 N 0.00 1.00 0.00 2.61 2.02 -1.88 -1.66 112.91 115.00 1u5b h THR 229 Ca 0.00 -0.16 0.00 0.00 0.77 0.00 0.00 66.41 67.02 1u5b h THR 229 Cb 0.00 0.50 0.00 0.00 -1.74 0.00 0.00 68.15 66.91 1u5b h THR 229 CO 0.00 0.08 0.00 -0.61 0.37 0.00 0.00 175.52 175.36 1u5b h GLN 230 N 0.45 0.00 -1.00 6.66 5.75 -1.89 -0.71 115.11 124.37 1u5b h GLN 230 Ca 0.21 0.00 0.06 0.00 -0.15 0.00 0.00 58.65 58.76 1u5b h GLN 230 Cb 0.24 0.00 -0.07 0.00 1.07 0.00 0.00 27.48 28.73 1u5b h GLN 230 CO -0.05 0.00 0.65 0.28 -2.65 0.00 0.00 178.83 177.06 1u5b h VAL 231 N 0.00 1.11 -0.14 2.39 2.07 -1.36 -1.59 116.25 118.72 1u5b h VAL 231 Ca 0.00 -0.41 -0.11 0.00 0.82 0.00 0.00 66.70 67.00 1u5b h VAL 231 Cb 0.14 -0.19 -0.01 0.00 -1.52 0.00 0.00 31.29 29.71 1u5b h VAL 231 CO 0.00 0.22 -0.41 0.45 0.02 0.00 0.00 177.57 177.85 1u5b h HIS 232 N 1.19 0.38 -0.26 1.57 3.86 -1.31 -1.20 115.15 119.38 1u5b h HIS 232 Ca 0.42 -0.10 -0.03 0.00 -1.16 0.00 0.00 60.37 59.50 1u5b h HIS 232 Cb 0.13 -0.08 -0.01 0.00 1.06 0.00 0.00 27.41 28.50 1u5b h HIS 232 CO -0.00 0.69 0.06 0.28 0.86 0.00 0.00 177.93 179.81 1u5b h VAL 233 N 0.27 1.22 0.00 2.45 2.07 -1.39 -2.12 116.25 118.75 1u5b h VAL 233 Ca 0.03 -0.72 -0.09 0.00 0.82 0.00 0.00 66.70 66.74 1u5b h VAL 233 Cb 0.84 1.18 -0.01 0.00 -1.52 0.00 0.00 31.29 31.78 1u5b h VAL 233 CO 0.07 0.23 -0.41 0.16 0.02 0.00 0.00 177.57 177.64 1u5b h ILE 234 N 0.25 0.91 -0.26 4.57 3.07 -1.01 0.44 117.51 125.49 1u5b h ILE 234 Ca 0.08 -1.66 -0.01 0.00 1.55 0.00 0.00 64.86 64.82 1u5b h ILE 234 Cb 0.29 2.02 -0.01 0.00 -0.27 0.00 0.00 36.82 38.85 1u5b h ILE 234 CO 0.00 0.40 0.11 -0.09 -1.05 0.00 0.00 178.15 177.53 1u5b h ARG 235 N 0.00 0.38 0.07 0.16 2.43 -1.14 0.73 114.38 117.01 1u5b h ARG 235 Ca -0.00 -0.06 0.02 0.00 -0.81 0.00 0.00 59.98 59.13 1u5b h ARG 235 Cb 0.98 -0.06 -0.04 0.00 -0.42 0.00 0.00 29.97 30.43 1u5b h ARG 235 CO 0.05 0.39 -0.28 1.49 -1.51 0.00 0.00 179.97 180.11 1u5b h GLU 236 N 0.27 -0.45 -0.97 0.20 4.81 -0.81 -2.34 114.58 115.29 1u5b h GLU 236 Ca 0.09 0.03 0.19 0.00 -0.13 0.00 0.00 59.36 59.54 1u5b h GLU 236 Cb 0.15 0.10 -0.09 0.00 0.63 0.00 0.00 28.75 29.54 1u5b h GLU 236 CO -0.01 -0.30 0.61 0.28 -0.73 0.00 0.00 179.01 178.86 1u5b h VAL 237 N -0.47 0.71 -0.73 0.32 2.07 -0.70 0.40 116.25 117.85 1u5b h VAL 237 Ca 0.04 -0.22 0.01 0.00 0.82 0.00 0.00 66.70 67.35 1u5b h VAL 237 Cb 0.52 0.00 -0.04 0.00 -1.52 0.00 0.00 31.29 30.26 1u5b h VAL 237 CO -0.20 0.12 0.49 0.00 0.02 0.00 0.00 177.57 178.00 1u5b h ALA 238 N 1.62 0.93 0.16 1.67 0.00 -0.45 0.04 119.26 123.23 1u5b h ALA 238 Ca 0.53 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 55.39 1u5b h ALA 238 Cb 0.97 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 1u5b h ALA 238 CO -0.30 0.35 -0.13 0.77 0.00 0.00 0.00 179.25 179.95 1u5b h SER 239 N 0.99 -0.33 -0.47 0.00 0.02 -0.44 -2.21 113.55 111.11 1u5b h SER 239 Ca 0.27 0.03 0.03 0.00 -0.84 0.00 0.00 61.79 61.28 1u5b h SER 239 Cb -0.11 0.11 -0.04 0.00 0.14 0.00 0.00 62.40 62.50 1u5b h SER 239 CO -0.06 -0.20 0.25 0.24 -1.14 0.00 0.00 176.83 175.92 1u5b h MET 240 N -0.30 0.48 -0.73 3.45 2.86 -1.02 -1.37 114.93 118.31 1u5b h MET 240 Ca -0.01 -0.03 -0.00 0.00 -2.06 0.00 0.00 59.70 57.61 1u5b h MET 240 Cb 0.27 -0.11 -0.04 0.00 0.06 0.00 0.00 31.60 31.78 1u5b h MET 240 CO -0.01 0.32 0.46 0.00 1.06 0.00 0.00 176.91 178.73 1u5b h ALA 241 N 1.24 0.93 -0.27 6.32 0.00 -0.96 0.20 119.26 126.72 1u5b h ALA 241 Ca 0.20 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 1u5b h ALA 241 Cb 0.08 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 1u5b h ALA 241 CO -0.12 0.39 0.14 -0.22 0.00 0.00 0.00 179.25 179.43 1u5b h LYS 242 N 1.00 0.38 -0.05 0.00 3.64 -0.95 0.13 116.57 120.72 1u5b h LYS 242 Ca 0.26 -0.05 -0.14 0.00 -1.27 0.00 0.00 60.65 59.46 1u5b h LYS 242 Cb -0.06 -0.07 0.01 0.00 -0.41 0.00 0.00 32.23 31.70 1u5b h LYS 242 CO -0.05 0.36 -0.50 0.93 -2.27 0.00 0.00 179.45 177.92 1u5b h GLU 243 N 0.31 0.43 0.03 1.90 4.39 -0.89 -2.05 114.58 118.69 1u5b h GLU 243 Ca 0.09 -0.39 -0.30 0.00 0.34 0.00 0.00 59.36 59.10 1u5b h GLU 243 Cb 0.09 0.10 -0.04 0.00 -0.10 0.00 0.00 28.75 28.80 1u5b h GLU 243 CO -0.01 1.04 -1.71 0.87 -1.16 0.00 0.00 179.01 178.04 1u5b h LYS 244 N -0.05 0.06 -0.00 2.33 1.57 -0.67 -3.41 116.57 116.40 1u5b h LYS 244 Ca -0.05 -0.10 0.00 0.00 -1.87 0.00 0.00 60.65 58.63 1u5b h LYS 244 Cb 1.18 0.04 0.00 0.00 0.08 0.00 0.00 32.23 33.52 1u5b h LYS 244 CO 0.10 0.67 -0.11 1.28 -0.57 0.00 0.00 179.45 180.82 1u5b n LEU 245 N -3.15 0.12 -1.64 2.94 4.77 0.35 -5.01 117.00 115.37 1u5b n LEU 245 Ca -0.18 -0.50 -0.13 0.00 -0.03 0.00 0.00 56.01 55.16 1u5b n LEU 245 Cb 1.05 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 42.14 1u5b n LEU 245 CO 0.45 0.03 -0.12 0.61 -1.33 0.00 0.00 177.39 177.03 1u5b n GLY 246 N 1.05 -0.14 3.59 -0.72 0.00 -0.55 -4.96 105.19 103.46 1u5b n GLY 246 Ca 0.00 -0.30 -0.34 0.00 0.00 0.00 0.00 46.02 45.38 1u5b n GLY 246 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1u5b s VAL 247 N -2.74 4.39 -0.37 1.61 1.01 -0.97 -4.94 120.40 118.39 1u5b s VAL 247 Ca 0.06 -0.18 -0.18 0.00 0.00 0.00 0.00 61.98 61.68 1u5b s VAL 247 Cb -0.03 -2.95 0.00 0.00 0.00 0.00 0.00 36.38 33.41 1u5b s VAL 247 CO 0.07 0.49 0.50 -0.55 0.00 0.00 0.00 175.10 175.61 1u5b s SER 248 N 0.25 6.29 -0.15 3.32 0.15 -1.26 -2.93 113.70 119.37 1u5b s SER 248 Ca 0.01 -0.19 -0.05 0.00 0.70 0.00 0.00 55.95 56.43 1u5b s SER 248 Cb -0.13 -2.26 -0.03 0.00 -1.71 0.00 0.00 66.02 61.88 1u5b s SER 248 CO 0.01 -0.52 0.01 0.00 1.20 0.00 0.00 173.24 173.95 1u5b s GLU 250 N -0.00 4.29 -0.19 0.00 2.12 0.11 -3.89 118.70 121.15 1u5b s GLU 250 Ca 0.04 0.55 -0.02 0.00 0.36 0.00 0.00 54.97 55.89 1u5b s GLU 250 Cb -0.13 -3.50 -0.01 0.00 0.26 0.00 0.00 34.13 30.76 1u5b s GLU 250 CO 0.02 -0.01 -0.09 0.08 -0.54 0.00 0.00 175.26 174.72 1u5b s VAL 251 N 1.16 3.14 -0.10 3.70 1.01 -0.35 0.05 120.40 129.01 1u5b s VAL 251 Ca 0.28 -0.59 0.03 0.00 0.00 0.00 0.00 61.98 61.70 1u5b s VAL 251 Cb -0.16 -2.39 0.01 0.00 0.00 0.00 0.00 36.38 33.84 1u5b s VAL 251 CO 0.11 0.47 -0.20 -0.63 0.00 0.00 0.00 175.10 174.85 1u5b s ILE 252 N 1.10 1.78 -0.29 2.22 1.01 -0.21 -0.96 121.20 125.85 1u5b s ILE 252 Ca 0.01 -0.84 -0.19 0.00 0.00 0.00 0.00 60.65 59.63 1u5b s ILE 252 Cb -0.15 -1.57 -0.02 0.00 0.01 0.00 0.00 42.46 40.74 1u5b s ILE 252 CO -0.02 0.50 0.57 -0.62 0.00 0.00 0.00 174.94 175.37 1u5b s ASP 253 N 0.60 6.45 0.22 3.58 2.15 0.83 -2.51 116.67 127.99 1u5b s ASP 253 Ca -0.14 0.42 -0.06 0.00 0.43 0.00 0.00 52.55 53.21 1u5b s ASP 253 Cb -0.17 -2.30 0.20 0.00 -0.30 0.00 0.00 42.92 40.35 1u5b s ASP 253 CO 0.04 -0.39 1.70 0.25 -0.17 0.00 0.00 175.17 176.60 1u5b h LEU 254 N 8.98 0.92 0.00 -1.34 5.85 -1.47 0.25 115.31 128.50 1u5b h LEU 254 Ca -0.28 -0.24 0.00 0.00 0.84 0.00 0.00 57.88 58.20 1u5b h LEU 254 Cb 1.13 -0.24 0.00 0.00 0.37 0.00 0.00 40.66 41.91 1u5b h LEU 254 CO 0.76 0.97 0.00 0.54 -0.34 0.00 0.00 178.44 180.37 1u5b n ARG 255 N -4.20 0.00 -3.70 1.25 1.74 -1.26 -3.74 116.66 106.75 1u5b n ARG 255 Ca 0.03 0.00 -0.37 0.00 -0.77 0.00 0.00 57.85 56.74 1u5b n ARG 255 Cb 0.32 0.00 -0.11 0.00 -1.02 0.00 0.00 32.46 31.65 1u5b n ARG 255 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 1u5b s THR 256 N 0.00 4.86 -0.06 0.55 2.01 -1.26 -0.34 115.64 121.40 1u5b s THR 256 Ca 0.00 0.01 -0.24 0.00 0.31 0.00 0.00 61.69 61.77 1u5b s THR 256 Cb 0.00 -3.29 -0.25 0.00 0.01 0.00 0.00 72.50 68.98 1u5b s THR 256 CO 0.00 0.31 0.99 0.40 -0.69 0.00 0.00 174.62 175.63 1u5b h ILE 257 N 5.38 1.56 -3.53 1.82 1.08 -0.89 -3.39 117.51 119.53 1u5b h ILE 257 Ca -0.37 -2.08 -0.20 0.00 -0.39 0.00 0.00 64.86 61.82 1u5b h ILE 257 Cb 1.18 2.88 -0.27 0.00 -3.07 0.00 0.00 36.82 37.54 1u5b h ILE 257 CO 0.58 0.57 -0.61 0.27 -0.69 0.00 0.00 178.15 178.27 1u5b s ILE 258 N -2.94 0.01 0.23 -0.67 -4.36 -1.21 -3.66 121.20 108.59 1u5b s ILE 258 Ca -0.16 -0.07 -0.30 0.00 -0.26 0.00 0.00 60.65 59.86 1u5b s ILE 258 Cb 0.01 -0.15 -0.09 0.00 1.25 0.00 0.00 42.46 43.47 1u5b s ILE 258 CO 0.75 -0.04 1.35 -2.84 0.24 0.00 0.00 174.94 174.41 1u5b s PRO 259 N -0.08 4.35 0.39 0.37 0.02 -1.26 -1.67 135.00 137.11 1u5b s PRO 259 Ca -0.01 2.15 0.03 0.00 0.02 0.00 0.00 61.00 63.19 1u5b s PRO 259 Cb -0.01 -3.16 -0.01 0.00 0.02 0.00 0.00 34.50 31.34 1u5b s PRO 259 CO 0.00 -0.30 0.57 1.67 -0.33 0.00 0.00 177.00 178.61 1u5b s TRP 260 N -0.02 3.18 -1.28 6.54 1.48 -1.24 -4.17 118.94 123.43 1u5b s TRP 260 Ca 0.57 0.02 -0.14 0.00 -1.06 0.00 0.00 56.10 55.49 1u5b s TRP 260 Cb -0.39 -2.15 0.13 0.00 -1.16 0.00 0.00 33.47 29.91 1u5b s TRP 260 CO 0.41 -0.18 1.72 -3.47 -4.06 0.00 0.00 176.95 171.38 1u5b n ASP 261 N -1.86 4.94 -0.17 -2.66 -0.08 -1.26 -4.78 116.55 110.67 1u5b n ASP 261 Ca 0.00 -2.97 -0.02 0.00 -1.51 0.00 0.00 54.79 50.29 1u5b n ASP 261 Cb 0.58 -1.61 0.07 0.00 2.34 0.00 0.00 41.12 42.51 1u5b n ASP 261 CO 0.00 0.00 0.00 0.58 0.12 0.00 0.00 177.20 177.90 1u5b h VAL 262 N 4.58 0.76 -0.44 5.18 2.07 -1.94 -3.10 116.25 123.37 1u5b h VAL 262 Ca 0.40 -0.11 -0.00 0.00 0.82 0.00 0.00 66.70 67.81 1u5b h VAL 262 Cb 0.78 0.43 -0.02 0.00 -1.52 0.00 0.00 31.29 30.96 1u5b h VAL 262 CO 1.48 0.06 0.25 0.44 0.02 0.00 0.00 177.57 179.82 1u5b h ASP 263 N 0.31 0.53 -0.80 0.57 3.32 -1.98 -1.20 116.42 117.18 1u5b h ASP 263 Ca 0.26 -0.07 -0.03 0.00 0.02 0.00 0.00 57.03 57.21 1u5b h ASP 263 Cb 0.32 -0.13 -0.04 0.00 0.22 0.00 0.00 39.33 39.70 1u5b h ASP 263 CO -0.30 0.44 0.38 0.74 -1.72 0.00 0.00 179.24 178.79 1u5b h THR 264 N 0.57 1.25 -0.12 0.35 2.02 -1.96 -0.98 112.91 114.04 1u5b h THR 264 Ca 0.16 -0.70 -0.03 0.00 0.77 0.00 0.00 66.41 66.61 1u5b h THR 264 Cb 0.02 0.24 -0.00 0.00 -1.74 0.00 0.00 68.15 66.66 1u5b h THR 264 CO -0.03 0.30 -0.03 0.40 0.37 0.00 0.00 175.52 176.53 1u5b h ILE 265 N 1.13 1.29 -0.53 3.11 1.08 -1.41 -2.43 117.51 119.75 1u5b h ILE 265 Ca 0.27 -0.96 0.00 0.00 -0.39 0.00 0.00 64.86 63.79 1u5b h ILE 265 Cb 0.12 1.68 -0.03 0.00 -3.07 0.00 0.00 36.82 35.52 1u5b h ILE 265 CO -0.03 0.28 0.34 0.00 -0.69 0.00 0.00 178.15 178.05 1u5b h LYS 267 N 0.71 0.76 -0.46 0.00 3.64 -1.16 0.84 116.57 120.91 1u5b h LYS 267 Ca 0.19 -0.05 -0.02 0.00 -1.27 0.00 0.00 60.65 59.51 1u5b h LYS 267 Cb -0.07 -0.17 -0.02 0.00 -0.41 0.00 0.00 32.23 31.56 1u5b h LYS 267 CO -0.04 0.50 0.22 1.03 -2.27 0.00 0.00 179.45 178.89 1u5b h SER 268 N 0.79 0.61 0.29 4.20 0.87 -0.99 -2.44 113.55 116.88 1u5b h SER 268 Ca 0.34 -0.13 -0.16 0.00 -1.23 0.00 0.00 61.79 60.61 1u5b h SER 268 Cb 0.22 -0.16 -0.01 0.00 -0.44 0.00 0.00 62.40 62.01 1u5b h SER 268 CO -0.19 0.57 -0.63 0.58 -0.53 0.00 0.00 176.83 176.63 1u5b h VAL 269 N 0.60 1.38 -0.94 2.23 2.07 -0.80 0.18 116.25 120.98 1u5b h VAL 269 Ca 0.16 -2.00 0.06 0.00 0.82 0.00 0.00 66.70 65.74 1u5b h VAL 269 Cb 0.12 2.00 -0.06 0.00 -1.52 0.00 0.00 31.29 31.83 1u5b h VAL 269 CO -0.02 0.60 0.61 0.40 0.02 0.00 0.00 177.57 179.18 1u5b h ILE 270 N 0.23 1.10 -0.08 4.57 2.04 -0.80 0.26 117.51 124.83 1u5b h ILE 270 Ca -0.01 -0.38 -0.04 0.00 1.00 0.00 0.00 64.86 65.43 1u5b h ILE 270 Cb 1.15 -0.11 -0.00 0.00 -0.74 0.00 0.00 36.82 37.12 1u5b h ILE 270 CO 0.10 0.20 -0.09 0.50 0.00 0.00 0.00 178.15 178.86 1u5b h LYS 271 N 1.11 0.21 0.06 2.37 3.64 -0.85 -3.39 116.57 119.73 1u5b h LYS 271 Ca 0.39 -0.11 -0.31 0.00 -1.27 0.00 0.00 60.65 59.35 1u5b h LYS 271 Cb 0.13 0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 31.93 1u5b h LYS 271 CO -0.14 0.65 -1.69 1.79 -2.27 0.00 0.00 179.45 177.79 1u5b h THR 272 N -0.22 0.93 0.00 1.00 1.35 -0.80 -3.48 112.91 111.69 1u5b h THR 272 Ca 0.01 -2.68 0.00 0.00 -0.55 0.00 0.00 66.41 63.19 1u5b h THR 272 Cb 0.61 2.56 0.00 0.00 -1.73 0.00 0.00 68.15 69.59 1u5b h THR 272 CO 0.02 0.71 0.00 0.61 -0.25 0.00 0.00 175.52 176.61 1u5b n GLY 273 N 1.68 0.82 3.16 5.82 0.00 0.90 -4.55 105.19 113.03 1u5b n GLY 273 Ca -0.19 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.70 1u5b n GLY 273 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1u5b s ARG 274 N -0.08 0.36 -0.02 1.61 0.52 -1.26 0.32 118.95 120.40 1u5b s ARG 274 Ca 0.00 0.30 -0.00 0.00 -0.52 0.00 0.00 55.73 55.51 1u5b s ARG 274 Cb 0.00 0.17 0.03 0.00 0.52 0.00 0.00 34.95 35.67 1u5b s ARG 274 CO 0.00 -0.05 0.03 -1.17 0.02 0.00 0.00 175.30 174.12 1u5b s LEU 275 N -0.05 1.04 -0.13 2.53 2.96 -1.26 -1.32 118.68 122.45 1u5b s LEU 275 Ca -0.02 0.03 0.03 0.00 -0.22 0.00 0.00 54.13 53.95 1u5b s LEU 275 Cb -0.02 -0.09 0.01 0.00 0.50 0.00 0.00 46.19 46.58 1u5b s LEU 275 CO 0.01 -0.13 -0.22 -0.22 -1.32 0.00 0.00 176.35 174.46 1u5b s LEU 276 N 1.12 2.13 -0.02 -0.68 0.20 -0.22 -1.54 118.68 119.68 1u5b s LEU 276 Ca -0.08 -0.58 0.07 0.00 0.69 0.00 0.00 54.13 54.22 1u5b s LEU 276 Cb -0.13 -1.44 -0.02 0.00 -0.43 0.00 0.00 46.19 44.17 1u5b s LEU 276 CO -0.03 0.11 -0.21 -0.63 -0.29 0.00 0.00 176.35 175.30 1u5b s ILE 277 N 0.63 2.46 0.00 6.68 1.01 0.14 -1.24 121.20 130.88 1u5b s ILE 277 Ca -0.11 -1.01 0.00 0.00 0.00 0.00 0.00 60.65 59.52 1u5b s ILE 277 Cb -0.16 -1.92 -0.00 0.00 0.01 0.00 0.00 42.46 40.39 1u5b s ILE 277 CO 0.02 0.54 -0.01 -0.55 0.00 0.00 0.00 174.94 174.95 1u5b s SER 278 N -0.78 0.13 -0.12 3.58 0.15 -0.82 -0.26 113.70 115.58 1u5b s SER 278 Ca 0.11 -0.06 -0.26 0.00 0.70 0.00 0.00 55.95 56.44 1u5b s SER 278 Cb -0.10 -0.00 0.06 0.00 -1.71 0.00 0.00 66.02 64.27 1u5b s SER 278 CO 0.00 -0.01 0.64 -1.38 1.20 0.00 0.00 173.24 173.69 1u5b s HIS 279 N -0.13 -0.64 0.43 3.44 -3.43 -1.06 -4.46 115.29 109.44 1u5b s HIS 279 Ca -0.01 1.28 0.21 0.00 -0.80 0.00 0.00 55.06 55.74 1u5b s HIS 279 Cb -0.01 0.32 1.21 0.00 -1.43 0.00 0.00 32.58 32.66 1u5b s HIS 279 CO -0.00 -0.49 2.02 0.93 -2.00 0.00 0.00 174.74 175.19 1u5b h GLU 280 N 3.84 0.00 -7.22 -0.38 5.08 -1.94 -2.83 114.58 111.14 1u5b h GLU 280 Ca -0.28 0.00 -0.52 0.00 -1.00 0.00 0.00 59.36 57.56 1u5b h GLU 280 Cb 1.15 0.00 0.14 0.00 0.50 0.00 0.00 28.75 30.54 1u5b h GLU 280 CO 0.28 0.17 0.35 0.00 -1.00 0.00 0.00 179.01 178.81 1u5b s ALA 281 N -4.37 2.19 0.52 3.43 0.00 -1.26 -3.12 121.76 119.14 1u5b s ALA 281 Ca -0.03 0.63 -0.21 0.00 0.00 0.00 0.00 51.96 52.34 1u5b s ALA 281 Cb 0.14 -3.38 -0.08 0.00 0.00 0.00 0.00 23.12 19.80 1u5b s ALA 281 CO 0.64 -1.75 0.91 -2.30 0.00 0.00 0.00 175.76 173.26 1u5b n PRO 282 N -2.93 1.03 0.08 0.00 -0.02 -1.26 -1.85 135.00 130.05 1u5b n PRO 282 Ca 0.11 0.38 -0.12 0.00 -2.02 0.00 0.00 63.50 61.85 1u5b n PRO 282 Cb 0.52 -2.04 -0.05 0.00 -0.02 0.00 0.00 33.50 31.90 1u5b n PRO 282 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 1u5b h LEU 283 N 0.89 -0.91 -9.28 2.45 5.85 -1.46 -3.27 115.31 109.59 1u5b h LEU 283 Ca -0.46 0.11 -0.55 0.00 0.84 0.00 0.00 57.88 57.82 1u5b h LEU 283 Cb 1.36 0.36 -0.02 0.00 0.37 0.00 0.00 40.66 42.73 1u5b h LEU 283 CO 0.53 -0.38 0.79 -0.89 -0.34 0.00 0.00 178.44 178.14 1u5b s THR 284 N -6.02 4.14 0.00 1.05 2.01 -1.26 -1.47 115.64 114.09 1u5b s THR 284 Ca -0.16 1.46 0.00 0.00 0.31 0.00 0.00 61.69 63.30 1u5b s THR 284 Cb 0.09 -3.94 0.00 0.00 0.01 0.00 0.00 72.50 68.66 1u5b s THR 284 CO 0.65 -0.04 0.00 0.61 -0.69 0.00 0.00 174.62 175.15 1u5b n GLY 285 N 3.50 0.64 3.66 4.40 0.00 -1.26 -5.02 105.19 111.10 1u5b n GLY 285 Ca 0.12 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.85 1u5b n GLY 285 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1u5b s GLY 286 N -2.00 1.61 0.49 -0.02 0.00 -0.55 -4.84 107.32 102.02 1u5b s GLY 286 Ca 0.00 0.01 0.28 0.00 0.00 0.00 0.00 44.72 45.01 1u5b s GLY 286 CO 0.00 0.55 1.89 -2.75 0.00 0.00 0.00 173.10 172.79 1u5b h PHE 287 N -1.87 0.00 -0.75 1.90 3.57 -1.87 -2.08 116.94 115.84 1u5b h PHE 287 Ca -0.51 0.00 0.19 0.00 3.53 0.00 0.00 57.97 61.18 1u5b h PHE 287 Cb 1.29 0.00 -0.04 0.00 2.79 0.00 0.00 35.95 40.00 1u5b h PHE 287 CO 0.39 0.12 0.52 0.00 -2.23 0.00 0.00 178.31 177.11 1u5b h ALA 288 N 1.88 2.48 -0.39 2.41 0.00 -1.91 -1.89 119.26 121.83 1u5b h ALA 288 Ca -0.00 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.84 1u5b h ALA 288 Cb 0.64 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.43 1u5b h ALA 288 CO 0.02 -0.70 0.01 0.77 0.00 0.00 0.00 179.25 179.35 1u5b h SER 289 N 0.15 0.59 -0.12 0.00 0.02 -1.67 0.77 113.55 113.29 1u5b h SER 289 Ca 0.37 -0.12 -0.10 0.00 -0.84 0.00 0.00 61.79 61.10 1u5b h SER 289 Cb 1.22 -0.15 0.00 0.00 0.14 0.00 0.00 62.40 63.61 1u5b h SER 289 CO -0.06 0.65 -0.31 -0.08 -1.14 0.00 0.00 176.83 175.89 1u5b h GLU 290 N 0.59 0.42 -0.16 3.45 4.57 -1.52 -1.91 114.58 120.01 1u5b h GLU 290 Ca 0.12 -0.29 -0.00 0.00 -1.18 0.00 0.00 59.36 58.01 1u5b h GLU 290 Cb 0.36 0.05 -0.01 0.00 -0.16 0.00 0.00 28.75 28.99 1u5b h GLU 290 CO 0.01 0.91 0.09 0.82 -1.18 0.00 0.00 179.01 179.66 1u5b h ILE 291 N -0.00 1.10 0.27 2.32 2.04 -1.20 -2.20 117.51 119.83 1u5b h ILE 291 Ca -0.01 -0.27 0.00 0.00 1.00 0.00 0.00 64.86 65.59 1u5b h ILE 291 Cb 0.92 0.98 -0.03 0.00 -0.74 0.00 0.00 36.82 37.95 1u5b h ILE 291 CO 0.07 0.09 -0.33 -1.28 0.00 0.00 0.00 178.15 176.70 1u5b h SER 292 N 0.17 -0.92 -0.33 1.72 0.87 -0.91 -0.19 113.55 113.96 1u5b h SER 292 Ca 0.06 0.09 0.07 0.00 -1.23 0.00 0.00 61.79 60.77 1u5b h SER 292 Cb 0.07 0.32 -0.07 0.00 -0.44 0.00 0.00 62.40 62.28 1u5b h SER 292 CO -0.01 -0.45 -0.12 0.28 -0.53 0.00 0.00 176.83 176.00 1u5b h SER 293 N -0.66 -0.42 0.28 6.23 0.02 -1.33 -0.22 113.55 117.46 1u5b h SER 293 Ca -0.01 0.11 -0.01 0.00 -0.84 0.00 0.00 61.79 61.04 1u5b h SER 293 Cb 0.62 0.25 0.00 0.00 0.14 0.00 0.00 62.40 63.41 1u5b h SER 293 CO -0.10 -0.15 -0.13 0.74 -1.14 0.00 0.00 176.83 176.05 1u5b h THR 294 N -0.05 0.74 -0.93 -2.27 2.02 -1.24 -1.72 112.91 109.45 1u5b h THR 294 Ca 0.17 -0.06 0.06 0.00 0.77 0.00 0.00 66.41 67.35 1u5b h THR 294 Cb 0.30 0.77 -0.06 0.00 -1.74 0.00 0.00 68.15 67.42 1u5b h THR 294 CO -0.37 0.01 0.59 0.58 0.37 0.00 0.00 175.52 176.71 1u5b h VAL 295 N -0.41 1.06 -0.89 3.16 2.07 -0.80 -0.50 116.25 119.95 1u5b h VAL 295 Ca -0.04 -0.37 0.01 0.00 0.82 0.00 0.00 66.70 67.13 1u5b h VAL 295 Cb 0.31 -0.11 -0.05 0.00 -1.52 0.00 0.00 31.29 29.93 1u5b h VAL 295 CO 0.06 0.20 0.59 -0.61 0.02 0.00 0.00 177.57 177.83 1u5b h GLN 296 N 1.07 1.15 -0.26 1.57 -0.00 -0.71 0.68 115.11 118.62 1u5b h GLN 296 Ca 0.41 -0.07 -0.14 0.00 -0.00 0.00 0.00 58.65 58.84 1u5b h GLN 296 Cb 0.18 -0.26 -0.00 0.00 0.00 0.00 0.00 27.48 27.39 1u5b h GLN 296 CO -0.18 0.76 -0.40 0.93 0.00 0.00 0.00 178.83 179.95 1u5b h GLU 297 N 1.19 0.72 0.05 1.69 5.08 -0.49 -2.50 114.58 120.32 1u5b h GLU 297 Ca 0.33 -0.43 -0.25 0.00 -1.00 0.00 0.00 59.36 58.01 1u5b h GLU 297 Cb -0.10 0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.17 1u5b h GLU 297 CO -0.08 1.06 -1.22 0.93 -1.00 0.00 0.00 179.01 178.69 1u5b h GLU 298 N 0.45 0.11 -0.05 2.33 4.39 -0.73 -3.38 114.58 117.70 1u5b h GLU 298 Ca 0.02 -0.19 0.00 0.00 0.34 0.00 0.00 59.36 59.53 1u5b h GLU 298 Cb 0.99 0.07 0.00 0.00 -0.10 0.00 0.00 28.75 29.71 1u5b h GLU 298 CO 0.09 1.02 0.00 0.00 -1.16 0.00 0.00 179.01 178.96 1u5b h PHE 300 N 0.28 0.28 0.00 0.00 3.57 -1.57 0.37 116.94 119.87 1u5b h PHE 300 Ca 0.00 0.05 0.00 0.00 3.53 0.00 0.00 57.97 61.55 1u5b h PHE 300 Cb 0.55 0.03 0.00 0.00 2.79 0.00 0.00 35.95 39.32 1u5b h PHE 300 CO 0.03 -0.30 0.00 -0.07 -2.23 0.00 0.00 178.31 175.75 1u5b h LEU 301 N 0.13 0.00 0.00 0.59 3.38 -1.88 -2.80 115.31 114.73 1u5b h LEU 301 Ca 0.59 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.56 1u5b h LEU 301 Cb 1.24 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.99 1u5b h LEU 301 CO -0.74 0.00 -0.94 0.59 0.09 0.00 0.00 178.44 177.44 1u5b n ASN 302 N -2.32 0.73 -4.63 -0.43 4.13 0.13 -4.93 115.26 107.95 1u5b n ASN 302 Ca 0.03 -0.58 -0.43 0.00 1.68 0.00 0.00 54.58 55.28 1u5b n ASN 302 Cb 0.29 0.83 -0.03 0.00 -1.54 0.00 0.00 39.78 39.33 1u5b n ASN 302 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 1u5b s LEU 303 N -3.30 3.89 0.28 3.41 1.43 -1.06 -4.32 118.68 119.01 1u5b s LEU 303 Ca 0.07 1.67 0.21 0.00 -1.03 0.00 0.00 54.13 55.05 1u5b s LEU 303 Cb 0.16 -3.53 0.12 0.00 0.03 0.00 0.00 46.19 42.96 1u5b s LEU 303 CO 0.81 -1.29 1.27 -0.33 0.23 0.00 0.00 176.35 177.04 1u5b h GLU 304 N 10.98 0.00 -3.46 1.70 4.39 -0.48 -3.48 114.58 124.23 1u5b h GLU 304 Ca -0.35 0.00 -0.05 0.00 0.34 0.00 0.00 59.36 59.30 1u5b h GLU 304 Cb 1.16 0.00 -0.12 0.00 -0.10 0.00 0.00 28.75 29.69 1u5b h GLU 304 CO 1.00 0.08 -0.10 0.00 -1.16 0.00 0.00 179.01 178.83 1u5b s ALA 305 N -3.23 -0.76 0.44 3.43 0.00 -1.25 -4.99 121.76 115.42 1u5b s ALA 305 Ca 0.02 -0.25 -0.25 0.00 0.00 0.00 0.00 51.96 51.48 1u5b s ALA 305 Cb 0.08 0.75 -0.08 0.00 0.00 0.00 0.00 23.12 23.86 1u5b s ALA 305 CO 0.74 -0.68 1.34 -2.14 0.00 0.00 0.00 175.76 175.02 1u5b s PRO 306 N -3.85 3.75 0.07 0.00 0.02 -1.26 -4.79 135.00 128.94 1u5b s PRO 306 Ca 0.07 2.22 -0.31 0.00 0.02 0.00 0.00 61.00 63.01 1u5b s PRO 306 Cb 0.01 -2.63 -0.09 0.00 0.02 0.00 0.00 34.50 31.81 1u5b s PRO 306 CO -0.08 -0.70 1.84 0.42 -0.33 0.00 0.00 177.00 178.15 1u5b s ILE 307 N -1.27 2.84 -0.08 2.83 1.01 -1.26 -4.74 121.20 120.53 1u5b s ILE 307 Ca 0.61 0.15 -0.05 0.00 0.00 0.00 0.00 60.65 61.35 1u5b s ILE 307 Cb -0.39 -3.09 -0.04 0.00 0.01 0.00 0.00 42.46 38.94 1u5b s ILE 307 CO 0.50 -0.01 0.14 -0.44 0.00 0.00 0.00 174.94 175.14 1u5b s SER 308 N 3.29 6.29 -0.18 3.58 0.01 -0.59 -5.01 113.70 121.10 1u5b s SER 308 Ca 0.82 0.40 -0.00 0.00 1.31 0.00 0.00 55.95 58.47 1u5b s SER 308 Cb -0.43 -2.00 0.00 0.00 0.21 0.00 0.00 66.02 63.81 1u5b s SER 308 CO 0.37 0.35 -0.14 -0.13 0.41 0.00 0.00 173.24 174.10 1u5b s ARG 309 N -1.36 3.18 -0.33 12.44 0.52 -1.26 -0.68 118.95 131.46 1u5b s ARG 309 Ca 0.19 -0.75 0.01 0.00 -0.52 0.00 0.00 55.73 54.66 1u5b s ARG 309 Cb -0.12 -2.69 0.08 0.00 0.52 0.00 0.00 34.95 32.75 1u5b s ARG 309 CO 0.09 -0.09 0.05 0.08 0.02 0.00 0.00 175.30 175.45 1u5b s VAL 310 N 1.09 2.67 0.39 3.52 1.01 0.64 -4.97 120.40 124.75 1u5b s VAL 310 Ca 0.00 -1.93 0.04 0.00 0.00 0.00 0.00 61.98 60.09 1u5b s VAL 310 Cb -0.14 -2.76 -0.03 0.00 0.00 0.00 0.00 36.38 33.45 1u5b s VAL 310 CO -0.05 -0.41 0.16 0.00 0.00 0.00 0.00 175.10 174.80 1u5b s GLY 312 N -3.55 2.32 0.84 0.00 0.00 -0.77 -4.52 107.32 101.64 1u5b s GLY 312 Ca 0.27 0.85 -0.11 0.00 0.00 0.00 0.00 44.72 45.73 1u5b s GLY 312 CO 0.17 1.25 1.10 -0.19 0.00 0.00 0.00 173.10 175.43 1u5b s TYR 313 N -2.02 2.30 -1.47 1.90 2.02 -1.26 -1.41 117.35 117.41 1u5b s TYR 313 Ca 0.74 1.51 -0.12 0.00 -0.37 0.00 0.00 57.07 58.82 1u5b s TYR 313 Cb -0.28 -3.13 0.03 0.00 -0.40 0.00 0.00 41.96 38.18 1u5b s TYR 313 CO 0.45 -2.20 2.35 -0.25 -1.57 0.00 0.00 175.55 174.33 1u5b n ASP 314 N -3.79 5.16 -4.03 2.29 8.00 -1.26 -4.44 116.55 118.49 1u5b n ASP 314 Ca 0.09 -2.82 -0.10 0.00 0.71 0.00 0.00 54.79 52.67 1u5b n ASP 314 Cb 0.53 -1.61 -0.08 0.00 -0.02 0.00 0.00 41.12 39.94 1u5b n ASP 314 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 1u5b s THR 315 N 2.54 0.08 1.01 -3.53 -4.23 -1.26 -5.10 115.64 105.14 1u5b s THR 315 Ca 0.51 -1.58 -0.12 0.00 -1.18 0.00 0.00 61.69 59.33 1u5b s THR 315 Cb 0.15 -1.92 0.19 0.00 1.34 0.00 0.00 72.50 72.26 1u5b s THR 315 CO -0.07 -0.35 1.08 -2.84 -0.54 0.00 0.00 174.62 171.90 1u5b s PRO 316 N -4.00 0.33 -0.34 3.99 0.02 -1.26 -4.90 135.00 128.84 1u5b s PRO 316 Ca 0.20 1.01 -0.22 0.00 0.02 0.00 0.00 61.00 62.01 1u5b s PRO 316 Cb 0.05 -1.69 0.00 0.00 0.02 0.00 0.00 34.50 32.88 1u5b s PRO 316 CO 0.01 -2.93 0.72 0.12 -0.33 0.00 0.00 177.00 174.59 1u5b s PHE 317 N -2.68 3.16 0.43 6.54 2.19 -1.26 -5.02 117.98 121.34 1u5b s PHE 317 Ca 0.66 0.55 -0.11 0.00 0.33 0.00 0.00 56.93 58.36 1u5b s PHE 317 Cb -0.22 -3.22 -0.07 0.00 -1.31 0.00 0.00 43.02 38.20 1u5b s PHE 317 CO 0.60 -0.63 0.81 -1.25 1.83 0.00 0.00 175.22 176.58 1u5b s PRO 318 N 2.88 3.80 0.00 10.12 0.04 -1.26 -1.20 135.00 149.38 1u5b s PRO 318 Ca 0.29 0.55 0.00 0.00 0.04 0.00 0.00 61.00 61.87 1u5b s PRO 318 Cb -0.14 -2.34 0.00 0.00 0.04 0.00 0.00 34.50 32.06 1u5b s PRO 318 CO 0.15 -0.09 0.24 1.58 0.04 0.00 0.00 177.00 178.92 1u5b n HIS 319 N -1.40 0.00 0.26 0.56 -0.00 -1.26 -3.77 115.22 109.61 1u5b n HIS 319 Ca 0.03 0.00 0.15 0.00 -0.00 0.00 0.00 57.72 57.90 1u5b n HIS 319 Cb 0.54 -0.00 0.54 0.00 -0.00 0.00 0.00 29.99 31.06 1u5b n HIS 319 CO 0.00 0.00 0.00 0.97 -0.00 0.00 0.00 176.34 177.31 1u5b h ILE 320 N 0.00 0.06 -0.41 3.57 6.09 -1.96 -2.60 117.51 122.25 1u5b h ILE 320 Ca 0.00 -0.70 0.00 0.00 -1.37 0.00 0.00 64.86 62.79 1u5b h ILE 320 Cb 0.00 1.66 0.00 0.00 0.47 0.00 0.00 36.82 38.95 1u5b h ILE 320 CO 0.00 0.02 0.00 0.49 -3.07 0.00 0.00 178.15 175.59 1u5b n PHE 321 N -3.12 0.55 -0.29 2.19 3.72 -1.26 -4.55 117.46 114.69 1u5b n PHE 321 Ca 0.01 -0.27 0.09 0.00 -0.05 0.00 0.00 57.45 57.23 1u5b n PHE 321 Cb 0.37 0.00 0.22 0.00 -0.94 0.00 0.00 39.48 39.13 1u5b n PHE 321 CO 0.00 0.00 0.00 1.49 -0.05 0.00 0.00 176.76 178.20 1u5b h GLU 322 N 2.92 0.10 -0.13 -1.08 4.81 -1.55 -0.28 114.58 119.37 1u5b h GLU 322 Ca 0.00 -0.01 0.04 0.00 -0.13 0.00 0.00 59.36 59.26 1u5b h GLU 322 Cb 0.66 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 30.01 1u5b h GLU 322 CO 0.00 0.07 0.15 -1.35 -0.73 0.00 0.00 179.01 177.15 1u5b h PRO 323 N 0.10 0.00 0.00 0.92 0.11 -1.88 -0.67 132.00 130.58 1u5b h PRO 323 Ca 0.49 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.60 1u5b h PRO 323 Cb 0.94 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.05 1u5b h PRO 323 CO -0.73 0.00 -1.00 1.19 -0.21 0.00 0.00 178.00 177.25 1u5b n PHE 324 N -3.80 0.73 0.03 0.65 3.72 -0.16 -4.47 117.46 114.17 1u5b n PHE 324 Ca 0.00 0.21 -0.21 0.00 -0.05 0.00 0.00 57.45 57.41 1u5b n PHE 324 Cb 0.26 -0.80 -0.14 0.00 -0.94 0.00 0.00 39.48 37.86 1u5b n PHE 324 CO 0.00 0.00 0.00 -0.92 -0.05 0.00 0.00 176.76 175.79 1u5b h TYR 325 N 0.00 0.50 -3.99 1.38 3.20 -0.68 -3.48 116.97 113.91 1u5b h TYR 325 Ca 0.00 -0.37 -0.49 0.00 3.14 0.00 0.00 58.73 61.02 1u5b h TYR 325 Cb 0.91 -0.02 0.03 0.00 1.54 0.00 0.00 36.73 39.19 1u5b h TYR 325 CO 0.00 1.44 0.43 0.96 -1.64 0.00 0.00 178.16 179.34 1u5b s ILE 326 N -2.46 3.56 -1.09 1.81 -4.36 -1.15 -4.15 121.20 113.37 1u5b s ILE 326 Ca -0.17 1.16 -0.18 0.00 -0.26 0.00 0.00 60.65 61.20 1u5b s ILE 326 Cb 0.03 -3.58 -0.07 0.00 1.25 0.00 0.00 42.46 40.09 1u5b s ILE 326 CO 0.80 -0.03 2.07 -0.81 0.24 0.00 0.00 174.94 177.20 1u5b n PRO 327 N -0.31 2.13 -1.43 0.37 -0.04 -1.26 -4.96 135.00 129.51 1u5b n PRO 327 Ca 0.06 -2.20 -0.29 0.00 -0.04 0.00 0.00 63.50 61.03 1u5b n PRO 327 Cb 0.50 -3.10 0.22 0.00 -0.04 0.00 0.00 33.50 31.08 1u5b n PRO 327 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 1u5b n ASP 328 N 6.88 -0.95 0.26 3.54 5.68 -1.26 -4.64 116.55 126.07 1u5b n ASP 328 Ca 0.51 -1.31 0.09 0.00 -0.50 0.00 0.00 54.79 53.58 1u5b n ASP 328 Cb 0.40 -0.97 0.67 0.00 -1.14 0.00 0.00 41.12 40.07 1u5b n ASP 328 CO 0.00 0.00 0.00 0.07 -1.33 0.00 0.00 177.20 175.94 1u5b h LYS 329 N 0.00 0.00 -0.07 0.11 2.10 -1.93 -0.59 116.57 116.19 1u5b h LYS 329 Ca -0.41 0.00 -0.22 0.00 -2.00 0.00 0.00 60.65 58.03 1u5b h LYS 329 Cb 1.17 0.00 0.01 0.00 -0.90 0.00 0.00 32.23 32.51 1u5b h LYS 329 CO 0.28 0.03 -0.84 -1.49 -2.00 0.00 0.00 179.45 175.43 1u5b h TRP 330 N 0.00 0.82 -0.38 0.07 4.06 -1.98 0.17 115.95 118.71 1u5b h TRP 330 Ca -0.00 -0.39 -0.08 0.00 2.06 0.00 0.00 58.89 60.48 1u5b h TRP 330 Cb 0.06 -0.11 -0.01 0.00 -1.00 0.00 0.00 29.16 28.10 1u5b h TRP 330 CO 0.00 1.20 -0.06 0.87 -3.56 0.00 0.00 178.44 176.89 1u5b h LYS 331 N 0.38 0.71 -0.27 0.49 1.57 -1.73 -0.46 116.57 117.27 1u5b h LYS 331 Ca -0.06 -0.26 -0.17 0.00 -1.87 0.00 0.00 60.65 58.29 1u5b h LYS 331 Cb 1.46 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 33.72 1u5b h LYS 331 CO 0.16 0.84 -0.50 0.00 -0.57 0.00 0.00 179.45 179.38 1u5b h TYR 333 N 0.56 0.35 -0.82 0.00 3.20 -0.52 -1.37 116.97 118.37 1u5b h TYR 333 Ca 0.01 0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.89 1u5b h TYR 333 Cb 1.10 -0.11 -0.04 0.00 1.54 0.00 0.00 36.73 39.22 1u5b h TYR 333 CO 0.08 0.21 0.52 0.22 -1.64 0.00 0.00 178.16 177.55 1u5b h ASP 334 N 0.39 0.96 -0.50 -2.11 3.58 -1.01 0.14 116.42 117.88 1u5b h ASP 334 Ca 0.12 -0.05 -0.03 0.00 0.42 0.00 0.00 57.03 57.50 1u5b h ASP 334 Cb -0.01 -0.24 -0.02 0.00 1.72 0.00 0.00 39.33 40.77 1u5b h ASP 334 CO -0.05 0.72 0.21 0.00 -2.88 0.00 0.00 179.24 177.25 1u5b h ALA 335 N 1.28 0.65 -0.72 -0.78 0.00 -1.29 -1.06 119.26 117.34 1u5b h ALA 335 Ca 0.30 -0.14 -0.04 0.00 0.00 0.00 0.00 54.91 55.02 1u5b h ALA 335 Cb -0.08 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.48 1u5b h ALA 335 CO -0.06 0.24 0.29 1.25 0.00 0.00 0.00 179.25 180.97 1u5b h LEU 336 N 0.67 0.99 -0.14 0.00 5.85 -0.45 -0.91 115.31 121.33 1u5b h LEU 336 Ca 0.17 -0.17 0.01 0.00 0.84 0.00 0.00 57.88 58.72 1u5b h LEU 336 Cb 0.17 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 40.93 1u5b h LEU 336 CO -0.02 0.89 0.08 -0.09 -0.34 0.00 0.00 178.44 178.96 1u5b h ARG 337 N 1.03 0.16 -0.96 1.25 2.43 -0.23 -1.06 114.38 117.00 1u5b h ARG 337 Ca 0.24 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.40 1u5b h ARG 337 Cb 0.21 -0.04 -0.05 0.00 -0.42 0.00 0.00 29.97 29.68 1u5b h ARG 337 CO -0.02 0.10 0.62 0.87 -1.51 0.00 0.00 179.97 180.03 1u5b h LYS 338 N 0.16 1.28 -0.57 0.20 1.57 -0.86 -2.50 116.57 115.86 1u5b h LYS 338 Ca 0.05 -0.09 -0.09 0.00 -1.87 0.00 0.00 60.65 58.65 1u5b h LYS 338 Cb -0.00 -0.28 -0.02 0.00 0.08 0.00 0.00 32.23 32.01 1u5b h LYS 338 CO -0.03 0.87 -0.01 1.98 -0.57 0.00 0.00 179.45 181.69 1u5b h MET 339 N 1.31 1.00 0.00 3.15 4.05 -0.71 -2.33 114.93 121.40 1u5b h MET 339 Ca 0.35 -0.32 -0.05 0.00 -0.28 0.00 0.00 59.70 59.40 1u5b h MET 339 Cb -0.12 -0.09 -0.01 0.00 -0.80 0.00 0.00 31.60 30.59 1u5b h MET 339 CO -0.07 1.00 -0.23 -0.84 0.23 0.00 0.00 176.91 177.00 1u5b h ILE 340 N 0.89 0.68 -0.26 1.77 -0.00 -1.08 -2.86 117.51 116.66 1u5b h ILE 340 Ca 0.16 -1.02 0.00 0.00 -0.00 0.00 0.00 64.86 64.00 1u5b h ILE 340 Cb 0.55 1.65 0.00 0.00 -0.00 0.00 0.00 36.82 39.03 1u5b h ILE 340 CO 0.03 0.23 0.00 0.59 -0.00 0.00 0.00 178.15 179.00 1u5b n ASN 341 N -3.56 2.01 0.00 2.16 3.02 -0.95 -5.11 115.26 112.82 1u5b n ASN 341 Ca -0.01 -1.82 0.04 0.00 -0.03 0.00 0.00 54.58 52.76 1u5b n ASN 341 Cb 0.38 -0.17 0.23 0.00 -0.61 0.00 0.00 39.78 39.61 1u5b n ASN 341 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64