#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h0e n ASN 35 N 0.00 0.62 -4.12 1.67 3.02 -1.26 -4.93 115.26 110.26 3h0e n ASN 35 Ca 0.00 -0.22 -0.22 0.00 -0.03 0.00 0.00 54.58 54.11 3h0e n ASN 35 Cb 0.00 0.77 -0.15 0.00 -0.61 0.00 0.00 39.78 39.79 3h0e n ASN 35 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 3h0e s SER 36 N -3.88 1.67 0.35 6.41 0.01 -1.26 -1.12 113.70 115.88 3h0e s SER 36 Ca 0.04 -0.32 -0.28 0.00 1.31 0.00 0.00 55.95 56.70 3h0e s SER 36 Cb 0.14 -0.16 -0.11 0.00 0.21 0.00 0.00 66.02 66.10 3h0e s SER 36 CO 0.80 0.13 1.47 -1.22 0.41 0.00 0.00 173.24 174.82 3h0e n TYR 37 N 2.46 2.81 -2.08 2.43 4.01 -0.13 -4.87 117.16 121.79 3h0e n TYR 37 Ca -0.15 0.43 -0.42 0.00 -0.16 0.00 0.00 57.90 57.60 3h0e n TYR 37 Cb 0.55 -2.52 -0.03 0.00 -0.31 0.00 0.00 39.34 37.04 3h0e n TYR 37 CO 0.00 0.00 0.00 0.21 -0.46 0.00 0.00 176.86 176.61 3h0e s LYS 38 N -1.74 3.32 -0.16 -0.72 2.20 -1.26 -4.84 119.74 116.54 3h0e s LYS 38 Ca 0.56 1.24 0.17 0.00 -0.36 0.00 0.00 55.97 57.58 3h0e s LYS 38 Cb -0.50 -4.18 0.44 0.00 -1.51 0.00 0.00 37.83 32.08 3h0e s LYS 38 CO 0.61 -1.88 1.33 -1.33 -0.36 0.00 0.00 175.35 173.71 3h0e n MET 39 N 8.43 2.43 -0.85 4.03 2.81 -1.26 -4.59 117.12 128.11 3h0e n MET 39 Ca 0.21 -2.72 -0.06 0.00 -1.81 0.00 0.00 57.70 53.32 3h0e n MET 39 Cb 0.48 -1.71 0.23 0.00 -0.71 0.00 0.00 33.22 31.50 3h0e n MET 39 CO 0.00 0.00 0.00 -0.40 1.51 0.00 0.00 175.97 177.08 3h0e n ASP 40 N -0.76 3.43 -4.66 7.83 3.85 -1.26 -4.91 116.55 120.07 3h0e n ASP 40 Ca 0.19 -3.50 -0.30 0.00 -0.71 0.00 0.00 54.79 50.47 3h0e n ASP 40 Cb 0.79 -0.68 0.17 0.00 -1.35 0.00 0.00 41.12 40.06 3h0e n ASP 40 CO 0.00 0.00 0.00 -0.31 -1.01 0.00 0.00 177.20 175.88 3h0e s TYR 41 N -3.13 1.82 0.38 2.11 1.51 -1.26 -4.91 117.35 113.87 3h0e s TYR 41 Ca 0.48 1.54 0.13 0.00 -1.01 0.00 0.00 57.07 58.22 3h0e s TYR 41 Cb 0.41 -3.22 0.95 0.00 -0.11 0.00 0.00 41.96 40.00 3h0e s TYR 41 CO 0.06 -2.81 1.83 -1.35 -1.11 0.00 0.00 175.55 172.17 3h0e h PRO 42 N -1.87 0.53 -5.93 -1.71 0.11 -1.93 -3.41 132.00 117.80 3h0e h PRO 42 Ca -0.48 -0.03 -0.56 0.00 0.11 0.00 0.00 66.00 65.04 3h0e h PRO 42 Cb 1.28 -0.12 -0.26 0.00 0.11 0.00 0.00 31.00 32.00 3h0e h PRO 42 CO 0.47 0.35 -0.84 -1.21 -0.21 0.00 0.00 178.00 176.57 3h0e s GLU 43 N -5.58 1.36 0.24 1.05 2.02 -0.39 -5.02 118.70 112.38 3h0e s GLU 43 Ca -0.09 -0.86 -0.04 0.00 0.02 0.00 0.00 54.97 54.00 3h0e s GLU 43 Cb 0.23 -1.43 0.27 0.00 0.10 0.00 0.00 34.13 33.31 3h0e s GLU 43 CO 0.79 0.37 1.74 0.52 0.02 0.00 0.00 175.26 178.70 3h0e h MET 44 N 5.06 0.88 0.00 1.61 2.86 -1.80 0.94 114.93 124.48 3h0e h MET 44 Ca -0.41 -0.23 0.00 0.00 -2.06 0.00 0.00 59.70 57.00 3h0e h MET 44 Cb 1.16 -0.10 0.00 0.00 0.06 0.00 0.00 31.60 32.71 3h0e h MET 44 CO 0.45 0.86 0.00 0.41 1.06 0.00 0.00 176.91 179.68 3h0e n GLY 45 N -0.63 0.87 3.81 8.32 0.00 -1.26 -1.08 105.19 115.22 3h0e n GLY 45 Ca 0.03 -2.14 -0.34 0.00 0.00 0.00 0.00 46.02 43.56 3h0e n GLY 45 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3h0e s LEU 46 N 0.00 4.12 -0.35 0.99 1.02 -1.26 -0.96 118.68 122.25 3h0e s LEU 46 Ca 0.00 1.61 0.01 0.00 0.02 0.00 0.00 54.13 55.77 3h0e s LEU 46 Cb 0.00 -4.18 0.11 0.00 0.02 0.00 0.00 46.19 42.14 3h0e s LEU 46 CO 0.00 -0.20 0.12 0.00 0.02 0.00 0.00 176.35 176.29 3h0e s ILE 48 N 1.16 5.02 -0.28 0.00 -1.09 -0.09 -1.15 121.20 124.78 3h0e s ILE 48 Ca 0.12 1.41 0.01 0.00 -2.23 0.00 0.00 60.65 59.96 3h0e s ILE 48 Cb -0.19 -4.03 0.06 0.00 -1.58 0.00 0.00 42.46 36.71 3h0e s ILE 48 CO -0.16 0.19 -0.06 -0.63 -1.23 0.00 0.00 174.94 173.05 3h0e s ILE 49 N 1.23 2.52 -0.37 2.92 1.01 0.07 0.40 121.20 128.98 3h0e s ILE 49 Ca 0.36 -1.54 -0.16 0.00 0.00 0.00 0.00 60.65 59.30 3h0e s ILE 49 Cb -0.17 -2.47 0.00 0.00 0.01 0.00 0.00 42.46 39.83 3h0e s ILE 49 CO 0.15 -0.07 0.41 -0.63 0.00 0.00 0.00 174.94 174.81 3h0e s ILE 50 N 1.16 5.11 -0.53 2.92 1.01 0.23 -0.83 121.20 130.28 3h0e s ILE 50 Ca -0.07 -0.07 -0.03 0.00 0.00 0.00 0.00 60.65 60.49 3h0e s ILE 50 Cb -0.20 -3.93 0.14 0.00 0.01 0.00 0.00 42.46 38.48 3h0e s ILE 50 CO -0.03 -0.24 0.34 0.21 0.00 0.00 0.00 174.94 175.21 3h0e s ASN 51 N 1.77 5.22 -0.43 3.58 2.47 0.60 -0.99 114.94 127.16 3h0e s ASN 51 Ca 0.13 -2.52 -0.18 0.00 0.42 0.00 0.00 52.86 50.71 3h0e s ASN 51 Cb -0.17 -1.84 0.02 0.00 -1.45 0.00 0.00 41.25 37.82 3h0e s ASN 51 CO 0.13 -0.44 0.50 0.20 -3.72 0.00 0.00 177.10 173.77 3h0e s ASN 52 N 1.13 6.24 -0.15 -4.21 0.01 -0.25 -1.53 114.94 116.19 3h0e s ASN 52 Ca 0.13 -0.58 -0.02 0.00 -0.71 0.00 0.00 52.86 51.68 3h0e s ASN 52 Cb -0.21 -2.25 -0.08 0.00 0.41 0.00 0.00 41.25 39.11 3h0e s ASN 52 CO -0.04 -0.65 -0.15 1.17 -1.51 0.00 0.00 177.10 175.92 3h0e n LYS 53 N 5.82 0.34 -4.49 -0.60 4.81 -1.26 -4.49 118.16 118.29 3h0e n LYS 53 Ca -0.05 0.10 -0.34 0.00 -0.87 0.00 0.00 58.31 57.15 3h0e n LYS 53 Cb 0.47 -1.19 -0.12 0.00 0.02 0.00 0.00 35.03 34.21 3h0e n LYS 53 CO 0.00 0.00 0.00 -0.80 1.17 0.00 0.00 177.40 177.77 3h0e s ASN 54 N -5.76 4.65 0.10 3.14 0.01 -1.26 -1.48 114.94 114.34 3h0e s ASN 54 Ca -0.20 -0.16 0.08 0.00 -0.71 0.00 0.00 52.86 51.88 3h0e s ASN 54 Cb 0.06 -1.71 -0.04 0.00 0.41 0.00 0.00 41.25 39.97 3h0e s ASN 54 CO 0.30 0.18 -0.16 -0.36 -1.51 0.00 0.00 177.10 175.55 3h0e s PHE 55 N 0.28 2.59 0.09 2.20 0.40 -1.26 -4.81 117.98 117.47 3h0e s PHE 55 Ca -0.04 -0.24 -0.36 0.00 -0.60 0.00 0.00 56.93 55.69 3h0e s PHE 55 Cb -0.14 -1.39 -0.17 0.00 0.51 0.00 0.00 43.02 41.83 3h0e s PHE 55 CO 0.03 0.37 1.28 0.72 0.70 0.00 0.00 175.22 178.33 3h0e n HIS 56 N 0.91 1.39 -0.24 0.36 8.25 -0.00 -4.81 115.22 121.07 3h0e n HIS 56 Ca -0.15 0.68 0.17 0.00 -0.26 0.00 0.00 57.72 58.16 3h0e n HIS 56 Cb 0.52 -2.30 0.47 0.00 1.12 0.00 0.00 29.99 29.81 3h0e n HIS 56 CO 0.00 0.00 0.00 -0.22 0.64 0.00 0.00 176.34 176.76 3h0e h LYS 57 N 4.20 0.48 0.00 -0.41 3.64 -1.93 -0.28 116.57 122.26 3h0e h LYS 57 Ca -0.47 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 58.88 3h0e h LYS 57 Cb 1.35 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 33.06 3h0e h LYS 57 CO 0.75 0.32 0.00 0.66 -2.27 0.00 0.00 179.45 178.91 3h0e h SER 58 N 0.49 0.00 0.70 4.20 4.64 -1.95 -1.91 113.55 119.72 3h0e h SER 58 Ca 0.46 0.00 -0.23 0.00 -0.47 0.00 0.00 61.79 61.55 3h0e h SER 58 Cb 1.00 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 63.06 3h0e h SER 58 CO -0.19 0.00 -1.43 0.71 -0.87 0.00 0.00 176.83 175.05 3h0e h THR 59 N 0.00 0.87 -0.01 2.95 1.35 -1.38 -3.48 112.91 113.22 3h0e h THR 59 Ca 0.00 -2.57 -0.00 0.00 -0.55 0.00 0.00 66.41 63.29 3h0e h THR 59 Cb 0.16 2.37 -0.00 0.00 -1.73 0.00 0.00 68.15 68.94 3h0e h THR 59 CO 0.00 0.50 -0.00 0.61 -0.25 0.00 0.00 175.52 176.37 3h0e n GLY 60 N 1.45 0.45 3.77 5.82 0.00 -0.72 -5.02 105.19 110.95 3h0e n GLY 60 Ca -0.11 -0.07 -0.38 0.00 0.00 0.00 0.00 46.02 45.46 3h0e n GLY 60 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3h0e s MET 61 N -0.38 4.53 0.57 1.61 -1.94 -1.26 -5.04 119.30 117.39 3h0e s MET 61 Ca 0.00 1.50 -0.14 0.00 -1.71 0.00 0.00 55.69 55.34 3h0e s MET 61 Cb 0.00 -2.89 -0.06 0.00 2.01 0.00 0.00 34.83 33.89 3h0e s MET 61 CO 0.00 0.20 1.01 0.95 -0.01 0.00 0.00 175.02 177.17 3h0e s THR 62 N -1.46 4.45 0.41 2.05 -4.23 -1.26 -4.63 115.64 110.97 3h0e s THR 62 Ca 0.49 1.04 -0.25 0.00 -1.18 0.00 0.00 61.69 61.79 3h0e s THR 62 Cb -0.23 -3.70 -0.08 0.00 1.34 0.00 0.00 72.50 69.83 3h0e s THR 62 CO 0.30 -0.81 1.23 -0.55 -0.54 0.00 0.00 174.62 174.26 3h0e s SER 63 N -3.39 6.35 -1.12 3.99 0.15 -1.26 -4.75 113.70 113.66 3h0e s SER 63 Ca 0.58 2.49 -0.08 0.00 0.70 0.00 0.00 55.95 59.64 3h0e s SER 63 Cb -0.11 -2.62 0.28 0.00 -1.71 0.00 0.00 66.02 61.85 3h0e s SER 63 CO 0.40 -0.81 1.20 0.54 1.20 0.00 0.00 173.24 175.78 3h0e n ARG 64 N 0.01 3.70 -1.72 5.44 1.74 -0.55 -5.03 116.66 120.24 3h0e n ARG 64 Ca 0.04 -4.43 -0.43 0.00 -0.77 0.00 0.00 57.85 52.26 3h0e n ARG 64 Cb 0.45 -2.57 -0.02 0.00 -1.02 0.00 0.00 32.46 29.30 3h0e n ARG 64 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 3h0e n SER 65 N 2.61 3.58 0.00 0.55 7.64 -1.26 -2.46 113.62 124.28 3h0e n SER 65 Ca 0.25 1.13 0.00 0.00 1.01 0.00 0.00 58.87 61.27 3h0e n SER 65 Cb 0.38 -1.54 0.00 0.00 -1.01 0.00 0.00 64.21 62.04 3h0e n SER 65 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3h0e n GLY 66 N 2.41 0.80 0.24 0.23 0.00 -1.25 -4.15 105.19 103.47 3h0e n GLY 66 Ca 0.10 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.21 3h0e n GLY 66 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h0e h THR 67 N 0.00 0.82 -0.35 2.61 1.03 -1.80 -1.95 112.91 113.27 3h0e h THR 67 Ca 0.00 -0.73 -0.10 0.00 -0.01 0.00 0.00 66.41 65.57 3h0e h THR 67 Cb 0.00 1.43 -0.01 0.00 -1.07 0.00 0.00 68.15 68.50 3h0e h THR 67 CO 0.00 0.18 -0.21 0.44 -0.01 0.00 0.00 175.52 175.92 3h0e h ASP 68 N 0.00 0.67 -0.63 0.00 3.32 -1.91 -0.15 116.42 117.72 3h0e h ASP 68 Ca -0.00 -0.23 0.01 0.00 0.02 0.00 0.00 57.03 56.83 3h0e h ASP 68 Cb 0.42 -0.18 -0.03 0.00 0.22 0.00 0.00 39.33 39.75 3h0e h ASP 68 CO 0.02 0.88 0.42 0.58 -1.72 0.00 0.00 179.24 179.42 3h0e h VAL 69 N 0.59 1.16 0.24 -1.35 2.07 -1.73 -0.69 116.25 116.54 3h0e h VAL 69 Ca 0.09 -0.29 0.00 0.00 0.82 0.00 0.00 66.70 67.31 3h0e h VAL 69 Cb 0.68 0.23 -0.02 0.00 -1.52 0.00 0.00 31.29 30.67 3h0e h VAL 69 CO 0.05 0.16 -0.22 0.44 0.02 0.00 0.00 177.57 178.02 3h0e h ASP 70 N 0.86 -0.57 -0.53 0.57 3.32 -1.17 -0.54 116.42 118.35 3h0e h ASP 70 Ca 0.23 0.05 0.05 0.00 0.02 0.00 0.00 57.03 57.38 3h0e h ASP 70 Cb -0.10 0.19 -0.05 0.00 0.22 0.00 0.00 39.33 39.59 3h0e h ASP 70 CO -0.05 -0.32 0.25 0.00 -1.72 0.00 0.00 179.24 177.40 3h0e h ALA 71 N 0.22 0.67 -0.34 3.45 0.00 -0.80 0.13 119.26 122.59 3h0e h ALA 71 Ca -0.01 0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 3h0e h ALA 71 Cb 0.44 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 3h0e h ALA 71 CO -0.03 -0.11 0.15 0.00 0.00 0.00 0.00 179.25 179.26 3h0e h ALA 72 N 1.30 0.45 -0.45 0.00 0.00 -1.06 -0.97 119.26 118.53 3h0e h ALA 72 Ca 0.24 -0.12 0.02 0.00 0.00 0.00 0.00 54.91 55.06 3h0e h ALA 72 Cb 0.18 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 3h0e h ALA 72 CO -0.18 0.03 0.25 -0.97 0.00 0.00 0.00 179.25 178.38 3h0e h ASN 73 N 0.41 0.40 -0.51 0.00 -0.73 -0.37 -1.89 115.58 112.90 3h0e h ASN 73 Ca 0.12 0.01 -0.04 0.00 1.87 0.00 0.00 56.30 58.26 3h0e h ASN 73 Cb 0.16 -0.07 -0.02 0.00 0.27 0.00 0.00 38.32 38.65 3h0e h ASN 73 CO -0.01 0.28 0.16 -0.07 -0.37 0.00 0.00 177.43 177.43 3h0e h LEU 74 N 0.51 0.73 -0.29 0.34 3.38 -0.64 -1.35 115.31 117.99 3h0e h LEU 74 Ca 0.18 -0.20 0.05 0.00 0.09 0.00 0.00 57.88 58.00 3h0e h LEU 74 Cb 0.04 -0.19 -0.05 0.00 0.09 0.00 0.00 40.66 40.55 3h0e h LEU 74 CO -0.10 0.74 0.01 -0.09 0.09 0.00 0.00 178.44 179.09 3h0e h ARG 75 N 0.69 0.09 -0.37 1.13 2.43 -0.86 -1.07 114.38 116.42 3h0e h ARG 75 Ca 0.16 -0.01 -0.07 0.00 -0.81 0.00 0.00 59.98 59.26 3h0e h ARG 75 Cb 0.26 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.78 3h0e h ARG 75 CO -0.01 0.06 -0.03 1.49 -1.51 0.00 0.00 179.97 179.98 3h0e h GLU 76 N 0.09 0.68 -0.39 0.20 4.57 -1.23 -0.66 114.58 117.84 3h0e h GLU 76 Ca 0.14 -0.23 -0.00 0.00 -1.18 0.00 0.00 59.36 58.09 3h0e h GLU 76 Cb 0.18 -0.05 -0.02 0.00 -0.16 0.00 0.00 28.75 28.70 3h0e h GLU 76 CO -0.23 0.80 0.24 1.15 -1.18 0.00 0.00 179.01 179.79 3h0e h THR 77 N 0.49 1.12 0.00 0.32 2.02 -0.99 -1.77 112.91 114.10 3h0e h THR 77 Ca 0.10 -0.26 -0.12 0.00 0.77 0.00 0.00 66.41 66.90 3h0e h THR 77 Cb 0.51 0.59 -0.02 0.00 -1.74 0.00 0.00 68.15 67.50 3h0e h THR 77 CO 0.02 0.12 -0.60 -0.26 0.37 0.00 0.00 175.52 175.17 3h0e h PHE 78 N 0.51 0.00 -0.88 3.16 -1.00 -1.22 -2.78 116.94 114.73 3h0e h PHE 78 Ca 0.14 0.00 -0.01 0.00 2.81 0.00 0.00 57.97 60.91 3h0e h PHE 78 Cb -0.02 0.00 -0.04 0.00 3.61 0.00 0.00 35.95 39.50 3h0e h PHE 78 CO -0.04 0.56 0.49 -0.09 -1.61 0.00 0.00 178.31 177.62 3h0e h ARG 79 N 0.00 1.21 0.00 1.51 2.43 -0.93 -1.07 114.38 117.54 3h0e h ARG 79 Ca -0.01 -0.13 -0.09 0.00 -0.81 0.00 0.00 59.98 58.93 3h0e h ARG 79 Cb 1.43 -0.24 -0.01 0.00 -0.42 0.00 0.00 29.97 30.73 3h0e h ARG 79 CO 0.07 0.88 -0.44 -0.97 -1.51 0.00 0.00 179.97 178.00 3h0e h ASN 80 N 1.22 0.00 0.06 -3.80 -1.24 -1.19 -1.77 115.58 108.86 3h0e h ASN 80 Ca 0.31 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.32 3h0e h ASN 80 Cb 0.01 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.06 3h0e h ASN 80 CO -0.05 0.44 -0.01 0.18 -1.29 0.00 0.00 177.43 176.70 3h0e n LEU 81 N -3.89 0.25 -0.30 0.34 4.77 -0.91 -4.90 117.00 112.36 3h0e n LEU 81 Ca -0.01 -0.05 -0.03 0.00 -0.03 0.00 0.00 56.01 55.89 3h0e n LEU 81 Cb 0.48 -0.03 -0.00 0.00 -2.33 0.00 0.00 43.42 41.54 3h0e n LEU 81 CO 0.39 0.04 -0.03 0.29 -1.33 0.00 0.00 177.39 176.75 3h0e n LYS 82 N -0.84 -0.21 -2.98 3.23 5.02 -0.67 -4.95 118.16 116.76 3h0e n LYS 82 Ca 0.22 0.14 -0.31 0.00 -2.02 0.00 0.00 58.31 56.35 3h0e n LYS 82 Cb 0.17 -3.79 -0.04 0.00 -0.02 0.00 0.00 35.03 31.35 3h0e n LYS 82 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 3h0e s TYR 83 N -2.13 3.45 -0.80 2.13 1.51 -0.46 -4.17 117.35 116.88 3h0e s TYR 83 Ca 0.00 1.04 -0.22 0.00 -1.01 0.00 0.00 57.07 56.87 3h0e s TYR 83 Cb 0.00 -2.42 0.07 0.00 -0.11 0.00 0.00 41.96 39.50 3h0e s TYR 83 CO 0.00 -0.03 1.14 -2.00 -1.11 0.00 0.00 175.55 173.55 3h0e s GLU 84 N -3.60 3.32 -0.03 -0.62 2.12 -0.13 -4.50 118.70 115.26 3h0e s GLU 84 Ca 0.51 -1.00 -0.27 0.00 0.36 0.00 0.00 54.97 54.56 3h0e s GLU 84 Cb -0.10 -4.57 -0.03 0.00 0.26 0.00 0.00 34.13 29.68 3h0e s GLU 84 CO 0.28 -1.93 0.86 0.08 -0.54 0.00 0.00 175.26 174.01 3h0e s VAL 85 N 4.17 4.94 -0.18 3.70 1.01 -1.26 -1.36 120.40 131.42 3h0e s VAL 85 Ca 0.31 1.80 0.01 0.00 0.00 0.00 0.00 61.98 64.10 3h0e s VAL 85 Cb -0.10 -4.20 0.04 0.00 0.00 0.00 0.00 36.38 32.12 3h0e s VAL 85 CO 0.03 0.19 -0.12 -0.13 0.00 0.00 0.00 175.10 175.06 3h0e s ARG 86 N 0.99 2.20 -0.10 2.72 0.52 -0.30 -4.95 118.95 120.04 3h0e s ARG 86 Ca 0.46 -0.78 -0.14 0.00 -0.52 0.00 0.00 55.73 54.76 3h0e s ARG 86 Cb -0.19 -2.35 -0.05 0.00 0.52 0.00 0.00 34.95 32.87 3h0e s ARG 86 CO 0.23 -0.36 0.33 -0.80 0.02 0.00 0.00 175.30 174.72 3h0e s ASN 87 N 1.40 6.57 0.02 0.23 -0.87 -1.26 -0.75 114.94 120.28 3h0e s ASN 87 Ca 0.01 0.68 0.05 0.00 -1.57 0.00 0.00 52.86 52.03 3h0e s ASN 87 Cb -0.15 -2.20 -0.02 0.00 -0.02 0.00 0.00 41.25 38.86 3h0e s ASN 87 CO -0.09 0.21 -0.14 -0.54 -2.57 0.00 0.00 177.10 173.97 3h0e s LYS 88 N -0.23 1.00 -0.02 -0.60 -0.14 -0.01 -4.96 119.74 114.78 3h0e s LYS 88 Ca 0.20 -0.66 0.06 0.00 -1.36 0.00 0.00 55.97 54.21 3h0e s LYS 88 Cb -0.14 -1.00 -0.01 0.00 -1.68 0.00 0.00 37.83 35.00 3h0e s LYS 88 CO 0.08 0.26 -0.20 -0.80 -0.76 0.00 0.00 175.35 173.92 3h0e s ASN 89 N -0.82 2.35 -0.95 2.83 0.01 -1.26 -0.29 114.94 116.81 3h0e s ASN 89 Ca 0.03 -0.37 -0.10 0.00 -0.71 0.00 0.00 52.86 51.72 3h0e s ASN 89 Cb -0.07 -0.31 -0.00 0.00 0.41 0.00 0.00 41.25 41.28 3h0e s ASN 89 CO 0.01 0.24 0.71 0.47 -1.51 0.00 0.00 177.10 177.01 3h0e n ASP 90 N 2.65 -5.75 -4.89 -1.22 8.00 -0.58 -4.95 116.55 109.81 3h0e n ASP 90 Ca -0.15 -0.78 -0.35 0.00 0.71 0.00 0.00 54.79 54.21 3h0e n ASP 90 Cb 0.53 -3.25 -0.06 0.00 -0.02 0.00 0.00 41.12 38.33 3h0e n ASP 90 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3h0e s LEU 91 N -5.44 4.38 0.96 0.64 1.43 -1.26 -4.89 118.68 114.50 3h0e s LEU 91 Ca 0.21 0.42 -0.12 0.00 -1.03 0.00 0.00 54.13 53.61 3h0e s LEU 91 Cb -0.08 -2.29 0.17 0.00 0.03 0.00 0.00 46.19 44.02 3h0e s LEU 91 CO 0.85 0.35 1.11 0.42 0.23 0.00 0.00 176.35 179.31 3h0e s THR 92 N -1.15 2.11 0.20 5.49 -4.23 -1.26 -0.64 115.64 116.16 3h0e s THR 92 Ca 0.20 0.04 -0.11 0.00 -1.18 0.00 0.00 61.69 60.64 3h0e s THR 92 Cb -0.12 -2.62 0.12 0.00 1.34 0.00 0.00 72.50 71.22 3h0e s THR 92 CO 0.10 -0.05 1.83 0.08 -0.54 0.00 0.00 174.62 176.04 3h0e h ARG 93 N -1.72 0.74 -0.01 3.99 0.11 -1.85 -0.73 114.38 114.91 3h0e h ARG 93 Ca -0.53 -0.04 -0.10 0.00 0.10 0.00 0.00 59.98 59.41 3h0e h ARG 93 Cb 1.33 -0.17 -0.01 0.00 1.11 0.00 0.00 29.97 32.23 3h0e h ARG 93 CO 0.59 0.49 -0.48 1.05 0.10 0.00 0.00 179.97 181.72 3h0e h GLU 94 N 0.76 0.02 -0.24 0.08 9.09 -1.95 -2.27 114.58 120.08 3h0e h GLU 94 Ca 0.26 -0.01 -0.13 0.00 0.05 0.00 0.00 59.36 59.53 3h0e h GLU 94 Cb 0.04 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 27.13 3h0e h GLU 94 CO -0.11 0.49 -0.39 0.93 0.05 0.00 0.00 179.01 179.98 3h0e h GLU 95 N 0.02 0.55 -0.13 1.06 5.08 -1.78 -1.78 114.58 117.60 3h0e h GLU 95 Ca -0.00 -0.27 -0.01 0.00 -1.00 0.00 0.00 59.36 58.07 3h0e h GLU 95 Cb 0.85 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.10 3h0e h GLU 95 CO 0.06 0.85 0.03 0.82 -1.00 0.00 0.00 179.01 179.78 3h0e h ILE 96 N 0.46 1.19 -0.55 3.13 2.04 -0.83 -0.98 117.51 121.98 3h0e h ILE 96 Ca 0.04 -0.61 -0.00 0.00 1.00 0.00 0.00 64.86 65.29 3h0e h ILE 96 Cb 0.88 1.36 -0.03 0.00 -0.74 0.00 0.00 36.82 38.30 3h0e h ILE 96 CO 0.08 0.18 0.33 0.58 0.00 0.00 0.00 178.15 179.31 3h0e h VAL 97 N 0.01 1.16 -0.53 1.67 2.07 -1.38 -1.33 116.25 117.92 3h0e h VAL 97 Ca 0.04 -0.37 -0.04 0.00 0.82 0.00 0.00 66.70 67.15 3h0e h VAL 97 Cb 0.25 0.42 -0.02 0.00 -1.52 0.00 0.00 31.29 30.42 3h0e h VAL 97 CO 0.00 0.17 0.18 -0.08 0.02 0.00 0.00 177.57 177.86 3h0e h GLU 98 N 0.73 0.81 -0.25 1.57 4.81 -1.28 -0.33 114.58 120.65 3h0e h GLU 98 Ca 0.20 -0.16 0.00 0.00 -0.13 0.00 0.00 59.36 59.26 3h0e h GLU 98 Cb -0.01 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 29.23 3h0e h GLU 98 CO -0.04 0.73 0.16 1.25 -0.73 0.00 0.00 179.01 180.39 3h0e h LEU 99 N 0.72 0.29 -0.54 1.64 5.85 -0.91 -0.48 115.31 121.88 3h0e h LEU 99 Ca 0.17 -0.02 -0.05 0.00 0.84 0.00 0.00 57.88 58.82 3h0e h LEU 99 Cb 0.25 -0.07 -0.02 0.00 0.37 0.00 0.00 40.66 41.18 3h0e h LEU 99 CO -0.01 0.23 0.15 0.24 -0.34 0.00 0.00 178.44 178.70 3h0e h MET 100 N 0.32 0.85 -0.29 1.25 2.86 -1.10 -0.00 114.93 118.82 3h0e h MET 100 Ca 0.09 -0.20 0.00 0.00 -2.06 0.00 0.00 59.70 57.54 3h0e h MET 100 Cb -0.02 -0.12 -0.02 0.00 0.06 0.00 0.00 31.60 31.51 3h0e h MET 100 CO -0.02 0.79 0.19 -0.09 1.06 0.00 0.00 176.91 178.84 3h0e h ARG 101 N 0.75 0.37 -0.39 1.72 2.43 -0.89 0.01 114.38 118.39 3h0e h ARG 101 Ca 0.17 -0.02 -0.02 0.00 -0.81 0.00 0.00 59.98 59.30 3h0e h ARG 101 Cb 0.32 -0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 29.76 3h0e h ARG 101 CO -0.00 0.25 0.18 -0.44 -1.51 0.00 0.00 179.97 178.45 3h0e h ASP 102 N 0.39 0.51 -0.83 -3.80 3.32 -0.88 -2.67 116.42 112.46 3h0e h ASP 102 Ca 0.11 -0.13 -0.02 0.00 0.02 0.00 0.00 57.03 57.00 3h0e h ASP 102 Cb -0.04 -0.13 -0.04 0.00 0.22 0.00 0.00 39.33 39.34 3h0e h ASP 102 CO -0.03 0.50 0.42 0.58 -1.72 0.00 0.00 179.24 179.00 3h0e h VAL 103 N 0.49 1.25 0.00 -1.35 2.07 -0.79 -1.77 116.25 116.15 3h0e h VAL 103 Ca 0.13 -0.67 0.00 0.00 0.82 0.00 0.00 66.70 66.98 3h0e h VAL 103 Cb 0.13 0.17 0.00 0.00 -1.52 0.00 0.00 31.29 30.07 3h0e h VAL 103 CO -0.02 0.29 0.00 -1.54 0.02 0.00 0.00 177.57 176.33 3h0e n SER 104 N -4.35 0.53 -0.26 0.57 3.41 -0.03 -2.26 113.62 111.23 3h0e n SER 104 Ca 0.08 0.65 0.11 0.00 -0.26 0.00 0.00 58.87 59.46 3h0e n SER 104 Cb 0.12 -0.76 0.10 0.00 -0.26 0.00 0.00 64.21 63.41 3h0e n SER 104 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 3h0e n LYS 105 N -2.11 0.69 -1.18 4.33 5.02 -0.68 -4.77 118.16 119.46 3h0e n LYS 105 Ca 0.02 -0.52 -0.30 0.00 -2.02 0.00 0.00 58.31 55.49 3h0e n LYS 105 Cb 0.18 -1.49 0.14 0.00 -0.02 0.00 0.00 35.03 33.84 3h0e n LYS 105 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 3h0e s GLU 106 N -2.67 1.27 -0.49 1.97 2.02 -0.96 -4.99 118.70 114.85 3h0e s GLU 106 Ca 0.17 0.87 -0.21 0.00 0.02 0.00 0.00 54.97 55.82 3h0e s GLU 106 Cb 0.18 -1.81 0.04 0.00 0.10 0.00 0.00 34.13 32.65 3h0e s GLU 106 CO 0.64 -2.25 0.69 0.34 0.02 0.00 0.00 175.26 174.70 3h0e s ASP 107 N -3.38 6.28 -0.11 -0.19 -1.08 -1.26 -4.90 116.67 112.03 3h0e s ASP 107 Ca 0.63 -0.62 0.16 0.00 -0.52 0.00 0.00 52.55 52.21 3h0e s ASP 107 Cb -0.18 -2.33 0.66 0.00 -1.46 0.00 0.00 42.92 39.62 3h0e s ASP 107 CO 0.57 -0.91 1.56 1.41 0.52 0.00 0.00 175.17 178.32 3h0e n HIS 108 N 6.43 1.40 -0.28 -5.34 8.25 -1.26 -4.60 115.22 119.82 3h0e n HIS 108 Ca -0.03 -0.55 0.20 0.00 -0.26 0.00 0.00 57.72 57.07 3h0e n HIS 108 Cb 0.47 -0.25 0.49 0.00 1.12 0.00 0.00 29.99 31.82 3h0e n HIS 108 CO 0.00 0.00 0.00 0.77 0.64 0.00 0.00 176.34 177.75 3h0e h SER 109 N 3.73 0.46 -0.56 0.41 0.02 -1.91 0.14 113.55 115.83 3h0e h SER 109 Ca 0.00 0.06 0.00 0.00 -0.84 0.00 0.00 61.79 61.01 3h0e h SER 109 Cb 1.38 -0.02 0.00 0.00 0.14 0.00 0.00 62.40 63.90 3h0e h SER 109 CO 0.23 0.16 0.00 0.29 -1.14 0.00 0.00 176.83 176.37 3h0e n LYS 110 N -4.56 2.35 -4.68 3.45 5.02 -1.26 -4.90 118.16 113.57 3h0e n LYS 110 Ca 0.21 -2.03 -0.34 0.00 -2.02 0.00 0.00 58.31 54.14 3h0e n LYS 110 Cb 0.74 -1.46 -0.12 0.00 -0.02 0.00 0.00 35.03 34.18 3h0e n LYS 110 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 3h0e s ARG 111 N -1.29 2.74 0.20 1.97 0.52 0.03 -1.26 118.95 121.88 3h0e s ARG 111 Ca 0.38 -0.58 0.07 0.00 -0.52 0.00 0.00 55.73 55.08 3h0e s ARG 111 Cb 0.20 -2.56 0.11 0.00 0.52 0.00 0.00 34.95 33.22 3h0e s ARG 111 CO 0.25 0.63 1.46 0.77 0.02 0.00 0.00 175.30 178.43 3h0e h SER 112 N 5.35 0.08 -2.71 0.23 0.02 -0.58 -3.47 113.55 112.47 3h0e h SER 112 Ca -0.47 -0.06 -0.05 0.00 -0.84 0.00 0.00 61.79 60.37 3h0e h SER 112 Cb 1.17 -0.02 0.00 0.00 0.14 0.00 0.00 62.40 63.69 3h0e h SER 112 CO 0.52 0.83 0.19 -1.54 -1.14 0.00 0.00 176.83 175.69 3h0e n SER 113 N -3.65 -1.79 -3.82 3.07 3.41 -0.24 -4.20 113.62 106.40 3h0e n SER 113 Ca -0.02 -2.32 -0.13 0.00 -0.26 0.00 0.00 58.87 56.15 3h0e n SER 113 Cb 0.75 3.00 -0.13 0.00 -0.26 0.00 0.00 64.21 67.57 3h0e n SER 113 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 175.04 175.00 3h0e s PHE 114 N -3.44 -0.11 -0.05 7.33 5.36 -0.74 -3.98 117.98 122.33 3h0e s PHE 114 Ca 0.14 0.30 0.02 0.00 -0.96 0.00 0.00 56.93 56.44 3h0e s PHE 114 Cb -0.04 0.00 0.01 0.00 -0.34 0.00 0.00 43.02 42.66 3h0e s PHE 114 CO 0.10 -0.08 -0.11 0.08 -1.46 0.00 0.00 175.22 173.76 3h0e s VAL 115 N 0.31 1.03 -0.07 3.12 1.01 -0.38 -0.08 120.40 125.35 3h0e s VAL 115 Ca -0.02 -0.44 0.02 0.00 0.00 0.00 0.00 61.98 61.54 3h0e s VAL 115 Cb -0.03 -0.94 0.01 0.00 0.00 0.00 0.00 36.38 35.42 3h0e s VAL 115 CO -0.01 0.33 -0.13 0.00 0.00 0.00 0.00 175.10 175.28 3h0e s VAL 117 N 0.63 2.87 -0.22 0.00 1.01 0.16 -0.83 120.40 124.03 3h0e s VAL 117 Ca -0.15 -0.71 -0.04 0.00 0.00 0.00 0.00 61.98 61.09 3h0e s VAL 117 Cb -0.16 -2.22 -0.01 0.00 0.00 0.00 0.00 36.38 34.00 3h0e s VAL 117 CO 0.04 0.51 -0.04 -0.76 0.00 0.00 0.00 175.10 174.85 3h0e s LEU 118 N 0.67 2.90 -0.30 3.92 1.43 0.33 -0.60 118.68 127.04 3h0e s LEU 118 Ca -0.07 -0.42 0.02 0.00 -1.03 0.00 0.00 54.13 52.63 3h0e s LEU 118 Cb -0.15 -1.73 0.07 0.00 0.03 0.00 0.00 46.19 44.40 3h0e s LEU 118 CO 0.02 -0.03 -0.03 -0.76 0.23 0.00 0.00 176.35 175.78 3h0e s LEU 119 N 1.47 3.95 0.00 1.79 1.43 -0.16 -0.85 118.68 126.31 3h0e s LEU 119 Ca 0.06 -1.58 -0.19 0.00 -1.03 0.00 0.00 54.13 51.38 3h0e s LEU 119 Cb -0.14 -1.62 0.07 0.00 0.03 0.00 0.00 46.19 44.52 3h0e s LEU 119 CO -0.03 -0.27 0.92 -0.24 0.23 0.00 0.00 176.35 176.95 3h0e n SER 120 N 4.44 -1.34 -4.77 2.29 2.88 -0.98 -1.09 113.62 115.06 3h0e n SER 120 Ca -0.09 -1.62 -0.30 0.00 -1.33 0.00 0.00 58.87 55.53 3h0e n SER 120 Cb 0.42 2.15 0.10 0.00 -0.75 0.00 0.00 64.21 66.13 3h0e n SER 120 CO 0.00 0.00 0.00 -1.00 -1.23 0.00 0.00 175.04 172.81 3h0e s HIS 121 N -2.60 2.68 0.26 0.66 3.76 -1.26 -4.09 115.29 114.69 3h0e s HIS 121 Ca 0.21 1.32 -0.21 0.00 -0.15 0.00 0.00 55.06 56.23 3h0e s HIS 121 Cb -0.02 -3.07 0.05 0.00 1.11 0.00 0.00 32.58 30.65 3h0e s HIS 121 CO 0.03 -1.85 0.86 0.20 -0.85 0.00 0.00 174.74 173.13 3h0e s GLY 122 N -3.63 0.02 0.29 -2.22 0.00 -1.26 -1.77 107.32 98.75 3h0e s GLY 122 Ca 0.61 -0.31 0.04 0.00 0.00 0.00 0.00 44.72 45.06 3h0e s GLY 122 CO 0.56 0.28 0.24 -0.54 0.00 0.00 0.00 173.10 173.64 3h0e s GLU 123 N -3.05 1.58 -0.06 2.90 0.41 -0.77 -4.38 118.70 115.33 3h0e s GLU 123 Ca 0.14 -1.87 -0.35 0.00 -0.41 0.00 0.00 54.97 52.49 3h0e s GLU 123 Cb -0.04 0.32 -0.12 0.00 -1.78 0.00 0.00 34.13 32.50 3h0e s GLU 123 CO 0.07 -0.57 1.81 -1.91 -0.49 0.00 0.00 175.26 174.17 3h0e n GLU 124 N -0.50 2.09 -0.95 1.61 4.07 -1.08 -1.02 120.64 124.85 3h0e n GLU 124 Ca 0.05 0.76 0.00 0.00 -0.06 0.00 0.00 57.16 57.92 3h0e n GLU 124 Cb 0.63 -2.58 0.00 0.00 -0.06 0.00 0.00 31.44 29.43 3h0e n GLU 124 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 3h0e n GLY 125 N 4.20 0.70 2.98 8.31 0.00 -1.26 -5.00 105.19 115.12 3h0e n GLY 125 Ca 0.22 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.12 3h0e n GLY 125 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3h0e s ILE 126 N -2.96 0.27 0.15 -0.61 -5.25 -0.19 -1.03 121.20 111.59 3h0e s ILE 126 Ca 0.00 -0.69 0.10 0.00 -0.99 0.00 0.00 60.65 59.06 3h0e s ILE 126 Cb 0.00 -0.34 -0.04 0.00 2.95 0.00 0.00 42.46 45.03 3h0e s ILE 126 CO 0.00 -0.28 -0.22 0.27 -1.79 0.00 0.00 174.94 172.92 3h0e s ILE 127 N -0.96 2.02 -0.22 8.37 -5.25 -0.39 -1.85 121.20 122.91 3h0e s ILE 127 Ca -0.08 -1.80 -0.12 0.00 -0.99 0.00 0.00 60.65 57.66 3h0e s ILE 127 Cb -0.07 -1.86 -0.05 0.00 2.95 0.00 0.00 42.46 43.43 3h0e s ILE 127 CO -0.00 -0.10 0.21 -0.36 -1.79 0.00 0.00 174.94 172.89 3h0e s PHE 128 N -1.48 3.35 0.98 1.37 0.40 -0.73 -0.26 117.98 121.60 3h0e s PHE 128 Ca 0.14 0.33 -0.14 0.00 -0.60 0.00 0.00 56.93 56.66 3h0e s PHE 128 Cb -0.08 -2.30 0.18 0.00 0.51 0.00 0.00 43.02 41.32 3h0e s PHE 128 CO 0.07 0.09 1.14 0.20 0.70 0.00 0.00 175.22 177.42 3h0e s GLY 129 N 0.93 1.59 0.64 4.36 0.00 0.07 -4.65 107.32 110.27 3h0e s GLY 129 Ca 0.10 -0.63 0.38 0.00 0.00 0.00 0.00 44.72 44.57 3h0e s GLY 129 CO 0.04 0.01 2.30 -0.91 0.00 0.00 0.00 173.10 174.54 3h0e h THR 130 N -1.75 0.20 -0.05 0.90 1.35 -1.14 -2.86 112.91 109.57 3h0e h THR 130 Ca -0.50 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.36 3h0e h THR 130 Cb 1.32 0.97 0.00 0.00 -1.73 0.00 0.00 68.15 68.71 3h0e h THR 130 CO 0.55 0.00 0.00 -0.46 -0.25 0.00 0.00 175.52 175.36 3h0e n ASN 131 N -3.36 1.78 0.00 5.36 6.94 -1.26 -0.82 115.26 123.89 3h0e n ASN 131 Ca -0.03 -1.61 0.00 0.00 -0.02 0.00 0.00 54.58 52.92 3h0e n ASN 131 Cb 0.11 -0.03 0.00 0.00 -2.36 0.00 0.00 39.78 37.50 3h0e n ASN 131 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 3h0e n GLY 132 N -0.09 2.45 3.77 4.83 0.00 -1.08 -4.93 105.19 110.14 3h0e n GLY 132 Ca 0.02 -1.33 -0.37 0.00 0.00 0.00 0.00 46.02 44.34 3h0e n GLY 132 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3h0e s PRO 133 N -2.00 3.68 -0.05 1.61 0.04 -1.26 -0.75 135.00 136.27 3h0e s PRO 133 Ca 0.00 1.88 0.02 0.00 0.04 0.00 0.00 61.00 62.95 3h0e s PRO 133 Cb 0.00 -2.42 0.01 0.00 0.04 0.00 0.00 34.50 32.13 3h0e s PRO 133 CO 0.00 -0.64 -0.11 0.08 0.04 0.00 0.00 177.00 176.37 3h0e s VAL 134 N -1.48 0.98 0.13 -0.36 1.01 0.64 -4.82 120.40 116.50 3h0e s VAL 134 Ca 0.64 -0.41 -0.31 0.00 0.00 0.00 0.00 61.98 61.89 3h0e s VAL 134 Cb -0.31 -0.89 -0.09 0.00 0.00 0.00 0.00 36.38 35.09 3h0e s VAL 134 CO 0.38 0.31 1.49 -1.81 0.00 0.00 0.00 175.10 175.48 3h0e s ASP 135 N 0.52 6.69 0.27 3.32 1.01 -1.26 -1.26 116.67 125.96 3h0e s ASP 135 Ca -0.10 2.47 -0.02 0.00 0.71 0.00 0.00 52.55 55.61 3h0e s ASP 135 Cb -0.13 -2.59 0.44 0.00 1.01 0.00 0.00 42.92 41.65 3h0e s ASP 135 CO 0.02 -0.75 1.88 -0.07 0.21 0.00 0.00 175.17 176.46 3h0e h LEU 136 N 6.98 1.02 -0.97 1.23 3.38 -1.43 -1.96 115.31 123.55 3h0e h LEU 136 Ca -0.42 0.01 0.16 0.00 0.09 0.00 0.00 57.88 57.72 3h0e h LEU 136 Cb 1.21 -0.20 -0.10 0.00 0.09 0.00 0.00 40.66 41.65 3h0e h LEU 136 CO 0.89 0.64 0.58 0.11 0.09 0.00 0.00 178.44 180.75 3h0e h LYS 137 N 1.14 0.78 -0.91 1.13 1.79 -1.91 -0.98 116.57 117.61 3h0e h LYS 137 Ca 0.44 -0.05 0.01 0.00 -2.18 0.00 0.00 60.65 58.87 3h0e h LYS 137 Cb 0.21 -0.17 -0.05 0.00 -1.58 0.00 0.00 32.23 30.64 3h0e h LYS 137 CO -0.18 0.51 0.60 -0.22 -1.08 0.00 0.00 179.45 179.08 3h0e h LYS 138 N 0.80 1.18 0.11 3.15 3.64 -1.74 0.71 116.57 124.41 3h0e h LYS 138 Ca 0.53 -0.07 -0.01 0.00 -1.27 0.00 0.00 60.65 59.83 3h0e h LYS 138 Cb 0.73 -0.27 0.00 0.00 -0.41 0.00 0.00 32.23 32.28 3h0e h LYS 138 CO -0.35 0.78 -0.05 0.82 -2.27 0.00 0.00 179.45 178.38 3h0e h ILE 139 N 1.22 1.09 0.00 2.00 2.04 -1.21 -3.31 117.51 119.33 3h0e h ILE 139 Ca 0.34 -1.07 -0.07 0.00 1.00 0.00 0.00 64.86 65.06 3h0e h ILE 139 Cb -0.12 1.73 -0.01 0.00 -0.74 0.00 0.00 36.82 37.68 3h0e h ILE 139 CO -0.08 0.25 -0.32 0.71 0.00 0.00 0.00 178.15 178.71 3h0e h THR 140 N -0.68 0.90 -0.16 -0.27 1.35 -1.14 -3.07 112.91 109.84 3h0e h THR 140 Ca -0.02 -1.24 0.05 0.00 -0.55 0.00 0.00 66.41 64.65 3h0e h THR 140 Cb 0.52 1.74 -0.01 0.00 -1.73 0.00 0.00 68.15 68.68 3h0e h THR 140 CO 0.03 0.31 0.15 0.78 -0.25 0.00 0.00 175.52 176.54 3h0e h ASN 141 N 0.00 0.00 0.47 5.36 2.35 -0.94 -1.05 115.58 121.77 3h0e h ASN 141 Ca -0.00 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.74 3h0e h ASN 141 Cb 0.72 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 39.09 3h0e h ASN 141 CO 0.04 0.00 -0.03 -0.26 -1.65 0.00 0.00 177.43 175.53 3h0e h PHE 142 N 0.00 0.00 -0.31 1.19 0.04 -1.69 -2.88 116.94 113.29 3h0e h PHE 142 Ca 0.08 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.85 3h0e h PHE 142 Cb 0.38 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.53 3h0e h PHE 142 CO 0.00 0.03 0.00 1.19 -0.60 0.00 0.00 178.31 178.93 3h0e n PHE 143 N -3.24 0.41 -1.33 -0.55 3.72 -0.40 -3.99 117.46 112.07 3h0e n PHE 143 Ca -0.01 -0.30 -0.37 0.00 -0.05 0.00 0.00 57.45 56.71 3h0e n PHE 143 Cb 0.20 -0.01 0.05 0.00 -0.94 0.00 0.00 39.48 38.78 3h0e n PHE 143 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 3h0e n ARG 144 N 0.95 0.34 0.01 -1.08 1.74 -1.09 -4.50 116.66 113.03 3h0e n ARG 144 Ca 0.14 0.15 0.22 0.00 -0.77 0.00 0.00 57.85 57.59 3h0e n ARG 144 Cb 0.47 -1.67 0.72 0.00 -1.02 0.00 0.00 32.46 30.96 3h0e n ARG 144 CO 0.00 0.00 0.00 0.78 -1.52 0.00 0.00 177.63 176.89 3h0e h GLY 145 N -0.12 0.00 -0.59 -0.13 0.00 -1.49 -0.31 103.07 100.43 3h0e h GLY 145 Ca -0.45 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.88 3h0e h GLY 145 CO 0.43 0.00 -0.57 2.09 0.00 0.00 0.00 176.54 178.49 3h0e n ASP 146 N -3.86 1.53 -0.00 0.19 5.75 -1.26 -4.44 116.55 114.46 3h0e n ASP 146 Ca 0.11 -1.26 0.05 0.00 -0.01 0.00 0.00 54.79 53.67 3h0e n ASP 146 Cb 0.73 0.65 -0.07 0.00 -1.03 0.00 0.00 41.12 41.41 3h0e n ASP 146 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 3h0e n ARG 147 N -0.53 2.17 -3.57 0.11 1.74 -0.21 -4.77 116.66 111.60 3h0e n ARG 147 Ca 0.07 -0.04 -0.29 0.00 -0.77 0.00 0.00 57.85 56.81 3h0e n ARG 147 Cb 0.37 -1.10 -0.12 0.00 -1.02 0.00 0.00 32.46 30.59 3h0e n ARG 147 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3h0e h ARG 149 N 6.64 0.00 0.00 0.00 2.47 -1.84 -2.42 114.38 119.23 3h0e h ARG 149 Ca 0.07 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.79 3h0e h ARG 149 Cb 0.94 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.26 3h0e h ARG 149 CO 0.38 0.31 0.00 -1.13 0.56 0.00 0.00 179.97 180.10 3h0e n SER 150 N -4.15 0.00 -0.33 7.04 3.41 -1.26 -2.36 113.62 115.97 3h0e n SER 150 Ca -0.02 -0.38 0.04 0.00 -0.26 0.00 0.00 58.87 58.25 3h0e n SER 150 Cb 0.36 -0.19 0.05 0.00 -0.26 0.00 0.00 64.21 64.17 3h0e n SER 150 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3h0e n LEU 151 N -1.19 1.94 -4.70 1.04 4.77 -0.92 -4.11 117.00 113.83 3h0e n LEU 151 Ca 0.16 -1.36 -0.42 0.00 -0.03 0.00 0.00 56.01 54.36 3h0e n LEU 151 Cb 0.18 -0.05 -0.03 0.00 -2.33 0.00 0.00 43.42 41.18 3h0e n LEU 151 CO 0.19 0.44 1.43 0.41 -1.33 0.00 0.00 177.39 178.53 3h0e n THR 152 N 0.31 0.21 -0.82 -5.08 -1.04 -1.00 -1.38 114.28 105.48 3h0e n THR 152 Ca 0.05 -0.04 0.00 0.00 -2.04 0.00 0.00 64.05 62.03 3h0e n THR 152 Cb 0.24 -2.04 0.00 0.00 -1.82 0.00 0.00 70.33 66.71 3h0e n THR 152 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3h0e n GLY 153 N 4.10 0.86 3.61 3.41 0.00 -1.26 -5.03 105.19 110.88 3h0e n GLY 153 Ca 0.17 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.89 3h0e n GLY 153 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3h0e s LYS 154 N -0.18 2.26 0.04 1.61 1.02 -0.48 -4.96 119.74 119.04 3h0e s LYS 154 Ca 0.00 -0.97 -0.30 0.00 0.02 0.00 0.00 55.97 54.72 3h0e s LYS 154 Cb 0.00 -2.38 -0.07 0.00 -0.52 0.00 0.00 37.83 34.86 3h0e s LYS 154 CO 0.00 0.52 1.59 -2.14 -0.92 0.00 0.00 175.35 174.40 3h0e s PRO 155 N -2.23 4.22 -0.32 -1.68 0.02 -1.26 -4.83 135.00 128.91 3h0e s PRO 155 Ca 0.23 2.23 -0.03 0.00 0.02 0.00 0.00 61.00 63.44 3h0e s PRO 155 Cb -0.11 -3.64 0.05 0.00 0.02 0.00 0.00 34.50 30.82 3h0e s PRO 155 CO 0.15 -0.71 0.05 0.15 -0.33 0.00 0.00 177.00 176.31 3h0e s LYS 156 N 2.74 2.47 -0.25 5.54 1.02 0.19 -1.79 119.74 129.67 3h0e s LYS 156 Ca 0.71 -1.27 -0.08 0.00 0.02 0.00 0.00 55.97 55.35 3h0e s LYS 156 Cb -0.37 -3.31 -0.03 0.00 -0.52 0.00 0.00 37.83 33.60 3h0e s LYS 156 CO 0.31 -0.67 0.09 -0.51 -0.92 0.00 0.00 175.35 173.65 3h0e s LEU 157 N 1.30 3.59 -0.19 3.17 1.02 0.89 -0.80 118.68 127.66 3h0e s LEU 157 Ca -0.03 -0.14 -0.01 0.00 0.02 0.00 0.00 54.13 53.97 3h0e s LEU 157 Cb -0.20 -1.96 0.00 0.00 0.02 0.00 0.00 46.19 44.05 3h0e s LEU 157 CO 0.00 -0.01 -0.12 -0.36 0.02 0.00 0.00 176.35 175.88 3h0e s PHE 158 N 1.48 2.86 -0.22 0.29 0.40 0.21 -0.63 117.98 122.37 3h0e s PHE 158 Ca 0.06 -1.19 -0.04 0.00 -0.60 0.00 0.00 56.93 55.15 3h0e s PHE 158 Cb -0.15 -2.00 -0.01 0.00 0.51 0.00 0.00 43.02 41.37 3h0e s PHE 158 CO 0.05 -0.62 -0.04 0.42 0.70 0.00 0.00 175.22 175.73 3h0e s ILE 159 N 1.27 3.44 -0.31 0.64 1.01 -0.01 -0.14 121.20 127.10 3h0e s ILE 159 Ca 0.03 -0.47 0.03 0.00 0.00 0.00 0.00 60.65 60.24 3h0e s ILE 159 Cb -0.14 -2.57 0.09 0.00 0.01 0.00 0.00 42.46 39.85 3h0e s ILE 159 CO -0.06 0.42 0.02 -0.63 0.00 0.00 0.00 174.94 174.69 3h0e s ILE 160 N 1.46 2.01 -0.60 2.92 1.01 -0.59 -0.51 121.20 126.89 3h0e s ILE 160 Ca 0.05 -1.99 -0.17 0.00 0.00 0.00 0.00 60.65 58.55 3h0e s ILE 160 Cb -0.14 -2.40 0.13 0.00 0.01 0.00 0.00 42.46 40.06 3h0e s ILE 160 CO -0.03 -0.46 0.62 -1.58 0.00 0.00 0.00 174.94 173.50 3h0e s GLN 161 N 1.08 3.10 -0.23 2.79 2.00 -0.03 -1.51 119.66 126.85 3h0e s GLN 161 Ca 0.06 -1.67 -0.29 0.00 -2.00 0.00 0.00 55.36 51.46 3h0e s GLN 161 Cb -0.19 -4.32 0.15 0.00 0.80 0.00 0.00 33.01 29.45 3h0e s GLN 161 CO -0.09 -1.41 1.16 0.00 -0.50 0.00 0.00 175.29 174.44 3h0e s ALA 162 N 1.84 -2.02 0.69 1.58 0.00 -1.26 -2.31 121.76 120.28 3h0e s ALA 162 Ca 0.09 1.73 -0.17 0.00 0.00 0.00 0.00 51.96 53.61 3h0e s ALA 162 Cb -0.25 -1.15 -0.01 0.00 0.00 0.00 0.00 23.12 21.72 3h0e s ALA 162 CO 0.02 -0.26 0.98 0.00 0.00 0.00 0.00 175.76 176.50 3h0e n ARG 164 N -1.65 1.21 0.00 0.00 1.74 -0.29 -2.77 116.66 114.90 3h0e n ARG 164 Ca 0.13 -2.75 0.00 0.00 -0.77 0.00 0.00 57.85 54.46 3h0e n ARG 164 Cb 0.49 -1.34 0.00 0.00 -1.02 0.00 0.00 32.46 30.59 3h0e n ARG 164 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3h0e n GLY 165 N -1.00 0.99 0.10 -0.13 0.00 -1.21 -1.32 105.19 102.62 3h0e n GLY 165 Ca 0.15 -1.92 0.05 0.00 0.00 0.00 0.00 46.02 44.30 3h0e n GLY 165 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3h0e n THR 166 N 8.28 1.21 -2.21 2.61 -2.24 -1.13 -3.44 114.28 117.36 3h0e n THR 166 Ca 0.00 -1.39 -0.37 0.00 -2.27 0.00 0.00 64.05 60.02 3h0e n THR 166 Cb 0.00 0.19 -0.00 0.00 -2.10 0.00 0.00 70.33 68.42 3h0e n THR 166 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 3h0e s GLU 167 N -1.69 3.60 -0.06 -0.78 2.02 -0.88 -4.64 118.70 116.27 3h0e s GLU 167 Ca 0.15 1.79 0.03 0.00 0.02 0.00 0.00 54.97 56.96 3h0e s GLU 167 Cb 0.13 -2.30 -0.02 0.00 0.10 0.00 0.00 34.13 32.04 3h0e s GLU 167 CO 0.01 -0.69 -0.15 -0.51 0.02 0.00 0.00 175.26 173.95 3h0e s LEU 168 N -3.25 2.71 -0.38 1.80 1.43 -1.26 -0.87 118.68 118.86 3h0e s LEU 168 Ca 0.66 -0.22 -0.16 0.00 -1.03 0.00 0.00 54.13 53.38 3h0e s LEU 168 Cb -0.29 -1.55 0.01 0.00 0.03 0.00 0.00 46.19 44.38 3h0e s LEU 168 CO 0.34 0.33 0.41 -0.62 0.23 0.00 0.00 176.35 177.04 3h0e s ASP 169 N -0.61 6.20 0.17 2.29 -1.08 -1.26 -4.94 116.67 117.44 3h0e s ASP 169 Ca 0.09 -0.43 0.27 0.00 -0.52 0.00 0.00 52.55 51.95 3h0e s ASP 169 Cb -0.11 -2.22 0.90 0.00 -1.46 0.00 0.00 42.92 40.03 3h0e s ASP 169 CO 0.01 -0.47 1.81 0.00 0.52 0.00 0.00 175.17 177.04 3h0e n GLY 171 N 1.32 -1.56 3.08 0.00 0.00 -1.26 -4.73 105.19 102.03 3h0e n GLY 171 Ca 0.06 -1.39 -0.12 0.00 0.00 0.00 0.00 46.02 44.57 3h0e n GLY 171 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 3h0e s ILE 172 N -1.55 0.05 0.00 -0.61 1.10 -1.26 -5.10 121.20 113.83 3h0e s ILE 172 Ca 0.00 -0.41 0.00 0.00 -0.51 0.00 0.00 60.65 59.73 3h0e s ILE 172 Cb 0.00 -0.35 0.00 0.00 0.15 0.00 0.00 42.46 42.26 3h0e s ILE 172 CO 0.00 -0.22 0.00 1.21 -2.11 0.00 0.00 174.94 173.82 3h0e n GLU 173 N 2.09 0.00 -1.71 3.50 2.13 -1.26 -5.24 120.64 120.15 3h0e n GLU 173 Ca -0.18 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.64 3h0e n GLU 173 Cb 0.57 0.00 0.00 0.00 0.27 0.00 0.00 31.44 32.28 3h0e n GLU 173 CO 0.00 0.00 0.00 -3.47 -0.41 0.00 0.00 177.13 173.25 3h0e n ASP 180 N 3.92 -0.65 -4.27 4.31 2.03 -1.26 -5.32 116.55 115.31 3h0e n ASP 180 Ca 0.00 1.04 -0.36 0.00 0.52 0.00 0.00 54.79 55.99 3h0e n ASP 180 Cb 0.00 -1.76 -0.13 0.00 -0.72 0.00 0.00 41.12 38.51 3h0e n ASP 180 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 3h0e s ASP 181 N -0.04 4.84 -0.15 1.67 2.15 -1.26 -4.95 116.67 118.94 3h0e s ASP 181 Ca 0.00 -0.85 0.14 0.00 0.43 0.00 0.00 52.55 52.28 3h0e s ASP 181 Cb 0.00 -1.79 0.35 0.00 -0.30 0.00 0.00 42.92 41.18 3h0e s ASP 181 CO 0.00 -0.19 1.18 0.23 -0.17 0.00 0.00 175.17 176.22 3h0e n MET 182 N 4.77 1.23 -2.17 4.34 2.81 -1.26 -5.07 117.12 121.77 3h0e n MET 182 Ca -0.15 -2.79 -0.41 0.00 -1.81 0.00 0.00 57.70 52.55 3h0e n MET 182 Cb 0.47 -1.35 -0.03 0.00 -0.71 0.00 0.00 33.22 31.60 3h0e n MET 182 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 3h0e s ALA 183 N -2.60 3.50 0.00 3.04 0.00 -1.26 -3.01 121.76 121.42 3h0e s ALA 183 Ca 0.33 1.19 0.00 0.00 0.00 0.00 0.00 51.96 53.49 3h0e s ALA 183 Cb 0.32 -3.46 0.00 0.00 0.00 0.00 0.00 23.12 19.97 3h0e s ALA 183 CO -0.04 -0.57 0.00 0.00 0.00 0.00 0.00 175.76 175.15 3h0e h HIS 185 N 0.00 0.12 -4.06 0.00 6.17 -1.96 -3.48 115.15 111.94 3h0e h HIS 185 Ca 0.00 -0.09 -0.11 0.00 0.71 0.00 0.00 60.37 60.88 3h0e h HIS 185 Cb 0.29 -0.01 -0.14 0.00 2.52 0.00 0.00 27.41 30.07 3h0e h HIS 185 CO 0.18 1.03 -0.52 0.15 0.71 0.00 0.00 177.93 179.47 3h0e s LYS 186 N -2.45 0.79 0.20 5.26 1.02 -1.26 -5.17 119.74 118.13 3h0e s LYS 186 Ca -0.18 -1.14 0.10 0.00 0.02 0.00 0.00 55.97 54.77 3h0e s LYS 186 Cb -0.02 0.28 -0.04 0.00 -0.52 0.00 0.00 37.83 37.53 3h0e s LYS 186 CO 0.72 -0.22 -0.20 0.96 -0.92 0.00 0.00 175.35 175.70 3h0e s ILE 187 N -3.92 2.09 0.49 2.17 -4.36 -1.26 -5.06 121.20 111.36 3h0e s ILE 187 Ca 0.09 -2.09 -0.23 0.00 -0.26 0.00 0.00 60.65 58.16 3h0e s ILE 187 Cb 0.06 -2.04 -0.07 0.00 1.25 0.00 0.00 42.46 41.67 3h0e s ILE 187 CO -0.08 -0.31 1.33 -2.84 0.24 0.00 0.00 174.94 173.28 3h0e s PRO 188 N -3.01 3.49 0.53 0.37 0.02 -1.26 -4.92 135.00 130.22 3h0e s PRO 188 Ca 0.21 2.19 0.28 0.00 0.02 0.00 0.00 61.00 63.70 3h0e s PRO 188 Cb -0.06 -2.45 1.47 0.00 0.02 0.00 0.00 34.50 33.49 3h0e s PRO 188 CO 0.09 -0.90 2.08 -0.39 -0.33 0.00 0.00 177.00 177.55 3h0e h VAL 189 N 1.86 0.52 -0.01 3.83 -1.51 -1.98 -2.75 116.25 116.22 3h0e h VAL 189 Ca -0.50 -0.52 0.00 0.00 -1.23 0.00 0.00 66.70 64.45 3h0e h VAL 189 Cb 1.28 1.34 0.00 0.00 -2.13 0.00 0.00 31.29 31.78 3h0e h VAL 189 CO 0.59 0.11 -0.33 -0.62 -1.23 0.00 0.00 177.57 176.09 3h0e n GLU 190 N -3.60 0.58 -1.76 5.19 -0.58 -1.26 -1.32 120.64 117.89 3h0e n GLU 190 Ca -0.02 -0.34 -0.34 0.00 -0.42 0.00 0.00 57.16 56.05 3h0e n GLU 190 Cb 0.24 -1.49 0.05 0.00 -0.57 0.00 0.00 31.44 29.67 3h0e n GLU 190 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3h0e s ALA 191 N -2.65 2.42 -0.57 0.62 0.00 -1.04 -3.98 121.76 116.56 3h0e s ALA 191 Ca 0.20 0.68 0.00 0.00 0.00 0.00 0.00 51.96 52.85 3h0e s ALA 191 Cb 0.19 -3.36 0.00 0.00 0.00 0.00 0.00 23.12 19.94 3h0e s ALA 191 CO 0.57 -1.35 0.00 -0.25 0.00 0.00 0.00 175.76 174.74 3h0e n ASP 192 N -2.31 -3.50 -4.79 0.00 8.00 -0.09 -4.81 116.55 109.04 3h0e n ASP 192 Ca 0.11 0.12 -0.34 0.00 0.71 0.00 0.00 54.79 55.39 3h0e n ASP 192 Cb 0.51 -1.65 -0.07 0.00 -0.02 0.00 0.00 41.12 39.89 3h0e n ASP 192 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 3h0e s PHE 193 N -2.21 3.36 -0.08 1.24 0.40 -1.26 -0.64 117.98 118.79 3h0e s PHE 193 Ca 0.00 0.29 0.02 0.00 -0.60 0.00 0.00 56.93 56.64 3h0e s PHE 193 Cb 0.00 -1.81 0.02 0.00 0.51 0.00 0.00 43.02 41.74 3h0e s PHE 193 CO 0.00 0.59 -0.12 -1.17 0.70 0.00 0.00 175.22 175.22 3h0e s LEU 194 N -1.39 1.58 -0.37 -0.37 0.20 0.02 -0.74 118.68 117.61 3h0e s LEU 194 Ca 0.19 -0.32 -0.05 0.00 0.69 0.00 0.00 54.13 54.64 3h0e s LEU 194 Cb -0.12 -0.87 0.07 0.00 -0.43 0.00 0.00 46.19 44.84 3h0e s LEU 194 CO 0.09 0.00 0.14 -0.31 -0.29 0.00 0.00 176.35 175.99 3h0e s TYR 195 N 0.90 3.35 -0.74 5.38 2.02 0.59 -0.62 117.35 128.23 3h0e s TYR 195 Ca -0.10 -1.75 -0.17 0.00 -0.37 0.00 0.00 57.07 54.67 3h0e s TYR 195 Cb -0.15 -2.62 0.14 0.00 -0.40 0.00 0.00 41.96 38.94 3h0e s TYR 195 CO 0.01 -0.83 0.83 0.00 -1.57 0.00 0.00 175.55 173.99 3h0e s ALA 196 N 1.32 3.59 0.20 3.71 0.00 0.80 -1.12 121.76 130.27 3h0e s ALA 196 Ca 0.01 -2.68 -0.25 0.00 0.00 0.00 0.00 51.96 49.04 3h0e s ALA 196 Cb -0.21 -3.65 -0.08 0.00 0.00 0.00 0.00 23.12 19.17 3h0e s ALA 196 CO 0.00 -2.49 0.81 0.71 0.00 0.00 0.00 175.76 174.80 3h0e s TYR 197 N 1.96 3.86 -0.03 0.00 2.02 -0.58 -1.54 117.35 123.04 3h0e s TYR 197 Ca 0.18 1.66 0.31 0.00 -0.37 0.00 0.00 57.07 58.86 3h0e s TYR 197 Cb -0.15 -2.79 1.30 0.00 -0.40 0.00 0.00 41.96 39.92 3h0e s TYR 197 CO -0.02 0.45 1.93 0.66 -1.57 0.00 0.00 175.55 176.99 3h0e h SER 198 N 4.04 0.00 -5.11 2.29 4.64 -1.56 -1.23 113.55 116.62 3h0e h SER 198 Ca -0.47 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 60.82 3h0e h SER 198 Cb 1.20 0.00 -0.11 0.00 -0.31 0.00 0.00 62.40 63.18 3h0e h SER 198 CO 0.66 0.00 -0.03 0.28 -0.87 0.00 0.00 176.83 176.87 3h0e s THR 199 N -3.59 0.04 0.61 2.95 -1.32 -1.26 -3.60 115.64 109.47 3h0e s THR 199 Ca 0.02 -0.82 -0.17 0.00 -1.21 0.00 0.00 61.69 59.51 3h0e s THR 199 Cb 0.09 -1.55 -0.03 0.00 -1.51 0.00 0.00 72.50 69.51 3h0e s THR 199 CO 0.50 -0.17 1.11 0.00 -2.21 0.00 0.00 174.62 173.85 3h0e s ALA 200 N -3.87 2.58 0.14 11.08 0.00 -0.71 -4.11 121.76 126.87 3h0e s ALA 200 Ca 0.09 0.62 -0.35 0.00 0.00 0.00 0.00 51.96 52.33 3h0e s ALA 200 Cb -0.00 -3.32 -0.15 0.00 0.00 0.00 0.00 23.12 19.65 3h0e s ALA 200 CO -0.04 -1.04 1.43 -2.30 0.00 0.00 0.00 175.76 173.82 3h0e n PRO 201 N -1.98 1.66 -0.23 0.00 -0.02 -1.26 -1.82 135.00 131.35 3h0e n PRO 201 Ca 0.11 0.60 0.00 0.00 -2.02 0.00 0.00 63.50 62.18 3h0e n PRO 201 Cb 0.52 -2.28 0.00 0.00 -0.02 0.00 0.00 33.50 31.71 3h0e n PRO 201 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3h0e n GLY 202 N 2.83 1.53 3.87 -1.23 0.00 -0.43 -5.01 105.19 106.75 3h0e n GLY 202 Ca 0.17 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.98 3h0e n GLY 202 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3h0e s TYR 203 N -2.87 3.15 0.74 1.61 1.51 -0.76 -2.08 117.35 118.66 3h0e s TYR 203 Ca 0.00 -0.13 -0.14 0.00 -1.01 0.00 0.00 57.07 55.79 3h0e s TYR 203 Cb 0.00 -1.55 0.04 0.00 -0.11 0.00 0.00 41.96 40.34 3h0e s TYR 203 CO 0.00 0.41 1.16 0.71 -1.11 0.00 0.00 175.55 176.72 3h0e s TYR 204 N -2.13 2.19 -0.11 2.71 2.02 -0.05 -1.14 117.35 120.84 3h0e s TYR 204 Ca 0.35 1.61 0.03 0.00 -0.37 0.00 0.00 57.07 58.69 3h0e s TYR 204 Cb -0.08 -3.34 0.01 0.00 -0.40 0.00 0.00 41.96 38.15 3h0e s TYR 204 CO 0.27 -2.32 -0.20 0.45 -1.57 0.00 0.00 175.55 172.18 3h0e s SER 205 N -2.37 2.79 0.05 2.29 0.15 -1.26 -4.83 113.70 110.52 3h0e s SER 205 Ca 0.70 -0.51 -0.15 0.00 0.70 0.00 0.00 55.95 56.69 3h0e s SER 205 Cb -0.25 -1.28 -0.06 0.00 -1.71 0.00 0.00 66.02 62.72 3h0e s SER 205 CO 0.47 0.08 0.47 0.26 1.20 0.00 0.00 173.24 175.72 3h0e s TRP 206 N 0.71 3.71 -0.01 3.44 0.52 -1.26 -4.75 118.94 121.30 3h0e s TRP 206 Ca -0.11 1.04 -0.00 0.00 0.02 0.00 0.00 56.10 57.05 3h0e s TRP 206 Cb -0.16 -2.33 0.00 0.00 -1.15 0.00 0.00 33.47 29.83 3h0e s TRP 206 CO 0.02 0.58 0.01 0.50 0.02 0.00 0.00 176.95 178.08 3h0e s ARG 207 N -1.36 0.02 -0.13 4.98 3.52 -1.26 -1.97 118.95 122.74 3h0e s ARG 207 Ca 0.29 0.02 -0.02 0.00 -0.13 0.00 0.00 55.73 55.89 3h0e s ARG 207 Cb -0.17 0.01 -0.02 0.00 -1.56 0.00 0.00 34.95 33.21 3h0e s ARG 207 CO 0.16 -0.00 -0.08 1.21 -0.81 0.00 0.00 175.30 175.78 3h0e s ASN 208 N 0.02 4.46 0.43 -2.12 3.84 0.57 -4.89 114.94 117.25 3h0e s ASN 208 Ca -0.00 -0.19 0.09 0.00 0.21 0.00 0.00 52.86 52.96 3h0e s ASN 208 Cb -0.00 -1.63 0.92 0.00 -0.55 0.00 0.00 41.25 39.99 3h0e s ASN 208 CO -0.00 0.19 2.06 0.77 -2.79 0.00 0.00 177.10 177.33 3h0e h SER 209 N 6.51 0.37 0.15 -4.21 4.64 -1.84 0.44 113.55 119.62 3h0e h SER 209 Ca -0.31 -0.02 -0.28 0.00 -0.47 0.00 0.00 61.79 60.71 3h0e h SER 209 Cb 1.20 -0.09 0.01 0.00 -0.31 0.00 0.00 62.40 63.20 3h0e h SER 209 CO 0.59 0.29 -1.38 0.50 -0.87 0.00 0.00 176.83 175.95 3h0e h LYS 210 N 0.43 0.32 -0.00 4.77 3.64 -1.93 -3.33 116.57 120.47 3h0e h LYS 210 Ca 0.11 -0.55 0.00 0.00 -1.27 0.00 0.00 60.65 58.95 3h0e h LYS 210 Cb -0.01 0.20 0.00 0.00 -0.41 0.00 0.00 32.23 32.01 3h0e h LYS 210 CO -0.02 1.26 -0.52 -0.25 -2.27 0.00 0.00 179.45 177.65 3h0e n ASP 211 N -3.87 0.78 0.00 4.20 8.00 -1.17 -5.00 116.55 119.50 3h0e n ASP 211 Ca -0.22 -0.89 0.00 0.00 0.71 0.00 0.00 54.79 54.39 3h0e n ASP 211 Cb 0.95 0.88 0.00 0.00 -0.02 0.00 0.00 41.12 42.93 3h0e n ASP 211 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3h0e n GLY 212 N 1.23 -1.85 3.79 0.44 0.00 0.15 -4.74 105.19 104.22 3h0e n GLY 212 Ca 0.03 -1.64 -0.34 0.00 0.00 0.00 0.00 46.02 44.06 3h0e n GLY 212 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3h0e s SER 213 N -4.00 6.42 0.20 1.61 1.04 -1.26 -0.31 113.70 117.40 3h0e s SER 213 Ca 0.00 1.95 -0.10 0.00 0.48 0.00 0.00 55.95 58.28 3h0e s SER 213 Cb 0.00 -2.57 0.23 0.00 0.10 0.00 0.00 66.02 63.79 3h0e s SER 213 CO 0.00 -0.73 1.77 -0.50 0.98 0.00 0.00 173.24 174.77 3h0e h TRP 214 N 1.74 0.51 0.10 5.02 6.55 -1.76 -1.39 115.95 126.71 3h0e h TRP 214 Ca -0.49 0.03 -0.00 0.00 0.95 0.00 0.00 58.89 59.37 3h0e h TRP 214 Cb 1.22 -0.14 0.00 0.00 -0.86 0.00 0.00 29.16 29.38 3h0e h TRP 214 CO 0.57 0.20 -0.05 0.35 -1.05 0.00 0.00 178.44 178.46 3h0e h PHE 215 N 0.52 -0.12 -0.57 0.49 3.57 -1.89 -1.37 116.94 117.57 3h0e h PHE 215 Ca 0.28 -0.00 -0.07 0.00 3.53 0.00 0.00 57.97 61.71 3h0e h PHE 215 Cb 0.26 0.04 -0.02 0.00 2.79 0.00 0.00 35.95 39.02 3h0e h PHE 215 CO -0.12 0.22 0.07 0.82 -2.23 0.00 0.00 178.31 177.07 3h0e h ILE 216 N -0.48 1.26 -0.26 1.41 1.08 -1.93 0.26 117.51 118.85 3h0e h ILE 216 Ca -0.01 -1.02 0.06 0.00 -0.39 0.00 0.00 64.86 63.50 3h0e h ILE 216 Cb 0.40 0.81 -0.08 0.00 -3.07 0.00 0.00 36.82 34.88 3h0e h ILE 216 CO 0.02 0.37 -0.30 -0.61 -0.69 0.00 0.00 178.15 176.94 3h0e h GLN 217 N 0.85 -0.29 -0.45 2.37 4.15 -1.25 -0.89 115.11 119.59 3h0e h GLN 217 Ca 0.17 0.02 -0.13 0.00 0.77 0.00 0.00 58.65 59.48 3h0e h GLN 217 Cb 0.45 0.07 -0.01 0.00 0.21 0.00 0.00 27.48 28.19 3h0e h GLN 217 CO 0.02 -0.20 -0.23 0.77 -1.93 0.00 0.00 178.83 177.26 3h0e h SER 218 N -0.31 0.96 -0.29 -0.69 0.02 -0.84 -2.70 113.55 109.71 3h0e h SER 218 Ca 0.13 -0.37 -0.01 0.00 -0.84 0.00 0.00 61.79 60.71 3h0e h SER 218 Cb 0.52 -0.27 -0.01 0.00 0.14 0.00 0.00 62.40 62.78 3h0e h SER 218 CO -0.43 1.15 0.16 0.25 -1.14 0.00 0.00 176.83 176.82 3h0e h LEU 219 N 0.81 0.36 -0.50 5.07 5.85 -0.17 -1.05 115.31 125.68 3h0e h LEU 219 Ca 0.10 -0.08 -0.03 0.00 0.84 0.00 0.00 57.88 58.71 3h0e h LEU 219 Cb 0.80 -0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.71 3h0e h LEU 219 CO 0.07 0.34 0.21 0.00 -0.34 0.00 0.00 178.44 178.72 3h0e h ALA 221 N 1.06 0.83 -0.19 0.00 0.00 -1.28 -0.72 119.26 118.95 3h0e h ALA 221 Ca 0.17 -0.07 -0.17 0.00 0.00 0.00 0.00 54.91 54.84 3h0e h ALA 221 Cb 0.18 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.70 3h0e h ALA 221 CO -0.02 0.30 -0.57 0.52 0.00 0.00 0.00 179.25 179.48 3h0e h MET 222 N 0.88 0.61 -0.59 0.00 2.07 -1.04 -1.70 114.93 115.17 3h0e h MET 222 Ca 0.23 -0.40 -0.06 0.00 -2.07 0.00 0.00 59.70 57.41 3h0e h MET 222 Cb -0.04 0.05 -0.02 0.00 -1.87 0.00 0.00 31.60 29.72 3h0e h MET 222 CO -0.04 1.01 0.13 -0.07 1.07 0.00 0.00 176.91 179.00 3h0e h LEU 223 N 0.46 0.90 -0.82 1.22 3.38 -1.06 0.13 115.31 119.53 3h0e h LEU 223 Ca 0.00 -0.24 -0.07 0.00 0.09 0.00 0.00 57.88 57.66 3h0e h LEU 223 Cb 1.13 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 41.62 3h0e h LEU 223 CO 0.11 0.91 0.14 0.11 0.09 0.00 0.00 178.44 179.80 3h0e h LYS 224 N 0.85 1.02 0.08 1.13 1.57 -1.00 -0.80 116.57 119.42 3h0e h LYS 224 Ca 0.18 -0.24 -0.26 0.00 -1.87 0.00 0.00 60.65 58.46 3h0e h LYS 224 Cb 0.37 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 32.54 3h0e h LYS 224 CO 0.01 0.92 -1.26 0.37 -0.57 0.00 0.00 179.45 178.92 3h0e h GLN 225 N 0.97 0.16 0.00 3.15 4.15 -1.14 -3.41 115.11 119.00 3h0e h GLN 225 Ca 0.20 -0.28 0.00 0.00 0.77 0.00 0.00 58.65 59.34 3h0e h GLN 225 Cb 0.37 0.10 0.00 0.00 0.21 0.00 0.00 27.48 28.17 3h0e h GLN 225 CO 0.00 1.08 0.00 0.66 -1.93 0.00 0.00 178.83 178.65 3h0e n TYR 226 N -3.43 0.00 0.31 3.99 4.01 0.45 -4.71 117.16 117.79 3h0e n TYR 226 Ca -0.08 0.00 0.19 0.00 -0.16 0.00 0.00 57.90 57.85 3h0e n TYR 226 Cb 1.00 0.00 1.01 0.00 -0.31 0.00 0.00 39.34 41.05 3h0e n TYR 226 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3h0e h ALA 227 N 0.00 1.28 -0.56 -0.72 0.00 -1.27 -0.86 119.26 117.13 3h0e h ALA 227 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3h0e h ALA 227 Cb 0.02 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.81 3h0e h ALA 227 CO 0.00 -0.16 0.00 -0.40 0.00 0.00 0.00 179.25 178.69 3h0e n ASP 228 N -3.18 4.59 0.00 0.00 5.75 -1.26 -4.04 116.55 118.40 3h0e n ASP 228 Ca -0.02 -2.54 0.00 0.00 -0.01 0.00 0.00 54.79 52.23 3h0e n ASP 228 Cb 0.22 -0.55 0.00 0.00 -1.03 0.00 0.00 41.12 39.75 3h0e n ASP 228 CO 0.00 0.00 0.00 2.29 -0.11 0.00 0.00 177.20 179.38 3h0e n LYS 229 N 0.79 0.00 -4.41 0.11 2.85 -0.45 -5.00 118.16 112.04 3h0e n LYS 229 Ca 0.24 0.00 -0.25 0.00 -1.05 0.00 0.00 58.31 57.25 3h0e n LYS 229 Cb 0.88 -0.00 -0.13 0.00 -0.65 0.00 0.00 35.03 35.13 3h0e n LYS 229 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 177.40 176.84 3h0e s LEU 230 N 0.00 2.27 0.53 -5.58 1.43 -0.47 -5.13 118.68 111.74 3h0e s LEU 230 Ca 0.00 -0.66 -0.20 0.00 -1.03 0.00 0.00 54.13 52.25 3h0e s LEU 230 Cb 0.00 -0.98 -0.06 0.00 0.03 0.00 0.00 46.19 45.18 3h0e s LEU 230 CO 0.00 0.11 1.13 -0.70 0.23 0.00 0.00 176.35 177.13 3h0e s GLU 231 N -1.74 3.41 0.26 1.70 -6.30 -1.26 -4.73 118.70 110.03 3h0e s GLU 231 Ca 0.08 1.63 -0.02 0.00 -2.50 0.00 0.00 54.97 54.16 3h0e s GLU 231 Cb -0.10 -2.05 0.52 0.00 0.00 0.00 0.00 34.13 32.50 3h0e s GLU 231 CO 0.04 -0.81 1.74 0.35 0.02 0.00 0.00 175.26 176.60 3h0e h PHE 232 N 1.30 0.63 -0.40 5.30 3.57 -1.41 -0.58 116.94 125.36 3h0e h PHE 232 Ca -0.50 0.04 -0.05 0.00 3.53 0.00 0.00 57.97 60.99 3h0e h PHE 232 Cb 1.26 -0.16 -0.02 0.00 2.79 0.00 0.00 35.95 39.82 3h0e h PHE 232 CO 0.51 0.10 0.05 0.52 -2.23 0.00 0.00 178.31 177.26 3h0e h MET 233 N 0.51 0.61 -0.04 1.11 2.86 -1.92 -0.57 114.93 117.49 3h0e h MET 233 Ca 0.45 -0.12 -0.15 0.00 -2.06 0.00 0.00 59.70 57.82 3h0e h MET 233 Cb 0.69 -0.09 -0.01 0.00 0.06 0.00 0.00 31.60 32.24 3h0e h MET 233 CO -0.40 0.60 -0.65 0.45 1.06 0.00 0.00 176.91 177.97 3h0e h HIS 234 N 0.59 0.22 -0.24 -0.22 3.86 -1.52 -1.61 115.15 116.22 3h0e h HIS 234 Ca 0.13 -0.09 -0.02 0.00 -1.16 0.00 0.00 60.37 59.23 3h0e h HIS 234 Cb 0.30 -0.04 -0.01 0.00 1.06 0.00 0.00 27.41 28.73 3h0e h HIS 234 CO 0.01 0.76 0.09 0.82 0.86 0.00 0.00 177.93 180.47 3h0e h ILE 235 N 0.12 1.18 0.00 2.45 2.04 -0.58 -2.70 117.51 120.02 3h0e h ILE 235 Ca -0.01 -0.55 -0.07 0.00 1.00 0.00 0.00 64.86 65.23 3h0e h ILE 235 Cb 1.16 1.09 -0.01 0.00 -0.74 0.00 0.00 36.82 38.32 3h0e h ILE 235 CO 0.10 0.18 -0.33 -0.07 0.00 0.00 0.00 178.15 178.03 3h0e h LEU 236 N 0.23 0.00 -0.72 1.44 3.38 -1.00 -1.76 115.31 116.89 3h0e h LEU 236 Ca 0.08 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.95 3h0e h LEU 236 Cb 0.20 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.93 3h0e h LEU 236 CO -0.01 0.33 -0.11 0.74 0.09 0.00 0.00 178.44 179.48 3h0e h THR 237 N 0.00 1.26 -0.14 0.22 2.02 -1.19 -0.05 112.91 115.03 3h0e h THR 237 Ca -0.00 -1.21 -0.11 0.00 0.77 0.00 0.00 66.41 65.86 3h0e h THR 237 Cb 0.60 1.01 -0.01 0.00 -1.74 0.00 0.00 68.15 68.01 3h0e h THR 237 CO 0.04 0.42 -0.41 0.03 0.37 0.00 0.00 175.52 175.97 3h0e h ARG 238 N 0.79 0.32 -0.33 6.66 3.08 -1.08 -1.40 114.38 122.42 3h0e h ARG 238 Ca 0.13 -0.15 -0.01 0.00 0.07 0.00 0.00 59.98 60.02 3h0e h ARG 238 Cb 0.62 -0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.65 3h0e h ARG 238 CO 0.04 0.68 0.18 0.28 -1.07 0.00 0.00 179.97 180.08 3h0e h VAL 239 N 0.27 1.14 -0.33 2.04 2.07 -1.02 0.49 116.25 120.91 3h0e h VAL 239 Ca 0.02 -0.36 0.07 0.00 0.82 0.00 0.00 66.70 67.25 3h0e h VAL 239 Cb 0.84 0.77 -0.08 0.00 -1.52 0.00 0.00 31.29 31.30 3h0e h VAL 239 CO 0.07 0.14 -0.18 0.78 0.02 0.00 0.00 177.57 178.40 3h0e h ASN 240 N 0.42 -0.59 -0.52 0.57 4.21 -0.63 -0.53 115.58 118.51 3h0e h ASN 240 Ca 0.12 0.13 -0.04 0.00 1.21 0.00 0.00 56.30 57.72 3h0e h ASN 240 Cb 0.06 0.32 -0.02 0.00 -1.12 0.00 0.00 38.32 37.56 3h0e h ASN 240 CO -0.02 -0.21 0.18 -0.09 -1.29 0.00 0.00 177.43 176.00 3h0e h ARG 241 N -0.13 0.79 0.28 0.81 2.43 -1.08 -0.99 114.38 116.50 3h0e h ARG 241 Ca 0.17 -0.16 -0.01 0.00 -0.81 0.00 0.00 59.98 59.16 3h0e h ARG 241 Cb 0.39 -0.12 0.00 0.00 -0.42 0.00 0.00 29.97 29.82 3h0e h ARG 241 CO -0.41 0.72 -0.13 -0.22 -1.51 0.00 0.00 179.97 178.42 3h0e h LYS 242 N 0.70 -0.36 -0.61 0.20 3.64 -0.51 -0.25 116.57 119.38 3h0e h LYS 242 Ca 0.17 0.02 0.06 0.00 -1.27 0.00 0.00 60.65 59.64 3h0e h LYS 242 Cb 0.25 0.08 -0.06 0.00 -0.41 0.00 0.00 32.23 32.09 3h0e h LYS 242 CO -0.01 -0.22 0.31 0.28 -2.27 0.00 0.00 179.45 177.54 3h0e h VAL 243 N -0.40 0.93 -0.24 2.00 2.07 -1.09 -0.61 116.25 118.90 3h0e h VAL 243 Ca -0.04 -0.20 -0.11 0.00 0.82 0.00 0.00 66.70 67.17 3h0e h VAL 243 Cb 0.31 0.29 -0.01 0.00 -1.52 0.00 0.00 31.29 30.36 3h0e h VAL 243 CO 0.06 0.11 -0.33 0.00 0.02 0.00 0.00 177.57 177.43 3h0e h ALA 244 N 1.34 0.98 0.00 1.67 0.00 -0.88 -3.24 119.26 119.13 3h0e h ALA 244 Ca 0.28 -0.39 -0.36 0.00 0.00 0.00 0.00 54.91 54.44 3h0e h ALA 244 Cb 0.21 -0.11 -0.07 0.00 0.00 0.00 0.00 17.79 17.82 3h0e h ALA 244 CO -0.20 0.60 -2.37 0.25 0.00 0.00 0.00 179.25 177.54 3h0e n THR 245 N -4.07 1.37 1.09 0.00 -2.24 -0.13 -4.60 114.28 105.70 3h0e n THR 245 Ca -0.01 -0.68 0.12 0.00 -2.27 0.00 0.00 64.05 61.21 3h0e n THR 245 Cb 0.46 -0.93 0.14 0.00 -2.10 0.00 0.00 70.33 67.91 3h0e n THR 245 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3h0e n GLU 246 N -2.97 1.36 -5.20 -0.78 1.02 -0.25 -4.90 120.64 108.92 3h0e n GLU 246 Ca -0.38 -1.05 -0.30 0.00 -0.02 0.00 0.00 57.16 55.41 3h0e n GLU 246 Cb 1.05 -1.48 -0.16 0.00 -0.02 0.00 0.00 31.44 30.83 3h0e n GLU 246 CO 0.00 0.00 0.00 -0.06 1.18 0.00 0.00 177.13 178.25 3h0e s PHE 247 N -2.36 2.30 -0.21 -0.32 0.40 -1.22 -5.05 117.98 111.52 3h0e s PHE 247 Ca 0.23 -0.64 -0.13 0.00 -0.60 0.00 0.00 56.93 55.79 3h0e s PHE 247 Cb 0.19 -1.51 0.06 0.00 0.51 0.00 0.00 43.02 42.27 3h0e s PHE 247 CO 0.50 -0.18 0.51 -2.00 0.70 0.00 0.00 175.22 174.75 3h0e s GLU 248 N -0.20 0.53 0.52 0.44 2.12 -1.26 -4.72 118.70 116.12 3h0e s GLU 248 Ca -0.02 0.91 -0.21 0.00 0.36 0.00 0.00 54.97 56.02 3h0e s GLU 248 Cb -0.13 0.08 -0.06 0.00 0.26 0.00 0.00 34.13 34.28 3h0e s GLU 248 CO 0.03 -0.14 1.15 -1.54 -0.54 0.00 0.00 175.26 174.22 3h0e s SER 249 N 1.29 5.83 -0.10 -1.70 1.04 -0.74 -4.88 113.70 114.45 3h0e s SER 249 Ca -0.08 2.25 0.01 0.00 0.48 0.00 0.00 55.95 58.62 3h0e s SER 249 Cb -0.07 -2.59 0.02 0.00 0.10 0.00 0.00 66.02 63.48 3h0e s SER 249 CO -0.13 -1.15 -0.13 0.12 0.98 0.00 0.00 173.24 172.94 3h0e s PHE 250 N -1.67 1.75 -0.07 5.02 5.36 -1.26 -0.65 117.98 126.47 3h0e s PHE 250 Ca 0.70 -0.79 -0.11 0.00 -0.96 0.00 0.00 56.93 55.76 3h0e s PHE 250 Cb -0.26 -1.30 0.02 0.00 -0.34 0.00 0.00 43.02 41.14 3h0e s PHE 250 CO 0.31 -0.43 0.28 0.45 -1.46 0.00 0.00 175.22 174.36 3h0e s SER 251 N 1.03 -0.23 0.53 6.13 0.15 -1.26 -4.94 113.70 115.10 3h0e s SER 251 Ca -0.07 0.35 0.31 0.00 0.70 0.00 0.00 55.95 57.24 3h0e s SER 251 Cb -0.15 0.47 1.28 0.00 -1.71 0.00 0.00 66.02 65.91 3h0e s SER 251 CO -0.01 -0.23 1.96 -0.26 1.20 0.00 0.00 173.24 175.89 3h0e h PHE 252 N 4.99 0.00 -3.51 3.44 0.04 -2.01 -3.40 116.94 116.49 3h0e h PHE 252 Ca -0.28 0.00 -0.61 0.00 2.80 0.00 0.00 57.97 59.88 3h0e h PHE 252 Cb 1.19 0.00 -0.12 0.00 2.20 0.00 0.00 35.95 39.22 3h0e h PHE 252 CO 0.46 0.06 0.28 0.34 -0.60 0.00 0.00 178.31 178.85 3h0e s ASP 253 N -5.83 6.54 0.43 2.17 -1.08 -1.26 -4.95 116.67 112.70 3h0e s ASP 253 Ca 0.01 0.42 0.15 0.00 -0.52 0.00 0.00 52.55 52.61 3h0e s ASP 253 Cb 0.10 -2.37 1.04 0.00 -1.46 0.00 0.00 42.92 40.23 3h0e s ASP 253 CO 0.57 -0.60 1.94 0.00 0.52 0.00 0.00 175.17 177.59 3h0e h ALA 254 N 8.29 2.08 -0.43 3.66 0.00 -1.96 -1.54 119.26 129.36 3h0e h ALA 254 Ca -0.25 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.64 3h0e h ALA 254 Cb 1.10 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.80 3h0e h ALA 254 CO 0.86 -0.26 0.23 1.15 0.00 0.00 0.00 179.25 181.24 3h0e h THR 255 N 0.41 1.13 -0.68 0.00 2.02 -1.93 -2.44 112.91 111.43 3h0e h THR 255 Ca 0.34 -0.33 0.00 0.00 0.77 0.00 0.00 66.41 67.19 3h0e h THR 255 Cb 0.74 0.56 0.00 0.00 -1.74 0.00 0.00 68.15 67.70 3h0e h THR 255 CO -0.10 0.14 0.00 0.49 0.37 0.00 0.00 175.52 176.42 3h0e n PHE 256 N -4.43 1.00 -3.82 3.16 3.72 -0.60 -4.98 117.46 111.52 3h0e n PHE 256 Ca 0.03 -0.52 -0.35 0.00 -0.05 0.00 0.00 57.45 56.56 3h0e n PHE 256 Cb 0.09 -0.04 -0.05 0.00 -0.94 0.00 0.00 39.48 38.54 3h0e n PHE 256 CO 0.00 0.00 0.00 -1.58 -0.05 0.00 0.00 176.76 175.13 3h0e s HIS 257 N -1.14 3.58 -1.61 1.38 2.46 -0.92 -4.41 115.29 114.62 3h0e s HIS 257 Ca 0.46 0.51 0.00 0.00 0.47 0.00 0.00 55.06 56.51 3h0e s HIS 257 Cb 0.25 -1.94 0.00 0.00 -0.13 0.00 0.00 32.58 30.76 3h0e s HIS 257 CO 0.30 0.64 0.00 0.00 -2.47 0.00 0.00 174.74 173.21 3h0e n ALA 258 N 1.23 -0.48 -2.29 1.58 0.00 0.18 -4.96 120.51 115.77 3h0e n ALA 258 Ca -0.13 0.17 -0.28 0.00 0.00 0.00 0.00 53.44 53.20 3h0e n ALA 258 Cb 0.53 -1.94 -0.02 0.00 0.00 0.00 0.00 19.45 18.03 3h0e n ALA 258 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 3h0e s LYS 259 N -4.63 3.63 0.31 0.00 -0.14 -1.26 -4.74 119.74 112.92 3h0e s LYS 259 Ca 0.00 0.24 0.04 0.00 -1.36 0.00 0.00 55.97 54.90 3h0e s LYS 259 Cb 0.00 -2.43 -0.06 0.00 -1.68 0.00 0.00 37.83 33.66 3h0e s LYS 259 CO 0.00 -0.08 0.04 0.15 -0.76 0.00 0.00 175.35 174.70 3h0e s LYS 260 N -4.26 1.60 -0.09 1.68 -0.14 0.12 -1.78 119.74 116.88 3h0e s LYS 260 Ca 0.48 -1.87 -0.09 0.00 -1.36 0.00 0.00 55.97 53.13 3h0e s LYS 260 Cb -0.10 -0.88 0.02 0.00 -1.68 0.00 0.00 37.83 35.19 3h0e s LYS 260 CO 0.38 -0.15 0.24 -1.14 -0.76 0.00 0.00 175.35 173.92 3h0e s GLN 261 N -3.87 0.30 -0.09 1.68 0.74 -1.26 -4.06 119.66 113.10 3h0e s GLN 261 Ca 0.35 0.29 0.02 0.00 0.05 0.00 0.00 55.36 56.07 3h0e s GLN 261 Cb 0.08 0.15 0.01 0.00 1.10 0.00 0.00 33.01 34.35 3h0e s GLN 261 CO 0.14 -0.04 -0.14 -1.50 -0.55 0.00 0.00 175.29 173.20 3h0e s ILE 262 N 0.03 1.37 1.16 -2.34 1.10 -1.26 -3.60 121.20 117.66 3h0e s ILE 262 Ca -0.01 -0.58 -0.19 0.00 -0.51 0.00 0.00 60.65 59.36 3h0e s ILE 262 Cb -0.02 -1.25 0.27 0.00 0.15 0.00 0.00 42.46 41.61 3h0e s ILE 262 CO 0.00 0.41 1.14 -2.84 -2.11 0.00 0.00 174.94 171.55 3h0e s PRO 263 N 0.87 -0.91 -0.23 3.50 0.02 -1.24 -1.74 135.00 135.26 3h0e s PRO 263 Ca -0.10 -0.10 -0.04 0.00 0.02 0.00 0.00 61.00 60.79 3h0e s PRO 263 Cb -0.15 -1.64 0.09 0.00 0.02 0.00 0.00 34.50 32.82 3h0e s PRO 263 CO 0.01 -3.50 0.17 0.00 -0.33 0.00 0.00 177.00 173.35 3h0e s ILE 265 N 2.21 4.85 -0.31 0.00 1.01 -1.26 -1.53 121.20 126.18 3h0e s ILE 265 Ca 0.07 1.53 0.01 0.00 0.00 0.00 0.00 60.65 62.25 3h0e s ILE 265 Cb -0.16 -4.10 0.07 0.00 0.01 0.00 0.00 42.46 38.29 3h0e s ILE 265 CO -0.22 -0.06 -0.01 -0.69 0.00 0.00 0.00 174.94 173.96 3h0e s VAL 266 N 2.78 2.58 -0.20 2.92 1.01 -0.28 -5.01 120.40 124.21 3h0e s VAL 266 Ca 0.34 -1.74 -0.03 0.00 0.00 0.00 0.00 61.98 60.55 3h0e s VAL 266 Cb -0.15 -2.61 -0.01 0.00 0.00 0.00 0.00 36.38 33.60 3h0e s VAL 266 CO 0.08 -0.24 -0.06 -0.55 0.00 0.00 0.00 175.10 174.32 3h0e s SER 267 N 1.19 4.26 -0.19 3.32 0.15 -1.26 -0.30 113.70 120.87 3h0e s SER 267 Ca -0.02 -0.36 0.16 0.00 0.70 0.00 0.00 55.95 56.43 3h0e s SER 267 Cb -0.20 -1.71 0.57 0.00 -1.71 0.00 0.00 66.02 62.96 3h0e s SER 267 CO -0.04 0.03 1.47 0.23 1.20 0.00 0.00 173.24 176.13 3h0e n MET 268 N 4.43 3.11 -2.25 5.44 2.81 0.08 -5.03 117.12 125.70 3h0e n MET 268 Ca -0.18 -2.90 -0.35 0.00 -1.81 0.00 0.00 57.70 52.45 3h0e n MET 268 Cb 0.51 -1.90 0.00 0.00 -0.71 0.00 0.00 33.22 31.12 3h0e n MET 268 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 3h0e s LEU 269 N -2.85 3.79 0.00 4.03 1.43 -1.17 -0.92 118.68 123.00 3h0e s LEU 269 Ca 0.44 2.21 0.12 0.00 -1.03 0.00 0.00 54.13 55.86 3h0e s LEU 269 Cb 0.36 -4.52 -0.02 0.00 0.03 0.00 0.00 46.19 42.04 3h0e s LEU 269 CO 0.09 -1.18 0.67 0.35 0.23 0.00 0.00 176.35 176.51 3h0e n THR 270 N -1.17 0.00 -4.08 5.49 -2.24 -1.26 -4.84 114.28 106.18 3h0e n THR 270 Ca 0.11 -0.37 -0.09 0.00 -2.27 0.00 0.00 64.05 61.43 3h0e n THR 270 Cb 0.50 1.12 -0.09 0.00 -2.10 0.00 0.00 70.33 69.76 3h0e n THR 270 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 3h0e s LYS 271 N -1.55 0.89 0.44 -0.78 1.02 -1.26 -5.00 119.74 113.50 3h0e s LYS 271 Ca 0.09 -1.31 -0.23 0.00 0.02 0.00 0.00 55.97 54.55 3h0e s LYS 271 Cb 0.09 0.27 -0.08 0.00 -0.52 0.00 0.00 37.83 37.59 3h0e s LYS 271 CO 0.31 -0.26 1.07 -1.21 -0.92 0.00 0.00 175.35 174.34 3h0e s GLU 272 N -3.99 3.98 -0.22 1.68 2.02 -0.27 -4.76 118.70 117.14 3h0e s GLU 272 Ca 0.18 1.53 0.02 0.00 0.02 0.00 0.00 54.97 56.71 3h0e s GLU 272 Cb 0.07 -2.39 0.05 0.00 0.10 0.00 0.00 34.13 31.95 3h0e s GLU 272 CO -0.02 -0.31 -0.12 -1.17 0.02 0.00 0.00 175.26 173.66 3h0e s LEU 273 N -2.95 2.63 -0.07 1.80 2.96 -1.26 -0.96 118.68 120.84 3h0e s LEU 273 Ca 0.62 -1.03 0.03 0.00 -0.22 0.00 0.00 54.13 53.52 3h0e s LEU 273 Cb -0.22 -1.36 -0.02 0.00 0.50 0.00 0.00 46.19 45.08 3h0e s LEU 273 CO 0.27 -0.14 -0.14 -0.31 -1.32 0.00 0.00 176.35 174.71 3h0e s TYR 274 N 1.29 2.74 -2.05 5.38 2.02 -1.26 -0.86 117.35 124.60 3h0e s TYR 274 Ca -0.03 -0.24 0.28 0.00 -0.37 0.00 0.00 57.07 56.70 3h0e s TYR 274 Cb -0.17 -1.68 1.04 0.00 -0.40 0.00 0.00 41.96 40.75 3h0e s TYR 274 CO -0.08 0.12 1.74 1.19 -1.57 0.00 0.00 175.55 176.94 3h0e n PHE 275 N 2.55 0.00 0.42 2.71 3.72 -1.26 -4.91 117.46 120.69 3h0e n PHE 275 Ca -0.17 0.00 0.05 0.00 -0.05 0.00 0.00 57.45 57.28 3h0e n PHE 275 Cb 0.52 -0.07 0.04 0.00 -0.94 0.00 0.00 39.48 39.03 3h0e n PHE 275 CO 0.00 0.00 0.00 2.48 -0.05 0.00 0.00 176.76 179.19