#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2rgk s LYS 2 N 0.00 3.76 0.00 2.12 1.02 -1.26 -4.94 119.74 120.44 2rgk s LYS 2 Ca 0.00 -0.45 0.00 0.00 0.02 0.00 0.00 55.97 55.54 2rgk s LYS 2 Cb 0.00 -3.18 0.00 0.00 -0.52 0.00 0.00 37.83 34.13 2rgk s LYS 2 CO 0.00 0.08 0.00 0.91 -0.92 0.00 0.00 175.35 175.42 2rgk n TRP 3 N 4.10 0.00 -1.64 3.18 7.02 -1.26 -4.94 117.44 123.89 2rgk n TRP 3 Ca -0.17 0.00 -0.45 0.00 -1.02 0.00 0.00 57.50 55.86 2rgk n TRP 3 Cb 0.52 0.11 -0.03 0.00 -2.42 0.00 0.00 31.31 29.49 2rgk n TRP 3 CO 0.00 0.00 0.00 1.19 -2.02 0.00 0.00 177.69 176.86 2rgk n PHE 4 N -2.89 1.87 -1.80 -5.99 3.72 -1.26 -1.92 117.46 109.19 2rgk n PHE 4 Ca 0.00 0.54 -0.19 0.00 -0.05 0.00 0.00 57.45 57.74 2rgk n PHE 4 Cb 0.39 -2.39 -0.06 0.00 -0.94 0.00 0.00 39.48 36.48 2rgk n PHE 4 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 176.76 176.80 2rgk n ASN 5 N 1.82 -5.42 -4.49 4.37 5.03 -1.26 -4.98 115.26 110.33 2rgk n ASN 5 Ca 0.11 0.33 -0.34 0.00 0.87 0.00 0.00 54.58 55.55 2rgk n ASN 5 Cb 0.31 -4.58 -0.12 0.00 -1.02 0.00 0.00 39.78 34.36 2rgk n ASN 5 CO 0.00 0.00 0.00 0.42 -1.83 0.00 0.00 177.26 175.85 2rgk s THR 6 N -2.80 4.05 0.52 3.41 -4.23 -0.81 -1.07 115.64 114.72 2rgk s THR 6 Ca 0.00 -0.29 0.22 0.00 -1.18 0.00 0.00 61.69 60.45 2rgk s THR 6 Cb 0.00 -2.82 0.36 0.00 1.34 0.00 0.00 72.50 71.38 2rgk s THR 6 CO 0.00 0.45 2.04 -0.07 -0.54 0.00 0.00 174.62 176.50 2rgk h LEU 7 N 7.15 0.01 -0.29 4.79 3.38 0.93 -1.53 115.31 129.75 2rgk h LEU 7 Ca -0.34 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.57 2rgk h LEU 7 Cb 1.18 -0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.92 2rgk h LEU 7 CO 0.63 0.01 -0.02 0.77 0.09 0.00 0.00 178.44 179.91 2rgk h SER 8 N 0.02 0.52 -0.26 -0.43 4.64 -1.93 -0.32 113.55 115.78 2rgk h SER 8 Ca 0.18 -0.33 -0.07 0.00 -0.47 0.00 0.00 61.79 61.11 2rgk h SER 8 Cb 0.71 -0.14 -0.01 0.00 -0.31 0.00 0.00 62.40 62.65 2rgk h SER 8 CO -0.00 0.72 -0.09 -0.74 -0.87 0.00 0.00 176.83 175.84 2rgk h HIS 9 N 0.30 0.60 0.00 4.77 -0.00 -1.66 -2.78 115.15 116.38 2rgk h HIS 9 Ca 0.08 -0.14 -0.01 0.00 -0.00 0.00 0.00 60.37 60.30 2rgk h HIS 9 Cb 0.47 -0.14 -0.00 0.00 -0.00 0.00 0.00 27.41 27.74 2rgk h HIS 9 CO 0.04 0.76 -0.03 -0.91 -0.00 0.00 0.00 177.93 177.79 2rgk h ASN 10 N 0.26 0.00 -0.30 3.26 4.21 -1.22 -0.46 115.58 121.33 2rgk h ASN 10 Ca 0.06 0.00 -0.18 0.00 1.21 0.00 0.00 56.30 57.40 2rgk h ASN 10 Cb 0.58 0.00 -0.00 0.00 -1.12 0.00 0.00 38.32 37.78 2rgk h ASN 10 CO 0.03 0.03 -0.50 0.03 -1.29 0.00 0.00 177.43 175.74 2rgk h ARG 11 N 0.00 0.87 -0.61 0.81 3.08 -0.81 -1.18 114.38 116.54 2rgk h ARG 11 Ca -0.00 -0.53 -0.01 0.00 0.07 0.00 0.00 59.98 59.51 2rgk h ARG 11 Cb 0.07 0.05 -0.03 0.00 0.08 0.00 0.00 29.97 30.15 2rgk h ARG 11 CO 0.00 1.17 0.34 2.35 -1.07 0.00 0.00 179.97 182.77 2rgk h TRP 12 N 0.66 0.82 -0.10 3.04 7.01 -0.88 -1.61 115.95 124.89 2rgk h TRP 12 Ca 0.02 -0.01 -0.00 0.00 2.11 0.00 0.00 58.89 61.01 2rgk h TRP 12 Cb 1.10 -0.27 -0.00 0.00 -2.10 0.00 0.00 29.16 27.89 2rgk h TRP 12 CO 0.07 0.58 0.06 -0.07 -2.79 0.00 0.00 178.44 176.30 2rgk h LEU 13 N 0.82 0.12 -0.77 0.65 3.38 -0.97 -1.29 115.31 117.25 2rgk h LEU 13 Ca 0.21 -0.04 0.01 0.00 0.09 0.00 0.00 57.88 58.16 2rgk h LEU 13 Cb 0.02 -0.03 -0.04 0.00 0.09 0.00 0.00 40.66 40.70 2rgk h LEU 13 CO -0.04 0.12 0.50 -0.08 0.09 0.00 0.00 178.44 179.04 2rgk h GLU 14 N 0.10 0.99 -0.57 1.13 4.81 -1.01 0.38 114.58 120.42 2rgk h GLU 14 Ca 0.04 -0.06 -0.04 0.00 -0.13 0.00 0.00 59.36 59.17 2rgk h GLU 14 Cb 0.02 -0.22 -0.03 0.00 0.63 0.00 0.00 28.75 29.15 2rgk h GLU 14 CO -0.01 0.66 0.20 1.96 -0.73 0.00 0.00 179.01 181.09 2rgk h GLN 15 N 1.02 0.84 -0.01 1.92 4.20 -1.10 0.46 115.11 122.44 2rgk h GLN 15 Ca 0.28 -0.14 -0.17 0.00 0.06 0.00 0.00 58.65 58.68 2rgk h GLN 15 Cb -0.10 -0.14 -0.02 0.00 0.30 0.00 0.00 27.48 27.52 2rgk h GLN 15 CO -0.07 0.71 -0.78 1.49 -0.67 0.00 0.00 178.83 179.50 2rgk h GLU 16 N 0.82 0.12 -0.25 1.46 4.57 -0.49 -2.94 114.58 117.87 2rgk h GLU 16 Ca 0.19 -0.12 -0.01 0.00 -1.18 0.00 0.00 59.36 58.25 2rgk h GLU 16 Cb 0.20 0.03 -0.01 0.00 -0.16 0.00 0.00 28.75 28.81 2rgk h GLU 16 CO -0.01 0.84 0.13 1.15 -1.18 0.00 0.00 179.01 179.94 2rgk h THR 17 N 0.07 1.14 -0.64 0.32 2.02 0.76 -2.14 112.91 114.43 2rgk h THR 17 Ca -0.02 -0.38 0.01 0.00 0.77 0.00 0.00 66.41 66.79 2rgk h THR 17 Cb 1.37 0.92 -0.03 0.00 -1.74 0.00 0.00 68.15 68.67 2rgk h THR 17 CO 0.11 0.13 0.43 0.44 0.37 0.00 0.00 175.52 177.00 2rgk h ASP 18 N 0.29 0.73 -0.39 4.18 3.32 -0.90 0.18 116.42 123.82 2rgk h ASP 18 Ca 0.09 -0.02 -0.07 0.00 0.02 0.00 0.00 57.03 57.06 2rgk h ASP 18 Cb 0.10 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 39.45 2rgk h ASP 18 CO -0.01 0.52 0.02 -0.09 -1.72 0.00 0.00 179.24 177.97 2rgk h ARG 19 N 0.86 0.76 -0.22 3.56 2.43 -1.29 -1.50 114.38 118.98 2rgk h ARG 19 Ca 0.24 -0.19 -0.17 0.00 -0.81 0.00 0.00 59.98 59.05 2rgk h ARG 19 Cb -0.08 -0.10 0.00 0.00 -0.42 0.00 0.00 29.97 29.38 2rgk h ARG 19 CO -0.05 0.75 -0.54 0.82 -1.51 0.00 0.00 179.97 179.43 2rgk h ILE 20 N 0.71 1.30 -0.59 1.20 1.08 -0.52 -2.40 117.51 118.29 2rgk h ILE 20 Ca 0.15 -1.76 0.03 0.00 -0.39 0.00 0.00 64.86 62.89 2rgk h ILE 20 Cb 0.40 1.82 -0.04 0.00 -3.07 0.00 0.00 36.82 35.94 2rgk h ILE 20 CO 0.01 0.56 0.35 -0.26 -0.69 0.00 0.00 178.15 178.12 2rgk h PHE 21 N 0.48 0.66 -0.56 1.37 0.04 -0.41 -2.62 116.94 115.90 2rgk h PHE 21 Ca -0.01 0.02 -0.01 0.00 2.80 0.00 0.00 57.97 60.78 2rgk h PHE 21 Cb 1.16 -0.21 -0.03 0.00 2.20 0.00 0.00 35.95 39.07 2rgk h PHE 21 CO 0.09 0.36 0.32 -0.44 -0.60 0.00 0.00 178.31 178.04 2rgk h ASP 22 N 0.69 0.68 -0.91 2.17 3.45 -1.24 -2.76 116.42 118.50 2rgk h ASP 22 Ca 0.24 -0.07 0.06 0.00 0.43 0.00 0.00 57.03 57.69 2rgk h ASP 22 Cb 0.05 -0.17 -0.06 0.00 -0.56 0.00 0.00 39.33 38.59 2rgk h ASP 22 CO -0.11 0.55 0.58 0.15 -1.57 0.00 0.00 179.24 178.83 2rgk h PHE 23 N 0.75 1.07 0.00 4.55 3.57 -1.09 -2.32 116.94 123.46 2rgk h PHE 23 Ca 0.20 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.73 2rgk h PHE 23 Cb 0.01 -0.35 0.00 0.00 2.79 0.00 0.00 35.95 38.40 2rgk h PHE 23 CO -0.02 0.56 0.00 0.78 -2.23 0.00 0.00 178.31 177.40 2rgk h GLY 24 N 1.07 0.00 2.00 2.40 0.00 -1.19 -3.27 103.07 104.08 2rgk h GLY 24 Ca 0.39 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.71 2rgk h GLY 24 CO -0.16 0.00 -0.05 0.50 0.00 0.00 0.00 176.54 176.83 2rgk h LYS 25 N 0.00 0.00 0.00 4.80 1.57 -1.24 -2.60 116.57 119.10 2rgk h LYS 25 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2rgk h LYS 25 Cb 0.53 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.84 2rgk h LYS 25 CO 0.00 0.05 0.00 0.09 -0.57 0.00 0.00 179.45 179.02 2rgk n ASN 26 N -3.76 0.05 0.00 0.86 4.13 -1.23 -3.60 115.26 111.70 2rgk n ASN 26 Ca -0.03 0.51 0.12 0.00 1.68 0.00 0.00 54.58 56.86 2rgk n ASN 26 Cb 0.14 -0.52 0.59 0.00 -1.54 0.00 0.00 39.78 38.45 2rgk n ASN 26 CO 0.00 0.00 0.00 -1.54 0.28 0.00 0.00 177.26 176.00 2rgk n SER 27 N -1.55 0.00 -4.73 6.41 3.41 -0.98 -4.73 113.62 111.45 2rgk n SER 27 Ca 0.06 -0.00 -0.42 0.00 -0.26 0.00 0.00 58.87 58.26 2rgk n SER 27 Cb 0.32 -0.31 -0.03 0.00 -0.26 0.00 0.00 64.21 63.93 2rgk n SER 27 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 2rgk s VAL 28 N -2.61 2.41 0.10 -3.33 1.01 -1.24 0.15 120.40 116.90 2rgk s VAL 28 Ca 0.21 0.32 -0.02 0.00 0.00 0.00 0.00 61.98 62.49 2rgk s VAL 28 Cb 0.16 -3.20 -0.03 0.00 0.00 0.00 0.00 36.38 33.30 2rgk s VAL 28 CO 0.37 0.04 0.06 0.68 0.00 0.00 0.00 175.10 176.25 2rgk s VAL 29 N 0.64 0.14 0.32 2.92 -7.23 -0.05 -4.82 120.40 112.33 2rgk s VAL 29 Ca 0.67 -1.77 0.09 0.00 -1.81 0.00 0.00 61.98 59.16 2rgk s VAL 29 Cb -0.45 -1.80 0.32 0.00 0.56 0.00 0.00 36.38 35.01 2rgk s VAL 29 CO 0.38 -0.64 1.75 -0.65 -0.31 0.00 0.00 175.10 175.63 2rgk h PRO 30 N 2.92 0.60 -0.36 4.82 0.11 -2.01 -1.31 132.00 136.77 2rgk h PRO 30 Ca -0.34 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.73 2rgk h PRO 30 Cb 1.18 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 32.16 2rgk h PRO 30 CO 0.60 0.40 0.00 0.25 -0.21 0.00 0.00 178.00 179.04 2rgk n THR 31 N -4.82 0.47 0.00 -1.15 -2.24 -1.26 -4.93 114.28 100.36 2rgk n THR 31 Ca 0.26 -0.53 0.00 0.00 -2.27 0.00 0.00 64.05 61.50 2rgk n THR 31 Cb 0.70 0.38 0.00 0.00 -2.10 0.00 0.00 70.33 69.32 2rgk n THR 31 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2rgk n GLY 32 N 1.21 0.61 3.15 3.38 0.00 -0.49 -4.70 105.19 108.34 2rgk n GLY 32 Ca 0.16 -0.81 -0.30 0.00 0.00 0.00 0.00 46.02 45.06 2rgk n GLY 32 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2rgk s PHE 33 N 0.00 2.29 0.29 1.61 0.08 -1.26 -0.87 117.98 120.12 2rgk s PHE 33 Ca 0.00 -1.00 -0.03 0.00 0.12 0.00 0.00 56.93 56.02 2rgk s PHE 33 Cb 0.00 -1.57 0.06 0.00 -0.57 0.00 0.00 43.02 40.94 2rgk s PHE 33 CO 0.00 -0.44 0.39 0.41 -0.10 0.00 0.00 175.22 175.48 2rgk n GLY 34 N 3.80 -0.16 3.46 4.36 0.00 0.40 -4.28 105.19 112.77 2rgk n GLY 34 Ca -0.20 -1.85 -0.43 0.00 0.00 0.00 0.00 46.02 43.54 2rgk n GLY 34 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 2rgk s TRP 35 N -1.39 3.18 0.29 1.61 -0.11 -1.26 -4.85 118.94 116.41 2rgk s TRP 35 Ca 0.24 -0.53 -0.25 0.00 1.22 0.00 0.00 56.10 56.78 2rgk s TRP 35 Cb -0.01 -2.98 -0.09 0.00 -1.50 0.00 0.00 33.47 28.89 2rgk s TRP 35 CO 0.16 -0.74 0.90 -0.51 -4.62 0.00 0.00 176.95 172.14 2rgk s LEU 36 N 2.04 4.38 0.00 5.86 1.43 -1.26 0.16 118.68 131.28 2rgk s LEU 36 Ca 0.10 1.76 0.02 0.00 -1.03 0.00 0.00 54.13 54.98 2rgk s LEU 36 Cb -0.19 -3.87 0.05 0.00 0.03 0.00 0.00 46.19 42.21 2rgk s LEU 36 CO 0.12 -0.02 0.38 0.61 0.23 0.00 0.00 176.35 177.67 2rgk n GLY 37 N 0.71 1.24 0.01 -3.19 0.00 0.21 -1.04 105.19 103.13 2rgk n GLY 37 Ca 0.01 -2.06 0.00 0.00 0.00 0.00 0.00 46.02 43.96 2rgk n GLY 37 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2rgk n ASN 38 N -2.86 0.02 -0.34 1.61 4.13 -1.26 -0.89 115.26 115.67 2rgk n ASN 38 Ca 0.07 0.39 0.06 0.00 1.68 0.00 0.00 54.58 56.78 2rgk n ASN 38 Cb 0.25 -0.39 0.10 0.00 -1.54 0.00 0.00 39.78 38.20 2rgk n ASN 38 CO 0.00 0.00 0.00 0.29 0.28 0.00 0.00 177.26 177.83 2rgk n LYS 39 N -1.41 0.84 -1.04 3.52 5.02 -1.26 -4.75 118.16 119.07 2rgk n LYS 39 Ca -0.00 -2.12 -0.01 0.00 -2.02 0.00 0.00 58.31 54.15 2rgk n LYS 39 Cb 0.13 -1.11 -0.01 0.00 -0.02 0.00 0.00 35.03 34.02 2rgk n LYS 39 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2rgk n GLY 40 N -0.85 0.47 3.90 0.72 0.00 -0.07 -4.97 105.19 104.39 2rgk n GLY 40 Ca 0.11 -0.19 -0.29 0.00 0.00 0.00 0.00 46.02 45.64 2rgk n GLY 40 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2rgk s GLN 41 N -0.97 3.65 -0.02 1.61 0.00 -1.26 -4.72 119.66 117.94 2rgk s GLN 41 Ca 0.00 0.01 -0.30 0.00 -0.00 0.00 0.00 55.36 55.07 2rgk s GLN 41 Cb 0.00 -2.69 -0.03 0.00 0.00 0.00 0.00 33.01 30.30 2rgk s GLN 41 CO 0.00 0.28 1.02 0.42 0.00 0.00 0.00 175.29 177.01 2rgk s ILE 42 N -1.97 4.75 -0.90 3.63 1.01 -1.26 0.68 121.20 127.14 2rgk s ILE 42 Ca 0.44 1.98 -0.15 0.00 0.00 0.00 0.00 60.65 62.92 2rgk s ILE 42 Cb -0.11 -4.27 0.20 0.00 0.01 0.00 0.00 42.46 38.29 2rgk s ILE 42 CO 0.28 0.11 0.93 -0.54 0.00 0.00 0.00 174.94 175.71 2rgk s LYS 43 N 1.33 3.69 0.56 2.79 1.02 0.12 -4.90 119.74 124.36 2rgk s LYS 43 Ca 0.52 -2.36 0.29 0.00 0.02 0.00 0.00 55.97 54.44 2rgk s LYS 43 Cb -0.21 -4.60 1.47 0.00 -0.52 0.00 0.00 37.83 33.96 2rgk s LYS 43 CO 0.25 -1.44 1.91 0.93 -0.92 0.00 0.00 175.35 176.09 2rgk h GLU 44 N 7.92 0.00 0.00 1.68 5.08 -1.93 -1.37 114.58 125.96 2rgk h GLU 44 Ca 0.14 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.50 2rgk h GLU 44 Cb 1.01 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.26 2rgk h GLU 44 CO 0.89 0.00 0.00 0.93 -1.00 0.00 0.00 179.01 179.83 2rgk h GLU 45 N 0.00 0.00 0.00 2.33 3.07 -1.96 -2.39 114.58 115.62 2rgk h GLU 45 Ca 0.28 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.14 2rgk h GLU 45 Cb 1.30 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.21 2rgk h GLU 45 CO -0.00 0.00 0.00 0.52 -1.40 0.00 0.00 179.01 178.13 2rgk h MET 46 N 0.00 0.00 0.00 2.33 2.86 -1.63 -3.50 114.93 115.00 2rgk h MET 46 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 2rgk h MET 46 Cb 0.33 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.99 2rgk h MET 46 CO 0.00 0.00 0.00 0.41 1.06 0.00 0.00 176.91 178.38 2rgk n GLY 47 N 1.11 -1.24 3.24 8.32 0.00 -0.90 -4.65 105.19 111.07 2rgk n GLY 47 Ca 0.04 -1.21 -0.40 0.00 0.00 0.00 0.00 46.02 44.45 2rgk n GLY 47 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2rgk s THR 48 N 0.00 4.14 0.28 2.61 2.01 0.20 -4.11 115.64 120.77 2rgk s THR 48 Ca 0.00 -1.57 -0.24 0.00 0.31 0.00 0.00 61.69 60.19 2rgk s THR 48 Cb 0.00 -3.62 -0.09 0.00 0.01 0.00 0.00 72.50 68.80 2rgk s THR 48 CO 0.00 -0.60 0.86 -1.00 -0.69 0.00 0.00 174.62 173.19 2rgk s HIS 49 N 1.38 3.68 0.08 4.92 3.76 -1.26 -1.75 115.29 126.10 2rgk s HIS 49 Ca 0.04 1.64 -0.25 0.00 -0.15 0.00 0.00 55.06 56.34 2rgk s HIS 49 Cb -0.24 -2.81 -0.16 0.00 1.11 0.00 0.00 32.58 30.48 2rgk s HIS 49 CO 0.01 0.26 1.68 1.25 -0.85 0.00 0.00 174.74 177.09 2rgk h LEU 50 N 3.28 -0.18 -1.04 0.89 5.85 -1.54 -1.95 115.31 120.62 2rgk h LEU 50 Ca -0.47 -0.02 0.05 0.00 0.84 0.00 0.00 57.88 58.28 2rgk h LEU 50 Cb 1.19 0.05 -0.06 0.00 0.37 0.00 0.00 40.66 42.21 2rgk h LEU 50 CO 0.65 -0.10 0.64 4.11 -0.34 0.00 0.00 178.44 183.40 2rgk h TRP 51 N -0.24 1.19 -0.32 1.25 5.08 -1.82 -0.41 115.95 120.68 2rgk h TRP 51 Ca -0.02 0.03 -0.06 0.00 1.08 0.00 0.00 58.89 59.92 2rgk h TRP 51 Cb 0.19 -0.40 -0.01 0.00 -3.00 0.00 0.00 29.16 25.94 2rgk h TRP 51 CO -0.06 0.67 -0.03 0.82 -1.28 0.00 0.00 178.44 178.56 2rgk h ILE 52 N 1.21 1.27 -0.47 0.12 2.04 -1.88 -0.67 117.51 119.13 2rgk h ILE 52 Ca 0.40 -1.02 -0.03 0.00 1.00 0.00 0.00 64.86 65.21 2rgk h ILE 52 Cb 0.06 1.30 -0.02 0.00 -0.74 0.00 0.00 36.82 37.42 2rgk h ILE 52 CO -0.14 0.33 0.16 0.74 0.00 0.00 0.00 178.15 179.25 2rgk h THR 53 N 0.37 1.22 -0.24 -0.27 2.02 -0.96 -1.40 112.91 113.65 2rgk h THR 53 Ca 0.09 -0.70 -0.03 0.00 0.77 0.00 0.00 66.41 66.54 2rgk h THR 53 Cb 0.49 0.80 -0.01 0.00 -1.74 0.00 0.00 68.15 67.70 2rgk h THR 53 CO 0.02 0.26 0.05 0.00 0.37 0.00 0.00 175.52 176.21 2rgk h ALA 54 N 1.01 0.32 -0.21 6.16 0.00 -1.05 -1.57 119.26 123.92 2rgk h ALA 54 Ca 0.15 -0.17 0.03 0.00 0.00 0.00 0.00 54.91 54.92 2rgk h ALA 54 Cb 0.24 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.90 2rgk h ALA 54 CO -0.01 -0.01 0.01 0.00 0.00 0.00 0.00 179.25 179.24 2rgk h ARG 55 N 0.21 0.08 -0.79 0.00 3.08 -0.98 -0.84 114.38 115.14 2rgk h ARG 55 Ca 0.07 -0.00 0.04 0.00 0.07 0.00 0.00 59.98 60.16 2rgk h ARG 55 Cb 0.31 -0.02 -0.05 0.00 0.08 0.00 0.00 29.97 30.30 2rgk h ARG 55 CO 0.00 0.05 0.52 0.52 -1.07 0.00 0.00 179.97 180.00 2rgk h MET 56 N 0.08 0.93 -0.66 0.04 2.86 -1.17 0.51 114.93 117.52 2rgk h MET 56 Ca 0.10 -0.06 0.01 0.00 -2.06 0.00 0.00 59.70 57.69 2rgk h MET 56 Cb 0.11 -0.21 -0.03 0.00 0.06 0.00 0.00 31.60 31.53 2rgk h MET 56 CO -0.15 0.61 0.44 1.25 1.06 0.00 0.00 176.91 180.12 2rgk h LEU 57 N 0.96 0.75 0.01 1.22 5.85 -0.37 -0.47 115.31 123.26 2rgk h LEU 57 Ca 0.32 -0.02 -0.00 0.00 0.84 0.00 0.00 57.88 59.02 2rgk h LEU 57 Cb 0.07 -0.19 0.00 0.00 0.37 0.00 0.00 40.66 40.91 2rgk h LEU 57 CO -0.10 0.55 -0.01 -0.74 -0.34 0.00 0.00 178.44 177.80 2rgk h HIS 58 N 0.89 -0.02 0.16 1.25 2.76 0.26 -2.89 115.15 117.57 2rgk h HIS 58 Ca 0.24 -0.00 0.01 0.00 -2.20 0.00 0.00 60.37 58.43 2rgk h HIS 58 Cb -0.10 0.01 -0.03 0.00 1.55 0.00 0.00 27.41 28.84 2rgk h HIS 58 CO -0.03 0.26 -0.26 0.28 -1.30 0.00 0.00 177.93 176.88 2rgk h VAL 59 N -0.29 0.43 0.00 5.26 2.07 0.35 -2.22 116.25 121.85 2rgk h VAL 59 Ca -0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 2rgk h VAL 59 Cb 0.29 0.43 0.00 0.00 -1.52 0.00 0.00 31.29 30.49 2rgk h VAL 59 CO 0.00 0.00 0.00 -1.22 0.02 0.00 0.00 177.57 176.37 2rgk n TYR 60 N -5.38 0.00 0.08 1.57 4.01 -0.22 -1.10 117.16 116.12 2rgk n TYR 60 Ca -0.07 0.00 -0.10 0.00 -0.16 0.00 0.00 57.90 57.57 2rgk n TYR 60 Cb 0.29 -0.24 -0.08 0.00 -0.31 0.00 0.00 39.34 39.00 2rgk n TYR 60 CO 0.00 0.00 0.00 0.77 -0.46 0.00 0.00 176.86 177.17 2rgk h SER 61 N 0.00 0.20 -0.01 7.72 0.02 -1.17 -1.15 113.55 119.16 2rgk h SER 61 Ca 0.00 -0.19 -0.17 0.00 -0.84 0.00 0.00 61.79 60.59 2rgk h SER 61 Cb 0.13 -0.06 0.01 0.00 0.14 0.00 0.00 62.40 62.62 2rgk h SER 61 CO 0.00 1.09 -0.65 0.58 -1.14 0.00 0.00 176.83 176.70 2rgk h VAL 62 N 0.06 1.40 -0.80 2.27 2.07 -1.01 -2.45 116.25 117.78 2rgk h VAL 62 Ca -0.05 -2.08 -0.02 0.00 0.82 0.00 0.00 66.70 65.37 2rgk h VAL 62 Cb 1.71 2.54 -0.04 0.00 -1.52 0.00 0.00 31.29 33.98 2rgk h VAL 62 CO 0.15 0.61 0.44 0.00 0.02 0.00 0.00 177.57 178.79 2rgk h ALA 63 N 0.34 1.26 -0.42 1.67 0.00 -1.40 -1.19 119.26 119.53 2rgk h ALA 63 Ca -0.08 -0.12 -0.09 0.00 0.00 0.00 0.00 54.91 54.62 2rgk h ALA 63 Cb 1.35 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 18.80 2rgk h ALA 63 CO 0.13 0.60 -0.12 0.00 0.00 0.00 0.00 179.25 179.86 2rgk h ALA 64 N 1.36 1.02 0.00 0.00 0.00 -1.22 -1.91 119.26 118.50 2rgk h ALA 64 Ca 0.28 -0.31 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 2rgk h ALA 64 Cb 0.03 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.65 2rgk h ALA 64 CO -0.05 0.59 -0.11 0.00 0.00 0.00 0.00 179.25 179.69 2rgk h ALA 65 N 1.19 0.99 -0.07 0.00 0.00 -0.87 -2.43 119.26 118.07 2rgk h ALA 65 Ca 0.11 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.93 2rgk h ALA 65 Cb 0.59 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.36 2rgk h ALA 65 CO 0.04 0.13 0.00 -1.33 0.00 0.00 0.00 179.25 178.09 2rgk n MET 66 N -3.21 1.34 -1.56 0.00 2.81 -0.52 -4.77 117.12 111.22 2rgk n MET 66 Ca 0.01 -0.51 0.00 0.00 -1.81 0.00 0.00 57.70 55.39 2rgk n MET 66 Cb 0.41 -1.35 0.00 0.00 -0.71 0.00 0.00 33.22 31.56 2rgk n MET 66 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2rgk n GLY 67 N 0.96 0.38 3.54 3.03 0.00 -0.91 -5.03 105.19 107.16 2rgk n GLY 67 Ca 0.16 -0.98 -0.42 0.00 0.00 0.00 0.00 46.02 44.78 2rgk n GLY 67 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2rgk s ARG 68 N -3.12 3.49 0.35 1.61 3.00 -0.97 -5.03 118.95 118.28 2rgk s ARG 68 Ca 0.00 -0.18 -0.28 0.00 0.00 0.00 0.00 55.73 55.27 2rgk s ARG 68 Cb 0.00 -3.87 -0.12 0.00 0.00 0.00 0.00 34.95 30.96 2rgk s ARG 68 CO 0.00 -0.84 1.27 -2.30 0.00 0.00 0.00 175.30 173.43 2rgk n PRO 69 N 6.07 2.06 0.00 3.54 -0.02 -1.26 -1.77 135.00 143.62 2rgk n PRO 69 Ca -0.02 0.72 0.00 0.00 -2.02 0.00 0.00 63.50 62.18 2rgk n PRO 69 Cb 0.48 -2.31 0.00 0.00 -0.02 0.00 0.00 33.50 31.65 2rgk n PRO 69 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2rgk n GLY 70 N 0.80 3.08 0.20 -1.23 0.00 -1.26 -4.90 105.19 101.87 2rgk n GLY 70 Ca 0.05 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.93 2rgk n GLY 70 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2rgk h ALA 71 N 0.00 -0.42 -0.85 4.61 0.00 -1.66 -2.32 119.26 118.62 2rgk h ALA 71 Ca 0.00 -0.14 0.14 0.00 0.00 0.00 0.00 54.91 54.91 2rgk h ALA 71 Cb 0.00 0.16 -0.09 0.00 0.00 0.00 0.00 17.79 17.86 2rgk h ALA 71 CO 0.00 -0.66 0.45 -0.92 0.00 0.00 0.00 179.25 178.11 2rgk h TYR 72 N -0.57 0.79 -0.93 0.00 3.20 -1.78 -0.18 116.97 117.51 2rgk h TYR 72 Ca -0.04 0.03 0.04 0.00 3.14 0.00 0.00 58.73 61.90 2rgk h TYR 72 Cb 0.42 -0.23 -0.06 0.00 1.54 0.00 0.00 36.73 38.41 2rgk h TYR 72 CO -0.02 0.22 0.60 0.77 -1.64 0.00 0.00 178.16 178.10 2rgk h SER 73 N 0.66 1.00 -0.05 -2.11 0.02 -1.89 0.15 113.55 111.34 2rgk h SER 73 Ca 0.45 -0.01 -0.14 0.00 -0.84 0.00 0.00 61.79 61.26 2rgk h SER 73 Cb 0.59 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 62.90 2rgk h SER 73 CO -0.34 0.68 -0.41 -0.07 -1.14 0.00 0.00 176.83 175.55 2rgk h LEU 74 N 1.16 0.61 -0.33 5.07 3.38 -0.54 -0.30 115.31 124.36 2rgk h LEU 74 Ca 0.37 -0.27 0.00 0.00 0.09 0.00 0.00 57.88 58.07 2rgk h LEU 74 Cb 0.02 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.59 2rgk h LEU 74 CO -0.13 0.95 0.22 0.58 0.09 0.00 0.00 178.44 180.15 2rgk h VAL 75 N 0.47 1.09 -0.42 1.22 2.07 -0.03 0.32 116.25 120.96 2rgk h VAL 75 Ca 0.04 -0.16 0.01 0.00 0.82 0.00 0.00 66.70 67.41 2rgk h VAL 75 Cb 0.92 0.60 -0.02 0.00 -1.52 0.00 0.00 31.29 31.26 2rgk h VAL 75 CO 0.08 0.08 0.27 -0.78 0.02 0.00 0.00 177.57 177.25 2rgk h ASP 76 N 0.45 0.46 -0.96 0.57 3.58 -0.48 -0.23 116.42 119.81 2rgk h ASP 76 Ca 0.12 -0.01 0.02 0.00 0.42 0.00 0.00 57.03 57.58 2rgk h ASP 76 Cb -0.05 -0.11 -0.05 0.00 1.72 0.00 0.00 39.33 40.84 2rgk h ASP 76 CO -0.03 0.34 0.64 -0.74 -2.88 0.00 0.00 179.24 176.57 2rgk h HIS 77 N 0.56 1.20 -0.20 0.28 2.76 -0.40 -1.22 115.15 118.13 2rgk h HIS 77 Ca 0.16 0.03 -0.00 0.00 -2.20 0.00 0.00 60.37 58.35 2rgk h HIS 77 Cb -0.05 -0.41 -0.01 0.00 1.55 0.00 0.00 27.41 28.50 2rgk h HIS 77 CO -0.05 0.74 0.11 0.78 -1.30 0.00 0.00 177.93 178.21 2rgk h GLY 78 N 1.28 0.30 1.00 5.26 0.00 0.55 -0.82 103.07 110.64 2rgk h GLY 78 Ca 0.36 -0.13 -0.00 0.00 0.00 0.00 0.00 47.33 47.55 2rgk h GLY 78 CO -0.09 0.13 0.38 -2.22 0.00 0.00 0.00 176.54 174.74 2rgk h ILE 79 N 0.22 1.18 -0.22 2.60 2.04 -0.63 -0.88 117.51 121.82 2rgk h ILE 79 Ca 0.07 -0.41 -0.06 0.00 1.00 0.00 0.00 64.86 65.46 2rgk h ILE 79 Cb 0.07 0.31 -0.01 0.00 -0.74 0.00 0.00 36.82 36.44 2rgk h ILE 79 CO -0.01 0.19 -0.14 0.11 0.00 0.00 0.00 178.15 178.30 2rgk h LYS 80 N 0.86 0.36 -0.26 2.37 1.57 -1.08 -2.27 116.57 118.12 2rgk h LYS 80 Ca 0.23 -0.10 -0.11 0.00 -1.87 0.00 0.00 60.65 58.80 2rgk h LYS 80 Cb -0.03 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.23 2rgk h LYS 80 CO -0.04 0.51 -0.32 0.00 -0.57 0.00 0.00 179.45 179.03 2rgk h ALA 81 N 1.52 0.96 0.00 3.86 0.00 -0.38 -0.63 119.26 124.59 2rgk h ALA 81 Ca 0.06 -0.39 -0.00 0.00 0.00 0.00 0.00 54.91 54.58 2rgk h ALA 81 Cb 0.46 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.13 2rgk h ALA 81 CO 0.03 0.61 -0.01 0.52 0.00 0.00 0.00 179.25 180.39 2rgk h MET 82 N 0.47 0.00 -0.03 0.00 2.86 -0.64 -2.26 114.93 115.33 2rgk h MET 82 Ca 0.06 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.70 2rgk h MET 82 Cb 0.78 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.44 2rgk h MET 82 CO 0.06 0.01 -0.06 0.09 1.06 0.00 0.00 176.91 178.07 2rgk n ASN 83 N -3.11 2.85 0.00 1.22 5.03 -0.93 -4.28 115.26 116.03 2rgk n ASN 83 Ca 0.01 -1.92 0.00 0.00 0.87 0.00 0.00 54.58 53.54 2rgk n ASN 83 Cb 0.36 0.06 0.00 0.00 -1.02 0.00 0.00 39.78 39.18 2rgk n ASN 83 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2rgk n GLY 84 N 1.34 1.99 0.30 7.41 0.00 -0.29 -4.83 105.19 111.12 2rgk n GLY 84 Ca 0.13 -0.89 0.08 0.00 0.00 0.00 0.00 46.02 45.34 2rgk n GLY 84 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2rgk h ALA 85 N -0.39 0.92 0.00 4.61 0.00 -1.86 0.70 119.26 123.24 2rgk h ALA 85 Ca 0.00 0.28 -0.00 0.00 0.00 0.00 0.00 54.91 55.18 2rgk h ALA 85 Cb 0.00 0.48 -0.00 0.00 0.00 0.00 0.00 17.79 18.27 2rgk h ALA 85 CO 0.00 -0.46 -0.01 -0.07 0.00 0.00 0.00 179.25 178.71 2rgk h LEU 86 N 0.08 0.00 -9.39 0.00 3.38 -1.84 -3.42 115.31 104.11 2rgk h LEU 86 Ca 0.48 0.00 -0.56 0.00 0.09 0.00 0.00 57.88 57.89 2rgk h LEU 86 Cb 0.89 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.59 2rgk h LEU 86 CO -0.76 0.01 0.13 -0.60 0.09 0.00 0.00 178.44 177.31 2rgk s ARG 87 N -4.44 4.46 -0.67 1.13 3.52 0.24 -1.16 118.95 122.03 2rgk s ARG 87 Ca -0.05 0.97 -0.27 0.00 -0.13 0.00 0.00 55.73 56.26 2rgk s ARG 87 Cb 0.14 -3.44 0.04 0.00 -1.56 0.00 0.00 34.95 30.13 2rgk s ARG 87 CO 0.50 0.08 1.20 0.34 -0.81 0.00 0.00 175.30 176.61 2rgk s ASP 88 N 0.70 6.25 0.14 -2.12 -1.08 -0.83 -4.87 116.67 114.86 2rgk s ASP 88 Ca 0.40 -0.35 0.21 0.00 -0.52 0.00 0.00 52.55 52.28 2rgk s ASP 88 Cb -0.19 -2.53 0.86 0.00 -1.46 0.00 0.00 42.92 39.60 2rgk s ASP 88 CO 0.20 -1.65 1.65 0.29 0.52 0.00 0.00 175.17 176.18 2rgk n LYS 89 N 8.80 0.12 -0.11 4.34 4.01 -1.26 -1.09 118.16 132.97 2rgk n LYS 89 Ca 0.04 0.30 -0.24 0.00 -0.51 0.00 0.00 58.31 57.89 2rgk n LYS 89 Cb 0.48 -1.70 -0.11 0.00 -0.51 0.00 0.00 35.03 33.19 2rgk n LYS 89 CO 0.00 0.00 0.00 1.17 -1.11 0.00 0.00 177.40 177.46 2rgk n LYS 90 N -1.92 0.59 0.00 1.97 4.81 -1.26 -4.68 118.16 117.67 2rgk n LYS 90 Ca 0.03 0.44 0.07 0.00 -0.87 0.00 0.00 58.31 57.98 2rgk n LYS 90 Cb 0.24 -1.65 -0.05 0.00 0.02 0.00 0.00 35.03 33.59 2rgk n LYS 90 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 2rgk n TYR 91 N -4.27 0.00 -0.01 5.64 4.01 -1.24 -5.11 117.16 116.17 2rgk n TYR 91 Ca -0.40 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.34 2rgk n TYR 91 Cb 0.78 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.81 2rgk n TYR 91 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2rgk n GLY 92 N 1.23 -3.39 7.00 2.72 0.00 -0.25 -4.94 105.19 107.57 2rgk n GLY 92 Ca 0.04 -1.84 0.00 0.00 0.00 0.00 0.00 46.02 44.22 2rgk n GLY 92 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2rgk n GLY 93 N -0.47 0.30 2.96 -0.02 0.00 -1.26 -4.27 105.19 102.43 2rgk n GLY 93 Ca 0.00 -0.95 -0.16 0.00 0.00 0.00 0.00 46.02 44.91 2rgk n GLY 93 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2rgk s TRP 94 N 0.00 0.50 0.63 1.61 0.51 -1.26 -1.97 118.94 118.95 2rgk s TRP 94 Ca 0.00 -0.10 -0.18 0.00 -2.12 0.00 0.00 56.10 53.70 2rgk s TRP 94 Cb 0.00 -0.32 -0.02 0.00 -0.81 0.00 0.00 33.47 32.32 2rgk s TRP 94 CO 0.00 -0.01 1.20 0.71 -0.51 0.00 0.00 176.95 178.34 2rgk s TYR 95 N -0.15 2.35 0.35 -1.98 2.02 -0.31 -4.64 117.35 114.99 2rgk s TYR 95 Ca 0.02 1.53 0.14 0.00 -0.37 0.00 0.00 57.07 58.39 2rgk s TYR 95 Cb -0.02 -3.45 0.74 0.00 -0.40 0.00 0.00 41.96 38.83 2rgk s TYR 95 CO -0.00 -2.24 1.82 0.00 -1.57 0.00 0.00 175.55 173.56 2rgk h ALA 96 N 0.57 1.32 -1.87 3.71 0.00 -0.38 -3.40 119.26 119.22 2rgk h ALA 96 Ca -0.50 -0.34 -0.01 0.00 0.00 0.00 0.00 54.91 54.06 2rgk h ALA 96 Cb 1.29 -0.06 -0.21 0.00 0.00 0.00 0.00 17.79 18.81 2rgk h ALA 96 CO 0.54 0.47 0.27 0.00 0.00 0.00 0.00 179.25 180.53 2rgk s VAL 98 N -0.54 0.10 0.23 0.00 -7.23 -0.72 -1.00 120.40 111.24 2rgk s VAL 98 Ca -0.04 -0.96 0.03 0.00 -1.81 0.00 0.00 61.98 59.19 2rgk s VAL 98 Cb -0.02 -1.34 -0.01 0.00 0.56 0.00 0.00 36.38 35.57 2rgk s VAL 98 CO 0.04 -0.47 0.25 -0.46 -0.31 0.00 0.00 175.10 174.15 2rgk n ASN 99 N -0.15 -0.65 0.30 4.85 0.23 -0.68 0.58 115.26 119.74 2rgk n ASN 99 Ca -0.14 -2.42 0.20 0.00 -0.53 0.00 0.00 54.58 51.69 2rgk n ASN 99 Cb 0.63 1.36 1.07 0.00 -2.08 0.00 0.00 39.78 40.76 2rgk n ASN 99 CO 0.00 0.00 0.00 0.44 -0.93 0.00 0.00 177.26 176.77 2rgk h ASP 100 N 1.37 0.00 0.82 0.53 3.32 -2.01 -2.60 116.42 117.86 2rgk h ASP 100 Ca -0.17 0.00 -0.17 0.00 0.02 0.00 0.00 57.03 56.71 2rgk h ASP 100 Cb 0.81 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.33 2rgk h ASP 100 CO 0.24 0.00 -1.27 -0.33 -1.72 0.00 0.00 179.24 176.16 2rgk h GLU 101 N 0.00 0.00 0.00 3.56 3.07 -2.04 -3.51 114.58 115.67 2rgk h GLU 101 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 2rgk h GLU 101 Cb 0.04 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.95 2rgk h GLU 101 CO 0.00 0.37 0.00 0.41 -1.40 0.00 0.00 179.01 178.39 2rgk n GLY 102 N 1.38 -0.54 3.60 -3.84 0.00 -0.98 -5.08 105.19 99.73 2rgk n GLY 102 Ca -0.08 -1.16 -0.43 0.00 0.00 0.00 0.00 46.02 44.35 2rgk n GLY 102 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2rgk s VAL 103 N -3.00 4.25 0.05 1.61 1.01 -1.26 -1.69 120.40 121.38 2rgk s VAL 103 Ca 0.00 1.26 -0.16 0.00 0.00 0.00 0.00 61.98 63.07 2rgk s VAL 103 Cb 0.00 -4.58 -0.22 0.00 0.00 0.00 0.00 36.38 31.59 2rgk s VAL 103 CO 0.00 -0.94 1.18 0.58 0.00 0.00 0.00 175.10 175.91 2rgk h VAL 104 N 6.17 1.34 -3.03 2.92 2.07 -1.39 -3.43 116.25 120.90 2rgk h VAL 104 Ca -0.23 -2.09 -0.48 0.00 0.82 0.00 0.00 66.70 64.72 2rgk h VAL 104 Cb 1.06 2.38 -0.41 0.00 -1.52 0.00 0.00 31.29 32.80 2rgk h VAL 104 CO 1.11 0.63 -0.76 -0.62 0.02 0.00 0.00 177.57 177.96 2rgk s ASP 105 N -6.99 2.70 0.00 0.57 -1.08 -0.47 -4.95 116.67 106.44 2rgk s ASP 105 Ca -0.11 -0.80 0.30 0.00 -0.52 0.00 0.00 52.55 51.41 2rgk s ASP 105 Cb 0.06 -0.33 1.43 0.00 -1.46 0.00 0.00 42.92 42.62 2rgk s ASP 105 CO 0.87 -0.36 1.96 0.00 0.52 0.00 0.00 175.17 178.16 2rgk n ALA 106 N 5.23 2.63 -1.43 3.66 0.00 -1.26 -0.68 120.51 128.66 2rgk n ALA 106 Ca -0.07 -0.33 -0.34 0.00 0.00 0.00 0.00 53.44 52.70 2rgk n ALA 106 Cb 0.47 -1.32 0.07 0.00 0.00 0.00 0.00 19.45 18.67 2rgk n ALA 106 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2rgk s SER 107 N -2.01 4.59 -0.68 0.00 1.04 -1.26 -3.67 113.70 111.71 2rgk s SER 107 Ca 0.42 2.22 -0.10 0.00 0.48 0.00 0.00 55.95 58.97 2rgk s SER 107 Cb 0.21 -2.57 0.18 0.00 0.10 0.00 0.00 66.02 63.94 2rgk s SER 107 CO 0.35 -1.99 0.58 -0.54 0.98 0.00 0.00 173.24 172.62 2rgk s LYS 108 N -3.94 3.06 -0.13 4.02 -0.14 -0.17 -2.16 119.74 120.27 2rgk s LYS 108 Ca 0.72 -2.27 -0.19 0.00 -1.36 0.00 0.00 55.97 52.86 2rgk s LYS 108 Cb -0.26 -4.14 -0.04 0.00 -1.68 0.00 0.00 37.83 31.71 2rgk s LYS 108 CO 0.43 -1.25 0.52 -0.65 -0.76 0.00 0.00 175.35 173.64 2rgk s GLN 109 N 0.48 4.32 0.10 1.68 -0.21 -1.26 -0.62 119.66 124.14 2rgk s GLN 109 Ca 0.14 0.50 -0.31 0.00 0.02 0.00 0.00 55.36 55.71 2rgk s GLN 109 Cb -0.18 -3.47 -0.12 0.00 1.00 0.00 0.00 33.01 30.25 2rgk s GLN 109 CO -0.05 0.07 1.60 0.78 -2.12 0.00 0.00 175.29 175.57 2rgk h GLY 110 N 7.04 -0.81 1.41 3.09 0.00 -0.52 -1.13 103.07 112.15 2rgk h GLY 110 Ca -0.39 0.44 0.05 0.00 0.00 0.00 0.00 47.33 47.42 2rgk h GLY 110 CO 0.75 -0.29 0.28 0.10 0.00 0.00 0.00 176.54 177.39 2rgk h TYR 111 N -0.69 0.37 -0.03 5.60 -0.00 -1.83 0.97 116.97 121.35 2rgk h TYR 111 Ca -0.00 0.01 -0.15 0.00 0.00 0.00 0.00 58.73 58.59 2rgk h TYR 111 Cb 0.66 -0.12 -0.01 0.00 0.00 0.00 0.00 36.73 37.26 2rgk h TYR 111 CO -0.26 0.21 -0.65 1.96 -0.00 0.00 0.00 178.16 179.41 2rgk h GLN 112 N 0.37 0.13 0.00 0.10 4.20 -1.86 -1.81 115.11 116.25 2rgk h GLN 112 Ca 0.18 -0.10 -0.12 0.00 0.06 0.00 0.00 58.65 58.67 2rgk h GLN 112 Cb 0.24 0.02 -0.02 0.00 0.30 0.00 0.00 27.48 28.03 2rgk h GLN 112 CO -0.04 0.73 -0.58 0.45 -0.67 0.00 0.00 178.83 178.73 2rgk h HIS 113 N 0.09 0.00 -0.00 2.96 3.86 0.31 -2.06 115.15 120.32 2rgk h HIS 113 Ca -0.01 0.00 -0.18 0.00 -1.16 0.00 0.00 60.37 59.02 2rgk h HIS 113 Cb 1.16 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 29.61 2rgk h HIS 113 CO 0.01 0.58 -0.82 0.74 0.86 0.00 0.00 177.93 179.30 2rgk h PHE 114 N 0.00 0.09 -0.13 2.45 0.04 -0.70 -0.98 116.94 117.71 2rgk h PHE 114 Ca -0.01 -0.05 -0.11 0.00 2.80 0.00 0.00 57.97 60.61 2rgk h PHE 114 Cb 1.28 -0.01 -0.01 0.00 2.20 0.00 0.00 35.95 39.41 2rgk h PHE 114 CO 0.00 0.85 -0.41 0.74 -0.60 0.00 0.00 178.31 178.88 2rgk h PHE 115 N 0.03 0.33 -0.33 -0.55 0.04 -1.20 -0.39 116.94 114.88 2rgk h PHE 115 Ca -0.02 -0.09 -0.01 0.00 2.80 0.00 0.00 57.97 60.65 2rgk h PHE 115 Cb 1.43 -0.07 -0.02 0.00 2.20 0.00 0.00 35.95 39.49 2rgk h PHE 115 CO 0.01 0.66 0.17 0.00 -0.60 0.00 0.00 178.31 178.54 2rgk h ALA 116 N 1.33 0.43 -0.45 2.45 0.00 -0.92 0.34 119.26 122.44 2rgk h ALA 116 Ca 0.02 -0.09 0.01 0.00 0.00 0.00 0.00 54.91 54.85 2rgk h ALA 116 Cb 0.83 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.47 2rgk h ALA 116 CO 0.07 -0.02 0.28 1.25 0.00 0.00 0.00 179.25 180.82 2rgk h LEU 117 N 0.41 0.47 0.19 0.00 5.85 -0.69 -1.31 115.31 120.23 2rgk h LEU 117 Ca 0.12 -0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.82 2rgk h LEU 117 Cb 0.10 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 41.02 2rgk h LEU 117 CO -0.02 0.34 -0.09 0.25 -0.34 0.00 0.00 178.44 178.58 2rgk h LEU 118 N 0.57 -0.22 -1.18 2.25 5.85 -0.60 -1.47 115.31 120.52 2rgk h LEU 118 Ca 0.17 0.00 0.14 0.00 0.84 0.00 0.00 57.88 59.03 2rgk h LEU 118 Cb -0.03 0.06 -0.08 0.00 0.37 0.00 0.00 40.66 40.98 2rgk h LEU 118 CO -0.06 -0.15 0.60 1.23 -0.34 0.00 0.00 178.44 179.72 2rgk h GLY 119 N -0.26 1.38 1.01 3.75 0.00 -0.05 -0.81 103.07 108.09 2rgk h GLY 119 Ca -0.03 -0.35 -0.14 0.00 0.00 0.00 0.00 47.33 46.81 2rgk h GLY 119 CO 0.04 0.11 -0.40 0.00 0.00 0.00 0.00 176.54 176.29 2rgk h ALA 120 N 1.58 0.40 -0.47 3.60 0.00 -0.90 -1.29 119.26 122.18 2rgk h ALA 120 Ca 0.47 -0.45 -0.09 0.00 0.00 0.00 0.00 54.91 54.84 2rgk h ALA 120 Cb 0.64 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.34 2rgk h ALA 120 CO -0.23 0.50 -0.05 0.00 0.00 0.00 0.00 179.25 179.46 2rgk h ALA 121 N 0.66 1.02 -0.29 0.00 0.00 -0.63 -0.96 119.26 119.06 2rgk h ALA 121 Ca 0.02 -0.29 -0.17 0.00 0.00 0.00 0.00 54.91 54.47 2rgk h ALA 121 Cb 0.99 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.59 2rgk h ALA 121 CO 0.09 0.60 -0.48 0.77 0.00 0.00 0.00 179.25 180.23 2rgk h SER 122 N 0.75 0.93 -0.76 0.00 0.02 -1.16 -2.95 113.55 110.38 2rgk h SER 122 Ca 0.14 -0.52 0.06 0.00 -0.84 0.00 0.00 61.79 60.62 2rgk h SER 122 Cb 0.53 -0.26 -0.05 0.00 0.14 0.00 0.00 62.40 62.76 2rgk h SER 122 CO 0.03 1.27 0.50 0.00 -1.14 0.00 0.00 176.83 177.49 2rgk h ALA 123 N 0.68 1.65 -0.75 3.77 0.00 -0.82 -1.48 119.26 122.31 2rgk h ALA 123 Ca 0.02 -0.02 0.10 0.00 0.00 0.00 0.00 54.91 55.01 2rgk h ALA 123 Cb 1.09 -0.22 -0.05 0.00 0.00 0.00 0.00 17.79 18.61 2rgk h ALA 123 CO 0.11 0.24 0.49 0.28 0.00 0.00 0.00 179.25 180.37 2rgk h VAL 124 N 0.83 0.93 0.00 0.00 2.07 -1.00 -1.15 116.25 117.93 2rgk h VAL 124 Ca 0.32 -0.22 0.00 0.00 0.82 0.00 0.00 66.70 67.62 2rgk h VAL 124 Cb 0.21 0.23 0.00 0.00 -1.52 0.00 0.00 31.29 30.22 2rgk h VAL 124 CO -0.11 0.12 0.00 0.71 0.02 0.00 0.00 177.57 178.31 2rgk h THR 125 N 0.64 0.00 0.00 2.57 1.35 -1.30 -1.38 112.91 114.80 2rgk h THR 125 Ca 0.34 -0.23 0.00 0.00 -0.55 0.00 0.00 66.41 65.98 2rgk h THR 125 Cb 0.48 0.97 0.00 0.00 -1.73 0.00 0.00 68.15 67.87 2rgk h THR 125 CO -0.12 0.00 -0.14 0.71 -0.25 0.00 0.00 175.52 175.72 2rgk h THR 126 N 0.00 0.00 0.00 6.82 1.35 -1.29 -3.48 112.91 116.31 2rgk h THR 126 Ca 0.00 -0.85 0.00 0.00 -0.55 0.00 0.00 66.41 65.01 2rgk h THR 126 Cb 0.31 1.77 0.00 0.00 -1.73 0.00 0.00 68.15 68.50 2rgk h THR 126 CO 0.00 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.88 2rgk n GLY 127 N 1.17 0.53 3.67 5.82 0.00 -0.52 -4.98 105.19 110.89 2rgk n GLY 127 Ca 0.04 -0.08 -0.47 0.00 0.00 0.00 0.00 46.02 45.51 2rgk n GLY 127 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 2rgk n HIS 128 N -2.92 2.30 0.02 1.61 -0.00 -1.26 -4.83 115.22 110.15 2rgk n HIS 128 Ca 0.00 0.13 0.22 0.00 -0.00 0.00 0.00 57.72 58.07 2rgk n HIS 128 Cb 0.00 -2.60 0.63 0.00 -0.00 0.00 0.00 29.99 28.02 2rgk n HIS 128 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.34 175.34 2rgk h PRO 129 N 7.55 0.00 -0.01 1.57 0.13 -1.96 0.02 132.00 139.29 2rgk h PRO 129 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 2rgk h PRO 129 Cb 1.26 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.39 2rgk h PRO 129 CO 0.92 0.00 -0.66 0.39 -0.23 0.00 0.00 178.00 178.42 2rgk n GLU 130 N -3.44 1.02 -0.13 0.86 -0.58 -1.26 -4.56 120.64 112.55 2rgk n GLU 130 Ca 0.11 -0.51 -0.09 0.00 -0.42 0.00 0.00 57.16 56.26 2rgk n GLU 130 Cb 0.90 -1.41 -0.01 0.00 -0.57 0.00 0.00 31.44 30.35 2rgk n GLU 130 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2rgk h ALA 131 N 3.17 0.50 -0.92 0.62 0.00 -1.32 -2.51 119.26 118.80 2rgk h ALA 131 Ca 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.78 2rgk h ALA 131 Cb 0.58 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 18.18 2rgk h ALA 131 CO 0.00 0.10 0.58 -0.09 0.00 0.00 0.00 179.25 179.84 2rgk h ARG 132 N 0.48 1.22 -0.26 0.00 9.65 -1.81 -1.90 114.38 121.76 2rgk h ARG 132 Ca 0.13 -0.09 0.01 0.00 -1.10 0.00 0.00 59.98 58.92 2rgk h ARG 132 Cb 0.19 -0.27 -0.02 0.00 -1.39 0.00 0.00 29.97 28.48 2rgk h ARG 132 CO -0.01 0.84 0.16 -0.22 2.80 0.00 0.00 179.97 183.53 2rgk h LYS 133 N 1.25 0.32 -0.62 0.20 3.64 -1.80 -2.05 116.57 117.51 2rgk h LYS 133 Ca 0.33 -0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.68 2rgk h LYS 133 Cb -0.10 -0.07 -0.03 0.00 -0.41 0.00 0.00 32.23 31.62 2rgk h LYS 133 CO -0.07 0.21 0.34 1.25 -2.27 0.00 0.00 179.45 178.92 2rgk h LEU 134 N 0.33 0.75 -0.29 5.20 5.85 -1.08 -1.77 115.31 124.29 2rgk h LEU 134 Ca 0.10 -0.05 -0.03 0.00 0.84 0.00 0.00 57.88 58.74 2rgk h LEU 134 Cb -0.02 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 40.81 2rgk h LEU 134 CO -0.04 0.61 0.06 0.25 -0.34 0.00 0.00 178.44 178.98 2rgk h LEU 135 N 0.86 0.45 -0.76 2.25 5.85 -0.90 -0.24 115.31 122.83 2rgk h LEU 135 Ca 0.22 -0.24 -0.05 0.00 0.84 0.00 0.00 57.88 58.64 2rgk h LEU 135 Cb 0.01 -0.12 -0.03 0.00 0.37 0.00 0.00 40.66 40.89 2rgk h LEU 135 CO -0.04 0.58 0.26 0.44 -0.34 0.00 0.00 178.44 179.34 2rgk h ASP 136 N 0.31 1.08 -0.62 1.25 3.32 -1.09 0.48 116.42 121.15 2rgk h ASP 136 Ca 0.09 -0.20 -0.07 0.00 0.02 0.00 0.00 57.03 56.88 2rgk h ASP 136 Cb 0.31 -0.28 -0.02 0.00 0.22 0.00 0.00 39.33 39.55 2rgk h ASP 136 CO 0.00 0.99 0.13 0.22 -1.72 0.00 0.00 179.24 178.86 2rgk h TYR 137 N 1.11 1.06 -0.34 4.55 3.20 -1.20 -1.78 116.97 123.57 2rgk h TYR 137 Ca 0.25 -0.14 -0.08 0.00 3.14 0.00 0.00 58.73 61.91 2rgk h TYR 137 Cb 0.28 -0.30 -0.02 0.00 1.54 0.00 0.00 36.73 38.24 2rgk h TYR 137 CO 0.02 0.90 -0.10 1.15 -1.64 0.00 0.00 178.16 178.49 2rgk h THR 138 N 0.92 1.24 -0.57 1.81 2.02 -0.60 -2.60 112.91 115.13 2rgk h THR 138 Ca 0.19 -1.04 -0.07 0.00 0.77 0.00 0.00 66.41 66.26 2rgk h THR 138 Cb 0.39 1.09 -0.02 0.00 -1.74 0.00 0.00 68.15 67.86 2rgk h THR 138 CO 0.01 0.35 0.10 0.40 0.37 0.00 0.00 175.52 176.74 2rgk h ILE 139 N 0.54 1.26 -0.03 3.11 2.04 -0.53 -1.06 117.51 122.84 2rgk h ILE 139 Ca 0.10 -0.97 0.00 0.00 1.00 0.00 0.00 64.86 64.99 2rgk h ILE 139 Cb 0.50 0.78 -0.00 0.00 -0.74 0.00 0.00 36.82 37.36 2rgk h ILE 139 CO 0.03 0.35 0.01 -0.33 0.00 0.00 0.00 178.15 178.21 2rgk h GLU 140 N 0.84 0.02 -0.64 2.37 5.08 -1.04 -0.44 114.58 120.77 2rgk h GLU 140 Ca 0.17 -0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.51 2rgk h GLU 140 Cb 0.41 -0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.62 2rgk h GLU 140 CO 0.01 0.01 0.29 0.82 -1.00 0.00 0.00 179.01 179.14 2rgk h ILE 141 N 0.02 1.21 -0.02 3.13 1.08 -1.37 -1.62 117.51 119.94 2rgk h ILE 141 Ca 0.01 -0.63 -0.00 0.00 -0.39 0.00 0.00 64.86 63.85 2rgk h ILE 141 Cb 0.01 0.42 -0.00 0.00 -3.07 0.00 0.00 36.82 34.18 2rgk h ILE 141 CO -0.01 0.26 -0.00 0.40 -0.69 0.00 0.00 178.15 178.10 2rgk h ILE 142 N 0.91 1.25 0.00 -0.67 1.08 -0.82 -1.62 117.51 117.64 2rgk h ILE 142 Ca 0.22 -0.75 0.00 0.00 -0.39 0.00 0.00 64.86 63.94 2rgk h ILE 142 Cb 0.13 1.72 0.00 0.00 -3.07 0.00 0.00 36.82 35.60 2rgk h ILE 142 CO -0.03 0.20 0.00 -0.62 -0.69 0.00 0.00 178.15 177.01 2rgk n GLU 143 N -4.92 0.15 -0.05 2.37 1.02 -0.21 -0.62 120.64 118.39 2rgk n GLU 143 Ca -0.08 0.33 -0.11 0.00 -0.02 0.00 0.00 57.16 57.28 2rgk n GLU 143 Cb 0.18 -1.76 -0.14 0.00 -0.02 0.00 0.00 31.44 29.69 2rgk n GLU 143 CO 0.00 0.00 0.00 1.17 1.18 0.00 0.00 177.13 179.48 2rgk n LYS 144 N -2.04 0.67 0.00 3.49 4.81 -0.62 -4.64 118.16 119.83 2rgk n LYS 144 Ca 0.03 0.18 0.00 0.00 -0.87 0.00 0.00 58.31 57.66 2rgk n LYS 144 Cb 0.25 -1.67 0.00 0.00 0.02 0.00 0.00 35.03 33.63 2rgk n LYS 144 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 2rgk n TYR 145 N -3.02 0.00 0.02 5.64 4.01 -0.62 -4.91 117.16 118.27 2rgk n TYR 145 Ca -0.26 0.00 0.05 0.00 -0.16 0.00 0.00 57.90 57.53 2rgk n TYR 145 Cb 1.08 0.00 -0.08 0.00 -0.31 0.00 0.00 39.34 40.03 2rgk n TYR 145 CO 0.00 0.00 0.00 1.19 -0.46 0.00 0.00 176.86 177.59 2rgk n PHE 146 N -1.34 0.00 -3.51 -0.72 3.72 -0.08 -4.74 117.46 110.79 2rgk n PHE 146 Ca 0.00 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 56.98 2rgk n PHE 146 Cb 0.17 -0.22 -0.10 0.00 -0.94 0.00 0.00 39.48 38.40 2rgk n PHE 146 CO 0.00 0.00 0.00 -0.46 -0.05 0.00 0.00 176.76 176.25 2rgk s TRP 147 N -2.67 3.26 -0.28 1.38 -0.11 0.21 -1.09 118.94 119.64 2rgk s TRP 147 Ca -0.03 -0.92 -0.29 0.00 1.22 0.00 0.00 56.10 56.07 2rgk s TRP 147 Cb 0.07 -2.73 -0.00 0.00 -1.50 0.00 0.00 33.47 29.30 2rgk s TRP 147 CO 0.42 -0.70 1.30 0.45 -4.62 0.00 0.00 176.95 173.80 2rgk s SER 148 N 1.92 6.72 0.31 5.86 0.15 -0.36 -4.74 113.70 123.55 2rgk s SER 148 Ca 0.03 1.29 0.10 0.00 0.70 0.00 0.00 55.95 58.08 2rgk s SER 148 Cb -0.21 -2.54 0.48 0.00 -1.71 0.00 0.00 66.02 62.04 2rgk s SER 148 CO 0.07 -1.03 1.69 -0.08 1.20 0.00 0.00 173.24 175.10 2rgk h GLU 149 N 9.12 0.06 0.01 5.44 4.81 -1.91 0.29 114.58 132.39 2rgk h GLU 149 Ca -0.26 -0.03 -0.25 0.00 -0.13 0.00 0.00 59.36 58.69 2rgk h GLU 149 Cb 1.10 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 30.45 2rgk h GLU 149 CO 1.02 0.55 -1.33 1.05 -0.73 0.00 0.00 179.01 179.57 2rgk h GLU 150 N 0.04 0.03 0.00 1.92 4.11 -1.96 -3.34 114.58 115.38 2rgk h GLU 150 Ca -0.00 -0.04 -0.16 0.00 0.07 0.00 0.00 59.36 59.22 2rgk h GLU 150 Cb 0.91 0.02 -0.03 0.00 0.50 0.00 0.00 28.75 30.15 2rgk h GLU 150 CO 0.07 0.81 -1.38 0.93 0.07 0.00 0.00 179.01 179.51 2rgk h GLU 151 N 0.01 0.00 -5.91 1.06 5.08 -1.96 -3.48 114.58 109.38 2rgk h GLU 151 Ca -0.14 0.00 -0.39 0.00 -1.00 0.00 0.00 59.36 57.83 2rgk h GLU 151 Cb 1.89 0.00 0.10 0.00 0.50 0.00 0.00 28.75 31.24 2rgk h GLU 151 CO 0.11 0.28 -0.79 1.04 -1.00 0.00 0.00 179.01 178.65 2rgk n GLN 152 N -2.89 -5.83 -3.87 2.33 1.13 0.10 -4.98 117.38 103.38 2rgk n GLN 152 Ca -0.09 0.72 -0.09 0.00 -1.94 0.00 0.00 57.00 55.60 2rgk n GLN 152 Cb 0.83 -5.52 -0.00 0.00 0.11 0.00 0.00 30.24 25.66 2rgk n GLN 152 CO 0.00 0.00 0.00 -1.64 -1.44 0.00 0.00 177.06 173.98 2rgk s MET 153 N -5.79 2.01 -0.13 -1.09 -1.94 -1.23 -4.67 119.30 106.46 2rgk s MET 153 Ca 0.08 -1.33 -0.08 0.00 -1.71 0.00 0.00 55.69 52.64 2rgk s MET 153 Cb -0.04 0.59 -0.04 0.00 2.01 0.00 0.00 34.83 37.35 2rgk s MET 153 CO 0.78 -0.92 0.15 0.00 -0.01 0.00 0.00 175.02 175.02 2rgk s LEU 155 N -0.74 2.61 -0.17 0.00 1.43 -0.25 -4.77 118.68 116.79 2rgk s LEU 155 Ca 0.14 1.32 -0.16 0.00 -1.03 0.00 0.00 54.13 54.40 2rgk s LEU 155 Cb -0.12 -3.94 -0.12 0.00 0.03 0.00 0.00 46.19 42.04 2rgk s LEU 155 CO 0.03 -1.96 0.07 -0.08 0.23 0.00 0.00 176.35 174.64 2rgk h GLU 156 N -1.08 0.00 -1.94 1.70 4.57 -1.86 -3.43 114.58 112.54 2rgk h GLU 156 Ca -0.47 0.00 0.20 0.00 -1.18 0.00 0.00 59.36 57.91 2rgk h GLU 156 Cb 1.27 0.00 -0.14 0.00 -0.16 0.00 0.00 28.75 29.72 2rgk h GLU 156 CO 0.59 0.53 0.63 -1.54 -1.18 0.00 0.00 179.01 178.04 2rgk s SER 157 N -6.29 -0.21 0.16 1.04 1.04 -1.26 0.19 113.70 108.37 2rgk s SER 157 Ca -0.21 -0.11 0.02 0.00 0.48 0.00 0.00 55.95 56.13 2rgk s SER 157 Cb 0.04 0.31 -0.05 0.00 0.10 0.00 0.00 66.02 66.42 2rgk s SER 157 CO 0.41 -0.52 -0.01 0.26 0.98 0.00 0.00 173.24 174.35 2rgk s TRP 158 N -2.86 1.18 0.89 5.02 0.52 0.21 -0.51 118.94 123.39 2rgk s TRP 158 Ca 0.09 -0.99 -0.12 0.00 0.02 0.00 0.00 56.10 55.10 2rgk s TRP 158 Cb -0.00 -0.67 0.12 0.00 -1.15 0.00 0.00 33.47 31.77 2rgk s TRP 158 CO -0.05 -0.19 1.13 0.16 0.02 0.00 0.00 176.95 178.02 2rgk s ASP 159 N -3.16 3.71 0.26 2.95 -4.77 -1.18 -1.00 116.67 113.48 2rgk s ASP 159 Ca 0.22 1.06 -0.06 0.00 -3.30 0.00 0.00 52.55 50.47 2rgk s ASP 159 Cb 0.06 -1.68 0.49 0.00 -1.09 0.00 0.00 42.92 40.70 2rgk s ASP 159 CO 0.03 -2.43 1.61 -0.08 0.70 0.00 0.00 175.17 174.99 2rgk h GLU 160 N -1.41 0.05 -0.02 2.11 4.81 -1.90 -0.80 114.58 117.42 2rgk h GLU 160 Ca -0.50 -0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.73 2rgk h GLU 160 Cb 1.32 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.68 2rgk h GLU 160 CO 0.61 0.03 0.00 0.00 -0.73 0.00 0.00 179.01 178.93 2rgk n ALA 161 N -3.12 2.59 -3.76 2.92 0.00 -1.26 -4.83 120.51 113.05 2rgk n ALA 161 Ca 0.15 -0.15 -0.27 0.00 0.00 0.00 0.00 53.44 53.18 2rgk n ALA 161 Cb 0.52 -1.25 0.05 0.00 0.00 0.00 0.00 19.45 18.78 2rgk n ALA 161 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 2rgk n PHE 162 N -0.64 -2.55 -0.09 0.00 3.72 -0.31 -4.90 117.46 112.70 2rgk n PHE 162 Ca 0.13 0.96 -0.13 0.00 -0.05 0.00 0.00 57.45 58.35 2rgk n PHE 162 Cb 0.08 -4.49 -0.14 0.00 -0.94 0.00 0.00 39.48 33.99 2rgk n PHE 162 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 2rgk n SER 163 N -2.93 0.88 -3.72 4.37 3.41 -1.26 -4.94 113.62 109.43 2rgk n SER 163 Ca 0.01 0.05 -0.19 0.00 -0.26 0.00 0.00 58.87 58.47 2rgk n SER 163 Cb 0.55 0.27 -0.17 0.00 -0.26 0.00 0.00 64.21 64.60 2rgk n SER 163 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 2rgk s LYS 164 N -2.52 0.08 0.00 4.33 2.47 -1.26 -5.06 119.74 117.78 2rgk s LYS 164 Ca -0.17 0.27 -0.17 0.00 -1.56 0.00 0.00 55.97 54.34 2rgk s LYS 164 Cb 0.07 -0.53 -0.06 0.00 -1.46 0.00 0.00 37.83 35.85 2rgk s LYS 164 CO 0.76 -0.27 0.47 -0.08 0.16 0.00 0.00 175.35 176.38 2rgk s THR 165 N 1.80 4.97 0.22 3.43 -1.32 -1.26 -3.12 115.64 120.36 2rgk s THR 165 Ca 0.01 0.97 -0.31 0.00 -1.21 0.00 0.00 61.69 61.14 2rgk s THR 165 Cb -0.12 -3.78 -0.14 0.00 -1.51 0.00 0.00 72.50 66.94 2rgk s THR 165 CO -0.03 0.54 1.29 1.21 -2.21 0.00 0.00 174.62 175.42 2rgk n GLU 166 N 2.06 1.69 -2.08 7.08 2.13 0.34 -4.85 120.64 127.01 2rgk n GLU 166 Ca -0.12 0.60 -0.42 0.00 0.66 0.00 0.00 57.16 57.88 2rgk n GLU 166 Cb 0.52 -2.18 0.00 0.00 0.27 0.00 0.00 31.44 30.05 2rgk n GLU 166 CO 0.00 0.00 0.00 0.39 -0.41 0.00 0.00 177.13 177.11 2rgk n GLU 167 N 1.80 3.20 -3.53 5.31 1.02 -1.26 -4.75 120.64 122.43 2rgk n GLU 167 Ca 0.12 -3.07 -0.11 0.00 -0.02 0.00 0.00 57.16 54.08 2rgk n GLU 167 Cb 0.29 -3.15 -0.04 0.00 -0.02 0.00 0.00 31.44 28.52 2rgk n GLU 167 CO 0.00 0.00 0.00 -0.47 1.18 0.00 0.00 177.13 177.84 2rgk s TYR 168 N 2.08 -0.43 -0.01 -0.32 5.04 -1.26 -4.40 117.35 118.05 2rgk s TYR 168 Ca 0.44 0.57 0.01 0.00 -2.44 0.00 0.00 57.07 55.65 2rgk s TYR 168 Cb 0.11 0.48 0.00 0.00 0.35 0.00 0.00 41.96 42.90 2rgk s TYR 168 CO -0.04 -0.49 -0.03 1.03 -1.34 0.00 0.00 175.55 174.68 2rgk s ARG 169 N -1.94 0.32 0.08 4.97 1.81 -0.49 -4.21 118.95 119.49 2rgk s ARG 169 Ca -0.01 -0.11 0.04 0.00 -1.72 0.00 0.00 55.73 53.92 2rgk s ARG 169 Cb -0.01 -0.33 -0.03 0.00 -0.45 0.00 0.00 34.95 34.14 2rgk s ARG 169 CO -0.01 0.06 -0.11 0.20 -0.68 0.00 0.00 175.30 174.75 2rgk s GLY 170 N 0.05 0.78 0.11 -3.53 0.00 -1.26 -0.52 107.32 102.94 2rgk s GLY 170 Ca -0.00 -1.03 -0.14 0.00 0.00 0.00 0.00 44.72 43.54 2rgk s GLY 170 CO -0.00 -1.09 1.49 -1.33 0.00 0.00 0.00 173.10 172.17 2rgk h GLY 171 N 4.01 0.79 0.82 0.20 0.00 -1.38 -3.23 103.07 104.29 2rgk h GLY 171 Ca -0.38 -0.70 0.03 0.00 0.00 0.00 0.00 47.33 46.28 2rgk h GLY 171 CO 0.46 0.64 0.16 -0.57 0.00 0.00 0.00 176.54 177.23 2rgk h ASN 172 N 0.51 0.23 -0.58 0.19 -0.73 -1.96 0.14 115.58 113.39 2rgk h ASN 172 Ca 0.08 0.02 0.06 0.00 1.87 0.00 0.00 56.30 58.33 2rgk h ASN 172 Cb 0.69 -0.02 -0.05 0.00 0.27 0.00 0.00 38.32 39.20 2rgk h ASN 172 CO 0.05 0.17 0.30 0.00 -0.37 0.00 0.00 177.43 177.58 2rgk h ALA 173 N 1.18 0.76 0.00 1.57 0.00 -1.95 -1.64 119.26 119.18 2rgk h ALA 173 Ca 0.14 0.03 -0.09 0.00 0.00 0.00 0.00 54.91 54.99 2rgk h ALA 173 Cb 0.06 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 2rgk h ALA 173 CO -0.11 -0.05 -0.43 -0.91 0.00 0.00 0.00 179.25 177.75 2rgk h ASN 174 N 0.56 0.00 0.11 0.00 4.21 -1.44 -2.04 115.58 116.98 2rgk h ASN 174 Ca 0.26 0.00 -0.01 0.00 1.21 0.00 0.00 56.30 57.77 2rgk h ASN 174 Cb 0.19 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.39 2rgk h ASN 174 CO -0.19 0.43 -0.05 -0.03 -1.29 0.00 0.00 177.43 176.30 2rgk h MET 175 N 0.00 -0.15 0.00 0.81 4.05 0.00 -2.03 114.93 117.61 2rgk h MET 175 Ca -0.00 0.01 -0.02 0.00 -0.28 0.00 0.00 59.70 59.40 2rgk h MET 175 Cb 0.83 0.03 -0.00 0.00 -0.80 0.00 0.00 31.60 31.66 2rgk h MET 175 CO 0.06 0.22 -0.12 0.45 0.23 0.00 0.00 176.91 177.75 2rgk h HIS 176 N -0.54 0.00 -0.42 1.39 3.86 -1.28 0.86 115.15 119.02 2rgk h HIS 176 Ca -0.02 0.00 -0.09 0.00 -1.16 0.00 0.00 60.37 59.11 2rgk h HIS 176 Cb 0.44 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.89 2rgk h HIS 176 CO 0.05 0.12 -0.09 0.00 0.86 0.00 0.00 177.93 178.87 2rgk h ALA 177 N 1.88 0.58 -0.65 2.45 0.00 -1.25 -0.11 119.26 122.17 2rgk h ALA 177 Ca -0.00 -0.31 -0.02 0.00 0.00 0.00 0.00 54.91 54.57 2rgk h ALA 177 Cb 0.27 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.88 2rgk h ALA 177 CO 0.02 0.44 0.32 0.28 0.00 0.00 0.00 179.25 180.31 2rgk h VAL 178 N 0.63 1.22 -0.00 0.00 2.07 -0.25 0.33 116.25 120.25 2rgk h VAL 178 Ca 0.11 -0.60 0.02 0.00 0.82 0.00 0.00 66.70 67.05 2rgk h VAL 178 Cb 0.61 0.42 -0.02 0.00 -1.52 0.00 0.00 31.29 30.78 2rgk h VAL 178 CO 0.04 0.25 -0.09 -0.08 0.02 0.00 0.00 177.57 177.70 2rgk h GLU 179 N 0.89 -0.15 -0.26 1.57 4.81 -0.56 -2.00 114.58 118.88 2rgk h GLU 179 Ca 0.22 0.01 -0.10 0.00 -0.13 0.00 0.00 59.36 59.36 2rgk h GLU 179 Cb 0.10 0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.50 2rgk h GLU 179 CO -0.03 -0.10 -0.28 0.00 -0.73 0.00 0.00 179.01 177.87 2rgk h ALA 180 N 0.82 1.04 -0.22 2.92 0.00 -0.70 -2.89 119.26 120.23 2rgk h ALA 180 Ca 0.04 -0.36 -0.02 0.00 0.00 0.00 0.00 54.91 54.56 2rgk h ALA 180 Cb 0.20 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 2rgk h ALA 180 CO -0.10 0.58 0.04 0.74 0.00 0.00 0.00 179.25 180.51 2rgk h PHE 181 N 0.44 0.31 0.25 0.00 0.04 0.01 -0.91 116.94 117.09 2rgk h PHE 181 Ca 0.06 -0.01 -0.01 0.00 2.80 0.00 0.00 57.97 60.81 2rgk h PHE 181 Cb 0.72 -0.10 0.00 0.00 2.20 0.00 0.00 35.95 38.77 2rgk h PHE 181 CO 0.02 0.30 -0.12 -0.07 -0.60 0.00 0.00 178.31 177.85 2rgk h LEU 182 N 0.32 -0.28 -0.43 1.54 3.38 -1.15 -1.09 115.31 117.59 2rgk h LEU 182 Ca 0.08 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.89 2rgk h LEU 182 Cb 0.16 0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.97 2rgk h LEU 182 CO -0.00 -0.19 -0.38 0.40 0.09 0.00 0.00 178.44 178.36 2rgk h ILE 183 N -0.35 1.27 -0.97 1.22 1.08 -1.56 -1.50 117.51 116.71 2rgk h ILE 183 Ca -0.03 -1.55 0.02 0.00 -0.39 0.00 0.00 64.86 62.90 2rgk h ILE 183 Cb 0.27 1.38 -0.05 0.00 -3.07 0.00 0.00 36.82 35.34 2rgk h ILE 183 CO 0.06 0.52 0.64 0.58 -0.69 0.00 0.00 178.15 179.26 2rgk h VAL 184 N 0.74 1.22 -0.36 1.67 2.07 -1.13 -0.41 116.25 120.05 2rgk h VAL 184 Ca 0.06 -0.44 -0.07 0.00 0.82 0.00 0.00 66.70 67.07 2rgk h VAL 184 Cb 0.96 -0.18 -0.02 0.00 -1.52 0.00 0.00 31.29 30.54 2rgk h VAL 184 CO 0.09 0.23 -0.08 0.22 0.02 0.00 0.00 177.57 178.05 2rgk h TYR 185 N 1.29 0.64 0.00 1.57 3.20 -0.91 -2.11 116.97 120.64 2rgk h TYR 185 Ca 0.37 -0.10 -0.08 0.00 3.14 0.00 0.00 58.73 62.06 2rgk h TYR 185 Cb -0.10 -0.17 -0.01 0.00 1.54 0.00 0.00 36.73 37.98 2rgk h TYR 185 CO -0.00 0.67 -0.39 -0.44 -1.64 0.00 0.00 178.16 176.36 2rgk h ASP 186 N 0.56 0.00 -0.56 -2.11 3.32 -0.04 0.28 116.42 117.86 2rgk h ASP 186 Ca 0.11 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.16 2rgk h ASP 186 Cb 0.48 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.03 2rgk h ASP 186 CO 0.03 0.39 0.00 1.33 -1.72 0.00 0.00 179.24 179.26 2rgk n VAL 187 N -3.79 1.25 0.00 -1.35 0.24 -0.67 -4.53 118.33 109.47 2rgk n VAL 187 Ca -0.01 -1.10 0.00 0.00 -2.04 0.00 0.00 64.34 61.19 2rgk n VAL 187 Cb 0.46 0.38 0.00 0.00 -1.47 0.00 0.00 33.84 33.21 2rgk n VAL 187 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 2rgk n THR 188 N 1.03 0.00 -3.60 3.34 -2.24 -0.82 -5.03 114.28 106.97 2rgk n THR 188 Ca 0.20 0.00 -0.24 0.00 -2.27 0.00 0.00 64.05 61.75 2rgk n THR 188 Cb 0.63 -0.16 0.08 0.00 -2.10 0.00 0.00 70.33 68.78 2rgk n THR 188 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 2rgk n HIS 189 N -1.29 -2.82 -3.39 4.78 8.25 0.97 -4.93 115.22 116.79 2rgk n HIS 189 Ca 0.00 1.01 -0.45 0.00 -0.26 0.00 0.00 57.72 58.02 2rgk n HIS 189 Cb 0.11 -5.02 -0.04 0.00 1.12 0.00 0.00 29.99 26.16 2rgk n HIS 189 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 2rgk s ASP 190 N -3.40 6.39 0.17 0.41 3.68 -1.26 -4.94 116.67 117.71 2rgk s ASP 190 Ca 0.54 -2.46 0.11 0.00 2.13 0.00 0.00 52.55 52.88 2rgk s ASP 190 Cb -0.24 -2.15 0.62 0.00 -1.45 0.00 0.00 42.92 39.70 2rgk s ASP 190 CO 0.73 -0.62 0.70 1.17 0.13 0.00 0.00 175.17 177.28 2rgk n LYS 191 N 4.26 -0.02 -0.25 4.34 4.81 -1.26 -1.16 118.16 128.88 2rgk n LYS 191 Ca 0.05 0.60 0.12 0.00 -0.87 0.00 0.00 58.31 58.21 2rgk n LYS 191 Cb 0.44 -1.10 0.40 0.00 0.02 0.00 0.00 35.03 34.78 2rgk n LYS 191 CO 0.00 0.00 0.00 1.57 1.17 0.00 0.00 177.40 180.14 2rgk h LYS 192 N 0.00 0.63 -0.29 1.64 2.10 -1.99 -1.58 116.57 117.09 2rgk h LYS 192 Ca 0.38 -0.04 -0.05 0.00 -2.00 0.00 0.00 60.65 58.94 2rgk h LYS 192 Cb 1.08 -0.14 -0.02 0.00 -0.90 0.00 0.00 32.23 32.26 2rgk h LYS 192 CO -0.30 0.42 -0.04 -1.49 -2.00 0.00 0.00 179.45 176.04 2rgk h TRP 193 N 0.65 0.47 0.06 0.07 4.06 -1.47 -0.24 115.95 119.56 2rgk h TRP 193 Ca 0.43 -0.05 -0.24 0.00 2.06 0.00 0.00 58.89 61.09 2rgk h TRP 193 Cb 0.72 -0.14 -0.01 0.00 -1.00 0.00 0.00 29.16 28.73 2rgk h TRP 193 CO -0.00 0.50 -1.11 1.25 -3.56 0.00 0.00 178.44 175.52 2rgk h LEU 194 N 0.44 0.24 -1.08 -4.49 5.85 -1.52 -2.64 115.31 112.11 2rgk h LEU 194 Ca 0.09 -0.25 -0.06 0.00 0.84 0.00 0.00 57.88 58.51 2rgk h LEU 194 Cb 0.35 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.28 2rgk h LEU 194 CO 0.01 1.18 0.04 0.44 -0.34 0.00 0.00 178.44 179.77 2rgk h ASP 195 N 0.05 0.65 -0.24 1.25 3.32 -0.79 -1.66 116.42 118.99 2rgk h ASP 195 Ca -0.08 -0.13 -0.17 0.00 0.02 0.00 0.00 57.03 56.67 2rgk h ASP 195 Cb 1.84 -0.17 -0.00 0.00 0.22 0.00 0.00 39.33 41.22 2rgk h ASP 195 CO 0.17 0.69 -0.51 0.03 -1.72 0.00 0.00 179.24 177.90 2rgk h ARG 196 N 0.66 0.83 -0.12 3.56 3.08 -1.02 -0.47 114.38 120.89 2rgk h ARG 196 Ca 0.14 -0.50 -0.00 0.00 0.07 0.00 0.00 59.98 59.69 2rgk h ARG 196 Cb 0.35 0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.45 2rgk h ARG 196 CO 0.01 1.13 0.06 0.00 -1.07 0.00 0.00 179.97 180.11 2rgk h ALA 197 N 0.77 0.15 -0.59 0.04 0.00 -1.15 0.21 119.26 118.68 2rgk h ALA 197 Ca 0.02 -0.05 0.03 0.00 0.00 0.00 0.00 54.91 54.91 2rgk h ALA 197 Cb 1.10 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.80 2rgk h ALA 197 CO 0.11 -0.31 0.35 0.82 0.00 0.00 0.00 179.25 180.23 2rgk h ILE 198 N 0.09 1.05 0.15 0.00 5.03 -1.24 -0.11 117.51 122.48 2rgk h ILE 198 Ca 0.04 -0.24 0.00 0.00 -0.12 0.00 0.00 64.86 64.55 2rgk h ILE 198 Cb 0.08 0.30 -0.01 0.00 -3.03 0.00 0.00 36.82 34.15 2rgk h ILE 198 CO -0.01 0.13 -0.15 -0.09 -0.68 0.00 0.00 178.15 177.35 2rgk h ARG 199 N 0.69 -0.31 -0.49 2.37 9.65 -0.71 0.67 114.38 126.25 2rgk h ARG 199 Ca 0.24 0.02 0.03 0.00 -1.10 0.00 0.00 59.98 59.17 2rgk h ARG 199 Cb 0.05 0.07 -0.03 0.00 -1.39 0.00 0.00 29.97 28.66 2rgk h ARG 199 CO -0.11 -0.21 0.28 0.28 2.80 0.00 0.00 179.97 183.01 2rgk h VAL 200 N -0.32 1.03 -0.78 0.20 2.07 -0.59 -2.59 116.25 115.28 2rgk h VAL 200 Ca 0.00 -0.19 -0.05 0.00 0.82 0.00 0.00 66.70 67.28 2rgk h VAL 200 Cb 0.30 0.42 -0.03 0.00 -1.52 0.00 0.00 31.29 30.46 2rgk h VAL 200 CO -0.04 0.10 0.31 0.00 0.02 0.00 0.00 177.57 177.97 2rgk h ALA 201 N 1.23 1.07 0.00 1.67 0.00 -0.79 -1.93 119.26 120.52 2rgk h ALA 201 Ca 0.20 -0.19 -0.03 0.00 0.00 0.00 0.00 54.91 54.89 2rgk h ALA 201 Cb 0.04 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 17.52 2rgk h ALA 201 CO -0.10 0.66 -0.15 0.66 0.00 0.00 0.00 179.25 180.31 2rgk h SER 202 N 1.13 0.00 0.00 0.00 4.64 -0.49 -0.03 113.55 118.81 2rgk h SER 202 Ca 0.26 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.58 2rgk h SER 202 Cb 0.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.30 2rgk h SER 202 CO -0.02 0.15 -0.16 0.58 -0.87 0.00 0.00 176.83 176.51 2rgk h VAL 203 N 0.00 0.00 0.00 0.95 2.07 -1.16 -1.27 116.25 116.84 2rgk h VAL 203 Ca -0.00 -0.74 -0.04 0.00 0.82 0.00 0.00 66.70 66.74 2rgk h VAL 203 Cb 0.36 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.12 2rgk h VAL 203 CO 0.02 0.00 -0.20 0.40 0.02 0.00 0.00 177.57 177.81 2rgk h ILE 204 N -0.74 1.05 0.00 4.57 2.04 -1.42 -2.26 117.51 120.75 2rgk h ILE 204 Ca 0.00 -0.71 -0.07 0.00 1.00 0.00 0.00 64.86 65.08 2rgk h ILE 204 Cb 0.16 1.39 -0.01 0.00 -0.74 0.00 0.00 36.82 37.62 2rgk h ILE 204 CO 0.00 0.20 -0.90 -0.38 0.00 0.00 0.00 178.15 177.06 2rgk n ILE 205 N -4.16 1.25 0.18 -0.67 2.08 -0.06 -2.59 119.36 115.39 2rgk n ILE 205 Ca -0.02 0.13 0.02 0.00 0.56 0.00 0.00 62.75 63.45 2rgk n ILE 205 Cb 0.27 -1.94 0.34 0.00 -0.75 0.00 0.00 39.64 37.56 2rgk n ILE 205 CO 0.00 0.00 0.00 -0.74 0.56 0.00 0.00 176.55 176.37 2rgk h HIS 206 N -0.56 0.00 0.06 1.39 2.76 -1.45 -0.14 115.15 117.20 2rgk h HIS 206 Ca -0.10 0.00 -0.35 0.00 -2.20 0.00 0.00 60.37 57.71 2rgk h HIS 206 Cb 0.77 0.00 -0.04 0.00 1.55 0.00 0.00 27.41 29.69 2rgk h HIS 206 CO -0.19 0.41 -1.99 -0.25 -1.30 0.00 0.00 177.93 174.60 2rgk n ASP 207 N -3.97 2.02 0.00 3.26 10.43 -0.48 -4.56 116.55 123.24 2rgk n ASP 207 Ca -0.02 0.20 0.00 0.00 2.57 0.00 0.00 54.79 57.54 2rgk n ASP 207 Cb 0.45 -0.79 0.00 0.00 1.84 0.00 0.00 41.12 42.61 2rgk n ASP 207 CO 0.00 0.00 0.00 0.52 -1.07 0.00 0.00 177.20 176.65 2rgk n VAL 208 N -3.72 0.00 -0.35 2.53 0.31 -0.86 -4.25 118.33 111.99 2rgk n VAL 208 Ca -0.37 0.13 0.11 0.00 -0.01 0.00 0.00 64.34 64.20 2rgk n VAL 208 Cb 0.94 -0.93 0.24 0.00 -0.91 0.00 0.00 33.84 33.17 2rgk n VAL 208 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2rgk h ALA 209 N -2.00 0.99 -0.82 3.52 0.00 -1.40 0.26 119.26 119.80 2rgk h ALA 209 Ca 0.00 0.36 0.11 0.00 0.00 0.00 0.00 54.91 55.38 2rgk h ALA 209 Cb 0.00 0.65 -0.08 0.00 0.00 0.00 0.00 17.79 18.36 2rgk h ALA 209 CO 0.00 -0.50 0.44 -0.09 0.00 0.00 0.00 179.25 179.10 2rgk h ARG 210 N 0.01 0.68 -0.63 0.00 2.43 -1.26 0.24 114.38 115.84 2rgk h ARG 210 Ca 0.55 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.68 2rgk h ARG 210 Cb 1.05 -0.15 0.00 0.00 -0.42 0.00 0.00 29.97 30.45 2rgk h ARG 210 CO -0.95 0.45 0.00 0.09 -1.51 0.00 0.00 179.97 178.05 2rgk n ASN 211 N -4.81 2.24 -2.39 -3.80 3.02 0.88 -3.60 115.26 106.80 2rgk n ASN 211 Ca 0.14 -2.21 -0.08 0.00 -0.03 0.00 0.00 54.58 52.40 2rgk n ASN 211 Cb 0.33 -0.42 0.04 0.00 -0.61 0.00 0.00 39.78 39.13 2rgk n ASN 211 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 2rgk n ASN 212 N 0.25 2.78 -2.62 6.41 5.15 0.39 -4.94 115.26 122.68 2rgk n ASN 212 Ca 0.10 -2.72 -0.21 0.00 -0.60 0.00 0.00 54.58 51.15 2rgk n ASN 212 Cb 0.46 -0.42 0.00 0.00 -0.53 0.00 0.00 39.78 39.29 2rgk n ASN 212 CO 0.00 0.00 0.00 1.41 1.40 0.00 0.00 177.26 180.07 2rgk n HIS 213 N -0.60 -1.35 -2.37 1.20 8.25 -1.20 -1.59 115.22 117.56 2rgk n HIS 213 Ca 0.21 0.18 -0.21 0.00 -0.26 0.00 0.00 57.72 57.64 2rgk n HIS 213 Cb 0.88 -4.05 -0.01 0.00 1.12 0.00 0.00 29.99 27.93 2rgk n HIS 213 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 2rgk n TYR 214 N -4.13 -0.97 -3.62 4.41 4.02 0.55 -4.81 117.16 112.60 2rgk n TYR 214 Ca -0.19 0.00 -0.40 0.00 -0.01 0.00 0.00 57.90 57.30 2rgk n TYR 214 Cb 0.66 -3.93 -0.11 0.00 -0.02 0.00 0.00 39.34 35.94 2rgk n TYR 214 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 176.86 176.88 2rgk s ARG 215 N -4.99 2.91 0.20 -0.72 0.52 -0.62 -4.63 118.95 111.63 2rgk s ARG 215 Ca 0.00 -1.02 -0.32 0.00 -0.52 0.00 0.00 55.73 53.88 2rgk s ARG 215 Cb 0.00 -3.68 -0.12 0.00 0.52 0.00 0.00 34.95 31.67 2rgk s ARG 215 CO 0.00 -0.64 1.71 0.08 0.02 0.00 0.00 175.30 176.47 2rgk s VAL 216 N 1.56 2.08 -0.29 3.52 1.01 -1.26 -4.53 120.40 122.49 2rgk s VAL 216 Ca 0.02 0.06 -0.21 0.00 0.00 0.00 0.00 61.98 61.85 2rgk s VAL 216 Cb -0.19 -3.04 -0.01 0.00 0.00 0.00 0.00 36.38 33.14 2rgk s VAL 216 CO 0.06 0.00 0.65 0.21 0.00 0.00 0.00 175.10 176.03 2rgk s ASN 217 N 1.18 6.54 0.02 3.32 3.84 -1.26 -4.56 114.94 124.02 2rgk s ASN 217 Ca 0.74 0.55 -0.13 0.00 0.21 0.00 0.00 52.86 54.23 2rgk s ASN 217 Cb -0.49 -2.34 -0.33 0.00 -0.55 0.00 0.00 41.25 37.53 2rgk s ASN 217 CO 0.32 -0.46 0.95 -0.08 -2.79 0.00 0.00 177.10 175.04 2rgk h GLU 218 N 8.08 0.47 -5.35 0.43 4.57 -1.93 -3.42 114.58 117.42 2rgk h GLU 218 Ca -0.26 -0.80 -0.61 0.00 -1.18 0.00 0.00 59.36 56.51 2rgk h GLU 218 Cb 1.12 0.30 -0.11 0.00 -0.16 0.00 0.00 28.75 29.89 2rgk h GLU 218 CO 0.80 1.37 -0.48 -1.01 -1.18 0.00 0.00 179.01 178.52 2rgk s HIS 219 N -2.60 3.45 0.10 0.92 0.09 -1.26 -1.11 115.29 114.87 2rgk s HIS 219 Ca -0.10 0.38 0.02 0.00 -0.00 0.00 0.00 55.06 55.37 2rgk s HIS 219 Cb 0.05 -2.13 -0.04 0.00 -0.00 0.00 0.00 32.58 30.45 2rgk s HIS 219 CO 0.92 0.37 -0.07 -0.06 -0.00 0.00 0.00 174.74 175.90 2rgk s PHE 220 N 0.12 0.90 0.74 1.40 0.40 0.32 -0.24 117.98 121.62 2rgk s PHE 220 Ca 0.10 -0.90 -0.02 0.00 -0.60 0.00 0.00 56.93 55.51 2rgk s PHE 220 Cb -0.11 -0.52 0.14 0.00 0.51 0.00 0.00 43.02 43.03 2rgk s PHE 220 CO -0.01 -0.14 1.02 0.16 0.70 0.00 0.00 175.22 176.96 2rgk s ASP 221 N -3.01 4.22 0.57 1.36 3.84 -0.66 -1.40 116.67 121.59 2rgk s ASP 221 Ca 0.12 -0.36 0.29 0.00 -0.00 0.00 0.00 52.55 52.59 2rgk s ASP 221 Cb 0.05 0.03 1.47 0.00 -1.38 0.00 0.00 42.92 43.09 2rgk s ASP 221 CO -0.04 -1.95 1.92 0.74 -0.00 0.00 0.00 175.17 175.83 2rgk h THR 222 N -0.62 0.46 -0.55 2.11 2.02 -1.87 0.10 112.91 114.56 2rgk h THR 222 Ca -0.36 0.00 0.00 0.00 0.77 0.00 0.00 66.41 66.82 2rgk h THR 222 Cb 1.26 0.63 0.00 0.00 -1.74 0.00 0.00 68.15 68.31 2rgk h THR 222 CO 0.39 0.00 0.00 0.00 0.37 0.00 0.00 175.52 176.28 2rgk n GLN 223 N -3.92 3.86 -2.33 6.66 6.02 -1.26 -4.94 117.38 121.46 2rgk n GLN 223 Ca 0.10 -2.90 -0.14 0.00 -0.01 0.00 0.00 57.00 54.05 2rgk n GLN 223 Cb 0.70 -1.94 -0.00 0.00 1.02 0.00 0.00 30.24 30.01 2rgk n GLN 223 CO 0.00 0.00 0.00 0.91 -1.01 0.00 0.00 177.06 176.96 2rgk n TRP 224 N 0.69 -0.76 -3.16 1.08 7.02 0.36 -5.01 117.44 117.66 2rgk n TRP 224 Ca 0.25 0.04 -0.39 0.00 -1.02 0.00 0.00 57.50 56.38 2rgk n TRP 224 Cb 0.94 -3.09 -0.06 0.00 -2.42 0.00 0.00 31.31 26.68 2rgk n TRP 224 CO 0.00 0.00 0.00 -0.80 -2.02 0.00 0.00 177.69 174.87 2rgk s ASN 225 N -2.41 6.75 0.41 -0.99 0.01 -1.26 -4.80 114.94 112.67 2rgk s ASN 225 Ca 0.03 0.91 -0.26 0.00 -0.71 0.00 0.00 52.86 52.83 2rgk s ASN 225 Cb -0.01 -2.35 -0.10 0.00 0.41 0.00 0.00 41.25 39.20 2rgk s ASN 225 CO 0.03 -0.16 1.29 -2.65 -1.51 0.00 0.00 177.10 174.11 2rgk n PRO 226 N 4.36 2.00 -3.50 -0.60 -0.02 -1.26 -1.65 135.00 134.33 2rgk n PRO 226 Ca -0.03 0.71 -0.27 0.00 -2.02 0.00 0.00 63.50 61.89 2rgk n PRO 226 Cb 0.51 -2.41 -0.09 0.00 -0.02 0.00 0.00 33.50 31.49 2rgk n PRO 226 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 2rgk n LEU 227 N 0.24 3.40 0.04 2.45 4.77 0.67 -4.86 117.00 123.71 2rgk n LEU 227 Ca 0.06 -5.35 0.15 0.00 -0.03 0.00 0.00 56.01 50.84 2rgk n LEU 227 Cb 0.39 -0.60 0.63 0.00 -2.33 0.00 0.00 43.42 41.51 2rgk n LEU 227 CO 0.60 2.00 1.16 1.55 -1.33 0.00 0.00 177.39 181.36 2rgk h PRO 228 N 4.41 0.10 -0.66 3.23 0.13 -1.93 -1.78 132.00 135.49 2rgk h PRO 228 Ca 0.18 -0.01 -0.00 0.00 -0.87 0.00 0.00 66.00 65.31 2rgk h PRO 228 Cb 0.69 -0.02 -0.00 0.00 0.13 0.00 0.00 31.00 31.80 2rgk h PRO 228 CO 0.79 0.06 0.00 -0.25 -0.23 0.00 0.00 178.00 178.38 2rgk n ASP 229 N -4.44 4.86 -4.68 1.44 8.00 -1.26 -4.42 116.55 116.05 2rgk n ASP 229 Ca 0.07 -2.76 -0.42 0.00 0.71 0.00 0.00 54.79 52.38 2rgk n ASP 229 Cb 0.43 -0.65 -0.03 0.00 -0.02 0.00 0.00 41.12 40.85 2rgk n ASP 229 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 2rgk s TYR 230 N -2.44 1.95 -1.61 1.24 5.04 -0.67 -1.77 117.35 119.09 2rgk s TYR 230 Ca 0.44 -0.06 -0.03 0.00 -2.44 0.00 0.00 57.07 54.98 2rgk s TYR 230 Cb 0.34 -4.14 0.01 0.00 0.35 0.00 0.00 41.96 38.52 2rgk s TYR 230 CO 0.13 -4.80 0.41 0.09 -1.34 0.00 0.00 175.55 170.04 2rgk n ASN 231 N 6.28 -5.93 0.21 4.32 5.03 -1.26 -4.24 115.26 119.67 2rgk n ASN 231 Ca 0.18 -0.20 0.09 0.00 0.87 0.00 0.00 54.58 55.52 2rgk n ASN 231 Cb 0.40 -4.84 0.36 0.00 -1.02 0.00 0.00 39.78 34.68 2rgk n ASN 231 CO 0.00 0.00 0.00 0.50 -1.83 0.00 0.00 177.26 175.93 2rgk h LYS 232 N -0.93 0.00 0.00 3.52 3.64 -1.70 -2.34 116.57 118.76 2rgk h LYS 232 Ca -0.51 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 58.86 2rgk h LYS 232 Cb 1.36 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 33.18 2rgk h LYS 232 CO 0.57 0.24 -0.02 -0.44 -2.27 0.00 0.00 179.45 177.53 2rgk h ASP 233 N 0.00 0.00 -2.29 4.20 3.32 -1.90 -3.33 116.42 116.43 2rgk h ASP 233 Ca -0.00 0.00 -0.63 0.00 0.02 0.00 0.00 57.03 56.42 2rgk h ASP 233 Cb 0.88 0.00 -0.40 0.00 0.22 0.00 0.00 39.33 40.03 2rgk h ASP 233 CO 0.03 0.02 -0.40 0.59 -1.72 0.00 0.00 179.24 177.76 2rgk n ASN 234 N -3.10 4.30 0.00 6.45 3.02 -0.88 -5.01 115.26 120.04 2rgk n ASN 234 Ca 0.04 -3.49 0.00 0.00 -0.03 0.00 0.00 54.58 51.10 2rgk n ASN 234 Cb 0.53 -0.73 0.00 0.00 -0.61 0.00 0.00 39.78 38.97 2rgk n ASN 234 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 2rgk n PRO 235 N 0.69 0.00 0.00 3.52 -0.04 -1.22 -2.97 135.00 134.98 2rgk n PRO 235 Ca 0.30 0.15 0.06 0.00 -0.04 0.00 0.00 63.50 63.97 2rgk n PRO 235 Cb 0.39 -0.73 0.28 0.00 -0.04 0.00 0.00 33.50 33.40 2rgk n PRO 235 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2rgk n ALA 236 N -1.97 1.63 -1.55 0.55 0.00 -1.26 -3.86 120.51 114.04 2rgk n ALA 236 Ca 0.00 -0.05 -0.15 0.00 0.00 0.00 0.00 53.44 53.24 2rgk n ALA 236 Cb 0.00 -1.20 -0.09 0.00 0.00 0.00 0.00 19.45 18.16 2rgk n ALA 236 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2rgk n HIS 237 N -1.42 1.05 -0.84 0.00 8.25 -1.16 -4.88 115.22 116.22 2rgk n HIS 237 Ca 0.04 -0.01 -0.35 0.00 -0.26 0.00 0.00 57.72 57.14 2rgk n HIS 237 Cb 0.13 -2.40 0.10 0.00 1.12 0.00 0.00 29.99 28.94 2rgk n HIS 237 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 2rgk n ARG 238 N 8.47 -0.59 -1.35 -0.41 5.12 -1.26 -4.47 116.66 122.16 2rgk n ARG 238 Ca 0.49 -0.16 -0.00 0.00 -1.93 0.00 0.00 57.85 56.25 2rgk n ARG 238 Cb 0.40 -1.43 -0.00 0.00 -1.16 0.00 0.00 32.46 30.27 2rgk n ARG 238 CO 0.00 0.00 0.00 0.34 -1.93 0.00 0.00 177.63 176.04 2rgk n PHE 239 N -3.63 -0.30 -3.37 -1.55 -0.00 -1.26 -4.74 117.46 102.60 2rgk n PHE 239 Ca 0.01 0.18 -0.18 0.00 -0.00 0.00 0.00 57.45 57.45 2rgk n PHE 239 Cb 0.62 -1.87 0.07 0.00 -0.00 0.00 0.00 39.48 38.30 2rgk n PHE 239 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.76 177.30 2rgk n ARG 240 N 0.12 -2.72 -1.37 -4.13 1.74 -1.26 -4.93 116.66 104.10 2rgk n ARG 240 Ca -0.02 0.78 -0.34 0.00 -0.77 0.00 0.00 57.85 57.51 2rgk n ARG 240 Cb 0.02 -5.51 0.10 0.00 -1.02 0.00 0.00 32.46 26.05 2rgk n ARG 240 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2rgk s ALA 241 N -3.42 2.07 0.47 7.54 0.00 -1.26 -4.79 121.76 122.37 2rgk s ALA 241 Ca 0.38 0.86 -0.22 0.00 0.00 0.00 0.00 51.96 52.99 2rgk s ALA 241 Cb -0.07 -3.47 -0.08 0.00 0.00 0.00 0.00 23.12 19.50 2rgk s ALA 241 CO 0.76 -1.95 1.09 0.12 0.00 0.00 0.00 175.76 175.79 2rgk s PHE 242 N -2.03 2.96 0.00 0.00 2.19 -1.25 -4.86 117.98 114.98 2rgk s PHE 242 Ca 0.74 1.58 0.00 0.00 0.33 0.00 0.00 56.93 59.57 2rgk s PHE 242 Cb -0.29 -3.21 0.00 0.00 -1.31 0.00 0.00 43.02 38.21 2rgk s PHE 242 CO 0.46 -1.11 0.00 0.41 1.83 0.00 0.00 175.22 176.81 2rgk n GLY 243 N 0.16 -1.01 3.64 13.12 0.00 -1.26 -4.68 105.19 115.16 2rgk n GLY 243 Ca 0.08 -1.22 -0.31 0.00 0.00 0.00 0.00 46.02 44.57 2rgk n GLY 243 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2rgk s GLY 244 N -0.18 1.83 -0.37 -0.02 0.00 -0.40 -4.60 107.32 103.59 2rgk s GLY 244 Ca 0.00 -1.05 -0.05 0.00 0.00 0.00 0.00 44.72 43.62 2rgk s GLY 244 CO 0.00 -0.96 0.14 -0.51 0.00 0.00 0.00 173.10 171.77 2rgk s THR 245 N -1.12 3.58 0.29 0.90 -4.23 -1.26 -1.08 115.64 112.71 2rgk s THR 245 Ca 0.20 -1.48 -0.02 0.00 -1.18 0.00 0.00 61.69 59.21 2rgk s THR 245 Cb -0.11 -3.18 0.40 0.00 1.34 0.00 0.00 72.50 70.95 2rgk s THR 245 CO 0.12 -0.37 1.58 -0.65 -0.54 0.00 0.00 174.62 174.76 2rgk h PRO 246 N 8.17 0.02 -0.93 3.99 0.11 -1.82 0.25 132.00 141.80 2rgk h PRO 246 Ca -0.20 -0.00 0.24 0.00 0.11 0.00 0.00 66.00 66.14 2rgk h PRO 246 Cb 1.07 -0.01 -0.17 0.00 0.11 0.00 0.00 31.00 32.00 2rgk h PRO 246 CO 0.65 0.02 -0.00 0.78 -0.21 0.00 0.00 178.00 179.23 2rgk h GLY 247 N 0.03 1.09 1.21 -0.55 0.00 -1.84 0.36 103.07 103.36 2rgk h GLY 247 Ca 0.54 0.16 -0.12 0.00 0.00 0.00 0.00 47.33 47.91 2rgk h GLY 247 CO -0.90 -0.44 -0.17 0.45 0.00 0.00 0.00 176.54 175.49 2rgk h HIS 248 N 0.04 1.03 -0.35 5.60 3.86 -1.32 -2.34 115.15 121.67 2rgk h HIS 248 Ca 0.54 -0.23 0.06 0.00 -1.16 0.00 0.00 60.37 59.58 2rgk h HIS 248 Cb 1.04 -0.25 -0.06 0.00 1.06 0.00 0.00 27.41 29.20 2rgk h HIS 248 CO -0.50 1.01 0.01 -1.49 0.86 0.00 0.00 177.93 177.81 2rgk h TRP 249 N 0.80 0.00 -0.22 2.45 6.55 -0.28 -0.36 115.95 124.90 2rgk h TRP 249 Ca 0.12 0.03 -0.07 0.00 0.95 0.00 0.00 58.89 59.92 2rgk h TRP 249 Cb 0.71 0.05 -0.01 0.00 -0.86 0.00 0.00 29.16 29.05 2rgk h TRP 249 CO 0.04 -0.05 -0.15 0.97 -1.05 0.00 0.00 178.44 178.20 2rgk h ILE 250 N 0.11 1.22 -0.34 1.49 2.10 -1.19 -2.20 117.51 118.71 2rgk h ILE 250 Ca 0.17 -0.97 -0.08 0.00 1.08 0.00 0.00 64.86 65.07 2rgk h ILE 250 Cb 0.23 1.22 -0.01 0.00 -1.09 0.00 0.00 36.82 37.17 2rgk h ILE 250 CO -0.28 0.31 -0.08 -0.33 -1.08 0.00 0.00 178.15 176.69 2rgk h GLU 251 N 0.34 0.65 -0.87 2.19 5.08 -0.76 -2.67 114.58 118.54 2rgk h GLU 251 Ca 0.06 -0.25 0.10 0.00 -1.00 0.00 0.00 59.36 58.27 2rgk h GLU 251 Cb 0.47 -0.04 -0.08 0.00 0.50 0.00 0.00 28.75 29.61 2rgk h GLU 251 CO 0.03 0.83 0.52 -1.49 -1.00 0.00 0.00 179.01 177.89 2rgk h TRP 252 N 0.44 0.94 0.01 4.33 4.06 -0.70 -1.20 115.95 123.84 2rgk h TRP 252 Ca 0.09 0.03 0.02 0.00 2.06 0.00 0.00 58.89 61.08 2rgk h TRP 252 Cb 0.59 -0.29 -0.02 0.00 -1.00 0.00 0.00 29.16 28.43 2rgk h TRP 252 CO 0.05 0.39 -0.12 0.78 -3.56 0.00 0.00 178.44 175.98 2rgk h GLY 253 N 0.86 -0.15 0.98 1.49 0.00 -1.15 -1.43 103.07 103.66 2rgk h GLY 253 Ca 0.42 0.14 0.00 0.00 0.00 0.00 0.00 47.33 47.89 2rgk h GLY 253 CO -0.25 -0.12 0.01 -0.09 0.00 0.00 0.00 176.54 176.09 2rgk h ARG 254 N -0.20 0.02 -0.40 4.80 2.43 -1.06 -2.60 114.38 117.36 2rgk h ARG 254 Ca 0.04 -0.00 0.06 0.00 -0.81 0.00 0.00 59.98 59.27 2rgk h ARG 254 Cb 0.25 -0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 29.77 2rgk h ARG 254 CO -0.11 0.01 0.27 -0.07 -1.51 0.00 0.00 179.97 178.57 2rgk h LEU 255 N 0.02 0.25 -0.84 3.80 3.38 -1.07 -0.74 115.31 120.11 2rgk h LEU 255 Ca 0.01 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.86 2rgk h LEU 255 Cb 0.01 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 2rgk h LEU 255 CO -0.01 0.16 -0.46 0.24 0.09 0.00 0.00 178.44 178.45 2rgk h MET 256 N 0.28 0.26 -0.09 1.13 2.86 -0.89 -2.17 114.93 116.32 2rgk h MET 256 Ca 0.18 -0.14 -0.15 0.00 -2.06 0.00 0.00 59.70 57.53 2rgk h MET 256 Cb 0.34 0.01 -0.01 0.00 0.06 0.00 0.00 31.60 32.00 2rgk h MET 256 CO -0.04 0.68 -0.61 -0.07 1.06 0.00 0.00 176.91 177.93 2rgk h LEU 257 N 0.21 0.35 -0.93 1.22 3.38 -0.93 0.14 115.31 118.76 2rgk h LEU 257 Ca 0.01 -0.20 0.00 0.00 0.09 0.00 0.00 57.88 57.78 2rgk h LEU 257 Cb 0.90 -0.10 -0.05 0.00 0.09 0.00 0.00 40.66 41.51 2rgk h LEU 257 CO 0.07 0.87 0.58 0.45 0.09 0.00 0.00 178.44 180.51 2rgk h HIS 258 N 0.23 1.20 -0.66 1.13 3.86 -0.98 0.54 115.15 120.46 2rgk h HIS 258 Ca -0.01 0.01 -0.08 0.00 -1.16 0.00 0.00 60.37 59.14 2rgk h HIS 258 Cb 1.12 -0.40 -0.03 0.00 1.06 0.00 0.00 27.41 29.17 2rgk h HIS 258 CO 0.03 0.78 0.11 0.82 0.86 0.00 0.00 177.93 180.53 2rgk h ILE 259 N 1.27 1.26 -0.03 2.45 2.04 -0.87 -1.30 117.51 122.33 2rgk h ILE 259 Ca 0.34 -1.03 0.00 0.00 1.00 0.00 0.00 64.86 65.17 2rgk h ILE 259 Cb -0.09 0.64 -0.00 0.00 -0.74 0.00 0.00 36.82 36.63 2rgk h ILE 259 CO -0.07 0.39 0.01 -0.74 0.00 0.00 0.00 178.15 177.74 2rgk h HIS 260 N 1.02 0.02 -0.46 1.37 2.76 0.25 -2.00 115.15 118.10 2rgk h HIS 260 Ca 0.20 0.00 -0.06 0.00 -2.20 0.00 0.00 60.37 58.31 2rgk h HIS 260 Cb 0.43 -0.01 -0.02 0.00 1.55 0.00 0.00 27.41 29.37 2rgk h HIS 260 CO 0.03 0.01 0.02 0.00 -1.30 0.00 0.00 177.93 176.70 2rgk h ALA 261 N 1.02 1.17 -0.66 5.26 0.00 0.19 -2.56 119.26 123.68 2rgk h ALA 261 Ca 0.01 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.68 2rgk h ALA 261 Cb 0.00 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.57 2rgk h ALA 261 CO -0.01 0.54 0.43 0.00 0.00 0.00 0.00 179.25 180.21 2rgk h ALA 262 N 1.32 0.83 -0.51 0.00 0.00 -0.94 0.97 119.26 120.92 2rgk h ALA 262 Ca 0.14 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.97 2rgk h ALA 262 Cb 0.40 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 2rgk h ALA 262 CO 0.01 0.27 0.20 -0.07 0.00 0.00 0.00 179.25 179.66 2rgk h LEU 263 N 0.89 0.72 -0.76 0.00 3.38 -1.06 -2.80 115.31 115.68 2rgk h LEU 263 Ca 0.24 -0.18 -0.10 0.00 0.09 0.00 0.00 57.88 57.94 2rgk h LEU 263 Cb -0.09 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.46 2rgk h LEU 263 CO -0.05 0.70 -0.11 -0.33 0.09 0.00 0.00 178.44 178.74 2rgk h GLU 264 N 0.69 0.83 0.00 1.13 5.08 -1.07 -1.35 114.58 119.89 2rgk h GLU 264 Ca 0.17 -0.28 0.00 0.00 -1.00 0.00 0.00 59.36 58.25 2rgk h GLU 264 Cb 0.21 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.40 2rgk h GLU 264 CO -0.01 0.90 0.13 0.00 -1.00 0.00 0.00 179.01 179.02 2rgk h ALA 265 N 1.13 1.09 -0.04 3.43 0.00 -0.54 1.00 119.26 125.33 2rgk h ALA 265 Ca 0.12 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 2rgk h ALA 265 Cb 0.60 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 2rgk h ALA 265 CO 0.04 -0.09 -0.44 2.89 0.00 0.00 0.00 179.25 181.65 2rgk n ARG 266 N -2.30 1.61 -3.41 0.00 1.85 -1.03 -4.97 116.66 108.41 2rgk n ARG 266 Ca -0.01 -3.27 -0.24 0.00 -1.00 0.00 0.00 57.85 53.32 2rgk n ARG 266 Cb 0.16 -1.64 0.05 0.00 -1.05 0.00 0.00 32.46 29.98 2rgk n ARG 266 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2rgk s GLU 268 N -6.11 2.93 -0.07 0.00 2.12 -0.54 -5.02 118.70 112.02 2rgk s GLU 268 Ca 0.48 -0.82 -0.30 0.00 0.36 0.00 0.00 54.97 54.69 2rgk s GLU 268 Cb -0.22 -2.36 -0.05 0.00 0.26 0.00 0.00 34.13 31.77 2rgk s GLU 268 CO 0.59 0.00 1.56 -1.14 -0.54 0.00 0.00 175.26 175.74 2rgk s GLN 269 N 0.78 4.20 0.50 4.30 0.74 -1.26 -2.99 119.66 125.92 2rgk s GLN 269 Ca -0.08 2.08 -0.20 0.00 0.05 0.00 0.00 55.36 57.20 2rgk s GLN 269 Cb -0.16 -3.92 -0.08 0.00 1.10 0.00 0.00 33.01 29.96 2rgk s GLN 269 CO -0.01 -0.80 1.07 -1.25 -0.55 0.00 0.00 175.29 173.75 2rgk s PRO 270 N 3.83 3.66 0.30 1.67 0.04 -1.26 -4.97 135.00 138.27 2rgk s PRO 270 Ca 0.69 1.44 -0.29 0.00 0.04 0.00 0.00 61.00 62.88 2rgk s PRO 270 Cb -0.31 -2.07 -0.13 0.00 0.04 0.00 0.00 34.50 32.04 2rgk s PRO 270 CO 0.26 -0.56 1.34 -2.30 0.04 0.00 0.00 177.00 175.78 2rgk n PRO 271 N -1.07 2.11 -0.35 0.56 -0.02 -1.26 -4.87 135.00 130.10 2rgk n PRO 271 Ca 0.10 0.74 0.03 0.00 -2.02 0.00 0.00 63.50 62.35 2rgk n PRO 271 Cb 0.52 -2.36 0.19 0.00 -0.02 0.00 0.00 33.50 31.83 2rgk n PRO 271 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2rgk h ALA 272 N 3.24 1.43 -0.11 3.55 0.00 -2.03 -2.96 119.26 122.37 2rgk h ALA 272 Ca -0.46 -0.03 0.03 0.00 0.00 0.00 0.00 54.91 54.46 2rgk h ALA 272 Cb 1.28 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 18.76 2rgk h ALA 272 CO 0.68 0.44 0.13 0.11 0.00 0.00 0.00 179.25 180.60 2rgk h TRP 273 N 1.15 0.00 0.01 0.00 5.08 -1.98 -2.81 115.95 117.39 2rgk h TRP 273 Ca 0.41 0.00 0.03 0.00 1.08 0.00 0.00 58.89 60.41 2rgk h TRP 273 Cb 0.14 0.00 -0.03 0.00 -3.00 0.00 0.00 29.16 26.27 2rgk h TRP 273 CO -0.00 0.00 -0.18 -0.07 -1.28 0.00 0.00 178.44 176.91 2rgk h LEU 274 N 0.00 -0.52 -0.14 0.11 3.38 -1.89 0.11 115.31 116.36 2rgk h LEU 274 Ca 0.05 0.07 -0.07 0.00 0.09 0.00 0.00 57.88 58.03 2rgk h LEU 274 Cb 0.30 0.21 -0.00 0.00 0.09 0.00 0.00 40.66 41.27 2rgk h LEU 274 CO -0.00 -0.24 -0.18 0.25 0.09 0.00 0.00 178.44 178.36 2rgk h LEU 275 N -0.29 0.41 -0.51 1.67 5.85 -1.72 -2.30 115.31 118.43 2rgk h LEU 275 Ca 0.05 -0.51 0.09 0.00 0.84 0.00 0.00 57.88 58.35 2rgk h LEU 275 Cb 0.36 -0.12 -0.07 0.00 0.37 0.00 0.00 40.66 41.20 2rgk h LEU 275 CO -0.16 0.83 0.09 -0.33 -0.34 0.00 0.00 178.44 178.53 2rgk h GLU 276 N -0.01 0.21 -0.19 1.25 5.08 -1.36 -0.60 114.58 118.97 2rgk h GLU 276 Ca 0.02 -0.01 -0.15 0.00 -1.00 0.00 0.00 59.36 58.21 2rgk h GLU 276 Cb 0.73 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.93 2rgk h GLU 276 CO 0.04 0.14 -0.52 -0.44 -1.00 0.00 0.00 179.01 177.24 2rgk h ASP 277 N 0.22 0.58 -0.56 1.42 3.32 -0.80 -1.56 116.42 119.04 2rgk h ASP 277 Ca 0.25 -0.30 0.01 0.00 0.02 0.00 0.00 57.03 57.02 2rgk h ASP 277 Cb 0.35 -0.17 -0.03 0.00 0.22 0.00 0.00 39.33 39.70 2rgk h ASP 277 CO -0.34 1.00 0.36 0.00 -1.72 0.00 0.00 179.24 178.53 2rgk h ALA 278 N 1.02 0.72 -0.70 3.45 0.00 -0.80 0.21 119.26 123.16 2rgk h ALA 278 Ca 0.01 -0.03 -0.05 0.00 0.00 0.00 0.00 54.91 54.84 2rgk h ALA 278 Cb 1.05 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.60 2rgk h ALA 278 CO 0.10 0.12 0.24 0.87 0.00 0.00 0.00 179.25 180.57 2rgk h LYS 279 N 0.73 1.06 -0.39 0.00 1.57 -0.95 -1.82 116.57 116.76 2rgk h LYS 279 Ca 0.21 -0.21 -0.03 0.00 -1.87 0.00 0.00 60.65 58.76 2rgk h LYS 279 Cb -0.05 -0.16 -0.02 0.00 0.08 0.00 0.00 32.23 32.08 2rgk h LYS 279 CO -0.06 0.89 0.13 0.78 -0.57 0.00 0.00 179.45 180.62 2rgk h GLY 280 N 1.08 0.64 1.39 3.86 0.00 -0.19 -1.05 103.07 108.81 2rgk h GLY 280 Ca 0.23 -0.37 -0.06 0.00 0.00 0.00 0.00 47.33 47.13 2rgk h GLY 280 CO -0.01 0.35 0.08 1.41 0.00 0.00 0.00 176.54 178.37 2rgk h LEU 281 N 0.48 0.72 -0.22 3.11 3.38 -0.46 -1.71 115.31 120.61 2rgk h LEU 281 Ca 0.13 -0.14 -0.06 0.00 0.09 0.00 0.00 57.88 57.90 2rgk h LEU 281 Cb 0.24 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 2rgk h LEU 281 CO -0.01 0.74 -0.08 0.15 0.09 0.00 0.00 178.44 179.33 2rgk h PHE 282 N 0.73 0.50 -0.45 1.13 3.57 -1.13 -2.20 116.94 119.10 2rgk h PHE 282 Ca 0.16 -0.12 0.02 0.00 3.53 0.00 0.00 57.97 61.56 2rgk h PHE 282 Cb 0.33 -0.12 -0.03 0.00 2.79 0.00 0.00 35.95 38.93 2rgk h PHE 282 CO 0.02 0.71 0.26 -0.97 -2.23 0.00 0.00 178.31 176.10 2rgk h ASN 283 N 0.15 0.43 -0.63 0.41 -1.24 -0.91 -2.40 115.58 111.39 2rgk h ASN 283 Ca 0.05 0.00 -0.01 0.00 0.71 0.00 0.00 56.30 57.06 2rgk h ASN 283 Cb 0.56 -0.09 -0.03 0.00 0.73 0.00 0.00 38.32 39.50 2rgk h ASN 283 CO 0.03 0.31 0.36 0.00 -1.29 0.00 0.00 177.43 176.84 2rgk h ALA 284 N 1.20 0.81 -0.23 1.57 0.00 -1.30 0.42 119.26 121.72 2rgk h ALA 284 Ca 0.18 -0.09 0.04 0.00 0.00 0.00 0.00 54.91 55.04 2rgk h ALA 284 Cb 0.01 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.52 2rgk h ALA 284 CO -0.08 0.30 0.01 1.15 0.00 0.00 0.00 179.25 180.63 2rgk h THR 285 N 0.86 0.85 -0.09 0.00 2.02 -1.01 0.13 112.91 115.66 2rgk h THR 285 Ca 0.22 -0.03 -0.16 0.00 0.77 0.00 0.00 66.41 67.22 2rgk h THR 285 Cb 0.01 0.76 -0.01 0.00 -1.74 0.00 0.00 68.15 67.17 2rgk h THR 285 CO -0.04 0.02 -0.62 -0.37 0.37 0.00 0.00 175.52 174.87 2rgk h VAL 286 N 0.08 1.37 -0.56 3.16 -1.51 -1.26 -0.27 116.25 117.27 2rgk h VAL 286 Ca 0.11 -1.99 -0.07 0.00 -1.23 0.00 0.00 66.70 63.52 2rgk h VAL 286 Cb 0.13 1.99 -0.02 0.00 -2.13 0.00 0.00 31.29 31.26 2rgk h VAL 286 CO -0.17 0.60 0.08 -0.09 -1.23 0.00 0.00 177.57 176.75 2rgk h ARG 287 N 0.24 0.93 0.01 5.19 2.43 -0.36 -3.15 114.38 119.67 2rgk h ARG 287 Ca -0.01 -0.25 -0.40 0.00 -0.81 0.00 0.00 59.98 58.50 2rgk h ARG 287 Cb 1.15 -0.11 -0.07 0.00 -0.42 0.00 0.00 29.97 30.53 2rgk h ARG 287 CO 0.10 0.90 -2.46 -0.25 -1.51 0.00 0.00 179.97 176.75 2rgk n ASP 288 N -4.34 1.98 0.01 -3.80 8.00 0.39 -4.76 116.55 114.04 2rgk n ASP 288 Ca 0.02 -0.03 0.03 0.00 0.71 0.00 0.00 54.79 55.53 2rgk n ASP 288 Cb 0.27 -0.51 -0.10 0.00 -0.02 0.00 0.00 41.12 40.76 2rgk n ASP 288 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2rgk n ALA 289 N -3.44 2.20 -2.69 2.24 0.00 -0.12 -4.70 120.51 114.00 2rgk n ALA 289 Ca -0.47 -0.61 -0.42 0.00 0.00 0.00 0.00 53.44 51.94 2rgk n ALA 289 Cb 0.97 -0.81 -0.03 0.00 0.00 0.00 0.00 19.45 19.58 2rgk n ALA 289 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 177.50 177.04 2rgk s TRP 290 N -3.09 3.55 -0.71 0.00 -0.11 -1.14 -1.95 118.94 115.49 2rgk s TRP 290 Ca -0.05 1.58 -0.10 0.00 1.22 0.00 0.00 56.10 58.76 2rgk s TRP 290 Cb 0.10 -3.14 0.01 0.00 -1.50 0.00 0.00 33.47 28.94 2rgk s TRP 290 CO 0.84 -0.15 0.46 0.00 -4.62 0.00 0.00 176.95 173.47 2rgk n ALA 291 N 4.66 -2.28 0.62 5.86 0.00 0.04 -4.87 120.51 124.54 2rgk n ALA 291 Ca 0.07 -0.29 0.07 0.00 0.00 0.00 0.00 53.44 53.29 2rgk n ALA 291 Cb 0.49 -0.99 0.02 0.00 0.00 0.00 0.00 19.45 18.97 2rgk n ALA 291 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2rgk n PRO 292 N -2.77 1.58 -0.49 0.00 -0.04 -1.26 -4.67 135.00 127.35 2rgk n PRO 292 Ca -0.18 -0.93 0.06 0.00 -0.04 0.00 0.00 63.50 62.40 2rgk n PRO 292 Cb 0.47 -1.23 0.10 0.00 -0.04 0.00 0.00 33.50 32.80 2rgk n PRO 292 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 2rgk n ASP 293 N 0.14 1.41 0.00 3.54 5.68 -1.26 -4.97 116.55 121.08 2rgk n ASP 293 Ca 0.07 -2.82 0.00 0.00 -0.50 0.00 0.00 54.79 51.54 2rgk n ASP 293 Cb 0.32 -0.37 0.00 0.00 -1.14 0.00 0.00 41.12 39.93 2rgk n ASP 293 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2rgk n GLY 294 N -0.72 1.68 3.15 6.12 0.00 -1.26 -5.08 105.19 109.08 2rgk n GLY 294 Ca 0.11 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.03 2rgk n GLY 294 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2rgk s ALA 295 N -2.23 0.87 0.79 4.61 0.00 -1.26 -5.16 121.76 119.39 2rgk s ALA 295 Ca 0.00 -1.39 -0.11 0.00 0.00 0.00 0.00 51.96 50.45 2rgk s ALA 295 Cb 0.00 0.50 0.07 0.00 0.00 0.00 0.00 23.12 23.69 2rgk s ALA 295 CO 0.00 -0.37 1.09 -0.51 0.00 0.00 0.00 175.76 175.97 2rgk s ASP 296 N -3.03 4.50 0.00 0.00 1.01 -1.26 -4.08 116.67 113.81 2rgk s ASP 296 Ca 0.17 1.37 0.00 0.00 0.71 0.00 0.00 52.55 54.79 2rgk s ASP 296 Cb 0.07 -2.11 0.00 0.00 1.01 0.00 0.00 42.92 41.89 2rgk s ASP 296 CO -0.03 -1.97 0.00 0.61 0.21 0.00 0.00 175.17 173.99 2rgk n GLY 297 N -1.98 2.97 3.35 0.21 0.00 -1.26 -4.77 105.19 103.70 2rgk n GLY 297 Ca 0.07 -2.01 -0.37 0.00 0.00 0.00 0.00 46.02 43.72 2rgk n GLY 297 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2rgk s ILE 298 N -2.30 3.94 0.82 -0.61 1.09 -1.26 -0.78 121.20 122.10 2rgk s ILE 298 Ca 0.00 -0.62 -0.11 0.00 -1.10 0.00 0.00 60.65 58.82 2rgk s ILE 298 Cb 0.00 -2.99 0.09 0.00 -1.06 0.00 0.00 42.46 38.50 2rgk s ILE 298 CO 0.00 0.14 1.13 0.68 -0.10 0.00 0.00 174.94 176.79 2rgk s VAL 299 N 1.51 2.71 -0.06 2.92 -7.23 -0.82 -4.42 120.40 115.00 2rgk s VAL 299 Ca 0.03 0.24 -0.24 0.00 -1.81 0.00 0.00 61.98 60.21 2rgk s VAL 299 Cb -0.17 -2.54 -0.27 0.00 0.56 0.00 0.00 36.38 33.96 2rgk s VAL 299 CO 0.02 -0.29 0.92 0.22 -0.31 0.00 0.00 175.10 175.67 2rgk h TYR 300 N -1.31 0.36 -3.99 2.82 3.20 -1.15 -3.43 116.97 113.48 2rgk h TYR 300 Ca -0.44 -0.24 -0.40 0.00 3.14 0.00 0.00 58.73 60.80 2rgk h TYR 300 Cb 1.25 -0.02 -0.23 0.00 1.54 0.00 0.00 36.73 39.27 2rgk h TYR 300 CO 0.54 1.13 -0.78 0.99 -1.64 0.00 0.00 178.16 178.40 2rgk s THR 301 N -2.65 0.97 0.05 1.81 2.01 -0.83 -3.98 115.64 113.03 2rgk s THR 301 Ca -0.15 -1.06 0.01 0.00 0.31 0.00 0.00 61.69 60.80 2rgk s THR 301 Cb 0.00 -0.92 -0.03 0.00 0.01 0.00 0.00 72.50 71.57 2rgk s THR 301 CO 0.78 -0.13 -0.06 -0.69 -0.69 0.00 0.00 174.62 173.83 2rgk s VAL 302 N -1.03 0.46 0.71 3.82 1.01 -0.25 -0.57 120.40 124.55 2rgk s VAL 302 Ca -0.02 -1.34 0.01 0.00 0.00 0.00 0.00 61.98 60.64 2rgk s VAL 302 Cb -0.09 -0.91 0.13 0.00 0.00 0.00 0.00 36.38 35.51 2rgk s VAL 302 CO 0.01 -0.59 0.97 1.51 0.00 0.00 0.00 175.10 177.00 2rgk s ASP 303 N -2.07 4.40 0.00 3.32 1.47 0.11 -1.27 116.67 122.64 2rgk s ASP 303 Ca -0.04 -0.51 0.00 0.00 1.18 0.00 0.00 52.55 53.19 2rgk s ASP 303 Cb -0.04 0.15 0.00 0.00 -0.34 0.00 0.00 42.92 42.68 2rgk s ASP 303 CO -0.02 -1.83 0.46 0.79 0.68 0.00 0.00 175.17 175.24 2rgk n TRP 304 N -2.76 0.00 -0.18 2.11 5.03 -1.26 -0.41 117.44 119.97 2rgk n TRP 304 Ca 0.16 0.00 0.01 0.00 3.03 0.00 0.00 57.50 60.69 2rgk n TRP 304 Cb 0.61 -0.00 0.01 0.00 -1.03 0.00 0.00 31.31 30.90 2rgk n TRP 304 CO 0.00 0.00 0.00 0.39 -0.03 0.00 0.00 177.69 178.05 2rgk n GLU 305 N -0.50 2.56 -0.97 -0.99 1.02 -1.26 -4.97 120.64 115.53 2rgk n GLU 305 Ca 0.00 -1.44 0.00 0.00 -0.02 0.00 0.00 57.16 55.70 2rgk n GLU 305 Cb 0.00 -0.97 0.00 0.00 -0.02 0.00 0.00 31.44 30.45 2rgk n GLU 305 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2rgk n GLY 306 N -0.49 0.91 3.72 0.62 0.00 0.45 -5.01 105.19 105.40 2rgk n GLY 306 Ca 0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.61 2rgk n GLY 306 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2rgk s LYS 307 N -0.06 4.54 0.33 1.61 3.01 -1.25 -4.68 119.74 123.23 2rgk s LYS 307 Ca 0.00 1.65 -0.29 0.00 -1.01 0.00 0.00 55.97 56.32 2rgk s LYS 307 Cb 0.00 -3.34 -0.11 0.00 -1.01 0.00 0.00 37.83 33.37 2rgk s LYS 307 CO 0.00 -0.04 1.50 -2.14 0.51 0.00 0.00 175.35 175.18 2rgk s PRO 308 N 0.39 4.16 0.00 -1.68 0.02 -1.26 0.07 135.00 136.70 2rgk s PRO 308 Ca 0.53 2.50 0.00 0.00 0.02 0.00 0.00 61.00 64.05 2rgk s PRO 308 Cb -0.27 -3.02 0.00 0.00 0.02 0.00 0.00 34.50 31.23 2rgk s PRO 308 CO 0.31 -0.52 0.00 0.28 -0.33 0.00 0.00 177.00 176.75 2rgk n VAL 309 N 1.34 0.00 -2.89 3.83 0.31 0.26 -4.81 118.33 116.37 2rgk n VAL 309 Ca 0.04 0.13 -0.43 0.00 -0.01 0.00 0.00 64.34 64.07 2rgk n VAL 309 Cb 0.39 -1.01 -0.05 0.00 -0.91 0.00 0.00 33.84 32.26 2rgk n VAL 309 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 2rgk s VAL 310 N -0.55 4.54 -1.36 2.52 1.01 -1.15 -4.92 120.40 120.49 2rgk s VAL 310 Ca 0.00 0.49 0.28 0.00 0.00 0.00 0.00 61.98 62.75 2rgk s VAL 310 Cb 0.00 -4.40 0.30 0.00 0.00 0.00 0.00 36.38 32.27 2rgk s VAL 310 CO 0.00 -0.84 1.76 0.54 0.00 0.00 0.00 175.10 176.56 2rgk n ARG 311 N 7.00 0.39 -1.87 2.72 1.74 -1.26 -1.97 116.66 123.41 2rgk n ARG 311 Ca 0.03 -0.14 -0.39 0.00 -0.77 0.00 0.00 57.85 56.58 2rgk n ARG 311 Cb 0.48 -1.50 0.02 0.00 -1.02 0.00 0.00 32.46 30.44 2rgk n ARG 311 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 2rgk s GLU 312 N -2.71 3.53 -0.65 5.56 8.01 -1.26 -4.26 118.70 126.91 2rgk s GLU 312 Ca 0.21 2.26 -0.18 0.00 0.01 0.00 0.00 54.97 57.27 2rgk s GLU 312 Cb 0.19 -2.50 0.12 0.00 -4.31 0.00 0.00 34.13 27.63 2rgk s GLU 312 CO 0.54 -0.89 0.75 1.03 0.01 0.00 0.00 175.26 176.70 2rgk s ARG 313 N -2.61 3.16 0.58 1.61 3.00 -0.15 -2.47 118.95 122.07 2rgk s ARG 313 Ca 0.65 -1.52 -0.14 0.00 0.00 0.00 0.00 55.73 54.72 2rgk s ARG 313 Cb -0.40 -4.36 -0.05 0.00 0.00 0.00 0.00 34.95 30.14 2rgk s ARG 313 CO 0.50 -1.53 1.02 0.08 0.00 0.00 0.00 175.30 175.37 2rgk s VAL 314 N 2.35 4.39 -0.00 3.52 1.01 -1.26 -1.05 120.40 129.35 2rgk s VAL 314 Ca 0.14 0.99 -0.24 0.00 0.00 0.00 0.00 61.98 62.87 2rgk s VAL 314 Cb -0.21 -3.66 -0.15 0.00 0.00 0.00 0.00 36.38 32.36 2rgk s VAL 314 CO 0.03 -0.81 1.08 -0.09 0.00 0.00 0.00 175.10 175.31 2rgk h ARG 315 N 0.28 -0.59 -0.88 2.72 2.43 -0.74 -3.36 114.38 114.25 2rgk h ARG 315 Ca -0.46 0.04 0.14 0.00 -0.81 0.00 0.00 59.98 58.89 2rgk h ARG 315 Cb 1.20 0.13 -0.07 0.00 -0.42 0.00 0.00 29.97 30.81 2rgk h ARG 315 CO 0.60 -0.28 0.57 0.11 -1.51 0.00 0.00 179.97 179.46 2rgk h TRP 316 N -0.99 0.80 -0.36 2.20 5.08 -1.93 -2.90 115.95 117.85 2rgk h TRP 316 Ca -0.06 0.02 0.07 0.00 1.08 0.00 0.00 58.89 60.00 2rgk h TRP 316 Cb 0.57 -0.25 -0.06 0.00 -3.00 0.00 0.00 29.16 26.42 2rgk h TRP 316 CO 0.02 0.31 -0.03 -1.35 -1.28 0.00 0.00 178.44 176.10 2rgk h PRO 317 N 0.69 0.06 -0.04 0.12 0.11 -1.92 0.80 132.00 131.83 2rgk h PRO 317 Ca 0.44 -0.00 -0.14 0.00 0.11 0.00 0.00 66.00 66.41 2rgk h PRO 317 Cb 0.70 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 31.78 2rgk h PRO 317 CO -0.20 0.04 -0.60 0.97 -0.21 0.00 0.00 178.00 178.01 2rgk h ILE 318 N 0.06 1.40 -0.64 4.15 2.10 -1.72 -1.78 117.51 121.08 2rgk h ILE 318 Ca 0.17 -2.00 -0.06 0.00 1.08 0.00 0.00 64.86 64.06 2rgk h ILE 318 Cb 0.25 2.04 -0.03 0.00 -1.09 0.00 0.00 36.82 37.99 2rgk h ILE 318 CO -0.32 0.58 0.17 0.58 -1.08 0.00 0.00 178.15 178.08 2rgk h VAL 319 N 0.10 1.25 -0.24 2.19 2.07 -1.19 -2.14 116.25 118.28 2rgk h VAL 319 Ca -0.01 -0.90 -0.13 0.00 0.82 0.00 0.00 66.70 66.49 2rgk h VAL 319 Cb 1.08 0.62 -0.01 0.00 -1.52 0.00 0.00 31.29 31.46 2rgk h VAL 319 CO 0.09 0.34 -0.37 -0.33 0.02 0.00 0.00 177.57 177.31 2rgk h GLU 320 N 0.93 0.54 -0.96 1.57 4.39 -0.71 -2.71 114.58 117.63 2rgk h GLU 320 Ca 0.20 -0.26 0.07 0.00 0.34 0.00 0.00 59.36 59.71 2rgk h GLU 320 Cb 0.34 -0.00 -0.07 0.00 -0.10 0.00 0.00 28.75 28.91 2rgk h GLU 320 CO -0.00 0.83 0.61 0.00 -1.16 0.00 0.00 179.01 179.29 2rgk h ALA 321 N 1.14 1.34 -0.55 3.43 0.00 -0.88 0.06 119.26 123.81 2rgk h ALA 321 Ca 0.04 -0.01 -0.11 0.00 0.00 0.00 0.00 54.91 54.84 2rgk h ALA 321 Cb 0.86 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.36 2rgk h ALA 321 CO 0.07 0.36 -0.07 0.52 0.00 0.00 0.00 179.25 180.13 2rgk h MET 322 N 1.09 1.02 -0.80 0.00 2.86 -1.13 0.07 114.93 118.04 2rgk h MET 322 Ca 0.42 -0.36 -0.05 0.00 -2.06 0.00 0.00 59.70 57.66 2rgk h MET 322 Cb 0.21 -0.07 -0.04 0.00 0.06 0.00 0.00 31.60 31.76 2rgk h MET 322 CO -0.19 1.05 0.32 0.78 1.06 0.00 0.00 176.91 179.93 2rgk h GLY 323 N 0.90 1.28 1.63 8.32 0.00 -0.94 -2.17 103.07 112.08 2rgk h GLY 323 Ca 0.15 -0.70 -0.18 0.00 0.00 0.00 0.00 47.33 46.60 2rgk h GLY 323 CO 0.04 0.66 -0.73 -0.84 0.00 0.00 0.00 176.54 175.67 2rgk h THR 324 N 1.16 1.39 -0.81 4.70 2.02 -0.87 -1.67 112.91 118.83 2rgk h THR 324 Ca 0.27 -2.16 0.04 0.00 0.77 0.00 0.00 66.41 65.32 2rgk h THR 324 Cb 0.22 2.13 -0.05 0.00 -1.74 0.00 0.00 68.15 68.71 2rgk h THR 324 CO -0.02 0.65 0.51 0.00 0.37 0.00 0.00 175.52 177.02 2rgk h ALA 325 N 0.97 1.07 -0.24 6.16 0.00 -0.68 0.25 119.26 126.79 2rgk h ALA 325 Ca -0.03 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.83 2rgk h ALA 325 Cb 1.30 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.82 2rgk h ALA 325 CO 0.12 0.31 0.06 -0.92 0.00 0.00 0.00 179.25 178.82 2rgk h TYR 326 N 0.98 0.40 0.04 0.00 3.20 -1.23 -0.31 116.97 120.04 2rgk h TYR 326 Ca 0.33 -0.05 0.02 0.00 3.14 0.00 0.00 58.73 62.17 2rgk h TYR 326 Cb 0.05 -0.11 -0.03 0.00 1.54 0.00 0.00 36.73 38.18 2rgk h TYR 326 CO -0.03 0.47 -0.16 0.00 -1.64 0.00 0.00 178.16 176.79 2rgk h ALA 327 N 0.88 -0.23 -0.30 1.82 0.00 -0.53 0.89 119.26 121.79 2rgk h ALA 327 Ca 0.08 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 2rgk h ALA 327 Cb 0.27 0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.32 2rgk h ALA 327 CO 0.00 -0.67 0.16 -0.07 0.00 0.00 0.00 179.25 178.67 2rgk h LEU 328 N -0.29 0.36 -0.24 0.00 3.38 -0.48 -2.12 115.31 115.92 2rgk h LEU 328 Ca 0.04 -0.02 -0.09 0.00 0.09 0.00 0.00 57.88 57.90 2rgk h LEU 328 Cb 0.34 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 40.99 2rgk h LEU 328 CO -0.13 0.30 -0.19 0.22 0.09 0.00 0.00 178.44 178.73 2rgk h TYR 329 N 0.41 0.65 -0.28 1.13 3.20 -0.16 -0.17 116.97 121.75 2rgk h TYR 329 Ca 0.11 -0.18 -0.00 0.00 3.14 0.00 0.00 58.73 61.79 2rgk h TYR 329 Cb 0.03 -0.14 -0.01 0.00 1.54 0.00 0.00 36.73 38.14 2rgk h TYR 329 CO 0.00 0.86 0.16 1.15 -1.64 0.00 0.00 178.16 178.69 2rgk h THR 330 N 0.26 1.08 0.03 1.81 2.02 -0.33 0.23 112.91 118.01 2rgk h THR 330 Ca 0.05 -0.19 -0.19 0.00 0.77 0.00 0.00 66.41 66.84 2rgk h THR 330 Cb 0.72 0.69 -0.02 0.00 -1.74 0.00 0.00 68.15 67.81 2rgk h THR 330 CO 0.05 0.09 -1.00 0.58 0.37 0.00 0.00 175.52 175.61 2rgk h VAL 331 N 0.38 1.15 0.00 3.16 2.07 -1.33 -3.41 116.25 118.28 2rgk h VAL 331 Ca 0.10 -2.27 -0.13 0.00 0.82 0.00 0.00 66.70 65.22 2rgk h VAL 331 Cb -0.01 2.62 -0.02 0.00 -1.52 0.00 0.00 31.29 32.36 2rgk h VAL 331 CO -0.02 0.48 -1.27 0.71 0.02 0.00 0.00 177.57 177.49 2rgk h THR 332 N -0.83 0.41 0.00 2.57 1.35 -1.01 -3.48 112.91 111.92 2rgk h THR 332 Ca -0.26 -1.79 0.00 0.00 -0.55 0.00 0.00 66.41 63.81 2rgk h THR 332 Cb 1.34 1.94 0.00 0.00 -1.73 0.00 0.00 68.15 69.70 2rgk h THR 332 CO -0.09 0.23 0.00 0.61 -0.25 0.00 0.00 175.52 176.02 2rgk n GLY 333 N 1.34 2.01 3.62 5.82 0.00 0.79 -4.96 105.19 113.82 2rgk n GLY 333 Ca -0.07 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.52 2rgk n GLY 333 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2rgk s ASP 334 N -3.48 6.16 0.57 1.61 -1.08 -1.26 -4.87 116.67 114.33 2rgk s ASP 334 Ca 0.00 1.66 0.38 0.00 -0.52 0.00 0.00 52.55 54.07 2rgk s ASP 334 Cb 0.00 -2.53 2.09 0.00 -1.46 0.00 0.00 42.92 41.02 2rgk s ASP 334 CO 0.00 -1.43 2.18 0.03 0.52 0.00 0.00 175.17 176.46 2rgk h ARG 335 N 11.74 0.00 -0.64 4.34 3.08 -1.94 -2.34 114.38 128.63 2rgk h ARG 335 Ca -0.36 0.00 0.05 0.00 0.07 0.00 0.00 59.98 59.74 2rgk h ARG 335 Cb 1.17 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 31.19 2rgk h ARG 335 CO 1.00 0.00 0.42 1.96 -1.07 0.00 0.00 179.97 182.28 2rgk h GLN 336 N 0.00 0.66 -0.30 0.04 4.20 -2.00 -0.47 115.11 117.25 2rgk h GLN 336 Ca 0.00 -0.04 -0.08 0.00 0.06 0.00 0.00 58.65 58.59 2rgk h GLN 336 Cb 0.00 -0.15 -0.02 0.00 0.30 0.00 0.00 27.48 27.62 2rgk h GLN 336 CO 0.00 0.44 -0.15 1.88 -0.67 0.00 0.00 178.83 180.33 2rgk h TYR 337 N 0.68 0.56 -0.22 2.96 0.99 -1.74 -1.86 116.97 118.35 2rgk h TYR 337 Ca 0.27 -0.09 -0.15 0.00 2.00 0.00 0.00 58.73 60.75 2rgk h TYR 337 Cb 0.19 -0.15 -0.01 0.00 1.00 0.00 0.00 36.73 37.76 2rgk h TYR 337 CO -0.00 0.64 -0.48 1.49 -0.00 0.00 0.00 178.16 179.81 2rgk h GLU 338 N 0.47 0.59 -0.60 4.88 4.81 -1.29 -1.14 114.58 122.31 2rgk h GLU 338 Ca 0.08 -0.34 -0.01 0.00 -0.13 0.00 0.00 59.36 58.97 2rgk h GLU 338 Cb 0.53 0.03 -0.03 0.00 0.63 0.00 0.00 28.75 29.91 2rgk h GLU 338 CO 0.03 0.94 0.35 1.15 -0.73 0.00 0.00 179.01 180.75 2rgk h THR 339 N 0.47 1.18 -0.33 0.32 2.02 -0.71 0.37 112.91 116.22 2rgk h THR 339 Ca 0.02 -0.43 -0.02 0.00 0.77 0.00 0.00 66.41 66.75 2rgk h THR 339 Cb 1.02 0.38 -0.01 0.00 -1.74 0.00 0.00 68.15 67.79 2rgk h THR 339 CO 0.09 0.19 0.13 -0.50 0.37 0.00 0.00 175.52 175.81 2rgk h TRP 340 N 0.81 0.51 -0.63 3.16 4.06 -1.18 0.51 115.95 123.20 2rgk h TRP 340 Ca 0.21 -0.04 0.11 0.00 2.06 0.00 0.00 58.89 61.24 2rgk h TRP 340 Cb 0.00 -0.15 -0.08 0.00 -1.00 0.00 0.00 29.16 27.93 2rgk h TRP 340 CO -0.02 0.48 0.20 -0.92 -3.56 0.00 0.00 178.44 174.62 2rgk h TYR 341 N 0.39 0.33 -0.15 0.49 3.20 -0.76 0.20 116.97 120.68 2rgk h TYR 341 Ca 0.11 0.03 -0.03 0.00 3.14 0.00 0.00 58.73 61.99 2rgk h TYR 341 Cb 0.19 -0.05 -0.01 0.00 1.54 0.00 0.00 36.73 38.40 2rgk h TYR 341 CO -0.00 0.03 -0.02 1.96 -1.64 0.00 0.00 178.16 178.49 2rgk h GLN 342 N 0.35 0.28 -0.08 1.82 4.20 -0.40 -0.54 115.11 120.73 2rgk h GLN 342 Ca 0.33 -0.10 -0.00 0.00 0.06 0.00 0.00 58.65 58.94 2rgk h GLN 342 Cb 0.46 -0.02 -0.00 0.00 0.30 0.00 0.00 27.48 28.22 2rgk h GLN 342 CO -0.37 0.53 0.04 0.00 -0.67 0.00 0.00 178.83 178.37 2rgk h THR 343 N -0.00 1.03 0.06 -0.54 1.03 -0.35 -0.40 112.91 113.73 2rgk h THR 343 Ca 0.04 -0.08 -0.25 0.00 -0.01 0.00 0.00 66.41 66.11 2rgk h THR 343 Cb 0.42 0.92 0.01 0.00 -1.07 0.00 0.00 68.15 68.43 2rgk h THR 343 CO 0.01 0.03 -1.08 -0.50 -0.01 0.00 0.00 175.52 173.98 2rgk h TRP 344 N 0.11 0.63 -0.55 0.00 6.55 -0.73 -2.30 115.95 119.66 2rgk h TRP 344 Ca 0.03 -0.38 -0.04 0.00 0.95 0.00 0.00 58.89 59.44 2rgk h TRP 344 Cb 0.01 -0.05 -0.03 0.00 -0.86 0.00 0.00 29.16 28.23 2rgk h TRP 344 CO 0.00 1.24 0.16 -1.49 -1.05 0.00 0.00 178.44 177.30 2rgk h TRP 345 N 0.19 0.84 -0.60 0.49 -0.00 -0.17 -0.14 115.95 116.55 2rgk h TRP 345 Ca -0.11 -0.07 -0.05 0.00 -0.00 0.00 0.00 58.89 58.66 2rgk h TRP 345 Cb 1.75 -0.25 -0.03 0.00 -0.00 0.00 0.00 29.16 30.63 2rgk h TRP 345 CO 0.07 0.69 0.18 0.93 -0.00 0.00 0.00 178.44 180.31 2rgk h GLU 346 N 0.80 0.93 -0.32 0.49 4.39 -1.01 -2.22 114.58 117.63 2rgk h GLU 346 Ca 0.18 -0.20 -0.01 0.00 0.34 0.00 0.00 59.36 59.67 2rgk h GLU 346 Cb 0.25 -0.13 -0.02 0.00 -0.10 0.00 0.00 28.75 28.75 2rgk h GLU 346 CO -0.01 0.83 0.17 -0.92 -1.16 0.00 0.00 179.01 177.93 2rgk h TYR 347 N 0.85 0.45 0.35 4.33 3.20 -0.84 -2.92 116.97 122.39 2rgk h TYR 347 Ca 0.19 -0.01 -0.01 0.00 3.14 0.00 0.00 58.73 62.03 2rgk h TYR 347 Cb 0.30 -0.14 -0.00 0.00 1.54 0.00 0.00 36.73 38.42 2rgk h TYR 347 CO 0.02 0.37 -0.20 0.00 -1.64 0.00 0.00 178.16 176.71 2rgk h ILE 349 N -0.52 0.76 0.05 0.00 2.10 -1.48 0.29 117.51 118.71 2rgk h ILE 349 Ca -0.04 -0.51 -0.25 0.00 1.08 0.00 0.00 64.86 65.13 2rgk h ILE 349 Cb 0.42 1.31 0.01 0.00 -1.09 0.00 0.00 36.82 37.46 2rgk h ILE 349 CO 0.06 0.13 -1.07 0.50 -1.08 0.00 0.00 178.15 176.69 2rgk h LYS 350 N 0.00 0.41 0.00 2.19 3.64 -1.27 -3.40 116.57 118.14 2rgk h LYS 350 Ca -0.00 -0.52 0.00 0.00 -1.27 0.00 0.00 60.65 58.86 2rgk h LYS 350 Cb 0.30 0.16 0.00 0.00 -0.41 0.00 0.00 32.23 32.28 2rgk h LYS 350 CO 0.02 1.18 -0.81 0.66 -2.27 0.00 0.00 179.45 178.22 2rgk n TYR 351 N -3.70 0.00 -0.09 1.91 4.02 -0.35 -4.92 117.16 114.03 2rgk n TYR 351 Ca -0.08 0.00 -0.12 0.00 -0.01 0.00 0.00 57.90 57.69 2rgk n TYR 351 Cb 0.91 0.00 -0.10 0.00 -0.02 0.00 0.00 39.34 40.13 2rgk n TYR 351 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 176.86 177.13 2rgk n LEU 352 N -1.32 2.14 -4.73 7.72 4.77 0.91 -4.86 117.00 121.63 2rgk n LEU 352 Ca 0.00 -0.08 -0.42 0.00 -0.03 0.00 0.00 56.01 55.49 2rgk n LEU 352 Cb 0.08 -0.39 -0.03 0.00 -2.33 0.00 0.00 43.42 40.75 2rgk n LEU 352 CO 0.00 0.71 1.04 -0.04 -1.33 0.00 0.00 177.39 177.76 2rgk s MET 353 N -2.39 4.34 -0.62 3.23 -1.94 -0.52 0.27 119.30 121.67 2rgk s MET 353 Ca -0.21 2.10 0.04 0.00 -1.71 0.00 0.00 55.69 55.91 2rgk s MET 353 Cb 0.06 -3.21 0.15 0.00 2.01 0.00 0.00 34.83 33.85 2rgk s MET 353 CO 0.51 -0.36 0.39 0.34 -0.01 0.00 0.00 175.02 175.89 2rgk s ASP 354 N 0.68 4.55 0.43 3.03 2.15 0.06 -4.85 116.67 122.72 2rgk s ASP 354 Ca 0.61 -3.47 0.23 0.00 0.43 0.00 0.00 52.55 50.34 2rgk s ASP 354 Cb -0.37 -1.61 0.92 0.00 -0.30 0.00 0.00 42.92 41.56 2rgk s ASP 354 CO 0.35 -0.15 1.84 1.88 -0.17 0.00 0.00 175.17 178.92 2rgk h TYR 355 N 5.89 0.00 0.38 -5.34 0.05 -1.89 0.14 116.97 116.21 2rgk h TYR 355 Ca 0.05 0.00 -0.02 0.00 0.05 0.00 0.00 58.73 58.81 2rgk h TYR 355 Cb 0.82 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.56 2rgk h TYR 355 CO 0.61 0.26 -0.18 1.49 -1.05 0.00 0.00 178.16 179.28 2rgk h GLU 356 N 0.00 -0.49 -0.02 4.88 4.57 -1.93 -3.35 114.58 118.24 2rgk h GLU 356 Ca -0.00 0.03 0.00 0.00 -1.18 0.00 0.00 59.36 58.21 2rgk h GLU 356 Cb 0.72 0.11 0.00 0.00 -0.16 0.00 0.00 28.75 29.43 2rgk h GLU 356 CO 0.03 -0.20 -0.20 0.09 -1.18 0.00 0.00 179.01 177.55 2rgk n ASN 357 N -5.21 1.94 0.00 1.04 3.02 -1.23 -5.09 115.26 109.73 2rgk n ASN 357 Ca -0.10 -1.47 0.00 0.00 -0.03 0.00 0.00 54.58 52.98 2rgk n ASN 357 Cb 0.27 0.28 0.00 0.00 -0.61 0.00 0.00 39.78 39.73 2rgk n ASN 357 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2rgk n GLY 358 N 1.07 2.31 7.00 7.41 0.00 0.49 -4.44 105.19 119.03 2rgk n GLY 358 Ca 0.08 -1.60 0.00 0.00 0.00 0.00 0.00 46.02 44.50 2rgk n GLY 358 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2rgk n SER 359 N 0.00 0.00 -4.40 1.61 2.88 -1.22 -4.66 113.62 107.82 2rgk n SER 359 Ca 0.00 0.00 -0.23 0.00 -1.33 0.00 0.00 58.87 57.31 2rgk n SER 359 Cb 0.00 0.00 -0.11 0.00 -0.75 0.00 0.00 64.21 63.35 2rgk n SER 359 CO 0.00 0.00 0.00 0.26 -1.23 0.00 0.00 175.04 174.07 2rgk s TRP 360 N 0.00 2.07 0.75 0.66 0.52 -1.26 -0.76 118.94 120.92 2rgk s TRP 360 Ca 0.00 -0.41 -0.11 0.00 0.02 0.00 0.00 56.10 55.60 2rgk s TRP 360 Cb 0.00 -0.97 0.04 0.00 -1.15 0.00 0.00 33.47 31.39 2rgk s TRP 360 CO 0.00 0.50 1.08 -1.58 0.02 0.00 0.00 176.95 176.97 2rgk s TRP 361 N -2.24 2.78 -0.20 -1.98 0.52 0.14 -4.84 118.94 113.11 2rgk s TRP 361 Ca 0.22 1.49 -0.14 0.00 0.02 0.00 0.00 56.10 57.69 2rgk s TRP 361 Cb -0.05 -2.99 -0.20 0.00 -1.15 0.00 0.00 33.47 29.08 2rgk s TRP 361 CO 0.10 -1.60 0.11 0.94 0.02 0.00 0.00 176.95 176.52 2rgk n GLN 362 N -3.38 0.63 -3.92 4.98 -0.06 -1.26 -4.67 117.38 109.69 2rgk n GLN 362 Ca 0.08 0.40 -0.10 0.00 -2.00 0.00 0.00 57.00 55.38 2rgk n GLN 362 Cb 0.53 -1.67 -0.11 0.00 -4.06 0.00 0.00 30.24 24.93 2rgk n GLN 362 CO 0.00 0.00 0.00 -2.00 -0.20 0.00 0.00 177.06 174.86 2rgk s GLU 363 N -2.46 0.35 0.14 3.69 2.12 -1.26 -0.06 118.70 121.23 2rgk s GLU 363 Ca -0.29 -0.46 0.06 0.00 0.36 0.00 0.00 54.97 54.64 2rgk s GLU 363 Cb 0.08 0.14 -0.04 0.00 0.26 0.00 0.00 34.13 34.57 2rgk s GLU 363 CO 0.62 -0.07 -0.13 -0.51 -0.54 0.00 0.00 175.26 174.63 2rgk s LEU 364 N -1.27 2.47 0.00 2.70 1.43 -0.22 -3.10 118.68 120.68 2rgk s LEU 364 Ca -0.14 -0.90 -0.11 0.00 -1.03 0.00 0.00 54.13 51.94 2rgk s LEU 364 Cb -0.08 -0.51 0.16 0.00 0.03 0.00 0.00 46.19 45.79 2rgk s LEU 364 CO 0.00 -0.20 0.87 -0.90 0.23 0.00 0.00 176.35 176.35 2rgk n ASP 365 N 0.17 -0.15 0.00 2.29 3.85 0.10 -0.98 116.55 121.83 2rgk n ASP 365 Ca -0.13 -1.28 0.04 0.00 -0.71 0.00 0.00 54.79 52.71 2rgk n ASP 365 Cb 0.59 -0.68 0.17 0.00 -1.35 0.00 0.00 41.12 39.84 2rgk n ASP 365 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 2rgk n ALA 366 N -3.66 1.37 -0.31 2.12 0.00 -1.26 -0.96 120.51 117.81 2rgk n ALA 366 Ca -0.14 -0.03 0.09 0.00 0.00 0.00 0.00 53.44 53.35 2rgk n ALA 366 Cb 0.39 -1.12 0.24 0.00 0.00 0.00 0.00 19.45 18.96 2rgk n ALA 366 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2rgk n ASP 367 N -1.47 3.52 -1.89 0.00 8.00 -1.26 -4.77 116.55 118.67 2rgk n ASP 367 Ca 0.02 -2.06 -0.15 0.00 0.71 0.00 0.00 54.79 53.31 2rgk n ASP 367 Cb 0.09 -0.37 0.01 0.00 -0.02 0.00 0.00 41.12 40.82 2rgk n ASP 367 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 2rgk n ASN 368 N 1.02 -4.60 -4.84 -2.24 3.02 -0.14 -5.02 115.26 102.47 2rgk n ASN 368 Ca 0.18 -0.09 -0.34 0.00 -0.03 0.00 0.00 54.58 54.30 2rgk n ASN 368 Cb 0.55 -3.63 -0.06 0.00 -0.61 0.00 0.00 39.78 36.03 2rgk n ASN 368 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 2rgk s LYS 369 N -4.99 3.27 0.30 3.52 1.02 -1.26 -4.82 119.74 116.79 2rgk s LYS 369 Ca 0.09 -0.34 -0.30 0.00 0.02 0.00 0.00 55.97 55.44 2rgk s LYS 369 Cb -0.04 -3.01 -0.11 0.00 -0.52 0.00 0.00 37.83 34.15 2rgk s LYS 369 CO 0.11 0.69 1.54 0.08 -0.92 0.00 0.00 175.35 176.85 2rgk s VAL 370 N -1.17 2.18 0.40 3.17 1.01 -1.26 -0.72 120.40 123.99 2rgk s VAL 370 Ca 0.22 0.15 0.06 0.00 0.00 0.00 0.00 61.98 62.41 2rgk s VAL 370 Cb -0.12 -3.10 -0.07 0.00 0.00 0.00 0.00 36.38 33.09 2rgk s VAL 370 CO 0.12 0.03 0.02 -0.89 0.00 0.00 0.00 175.10 174.38 2rgk s THR 371 N -0.28 1.70 -0.25 3.92 2.01 -1.18 -4.84 115.64 116.72 2rgk s THR 371 Ca 0.60 -2.00 -0.26 0.00 0.31 0.00 0.00 61.69 60.34 2rgk s THR 371 Cb -0.46 -2.87 0.09 0.00 0.01 0.00 0.00 72.50 69.27 2rgk s THR 371 CO 0.51 0.00 0.85 -0.89 -0.69 0.00 0.00 174.62 174.40 2rgk s THR 372 N -2.88 0.00 0.00 -0.82 2.01 -1.26 -4.82 115.64 107.87 2rgk s THR 372 Ca 0.33 0.00 0.00 0.00 0.31 0.00 0.00 61.69 62.33 2rgk s THR 372 Cb 0.09 -1.00 0.00 0.00 0.01 0.00 0.00 72.50 71.60 2rgk s THR 372 CO 0.16 0.00 0.00 0.61 -0.69 0.00 0.00 174.62 174.70 2rgk n GLY 377 N 2.27 2.15 2.56 4.40 0.00 -1.26 -5.17 105.19 110.14 2rgk n GLY 377 Ca -0.14 -0.19 -0.16 0.00 0.00 0.00 0.00 46.02 45.53 2rgk n GLY 377 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2rgk n LYS 378 N 0.00 1.81 0.00 1.61 5.02 -0.21 -4.33 118.16 122.07 2rgk n LYS 378 Ca 0.00 -3.69 0.02 0.00 -2.02 0.00 0.00 58.31 52.62 2rgk n LYS 378 Cb 0.00 -1.63 0.08 0.00 -0.02 0.00 0.00 35.03 33.46 2rgk n LYS 378 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2rgk n GLN 379 N -0.12 0.05 -4.06 1.97 0.00 -1.05 -4.52 117.38 109.65 2rgk n GLN 379 Ca 0.20 0.25 -0.12 0.00 0.00 0.00 0.00 57.00 57.33 2rgk n GLN 379 Cb 0.72 -1.50 -0.11 0.00 0.00 0.00 0.00 30.24 29.35 2rgk n GLN 379 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.06 177.40 2rgk s ASP 380 N -2.55 0.78 0.00 2.61 2.15 -1.26 -4.72 116.67 113.68 2rgk s ASP 380 Ca 0.03 -0.57 0.00 0.00 0.43 0.00 0.00 52.55 52.44 2rgk s ASP 380 Cb 0.02 0.05 0.00 0.00 -0.30 0.00 0.00 42.92 42.69 2rgk s ASP 380 CO 0.05 -0.23 0.00 2.30 -0.17 0.00 0.00 175.17 177.12 2rgk n ILE 381 N 1.40 0.00 -0.13 4.11 -5.35 -1.26 -4.88 119.36 113.24 2rgk n ILE 381 Ca -0.22 0.00 -0.04 0.00 -0.27 0.00 0.00 62.75 62.22 2rgk n ILE 381 Cb 0.55 0.91 0.04 0.00 -1.74 0.00 0.00 39.64 39.40 2rgk n ILE 381 CO 0.00 0.00 0.00 0.22 -1.76 0.00 0.00 176.55 175.01 2rgk h TYR 382 N 0.00 -0.00 -0.94 4.28 3.20 -1.93 -2.19 116.97 119.39 2rgk h TYR 382 Ca 0.00 0.03 0.08 0.00 3.14 0.00 0.00 58.73 61.98 2rgk h TYR 382 Cb 0.00 0.07 -0.07 0.00 1.54 0.00 0.00 36.73 38.27 2rgk h TYR 382 CO 0.00 -0.08 0.59 0.45 -1.64 0.00 0.00 178.16 177.48 2rgk h HIS 383 N 0.12 1.09 -0.87 -3.82 3.86 -1.99 -2.84 115.15 110.70 2rgk h HIS 383 Ca 0.22 0.03 0.17 0.00 -1.16 0.00 0.00 60.37 59.63 2rgk h HIS 383 Cb 0.31 -0.35 -0.07 0.00 1.06 0.00 0.00 27.41 28.36 2rgk h HIS 383 CO -0.28 0.52 0.57 -0.07 0.86 0.00 0.00 177.93 179.54 2rgk h LEU 384 N 1.04 0.50 -2.51 2.43 3.38 -1.76 -0.68 115.31 117.71 2rgk h LEU 384 Ca 0.42 0.04 0.01 0.00 0.09 0.00 0.00 57.88 58.45 2rgk h LEU 384 Cb 0.25 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 40.94 2rgk h LEU 384 CO -0.20 0.23 0.12 -0.07 0.09 0.00 0.00 178.44 178.62 2rgk h LEU 385 N 0.52 0.00 -1.09 1.67 3.38 -1.55 -0.64 115.31 117.60 2rgk h LEU 385 Ca 0.44 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.41 2rgk h LEU 385 Cb 0.93 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.68 2rgk h LEU 385 CO -0.18 0.00 0.00 0.45 0.09 0.00 0.00 178.44 178.80 2rgk h HIS 386 N 0.00 0.00 -0.00 1.13 3.86 -1.30 0.13 115.15 118.97 2rgk h HIS 386 Ca 0.02 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.23 2rgk h HIS 386 Cb 0.27 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.74 2rgk h HIS 386 CO 0.00 0.00 -0.26 0.00 0.86 0.00 0.00 177.93 178.53 2rgk n LEU 388 N -1.07 2.09 -0.11 0.00 4.77 -0.70 -4.67 117.00 117.32 2rgk n LEU 388 Ca 0.01 -0.07 -0.19 0.00 -0.03 0.00 0.00 56.01 55.73 2rgk n LEU 388 Cb 0.09 -0.37 -0.09 0.00 -2.33 0.00 0.00 43.42 40.72 2rgk n LEU 388 CO 0.11 0.69 -1.23 0.52 -1.33 0.00 0.00 177.39 176.16 2rgk n VAL 389 N -2.92 1.23 -0.31 4.08 0.31 0.38 -4.62 118.33 116.48 2rgk n VAL 389 Ca -0.32 -0.41 0.11 0.00 -0.01 0.00 0.00 64.34 63.71 2rgk n VAL 389 Cb 0.90 -1.47 0.28 0.00 -0.91 0.00 0.00 33.84 32.64 2rgk n VAL 389 CO 0.00 0.00 0.00 0.40 -1.32 0.00 0.00 176.83 175.91 2rgk h ILE 390 N -0.32 0.61 0.00 2.52 2.04 -1.58 0.18 117.51 120.96 2rgk h ILE 390 Ca -0.52 -0.19 0.00 0.00 1.00 0.00 0.00 64.86 65.16 2rgk h ILE 390 Cb 1.65 0.02 0.00 0.00 -0.74 0.00 0.00 36.82 37.75 2rgk h ILE 390 CO -0.18 0.10 0.00 -2.65 0.00 0.00 0.00 178.15 175.42 2rgk n PRO 391 N -4.93 0.36 0.00 2.37 -0.02 -1.26 -2.27 135.00 129.25 2rgk n PRO 391 Ca 0.20 0.03 0.06 0.00 -2.02 0.00 0.00 63.50 61.78 2rgk n PRO 391 Cb 0.55 -1.50 -0.03 0.00 -0.02 0.00 0.00 33.50 32.51 2rgk n PRO 391 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2rgk n ARG 392 N -1.05 2.21 -4.28 -0.52 1.74 0.05 -4.57 116.66 110.24 2rgk n ARG 392 Ca 0.09 -0.46 -0.17 0.00 -0.77 0.00 0.00 57.85 56.54 2rgk n ARG 392 Cb 0.05 -1.16 -0.10 0.00 -1.02 0.00 0.00 32.46 30.23 2rgk n ARG 392 CO 0.00 0.00 0.00 0.96 -1.52 0.00 0.00 177.63 177.07 2rgk s ILE 393 N -1.85 1.41 1.08 0.55 -4.36 -0.96 -0.67 121.20 116.39 2rgk s ILE 393 Ca 0.09 -1.97 -0.14 0.00 -0.26 0.00 0.00 60.65 58.37 2rgk s ILE 393 Cb 0.10 -1.78 0.23 0.00 1.25 0.00 0.00 42.46 42.26 2rgk s ILE 393 CO 0.40 -0.57 1.08 -2.16 0.24 0.00 0.00 174.94 173.94 2rgk s PRO 394 N -3.29 -0.25 0.10 0.37 0.04 -1.26 -4.93 135.00 125.79 2rgk s PRO 394 Ca 0.15 0.43 0.25 0.00 0.04 0.00 0.00 61.00 61.88 2rgk s PRO 394 Cb -0.01 -1.67 0.97 0.00 0.04 0.00 0.00 34.50 33.83 2rgk s PRO 394 CO 0.03 -3.17 1.78 1.28 0.04 0.00 0.00 177.00 176.96 2rgk n LEU 395 N -4.47 0.35 -3.78 -3.56 4.77 -1.26 -4.73 117.00 104.32 2rgk n LEU 395 Ca 0.06 0.55 -0.13 0.00 -0.03 0.00 0.00 56.01 56.46 2rgk n LEU 395 Cb 0.57 -0.45 -0.14 0.00 -2.33 0.00 0.00 43.42 41.08 2rgk n LEU 395 CO 0.55 -0.17 -0.22 0.00 -1.33 0.00 0.00 177.39 176.22 2rgk s ALA 396 N -3.08 -0.31 1.03 -1.18 0.00 -1.26 -4.37 121.76 112.60 2rgk s ALA 396 Ca 0.11 0.57 -0.04 0.00 0.00 0.00 0.00 51.96 52.59 2rgk s ALA 396 Cb 0.14 -0.36 0.06 0.00 0.00 0.00 0.00 23.12 22.96 2rgk s ALA 396 CO 0.49 -0.12 0.28 -0.35 0.00 0.00 0.00 175.76 176.07 2rgk n PRO 397 N 3.69 -1.00 -0.35 0.00 -0.04 -1.26 -5.02 135.00 131.02 2rgk n PRO 397 Ca -0.20 -0.45 -0.30 0.00 -0.04 0.00 0.00 63.50 62.51 2rgk n PRO 397 Cb 0.55 -0.36 0.28 0.00 -0.04 0.00 0.00 33.50 33.93 2rgk n PRO 397 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 2rgk s GLY 398 N -3.28 1.44 0.02 0.55 0.00 -1.26 -4.47 107.32 100.33 2rgk s GLY 398 Ca 0.17 -0.55 -0.08 0.00 0.00 0.00 0.00 44.72 44.27 2rgk s GLY 398 CO 0.13 0.38 1.12 1.98 0.00 0.00 0.00 173.10 176.71 2rgk h MET 399 N -3.25 -0.15 -0.16 2.90 4.05 -1.91 0.25 114.93 116.66 2rgk h MET 399 Ca -0.51 0.01 0.05 0.00 -0.28 0.00 0.00 59.70 58.96 2rgk h MET 399 Cb 1.34 0.03 -0.05 0.00 -0.80 0.00 0.00 31.60 32.13 2rgk h MET 399 CO 0.36 -0.10 -0.15 0.00 0.23 0.00 0.00 176.91 177.26 2rgk h ALA 400 N -1.28 -0.03 -1.01 0.39 0.00 -1.95 0.80 119.26 116.18 2rgk h ALA 400 Ca 0.00 0.06 0.09 0.00 0.00 0.00 0.00 54.91 55.06 2rgk h ALA 400 Cb 0.16 0.31 -0.08 0.00 0.00 0.00 0.00 17.79 18.18 2rgk h ALA 400 CO -0.07 -0.59 0.64 -1.35 0.00 0.00 0.00 179.25 177.88 2rgk h PRO 401 N -0.16 1.07 -0.28 0.00 0.11 -1.89 -0.72 132.00 130.12 2rgk h PRO 401 Ca 0.10 -0.06 -0.03 0.00 0.11 0.00 0.00 66.00 66.12 2rgk h PRO 401 Cb 0.32 -0.24 -0.01 0.00 0.11 0.00 0.00 31.00 31.18 2rgk h PRO 401 CO -0.26 0.71 0.04 0.00 -0.21 0.00 0.00 178.00 178.28 2rgk h ALA 402 N 1.49 0.38 -0.48 -0.75 0.00 0.59 -0.07 119.26 120.42 2rgk h ALA 402 Ca 0.46 -0.19 -0.09 0.00 0.00 0.00 0.00 54.91 55.09 2rgk h ALA 402 Cb 0.31 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 2rgk h ALA 402 CO -0.22 0.07 -0.07 0.28 0.00 0.00 0.00 179.25 179.31 2rgk h VAL 403 N 0.29 1.26 0.00 0.00 2.07 -0.47 -1.56 116.25 117.83 2rgk h VAL 403 Ca 0.09 -1.15 -0.10 0.00 0.82 0.00 0.00 66.70 66.36 2rgk h VAL 403 Cb 0.34 0.96 -0.01 0.00 -1.52 0.00 0.00 31.29 31.06 2rgk h VAL 403 CO 0.01 0.40 -0.47 0.00 0.02 0.00 0.00 177.57 177.53 2rgk h ALA 404 N 1.14 1.13 -0.02 1.67 0.00 -1.02 -1.95 119.26 120.22 2rgk h ALA 404 Ca 0.14 -0.42 0.00 0.00 0.00 0.00 0.00 54.91 54.62 2rgk h ALA 404 Cb 0.57 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.28 2rgk h ALA 404 CO 0.03 0.58 0.00 0.00 0.00 0.00 0.00 179.25 179.87 2rgk n ALA 405 N -2.40 2.61 -3.02 0.00 0.00 -0.05 -4.90 120.51 112.75 2rgk n ALA 405 Ca -0.01 -0.17 -0.12 0.00 0.00 0.00 0.00 53.44 53.14 2rgk n ALA 405 Cb 0.51 -1.30 0.05 0.00 0.00 0.00 0.00 19.45 18.71 2rgk n ALA 405 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2rgk n GLY 406 N 0.85 0.10 1.05 0.00 0.00 -0.73 -4.96 105.19 101.50 2rgk n GLY 406 Ca 0.15 -0.17 0.12 0.00 0.00 0.00 0.00 46.02 46.12 2rgk n GLY 406 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2rgk n LEU 407 N -2.90 3.20 -4.66 0.99 4.77 -0.62 -4.88 117.00 112.91 2rgk n LEU 407 Ca -0.04 -1.20 -0.49 0.00 -0.03 0.00 0.00 56.01 54.25 2rgk n LEU 407 Cb 0.55 -0.10 -0.05 0.00 -2.33 0.00 0.00 43.42 41.49 2rgk n LEU 407 CO 0.35 0.60 1.23 -0.11 -1.33 0.00 0.00 177.39 178.13 2rgk n LEU 408 N 1.42 2.81 0.00 2.23 7.94 -1.26 -1.08 117.00 129.05 2rgk n LEU 408 Ca 0.16 1.06 0.00 0.00 -1.11 0.00 0.00 56.01 56.12 2rgk n LEU 408 Cb 0.61 -1.33 0.00 0.00 0.53 0.00 0.00 43.42 43.23 2rgk n LEU 408 CO 0.15 -0.40 0.00 0.47 -1.11 0.00 0.00 177.39 176.51 2rgk n ASP 409 N 4.32 -5.07 -0.29 1.96 8.00 0.15 -4.86 116.55 120.76 2rgk n ASP 409 Ca 0.20 0.00 0.23 0.00 0.71 0.00 0.00 54.79 55.93 2rgk n ASP 409 Cb 0.25 -3.09 0.54 0.00 -0.02 0.00 0.00 41.12 38.80 2rgk n ASP 409 CO 0.00 0.00 0.00 -0.29 -0.39 0.00 0.00 177.20 176.52 2rgk h ILE 410 N 0.00 0.57 -0.56 0.53 2.10 -1.27 -0.34 117.51 118.54 2rgk h ILE 410 Ca 0.00 -0.12 0.00 0.00 1.08 0.00 0.00 64.86 65.82 2rgk h ILE 410 Cb 0.80 0.19 0.00 0.00 -1.09 0.00 0.00 36.82 36.72 2rgk h ILE 410 CO 0.00 0.06 0.00 0.59 -1.08 0.00 0.00 178.15 177.72 2rgk n ASN 411 N -4.53 3.55 -4.89 2.19 3.02 -1.26 -4.97 115.26 108.37 2rgk n ASN 411 Ca 0.23 -1.99 -0.29 0.00 -0.03 0.00 0.00 54.58 52.50 2rgk n ASN 411 Cb 0.85 -0.37 -0.04 0.00 -0.61 0.00 0.00 39.78 39.61 2rgk n ASN 411 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2rgk s ALA 412 N -1.26 3.88 0.00 5.41 0.00 -0.14 -4.78 121.76 124.87 2rgk s ALA 412 Ca 0.43 -0.97 0.00 0.00 0.00 0.00 0.00 51.96 51.42 2rgk s ALA 412 Cb 0.23 -1.70 0.00 0.00 0.00 0.00 0.00 23.12 21.65 2rgk s ALA 412 CO 0.32 0.68 0.24 1.63 0.00 0.00 0.00 175.76 178.63