#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2x5a s ILE 3 N 0.00 3.18 -0.29 2.28 1.01 -1.26 -5.09 121.20 121.03 2x5a s ILE 3 Ca 0.00 -0.57 -0.09 0.00 0.00 0.00 0.00 60.65 59.99 2x5a s ILE 3 Cb 0.00 -2.41 -0.02 0.00 0.01 0.00 0.00 42.46 40.05 2x5a s ILE 3 CO 0.00 0.46 0.12 -0.54 0.00 0.00 0.00 174.94 174.99 2x5a s LYS 4 N 1.14 3.47 -0.05 2.79 -0.14 -1.26 -5.09 119.74 120.60 2x5a s LYS 4 Ca 0.01 -0.62 -0.07 0.00 -1.36 0.00 0.00 55.97 53.93 2x5a s LYS 4 Cb -0.14 -3.48 -0.04 0.00 -1.68 0.00 0.00 37.83 32.48 2x5a s LYS 4 CO -0.02 -0.33 0.22 -0.80 -0.76 0.00 0.00 175.35 173.66 2x5a s ASN 5 N 1.62 6.47 0.08 2.83 -0.87 -1.26 -5.02 114.94 118.79 2x5a s ASN 5 Ca 0.05 0.54 0.00 0.00 -1.57 0.00 0.00 52.86 51.88 2x5a s ASN 5 Cb -0.16 -2.09 0.00 0.00 -0.02 0.00 0.00 41.25 38.98 2x5a s ASN 5 CO 0.05 0.33 0.00 0.49 -2.57 0.00 0.00 177.10 175.40 2x5a n PHE 6 N 1.54 -0.39 -1.37 2.20 3.01 -1.26 -4.75 117.46 116.44 2x5a n PHE 6 Ca -0.15 0.07 -0.31 0.00 1.01 0.00 0.00 57.45 58.07 2x5a n PHE 6 Cb 0.54 0.15 -0.06 0.00 -0.01 0.00 0.00 39.48 40.09 2x5a n PHE 6 CO 0.00 0.00 0.00 2.41 1.01 0.00 0.00 176.76 180.18 2x5a n THR 7 N -3.21 4.06 -3.95 4.37 -1.04 -1.26 -4.83 114.28 108.42 2x5a n THR 7 Ca 0.00 -2.66 -0.10 0.00 -2.04 0.00 0.00 64.05 59.26 2x5a n THR 7 Cb 0.17 -2.27 -0.10 0.00 -1.82 0.00 0.00 70.33 66.31 2x5a n THR 7 CO 0.00 0.00 0.00 -0.36 -0.64 0.00 0.00 175.07 174.07 2x5a s PHE 8 N 0.90 0.20 0.24 -1.42 0.40 -1.26 -5.15 117.98 111.89 2x5a s PHE 8 Ca 0.65 -0.42 -0.30 0.00 -0.60 0.00 0.00 56.93 56.27 2x5a s PHE 8 Cb 0.24 -0.15 -0.09 0.00 0.51 0.00 0.00 43.02 43.53 2x5a s PHE 8 CO -0.07 -0.24 1.17 -0.59 0.70 0.00 0.00 175.22 176.20 2x5a s PHE 9 N -1.62 3.44 -0.54 0.36 -0.12 -1.26 -4.81 117.98 113.42 2x5a s PHE 9 Ca -0.14 1.53 -0.17 0.00 -0.05 0.00 0.00 56.93 58.10 2x5a s PHE 9 Cb -0.08 -3.41 0.12 0.00 -0.63 0.00 0.00 43.02 39.02 2x5a s PHE 9 CO -0.01 -1.04 0.53 -1.12 -0.05 0.00 0.00 175.22 173.54 2x5a s SER 10 N -0.32 6.18 0.40 1.98 0.01 -1.26 -4.86 113.70 115.83 2x5a s SER 10 Ca 0.49 -1.64 0.13 0.00 1.31 0.00 0.00 55.95 56.25 2x5a s SER 10 Cb -0.33 -2.23 0.97 0.00 0.21 0.00 0.00 66.02 64.64 2x5a s SER 10 CO 0.40 -0.89 1.90 -0.65 0.41 0.00 0.00 173.24 174.41 2x5a h PRO 11 N 8.94 0.50 -0.33 12.44 0.11 -2.00 -1.77 132.00 149.89 2x5a h PRO 11 Ca -0.30 -0.03 -0.09 0.00 0.11 0.00 0.00 66.00 65.70 2x5a h PRO 11 Cb 1.10 -0.11 -0.05 0.00 0.11 0.00 0.00 31.00 32.04 2x5a h PRO 11 CO 1.03 0.33 0.01 0.09 -0.21 0.00 0.00 178.00 179.25 2x5a n ASN 12 N -4.51 3.41 -0.85 -2.05 3.02 -1.26 -4.96 115.26 108.07 2x5a n ASN 12 Ca 0.16 -3.31 -0.10 0.00 -0.03 0.00 0.00 54.58 51.30 2x5a n ASN 12 Cb 0.52 -0.59 -0.04 0.00 -0.61 0.00 0.00 39.78 39.05 2x5a n ASN 12 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 2x5a n SER 13 N -0.75 -5.18 0.00 6.41 7.64 -0.67 -4.75 113.62 116.33 2x5a n SER 13 Ca 0.27 0.26 0.00 0.00 1.01 0.00 0.00 58.87 60.41 2x5a n SER 13 Cb 0.99 -3.88 0.00 0.00 -1.01 0.00 0.00 64.21 60.30 2x5a n SER 13 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 2x5a n THR 14 N -2.05 0.00 0.10 0.44 -2.24 -1.26 -4.93 114.28 104.34 2x5a n THR 14 Ca -0.10 -0.00 -0.12 0.00 -2.27 0.00 0.00 64.05 61.55 2x5a n THR 14 Cb 0.54 0.29 -0.05 0.00 -2.10 0.00 0.00 70.33 69.01 2x5a n THR 14 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 2x5a h GLU 15 N 0.00 -0.43 -2.54 -0.78 3.07 -1.88 -3.38 114.58 108.64 2x5a h GLU 15 Ca 0.00 0.03 -0.60 0.00 -0.50 0.00 0.00 59.36 58.28 2x5a h GLU 15 Cb 0.00 0.10 -0.42 0.00 -0.84 0.00 0.00 28.75 27.59 2x5a h GLU 15 CO 0.00 -0.29 -0.64 1.19 -1.40 0.00 0.00 179.01 177.87 2x5a n PHE 16 N -5.38 3.00 -2.44 4.33 3.72 -1.26 -5.02 117.46 114.41 2x5a n PHE 16 Ca -0.06 -4.14 -0.40 0.00 -0.05 0.00 0.00 57.45 52.80 2x5a n PHE 16 Cb 0.29 -0.53 -0.04 0.00 -0.94 0.00 0.00 39.48 38.26 2x5a n PHE 16 CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 176.76 175.46 2x5a s PRO 17 N -1.87 4.60 -0.32 -1.08 0.04 -1.26 -4.85 135.00 130.26 2x5a s PRO 17 Ca 0.33 1.84 -0.12 0.00 0.04 0.00 0.00 61.00 63.09 2x5a s PRO 17 Cb 0.07 -3.19 -0.02 0.00 0.04 0.00 0.00 34.50 31.39 2x5a s PRO 17 CO -0.09 0.13 0.22 0.54 0.04 0.00 0.00 177.00 177.84 2x5a s VAL 18 N -0.94 5.21 0.62 -0.36 0.11 -1.26 -4.95 120.40 118.84 2x5a s VAL 18 Ca 0.46 -0.14 -0.10 0.00 -2.93 0.00 0.00 61.98 59.27 2x5a s VAL 18 Cb -0.32 -3.62 -0.03 0.00 -1.53 0.00 0.00 36.38 30.87 2x5a s VAL 18 CO 0.41 0.07 1.01 -0.83 -3.33 0.00 0.00 175.10 172.43 2x5a s GLY 19 N 1.72 1.64 0.36 6.54 0.00 -1.26 -4.96 107.32 111.36 2x5a s GLY 19 Ca 0.06 -0.20 0.10 0.00 0.00 0.00 0.00 44.72 44.68 2x5a s GLY 19 CO 0.10 0.08 1.84 1.48 0.00 0.00 0.00 173.10 176.60 2x5a h SER 20 N -0.32 0.14 0.01 1.64 4.64 -1.99 -2.19 113.55 115.49 2x5a h SER 20 Ca -0.45 -0.04 -0.13 0.00 -0.47 0.00 0.00 61.79 60.70 2x5a h SER 20 Cb 1.21 -0.04 -0.01 0.00 -0.31 0.00 0.00 62.40 63.25 2x5a h SER 20 CO 0.62 0.43 -0.43 -0.55 -0.87 0.00 0.00 176.83 176.03 2x5a h ASN 21 N 0.13 0.55 -0.32 4.97 -1.07 -1.94 0.03 115.58 117.93 2x5a h ASN 21 Ca 0.02 -0.25 -0.12 0.00 0.07 0.00 0.00 56.30 56.02 2x5a h ASN 21 Cb 0.57 -0.15 -0.01 0.00 -2.07 0.00 0.00 38.32 36.66 2x5a h ASN 21 CO 0.04 0.91 -0.27 0.78 0.07 0.00 0.00 177.43 178.96 2x5a h ASN 22 N 0.42 0.79 -0.16 6.14 4.21 -1.83 -1.37 115.58 123.78 2x5a h ASN 22 Ca 0.03 -0.46 -0.12 0.00 1.21 0.00 0.00 56.30 56.97 2x5a h ASN 22 Cb 0.93 -0.22 -0.01 0.00 -1.12 0.00 0.00 38.32 37.89 2x5a h ASN 22 CO 0.08 1.08 -0.30 0.44 -1.29 0.00 0.00 177.43 177.44 2x5a h ASP 23 N 0.51 0.67 -0.11 5.81 5.19 -1.34 -1.17 116.42 125.98 2x5a h ASP 23 Ca 0.06 -0.26 0.03 0.00 -0.62 0.00 0.00 57.03 56.24 2x5a h ASP 23 Cb 0.84 -0.19 -0.03 0.00 0.18 0.00 0.00 39.33 40.13 2x5a h ASP 23 CO 0.07 0.93 -0.09 1.23 -3.12 0.00 0.00 179.24 178.26 2x5a h GLY 24 N 1.00 -0.01 1.00 2.75 0.00 -0.78 0.11 103.07 107.14 2x5a h GLY 24 Ca 0.07 0.11 -0.04 0.00 0.00 0.00 0.00 47.33 47.46 2x5a h GLY 24 CO 0.06 -0.10 0.20 0.50 0.00 0.00 0.00 176.54 177.20 2x5a h LYS 25 N -0.11 0.91 -0.03 4.80 1.57 -1.14 -1.45 116.57 121.13 2x5a h LYS 25 Ca 0.07 -0.19 0.02 0.00 -1.87 0.00 0.00 60.65 58.69 2x5a h LYS 25 Cb 0.21 -0.14 -0.03 0.00 0.08 0.00 0.00 32.23 32.36 2x5a h LYS 25 CO -0.17 0.81 -0.12 1.25 -0.57 0.00 0.00 179.45 180.65 2x5a h LEU 26 N 0.84 -0.35 -0.74 2.94 5.85 -0.76 -1.32 115.31 121.76 2x5a h LEU 26 Ca 0.19 0.06 -0.02 0.00 0.84 0.00 0.00 57.88 58.95 2x5a h LEU 26 Cb 0.26 0.15 -0.03 0.00 0.37 0.00 0.00 40.66 41.41 2x5a h LEU 26 CO -0.01 -0.17 0.40 1.88 -0.34 0.00 0.00 178.44 180.20 2x5a h TYR 27 N -0.19 1.03 -0.75 1.25 0.05 -0.61 -0.94 116.97 116.81 2x5a h TYR 27 Ca 0.05 -0.03 0.02 0.00 0.05 0.00 0.00 58.73 58.82 2x5a h TYR 27 Cb 0.26 -0.33 -0.04 0.00 1.01 0.00 0.00 36.73 37.63 2x5a h TYR 27 CO -0.19 0.73 0.48 0.52 -1.05 0.00 0.00 178.16 178.65 2x5a h MET 28 N 1.03 0.94 -0.38 4.88 2.86 -1.00 -2.18 114.93 121.07 2x5a h MET 28 Ca 0.26 -0.06 -0.14 0.00 -2.06 0.00 0.00 59.70 57.70 2x5a h MET 28 Cb 0.05 -0.21 -0.01 0.00 0.06 0.00 0.00 31.60 31.49 2x5a h MET 28 CO -0.04 0.62 -0.32 0.52 1.06 0.00 0.00 176.91 178.75 2x5a h MET 29 N 0.97 0.84 -0.51 1.72 2.86 -0.76 -0.01 114.93 120.04 2x5a h MET 29 Ca 0.29 -0.40 -0.06 0.00 -2.06 0.00 0.00 59.70 57.47 2x5a h MET 29 Cb -0.05 -0.01 -0.02 0.00 0.06 0.00 0.00 31.60 31.59 2x5a h MET 29 CO -0.09 1.04 0.08 -0.07 1.06 0.00 0.00 176.91 178.94 2x5a h LEU 30 N 0.70 0.80 0.00 1.22 3.38 -0.88 -3.21 115.31 117.34 2x5a h LEU 30 Ca 0.07 -0.26 0.00 0.00 0.09 0.00 0.00 57.88 57.78 2x5a h LEU 30 Cb 0.88 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.42 2x5a h LEU 30 CO 0.08 0.86 -0.72 0.00 0.09 0.00 0.00 178.44 178.75 2x5a h THR 31 N 0.72 0.00 -3.59 0.22 1.03 -1.40 -3.49 112.91 106.40 2x5a h THR 31 Ca 0.15 -0.67 -0.11 0.00 -0.01 0.00 0.00 66.41 65.78 2x5a h THR 31 Cb 0.40 1.23 0.07 0.00 -1.07 0.00 0.00 68.15 68.78 2x5a h THR 31 CO 0.01 0.00 -0.30 0.61 -0.01 0.00 0.00 175.52 175.83 2x5a n GLY 32 N 1.28 0.15 3.39 2.99 0.00 -0.12 -4.63 105.19 108.24 2x5a n GLY 32 Ca 0.02 -0.13 -0.29 0.00 0.00 0.00 0.00 46.02 45.62 2x5a n GLY 32 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 2x5a s MET 33 N -4.06 1.48 0.07 1.61 0.23 -0.60 -0.09 119.30 117.94 2x5a s MET 33 Ca 0.07 -1.31 0.01 0.00 -1.03 0.00 0.00 55.69 53.43 2x5a s MET 33 Cb -0.01 -1.92 0.01 0.00 -1.53 0.00 0.00 34.83 31.38 2x5a s MET 33 CO 0.27 0.46 0.06 -0.40 -2.03 0.00 0.00 175.02 173.38 2x5a n ASP 34 N 1.03 0.92 -0.02 -1.18 5.68 -1.26 -4.68 116.55 117.03 2x5a n ASP 34 Ca -0.18 -1.21 0.16 0.00 -0.50 0.00 0.00 54.79 53.06 2x5a n ASP 34 Cb 0.53 -0.02 0.92 0.00 -1.14 0.00 0.00 41.12 41.41 2x5a n ASP 34 CO 0.00 0.00 0.00 -1.22 -1.33 0.00 0.00 177.20 174.65 2x5a n TYR 35 N -0.81 0.00 -0.29 2.11 4.01 -1.26 -3.62 117.16 117.31 2x5a n TYR 35 Ca 0.00 0.00 0.09 0.00 -0.16 0.00 0.00 57.90 57.84 2x5a n TYR 35 Cb 0.07 -0.01 0.25 0.00 -0.31 0.00 0.00 39.34 39.34 2x5a n TYR 35 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 2x5a n ARG 36 N -0.95 2.79 -4.33 -0.72 1.74 -1.26 -4.16 116.66 109.77 2x5a n ARG 36 Ca 0.23 -2.41 -0.20 0.00 -0.77 0.00 0.00 57.85 54.70 2x5a n ARG 36 Cb 0.13 -1.44 -0.08 0.00 -1.02 0.00 0.00 32.46 30.05 2x5a n ARG 36 CO 0.00 0.00 0.00 -0.08 -1.52 0.00 0.00 177.63 176.03 2x5a s THR 37 N -1.00 0.11 0.24 0.55 -1.32 -1.24 -4.95 115.64 108.03 2x5a s THR 37 Ca 0.38 -2.00 0.02 0.00 -1.21 0.00 0.00 61.69 58.88 2x5a s THR 37 Cb 0.20 -2.46 -0.04 0.00 -1.51 0.00 0.00 72.50 68.69 2x5a s THR 37 CO 0.26 0.00 0.18 0.27 -2.21 0.00 0.00 174.62 173.12 2x5a s ILE 38 N -3.43 0.01 -0.10 5.08 -0.00 -1.26 -4.60 121.20 116.91 2x5a s ILE 38 Ca 0.37 -2.00 0.04 0.00 -0.00 0.00 0.00 60.65 59.06 2x5a s ILE 38 Cb 0.02 -2.50 0.00 0.00 -0.00 0.00 0.00 42.46 39.99 2x5a s ILE 38 CO 0.25 0.00 -0.23 -0.13 -0.00 0.00 0.00 174.94 174.83 2x5a s ARG 39 N -3.93 2.90 -0.06 0.37 1.81 -0.73 -4.44 118.95 114.88 2x5a s ARG 39 Ca 0.39 -0.83 -0.05 0.00 -1.72 0.00 0.00 55.73 53.53 2x5a s ARG 39 Cb 0.06 -2.21 0.02 0.00 -0.45 0.00 0.00 34.95 32.36 2x5a s ARG 39 CO 0.17 0.15 0.14 0.50 -0.68 0.00 0.00 175.30 175.59 2x5a s ARG 40 N 0.40 0.16 -0.10 3.54 3.00 -1.26 -0.64 118.95 124.05 2x5a s ARG 40 Ca -0.18 0.23 -0.04 0.00 -1.00 0.00 0.00 55.73 54.74 2x5a s ARG 40 Cb -0.18 0.04 0.05 0.00 0.00 0.00 0.00 34.95 34.87 2x5a s ARG 40 CO 0.08 -0.04 0.19 0.21 0.00 0.00 0.00 175.30 175.74 2x5a s LYS 41 N 0.24 0.08 -0.62 5.12 2.47 -0.49 -5.00 119.74 121.55 2x5a s LYS 41 Ca -0.01 0.59 -0.22 0.00 -1.56 0.00 0.00 55.97 54.76 2x5a s LYS 41 Cb -0.03 -0.19 0.07 0.00 -1.46 0.00 0.00 37.83 36.22 2x5a s LYS 41 CO -0.01 -0.27 0.91 -0.51 0.16 0.00 0.00 175.35 175.63 2x5a s ASP 42 N 2.11 6.21 0.33 1.43 1.01 -1.26 -1.16 116.67 125.33 2x5a s ASP 42 Ca 0.00 -0.91 0.11 0.00 0.71 0.00 0.00 52.55 52.46 2x5a s ASP 42 Cb -0.12 -2.40 0.58 0.00 1.01 0.00 0.00 42.92 41.99 2x5a s ASP 42 CO -0.07 -1.34 1.75 -0.50 0.21 0.00 0.00 175.17 175.22 2x5a h TRP 43 N 9.45 0.05 -3.95 4.23 4.06 -1.19 -3.43 115.95 125.18 2x5a h TRP 43 Ca -0.28 -0.01 -0.30 0.00 2.06 0.00 0.00 58.89 60.36 2x5a h TRP 43 Cb 1.07 -0.01 -0.21 0.00 -1.00 0.00 0.00 29.16 29.01 2x5a h TRP 43 CO 0.93 0.48 -0.74 -1.54 -3.56 0.00 0.00 178.44 174.01 2x5a s SER 44 N -6.90 1.03 0.20 -3.49 1.04 -1.16 -5.04 113.70 99.38 2x5a s SER 44 Ca -0.03 -0.59 -0.31 0.00 0.48 0.00 0.00 55.95 55.50 2x5a s SER 44 Cb 0.14 0.02 -0.10 0.00 0.10 0.00 0.00 66.02 66.18 2x5a s SER 44 CO 0.74 -0.20 1.51 -0.44 0.98 0.00 0.00 173.24 175.83 2x5a s SER 45 N -1.71 6.62 0.63 7.02 0.01 -1.26 -4.29 113.70 120.71 2x5a s SER 45 Ca -0.07 2.63 -0.18 0.00 1.31 0.00 0.00 55.95 59.63 2x5a s SER 45 Cb -0.09 -2.61 -0.02 0.00 0.21 0.00 0.00 66.02 63.51 2x5a s SER 45 CO 0.00 -0.77 1.25 -2.84 0.41 0.00 0.00 173.24 171.29 2x5a s PRO 46 N 0.49 2.74 -0.14 12.44 0.02 -1.26 -4.54 135.00 144.75 2x5a s PRO 46 Ca 0.65 1.93 -0.01 0.00 0.02 0.00 0.00 61.00 63.59 2x5a s PRO 46 Cb -0.43 -1.89 -0.02 0.00 0.02 0.00 0.00 34.50 32.19 2x5a s PRO 46 CO 0.36 -1.42 -0.10 -0.51 -0.33 0.00 0.00 177.00 175.01 2x5a s LEU 47 N -4.27 2.92 -0.23 -5.54 1.43 0.62 -4.91 118.68 108.70 2x5a s LEU 47 Ca 0.80 -0.25 -0.13 0.00 -1.03 0.00 0.00 54.13 53.52 2x5a s LEU 47 Cb -0.33 -1.67 -0.04 0.00 0.03 0.00 0.00 46.19 44.17 2x5a s LEU 47 CO 0.37 0.17 0.27 0.20 0.23 0.00 0.00 176.35 177.59 2x5a s ASN 48 N 0.33 6.25 -0.16 2.29 0.01 -1.26 -0.01 114.94 122.40 2x5a s ASN 48 Ca -0.08 0.28 -0.03 0.00 -0.71 0.00 0.00 52.86 52.32 2x5a s ASN 48 Cb -0.15 -2.16 0.05 0.00 0.41 0.00 0.00 41.25 39.40 2x5a s ASN 48 CO 0.05 -0.01 0.04 0.42 -1.51 0.00 0.00 177.10 176.09 2x5a s THR 49 N 1.25 0.32 0.00 1.60 -4.23 -0.84 -5.00 115.64 108.74 2x5a s THR 49 Ca 0.13 -0.28 0.00 0.00 -1.18 0.00 0.00 61.69 60.35 2x5a s THR 49 Cb -0.14 -0.78 0.00 0.00 1.34 0.00 0.00 72.50 72.91 2x5a s THR 49 CO 0.06 -0.11 0.00 0.00 -0.54 0.00 0.00 174.62 174.03 2x5a n ALA 50 N 5.13 0.00 -2.06 3.99 0.00 -1.26 -2.15 120.51 124.17 2x5a n ALA 50 Ca -0.08 0.00 -0.38 0.00 0.00 0.00 0.00 53.44 52.98 2x5a n ALA 50 Cb 0.48 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.93 2x5a n ALA 50 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2x5a n LEU 51 N 0.00 7.68 -3.75 0.00 4.77 -1.26 -3.73 117.00 120.72 2x5a n LEU 51 Ca 0.00 -4.88 -0.13 0.00 -0.03 0.00 0.00 56.01 50.96 2x5a n LEU 51 Cb 0.00 -1.29 -0.09 0.00 -2.33 0.00 0.00 43.42 39.71 2x5a n LEU 51 CO 0.00 2.00 0.04 0.20 -1.33 0.00 0.00 177.39 178.30 2x5a s ASN 52 N -0.05 -0.26 -0.15 -1.43 0.01 -0.91 -0.40 114.94 111.75 2x5a s ASN 52 Ca 0.52 0.29 0.02 0.00 -0.71 0.00 0.00 52.86 52.97 2x5a s ASN 52 Cb 0.22 0.44 0.02 0.00 0.41 0.00 0.00 41.25 42.34 2x5a s ASN 52 CO -0.13 -0.36 -0.19 0.54 -1.51 0.00 0.00 177.10 175.44 2x5a s VAL 53 N -0.90 1.91 -0.34 1.60 0.11 -0.66 -1.99 120.40 120.12 2x5a s VAL 53 Ca -0.10 -0.87 -0.11 0.00 -2.93 0.00 0.00 61.98 57.98 2x5a s VAL 53 Cb -0.04 -1.71 0.00 0.00 -1.53 0.00 0.00 36.38 33.10 2x5a s VAL 53 CO 0.03 0.52 0.18 -1.58 -3.33 0.00 0.00 175.10 170.93 2x5a s GLN 54 N 1.07 3.19 -0.55 1.54 0.74 0.99 -0.88 119.66 125.76 2x5a s GLN 54 Ca -0.02 -0.83 -0.27 0.00 0.05 0.00 0.00 55.36 54.30 2x5a s GLN 54 Cb -0.14 -3.66 0.03 0.00 1.10 0.00 0.00 33.01 30.34 2x5a s GLN 54 CO -0.06 -0.52 1.08 0.71 -0.55 0.00 0.00 175.29 175.95 2x5a s TYR 55 N 1.61 2.72 -0.03 1.67 2.02 0.32 -0.27 117.35 125.39 2x5a s TYR 55 Ca 0.04 0.33 -0.26 0.00 -0.37 0.00 0.00 57.07 56.81 2x5a s TYR 55 Cb -0.18 -4.32 -0.21 0.00 -0.40 0.00 0.00 41.96 36.86 2x5a s TYR 55 CO 0.07 -1.43 1.20 1.79 -1.57 0.00 0.00 175.55 175.61 2x5a h THR 56 N 6.12 1.45 -1.07 -0.71 1.35 -1.80 0.10 112.91 118.35 2x5a h THR 56 Ca -0.25 -1.36 -0.10 0.00 -0.55 0.00 0.00 66.41 64.16 2x5a h THR 56 Cb 1.06 2.33 -0.19 0.00 -1.73 0.00 0.00 68.15 69.62 2x5a h THR 56 CO 1.13 0.36 -0.47 0.21 -0.25 0.00 0.00 175.52 176.50 2x5a s ASN 57 N -5.84 -1.34 -0.09 5.36 2.47 -1.21 -2.18 114.94 112.12 2x5a s ASN 57 Ca -0.16 -0.98 0.03 0.00 0.42 0.00 0.00 52.86 52.17 2x5a s ASN 57 Cb 0.01 1.86 0.00 0.00 -1.45 0.00 0.00 41.25 41.67 2x5a s ASN 57 CO 0.69 -0.16 -0.20 -0.89 -3.72 0.00 0.00 177.10 172.82 2x5a s THR 58 N 1.67 1.75 -0.11 -5.21 2.01 -0.72 -0.51 115.64 114.53 2x5a s THR 58 Ca 0.18 -0.84 -0.05 0.00 0.31 0.00 0.00 61.69 61.29 2x5a s THR 58 Cb -0.04 -1.53 -0.04 0.00 0.01 0.00 0.00 72.50 70.90 2x5a s THR 58 CO -0.07 0.49 0.09 -0.44 -0.69 0.00 0.00 174.62 174.00 2x5a s SER 59 N 0.44 5.94 0.01 3.53 0.01 -0.31 0.05 113.70 123.36 2x5a s SER 59 Ca -0.17 0.34 0.03 0.00 1.31 0.00 0.00 55.95 57.45 2x5a s SER 59 Cb -0.17 -1.84 -0.01 0.00 0.21 0.00 0.00 66.02 64.21 2x5a s SER 59 CO 0.07 0.39 -0.09 -0.63 0.41 0.00 0.00 173.24 173.40 2x5a s ILE 60 N -0.95 0.67 -0.21 1.44 1.01 -0.33 -1.39 121.20 121.43 2x5a s ILE 60 Ca 0.14 -0.51 0.00 0.00 0.00 0.00 0.00 60.65 60.28 2x5a s ILE 60 Cb -0.12 -0.59 0.03 0.00 0.01 0.00 0.00 42.46 41.79 2x5a s ILE 60 CO 0.03 0.08 -0.14 -0.63 0.00 0.00 0.00 174.94 174.29 2x5a s ILE 61 N -0.42 2.39 -0.08 2.92 1.01 0.18 -1.52 121.20 125.68 2x5a s ILE 61 Ca 0.01 -1.04 -0.00 0.00 0.00 0.00 0.00 60.65 59.62 2x5a s ILE 61 Cb -0.05 -2.13 0.03 0.00 0.01 0.00 0.00 42.46 40.32 2x5a s ILE 61 CO -0.00 0.35 -0.04 0.00 0.00 0.00 0.00 174.94 175.25 2x5a s ALA 62 N 1.28 0.92 -1.65 9.38 0.00 -0.58 -1.77 121.76 129.34 2x5a s ALA 62 Ca 0.02 -0.26 -0.03 0.00 0.00 0.00 0.00 51.96 51.69 2x5a s ALA 62 Cb -0.15 -0.73 0.00 0.00 0.00 0.00 0.00 23.12 22.24 2x5a s ALA 62 CO -0.09 -0.34 0.37 0.41 0.00 0.00 0.00 175.76 176.11 2x5a n GLY 63 N 4.82 -0.51 2.62 0.00 0.00 -1.26 -1.43 105.19 109.43 2x5a n GLY 63 Ca -0.13 0.08 0.00 0.00 0.00 0.00 0.00 46.02 45.97 2x5a n GLY 63 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2x5a n GLY 64 N -1.33 0.46 3.65 -0.02 0.00 -1.26 -4.67 105.19 102.02 2x5a n GLY 64 Ca -0.17 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.48 2x5a n GLY 64 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2x5a s ARG 65 N -0.50 4.05 -0.09 1.61 1.81 -0.52 -4.21 118.95 121.10 2x5a s ARG 65 Ca 0.00 -0.28 -0.15 0.00 -1.72 0.00 0.00 55.73 53.58 2x5a s ARG 65 Cb 0.00 -3.56 -0.05 0.00 -0.45 0.00 0.00 34.95 30.89 2x5a s ARG 65 CO 0.00 0.02 0.37 -0.47 -0.68 0.00 0.00 175.30 174.54 2x5a s TYR 66 N 1.18 3.59 0.10 -0.53 5.04 -1.26 -1.52 117.35 123.94 2x5a s TYR 66 Ca 0.07 0.81 -0.14 0.00 -2.44 0.00 0.00 57.07 55.37 2x5a s TYR 66 Cb -0.14 -2.34 0.03 0.00 0.35 0.00 0.00 41.96 39.86 2x5a s TYR 66 CO 0.06 0.42 0.34 -0.59 -1.34 0.00 0.00 175.55 174.43 2x5a s PHE 67 N -0.20 -0.12 -0.04 4.97 -0.12 -0.58 -5.02 117.98 116.86 2x5a s PHE 67 Ca 0.21 -0.16 0.06 0.00 -0.05 0.00 0.00 56.93 56.99 2x5a s PHE 67 Cb -0.15 0.16 -0.01 0.00 -0.63 0.00 0.00 43.02 42.39 2x5a s PHE 67 CO 0.09 -0.63 -0.23 -1.21 -0.05 0.00 0.00 175.22 173.19 2x5a s GLU 68 N -3.50 2.20 -0.44 1.99 2.02 -1.26 -1.19 118.70 118.52 2x5a s GLU 68 Ca 0.01 -0.83 -0.13 0.00 0.02 0.00 0.00 54.97 54.05 2x5a s GLU 68 Cb 0.02 -1.94 0.06 0.00 0.10 0.00 0.00 34.13 32.37 2x5a s GLU 68 CO -0.10 0.39 0.33 -0.51 0.02 0.00 0.00 175.26 175.39 2x5a s LEU 69 N -0.24 5.34 -0.33 1.80 1.43 0.11 -4.98 118.68 121.81 2x5a s LEU 69 Ca 0.00 -1.30 -0.00 0.00 -1.03 0.00 0.00 54.13 51.80 2x5a s LEU 69 Cb -0.12 -2.11 0.07 0.00 0.03 0.00 0.00 46.19 44.07 2x5a s LEU 69 CO 0.02 -0.57 0.04 -0.76 0.23 0.00 0.00 176.35 175.31 2x5a s LEU 70 N 1.57 4.29 -1.27 1.79 1.43 -1.26 -1.76 118.68 123.47 2x5a s LEU 70 Ca 0.04 -1.63 -0.08 0.00 -1.03 0.00 0.00 54.13 51.42 2x5a s LEU 70 Cb -0.23 -1.70 -0.01 0.00 0.03 0.00 0.00 46.19 44.29 2x5a s LEU 70 CO 0.06 -0.33 0.63 0.59 0.23 0.00 0.00 176.35 177.53 2x5a n ASN 71 N 4.51 -2.53 -4.39 2.29 5.03 -0.12 -4.97 115.26 115.09 2x5a n ASN 71 Ca -0.08 -0.96 -0.39 0.00 0.87 0.00 0.00 54.58 54.02 2x5a n ASN 71 Cb 0.42 -3.45 -0.12 0.00 -1.02 0.00 0.00 39.78 35.61 2x5a n ASN 71 CO 0.00 0.00 0.00 -0.70 -1.83 0.00 0.00 177.26 174.73 2x5a s GLU 72 N -6.16 3.10 -0.14 3.52 2.56 -0.39 -4.91 118.70 116.28 2x5a s GLU 72 Ca 0.19 -0.88 -0.12 0.00 0.00 0.00 0.00 54.97 54.17 2x5a s GLU 72 Cb -0.07 -3.56 -0.05 0.00 2.00 0.00 0.00 34.13 32.45 2x5a s GLU 72 CO 0.86 -0.52 0.24 0.99 -0.56 0.00 0.00 175.26 176.27 2x5a s THR 73 N 1.56 5.33 -0.18 -1.70 2.01 -1.26 -0.52 115.64 120.89 2x5a s THR 73 Ca 0.03 0.44 -0.01 0.00 0.31 0.00 0.00 61.69 62.46 2x5a s THR 73 Cb -0.18 -3.56 -0.00 0.00 0.01 0.00 0.00 72.50 68.77 2x5a s THR 73 CO 0.05 0.47 -0.12 -0.69 -0.69 0.00 0.00 174.62 173.65 2x5a s VAL 74 N -0.08 2.87 0.19 3.82 1.01 -0.06 -4.97 120.40 123.18 2x5a s VAL 74 Ca 0.15 -0.69 -0.30 0.00 0.00 0.00 0.00 61.98 61.15 2x5a s VAL 74 Cb -0.13 -2.24 -0.08 0.00 0.00 0.00 0.00 36.38 33.93 2x5a s VAL 74 CO 0.04 0.49 1.02 0.00 0.00 0.00 0.00 175.10 176.65 2x5a s ALA 75 N 1.03 3.33 0.21 5.51 0.00 -1.26 -1.66 121.76 128.91 2x5a s ALA 75 Ca -0.01 0.70 0.09 0.00 0.00 0.00 0.00 51.96 52.74 2x5a s ALA 75 Cb -0.15 -3.29 -0.04 0.00 0.00 0.00 0.00 23.12 19.64 2x5a s ALA 75 CO -0.02 -0.04 -0.05 -0.51 0.00 0.00 0.00 175.76 175.14 2x5a s LEU 76 N -0.61 3.11 0.06 0.00 1.43 0.46 -4.65 118.68 118.49 2x5a s LEU 76 Ca 0.46 -0.57 -0.24 0.00 -1.03 0.00 0.00 54.13 52.75 2x5a s LEU 76 Cb -0.27 -1.73 -0.06 0.00 0.03 0.00 0.00 46.19 44.16 2x5a s LEU 76 CO 0.33 0.06 0.72 -0.75 0.23 0.00 0.00 176.35 176.95 2x5a s LYS 77 N -3.15 4.45 0.51 1.70 2.20 -1.26 -4.84 119.74 119.36 2x5a s LYS 77 Ca 0.28 0.99 -0.19 0.00 -0.36 0.00 0.00 55.97 56.68 2x5a s LYS 77 Cb -0.08 -3.33 -0.07 0.00 -1.51 0.00 0.00 37.83 32.84 2x5a s LYS 77 CO 0.17 0.38 1.04 0.20 -0.36 0.00 0.00 175.35 176.79 2x5a s GLY 78 N -0.36 2.41 -1.52 5.54 0.00 -1.26 -3.96 107.32 108.16 2x5a s GLY 78 Ca 0.36 0.55 -0.07 0.00 0.00 0.00 0.00 44.72 45.56 2x5a s GLY 78 CO 0.22 0.87 0.54 1.22 0.00 0.00 0.00 173.10 175.95 2x5a n ASP 79 N -1.25 -1.41 -3.99 1.64 9.92 0.57 -4.92 116.55 117.10 2x5a n ASP 79 Ca 0.09 -1.02 -0.09 0.00 -0.53 0.00 0.00 54.79 53.24 2x5a n ASP 79 Cb 0.53 -2.89 -0.08 0.00 -0.64 0.00 0.00 41.12 38.04 2x5a n ASP 79 CO 0.00 0.00 0.00 -0.44 0.13 0.00 0.00 177.20 176.89 2x5a s SER 80 N -3.97 0.15 -0.42 -2.24 0.01 -1.24 -4.96 113.70 101.04 2x5a s SER 80 Ca 0.28 -0.92 -0.15 0.00 1.31 0.00 0.00 55.95 56.47 2x5a s SER 80 Cb -0.15 0.37 0.03 0.00 0.21 0.00 0.00 66.02 66.48 2x5a s SER 80 CO 0.91 -0.81 0.31 -0.69 0.41 0.00 0.00 173.24 173.37 2x5a s VAL 81 N -3.96 5.24 -0.24 3.43 1.01 -1.26 -0.98 120.40 123.63 2x5a s VAL 81 Ca 0.16 -0.73 -0.15 0.00 0.00 0.00 0.00 61.98 61.26 2x5a s VAL 81 Cb 0.05 -3.95 -0.04 0.00 0.00 0.00 0.00 36.38 32.44 2x5a s VAL 81 CO -0.02 -0.35 0.36 0.20 0.00 0.00 0.00 175.10 175.28 2x5a s ASN 82 N 1.82 6.31 -0.44 3.32 -0.87 0.73 -4.64 114.94 121.18 2x5a s ASN 82 Ca 0.05 0.36 -0.17 0.00 -1.57 0.00 0.00 52.86 51.52 2x5a s ASN 82 Cb -0.20 -2.21 0.03 0.00 -0.02 0.00 0.00 41.25 38.86 2x5a s ASN 82 CO 0.09 -0.11 0.45 -0.31 -2.57 0.00 0.00 177.10 174.65 2x5a s TYR 83 N 1.65 3.17 -0.22 2.20 2.02 0.52 -0.34 117.35 126.34 2x5a s TYR 83 Ca 0.16 -0.47 -0.26 0.00 -0.37 0.00 0.00 57.07 56.13 2x5a s TYR 83 Cb -0.15 -2.99 -0.00 0.00 -0.40 0.00 0.00 41.96 38.41 2x5a s TYR 83 CO 0.08 -0.75 0.87 0.42 -1.57 0.00 0.00 175.55 174.61 2x5a s ILE 84 N 2.12 4.82 0.05 2.71 -1.09 0.45 -0.63 121.20 129.64 2x5a s ILE 84 Ca 0.11 1.67 0.07 0.00 -2.23 0.00 0.00 60.65 60.27 2x5a s ILE 84 Cb -0.18 -4.16 -0.03 0.00 -1.58 0.00 0.00 42.46 36.50 2x5a s ILE 84 CO 0.12 -0.07 -0.15 -1.00 -1.23 0.00 0.00 174.94 172.62 2x5a s HIS 85 N 2.73 2.64 -0.23 3.97 3.76 0.29 -0.96 115.29 127.49 2x5a s HIS 85 Ca 0.38 -0.20 -0.10 0.00 -0.15 0.00 0.00 55.06 54.99 2x5a s HIS 85 Cb -0.16 -1.47 -0.05 0.00 1.11 0.00 0.00 32.58 32.02 2x5a s HIS 85 CO 0.08 0.32 0.13 0.00 -0.85 0.00 0.00 174.74 174.43 2x5a s ALA 86 N -1.02 3.52 -0.17 -1.40 0.00 0.07 -1.74 121.76 121.02 2x5a s ALA 86 Ca 0.17 -0.90 -0.00 0.00 0.00 0.00 0.00 51.96 51.23 2x5a s ALA 86 Cb -0.11 -2.23 0.00 0.00 0.00 0.00 0.00 23.12 20.79 2x5a s ALA 86 CO 0.08 -0.17 -0.14 -0.80 0.00 0.00 0.00 175.76 174.72 2x5a s ASN 87 N 1.02 3.63 -0.25 0.00 0.01 0.43 -1.50 114.94 118.29 2x5a s ASN 87 Ca 0.06 -0.51 -0.03 0.00 -0.71 0.00 0.00 52.86 51.68 2x5a s ASN 87 Cb -0.14 -1.57 0.02 0.00 0.41 0.00 0.00 41.25 39.97 2x5a s ASN 87 CO 0.04 0.04 -0.04 -0.63 -1.51 0.00 0.00 177.10 174.99 2x5a s ILE 88 N 1.08 3.08 -0.29 0.60 1.01 0.61 -1.54 121.20 125.75 2x5a s ILE 88 Ca -0.00 -0.88 0.02 0.00 0.00 0.00 0.00 60.65 59.78 2x5a s ILE 88 Cb -0.14 -2.53 0.08 0.00 0.01 0.00 0.00 42.46 39.88 2x5a s ILE 88 CO -0.04 0.23 0.01 -0.62 0.00 0.00 0.00 174.94 174.52 2x5a s ASP 89 N 1.37 4.31 0.54 3.58 -1.08 0.52 -1.21 116.67 124.70 2x5a s ASP 89 Ca 0.02 -1.68 0.35 0.00 -0.52 0.00 0.00 52.55 50.72 2x5a s ASP 89 Cb -0.16 -1.33 1.63 0.00 -1.46 0.00 0.00 42.92 41.60 2x5a s ASP 89 CO -0.04 -0.32 2.05 -0.07 0.52 0.00 0.00 175.17 177.31 2x5a h LEU 90 N 7.83 0.00 -0.88 -1.34 3.38 -1.83 -2.46 115.31 120.01 2x5a h LEU 90 Ca -0.12 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.78 2x5a h LEU 90 Cb 1.04 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.78 2x5a h LEU 90 CO 0.47 0.00 -0.33 0.71 0.09 0.00 0.00 178.44 179.39 2x5a h THR 91 N 0.00 0.74 -0.65 0.22 1.35 -1.94 -3.32 112.91 109.30 2x5a h THR 91 Ca 0.00 -1.44 -0.73 0.00 -0.55 0.00 0.00 66.41 63.69 2x5a h THR 91 Cb 0.32 1.93 -0.09 0.00 -1.73 0.00 0.00 68.15 68.58 2x5a h THR 91 CO 0.00 0.32 2.60 0.00 -0.25 0.00 0.00 175.52 178.19 2x5a n GLN 92 N -3.43 3.17 -0.30 4.72 1.13 -0.93 -4.85 117.38 116.89 2x5a n GLN 92 Ca 0.00 -3.03 0.09 0.00 -1.94 0.00 0.00 57.00 52.12 2x5a n GLN 92 Cb 0.51 -3.17 0.21 0.00 0.11 0.00 0.00 30.24 27.90 2x5a n GLN 92 CO 0.00 0.00 0.00 1.15 -1.44 0.00 0.00 177.06 176.77 2x5a h THR 93 N 4.06 0.17 -0.01 5.09 2.02 -1.82 -1.36 112.91 121.07 2x5a h THR 93 Ca 0.49 -0.02 -0.22 0.00 0.77 0.00 0.00 66.41 67.43 2x5a h THR 93 Cb 0.66 0.11 0.00 0.00 -1.74 0.00 0.00 68.15 67.19 2x5a h THR 93 CO 1.74 0.01 -0.92 0.00 0.37 0.00 0.00 175.52 176.71 2x5a h ALA 94 N 1.86 0.39 -2.30 6.16 0.00 -1.94 -3.40 119.26 120.03 2x5a h ALA 94 Ca 0.50 -0.70 -0.58 0.00 0.00 0.00 0.00 54.91 54.12 2x5a h ALA 94 Cb 0.93 -0.03 -0.39 0.00 0.00 0.00 0.00 17.79 18.30 2x5a h ALA 94 CO -0.82 0.82 -0.96 0.09 0.00 0.00 0.00 179.25 178.38 2x5a n ASN 95 N -3.75 0.37 0.24 0.00 3.02 -0.94 -5.00 115.26 109.20 2x5a n ASN 95 Ca -0.06 -2.64 0.12 0.00 -0.03 0.00 0.00 54.58 51.97 2x5a n ASN 95 Cb 0.82 -0.61 0.53 0.00 -0.61 0.00 0.00 39.78 39.91 2x5a n ASN 95 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 2x5a h PRO 96 N 4.94 0.00 -5.96 3.52 0.13 -1.47 -3.44 132.00 129.72 2x5a h PRO 96 Ca 0.18 0.00 -0.68 0.00 -0.87 0.00 0.00 66.00 64.64 2x5a h PRO 96 Cb 0.87 0.00 -0.21 0.00 0.13 0.00 0.00 31.00 31.79 2x5a h PRO 96 CO 0.47 0.17 -0.71 0.08 -0.23 0.00 0.00 178.00 177.78 2x5a s VAL 97 N -3.69 3.59 0.03 1.56 1.01 -1.26 -0.36 120.40 121.29 2x5a s VAL 97 Ca 0.00 -0.51 -0.07 0.00 0.00 0.00 0.00 61.98 61.41 2x5a s VAL 97 Cb 0.10 -2.48 -0.01 0.00 0.00 0.00 0.00 36.38 33.99 2x5a s VAL 97 CO 0.61 0.58 0.12 -0.94 0.00 0.00 0.00 175.10 175.47 2x5a s SER 98 N -0.52 0.12 0.03 3.32 1.04 -0.59 -4.99 113.70 112.11 2x5a s SER 98 Ca 0.08 -0.44 0.03 0.00 0.48 0.00 0.00 55.95 56.10 2x5a s SER 98 Cb -0.12 0.24 -0.04 0.00 0.10 0.00 0.00 66.02 66.20 2x5a s SER 98 CO 0.02 -0.49 -0.03 -0.76 0.98 0.00 0.00 173.24 172.96 2x5a s LEU 99 N -1.98 3.36 0.03 2.42 1.43 -1.26 -0.42 118.68 122.25 2x5a s LEU 99 Ca -0.07 -0.12 0.00 0.00 -1.03 0.00 0.00 54.13 52.91 2x5a s LEU 99 Cb -0.02 -1.99 -0.02 0.00 0.03 0.00 0.00 46.19 44.19 2x5a s LEU 99 CO -0.03 0.25 -0.04 -0.94 0.23 0.00 0.00 176.35 175.81 2x5a s SER 100 N -1.76 0.40 -0.27 2.29 1.04 -0.71 -4.98 113.70 109.71 2x5a s SER 100 Ca 0.21 -0.54 -0.05 0.00 0.48 0.00 0.00 55.95 56.05 2x5a s SER 100 Cb -0.11 0.09 0.01 0.00 0.10 0.00 0.00 66.02 66.11 2x5a s SER 100 CO 0.12 -0.29 0.02 0.00 0.98 0.00 0.00 173.24 174.06 2x5a s ALA 101 N -1.57 2.91 0.25 5.32 0.00 -1.26 -0.55 121.76 126.87 2x5a s ALA 101 Ca -0.13 -1.42 0.11 0.00 0.00 0.00 0.00 51.96 50.52 2x5a s ALA 101 Cb -0.09 -1.94 -0.05 0.00 0.00 0.00 0.00 23.12 21.04 2x5a s ALA 101 CO -0.01 -0.83 -0.20 -1.21 0.00 0.00 0.00 175.76 173.52 2x5a s GLU 102 N 1.44 1.59 0.31 0.00 2.02 0.20 -4.88 118.70 119.38 2x5a s GLU 102 Ca 0.02 -1.70 0.26 0.00 0.02 0.00 0.00 54.97 53.57 2x5a s GLU 102 Cb -0.17 -1.66 0.95 0.00 0.10 0.00 0.00 34.13 33.35 2x5a s GLU 102 CO -0.01 0.31 1.77 1.79 0.02 0.00 0.00 175.26 179.15 2x5a h THR 103 N 2.46 0.00 -4.07 3.63 1.35 -1.86 0.15 112.91 114.56 2x5a h THR 103 Ca -0.40 -0.41 -0.13 0.00 -0.55 0.00 0.00 66.41 64.91 2x5a h THR 103 Cb 1.25 1.28 -0.13 0.00 -1.73 0.00 0.00 68.15 68.81 2x5a h THR 103 CO 0.59 0.00 -0.40 0.00 -0.25 0.00 0.00 175.52 175.46 2x5a s ALA 104 N -3.31 0.33 -0.62 6.62 0.00 -1.26 -4.87 121.76 118.64 2x5a s ALA 104 Ca 0.06 -1.14 -0.27 0.00 0.00 0.00 0.00 51.96 50.61 2x5a s ALA 104 Cb 0.10 1.00 0.03 0.00 0.00 0.00 0.00 23.12 24.24 2x5a s ALA 104 CO 0.49 -0.64 1.17 1.21 0.00 0.00 0.00 175.76 177.99 2x5a s ASN 105 N -3.03 6.36 -0.37 0.00 3.84 -1.26 -4.71 114.94 115.77 2x5a s ASN 105 Ca 0.23 -0.13 0.07 0.00 0.21 0.00 0.00 52.86 53.24 2x5a s ASN 105 Cb 0.04 -2.53 0.62 0.00 -0.55 0.00 0.00 41.25 38.83 2x5a s ASN 105 CO 0.04 -1.53 1.74 0.59 -2.79 0.00 0.00 177.10 175.15 2x5a n ASN 106 N 8.48 3.43 -4.69 -4.21 3.02 -1.26 -5.01 115.26 115.02 2x5a n ASN 106 Ca 0.06 -3.61 -0.44 0.00 -0.03 0.00 0.00 54.58 50.56 2x5a n ASN 106 Cb 0.49 -0.75 -0.03 0.00 -0.61 0.00 0.00 39.78 38.87 2x5a n ASN 106 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 2x5a n SER 107 N -1.01 3.73 -0.00 6.41 7.64 -1.26 -4.82 113.62 124.31 2x5a n SER 107 Ca 0.48 1.04 0.06 0.00 1.01 0.00 0.00 58.87 61.45 2x5a n SER 107 Cb 1.40 -1.51 -0.07 0.00 -1.01 0.00 0.00 64.21 63.02 2x5a n SER 107 CO 0.00 0.00 0.00 -0.46 -3.01 0.00 0.00 175.04 171.57 2x5a n ASN 108 N 4.50 0.57 -2.18 6.43 0.23 -0.72 -5.00 115.26 119.09 2x5a n ASN 108 Ca 0.17 -0.78 -0.20 0.00 -0.53 0.00 0.00 54.58 53.24 2x5a n ASN 108 Cb 0.34 1.00 -0.03 0.00 -2.08 0.00 0.00 39.78 39.01 2x5a n ASN 108 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2x5a n GLY 109 N 1.28 0.13 3.69 4.83 0.00 -1.26 -4.95 105.19 108.92 2x5a n GLY 109 Ca 0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.62 2x5a n GLY 109 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2x5a s VAL 110 N -2.89 3.24 -1.00 1.61 1.01 -1.26 -4.80 120.40 116.31 2x5a s VAL 110 Ca 0.00 0.67 -0.23 0.00 0.00 0.00 0.00 61.98 62.42 2x5a s VAL 110 Cb 0.00 -3.43 0.02 0.00 0.00 0.00 0.00 36.38 32.97 2x5a s VAL 110 CO 0.00 -0.00 1.58 -0.62 0.00 0.00 0.00 175.10 176.06 2x5a s ASP 111 N 2.27 6.15 0.25 3.32 -1.08 -1.26 -4.69 116.67 121.63 2x5a s ASP 111 Ca 0.71 -1.27 0.25 0.00 -0.52 0.00 0.00 52.55 51.72 2x5a s ASP 111 Cb -0.37 -2.57 0.85 0.00 -1.46 0.00 0.00 42.92 39.38 2x5a s ASP 111 CO 0.30 -1.83 1.76 0.16 0.52 0.00 0.00 175.17 176.08 2x5a h ILE 112 N 6.89 0.00 0.00 4.11 3.07 -1.89 -1.90 117.51 127.79 2x5a h ILE 112 Ca 0.18 -0.44 0.00 0.00 1.55 0.00 0.00 64.86 66.15 2x5a h ILE 112 Cb 1.01 1.36 0.00 0.00 -0.27 0.00 0.00 36.82 38.91 2x5a h ILE 112 CO 1.37 0.00 -0.80 0.78 -1.05 0.00 0.00 178.15 178.45 2x5a h ASN 113 N 0.00 0.00 0.00 2.16 2.35 -1.89 -3.39 115.58 114.81 2x5a h ASN 113 Ca 0.00 -0.14 -0.03 0.00 -0.55 0.00 0.00 56.30 55.59 2x5a h ASN 113 Cb 0.63 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.00 2x5a h ASN 113 CO 0.00 0.07 -1.21 0.59 -1.65 0.00 0.00 177.43 175.23 2x5a n ASN 114 N -2.35 4.09 -1.71 5.81 3.02 -1.22 -4.87 115.26 118.02 2x5a n ASN 114 Ca 0.02 0.00 -0.06 0.00 -0.03 0.00 0.00 54.58 54.51 2x5a n ASN 114 Cb 0.49 0.94 -0.02 0.00 -0.61 0.00 0.00 39.78 40.58 2x5a n ASN 114 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2x5a n GLY 115 N 2.48 3.45 3.93 7.41 0.00 -0.72 -5.14 105.19 116.60 2x5a n GLY 115 Ca -0.03 -1.67 -0.26 0.00 0.00 0.00 0.00 46.02 44.07 2x5a n GLY 115 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2x5a s SER 116 N -1.75 5.50 0.00 1.61 1.04 -1.26 -4.40 113.70 114.44 2x5a s SER 116 Ca 0.12 0.59 0.00 0.00 0.48 0.00 0.00 55.95 57.14 2x5a s SER 116 Cb 0.00 -1.56 0.00 0.00 0.10 0.00 0.00 66.02 64.57 2x5a s SER 116 CO 0.09 -1.10 0.00 0.61 0.98 0.00 0.00 173.24 173.82 2x5a n GLY 117 N -2.56 2.78 3.67 7.32 0.00 -1.26 -4.84 105.19 110.30 2x5a n GLY 117 Ca 0.05 -2.09 -0.36 0.00 0.00 0.00 0.00 46.02 43.62 2x5a n GLY 117 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2x5a s VAL 118 N -2.27 5.36 -0.11 1.61 1.01 -1.26 -4.66 120.40 120.08 2x5a s VAL 118 Ca 0.00 0.18 -0.23 0.00 0.00 0.00 0.00 61.98 61.93 2x5a s VAL 118 Cb 0.00 -3.49 -0.03 0.00 0.00 0.00 0.00 36.38 32.86 2x5a s VAL 118 CO 0.00 0.35 0.71 -0.22 0.00 0.00 0.00 175.10 175.94 2x5a s LEU 119 N 0.99 4.26 -0.13 3.92 2.96 -0.35 -4.72 118.68 125.61 2x5a s LEU 119 Ca 0.08 1.11 0.03 0.00 -0.22 0.00 0.00 54.13 55.12 2x5a s LEU 119 Cb -0.13 -3.07 0.01 0.00 0.50 0.00 0.00 46.19 43.50 2x5a s LEU 119 CO 0.04 -0.20 -0.22 -0.54 -1.32 0.00 0.00 176.35 174.11 2x5a s LYS 120 N 1.26 3.06 -0.05 1.98 1.02 -1.26 -0.28 119.74 125.46 2x5a s LYS 120 Ca 0.36 -0.85 -0.02 0.00 0.02 0.00 0.00 55.97 55.48 2x5a s LYS 120 Cb -0.17 -2.42 0.04 0.00 -0.52 0.00 0.00 37.83 34.76 2x5a s LYS 120 CO 0.15 0.05 0.10 0.54 -0.92 0.00 0.00 175.35 175.27 2x5a s VAL 121 N 0.67 -0.13 0.09 3.17 0.11 -0.56 -1.76 120.40 122.00 2x5a s VAL 121 Ca -0.10 0.31 -0.30 0.00 -2.93 0.00 0.00 61.98 58.96 2x5a s VAL 121 Cb -0.16 -0.19 -0.05 0.00 -1.53 0.00 0.00 36.38 34.44 2x5a s VAL 121 CO 0.02 0.13 0.99 0.00 -3.33 0.00 0.00 175.10 172.90 2x5a n PHE 123 N 3.01 0.00 -3.90 0.00 1.16 -0.14 -4.85 117.46 112.75 2x5a n PHE 123 Ca 0.03 0.00 -0.11 0.00 -1.87 0.00 0.00 57.45 55.51 2x5a n PHE 123 Cb 0.49 0.00 -0.11 0.00 -1.61 0.00 0.00 39.48 38.26 2x5a n PHE 123 CO 0.00 0.00 0.00 0.34 -1.87 0.00 0.00 176.76 175.23 2x5a s ASP 124 N -1.23 0.07 -0.23 5.98 2.15 -1.18 -1.54 116.67 120.70 2x5a s ASP 124 Ca 0.00 -0.24 0.01 0.00 0.43 0.00 0.00 52.55 52.75 2x5a s ASP 124 Cb 0.00 0.18 0.05 0.00 -0.30 0.00 0.00 42.92 42.85 2x5a s ASP 124 CO 0.00 -0.31 -0.10 -0.63 -0.17 0.00 0.00 175.17 173.96 2x5a s ILE 125 N -1.23 1.80 -0.25 4.11 1.01 0.38 -0.41 121.20 126.61 2x5a s ILE 125 Ca -0.13 -1.26 -0.02 0.00 0.00 0.00 0.00 60.65 59.24 2x5a s ILE 125 Cb -0.07 -1.92 0.03 0.00 0.01 0.00 0.00 42.46 40.50 2x5a s ILE 125 CO 0.01 0.06 -0.06 -0.69 0.00 0.00 0.00 174.94 174.26 2x5a s VAL 126 N 1.30 2.91 -0.09 2.92 1.01 0.54 -0.63 120.40 128.36 2x5a s VAL 126 Ca -0.04 -1.02 -0.14 0.00 0.00 0.00 0.00 61.98 60.78 2x5a s VAL 126 Cb -0.18 -2.48 -0.05 0.00 0.00 0.00 0.00 36.38 33.67 2x5a s VAL 126 CO -0.07 0.19 0.34 -0.89 0.00 0.00 0.00 175.10 174.67 2x5a s THR 127 N 1.33 5.21 0.35 3.92 2.01 0.01 -0.19 115.64 128.28 2x5a s THR 127 Ca 0.00 0.67 0.09 0.00 0.31 0.00 0.00 61.69 62.76 2x5a s THR 127 Cb -0.17 -3.66 -0.06 0.00 0.01 0.00 0.00 72.50 68.62 2x5a s THR 127 CO -0.04 0.48 -0.06 0.42 -0.69 0.00 0.00 174.62 174.73 2x5a s THR 128 N -0.29 2.34 0.00 -0.82 -4.23 -0.15 -0.62 115.64 111.85 2x5a s THR 128 Ca 0.20 -2.13 0.00 0.00 -1.18 0.00 0.00 61.69 58.59 2x5a s THR 128 Cb -0.15 -2.71 0.00 0.00 1.34 0.00 0.00 72.50 70.99 2x5a s THR 128 CO 0.08 -0.19 0.00 -1.54 -0.54 0.00 0.00 174.62 172.43 2x5a n SER 129 N -0.85 0.82 0.16 3.99 3.41 0.43 -3.59 113.62 117.99 2x5a n SER 129 Ca -0.05 -0.31 0.13 0.00 -0.26 0.00 0.00 58.87 58.39 2x5a n SER 129 Cb 0.63 0.00 0.38 0.00 -0.26 0.00 0.00 64.21 64.97 2x5a n SER 129 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 2x5a h GLY 130 N 0.00 0.00 0.00 5.00 0.00 -1.96 0.16 103.07 106.28 2x5a h GLY 130 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 47.33 47.22 2x5a h GLY 130 CO 0.00 0.00 -1.51 -1.30 0.00 0.00 0.00 176.54 173.73 2x5a n THR 131 N -2.57 0.43 -3.52 4.70 -2.24 -1.26 -4.84 114.28 104.98 2x5a n THR 131 Ca 0.04 -0.31 0.00 0.00 -2.27 0.00 0.00 64.05 61.51 2x5a n THR 131 Cb 0.41 -0.56 0.00 0.00 -2.10 0.00 0.00 70.33 68.08 2x5a n THR 131 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2x5a n GLY 132 N 2.41 1.01 3.71 3.38 0.00 -1.26 -4.00 105.19 110.44 2x5a n GLY 132 Ca -0.11 -0.84 -0.42 0.00 0.00 0.00 0.00 46.02 44.65 2x5a n GLY 132 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2x5a s VAL 133 N -2.34 4.42 -0.23 1.61 1.01 -1.24 -0.42 120.40 123.20 2x5a s VAL 133 Ca 0.00 1.74 0.09 0.00 0.00 0.00 0.00 61.98 63.81 2x5a s VAL 133 Cb 0.00 -4.11 -0.20 0.00 0.00 0.00 0.00 36.38 32.07 2x5a s VAL 133 CO 0.00 0.12 -0.09 0.35 0.00 0.00 0.00 175.10 175.48 2x5a n THR 134 N 4.00 1.41 -3.53 3.92 -2.24 0.21 -4.89 114.28 113.14 2x5a n THR 134 Ca 0.08 -0.68 -0.13 0.00 -2.27 0.00 0.00 64.05 61.04 2x5a n THR 134 Cb 0.48 -0.98 -0.04 0.00 -2.10 0.00 0.00 70.33 67.69 2x5a n THR 134 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2x5a s SER 135 N -6.00 -0.48 -0.03 3.42 1.04 -1.13 -5.03 113.70 105.49 2x5a s SER 135 Ca -0.23 0.14 0.02 0.00 0.48 0.00 0.00 55.95 56.35 2x5a s SER 135 Cb 0.07 0.52 0.01 0.00 0.10 0.00 0.00 66.02 66.73 2x5a s SER 135 CO 0.69 -0.79 -0.06 -0.89 0.98 0.00 0.00 173.24 173.17 2x5a s THR 136 N -2.79 0.57 -0.08 2.02 2.01 -1.26 -0.81 115.64 115.30 2x5a s THR 136 Ca -0.03 -0.21 0.00 0.00 0.31 0.00 0.00 61.69 61.76 2x5a s THR 136 Cb -0.00 -0.54 0.02 0.00 0.01 0.00 0.00 72.50 71.99 2x5a s THR 136 CO -0.04 0.20 -0.06 -0.75 -0.69 0.00 0.00 174.62 173.28 2x5a s LYS 137 N 0.47 1.16 0.58 4.92 2.20 0.20 -5.01 119.74 124.25 2x5a s LYS 137 Ca -0.06 -0.15 -0.14 0.00 -0.36 0.00 0.00 55.97 55.25 2x5a s LYS 137 Cb -0.10 -1.22 -0.05 0.00 -1.51 0.00 0.00 37.83 34.95 2x5a s LYS 137 CO 0.00 -0.18 1.02 -1.25 -0.36 0.00 0.00 175.35 174.58 2x5a s PRO 138 N 1.40 3.64 0.30 4.03 0.04 -1.26 -0.47 135.00 142.68 2x5a s PRO 138 Ca -0.02 0.94 -0.27 0.00 0.04 0.00 0.00 61.00 61.68 2x5a s PRO 138 Cb -0.13 -2.09 -0.09 0.00 0.04 0.00 0.00 34.50 32.22 2x5a s PRO 138 CO -0.03 -0.53 0.96 0.42 0.04 0.00 0.00 177.00 177.86 2x5a s ILE 139 N -2.80 4.06 0.33 0.56 -1.09 -0.59 -4.85 121.20 116.82 2x5a s ILE 139 Ca 0.58 1.84 -0.29 0.00 -2.23 0.00 0.00 60.65 60.56 2x5a s ILE 139 Cb -0.12 -4.08 -0.11 0.00 -1.58 0.00 0.00 42.46 36.57 2x5a s ILE 139 CO 0.41 0.27 1.49 -0.69 -1.23 0.00 0.00 174.94 175.18 2x5a s VAL 140 N -1.44 2.23 -0.45 2.92 1.01 -1.26 -4.94 120.40 118.46 2x5a s VAL 140 Ca 0.47 0.21 -0.17 0.00 0.00 0.00 0.00 61.98 62.50 2x5a s VAL 140 Cb -0.22 -3.14 0.04 0.00 0.00 0.00 0.00 36.38 33.06 2x5a s VAL 140 CO 0.28 0.04 0.44 -1.10 0.00 0.00 0.00 175.10 174.76 2x5a s GLN 141 N -1.36 3.04 -0.07 2.72 -0.21 -1.26 -4.64 119.66 117.88 2x5a s GLN 141 Ca 0.56 -1.02 -0.20 0.00 0.02 0.00 0.00 55.36 54.72 2x5a s GLN 141 Cb -0.45 -4.05 -0.04 0.00 1.00 0.00 0.00 33.01 29.47 2x5a s GLN 141 CO 0.55 -0.96 0.57 0.99 -2.12 0.00 0.00 175.29 174.31 2x5a s THR 142 N 2.00 5.08 -0.33 -0.19 2.01 -1.26 -5.04 115.64 117.91 2x5a s THR 142 Ca 0.09 1.17 -0.07 0.00 0.31 0.00 0.00 61.69 63.19 2x5a s THR 142 Cb -0.20 -3.91 0.03 0.00 0.01 0.00 0.00 72.50 68.43 2x5a s THR 142 CO 0.10 0.33 0.10 -0.44 -0.69 0.00 0.00 174.62 174.02 2x5a s SER 143 N 0.46 5.27 -0.43 3.53 0.01 -1.26 -4.54 113.70 116.73 2x5a s SER 143 Ca 0.31 -1.01 -0.16 0.00 1.31 0.00 0.00 55.95 56.40 2x5a s SER 143 Cb -0.17 -1.88 0.03 0.00 0.21 0.00 0.00 66.02 64.22 2x5a s SER 143 CO 0.14 -0.29 0.37 -0.89 0.41 0.00 0.00 173.24 172.98 2x5a s THR 144 N 1.44 5.19 0.16 1.44 2.01 0.88 -5.04 115.64 121.71 2x5a s THR 144 Ca -0.00 -0.63 0.10 0.00 0.31 0.00 0.00 61.69 61.47 2x5a s THR 144 Cb -0.19 -4.01 -0.04 0.00 0.01 0.00 0.00 72.50 68.27 2x5a s THR 144 CO 0.03 -0.41 -0.23 -0.76 -0.69 0.00 0.00 174.62 172.56 2x5a s LEU 145 N 1.84 2.39 -0.17 4.42 1.43 -1.26 -4.60 118.68 122.73 2x5a s LEU 145 Ca 0.07 -0.81 -0.23 0.00 -1.03 0.00 0.00 54.13 52.13 2x5a s LEU 145 Cb -0.19 -1.08 -0.21 0.00 0.03 0.00 0.00 46.19 44.74 2x5a s LEU 145 CO 0.11 0.10 0.45 -0.78 0.23 0.00 0.00 176.35 176.46 2x5a h ASP 146 N 3.50 0.00 -3.17 2.29 3.58 -2.02 -3.48 116.42 117.11 2x5a h ASP 146 Ca -0.47 -0.69 -0.10 0.00 0.42 0.00 0.00 57.03 56.19 2x5a h ASP 146 Cb 1.19 0.00 -0.26 0.00 1.72 0.00 0.00 39.33 41.98 2x5a h ASP 146 CO 0.45 1.17 -0.27 -0.55 -2.88 0.00 0.00 179.24 177.16 2x5a s SER 147 N -6.43 -0.55 -0.11 2.28 0.15 -1.26 -5.15 113.70 102.63 2x5a s SER 147 Ca -0.22 0.95 0.02 0.00 0.70 0.00 0.00 55.95 57.40 2x5a s SER 147 Cb 0.01 0.85 -0.01 0.00 -1.71 0.00 0.00 66.02 65.16 2x5a s SER 147 CO 0.59 -0.20 -0.19 -0.63 1.20 0.00 0.00 173.24 174.01 2x5a s ILE 148 N 1.47 2.52 -0.27 6.45 1.01 -1.26 -5.09 121.20 126.03 2x5a s ILE 148 Ca -0.09 -0.86 -0.03 0.00 0.00 0.00 0.00 60.65 59.67 2x5a s ILE 148 Cb -0.08 -2.01 0.03 0.00 0.01 0.00 0.00 42.46 40.41 2x5a s ILE 148 CO -0.13 0.55 -0.01 -0.55 0.00 0.00 0.00 174.94 174.79 2x5a s SER 149 N 0.28 4.63 0.10 3.58 0.15 -1.26 -5.11 113.70 116.07 2x5a s SER 149 Ca -0.14 -0.92 0.04 0.00 0.70 0.00 0.00 55.95 55.63 2x5a s SER 149 Cb -0.17 -1.73 -0.04 0.00 -1.71 0.00 0.00 66.02 62.38 2x5a s SER 149 CO 0.07 -0.17 -0.10 0.54 1.20 0.00 0.00 173.24 174.78 2x5a s VAL 150 N 1.35 0.93 -0.13 4.45 0.11 -1.26 -5.09 120.40 120.76 2x5a s VAL 150 Ca -0.00 -1.69 -0.07 0.00 -2.93 0.00 0.00 61.98 57.29 2x5a s VAL 150 Cb -0.17 -1.42 -0.02 0.00 -1.53 0.00 0.00 36.38 33.24 2x5a s VAL 150 CO -0.02 -0.60 -0.13 0.78 -3.33 0.00 0.00 175.10 171.80 2x5a h ASN 151 N 3.46 0.00 -4.73 3.54 2.35 -2.09 -3.49 115.58 114.62 2x5a h ASN 151 Ca -0.37 0.00 -0.29 0.00 -0.55 0.00 0.00 56.30 55.09 2x5a h ASN 151 Cb 1.19 0.00 -0.21 0.00 0.05 0.00 0.00 38.32 39.35 2x5a h ASN 151 CO 0.55 0.67 -0.74 -1.81 -1.65 0.00 0.00 177.43 174.45 2x5a s ASP 152 N -5.60 0.96 -0.02 5.81 1.01 -1.26 -5.16 116.67 112.40 2x5a s ASP 152 Ca -0.11 -0.56 -0.02 0.00 0.71 0.00 0.00 52.55 52.57 2x5a s ASP 152 Cb 0.01 0.03 0.01 0.00 1.01 0.00 0.00 42.92 43.98 2x5a s ASP 152 CO 0.16 -0.19 0.06 -0.32 0.21 0.00 0.00 175.17 175.09 2x5a s MET 153 N -1.61 0.07 -0.13 8.23 -2.45 -1.26 -5.15 119.30 116.99 2x5a s MET 153 Ca -0.09 0.08 0.02 0.00 -1.25 0.00 0.00 55.69 54.45 2x5a s MET 153 Cb -0.10 0.03 0.01 0.00 1.25 0.00 0.00 34.83 36.02 2x5a s MET 153 CO 0.01 -0.01 -0.21 0.99 1.05 0.00 0.00 175.02 176.85 2x5a s THR 154 N 0.03 2.19 -0.19 10.11 2.01 -1.26 -5.12 115.64 123.41 2x5a s THR 154 Ca -0.00 -0.95 -0.02 0.00 0.31 0.00 0.00 61.69 61.03 2x5a s THR 154 Cb -0.00 -1.87 -0.01 0.00 0.01 0.00 0.00 72.50 70.62 2x5a s THR 154 CO 0.00 0.55 -0.08 -0.69 -0.69 0.00 0.00 174.62 173.71 2x5a s VAL 155 N 0.70 3.20 -0.09 3.82 1.01 -1.26 -5.01 120.40 122.78 2x5a s VAL 155 Ca -0.09 -0.57 0.15 0.00 0.00 0.00 0.00 61.98 61.47 2x5a s VAL 155 Cb -0.16 -2.42 -0.19 0.00 0.00 0.00 0.00 36.38 33.62 2x5a s VAL 155 CO 0.01 0.47 0.71 -1.54 0.00 0.00 0.00 175.10 174.75 2x5a n SER 156 N 4.33 0.83 0.00 3.32 3.41 -1.26 -4.88 113.62 119.37 2x5a n SER 156 Ca -0.18 0.38 0.00 0.00 -0.26 0.00 0.00 58.87 58.81 2x5a n SER 156 Cb 0.51 0.10 0.00 0.00 -0.26 0.00 0.00 64.21 64.57 2x5a n SER 156 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2x5a n GLY 157 N 1.48 0.23 3.15 5.00 0.00 -1.26 -5.15 105.19 108.66 2x5a n GLY 157 Ca -0.14 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.79 2x5a n GLY 157 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2x5a s SER 158 N -0.98 0.16 -0.19 1.61 0.01 -1.26 -5.15 113.70 107.90 2x5a s SER 158 Ca 0.00 -0.59 -0.06 0.00 1.31 0.00 0.00 55.95 56.61 2x5a s SER 158 Cb 0.00 0.27 -0.03 0.00 0.21 0.00 0.00 66.02 66.47 2x5a s SER 158 CO 0.00 -0.60 0.03 -0.63 0.41 0.00 0.00 173.24 172.46 2x5a s ILE 159 N -3.13 4.39 -0.36 1.44 1.01 -1.26 -5.08 121.20 118.21 2x5a s ILE 159 Ca -0.01 -0.17 -0.14 0.00 0.00 0.00 0.00 60.65 60.34 2x5a s ILE 159 Cb 0.02 -2.98 -0.01 0.00 0.01 0.00 0.00 42.46 39.50 2x5a s ILE 159 CO -0.07 0.44 0.28 -0.62 0.00 0.00 0.00 174.94 174.97 2x5a s ASP 160 N 0.68 6.10 0.22 3.58 -1.08 -1.26 -5.09 116.67 119.82 2x5a s ASP 160 Ca 0.02 -0.47 0.08 0.00 -0.52 0.00 0.00 52.55 51.65 2x5a s ASP 160 Cb -0.14 -2.16 -0.04 0.00 -1.46 0.00 0.00 42.92 39.13 2x5a s ASP 160 CO 0.02 -0.31 0.05 0.68 0.52 0.00 0.00 175.17 176.13 2x5a s VAL 161 N 1.79 3.83 0.44 1.11 -7.23 -1.26 -5.10 120.40 113.99 2x5a s VAL 161 Ca 0.07 -1.55 -0.25 0.00 -1.81 0.00 0.00 61.98 58.44 2x5a s VAL 161 Cb -0.17 -3.00 -0.08 0.00 0.56 0.00 0.00 36.38 33.69 2x5a s VAL 161 CO 0.11 -0.24 1.41 -2.84 -0.31 0.00 0.00 175.10 173.22 2x5a s PRO 162 N -3.36 3.73 -0.07 4.82 0.02 -1.26 -4.74 135.00 134.15 2x5a s PRO 162 Ca 0.30 2.37 0.03 0.00 0.02 0.00 0.00 61.00 63.73 2x5a s PRO 162 Cb -0.08 -2.67 0.01 0.00 0.02 0.00 0.00 34.50 31.78 2x5a s PRO 162 CO 0.21 -0.77 -0.16 0.08 -0.33 0.00 0.00 177.00 176.03 2x5a s VAL 163 N -1.21 1.42 -0.01 3.83 1.01 -1.26 -1.61 120.40 122.57 2x5a s VAL 163 Ca 0.60 -0.66 0.06 0.00 0.00 0.00 0.00 61.98 61.98 2x5a s VAL 163 Cb -0.43 -1.25 -0.01 0.00 0.00 0.00 0.00 36.38 34.68 2x5a s VAL 163 CO 0.55 0.42 -0.19 -1.10 0.00 0.00 0.00 175.10 174.78 2x5a s GLN 164 N 0.45 1.51 0.11 2.72 -0.21 -0.32 -4.99 119.66 118.92 2x5a s GLN 164 Ca -0.13 -0.68 0.09 0.00 0.02 0.00 0.00 55.36 54.66 2x5a s GLN 164 Cb -0.15 -1.47 -0.04 0.00 1.00 0.00 0.00 33.01 32.35 2x5a s GLN 164 CO 0.05 0.40 -0.23 0.95 -2.12 0.00 0.00 175.29 174.34 2x5a s THR 165 N -0.46 1.90 -0.16 -0.19 -4.23 -1.26 -0.50 115.64 110.74 2x5a s THR 165 Ca 0.07 -1.63 -0.10 0.00 -1.18 0.00 0.00 61.69 58.85 2x5a s THR 165 Cb -0.07 -1.71 0.05 0.00 1.34 0.00 0.00 72.50 72.10 2x5a s THR 165 CO -0.01 -0.01 0.39 -0.22 -0.54 0.00 0.00 174.62 174.23 2x5a s LEU 166 N -1.97 0.14 -0.19 4.79 2.96 -0.30 -5.01 118.68 119.09 2x5a s LEU 166 Ca 0.09 0.82 -0.05 0.00 -0.22 0.00 0.00 54.13 54.78 2x5a s LEU 166 Cb -0.10 1.29 -0.03 0.00 0.50 0.00 0.00 46.19 47.85 2x5a s LEU 166 CO 0.05 -0.17 -0.00 -0.89 -1.32 0.00 0.00 176.35 174.01 2x5a s THR 167 N 1.03 3.98 -0.17 3.68 2.01 -1.26 -0.18 115.64 124.73 2x5a s THR 167 Ca -0.07 -0.31 -0.00 0.00 0.31 0.00 0.00 61.69 61.62 2x5a s THR 167 Cb -0.07 -2.79 -0.00 0.00 0.01 0.00 0.00 72.50 69.65 2x5a s THR 167 CO -0.08 0.44 -0.14 -0.69 -0.69 0.00 0.00 174.62 173.46 2x5a s VAL 168 N 0.84 2.74 -1.06 3.82 1.01 0.52 -4.98 120.40 123.28 2x5a s VAL 168 Ca 0.00 -0.73 -0.16 0.00 0.00 0.00 0.00 61.98 61.10 2x5a s VAL 168 Cb -0.14 -2.17 0.16 0.00 0.00 0.00 0.00 36.38 34.23 2x5a s VAL 168 CO 0.02 0.50 1.24 -1.61 0.00 0.00 0.00 175.10 175.25 2x5a s GLU 169 N 0.99 3.86 0.58 2.72 0.41 -1.26 -1.18 118.70 124.82 2x5a s GLU 169 Ca -0.02 -2.27 0.29 0.00 -0.41 0.00 0.00 54.97 52.56 2x5a s GLU 169 Cb -0.15 -4.93 1.76 0.00 -1.78 0.00 0.00 34.13 29.03 2x5a s GLU 169 CO -0.02 -1.70 2.23 0.00 -0.49 0.00 0.00 175.26 175.27 2x5a h ALA 170 N 7.86 1.51 0.00 5.21 0.00 -1.55 -1.07 119.26 131.22 2x5a h ALA 170 Ca 0.23 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.12 2x5a h ALA 170 Cb 0.95 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.73 2x5a h ALA 170 CO 1.14 0.02 0.00 0.41 0.00 0.00 0.00 179.25 180.82 2x5a n GLY 171 N -1.24 2.70 2.65 0.00 0.00 -1.23 -0.58 105.19 107.48 2x5a n GLY 171 Ca -0.03 -1.97 -0.16 0.00 0.00 0.00 0.00 46.02 43.86 2x5a n GLY 171 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2x5a n ASN 172 N 0.00 -5.48 0.00 1.61 3.02 -1.26 -1.80 115.26 111.34 2x5a n ASN 172 Ca 0.00 0.39 0.00 0.00 -0.03 0.00 0.00 54.58 54.94 2x5a n ASN 172 Cb 0.00 -4.37 0.00 0.00 -0.61 0.00 0.00 39.78 34.80 2x5a n ASN 172 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2x5a n GLY 173 N -0.26 0.82 3.73 7.41 0.00 -1.26 -2.00 105.19 113.63 2x5a n GLY 173 Ca -0.16 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.45 2x5a n GLY 173 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2x5a s LEU 174 N 0.00 4.47 -0.04 0.99 2.96 -0.75 -2.02 118.68 124.30 2x5a s LEU 174 Ca 0.00 1.95 0.05 0.00 -0.22 0.00 0.00 54.13 55.91 2x5a s LEU 174 Cb 0.00 -3.59 -0.01 0.00 0.50 0.00 0.00 46.19 43.09 2x5a s LEU 174 CO 0.00 -0.21 -0.20 -1.58 -1.32 0.00 0.00 176.35 173.04 2x5a s GLN 175 N 0.05 1.92 -0.07 1.98 0.74 -0.57 -1.80 119.66 121.91 2x5a s GLN 175 Ca 0.50 -0.73 0.05 0.00 0.05 0.00 0.00 55.36 55.23 2x5a s GLN 175 Cb -0.27 -1.72 -0.01 0.00 1.10 0.00 0.00 33.01 32.11 2x5a s GLN 175 CO 0.32 0.35 -0.22 -0.51 -0.55 0.00 0.00 175.29 174.68 2x5a s LEU 176 N -0.20 2.24 -0.32 3.68 1.43 -0.33 -0.87 118.68 124.32 2x5a s LEU 176 Ca 0.00 -0.45 -0.00 0.00 -1.03 0.00 0.00 54.13 52.65 2x5a s LEU 176 Cb -0.11 -1.43 0.07 0.00 0.03 0.00 0.00 46.19 44.75 2x5a s LEU 176 CO 0.01 0.24 0.03 -1.58 0.23 0.00 0.00 176.35 175.28 2x5a s GLN 177 N -0.11 2.14 -0.16 1.70 -0.44 -0.22 -0.36 119.66 122.22 2x5a s GLN 177 Ca -0.04 -1.50 -0.08 0.00 -2.50 0.00 0.00 55.36 51.24 2x5a s GLN 177 Cb -0.14 -3.21 -0.04 0.00 -1.64 0.00 0.00 33.01 27.98 2x5a s GLN 177 CO 0.04 -0.75 0.12 -0.51 0.50 0.00 0.00 175.29 174.69 2x5a s LEU 178 N 1.14 4.21 -0.16 3.68 1.02 0.75 -0.99 118.68 128.34 2x5a s LEU 178 Ca -0.01 0.31 0.00 0.00 0.02 0.00 0.00 54.13 54.46 2x5a s LEU 178 Cb -0.20 -2.06 0.02 0.00 0.02 0.00 0.00 46.19 43.97 2x5a s LEU 178 CO -0.04 0.28 -0.14 -0.89 0.02 0.00 0.00 176.35 175.58 2x5a s THR 179 N -0.25 1.62 -0.15 5.49 2.01 -0.69 -1.16 115.64 122.52 2x5a s THR 179 Ca 0.10 -0.69 -0.02 0.00 0.31 0.00 0.00 61.69 61.40 2x5a s THR 179 Cb -0.12 -1.53 -0.02 0.00 0.01 0.00 0.00 72.50 70.85 2x5a s THR 179 CO 0.01 0.44 -0.09 -0.75 -0.69 0.00 0.00 174.62 173.54 2x5a s LYS 180 N 1.46 3.48 -0.03 4.92 2.20 0.34 -1.41 119.74 130.71 2x5a s LYS 180 Ca 0.04 -0.62 0.07 0.00 -0.36 0.00 0.00 55.97 55.10 2x5a s LYS 180 Cb -0.13 -2.77 -0.01 0.00 -1.51 0.00 0.00 37.83 33.40 2x5a s LYS 180 CO -0.11 0.17 -0.22 0.15 -0.36 0.00 0.00 175.35 174.98 2x5a s LYS 181 N 0.49 1.94 -1.10 4.03 1.02 -0.04 -1.18 119.74 124.91 2x5a s LYS 181 Ca -0.07 -0.80 0.00 0.00 0.02 0.00 0.00 55.97 55.12 2x5a s LYS 181 Cb -0.15 -1.81 0.00 0.00 -0.52 0.00 0.00 37.83 35.35 2x5a s LYS 181 CO 0.04 0.44 0.00 -1.71 -0.92 0.00 0.00 175.35 173.20 2x5a n ASN 182 N 2.66 -5.37 -0.70 2.83 5.15 -0.63 -1.88 115.26 117.32 2x5a n ASN 182 Ca -0.16 0.26 -0.09 0.00 -0.60 0.00 0.00 54.58 53.98 2x5a n ASN 182 Cb 0.52 -3.78 -0.04 0.00 -0.53 0.00 0.00 39.78 35.95 2x5a n ASN 182 CO 0.00 0.00 0.00 -3.20 1.40 0.00 0.00 177.26 175.46 2x5a n ASN 183 N -0.91 -4.83 0.09 1.20 5.15 -1.26 -4.81 115.26 109.90 2x5a n ASN 183 Ca -0.10 0.23 0.00 0.00 -0.60 0.00 0.00 54.58 54.10 2x5a n ASN 183 Cb 0.53 -3.13 0.00 0.00 -0.53 0.00 0.00 39.78 36.65 2x5a n ASN 183 CO 0.00 0.00 0.00 -0.67 1.40 0.00 0.00 177.26 177.99 2x5a n ASP 184 N -0.43 0.45 -4.69 1.20 4.64 -0.79 -4.77 116.55 112.17 2x5a n ASP 184 Ca -0.09 0.30 -0.42 0.00 -1.38 0.00 0.00 54.79 53.19 2x5a n ASP 184 Cb 0.42 0.03 -0.03 0.00 -1.04 0.00 0.00 41.12 40.51 2x5a n ASP 184 CO 0.00 0.00 0.00 -0.22 -0.82 0.00 0.00 177.20 176.16 2x5a s LEU 185 N -6.86 4.24 -0.08 -2.67 2.96 -0.88 -1.13 118.68 114.25 2x5a s LEU 185 Ca 0.00 1.54 0.04 0.00 -0.22 0.00 0.00 54.13 55.49 2x5a s LEU 185 Cb 0.00 -3.56 -0.01 0.00 0.50 0.00 0.00 46.19 43.13 2x5a s LEU 185 CO 0.00 -0.47 -0.22 -0.69 -1.32 0.00 0.00 176.35 173.65 2x5a s VAL 186 N 2.10 2.25 -0.19 1.68 1.01 -0.12 -0.86 120.40 126.27 2x5a s VAL 186 Ca 0.48 -0.98 -0.01 0.00 0.00 0.00 0.00 61.98 61.47 2x5a s VAL 186 Cb -0.18 -1.85 0.00 0.00 0.00 0.00 0.00 36.38 34.35 2x5a s VAL 186 CO 0.17 0.56 -0.11 -0.63 0.00 0.00 0.00 175.10 175.09 2x5a s ILE 187 N 0.03 2.82 -0.21 2.22 1.01 -0.50 -1.41 121.20 125.16 2x5a s ILE 187 Ca -0.09 -0.69 -0.10 0.00 0.00 0.00 0.00 60.65 59.78 2x5a s ILE 187 Cb -0.15 -2.24 -0.05 0.00 0.01 0.00 0.00 42.46 40.03 2x5a s ILE 187 CO 0.05 0.48 0.13 -0.69 0.00 0.00 0.00 174.94 174.91 2x5a s VAL 188 N 1.27 5.32 -0.20 2.92 1.01 0.12 -1.71 120.40 129.12 2x5a s VAL 188 Ca 0.03 0.16 -0.03 0.00 0.00 0.00 0.00 61.98 62.14 2x5a s VAL 188 Cb -0.14 -3.44 -0.01 0.00 0.00 0.00 0.00 36.38 32.79 2x5a s VAL 188 CO -0.06 0.42 -0.05 -0.13 0.00 0.00 0.00 175.10 175.28 2x5a s ARG 189 N 0.56 3.42 0.13 2.72 0.52 -0.16 -1.25 118.95 124.88 2x5a s ARG 189 Ca 0.07 -0.62 -0.24 0.00 -0.52 0.00 0.00 55.73 54.43 2x5a s ARG 189 Cb -0.12 -2.96 -0.07 0.00 0.52 0.00 0.00 34.95 32.31 2x5a s ARG 189 CO -0.00 -0.11 0.72 -0.06 0.02 0.00 0.00 175.30 175.88 2x5a s PHE 190 N 1.24 3.86 0.31 -0.53 0.08 -0.09 -1.05 117.98 121.81 2x5a s PHE 190 Ca 0.03 1.53 0.04 0.00 0.12 0.00 0.00 56.93 58.64 2x5a s PHE 190 Cb -0.14 -2.71 -0.02 0.00 -0.57 0.00 0.00 43.02 39.57 2x5a s PHE 190 CO -0.01 0.50 0.31 -0.06 -0.10 0.00 0.00 175.22 175.86 2x5a s PHE 191 N -1.00 1.50 0.00 0.36 0.08 -0.04 -3.97 117.98 114.91 2x5a s PHE 191 Ca 0.34 -1.53 0.00 0.00 0.12 0.00 0.00 56.93 55.86 2x5a s PHE 191 Cb -0.22 -0.54 0.00 0.00 -0.57 0.00 0.00 43.02 41.69 2x5a s PHE 191 CO 0.24 -0.90 0.00 0.41 -0.10 0.00 0.00 175.22 174.87 2x5a n GLY 192 N -0.56 -1.71 3.01 4.36 0.00 -1.26 -1.51 105.19 107.51 2x5a n GLY 192 Ca 0.05 -1.43 -0.13 0.00 0.00 0.00 0.00 46.02 44.51 2x5a n GLY 192 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2x5a s SER 193 N -4.00 -0.00 0.01 1.61 0.01 -0.86 -1.74 113.70 108.74 2x5a s SER 193 Ca 0.00 0.50 -0.15 0.00 1.31 0.00 0.00 55.95 57.61 2x5a s SER 193 Cb 0.00 0.44 -0.06 0.00 0.21 0.00 0.00 66.02 66.61 2x5a s SER 193 CO 0.00 -0.19 0.42 -0.69 0.41 0.00 0.00 173.24 173.19 2x5a s VAL 194 N 1.63 5.01 0.10 3.43 1.01 -0.09 -4.07 120.40 127.42 2x5a s VAL 194 Ca -0.06 0.83 -0.17 0.00 0.00 0.00 0.00 61.98 62.59 2x5a s VAL 194 Cb -0.11 -3.72 0.04 0.00 0.00 0.00 0.00 36.38 32.59 2x5a s VAL 194 CO -0.08 0.55 0.40 -0.94 0.00 0.00 0.00 175.10 175.03 2x5a s SER 195 N -1.15 -0.25 -1.13 3.32 1.04 -0.85 -1.53 113.70 113.15 2x5a s SER 195 Ca 0.25 -0.21 -0.14 0.00 0.48 0.00 0.00 55.95 56.33 2x5a s SER 195 Cb -0.17 0.46 -0.03 0.00 0.10 0.00 0.00 66.02 66.38 2x5a s SER 195 CO 0.14 -0.78 0.82 0.59 0.98 0.00 0.00 173.24 174.98 2x5a n ASN 196 N 0.04 -5.24 -3.97 7.02 4.13 -1.04 -4.76 115.26 111.43 2x5a n ASN 196 Ca -0.17 -0.91 -0.09 0.00 1.68 0.00 0.00 54.58 55.09 2x5a n ASN 196 Cb 0.62 -3.97 -0.11 0.00 -1.54 0.00 0.00 39.78 34.78 2x5a n ASN 196 CO 0.00 0.00 0.00 -0.51 0.28 0.00 0.00 177.26 177.03 2x5a s ILE 197 N -3.47 0.11 0.20 2.41 1.10 -1.07 -4.99 121.20 115.48 2x5a s ILE 197 Ca 0.42 -0.94 0.11 0.00 -0.51 0.00 0.00 60.65 59.72 2x5a s ILE 197 Cb -0.12 -0.40 -0.04 0.00 0.15 0.00 0.00 42.46 42.05 2x5a s ILE 197 CO 0.82 -0.52 -0.22 -1.10 -2.11 0.00 0.00 174.94 171.82 2x5a s GLN 198 N -1.66 1.46 0.27 3.50 -0.21 -1.26 -0.45 119.66 121.32 2x5a s GLN 198 Ca -0.14 -1.52 -0.31 0.00 0.02 0.00 0.00 55.36 53.41 2x5a s GLN 198 Cb -0.08 -1.66 -0.12 0.00 1.00 0.00 0.00 33.01 32.15 2x5a s GLN 198 CO -0.01 0.35 1.61 0.36 -2.12 0.00 0.00 175.29 175.47 2x5a n LYS 199 N 0.14 2.67 -0.12 2.91 2.85 -1.26 -2.04 118.16 123.31 2x5a n LYS 199 Ca -0.12 0.95 0.00 0.00 -1.05 0.00 0.00 58.31 58.10 2x5a n LYS 199 Cb 0.57 -2.74 0.00 0.00 -0.65 0.00 0.00 35.03 32.21 2x5a n LYS 199 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2x5a n GLY 200 N 2.50 1.86 3.80 2.58 0.00 0.50 -5.02 105.19 111.41 2x5a n GLY 200 Ca 0.10 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.74 2x5a n GLY 200 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2x5a s TRP 201 N -2.82 3.77 0.22 1.61 0.52 -0.87 -4.77 118.94 116.61 2x5a s TRP 201 Ca 0.00 1.46 -0.30 0.00 0.02 0.00 0.00 56.10 57.28 2x5a s TRP 201 Cb 0.00 -2.65 -0.09 0.00 -1.15 0.00 0.00 33.47 29.58 2x5a s TRP 201 CO 0.00 0.45 1.21 1.21 0.02 0.00 0.00 176.95 179.83 2x5a s ASN 202 N -1.38 7.06 0.43 2.95 2.47 -1.26 -0.68 114.94 124.53 2x5a s ASN 202 Ca 0.38 2.31 -0.25 0.00 0.42 0.00 0.00 52.86 55.72 2x5a s ASN 202 Cb -0.19 -2.62 -0.08 0.00 -1.45 0.00 0.00 41.25 36.91 2x5a s ASN 202 CO 0.23 -0.37 1.30 -0.04 -3.72 0.00 0.00 177.10 174.49 2x5a s MET 203 N -0.61 3.83 0.00 0.43 -1.94 -0.04 -4.90 119.30 116.08 2x5a s MET 203 Ca 0.51 2.12 0.24 0.00 -1.71 0.00 0.00 55.69 56.86 2x5a s MET 203 Cb -0.34 -2.65 1.45 0.00 2.01 0.00 0.00 34.83 35.30 2x5a s MET 203 CO 0.39 -0.59 1.82 -1.13 -0.01 0.00 0.00 175.02 175.50 2x5a n SER 204 N -0.10 0.00 0.00 3.03 3.41 -1.25 -4.86 113.62 113.85 2x5a n SER 204 Ca 0.05 -0.79 0.00 0.00 -0.26 0.00 0.00 58.87 57.87 2x5a n SER 204 Cb 0.44 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.39 2x5a n SER 204 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2x5a n GLY 205 N 0.54 2.80 3.75 5.00 0.00 0.25 -4.84 105.19 112.70 2x5a n GLY 205 Ca 0.18 -1.83 -0.41 0.00 0.00 0.00 0.00 46.02 43.96 2x5a n GLY 205 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2x5a s THR 206 N 3.24 3.01 0.49 2.61 2.01 -0.41 -4.81 115.64 121.77 2x5a s THR 206 Ca 0.00 0.91 -0.11 0.00 0.31 0.00 0.00 61.69 62.80 2x5a s THR 206 Cb 0.00 -3.58 -0.06 0.00 0.01 0.00 0.00 72.50 68.87 2x5a s THR 206 CO 0.00 0.17 0.87 0.26 -0.69 0.00 0.00 174.62 175.23 2x5a s TRP 207 N -0.47 3.52 0.16 4.92 0.52 -1.26 -4.34 118.94 121.98 2x5a s TRP 207 Ca 0.53 1.13 -0.31 0.00 0.02 0.00 0.00 56.10 57.47 2x5a s TRP 207 Cb -0.38 -2.54 -0.09 0.00 -1.15 0.00 0.00 33.47 29.31 2x5a s TRP 207 CO 0.44 -0.31 1.48 0.08 0.02 0.00 0.00 176.95 178.66 2x5a s VAL 208 N -2.66 2.89 0.47 4.03 1.01 0.62 -4.97 120.40 121.79 2x5a s VAL 208 Ca 0.53 0.66 -0.24 0.00 0.00 0.00 0.00 61.98 62.92 2x5a s VAL 208 Cb -0.10 -3.42 -0.08 0.00 0.00 0.00 0.00 36.38 32.78 2x5a s VAL 208 CO 0.39 0.06 1.32 0.47 0.00 0.00 0.00 175.10 177.34 2x5a n ASP 209 N 3.69 2.71 -0.31 3.32 9.92 -1.26 -4.59 116.55 130.02 2x5a n ASP 209 Ca 0.12 1.07 0.12 0.00 -0.53 0.00 0.00 54.79 55.56 2x5a n ASP 209 Cb 0.40 -1.54 0.26 0.00 -0.64 0.00 0.00 41.12 39.60 2x5a n ASP 209 CO 0.00 0.00 0.00 -0.09 0.13 0.00 0.00 177.20 177.24 2x5a h ARG 210 N 1.91 0.07 0.00 -1.24 2.43 -1.96 -1.20 114.38 114.40 2x5a h ARG 210 Ca -0.49 -0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.67 2x5a h ARG 210 Cb 1.29 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.83 2x5a h ARG 210 CO 0.59 0.05 0.00 -2.30 -1.51 0.00 0.00 179.97 176.80 2x5a n PRO 211 N -5.40 0.16 0.00 0.20 -0.02 -1.26 -1.98 135.00 126.70 2x5a n PRO 211 Ca 0.21 0.58 0.08 0.00 -2.02 0.00 0.00 63.50 62.34 2x5a n PRO 211 Cb 0.68 -1.94 0.01 0.00 -0.02 0.00 0.00 33.50 32.23 2x5a n PRO 211 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 2x5a n PHE 212 N -2.26 0.00 -2.25 6.00 3.72 -0.46 -5.00 117.46 117.20 2x5a n PHE 212 Ca -0.00 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 56.98 2x5a n PHE 212 Cb 0.09 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.60 2x5a n PHE 212 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 176.76 177.74 2x5a s ARG 213 N -1.75 4.36 0.66 -1.08 0.52 -0.84 -4.99 118.95 115.84 2x5a s ARG 213 Ca 0.14 1.99 -0.11 0.00 -0.52 0.00 0.00 55.73 57.22 2x5a s ARG 213 Cb 0.12 -3.27 -0.01 0.00 0.52 0.00 0.00 34.95 32.32 2x5a s ARG 213 CO 0.36 -0.36 1.06 -1.25 0.02 0.00 0.00 175.30 175.13 2x5a s PRO 214 N 0.90 3.23 0.24 3.54 0.04 -1.26 -4.90 135.00 136.79 2x5a s PRO 214 Ca 0.62 0.64 0.06 0.00 0.04 0.00 0.00 61.00 62.35 2x5a s PRO 214 Cb -0.35 -2.05 0.26 0.00 0.04 0.00 0.00 34.50 32.40 2x5a s PRO 214 CO 0.31 -0.81 1.56 0.00 0.04 0.00 0.00 177.00 178.10 2x5a h ALA 215 N -0.50 0.86 -2.93 8.56 0.00 -1.67 -3.37 119.26 120.22 2x5a h ALA 215 Ca -0.44 -0.56 -0.41 0.00 0.00 0.00 0.00 54.91 53.50 2x5a h ALA 215 Cb 1.22 -0.09 -0.18 0.00 0.00 0.00 0.00 17.79 18.74 2x5a h ALA 215 CO 0.62 0.75 -0.76 0.00 0.00 0.00 0.00 179.25 179.87 2x5a s ALA 216 N -3.69 1.45 0.18 0.00 0.00 -1.26 -4.81 121.76 113.64 2x5a s ALA 216 Ca -0.03 -1.27 -0.33 0.00 0.00 0.00 0.00 51.96 50.33 2x5a s ALA 216 Cb 0.12 -0.07 -0.14 0.00 0.00 0.00 0.00 23.12 23.03 2x5a s ALA 216 CO 0.79 0.10 1.43 1.55 0.00 0.00 0.00 175.76 179.63 2x5a n VAL 217 N 0.59 0.47 -4.15 0.00 3.14 -1.26 -4.67 118.33 112.45 2x5a n VAL 217 Ca -0.16 -0.12 -0.33 0.00 -2.96 0.00 0.00 64.34 60.77 2x5a n VAL 217 Cb 0.57 -1.34 -0.16 0.00 -1.06 0.00 0.00 33.84 31.85 2x5a n VAL 217 CO 0.00 0.00 0.00 -1.10 -6.46 0.00 0.00 176.83 169.27 2x5a s GLN 218 N 0.20 3.00 -0.32 1.45 -1.52 -0.61 -4.96 119.66 116.90 2x5a s GLN 218 Ca 0.75 -0.83 -0.19 0.00 -1.95 0.00 0.00 55.36 53.14 2x5a s GLN 218 Cb -0.72 -2.57 -0.01 0.00 -0.22 0.00 0.00 33.01 29.48 2x5a s GLN 218 CO 0.45 -0.20 0.54 -1.12 -0.25 0.00 0.00 175.29 174.72 2x5a s SER 219 N 1.26 6.38 -0.22 5.90 0.01 -1.26 -0.80 113.70 124.98 2x5a s SER 219 Ca 0.04 0.21 -0.02 0.00 1.31 0.00 0.00 55.95 57.48 2x5a s SER 219 Cb -0.13 -2.29 0.00 0.00 0.21 0.00 0.00 66.02 63.81 2x5a s SER 219 CO -0.12 -0.44 -0.08 -0.76 0.41 0.00 0.00 173.24 172.25 2x5a s LEU 220 N 2.44 2.76 0.13 2.44 1.43 0.29 -4.95 118.68 123.23 2x5a s LEU 220 Ca 0.21 -0.52 -0.30 0.00 -1.03 0.00 0.00 54.13 52.49 2x5a s LEU 220 Cb -0.15 -1.67 -0.06 0.00 0.03 0.00 0.00 46.19 44.34 2x5a s LEU 220 CO 0.12 -0.03 1.04 -0.69 0.23 0.00 0.00 176.35 177.02 2x5a s VAL 221 N 1.41 4.21 0.30 -1.59 1.01 -1.26 -1.82 120.40 122.67 2x5a s VAL 221 Ca 0.05 1.83 0.04 0.00 0.00 0.00 0.00 61.98 63.90 2x5a s VAL 221 Cb -0.14 -4.17 -0.06 0.00 0.00 0.00 0.00 36.38 32.01 2x5a s VAL 221 CO -0.06 0.28 0.04 -0.83 0.00 0.00 0.00 175.10 174.53 2x5a s GLY 222 N 0.08 1.97 0.04 4.51 0.00 0.33 -4.63 107.32 109.62 2x5a s GLY 222 Ca 0.49 -2.00 0.05 0.00 0.00 0.00 0.00 44.72 43.26 2x5a s GLY 222 CO 0.32 -1.79 -0.15 -1.58 0.00 0.00 0.00 173.10 169.90 2x5a s HIS 223 N -3.31 1.29 -0.35 1.90 2.46 0.32 -1.85 115.29 115.75 2x5a s HIS 223 Ca 0.35 -0.36 -0.21 0.00 0.47 0.00 0.00 55.06 55.31 2x5a s HIS 223 Cb 0.08 -0.76 0.00 0.00 -0.13 0.00 0.00 32.58 31.77 2x5a s HIS 223 CO 0.14 0.04 0.66 -0.06 -2.47 0.00 0.00 174.74 173.06 2x5a s PHE 224 N -0.87 3.16 0.08 3.88 0.08 -0.91 -1.10 117.98 122.30 2x5a s PHE 224 Ca 0.02 0.42 -0.35 0.00 0.12 0.00 0.00 56.93 57.14 2x5a s PHE 224 Cb -0.08 -3.15 -0.14 0.00 -0.57 0.00 0.00 43.02 39.07 2x5a s PHE 224 CO 0.01 -0.62 1.56 0.00 -0.10 0.00 0.00 175.22 176.08 2x5a n ALA 225 N 6.08 0.59 -1.03 5.36 0.00 -0.71 -1.90 120.51 128.89 2x5a n ALA 225 Ca -0.00 0.44 -0.01 0.00 0.00 0.00 0.00 53.44 53.86 2x5a n ALA 225 Cb 0.49 -2.29 -0.00 0.00 0.00 0.00 0.00 19.45 17.64 2x5a n ALA 225 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2x5a n GLY 226 N 3.35 0.46 3.52 0.00 0.00 -1.26 -4.81 105.19 106.45 2x5a n GLY 226 Ca 0.19 -0.17 -0.24 0.00 0.00 0.00 0.00 46.02 45.80 2x5a n GLY 226 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2x5a s ARG 227 N -0.94 1.78 0.00 1.61 0.52 -0.80 -5.04 118.95 116.08 2x5a s ARG 227 Ca 0.00 -2.00 0.25 0.00 -0.52 0.00 0.00 55.73 53.45 2x5a s ARG 227 Cb 0.00 -1.11 0.58 0.00 0.52 0.00 0.00 34.95 34.94 2x5a s ARG 227 CO 0.00 -0.17 1.48 -0.25 0.02 0.00 0.00 175.30 176.38 2x5a n ASP 228 N -0.82 2.41 -4.91 0.23 8.00 -1.26 -4.81 116.55 115.38 2x5a n ASP 228 Ca -0.04 -1.80 -0.29 0.00 0.71 0.00 0.00 54.79 53.37 2x5a n ASP 228 Cb 0.67 -0.05 -0.04 0.00 -0.02 0.00 0.00 41.12 41.68 2x5a n ASP 228 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 2x5a s THR 229 N -1.90 5.17 0.29 -3.53 -4.23 -1.26 -5.05 115.64 105.13 2x5a s THR 229 Ca 0.33 -0.14 0.02 0.00 -1.18 0.00 0.00 61.69 60.72 2x5a s THR 229 Cb 0.20 -3.68 -0.04 0.00 1.34 0.00 0.00 72.50 70.32 2x5a s THR 229 CO 0.31 -0.09 0.13 -0.94 -0.54 0.00 0.00 174.62 173.49 2x5a s SER 230 N -2.82 1.45 0.29 3.99 1.04 -1.26 -2.14 113.70 114.24 2x5a s SER 230 Ca 0.40 -1.49 -0.06 0.00 0.48 0.00 0.00 55.95 55.29 2x5a s SER 230 Cb -0.12 0.29 -0.01 0.00 0.10 0.00 0.00 66.02 66.29 2x5a s SER 230 CO 0.27 -0.82 0.43 0.72 0.98 0.00 0.00 173.24 174.82 2x5a s PHE 231 N -3.65 0.84 0.00 5.02 -0.12 -0.77 -4.71 117.98 114.58 2x5a s PHE 231 Ca 0.36 -1.11 -0.11 0.00 -0.05 0.00 0.00 56.93 56.01 2x5a s PHE 231 Cb 0.06 -0.06 0.01 0.00 -0.63 0.00 0.00 43.02 42.40 2x5a s PHE 231 CO 0.16 -1.02 0.23 -3.38 -0.05 0.00 0.00 175.22 171.16 2x5a s HIS 232 N -3.54 -0.07 0.12 3.49 -3.43 -1.26 -0.51 115.29 110.09 2x5a s HIS 232 Ca 0.29 0.03 0.08 0.00 -0.80 0.00 0.00 55.06 54.66 2x5a s HIS 232 Cb 0.01 0.03 -0.04 0.00 -1.43 0.00 0.00 32.58 31.15 2x5a s HIS 232 CO 0.15 -0.37 -0.20 0.96 -2.00 0.00 0.00 174.74 173.28 2x5a s ILE 233 N -1.62 1.74 -0.20 -5.38 -5.25 -0.76 -0.49 121.20 109.24 2x5a s ILE 233 Ca -0.12 -1.63 -0.05 0.00 -0.99 0.00 0.00 60.65 57.87 2x5a s ILE 233 Cb -0.05 -1.62 -0.02 0.00 2.95 0.00 0.00 42.46 43.72 2x5a s ILE 233 CO 0.02 -0.12 -0.01 -1.81 -1.79 0.00 0.00 174.94 171.23 2x5a s ASP 234 N -2.07 4.71 -0.43 4.36 1.11 -0.22 -0.54 116.67 123.59 2x5a s ASP 234 Ca 0.08 -0.24 -0.19 0.00 0.18 0.00 0.00 52.55 52.38 2x5a s ASP 234 Cb -0.09 -1.81 0.02 0.00 1.07 0.00 0.00 42.92 42.12 2x5a s ASP 234 CO 0.05 0.05 0.55 -0.63 1.18 0.00 0.00 175.17 176.37 2x5a s ILE 235 N 1.10 4.94 0.40 0.77 1.01 0.02 -1.38 121.20 128.06 2x5a s ILE 235 Ca 0.02 -0.06 -0.16 0.00 0.00 0.00 0.00 60.65 60.45 2x5a s ILE 235 Cb -0.14 -4.13 -0.09 0.00 0.01 0.00 0.00 42.46 38.11 2x5a s ILE 235 CO 0.01 -0.51 0.84 0.20 0.00 0.00 0.00 174.94 175.49 2x5a s ASN 236 N 1.91 6.73 0.61 3.58 0.01 -0.33 -1.57 114.94 125.88 2x5a s ASN 236 Ca 0.18 1.41 0.30 0.00 -0.71 0.00 0.00 52.86 54.04 2x5a s ASN 236 Cb -0.15 -2.43 1.62 0.00 0.41 0.00 0.00 41.25 40.70 2x5a s ASN 236 CO 0.17 -0.36 2.01 -0.65 -1.51 0.00 0.00 177.10 176.76 2x5a h PRO 237 N 1.70 0.00 0.00 -0.60 0.11 -1.83 -0.01 132.00 131.37 2x5a h PRO 237 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 2x5a h PRO 237 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 2x5a h PRO 237 CO 0.63 0.00 0.00 0.27 -0.21 0.00 0.00 178.00 178.69 2x5a n ASN 238 N -3.58 0.00 0.00 -2.05 0.23 -1.26 -4.69 115.26 103.91 2x5a n ASN 238 Ca 0.03 0.22 0.00 0.00 -0.53 0.00 0.00 54.58 54.30 2x5a n ASN 238 Cb 0.44 -0.40 0.00 0.00 -2.08 0.00 0.00 39.78 37.74 2x5a n ASN 238 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2x5a n GLY 239 N 1.29 1.53 3.77 4.83 0.00 -0.02 -4.90 105.19 111.69 2x5a n GLY 239 Ca 0.10 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.79 2x5a n GLY 239 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2x5a s SER 240 N -1.62 5.02 -0.15 1.61 1.04 -1.26 -0.27 113.70 118.06 2x5a s SER 240 Ca 0.00 2.00 0.02 0.00 0.48 0.00 0.00 55.95 58.45 2x5a s SER 240 Cb 0.00 -2.55 0.02 0.00 0.10 0.00 0.00 66.02 63.58 2x5a s SER 240 CO 0.00 -1.69 -0.20 -0.63 0.98 0.00 0.00 173.24 171.70 2x5a s ILE 241 N -2.37 1.98 -0.17 -1.02 1.01 -1.26 -1.19 121.20 118.18 2x5a s ILE 241 Ca 0.67 -0.91 -0.07 0.00 0.00 0.00 0.00 60.65 60.33 2x5a s ILE 241 Cb -0.21 -1.78 -0.04 0.00 0.01 0.00 0.00 42.46 40.45 2x5a s ILE 241 CO 0.43 0.53 0.06 -0.89 0.00 0.00 0.00 174.94 175.06 2x5a s THR 242 N 1.06 4.74 -0.04 2.92 2.01 -0.48 -0.86 115.64 124.99 2x5a s THR 242 Ca -0.02 -0.05 -0.30 0.00 0.31 0.00 0.00 61.69 61.63 2x5a s THR 242 Cb -0.14 -3.12 -0.03 0.00 0.01 0.00 0.00 72.50 69.21 2x5a s THR 242 CO -0.07 0.48 1.06 0.86 -0.69 0.00 0.00 174.62 176.26 2x5a s TRP 243 N 0.26 3.49 -0.10 4.92 -0.11 0.14 -1.05 118.94 126.48 2x5a s TRP 243 Ca 0.03 1.51 0.13 0.00 1.22 0.00 0.00 56.10 59.00 2x5a s TRP 243 Cb -0.12 -3.25 0.24 0.00 -1.50 0.00 0.00 33.47 28.84 2x5a s TRP 243 CO 0.00 -0.52 1.12 0.91 -4.62 0.00 0.00 176.95 173.84 2x5a n TRP 244 N 4.53 0.00 -2.13 5.86 7.02 0.36 -0.37 117.44 132.70 2x5a n TRP 244 Ca 0.08 -0.78 -0.08 0.00 -1.02 0.00 0.00 57.50 55.71 2x5a n TRP 244 Cb 0.49 -0.14 0.04 0.00 -2.42 0.00 0.00 31.31 29.28 2x5a n TRP 244 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 2x5a n GLY 245 N -0.88 0.32 3.78 6.99 0.00 -1.21 -4.25 105.19 109.94 2x5a n GLY 245 Ca 0.12 -1.92 -0.29 0.00 0.00 0.00 0.00 46.02 43.93 2x5a n GLY 245 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2x5a s ALA 246 N -3.12 1.85 0.24 4.61 0.00 -1.26 -4.14 121.76 119.93 2x5a s ALA 246 Ca 0.21 -0.37 -0.30 0.00 0.00 0.00 0.00 51.96 51.50 2x5a s ALA 246 Cb -0.01 -3.08 -0.10 0.00 0.00 0.00 0.00 23.12 19.93 2x5a s ALA 246 CO 0.14 -2.15 1.45 -0.80 0.00 0.00 0.00 175.76 174.40 2x5a s ASN 247 N -3.89 6.65 -0.10 0.00 0.01 -1.26 -4.59 114.94 111.75 2x5a s ASN 247 Ca 0.63 2.65 -0.00 0.00 -0.71 0.00 0.00 52.86 55.43 2x5a s ASN 247 Cb -0.15 -2.62 -0.03 0.00 0.41 0.00 0.00 41.25 38.86 2x5a s ASN 247 CO 0.54 -0.72 -0.08 -0.63 -1.51 0.00 0.00 177.10 174.70 2x5a s ILE 248 N 0.15 3.54 0.44 0.60 1.01 0.41 -5.00 121.20 122.36 2x5a s ILE 248 Ca 0.61 -0.51 -0.06 0.00 0.00 0.00 0.00 60.65 60.69 2x5a s ILE 248 Cb -0.42 -2.48 0.10 0.00 0.01 0.00 0.00 42.46 39.67 2x5a s ILE 248 CO 0.42 0.55 0.60 -0.90 0.00 0.00 0.00 174.94 175.61 2x5a n ASP 249 N 2.89 0.25 -0.13 3.58 5.68 -1.26 -2.50 116.55 125.05 2x5a n ASP 249 Ca -0.18 -1.34 0.15 0.00 -0.50 0.00 0.00 54.79 52.92 2x5a n ASP 249 Cb 0.53 -0.44 0.51 0.00 -1.14 0.00 0.00 41.12 40.58 2x5a n ASP 249 CO 0.00 0.00 0.00 0.07 -1.33 0.00 0.00 177.20 175.94 2x5a h LYS 250 N 0.00 0.38 -6.20 0.11 2.10 -1.97 -3.17 116.57 107.83 2x5a h LYS 250 Ca -0.20 -0.02 -0.56 0.00 -2.00 0.00 0.00 60.65 57.87 2x5a h LYS 250 Cb 0.59 -0.09 -0.03 0.00 -0.90 0.00 0.00 32.23 31.80 2x5a h LYS 250 CO 0.16 0.25 0.94 0.99 -2.00 0.00 0.00 179.45 179.79 2x5a s THR 251 N -5.38 4.07 0.37 0.07 2.01 -1.26 -4.74 115.64 110.77 2x5a s THR 251 Ca -0.08 1.31 -0.26 0.00 0.31 0.00 0.00 61.69 62.97 2x5a s THR 251 Cb 0.21 -3.84 -0.09 0.00 0.01 0.00 0.00 72.50 68.78 2x5a s THR 251 CO 0.76 -0.10 1.12 -2.84 -0.69 0.00 0.00 174.62 172.87 2x5a s PRO 252 N 3.51 4.25 -0.12 4.92 0.02 -1.26 -4.73 135.00 141.59 2x5a s PRO 252 Ca 0.60 1.76 0.03 0.00 0.02 0.00 0.00 61.00 63.41 2x5a s PRO 252 Cb -0.25 -2.79 0.00 0.00 0.02 0.00 0.00 34.50 31.48 2x5a s PRO 252 CO 0.19 -0.13 -0.23 0.42 -0.33 0.00 0.00 177.00 176.93 2x5a s ILE 253 N -1.40 2.10 0.15 2.83 1.01 -0.58 -4.88 121.20 120.42 2x5a s ILE 253 Ca 0.54 -0.99 -0.31 0.00 0.00 0.00 0.00 60.65 59.89 2x5a s ILE 253 Cb -0.29 -1.82 -0.10 0.00 0.01 0.00 0.00 42.46 40.26 2x5a s ILE 253 CO 0.37 0.55 1.62 0.00 0.00 0.00 0.00 174.94 177.48 2x5a s ALA 254 N 0.55 3.78 -0.19 9.38 0.00 -1.26 -0.91 121.76 133.11 2x5a s ALA 254 Ca -0.13 1.37 -0.04 0.00 0.00 0.00 0.00 51.96 53.16 2x5a s ALA 254 Cb -0.17 -3.65 -0.02 0.00 0.00 0.00 0.00 23.12 19.28 2x5a s ALA 254 CO 0.04 -0.89 -0.04 0.95 0.00 0.00 0.00 175.76 175.82 2x5a s THR 255 N 1.54 3.61 0.21 0.00 -4.23 -0.71 -1.75 115.64 114.32 2x5a s THR 255 Ca 0.72 -0.44 -0.01 0.00 -1.18 0.00 0.00 61.69 60.79 2x5a s THR 255 Cb -0.44 -2.61 -0.04 0.00 1.34 0.00 0.00 72.50 70.75 2x5a s THR 255 CO 0.32 0.46 0.13 -0.13 -0.54 0.00 0.00 174.62 174.85 2x5a s ARG 256 N 0.91 1.24 0.00 3.99 1.81 -0.26 -3.07 118.95 123.57 2x5a s ARG 256 Ca -0.00 -1.66 0.00 0.00 -1.72 0.00 0.00 55.73 52.35 2x5a s ARG 256 Cb -0.15 0.20 0.00 0.00 -0.45 0.00 0.00 34.95 34.56 2x5a s ARG 256 CO 0.01 -0.38 0.00 0.41 -0.68 0.00 0.00 175.30 174.66 2x5a n GLY 257 N -0.30 3.70 3.53 -3.53 0.00 -1.25 -0.52 105.19 106.82 2x5a n GLY 257 Ca 0.02 -1.71 -0.34 0.00 0.00 0.00 0.00 46.02 43.99 2x5a n GLY 257 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2x5a s ASN 258 N 0.00 4.85 -0.01 1.61 -0.87 -1.26 -0.91 114.94 118.35 2x5a s ASN 258 Ca 0.00 -0.08 0.02 0.00 -1.57 0.00 0.00 52.86 51.23 2x5a s ASN 258 Cb 0.00 -1.68 -0.00 0.00 -0.02 0.00 0.00 41.25 39.55 2x5a s ASN 258 CO 0.00 0.22 -0.08 -0.83 -2.57 0.00 0.00 177.10 173.84 2x5a s GLY 259 N 0.08 0.42 0.10 0.66 0.00 -0.38 -4.90 107.32 103.30 2x5a s GLY 259 Ca -0.00 -0.32 0.09 0.00 0.00 0.00 0.00 44.72 44.49 2x5a s GLY 259 CO 0.03 -0.19 -0.19 -0.56 0.00 0.00 0.00 173.10 172.19 2x5a s SER 260 N -0.03 3.84 0.12 1.64 0.01 -1.26 0.10 113.70 118.11 2x5a s SER 260 Ca 0.01 -0.54 -0.16 0.00 1.31 0.00 0.00 55.95 56.57 2x5a s SER 260 Cb -0.05 -0.54 0.03 0.00 0.21 0.00 0.00 66.02 65.67 2x5a s SER 260 CO -0.00 0.19 0.38 -0.72 0.41 0.00 0.00 173.24 173.51 2x5a s TYR 261 N -1.09 -0.18 -0.14 2.43 -0.85 -0.50 -5.01 117.35 112.00 2x5a s TYR 261 Ca 0.17 -0.13 -0.07 0.00 -0.52 0.00 0.00 57.07 56.53 2x5a s TYR 261 Cb -0.11 0.23 -0.04 0.00 0.38 0.00 0.00 41.96 42.42 2x5a s TYR 261 CO 0.09 -0.68 0.09 -0.06 -1.52 0.00 0.00 175.55 173.47 2x5a s PHE 262 N -3.71 3.38 -0.01 -3.49 0.08 -1.26 -0.94 117.98 112.02 2x5a s PHE 262 Ca 0.02 0.29 -0.21 0.00 0.12 0.00 0.00 56.93 57.15 2x5a s PHE 262 Cb 0.02 -1.98 -0.25 0.00 -0.57 0.00 0.00 43.02 40.24 2x5a s PHE 262 CO -0.11 0.44 1.05 0.82 -0.10 0.00 0.00 175.22 177.32 2x5a h ILE 263 N 4.39 1.47 -0.01 0.64 2.04 -1.43 -3.42 117.51 121.18 2x5a h ILE 263 Ca -0.46 -2.13 0.00 0.00 1.00 0.00 0.00 64.86 63.26 2x5a h ILE 263 Cb 1.19 2.73 0.00 0.00 -0.74 0.00 0.00 36.82 40.00 2x5a h ILE 263 CO 0.64 0.61 0.00 0.29 0.00 0.00 0.00 178.15 179.69