#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 3.62 -0.01 2.12 1.02 -1.26 -4.95 119.74 120.27 2rgk s LYS 2 Ca 0.00 -0.53 -0.01 0.00 0.02 0.00 0.00 55.97 55.46 2rgk s LYS 2 Cb 0.00 -3.01 -0.01 0.00 -0.52 0.00 0.00 37.83 34.29 2rgk s LYS 2 CO 0.00 0.08 -0.02 0.91 -0.92 0.00 0.00 175.35 175.40 2rgk n TRP 3 N 4.02 0.00 -1.63 3.18 7.02 -1.26 -4.93 117.44 123.84 2rgk n TRP 3 Ca -0.17 0.00 -0.44 0.00 -1.02 0.00 0.00 57.50 55.87 2rgk n TRP 3 Cb 0.52 -0.05 -0.01 0.00 -2.42 0.00 0.00 31.31 29.35 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 -2.98 1.63 -1.85 -5.99 3.72 -1.26 -2.10 117.46 108.63 2rgk n PHE 4 Ca -0.03 0.64 -0.20 0.00 -0.05 0.00 0.00 57.45 57.81 2rgk n PHE 4 Cb 0.52 -2.31 -0.06 0.00 -0.94 0.00 0.00 39.48 36.69 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 1.00 -5.36 -4.38 4.37 5.03 -1.26 -4.97 115.26 109.67 2rgk n ASN 5 Ca 0.08 0.33 -0.34 0.00 0.87 0.00 0.00 54.58 55.52 2rgk n ASN 5 Cb 0.34 -4.66 -0.14 0.00 -1.02 0.00 0.00 39.78 34.30 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 -2.78 3.35 0.51 3.41 -4.23 -0.89 -1.10 115.64 113.92 2rgk s THR 6 Ca 0.00 -0.53 0.19 0.00 -1.18 0.00 0.00 61.69 60.17 2rgk s THR 6 Cb 0.00 -2.46 0.33 0.00 1.34 0.00 0.00 72.50 71.71 2rgk s THR 6 CO 0.00 0.48 2.06 -0.07 -0.54 0.00 0.00 174.62 176.56 2rgk h LEU 7 N 7.17 0.06 -0.62 4.79 3.38 0.40 -1.59 115.31 128.90 2rgk h LEU 7 Ca -0.32 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.58 2rgk h LEU 7 Cb 1.19 -0.01 -0.03 0.00 0.09 0.00 0.00 40.66 41.90 2rgk h LEU 7 CO 0.59 0.04 0.14 0.77 0.09 0.00 0.00 178.44 180.07 2rgk h SER 8 N 0.07 0.95 -0.15 -0.43 4.64 -1.93 0.50 113.55 117.20 2rgk h SER 8 Ca 0.14 -0.24 -0.19 0.00 -0.47 0.00 0.00 61.79 61.03 2rgk h SER 8 Cb 0.47 -0.25 0.01 0.00 -0.31 0.00 0.00 62.40 62.32 2rgk h SER 8 CO -0.01 0.95 -0.64 -0.74 -0.87 0.00 0.00 176.83 175.51 2rgk h HIS 9 N 0.92 0.93 0.00 4.77 -0.00 -1.65 -2.99 115.15 117.12 2rgk h HIS 9 Ca 0.19 -0.40 -0.03 0.00 -0.00 0.00 0.00 60.37 60.13 2rgk h HIS 9 Cb 0.37 -0.15 -0.00 0.00 -0.00 0.00 0.00 27.41 27.63 2rgk h HIS 9 CO 0.03 1.21 -0.14 -0.91 -0.00 0.00 0.00 177.93 178.11 2rgk h ASN 10 N 0.38 0.00 0.40 3.26 2.35 -1.15 -0.45 115.58 120.37 2rgk h ASN 10 Ca -0.04 0.00 -0.17 0.00 -0.55 0.00 0.00 56.30 55.54 2rgk h ASN 10 Cb 1.27 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.63 2rgk h ASN 10 CO 0.13 0.14 -0.70 0.03 -1.65 0.00 0.00 177.43 175.38 2rgk h ARG 11 N 0.00 0.26 -0.40 0.81 3.08 -0.82 -1.81 114.38 115.50 2rgk h ARG 11 Ca -0.00 -0.21 -0.13 0.00 0.07 0.00 0.00 59.98 59.71 2rgk h ARG 11 Cb 0.42 0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.50 2rgk h ARG 11 CO 0.02 0.86 -0.24 2.35 -1.07 0.00 0.00 179.97 181.89 2rgk h TRP 12 N 0.18 1.02 -0.70 3.04 7.01 -1.00 -1.85 115.95 123.64 2rgk h TRP 12 Ca -0.02 -0.27 -0.06 0.00 2.11 0.00 0.00 58.89 60.65 2rgk h TRP 12 Cb 1.26 -0.23 -0.03 0.00 -2.10 0.00 0.00 29.16 28.06 2rgk h TRP 12 CO 0.03 1.05 0.19 -0.07 -2.79 0.00 0.00 178.44 176.85 2rgk h LEU 13 N 0.69 1.06 -0.52 0.65 3.38 -1.07 -1.94 115.31 117.56 2rgk h LEU 13 Ca 0.08 -0.23 -0.09 0.00 0.09 0.00 0.00 57.88 57.74 2rgk h LEU 13 Cb 0.81 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 41.27 2rgk h LEU 13 CO 0.07 1.01 -0.04 -0.08 0.09 0.00 0.00 178.44 179.49 2rgk h GLU 14 N 1.05 0.94 -0.67 1.13 4.81 -1.22 0.77 114.58 121.39 2rgk h GLU 14 Ca 0.22 -0.32 -0.02 0.00 -0.13 0.00 0.00 59.36 59.12 2rgk h GLU 14 Cb 0.35 -0.08 -0.03 0.00 0.63 0.00 0.00 28.75 29.62 2rgk h GLU 14 CO -0.00 0.97 0.34 1.96 -0.73 0.00 0.00 179.01 181.55 2rgk h GLN 15 N 0.80 0.94 -0.20 1.92 4.20 -1.13 -0.68 115.11 120.98 2rgk h GLN 15 Ca 0.14 -0.11 -0.16 0.00 0.06 0.00 0.00 58.65 58.58 2rgk h GLN 15 Cb 0.57 -0.18 -0.01 0.00 0.30 0.00 0.00 27.48 28.17 2rgk h GLN 15 CO 0.03 0.72 -0.54 1.49 -0.67 0.00 0.00 178.83 179.86 2rgk h GLU 16 N 0.95 0.58 -0.83 1.46 4.57 -1.05 -2.92 114.58 117.33 2rgk h GLU 16 Ca 0.24 -0.36 -0.01 0.00 -1.18 0.00 0.00 59.36 58.05 2rgk h GLU 16 Cb 0.07 0.04 -0.04 0.00 -0.16 0.00 0.00 28.75 28.66 2rgk h GLU 16 CO -0.03 0.97 0.50 1.15 -1.18 0.00 0.00 179.01 180.41 2rgk h THR 17 N 0.45 1.23 -0.65 0.32 2.02 0.22 -2.17 112.91 114.33 2rgk h THR 17 Ca 0.01 -0.52 -0.08 0.00 0.77 0.00 0.00 66.41 66.59 2rgk h THR 17 Cb 1.08 0.07 -0.03 0.00 -1.74 0.00 0.00 68.15 67.54 2rgk h THR 17 CO 0.10 0.25 0.09 0.44 0.37 0.00 0.00 175.52 176.77 2rgk h ASP 18 N 1.15 1.05 -0.04 4.18 3.32 -1.07 -0.34 116.42 124.67 2rgk h ASP 18 Ca 0.30 -0.27 -0.01 0.00 0.02 0.00 0.00 57.03 57.07 2rgk h ASP 18 Cb -0.04 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.23 2rgk h ASP 18 CO -0.06 1.05 0.00 -0.09 -1.72 0.00 0.00 179.24 178.43 2rgk h ARG 19 N 1.01 0.13 0.03 3.56 2.43 -1.28 -0.59 114.38 119.66 2rgk h ARG 19 Ca 0.20 -0.01 -0.19 0.00 -0.81 0.00 0.00 59.98 59.16 2rgk h ARG 19 Cb 0.46 -0.03 0.02 0.00 -0.42 0.00 0.00 29.97 30.00 2rgk h ARG 19 CO 0.02 0.14 -0.76 0.82 -1.51 0.00 0.00 179.97 178.68 2rgk h ILE 20 N 0.13 1.40 -0.61 1.20 1.08 -0.76 -2.47 117.51 117.48 2rgk h ILE 20 Ca 0.03 -2.21 0.02 0.00 -0.39 0.00 0.00 64.86 62.32 2rgk h ILE 20 Cb 0.09 2.66 -0.04 0.00 -3.07 0.00 0.00 36.82 36.47 2rgk h ILE 20 CO 0.00 0.65 0.39 -0.26 -0.69 0.00 0.00 178.15 178.24 2rgk h PHE 21 N -0.03 0.73 -0.16 1.37 0.04 -0.61 -2.23 116.94 116.05 2rgk h PHE 21 Ca -0.10 0.02 0.04 0.00 2.80 0.00 0.00 57.97 60.73 2rgk h PHE 21 Cb 1.48 -0.24 -0.05 0.00 2.20 0.00 0.00 35.95 39.34 2rgk h PHE 21 CO 0.14 0.43 -0.12 -0.44 -0.60 0.00 0.00 178.31 177.72 2rgk h ASP 22 N 0.77 -0.39 -0.70 2.17 3.32 -1.15 -2.71 116.42 117.74 2rgk h ASP 22 Ca 0.24 0.08 0.12 0.00 0.02 0.00 0.00 57.03 57.49 2rgk h ASP 22 Cb -0.02 0.20 -0.08 0.00 0.22 0.00 0.00 39.33 39.64 2rgk h ASP 22 CO -0.08 -0.16 0.27 0.15 -1.72 0.00 0.00 179.24 177.70 2rgk h PHE 23 N -0.13 0.47 0.00 4.55 3.57 -0.92 -2.20 116.94 122.27 2rgk h PHE 23 Ca 0.10 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.63 2rgk h PHE 23 Cb 0.28 -0.10 0.00 0.00 2.79 0.00 0.00 35.95 38.91 2rgk h PHE 23 CO -0.26 0.09 0.00 0.78 -2.23 0.00 0.00 178.31 176.69 2rgk h GLY 24 N 0.44 0.00 1.73 2.40 0.00 -1.14 -3.29 103.07 103.21 2rgk h GLY 24 Ca 0.37 0.00 0.02 0.00 0.00 0.00 0.00 47.33 47.71 2rgk h GLY 24 CO -0.36 0.00 0.12 0.50 0.00 0.00 0.00 176.54 176.80 2rgk h LYS 25 N 0.00 0.00 0.00 4.80 1.57 -1.19 -1.43 116.57 120.32 2rgk h LYS 25 Ca 0.00 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.75 2rgk h LYS 25 Cb 0.52 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.82 2rgk h LYS 25 CO 0.00 0.00 -0.16 -0.91 -0.57 0.00 0.00 179.45 177.81 2rgk h ASN 26 N 0.00 0.00 0.00 0.86 4.21 -1.76 -3.25 115.58 115.64 2rgk h ASN 26 Ca 0.03 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.54 2rgk h ASN 26 Cb 0.26 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.46 2rgk h ASN 26 CO -0.00 0.16 0.03 0.77 -1.29 0.00 0.00 177.43 177.10 2rgk h SER 27 N 0.00 0.00 -2.04 5.81 4.64 -1.51 -3.44 113.55 117.00 2rgk h SER 27 Ca -0.00 0.00 -0.62 0.00 -0.47 0.00 0.00 61.79 60.70 2rgk h SER 27 Cb 0.97 0.00 0.05 0.00 -0.31 0.00 0.00 62.40 63.10 2rgk h SER 27 CO 0.02 0.00 0.79 0.52 -0.87 0.00 0.00 176.83 177.29 2rgk n VAL 28 N -2.59 0.13 -3.96 0.95 0.31 -1.23 0.28 118.33 112.22 2rgk n VAL 28 Ca -0.02 -0.02 -0.08 0.00 -0.01 0.00 0.00 64.34 64.20 2rgk n VAL 28 Cb 0.08 -1.42 -0.09 0.00 -0.91 0.00 0.00 33.84 31.50 2rgk n VAL 28 CO 0.00 0.00 0.00 0.68 -1.32 0.00 0.00 176.83 176.19 2rgk s VAL 29 N 1.61 0.17 0.27 2.52 -7.23 0.41 -4.75 120.40 113.40 2rgk s VAL 29 Ca 0.84 -1.39 -0.04 0.00 -1.81 0.00 0.00 61.98 59.58 2rgk s VAL 29 Cb -0.77 -1.28 0.36 0.00 0.56 0.00 0.00 36.38 35.26 2rgk s VAL 29 CO 0.44 -0.77 1.60 -0.65 -0.31 0.00 0.00 175.10 175.41 2rgk h PRO 30 N 3.16 0.04 -0.01 4.82 0.11 -2.01 -0.92 132.00 137.18 2rgk h PRO 30 Ca -0.34 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.77 2rgk h PRO 30 Cb 1.17 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.27 2rgk h PRO 30 CO 0.58 0.03 -0.07 0.25 -0.21 0.00 0.00 178.00 178.58 2rgk n THR 31 N -5.46 0.00 0.00 -1.15 -2.24 -1.26 -4.93 114.28 99.24 2rgk n THR 31 Ca 0.17 -0.19 0.00 0.00 -2.27 0.00 0.00 64.05 61.76 2rgk n THR 31 Cb 0.58 0.36 0.00 0.00 -2.10 0.00 0.00 70.33 69.17 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 -0.22 3.28 3.38 0.00 -0.35 -4.68 105.19 107.81 2rgk n GLY 32 Ca 0.17 -0.34 -0.32 0.00 0.00 0.00 0.00 46.02 45.53 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 2.64 0.53 1.61 0.08 -1.26 -0.45 117.98 121.13 2rgk s PHE 33 Ca 0.00 -0.87 -0.08 0.00 0.12 0.00 0.00 56.93 56.09 2rgk s PHE 33 Cb 0.00 -1.75 0.12 0.00 -0.57 0.00 0.00 43.02 40.82 2rgk s PHE 33 CO 0.00 -0.33 0.71 0.41 -0.10 0.00 0.00 175.22 175.92 2rgk n GLY 34 N 3.47 -1.14 3.34 4.36 0.00 0.81 -4.27 105.19 111.76 2rgk n GLY 34 Ca -0.19 -1.72 -0.42 0.00 0.00 0.00 0.00 46.02 43.69 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 -2.50 3.28 0.14 1.61 -0.11 -1.26 -4.82 118.94 115.29 2rgk s TRP 35 Ca 0.41 -1.17 -0.30 0.00 1.22 0.00 0.00 56.10 56.26 2rgk s TRP 35 Cb -0.01 -2.98 -0.07 0.00 -1.50 0.00 0.00 33.47 28.91 2rgk s TRP 35 CO 0.29 -0.79 1.10 -0.51 -4.62 0.00 0.00 176.95 172.41 2rgk s LEU 36 N 1.54 4.47 0.00 5.86 1.43 -1.26 -0.23 118.68 130.49 2rgk s LEU 36 Ca 0.03 2.03 0.00 0.00 -1.03 0.00 0.00 54.13 55.16 2rgk s LEU 36 Cb -0.23 -3.60 0.00 0.00 0.03 0.00 0.00 46.19 42.39 2rgk s LEU 36 CO 0.05 -0.25 0.00 0.61 0.23 0.00 0.00 176.35 176.99 2rgk n GLY 37 N 2.29 -0.23 0.09 -3.19 0.00 0.15 -0.28 105.19 104.02 2rgk n GLY 37 Ca 0.04 -1.77 0.10 0.00 0.00 0.00 0.00 46.02 44.39 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 -1.71 0.45 -0.29 1.61 3.02 -1.26 -2.29 115.26 114.79 2rgk n ASN 38 Ca 0.00 0.62 0.06 0.00 -0.03 0.00 0.00 54.58 55.24 2rgk n ASN 38 Cb 0.00 -0.71 0.13 0.00 -0.61 0.00 0.00 39.78 38.58 2rgk n ASN 38 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 2rgk n LYS 39 N -2.01 2.29 -1.06 3.52 5.02 -1.26 -4.69 118.16 119.96 2rgk n LYS 39 Ca 0.02 -2.27 -0.02 0.00 -2.02 0.00 0.00 58.31 54.02 2rgk n LYS 39 Cb 0.19 -1.40 -0.01 0.00 -0.02 0.00 0.00 35.03 33.79 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 -0.74 0.56 3.91 0.72 0.00 -0.97 -4.95 105.19 103.72 2rgk n GLY 40 Ca 0.12 -0.50 -0.31 0.00 0.00 0.00 0.00 46.02 45.33 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 -1.47 3.51 0.11 1.61 0.00 -1.26 -4.76 119.66 117.40 2rgk s GLN 41 Ca 0.00 -0.32 -0.30 0.00 -0.00 0.00 0.00 55.36 54.74 2rgk s GLN 41 Cb 0.00 -2.96 -0.07 0.00 0.00 0.00 0.00 33.01 29.98 2rgk s GLN 41 CO 0.00 0.55 1.18 0.42 0.00 0.00 0.00 175.29 177.44 2rgk s ILE 42 N -1.59 3.88 -0.91 3.63 1.01 -1.26 0.32 121.20 126.27 2rgk s ILE 42 Ca 0.37 1.45 -0.13 0.00 0.00 0.00 0.00 60.65 62.33 2rgk s ILE 42 Cb -0.12 -3.92 0.22 0.00 0.01 0.00 0.00 42.46 38.64 2rgk s ILE 42 CO 0.27 0.17 0.89 -0.54 0.00 0.00 0.00 174.94 175.73 2rgk s LYS 43 N 0.47 3.74 0.60 2.79 1.02 0.69 -4.87 119.74 124.18 2rgk s LYS 43 Ca 0.56 -2.55 0.30 0.00 0.02 0.00 0.00 55.97 54.29 2rgk s LYS 43 Cb -0.30 -4.52 1.74 0.00 -0.52 0.00 0.00 37.83 34.22 2rgk s LYS 43 CO 0.32 -1.34 2.12 0.93 -0.92 0.00 0.00 175.35 176.46 2rgk h GLU 44 N 7.63 0.00 0.00 1.68 4.39 -1.93 -1.79 114.58 124.56 2rgk h GLU 44 Ca 0.13 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.83 2rgk h GLU 44 Cb 1.00 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.65 2rgk h GLU 44 CO 0.85 0.00 0.00 0.93 -1.16 0.00 0.00 179.01 179.63 2rgk h GLU 45 N 0.00 0.00 0.00 2.33 3.07 -1.97 -1.82 114.58 116.19 2rgk h GLU 45 Ca 0.07 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.93 2rgk h GLU 45 Cb 0.44 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.35 2rgk h GLU 45 CO -0.00 0.00 -0.19 0.52 -1.40 0.00 0.00 179.01 177.94 2rgk h MET 46 N 0.00 0.00 0.00 2.33 2.86 -1.71 -3.50 114.93 114.92 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 0.32 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.98 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 1.17 -0.07 3.24 8.32 0.00 -0.69 -4.62 105.19 112.55 2rgk n GLY 47 Ca 0.04 -1.02 -0.41 0.00 0.00 0.00 0.00 46.02 44.63 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 4.27 0.25 2.61 2.01 0.21 -4.13 115.64 120.86 2rgk s THR 48 Ca 0.00 -1.65 -0.21 0.00 0.31 0.00 0.00 61.69 60.14 2rgk s THR 48 Cb 0.00 -3.75 -0.09 0.00 0.01 0.00 0.00 72.50 68.67 2rgk s THR 48 CO 0.00 -0.70 0.78 -1.00 -0.69 0.00 0.00 174.62 173.01 2rgk s HIS 49 N 1.39 3.64 0.15 4.92 3.76 -1.26 -1.57 115.29 126.32 2rgk s HIS 49 Ca 0.05 1.47 -0.14 0.00 -0.15 0.00 0.00 55.06 56.29 2rgk s HIS 49 Cb -0.25 -2.69 0.03 0.00 1.11 0.00 0.00 32.58 30.78 2rgk s HIS 49 CO 0.00 0.29 1.69 1.25 -0.85 0.00 0.00 174.74 177.12 2rgk h LEU 50 N 3.28 0.68 -0.58 0.89 5.85 -1.37 -1.42 115.31 122.64 2rgk h LEU 50 Ca -0.48 -0.19 -0.06 0.00 0.84 0.00 0.00 57.88 58.00 2rgk h LEU 50 Cb 1.19 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 42.02 2rgk h LEU 50 CO 0.65 0.68 0.15 4.11 -0.34 0.00 0.00 178.44 183.69 2rgk h TRP 51 N 0.64 0.97 -0.33 1.25 5.08 -1.84 0.72 115.95 122.44 2rgk h TRP 51 Ca 0.16 -0.11 -0.05 0.00 1.08 0.00 0.00 58.89 59.96 2rgk h TRP 51 Cb 0.23 -0.27 -0.01 0.00 -3.00 0.00 0.00 29.16 26.10 2rgk h TRP 51 CO 0.01 0.82 0.01 0.82 -1.28 0.00 0.00 178.44 178.82 2rgk h ILE 52 N 0.83 1.26 -0.60 0.12 2.04 -1.90 -0.68 117.51 118.58 2rgk h ILE 52 Ca 0.18 -0.94 -0.01 0.00 1.00 0.00 0.00 64.86 65.09 2rgk h ILE 52 Cb 0.34 1.23 -0.03 0.00 -0.74 0.00 0.00 36.82 37.62 2rgk h ILE 52 CO 0.00 0.31 0.34 0.74 0.00 0.00 0.00 178.15 179.54 2rgk h THR 53 N 0.38 1.19 -0.56 -0.27 2.02 -1.04 -0.99 112.91 113.64 2rgk h THR 53 Ca 0.09 -0.45 -0.03 0.00 0.77 0.00 0.00 66.41 66.79 2rgk h THR 53 Cb 0.43 0.40 -0.02 0.00 -1.74 0.00 0.00 68.15 67.22 2rgk h THR 53 CO 0.02 0.20 0.22 0.00 0.37 0.00 0.00 175.52 176.33 2rgk h ALA 54 N 1.16 0.73 -0.31 6.16 0.00 -0.75 -2.44 119.26 123.82 2rgk h ALA 54 Ca 0.21 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 2rgk h ALA 54 Cb 0.02 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 2rgk h ALA 54 CO -0.04 0.35 0.12 0.00 0.00 0.00 0.00 179.25 179.68 2rgk h ARG 55 N 0.77 0.46 -0.98 0.00 3.08 -0.73 -2.44 114.38 114.55 2rgk h ARG 55 Ca 0.19 -0.08 0.02 0.00 0.07 0.00 0.00 59.98 60.17 2rgk h ARG 55 Cb 0.20 -0.08 -0.05 0.00 0.08 0.00 0.00 29.97 30.13 2rgk h ARG 55 CO -0.01 0.47 0.65 0.52 -1.07 0.00 0.00 179.97 180.52 2rgk h MET 56 N 0.35 1.27 -0.89 0.04 2.86 -1.10 0.16 114.93 117.62 2rgk h MET 56 Ca 0.10 -0.08 0.03 0.00 -2.06 0.00 0.00 59.70 57.69 2rgk h MET 56 Cb 0.18 -0.29 -0.05 0.00 0.06 0.00 0.00 31.60 31.51 2rgk h MET 56 CO -0.01 0.84 0.59 1.25 1.06 0.00 0.00 176.91 180.64 2rgk h LEU 57 N 1.31 0.98 -0.01 1.22 5.85 -1.20 -0.91 115.31 122.55 2rgk h LEU 57 Ca 0.37 -0.02 -0.00 0.00 0.84 0.00 0.00 57.88 59.07 2rgk h LEU 57 Cb -0.12 -0.23 -0.00 0.00 0.37 0.00 0.00 40.66 40.68 2rgk h LEU 57 CO -0.09 0.69 -0.00 -0.74 -0.34 0.00 0.00 178.44 177.96 2rgk h HIS 58 N 1.15 0.02 -0.23 1.25 2.76 -0.68 -2.79 115.15 116.62 2rgk h HIS 58 Ca 0.35 -0.01 0.04 0.00 -2.20 0.00 0.00 60.37 58.55 2rgk h HIS 58 Cb -0.03 -0.01 -0.04 0.00 1.55 0.00 0.00 27.41 28.88 2rgk h HIS 58 CO -0.00 0.41 -0.04 0.28 -1.30 0.00 0.00 177.93 177.28 2rgk h VAL 59 N -0.37 0.79 0.00 5.26 2.07 -0.33 -2.47 116.25 121.20 2rgk h VAL 59 Ca 0.00 -0.01 0.00 0.00 0.82 0.00 0.00 66.70 67.51 2rgk h VAL 59 Cb 0.40 0.77 0.00 0.00 -1.52 0.00 0.00 31.29 30.94 2rgk h VAL 59 CO 0.00 0.00 0.00 -1.22 0.02 0.00 0.00 177.57 176.38 2rgk n TYR 60 N -5.19 0.00 0.08 1.57 4.01 -0.38 -2.00 117.16 115.25 2rgk n TYR 60 Ca -0.02 0.00 -0.10 0.00 -0.16 0.00 0.00 57.90 57.62 2rgk n TYR 60 Cb 0.13 -0.46 -0.06 0.00 -0.31 0.00 0.00 39.34 38.64 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 0.28 -0.11 7.72 0.02 -1.16 -1.77 113.55 118.54 2rgk h SER 61 Ca 0.00 -0.25 -0.23 0.00 -0.84 0.00 0.00 61.79 60.47 2rgk h SER 61 Cb 0.33 -0.09 0.01 0.00 0.14 0.00 0.00 62.40 62.80 2rgk h SER 61 CO 0.00 1.10 -0.83 0.58 -1.14 0.00 0.00 176.83 176.54 2rgk h VAL 62 N 0.09 1.29 -0.84 2.27 2.07 -1.29 -2.58 116.25 117.26 2rgk h VAL 62 Ca -0.06 -2.04 -0.03 0.00 0.82 0.00 0.00 66.70 65.39 2rgk h VAL 62 Cb 1.65 2.12 -0.04 0.00 -1.52 0.00 0.00 31.29 33.50 2rgk h VAL 62 CO 0.15 0.64 0.41 0.00 0.02 0.00 0.00 177.57 178.79 2rgk h ALA 63 N 0.50 1.08 -0.70 1.67 0.00 -1.38 -1.37 119.26 119.05 2rgk h ALA 63 Ca -0.07 -0.16 -0.05 0.00 0.00 0.00 0.00 54.91 54.63 2rgk h ALA 63 Cb 1.47 -0.33 -0.03 0.00 0.00 0.00 0.00 17.79 18.90 2rgk h ALA 63 CO 0.17 0.64 0.25 0.00 0.00 0.00 0.00 179.25 180.31 2rgk h ALA 64 N 1.22 0.92 0.00 0.00 0.00 -1.32 -1.69 119.26 118.38 2rgk h ALA 64 Ca 0.29 -0.20 -0.03 0.00 0.00 0.00 0.00 54.91 54.97 2rgk h ALA 64 Cb 0.11 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 17.62 2rgk h ALA 64 CO -0.04 0.57 -0.13 0.00 0.00 0.00 0.00 179.25 179.65 2rgk h ALA 65 N 1.12 1.20 -0.09 0.00 0.00 -0.99 -1.28 119.26 119.21 2rgk h ALA 65 Ca 0.23 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.02 2rgk h ALA 65 Cb 0.26 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.03 2rgk h ALA 65 CO -0.01 0.16 0.00 -1.33 0.00 0.00 0.00 179.25 178.07 2rgk n MET 66 N -3.54 1.50 -2.12 0.00 2.81 -0.57 -4.75 117.12 110.45 2rgk n MET 66 Ca -0.01 -0.74 -0.04 0.00 -1.81 0.00 0.00 57.70 55.10 2rgk n MET 66 Cb 0.27 -1.39 -0.00 0.00 -0.71 0.00 0.00 33.22 31.40 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 1.04 0.23 3.51 3.03 0.00 -0.48 -5.03 105.19 107.49 2rgk n GLY 67 Ca 0.16 -0.70 -0.43 0.00 0.00 0.00 0.00 46.02 45.06 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 -4.28 3.25 0.18 1.61 3.00 -1.07 -5.03 118.95 116.60 2rgk s ARG 68 Ca 0.01 -0.51 -0.33 0.00 0.00 0.00 0.00 55.73 54.89 2rgk s ARG 68 Cb -0.00 -3.94 -0.14 0.00 0.00 0.00 0.00 34.95 30.87 2rgk s ARG 68 CO 0.01 -0.89 1.54 -2.30 0.00 0.00 0.00 175.30 173.66 2rgk n PRO 69 N 5.91 2.12 0.00 3.54 -0.02 -1.26 -1.98 135.00 143.30 2rgk n PRO 69 Ca -0.04 0.76 0.00 0.00 -2.02 0.00 0.00 63.50 62.20 2rgk n PRO 69 Cb 0.48 -2.50 0.00 0.00 -0.02 0.00 0.00 33.50 31.45 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 3.11 2.14 0.20 -1.23 0.00 -1.26 -4.92 105.19 103.23 2rgk n GLY 70 Ca 0.16 -0.33 -0.06 0.00 0.00 0.00 0.00 46.02 45.79 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 0.63 -0.69 4.61 0.00 -1.72 -1.84 119.26 120.25 2rgk h ALA 71 Ca 0.00 0.00 0.08 0.00 0.00 0.00 0.00 54.91 54.99 2rgk h ALA 71 Cb 0.00 -0.12 -0.07 0.00 0.00 0.00 0.00 17.79 17.61 2rgk h ALA 71 CO 0.00 -0.04 0.35 -0.92 0.00 0.00 0.00 179.25 178.64 2rgk h TYR 72 N 0.55 0.64 -0.77 0.00 3.20 -1.78 -0.04 116.97 118.76 2rgk h TYR 72 Ca 0.20 0.03 0.04 0.00 3.14 0.00 0.00 58.73 62.14 2rgk h TYR 72 Cb 0.05 -0.18 -0.05 0.00 1.54 0.00 0.00 36.73 38.09 2rgk h TYR 72 CO -0.08 0.25 0.48 0.77 -1.64 0.00 0.00 178.16 177.95 2rgk h SER 73 N 0.62 0.78 -0.37 -2.11 0.02 -1.74 0.39 113.55 111.13 2rgk h SER 73 Ca 0.33 0.01 -0.07 0.00 -0.84 0.00 0.00 61.79 61.22 2rgk h SER 73 Cb 0.31 -0.16 -0.02 0.00 0.14 0.00 0.00 62.40 62.67 2rgk h SER 73 CO -0.24 0.52 -0.01 -0.07 -1.14 0.00 0.00 176.83 175.90 2rgk h LEU 74 N 0.92 0.72 -0.51 5.07 3.38 -0.68 0.40 115.31 124.62 2rgk h LEU 74 Ca 0.32 -0.17 -0.01 0.00 0.09 0.00 0.00 57.88 58.11 2rgk h LEU 74 Cb 0.07 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.61 2rgk h LEU 74 CO -0.13 0.79 0.29 0.58 0.09 0.00 0.00 178.44 180.06 2rgk h VAL 75 N 0.70 1.16 -0.55 1.22 2.07 0.34 0.28 116.25 121.48 2rgk h VAL 75 Ca 0.14 -0.40 -0.01 0.00 0.82 0.00 0.00 66.70 67.25 2rgk h VAL 75 Cb 0.44 0.51 -0.03 0.00 -1.52 0.00 0.00 31.29 30.70 2rgk h VAL 75 CO 0.02 0.17 0.32 -0.78 0.02 0.00 0.00 177.57 177.32 2rgk h ASP 76 N 0.67 0.66 -0.76 0.57 3.58 0.79 -0.78 116.42 121.16 2rgk h ASP 76 Ca 0.18 -0.07 -0.01 0.00 0.42 0.00 0.00 57.03 57.55 2rgk h ASP 76 Cb 0.02 -0.17 -0.04 0.00 1.72 0.00 0.00 39.33 40.87 2rgk h ASP 76 CO -0.03 0.54 0.43 -0.74 -2.88 0.00 0.00 179.24 176.55 2rgk h HIS 77 N 0.73 1.03 0.33 0.28 2.76 0.52 -2.01 115.15 118.80 2rgk h HIS 77 Ca 0.19 -0.02 -0.02 0.00 -2.20 0.00 0.00 60.37 58.33 2rgk h HIS 77 Cb 0.00 -0.33 0.00 0.00 1.55 0.00 0.00 27.41 28.63 2rgk h HIS 77 CO -0.02 0.72 -0.16 0.78 -1.30 0.00 0.00 177.93 177.94 2rgk h GLY 78 N 1.05 -0.47 0.40 5.26 0.00 0.17 -0.44 103.07 109.04 2rgk h GLY 78 Ca 0.27 0.18 0.11 0.00 0.00 0.00 0.00 47.33 47.89 2rgk h GLY 78 CO -0.04 -0.17 0.45 -2.22 0.00 0.00 0.00 176.54 174.55 2rgk h ILE 79 N -0.45 0.83 -0.24 2.60 2.04 -1.00 0.99 117.51 122.27 2rgk h ILE 79 Ca -0.04 -0.24 -0.10 0.00 1.00 0.00 0.00 64.86 65.47 2rgk h ILE 79 Cb 0.35 0.06 -0.01 0.00 -0.74 0.00 0.00 36.82 36.48 2rgk h ILE 79 CO 0.07 0.13 -0.27 0.11 0.00 0.00 0.00 178.15 178.19 2rgk h LYS 80 N 0.71 0.48 -0.26 2.37 1.57 -1.13 -2.60 116.57 117.71 2rgk h LYS 80 Ca 0.42 -0.19 -0.12 0.00 -1.87 0.00 0.00 60.65 58.89 2rgk h LYS 80 Cb 0.47 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.75 2rgk h LYS 80 CO -0.29 0.71 -0.32 0.00 -0.57 0.00 0.00 179.45 178.97 2rgk h ALA 81 N 1.29 0.95 0.00 3.86 0.00 0.71 -1.58 119.26 124.50 2rgk h ALA 81 Ca 0.06 -0.39 0.00 0.00 0.00 0.00 0.00 54.91 54.57 2rgk h ALA 81 Cb 0.69 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.37 2rgk h ALA 81 CO 0.05 0.61 0.00 -1.33 0.00 0.00 0.00 179.25 178.58 2rgk n MET 82 N -4.07 0.24 -0.05 0.00 2.81 0.15 -1.94 117.12 114.26 2rgk n MET 82 Ca -0.01 0.10 0.05 0.00 -1.81 0.00 0.00 57.70 56.03 2rgk n MET 82 Cb 0.46 -1.50 0.07 0.00 -0.71 0.00 0.00 33.22 31.54 2rgk n MET 82 CO 0.00 0.00 0.00 0.09 1.51 0.00 0.00 175.97 177.57 2rgk n ASN 83 N -1.33 2.10 0.00 7.83 3.02 -0.67 -4.46 115.26 121.75 2rgk n ASN 83 Ca 0.09 -1.59 0.00 0.00 -0.03 0.00 0.00 54.58 53.05 2rgk n ASN 83 Cb 0.18 -0.07 0.00 0.00 -0.61 0.00 0.00 39.78 39.28 2rgk n ASN 83 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2rgk n GLY 84 N 0.45 2.53 0.41 7.41 0.00 -0.74 -4.85 105.19 110.40 2rgk n GLY 84 Ca 0.07 -0.95 0.21 0.00 0.00 0.00 0.00 46.02 45.35 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 -0.03 2.44 -0.33 4.61 0.00 -1.89 -0.72 119.26 123.34 2rgk h ALA 85 Ca 0.00 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.84 2rgk h ALA 85 Cb 0.00 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 2rgk h ALA 85 CO 0.00 -0.66 -0.06 -0.07 0.00 0.00 0.00 179.25 178.46 2rgk h LEU 86 N 0.18 0.51 -9.65 0.00 3.38 -1.84 -3.43 115.31 104.47 2rgk h LEU 86 Ca 0.37 -0.11 -0.51 0.00 0.09 0.00 0.00 57.88 57.71 2rgk h LEU 86 Cb 1.20 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 41.81 2rgk h LEU 86 CO -0.07 0.62 0.44 -0.60 0.09 0.00 0.00 178.44 178.93 2rgk s ARG 87 N -4.86 4.63 -0.92 1.13 3.52 -0.28 -1.00 118.95 121.18 2rgk s ARG 87 Ca -0.08 1.65 -0.18 0.00 -0.13 0.00 0.00 55.73 56.99 2rgk s ARG 87 Cb 0.15 -3.30 0.14 0.00 -1.56 0.00 0.00 34.95 30.38 2rgk s ARG 87 CO 0.77 0.13 1.09 0.34 -0.81 0.00 0.00 175.30 176.83 2rgk s ASP 88 N -0.17 6.63 0.00 -2.12 -1.08 -0.35 -4.86 116.67 114.72 2rgk s ASP 88 Ca 0.48 -2.09 0.02 0.00 -0.52 0.00 0.00 52.55 50.44 2rgk s ASP 88 Cb -0.28 -2.38 0.08 0.00 -1.46 0.00 0.00 42.92 38.87 2rgk s ASP 88 CO 0.34 -1.02 1.05 0.29 0.52 0.00 0.00 175.17 176.35 2rgk n LYS 89 N 6.32 0.00 -0.10 4.34 4.76 -1.26 -0.56 118.16 131.66 2rgk n LYS 89 Ca 0.23 0.46 -0.14 0.00 -2.87 0.00 0.00 58.31 55.99 2rgk n LYS 89 Cb 0.49 -1.50 -0.05 0.00 -1.84 0.00 0.00 35.03 32.13 2rgk n LYS 89 CO 0.00 0.00 0.00 1.17 -1.37 0.00 0.00 177.40 177.20 2rgk n LYS 90 N -1.49 0.53 -0.02 1.97 4.81 -1.26 -4.74 118.16 117.95 2rgk n LYS 90 Ca 0.00 0.35 0.01 0.00 -0.87 0.00 0.00 58.31 57.80 2rgk n LYS 90 Cb 0.02 -1.55 -0.13 0.00 0.02 0.00 0.00 35.03 33.39 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 -4.45 0.32 0.00 5.64 4.01 -1.22 -5.10 117.16 116.37 2rgk n TYR 91 Ca -0.24 0.11 0.00 0.00 -0.16 0.00 0.00 57.90 57.61 2rgk n TYR 91 Cb 0.56 -0.84 0.00 0.00 -0.31 0.00 0.00 39.34 38.75 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 1.45 2.70 7.00 2.72 0.00 0.28 -4.97 105.19 114.36 2rgk n GLY 92 Ca -0.14 -1.94 0.00 0.00 0.00 0.00 0.00 46.02 43.93 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 0.55 -0.64 3.01 -0.02 0.00 -1.26 -4.56 105.19 102.28 2rgk n GLY 93 Ca 0.00 -1.15 -0.14 0.00 0.00 0.00 0.00 46.02 44.73 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 0.55 0.49 1.61 0.51 -1.26 -1.21 118.94 119.63 2rgk s TRP 94 Ca 0.00 -0.33 -0.22 0.00 -2.12 0.00 0.00 56.10 53.43 2rgk s TRP 94 Cb 0.00 -0.34 -0.07 0.00 -0.81 0.00 0.00 33.47 32.25 2rgk s TRP 94 CO 0.00 -0.06 1.16 0.71 -0.51 0.00 0.00 176.95 178.25 2rgk s TYR 95 N -0.86 2.79 0.36 -1.98 2.02 -0.17 -4.67 117.35 114.84 2rgk s TYR 95 Ca -0.05 1.53 0.08 0.00 -0.37 0.00 0.00 57.07 58.26 2rgk s TYR 95 Cb -0.07 -3.37 0.68 0.00 -0.40 0.00 0.00 41.96 38.81 2rgk s TYR 95 CO 0.00 -1.58 1.87 0.00 -1.57 0.00 0.00 175.55 174.27 2rgk h ALA 96 N 1.76 1.40 -2.06 3.71 0.00 -1.07 -3.39 119.26 119.60 2rgk h ALA 96 Ca -0.50 -0.24 -0.06 0.00 0.00 0.00 0.00 54.91 54.12 2rgk h ALA 96 Cb 1.25 -0.10 -0.20 0.00 0.00 0.00 0.00 17.79 18.74 2rgk h ALA 96 CO 0.59 0.41 0.12 0.00 0.00 0.00 0.00 179.25 180.37 2rgk s VAL 98 N -0.36 0.00 0.00 0.00 -7.23 -0.61 -0.58 120.40 111.62 2rgk s VAL 98 Ca -0.05 -1.59 0.00 0.00 -1.81 0.00 0.00 61.98 58.53 2rgk s VAL 98 Cb -0.03 -2.58 0.00 0.00 0.56 0.00 0.00 36.38 34.34 2rgk s VAL 98 CO 0.05 0.00 0.00 -0.46 -0.31 0.00 0.00 175.10 174.38 2rgk n ASN 99 N -1.21 0.00 -0.04 4.85 0.23 -0.10 0.64 115.26 119.64 2rgk n ASN 99 Ca 0.01 0.00 -0.16 0.00 -0.53 0.00 0.00 54.58 53.90 2rgk n ASN 99 Cb 0.62 0.00 -0.07 0.00 -2.08 0.00 0.00 39.78 38.24 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 0.00 0.74 0.32 0.53 3.32 -2.02 -3.25 116.42 116.07 2rgk h ASP 100 Ca 0.00 -0.61 -0.08 0.00 0.02 0.00 0.00 57.03 56.36 2rgk h ASP 100 Cb 0.00 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.32 2rgk h ASP 100 CO 0.00 1.23 -0.37 -0.33 -1.72 0.00 0.00 179.24 178.05 2rgk h GLU 101 N 0.30 0.07 0.00 3.56 3.07 -2.04 -3.49 114.58 116.04 2rgk h GLU 101 Ca -0.03 -0.03 0.00 0.00 -0.50 0.00 0.00 59.36 58.81 2rgk h GLU 101 Cb 1.18 -0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.08 2rgk h GLU 101 CO 0.12 0.43 0.00 0.41 -1.40 0.00 0.00 179.01 178.56 2rgk n GLY 102 N -0.42 -0.16 3.70 -3.84 0.00 -1.23 -5.10 105.19 98.14 2rgk n GLY 102 Ca -0.02 -0.85 -0.42 0.00 0.00 0.00 0.00 46.02 44.73 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 -4.00 4.84 -0.15 1.61 1.01 -1.26 -0.92 120.40 121.53 2rgk s VAL 103 Ca 0.00 1.98 -0.06 0.00 0.00 0.00 0.00 61.98 63.90 2rgk s VAL 103 Cb 0.00 -4.28 -0.24 0.00 0.00 0.00 0.00 36.38 31.85 2rgk s VAL 103 CO 0.00 0.08 0.25 0.52 0.00 0.00 0.00 175.10 175.95 2rgk n VAL 104 N 4.27 1.72 -3.64 2.92 0.31 0.25 -4.86 118.33 119.30 2rgk n VAL 104 Ca 0.07 -0.62 -0.20 0.00 -0.01 0.00 0.00 64.34 63.58 2rgk n VAL 104 Cb 0.50 -1.69 -0.16 0.00 -0.91 0.00 0.00 33.84 31.57 2rgk n VAL 104 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2rgk s ASP 105 N -6.95 1.26 0.00 4.52 3.68 -0.42 -4.96 116.67 113.81 2rgk s ASP 105 Ca -0.25 0.00 0.23 0.00 2.13 0.00 0.00 52.55 54.66 2rgk s ASP 105 Cb 0.07 0.04 0.61 0.00 -1.45 0.00 0.00 42.92 42.19 2rgk s ASP 105 CO 0.73 -0.28 1.49 0.00 0.13 0.00 0.00 175.17 177.25 2rgk n ALA 106 N 5.31 2.49 -1.59 3.66 0.00 -1.26 -1.89 120.51 127.22 2rgk n ALA 106 Ca -0.05 -0.68 -0.34 0.00 0.00 0.00 0.00 53.44 52.37 2rgk n ALA 106 Cb 0.50 -1.00 0.04 0.00 0.00 0.00 0.00 19.45 18.99 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 -1.65 5.14 -0.53 0.00 1.04 -1.26 -3.72 113.70 112.72 2rgk s SER 107 Ca 0.34 2.16 -0.07 0.00 0.48 0.00 0.00 55.95 58.87 2rgk s SER 107 Cb 0.20 -2.57 0.14 0.00 0.10 0.00 0.00 66.02 63.88 2rgk s SER 107 CO 0.29 -1.62 0.38 -0.54 0.98 0.00 0.00 173.24 172.73 2rgk s LYS 108 N -3.74 2.49 -0.17 4.02 -0.14 -0.48 -2.51 119.74 119.20 2rgk s LYS 108 Ca 0.71 -2.02 -0.16 0.00 -1.36 0.00 0.00 55.97 53.14 2rgk s LYS 108 Cb -0.24 -3.85 -0.04 0.00 -1.68 0.00 0.00 37.83 32.02 2rgk s LYS 108 CO 0.37 -1.17 0.40 -0.65 -0.76 0.00 0.00 175.35 173.54 2rgk s GLN 109 N 0.87 4.23 0.13 1.68 -0.21 -1.26 -0.78 119.66 124.32 2rgk s GLN 109 Ca 0.10 0.25 -0.25 0.00 0.02 0.00 0.00 55.36 55.47 2rgk s GLN 109 Cb -0.23 -3.49 -0.03 0.00 1.00 0.00 0.00 33.01 30.26 2rgk s GLN 109 CO -0.03 0.06 1.62 0.78 -2.12 0.00 0.00 175.29 175.61 2rgk h GLY 110 N 7.22 -0.39 0.54 3.09 0.00 -0.90 -1.44 103.07 111.19 2rgk h GLY 110 Ca -0.38 0.34 0.14 0.00 0.00 0.00 0.00 47.33 47.43 2rgk h GLY 110 CO 0.74 -0.22 0.58 0.10 0.00 0.00 0.00 176.54 177.74 2rgk h TYR 111 N -0.39 0.87 -0.05 5.60 -0.00 -1.84 0.20 116.97 121.38 2rgk h TYR 111 Ca 0.08 0.03 -0.16 0.00 0.00 0.00 0.00 58.73 58.68 2rgk h TYR 111 Cb 0.51 -0.28 -0.01 0.00 0.00 0.00 0.00 36.73 36.95 2rgk h TYR 111 CO -0.35 0.33 -0.69 1.96 -0.00 0.00 0.00 178.16 179.42 2rgk h GLN 112 N 0.75 0.23 -0.09 0.10 4.20 -1.82 -2.18 115.11 116.30 2rgk h GLN 112 Ca 0.45 -0.18 -0.14 0.00 0.06 0.00 0.00 58.65 58.84 2rgk h GLN 112 Cb 0.66 0.04 -0.01 0.00 0.30 0.00 0.00 27.48 28.46 2rgk h GLN 112 CO -0.21 0.83 -0.55 0.45 -0.67 0.00 0.00 178.83 178.68 2rgk h HIS 113 N 0.16 0.32 -0.00 2.96 3.86 0.11 -1.65 115.15 120.89 2rgk h HIS 113 Ca -0.02 -0.11 -0.11 0.00 -1.16 0.00 0.00 60.37 58.97 2rgk h HIS 113 Cb 1.23 -0.06 -0.02 0.00 1.06 0.00 0.00 27.41 29.62 2rgk h HIS 113 CO 0.02 0.75 -0.53 0.74 0.86 0.00 0.00 177.93 179.77 2rgk h PHE 114 N 0.20 0.01 -0.12 2.45 0.04 -0.50 -0.71 116.94 118.31 2rgk h PHE 114 Ca 0.00 -0.00 -0.13 0.00 2.80 0.00 0.00 57.97 60.63 2rgk h PHE 114 Cb 1.03 -0.00 -0.01 0.00 2.20 0.00 0.00 35.95 39.16 2rgk h PHE 114 CO 0.02 0.54 -0.51 0.74 -0.60 0.00 0.00 178.31 178.50 2rgk h PHE 115 N 0.01 0.40 -0.70 -0.55 0.04 -1.09 -0.51 116.94 114.55 2rgk h PHE 115 Ca -0.00 -0.13 -0.04 0.00 2.80 0.00 0.00 57.97 60.59 2rgk h PHE 115 Cb 0.94 -0.08 -0.03 0.00 2.20 0.00 0.00 35.95 38.97 2rgk h PHE 115 CO 0.00 0.77 0.29 0.00 -0.60 0.00 0.00 178.31 178.77 2rgk h ALA 116 N 1.20 1.19 -0.55 2.45 0.00 -0.37 0.25 119.26 123.44 2rgk h ALA 116 Ca 0.01 -0.17 -0.11 0.00 0.00 0.00 0.00 54.91 54.63 2rgk h ALA 116 Cb 0.99 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.48 2rgk h ALA 116 CO 0.08 0.59 -0.10 1.25 0.00 0.00 0.00 179.25 181.07 2rgk h LEU 117 N 1.01 1.03 -0.13 0.00 5.85 -0.58 -1.24 115.31 121.25 2rgk h LEU 117 Ca 0.24 -0.34 -0.01 0.00 0.84 0.00 0.00 57.88 58.60 2rgk h LEU 117 Cb 0.18 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 40.92 2rgk h LEU 117 CO -0.02 1.14 0.03 0.25 -0.34 0.00 0.00 178.44 179.49 2rgk h LEU 118 N 0.92 0.21 -0.76 2.25 5.85 -0.25 -0.98 115.31 122.54 2rgk h LEU 118 Ca 0.14 -0.25 0.07 0.00 0.84 0.00 0.00 57.88 58.68 2rgk h LEU 118 Cb 0.67 -0.06 -0.06 0.00 0.37 0.00 0.00 40.66 41.59 2rgk h LEU 118 CO 0.05 0.40 0.45 1.23 -0.34 0.00 0.00 178.44 180.23 2rgk h GLY 119 N 0.00 1.14 0.87 3.75 0.00 -0.40 0.19 103.07 108.63 2rgk h GLY 119 Ca 0.04 -0.31 -0.06 0.00 0.00 0.00 0.00 47.33 47.00 2rgk h GLY 119 CO 0.00 0.19 -0.06 0.00 0.00 0.00 0.00 176.54 176.68 2rgk h ALA 120 N 1.38 0.38 -0.57 3.60 0.00 -1.09 -0.87 119.26 122.09 2rgk h ALA 120 Ca 0.34 -0.27 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 2rgk h ALA 120 Cb 0.21 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.87 2rgk h ALA 120 CO -0.19 0.19 0.25 0.00 0.00 0.00 0.00 179.25 179.50 2rgk h ALA 121 N 0.79 1.37 -0.00 0.00 0.00 -0.74 -1.61 119.26 119.07 2rgk h ALA 121 Ca 0.07 -0.13 -0.17 0.00 0.00 0.00 0.00 54.91 54.68 2rgk h ALA 121 Cb 0.53 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.06 2rgk h ALA 121 CO 0.03 0.48 -0.80 0.77 0.00 0.00 0.00 179.25 179.72 2rgk h SER 122 N 0.81 0.11 -0.10 0.00 0.02 -0.86 -3.11 113.55 110.42 2rgk h SER 122 Ca 0.20 -0.08 -0.09 0.00 -0.84 0.00 0.00 61.79 60.97 2rgk h SER 122 Cb 0.12 -0.03 -0.01 0.00 0.14 0.00 0.00 62.40 62.61 2rgk h SER 122 CO -0.02 0.86 -0.22 0.00 -1.14 0.00 0.00 176.83 176.31 2rgk h ALA 123 N 1.13 1.10 -0.60 3.77 0.00 -0.55 -2.64 119.26 121.47 2rgk h ALA 123 Ca -0.02 -0.33 0.10 0.00 0.00 0.00 0.00 54.91 54.65 2rgk h ALA 123 Cb 1.41 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 19.03 2rgk h ALA 123 CO 0.11 0.56 0.40 0.28 0.00 0.00 0.00 179.25 180.60 2rgk h VAL 124 N 0.47 0.90 0.00 0.00 2.07 -1.24 -0.72 116.25 117.73 2rgk h VAL 124 Ca 0.07 -0.14 0.00 0.00 0.82 0.00 0.00 66.70 67.45 2rgk h VAL 124 Cb 0.64 0.45 0.00 0.00 -1.52 0.00 0.00 31.29 30.87 2rgk h VAL 124 CO 0.05 0.07 0.00 0.35 0.02 0.00 0.00 177.57 178.06 2rgk n THR 125 N -4.47 0.84 0.30 2.57 -2.24 -0.99 -1.91 114.28 108.38 2rgk n THR 125 Ca 0.10 0.19 0.12 0.00 -2.27 0.00 0.00 64.05 62.19 2rgk n THR 125 Cb 0.37 -1.03 0.16 0.00 -2.10 0.00 0.00 70.33 67.73 2rgk n THR 125 CO 0.00 0.00 0.00 0.71 -0.57 0.00 0.00 175.07 175.21 2rgk h THR 126 N 0.00 0.00 0.00 4.28 1.35 -1.24 -3.47 112.91 113.82 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 0.35 1.66 0.00 0.00 -1.73 0.00 0.00 68.15 68.43 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 1.19 0.85 3.57 5.82 0.00 -0.80 -5.00 105.19 110.82 2rgk n GLY 127 Ca 0.03 0.00 -0.52 0.00 0.00 0.00 0.00 46.02 45.53 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 -2.02 1.32 0.31 1.61 -0.00 -1.26 -4.82 115.22 110.35 2rgk n HIS 128 Ca 0.00 0.70 0.19 0.00 -0.00 0.00 0.00 57.72 58.61 2rgk n HIS 128 Cb 0.00 -2.28 0.99 0.00 -0.00 0.00 0.00 29.99 28.69 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 3.97 0.00 -0.02 1.57 0.13 -1.96 -2.29 132.00 133.41 2rgk h PRO 129 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 2rgk h PRO 129 Cb 1.35 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.48 2rgk h PRO 129 CO 0.74 0.00 -0.25 0.39 -0.23 0.00 0.00 178.00 178.65 2rgk n GLU 130 N -3.14 1.58 0.01 0.86 -0.58 -1.26 -4.61 120.64 113.50 2rgk n GLU 130 Ca -0.02 -1.12 -0.12 0.00 -0.42 0.00 0.00 57.16 55.48 2rgk n GLU 130 Cb 0.25 -1.34 -0.07 0.00 -0.57 0.00 0.00 31.44 29.70 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 3.32 0.05 -0.73 0.62 0.00 -1.74 -1.96 119.26 118.82 2rgk h ALA 131 Ca 0.00 -0.10 0.04 0.00 0.00 0.00 0.00 54.91 54.85 2rgk h ALA 131 Cb 0.67 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.40 2rgk h ALA 131 CO 0.00 -0.36 0.44 -0.09 0.00 0.00 0.00 179.25 179.24 2rgk h ARG 132 N -0.13 0.82 -0.90 0.00 9.65 -1.82 -0.32 114.38 121.68 2rgk h ARG 132 Ca 0.01 -0.05 0.04 0.00 -1.10 0.00 0.00 59.98 58.88 2rgk h ARG 132 Cb 0.19 -0.18 -0.06 0.00 -1.39 0.00 0.00 29.97 28.53 2rgk h ARG 132 CO -0.00 0.54 0.58 -0.22 2.80 0.00 0.00 179.97 183.67 2rgk h LYS 133 N 0.84 1.08 -0.10 0.20 3.64 -1.81 -0.56 116.57 119.86 2rgk h LYS 133 Ca 0.30 -0.06 -0.14 0.00 -1.27 0.00 0.00 60.65 59.48 2rgk h LYS 133 Cb 0.09 -0.24 -0.01 0.00 -0.41 0.00 0.00 32.23 31.65 2rgk h LYS 133 CO -0.14 0.71 -0.55 1.25 -2.27 0.00 0.00 179.45 178.45 2rgk h LEU 134 N 1.11 0.32 -0.04 5.20 5.85 -0.52 -2.73 115.31 124.49 2rgk h LEU 134 Ca 0.37 -0.17 -0.02 0.00 0.84 0.00 0.00 57.88 58.90 2rgk h LEU 134 Cb 0.05 -0.09 -0.00 0.00 0.37 0.00 0.00 40.66 40.98 2rgk h LEU 134 CO -0.13 0.81 -0.04 0.25 -0.34 0.00 0.00 178.44 178.99 2rgk h LEU 135 N 0.22 0.11 -0.91 2.25 5.85 -0.38 -1.66 115.31 120.80 2rgk h LEU 135 Ca 0.00 -0.47 0.11 0.00 0.84 0.00 0.00 57.88 58.36 2rgk h LEU 135 Cb 1.04 -0.03 -0.08 0.00 0.37 0.00 0.00 40.66 41.96 2rgk h LEU 135 CO 0.09 0.56 0.54 0.44 -0.34 0.00 0.00 178.44 179.73 2rgk h ASP 136 N -0.34 0.79 -0.02 1.25 3.32 -1.13 0.28 116.42 120.57 2rgk h ASP 136 Ca 0.01 0.05 -0.00 0.00 0.02 0.00 0.00 57.03 57.10 2rgk h ASP 136 Cb 0.52 -0.11 -0.00 0.00 0.22 0.00 0.00 39.33 39.97 2rgk h ASP 136 CO 0.01 0.43 0.00 0.22 -1.72 0.00 0.00 179.24 178.19 2rgk h TYR 137 N 0.89 0.04 -0.99 4.55 3.20 -1.45 -2.24 116.97 120.97 2rgk h TYR 137 Ca 0.44 -0.01 0.07 0.00 3.14 0.00 0.00 58.73 62.38 2rgk h TYR 137 Cb 0.42 -0.01 -0.07 0.00 1.54 0.00 0.00 36.73 38.61 2rgk h TYR 137 CO -0.04 0.30 0.64 1.15 -1.64 0.00 0.00 178.16 178.57 2rgk h THR 138 N -0.23 1.07 -0.58 1.81 2.02 -0.57 -1.27 112.91 115.17 2rgk h THR 138 Ca 0.01 -0.39 -0.00 0.00 0.77 0.00 0.00 66.41 66.79 2rgk h THR 138 Cb 0.28 -0.17 -0.03 0.00 -1.74 0.00 0.00 68.15 66.49 2rgk h THR 138 CO 0.00 0.21 0.36 0.40 0.37 0.00 0.00 175.52 176.86 2rgk h ILE 139 N 1.14 1.17 -0.13 3.11 2.04 -0.84 0.17 117.51 124.17 2rgk h ILE 139 Ca 0.43 -0.37 0.02 0.00 1.00 0.00 0.00 64.86 65.94 2rgk h ILE 139 Cb 0.19 0.36 -0.02 0.00 -0.74 0.00 0.00 36.82 36.62 2rgk h ILE 139 CO -0.17 0.17 0.00 -0.33 0.00 0.00 0.00 178.15 177.82 2rgk h GLU 140 N 0.79 0.04 -0.18 2.37 5.08 -0.64 0.23 114.58 122.27 2rgk h GLU 140 Ca 0.21 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.57 2rgk h GLU 140 Cb -0.03 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.20 2rgk h GLU 140 CO -0.04 0.03 0.11 0.82 -1.00 0.00 0.00 179.01 178.93 2rgk h ILE 141 N 0.04 1.05 0.22 3.13 1.08 -1.04 -1.32 117.51 120.68 2rgk h ILE 141 Ca 0.06 -0.11 -0.01 0.00 -0.39 0.00 0.00 64.86 64.41 2rgk h ILE 141 Cb 0.07 0.81 0.00 0.00 -3.07 0.00 0.00 36.82 34.63 2rgk h ILE 141 CO -0.10 0.05 -0.10 0.40 -0.69 0.00 0.00 178.15 177.71 2rgk h ILE 142 N 0.23 0.80 0.00 -0.67 1.08 -0.36 -0.94 117.51 117.65 2rgk h ILE 142 Ca 0.06 -0.08 0.00 0.00 -0.39 0.00 0.00 64.86 64.46 2rgk h ILE 142 Cb -0.01 0.85 0.00 0.00 -3.07 0.00 0.00 36.82 34.58 2rgk h ILE 142 CO -0.01 0.02 0.00 -0.33 -0.69 0.00 0.00 178.15 177.13 2rgk h GLU 143 N -0.33 0.00 0.08 2.37 5.08 -0.49 -0.17 114.58 121.13 2rgk h GLU 143 Ca -0.03 0.00 -0.33 0.00 -1.00 0.00 0.00 59.36 58.00 2rgk h GLU 143 Cb 0.25 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.48 2rgk h GLU 143 CO 0.05 0.00 -1.79 1.17 -1.00 0.00 0.00 179.01 177.44 2rgk n LYS 144 N -2.54 0.69 0.00 2.33 4.81 -0.50 -4.66 118.16 118.28 2rgk n LYS 144 Ca 0.00 0.36 0.00 0.00 -0.87 0.00 0.00 58.31 57.80 2rgk n LYS 144 Cb 0.17 -1.71 0.00 0.00 0.02 0.00 0.00 35.03 33.51 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 -3.80 0.00 -0.01 5.64 4.01 -0.40 -4.87 117.16 117.73 2rgk n TYR 145 Ca -0.33 0.00 0.01 0.00 -0.16 0.00 0.00 57.90 57.42 2rgk n TYR 145 Cb 0.93 0.00 -0.02 0.00 -0.31 0.00 0.00 39.34 39.93 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 -0.79 0.00 -3.53 -0.72 3.72 -0.22 -4.74 117.46 111.18 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 0.00 -0.10 -0.10 0.00 -0.94 0.00 0.00 39.48 38.34 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 -2.17 3.25 0.03 1.38 -0.11 -0.37 -0.16 118.94 120.77 2rgk s TRP 147 Ca -0.01 -0.84 -0.30 0.00 1.22 0.00 0.00 56.10 56.16 2rgk s TRP 147 Cb 0.02 -2.57 -0.04 0.00 -1.50 0.00 0.00 33.47 29.38 2rgk s TRP 147 CO 0.13 -0.65 1.10 0.45 -4.62 0.00 0.00 176.95 173.37 2rgk s SER 148 N 1.69 7.21 0.02 5.86 0.15 0.28 -4.75 113.70 124.15 2rgk s SER 148 Ca 0.03 1.84 -0.28 0.00 0.70 0.00 0.00 55.95 58.25 2rgk s SER 148 Cb -0.20 -2.57 -0.16 0.00 -1.71 0.00 0.00 66.02 61.38 2rgk s SER 148 CO 0.08 -0.38 1.23 -0.33 1.20 0.00 0.00 173.24 175.04 2rgk h GLU 149 N 6.84 -0.82 -0.08 5.44 4.39 -1.92 0.27 114.58 128.70 2rgk h GLU 149 Ca -0.41 0.06 -0.09 0.00 0.34 0.00 0.00 59.36 59.26 2rgk h GLU 149 Cb 1.21 0.19 -0.01 0.00 -0.10 0.00 0.00 28.75 30.04 2rgk h GLU 149 CO 0.79 -0.50 -0.36 1.05 -1.16 0.00 0.00 179.01 178.82 2rgk h GLU 150 N -1.10 0.15 0.03 2.33 4.11 -1.97 -3.16 114.58 114.97 2rgk h GLU 150 Ca -0.09 -0.06 -0.27 0.00 0.07 0.00 0.00 59.36 59.01 2rgk h GLU 150 Cb 0.70 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.90 2rgk h GLU 150 CO 0.14 0.50 -1.42 0.93 0.07 0.00 0.00 179.01 179.23 2rgk h GLU 151 N 0.13 0.05 -6.02 1.06 5.08 -1.97 -3.48 114.58 109.44 2rgk h GLU 151 Ca 0.01 -0.09 -0.41 0.00 -1.00 0.00 0.00 59.36 57.87 2rgk h GLU 151 Cb 0.70 0.03 0.07 0.00 0.50 0.00 0.00 28.75 30.06 2rgk h GLU 151 CO 0.05 0.81 -0.78 1.04 -1.00 0.00 0.00 179.01 179.13 2rgk n GLN 152 N -3.25 -5.77 -3.95 2.33 1.13 0.94 -4.97 117.38 103.85 2rgk n GLN 152 Ca -0.11 0.69 -0.11 0.00 -1.94 0.00 0.00 57.00 55.53 2rgk n GLN 152 Cb 1.01 -5.47 -0.02 0.00 0.11 0.00 0.00 30.24 25.87 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 -6.05 1.92 -0.00 -1.09 -1.94 -1.24 -4.69 119.30 106.21 2rgk s MET 153 Ca 0.22 -1.44 -0.02 0.00 -1.71 0.00 0.00 55.69 52.74 2rgk s MET 153 Cb -0.11 0.53 -0.04 0.00 2.01 0.00 0.00 34.83 37.22 2rgk s MET 153 CO 0.79 -0.84 0.16 0.00 -0.01 0.00 0.00 175.02 175.12 2rgk s LEU 155 N -1.93 2.62 -0.24 0.00 1.43 0.77 -4.82 118.68 116.51 2rgk s LEU 155 Ca 0.27 0.78 -0.17 0.00 -1.03 0.00 0.00 54.13 53.98 2rgk s LEU 155 Cb -0.12 -3.35 -0.14 0.00 0.03 0.00 0.00 46.19 42.60 2rgk s LEU 155 CO 0.18 -1.77 -0.12 1.21 0.23 0.00 0.00 176.35 176.09 2rgk n GLU 156 N -3.20 0.57 -3.65 1.70 4.07 -1.26 -4.60 120.64 114.27 2rgk n GLU 156 Ca 0.08 0.40 -0.04 0.00 -0.06 0.00 0.00 57.16 57.54 2rgk n GLU 156 Cb 0.60 -1.60 -0.01 0.00 -0.06 0.00 0.00 31.44 30.37 2rgk n GLU 156 CO 0.00 0.00 0.00 -1.54 -0.06 0.00 0.00 177.13 175.53 2rgk s SER 157 N -7.11 -0.19 0.08 4.31 1.04 -1.26 -0.29 113.70 110.28 2rgk s SER 157 Ca -0.34 -0.21 -0.02 0.00 0.48 0.00 0.00 55.95 55.86 2rgk s SER 157 Cb 0.10 0.36 -0.03 0.00 0.10 0.00 0.00 66.02 66.55 2rgk s SER 157 CO 0.52 -0.64 0.04 0.26 0.98 0.00 0.00 173.24 174.40 2rgk s TRP 158 N -2.98 0.56 0.94 5.02 0.52 0.04 -0.70 118.94 122.34 2rgk s TRP 158 Ca 0.11 -1.04 -0.12 0.00 0.02 0.00 0.00 56.10 55.07 2rgk s TRP 158 Cb 0.00 -0.35 0.16 0.00 -1.15 0.00 0.00 33.47 32.12 2rgk s TRP 158 CO -0.02 -0.45 1.12 0.16 0.02 0.00 0.00 176.95 177.77 2rgk s ASP 159 N -2.95 3.17 0.25 2.95 -4.77 -1.09 -1.39 116.67 112.84 2rgk s ASP 159 Ca 0.12 1.03 -0.06 0.00 -3.30 0.00 0.00 52.55 50.34 2rgk s ASP 159 Cb 0.07 -1.64 0.47 0.00 -1.09 0.00 0.00 42.92 40.73 2rgk s ASP 159 CO -0.07 -2.77 1.65 -0.08 0.70 0.00 0.00 175.17 174.60 2rgk h GLU 160 N -1.65 0.14 -0.33 2.11 4.81 -1.91 -1.58 114.58 116.18 2rgk h GLU 160 Ca -0.52 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 58.70 2rgk h GLU 160 Cb 1.33 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 30.68 2rgk h GLU 160 CO 0.61 0.09 0.00 0.00 -0.73 0.00 0.00 179.01 178.98 2rgk n ALA 161 N -2.85 2.51 -3.76 2.92 0.00 -1.26 -4.85 120.51 113.21 2rgk n ALA 161 Ca 0.14 -0.51 -0.24 0.00 0.00 0.00 0.00 53.44 52.83 2rgk n ALA 161 Cb 0.49 -0.98 0.03 0.00 0.00 0.00 0.00 19.45 18.99 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 0.31 -2.10 -0.09 0.00 3.72 -0.59 -4.89 117.46 113.81 2rgk n PHE 162 Ca 0.09 0.87 -0.12 0.00 -0.05 0.00 0.00 57.45 58.24 2rgk n PHE 162 Cb 0.27 -4.31 -0.15 0.00 -0.94 0.00 0.00 39.48 34.35 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 -2.98 0.74 -3.76 4.37 3.41 -1.26 -4.95 113.62 109.19 2rgk n SER 163 Ca -0.17 0.04 -0.15 0.00 -0.26 0.00 0.00 58.87 58.33 2rgk n SER 163 Cb 0.62 0.39 -0.16 0.00 -0.26 0.00 0.00 64.21 64.80 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 -0.01 0.09 4.33 2.20 -1.26 -5.05 119.74 117.51 2rgk s LYS 164 Ca -0.16 0.24 -0.13 0.00 -0.36 0.00 0.00 55.97 55.57 2rgk s LYS 164 Cb 0.07 -0.25 -0.06 0.00 -1.51 0.00 0.00 37.83 36.08 2rgk s LYS 164 CO 0.77 -0.18 0.46 -0.08 -0.36 0.00 0.00 175.35 175.96 2rgk s THR 165 N 1.17 4.99 0.32 3.43 -1.32 -1.26 -2.69 115.64 120.28 2rgk s THR 165 Ca -0.08 0.67 -0.29 0.00 -1.21 0.00 0.00 61.69 60.78 2rgk s THR 165 Cb -0.13 -3.70 -0.11 0.00 -1.51 0.00 0.00 72.50 67.06 2rgk s THR 165 CO -0.04 0.33 1.51 -0.70 -2.21 0.00 0.00 174.62 173.52 2rgk s GLU 166 N -1.75 4.15 -1.44 7.08 2.12 0.12 -4.88 118.70 124.10 2rgk s GLU 166 Ca 0.33 2.51 -0.09 0.00 0.36 0.00 0.00 54.97 58.08 2rgk s GLU 166 Cb -0.15 -3.02 0.05 0.00 0.26 0.00 0.00 34.13 31.27 2rgk s GLU 166 CO 0.18 -0.53 2.46 0.39 -0.54 0.00 0.00 175.26 177.21 2rgk n GLU 167 N 1.41 3.84 -3.58 4.30 1.02 -1.26 -4.74 120.64 121.63 2rgk n GLU 167 Ca 0.04 -2.92 -0.15 0.00 -0.02 0.00 0.00 57.16 54.12 2rgk n GLU 167 Cb 0.39 -2.85 -0.06 0.00 -0.02 0.00 0.00 31.44 28.90 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 0.93 -0.46 -0.04 -0.32 5.04 -1.26 -4.49 117.35 116.74 2rgk s TYR 168 Ca 0.56 0.63 0.01 0.00 -2.44 0.00 0.00 57.07 55.82 2rgk s TYR 168 Cb 0.16 0.33 0.02 0.00 0.35 0.00 0.00 41.96 42.83 2rgk s TYR 168 CO -0.06 -0.61 -0.03 1.03 -1.34 0.00 0.00 175.55 174.54 2rgk s ARG 169 N -1.98 0.64 0.10 4.97 1.81 -0.71 -4.24 118.95 119.54 2rgk s ARG 169 Ca -0.08 -0.04 0.09 0.00 -1.72 0.00 0.00 55.73 53.99 2rgk s ARG 169 Cb -0.01 -0.72 -0.03 0.00 -0.45 0.00 0.00 34.95 33.73 2rgk s ARG 169 CO 0.02 -0.11 -0.23 0.20 -0.68 0.00 0.00 175.30 174.50 2rgk s GLY 170 N 0.99 1.34 0.21 -3.53 0.00 -1.26 -1.18 107.32 103.90 2rgk s GLY 170 Ca -0.10 -1.29 -0.05 0.00 0.00 0.00 0.00 44.72 43.28 2rgk s GLY 170 CO -0.01 -1.27 1.64 -1.33 0.00 0.00 0.00 173.10 172.13 2rgk h GLY 171 N 4.17 0.88 0.82 0.20 0.00 -1.47 -3.14 103.07 104.55 2rgk h GLY 171 Ca -0.47 -0.73 0.02 0.00 0.00 0.00 0.00 47.33 46.16 2rgk h GLY 171 CO 0.40 0.66 0.15 -0.57 0.00 0.00 0.00 176.54 177.18 2rgk h ASN 172 N 0.72 0.21 -0.60 0.19 -0.73 -1.96 0.61 115.58 114.01 2rgk h ASN 172 Ca 0.11 0.02 -0.01 0.00 1.87 0.00 0.00 56.30 58.29 2rgk h ASN 172 Cb 0.69 -0.02 -0.03 0.00 0.27 0.00 0.00 38.32 39.23 2rgk h ASN 172 CO 0.05 0.16 0.36 0.00 -0.37 0.00 0.00 177.43 177.63 2rgk h ALA 173 N 1.17 0.77 0.00 1.57 0.00 -1.94 -1.93 119.26 118.91 2rgk h ALA 173 Ca 0.13 -0.08 -0.07 0.00 0.00 0.00 0.00 54.91 54.89 2rgk h ALA 173 Cb 0.06 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 2rgk h ALA 173 CO -0.10 0.26 -0.33 -0.91 0.00 0.00 0.00 179.25 178.17 2rgk h ASN 174 N 0.82 0.00 -0.34 0.00 4.21 -1.32 -1.98 115.58 116.96 2rgk h ASN 174 Ca 0.22 0.00 -0.14 0.00 1.21 0.00 0.00 56.30 57.59 2rgk h ASN 174 Cb -0.00 0.00 -0.01 0.00 -1.12 0.00 0.00 38.32 37.19 2rgk h ASN 174 CO -0.04 0.33 -0.33 -0.03 -1.29 0.00 0.00 177.43 176.07 2rgk h MET 175 N 0.00 0.83 0.00 0.81 4.05 0.93 -2.22 114.93 119.33 2rgk h MET 175 Ca -0.00 -0.43 0.00 0.00 -0.28 0.00 0.00 59.70 58.99 2rgk h MET 175 Cb 0.66 0.01 0.00 0.00 -0.80 0.00 0.00 31.60 31.48 2rgk h MET 175 CO 0.04 1.07 0.00 0.45 0.23 0.00 0.00 176.91 178.70 2rgk h HIS 176 N 0.62 0.00 -0.18 1.39 3.86 -1.22 -1.08 115.15 118.53 2rgk h HIS 176 Ca 0.06 0.00 -0.08 0.00 -1.16 0.00 0.00 60.37 59.18 2rgk h HIS 176 Cb 0.91 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 29.38 2rgk h HIS 176 CO 0.07 0.00 -0.22 0.00 0.86 0.00 0.00 177.93 178.64 2rgk h ALA 177 N 2.12 0.27 -0.06 2.45 0.00 -1.18 0.82 119.26 123.68 2rgk h ALA 177 Ca 0.00 -0.36 0.02 0.00 0.00 0.00 0.00 54.91 54.57 2rgk h ALA 177 Cb 0.74 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.46 2rgk h ALA 177 CO 0.00 0.22 -0.05 0.28 0.00 0.00 0.00 179.25 179.69 2rgk h VAL 178 N 0.12 0.84 -0.23 0.00 2.07 -0.90 0.61 116.25 118.75 2rgk h VAL 178 Ca 0.02 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.60 2rgk h VAL 178 Cb 0.77 0.84 -0.07 0.00 -1.52 0.00 0.00 31.29 31.31 2rgk h VAL 178 CO 0.05 0.00 -0.21 -0.08 0.02 0.00 0.00 177.57 177.35 2rgk h GLU 179 N -0.07 -0.21 -0.65 1.57 4.81 -1.11 -1.79 114.58 117.14 2rgk h GLU 179 Ca 0.05 0.01 -0.06 0.00 -0.13 0.00 0.00 59.36 59.23 2rgk h GLU 179 Cb 0.13 0.05 -0.03 0.00 0.63 0.00 0.00 28.75 29.53 2rgk h GLU 179 CO -0.10 -0.14 0.18 0.00 -0.73 0.00 0.00 179.01 178.21 2rgk h ALA 180 N 0.86 0.85 -0.64 2.92 0.00 -0.29 -2.93 119.26 120.04 2rgk h ALA 180 Ca 0.13 -0.23 0.02 0.00 0.00 0.00 0.00 54.91 54.84 2rgk h ALA 180 Cb 0.42 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.93 2rgk h ALA 180 CO -0.36 0.55 0.42 0.74 0.00 0.00 0.00 179.25 180.60 2rgk h PHE 181 N 0.95 0.78 -0.37 0.00 0.04 0.71 -1.86 116.94 117.18 2rgk h PHE 181 Ca 0.21 0.02 0.02 0.00 2.80 0.00 0.00 57.97 61.01 2rgk h PHE 181 Cb 0.33 -0.26 -0.02 0.00 2.20 0.00 0.00 35.95 38.20 2rgk h PHE 181 CO 0.02 0.47 0.22 -0.07 -0.60 0.00 0.00 178.31 178.36 2rgk h LEU 182 N 0.82 0.36 -0.41 1.54 3.38 -1.14 0.61 115.31 120.46 2rgk h LEU 182 Ca 0.24 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 58.05 2rgk h LEU 182 Cb -0.03 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 40.65 2rgk h LEU 182 CO -0.06 0.26 -0.46 0.40 0.09 0.00 0.00 178.44 178.67 2rgk h ILE 183 N 0.45 1.28 -0.74 1.22 1.08 -1.54 -1.40 117.51 117.86 2rgk h ILE 183 Ca 0.15 -1.65 -0.00 0.00 -0.39 0.00 0.00 64.86 62.97 2rgk h ILE 183 Cb 0.00 1.53 -0.04 0.00 -3.07 0.00 0.00 36.82 35.24 2rgk h ILE 183 CO -0.07 0.54 0.45 0.58 -0.69 0.00 0.00 178.15 178.96 2rgk h VAL 184 N 0.66 1.21 -0.46 1.67 2.07 -1.09 -1.23 116.25 119.08 2rgk h VAL 184 Ca 0.04 -0.45 -0.04 0.00 0.82 0.00 0.00 66.70 67.07 2rgk h VAL 184 Cb 1.04 0.16 -0.02 0.00 -1.52 0.00 0.00 31.29 30.96 2rgk h VAL 184 CO 0.10 0.21 0.13 0.22 0.02 0.00 0.00 177.57 178.26 2rgk h TYR 185 N 1.02 0.76 -0.64 1.57 3.20 -0.59 -2.65 116.97 119.64 2rgk h TYR 185 Ca 0.27 -0.08 -0.01 0.00 3.14 0.00 0.00 58.73 62.04 2rgk h TYR 185 Cb -0.05 -0.22 -0.03 0.00 1.54 0.00 0.00 36.73 37.98 2rgk h TYR 185 CO 0.00 0.68 0.34 -0.44 -1.64 0.00 0.00 178.16 177.10 2rgk h ASP 186 N 0.62 0.79 -0.53 -2.11 3.32 -0.20 0.24 116.42 118.54 2rgk h ASP 186 Ca 0.15 -0.06 0.00 0.00 0.02 0.00 0.00 57.03 57.13 2rgk h ASP 186 Cb 0.29 -0.20 0.00 0.00 0.22 0.00 0.00 39.33 39.64 2rgk h ASP 186 CO -0.00 0.65 0.00 1.33 -1.72 0.00 0.00 179.24 179.50 2rgk n VAL 187 N -4.37 2.25 0.00 -1.35 0.24 -0.57 -4.34 118.33 110.20 2rgk n VAL 187 Ca 0.06 -1.20 0.00 0.00 -2.04 0.00 0.00 64.34 61.16 2rgk n VAL 187 Cb 0.11 -0.20 0.00 0.00 -1.47 0.00 0.00 33.84 32.27 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 0.68 0.00 -4.07 3.34 -2.24 -1.02 -5.03 114.28 105.95 2rgk n THR 188 Ca 0.24 0.00 -0.27 0.00 -2.27 0.00 0.00 64.05 61.75 2rgk n THR 188 Cb 1.02 0.00 -0.05 0.00 -2.10 0.00 0.00 70.33 69.21 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 -0.10 -1.53 -3.90 4.78 -0.00 0.81 -4.92 115.22 110.36 2rgk n HIS 189 Ca 0.00 0.70 -0.33 0.00 -0.00 0.00 0.00 57.72 58.09 2rgk n HIS 189 Cb 0.00 -3.45 -0.13 0.00 -0.00 0.00 0.00 29.99 26.41 2rgk n HIS 189 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 176.34 176.68 2rgk s ASP 190 N -4.37 4.90 0.61 0.41 -1.08 -1.26 -4.99 116.67 110.89 2rgk s ASP 190 Ca 0.01 -2.34 0.24 0.00 -0.52 0.00 0.00 52.55 49.94 2rgk s ASP 190 Cb -0.00 -1.72 0.96 0.00 -1.46 0.00 0.00 42.92 40.70 2rgk s ASP 190 CO 0.92 -0.41 1.41 0.07 0.52 0.00 0.00 175.17 177.69 2rgk h LYS 191 N 7.50 0.00 -0.83 4.34 2.10 -1.92 -2.31 116.57 125.45 2rgk h LYS 191 Ca -0.07 0.00 0.20 0.00 -2.00 0.00 0.00 60.65 58.78 2rgk h LYS 191 Cb 1.00 0.00 -0.13 0.00 -0.90 0.00 0.00 32.23 32.20 2rgk h LYS 191 CO 0.63 0.00 0.19 -0.22 -2.00 0.00 0.00 179.45 178.05 2rgk h LYS 192 N 0.00 0.21 0.00 0.07 3.64 -1.98 0.34 116.57 118.85 2rgk h LYS 192 Ca 0.36 -0.01 -0.08 0.00 -1.27 0.00 0.00 60.65 59.64 2rgk h LYS 192 Cb 2.38 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 34.14 2rgk h LYS 192 CO -0.00 0.14 -0.40 -1.49 -2.27 0.00 0.00 179.45 175.43 2rgk h TRP 193 N 0.22 0.00 0.01 1.91 4.06 -1.75 -0.41 115.95 119.99 2rgk h TRP 193 Ca 0.49 0.00 -0.22 0.00 2.06 0.00 0.00 58.89 61.22 2rgk h TRP 193 Cb 0.94 0.00 -0.03 0.00 -1.00 0.00 0.00 29.16 29.07 2rgk h TRP 193 CO -0.28 0.40 -1.09 1.25 -3.56 0.00 0.00 178.44 175.15 2rgk h LEU 194 N 0.00 0.02 -0.46 -4.49 5.85 -0.96 -2.56 115.31 112.72 2rgk h LEU 194 Ca -0.00 -0.03 -0.09 0.00 0.84 0.00 0.00 57.88 58.60 2rgk h LEU 194 Cb 0.73 -0.01 -0.02 0.00 0.37 0.00 0.00 40.66 41.73 2rgk h LEU 194 CO 0.05 1.02 -0.06 0.44 -0.34 0.00 0.00 178.44 179.56 2rgk h ASP 195 N 0.00 0.84 -0.40 1.25 3.32 -0.07 -1.82 116.42 119.56 2rgk h ASP 195 Ca -0.05 -0.34 -0.06 0.00 0.02 0.00 0.00 57.03 56.60 2rgk h ASP 195 Cb 1.81 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 41.11 2rgk h ASP 195 CO 0.13 0.98 0.00 0.03 -1.72 0.00 0.00 179.24 178.66 2rgk h ARG 196 N 0.69 0.70 -0.00 3.56 3.08 -1.12 -1.74 114.38 119.55 2rgk h ARG 196 Ca 0.12 -0.22 0.02 0.00 0.07 0.00 0.00 59.98 59.97 2rgk h ARG 196 Cb 0.58 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.55 2rgk h ARG 196 CO 0.03 0.79 -0.10 0.00 -1.07 0.00 0.00 179.97 179.62 2rgk h ALA 197 N 0.89 -0.11 -0.20 0.04 0.00 -1.30 -1.17 119.26 117.42 2rgk h ALA 197 Ca 0.11 0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.97 2rgk h ALA 197 Cb 0.47 0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 2rgk h ALA 197 CO 0.02 -0.59 -0.16 0.97 0.00 0.00 0.00 179.25 179.48 2rgk h ILE 198 N -0.17 1.22 0.35 0.00 2.10 -1.33 -2.54 117.51 117.13 2rgk h ILE 198 Ca 0.04 -0.97 -0.02 0.00 1.08 0.00 0.00 64.86 64.99 2rgk h ILE 198 Cb 0.22 1.25 0.00 0.00 -1.09 0.00 0.00 36.82 37.20 2rgk h ILE 198 CO -0.10 0.31 -0.17 -0.09 -1.08 0.00 0.00 178.15 177.01 2rgk h ARG 199 N 0.31 -0.45 0.00 2.19 9.65 -0.69 0.12 114.38 125.50 2rgk h ARG 199 Ca 0.06 0.03 -0.04 0.00 -1.10 0.00 0.00 59.98 58.93 2rgk h ARG 199 Cb 0.48 0.10 -0.01 0.00 -1.39 0.00 0.00 29.97 29.15 2rgk h ARG 199 CO 0.03 -0.22 -0.18 -0.39 2.80 0.00 0.00 179.97 182.01 2rgk h VAL 200 N -0.60 1.00 -0.07 0.20 -1.51 -1.18 -1.79 116.25 112.30 2rgk h VAL 200 Ca -0.05 -0.64 -0.16 0.00 -1.23 0.00 0.00 66.70 64.62 2rgk h VAL 200 Cb 0.44 1.36 -0.01 0.00 -2.13 0.00 0.00 31.29 30.94 2rgk h VAL 200 CO 0.08 0.17 -0.66 0.00 -1.23 0.00 0.00 177.57 175.93 2rgk h ALA 201 N 1.82 0.73 -0.20 5.19 0.00 -1.15 -1.18 119.26 124.48 2rgk h ALA 201 Ca -0.00 -0.58 -0.15 0.00 0.00 0.00 0.00 54.91 54.19 2rgk h ALA 201 Cb 0.34 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 2rgk h ALA 201 CO 0.02 0.75 -0.48 0.66 0.00 0.00 0.00 179.25 180.20 2rgk h SER 202 N 0.22 0.59 0.29 0.00 4.64 0.06 -1.17 113.55 118.17 2rgk h SER 202 Ca -0.02 -0.29 -0.01 0.00 -0.47 0.00 0.00 61.79 61.00 2rgk h SER 202 Cb 1.20 -0.17 0.00 0.00 -0.31 0.00 0.00 62.40 63.12 2rgk h SER 202 CO 0.11 0.98 -0.14 0.58 -0.87 0.00 0.00 176.83 177.48 2rgk h VAL 203 N 0.43 0.43 -0.08 0.95 2.07 -1.24 0.17 116.25 118.98 2rgk h VAL 203 Ca 0.02 -0.82 -0.19 0.00 0.82 0.00 0.00 66.70 66.53 2rgk h VAL 203 Cb 1.00 0.71 -0.00 0.00 -1.52 0.00 0.00 31.29 31.48 2rgk h VAL 203 CO 0.09 0.11 -0.75 0.40 0.02 0.00 0.00 177.57 177.44 2rgk h ILE 204 N -0.99 1.37 0.00 4.57 2.04 -1.31 -3.16 117.51 120.03 2rgk h ILE 204 Ca -0.04 -2.14 -0.10 0.00 1.00 0.00 0.00 64.86 63.58 2rgk h ILE 204 Cb 0.48 2.12 -0.01 0.00 -0.74 0.00 0.00 36.82 38.66 2rgk h ILE 204 CO 0.07 0.65 -1.18 -0.38 0.00 0.00 0.00 178.15 177.30 2rgk n ILE 205 N -3.84 1.40 0.02 -0.67 2.08 -0.54 -2.60 119.36 115.21 2rgk n ILE 205 Ca -0.05 0.06 0.02 0.00 0.56 0.00 0.00 62.75 63.35 2rgk n ILE 205 Cb 0.72 -2.11 0.37 0.00 -0.75 0.00 0.00 39.64 37.87 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 -0.82 0.49 0.02 1.39 2.76 -1.09 0.12 115.15 118.02 2rgk h HIS 206 Ca -0.15 -0.02 -0.35 0.00 -2.20 0.00 0.00 60.37 57.65 2rgk h HIS 206 Cb 0.99 -0.15 -0.05 0.00 1.55 0.00 0.00 27.41 29.74 2rgk h HIS 206 CO -0.28 0.42 -2.14 -0.25 -1.30 0.00 0.00 177.93 174.38 2rgk n ASP 207 N -4.37 1.05 -0.08 3.26 8.00 0.58 -4.44 116.55 120.56 2rgk n ASP 207 Ca 0.02 0.13 -0.17 0.00 0.71 0.00 0.00 54.79 55.48 2rgk n ASP 207 Cb 0.16 0.06 -0.06 0.00 -0.02 0.00 0.00 41.12 41.26 2rgk n ASP 207 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 2rgk n VAL 208 N -3.08 1.15 -0.15 2.53 0.31 -1.19 -4.43 118.33 113.47 2rgk n VAL 208 Ca -0.31 -0.15 -0.08 0.00 -0.01 0.00 0.00 64.34 63.79 2rgk n VAL 208 Cb 1.07 -1.85 0.00 0.00 -0.91 0.00 0.00 33.84 32.16 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 -0.69 0.57 -0.78 3.52 0.00 -1.24 -2.78 119.26 117.86 2rgk h ALA 209 Ca -0.37 -0.11 0.18 0.00 0.00 0.00 0.00 54.91 54.61 2rgk h ALA 209 Cb 1.25 -0.18 -0.05 0.00 0.00 0.00 0.00 17.79 18.81 2rgk h ALA 209 CO -0.22 0.13 0.53 -0.09 0.00 0.00 0.00 179.25 179.59 2rgk h ARG 210 N 0.58 0.29 -0.57 0.00 2.43 -1.19 0.87 114.38 116.79 2rgk h ARG 210 Ca 0.15 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.31 2rgk h ARG 210 Cb 0.10 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 29.59 2rgk h ARG 210 CO -0.02 0.19 0.00 0.27 -1.51 0.00 0.00 179.97 178.90 2rgk n ASN 211 N -4.45 5.08 -2.28 -3.80 2.04 -1.06 -4.19 115.26 106.60 2rgk n ASN 211 Ca 0.16 -2.72 -0.17 0.00 -0.44 0.00 0.00 54.58 51.41 2rgk n ASN 211 Cb 0.64 -0.61 0.03 0.00 -2.53 0.00 0.00 39.78 37.30 2rgk n ASN 211 CO 0.00 0.00 0.00 -3.20 -0.44 0.00 0.00 177.26 173.62 2rgk n ASN 212 N 0.71 3.93 -2.41 0.53 4.05 0.11 -4.92 115.26 117.26 2rgk n ASN 212 Ca 0.26 -3.25 -0.18 0.00 0.45 0.00 0.00 54.58 51.86 2rgk n ASN 212 Cb 1.02 -0.39 -0.01 0.00 1.23 0.00 0.00 39.78 41.63 2rgk n ASN 212 CO 0.00 0.00 0.00 1.41 -3.05 0.00 0.00 177.26 175.62 2rgk n HIS 213 N -0.66 -1.15 -1.40 1.20 8.25 -1.23 -0.91 115.22 119.32 2rgk n HIS 213 Ca 0.33 0.00 -0.14 0.00 -0.26 0.00 0.00 57.72 57.65 2rgk n HIS 213 Cb 0.91 -3.50 -0.06 0.00 1.12 0.00 0.00 29.99 28.46 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 -3.75 0.00 -3.10 4.41 4.02 -0.09 -4.80 117.16 113.85 2rgk n TYR 214 Ca -0.21 0.00 -0.41 0.00 -0.01 0.00 0.00 57.90 57.27 2rgk n TYR 214 Cb 0.66 -2.67 -0.06 0.00 -0.02 0.00 0.00 39.34 37.25 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 -3.08 3.90 0.03 -0.72 0.52 -0.08 -4.70 118.95 114.81 2rgk s ARG 215 Ca 0.00 0.32 -0.30 0.00 -0.52 0.00 0.00 55.73 55.23 2rgk s ARG 215 Cb 0.00 -3.73 -0.05 0.00 0.52 0.00 0.00 34.95 31.69 2rgk s ARG 215 CO 0.00 -0.58 1.21 0.08 0.02 0.00 0.00 175.30 176.02 2rgk s VAL 216 N 2.64 4.08 -0.17 3.52 1.01 -1.26 -4.59 120.40 125.63 2rgk s VAL 216 Ca 0.26 1.48 -0.24 0.00 0.00 0.00 0.00 61.98 63.47 2rgk s VAL 216 Cb -0.15 -3.95 -0.02 0.00 0.00 0.00 0.00 36.38 32.27 2rgk s VAL 216 CO 0.12 0.08 0.78 0.21 0.00 0.00 0.00 175.10 176.29 2rgk s ASN 217 N 1.20 6.90 -0.10 3.32 3.84 -1.26 -4.55 114.94 124.29 2rgk s ASN 217 Ca 0.58 1.10 0.10 0.00 0.21 0.00 0.00 52.86 54.86 2rgk s ASN 217 Cb -0.28 -2.43 -0.24 0.00 -0.55 0.00 0.00 41.25 37.75 2rgk s ASN 217 CO 0.27 -0.36 0.44 1.21 -2.79 0.00 0.00 177.10 175.87 2rgk n GLU 218 N 5.13 0.67 -3.90 0.43 0.00 -1.26 -4.71 120.64 116.99 2rgk n GLU 218 Ca 0.03 0.22 -0.35 0.00 0.00 0.00 0.00 57.16 57.06 2rgk n GLU 218 Cb 0.49 -1.71 -0.08 0.00 0.00 0.00 0.00 31.44 30.14 2rgk n GLU 218 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.13 176.12 2rgk s HIS 219 N -2.56 3.37 0.05 4.31 0.09 -1.26 -1.27 115.29 118.02 2rgk s HIS 219 Ca -0.10 0.26 0.00 0.00 -0.00 0.00 0.00 55.06 55.22 2rgk s HIS 219 Cb 0.07 -2.07 -0.03 0.00 -0.00 0.00 0.00 32.58 30.55 2rgk s HIS 219 CO 0.80 0.32 -0.04 -0.06 -0.00 0.00 0.00 174.74 175.76 2rgk s PHE 220 N 0.06 0.57 0.77 1.40 0.40 -0.33 -0.42 117.98 120.43 2rgk s PHE 220 Ca 0.08 -0.83 -0.03 0.00 -0.60 0.00 0.00 56.93 55.54 2rgk s PHE 220 Cb -0.12 -0.37 0.15 0.00 0.51 0.00 0.00 43.02 43.18 2rgk s PHE 220 CO 0.00 -0.24 1.06 0.16 0.70 0.00 0.00 175.22 176.90 2rgk s ASP 221 N -2.43 4.07 0.61 1.36 1.47 0.25 -1.73 116.67 120.27 2rgk s ASP 221 Ca 0.00 -0.28 0.30 0.00 1.18 0.00 0.00 52.55 53.75 2rgk s ASP 221 Cb 0.01 -0.00 1.63 0.00 -0.34 0.00 0.00 42.92 44.22 2rgk s ASP 221 CO -0.05 -2.06 2.00 0.74 0.68 0.00 0.00 175.17 176.48 2rgk h THR 222 N -0.76 0.30 -0.54 2.11 2.02 -1.90 0.36 112.91 114.50 2rgk h THR 222 Ca -0.37 0.00 0.00 0.00 0.77 0.00 0.00 66.41 66.81 2rgk h THR 222 Cb 1.26 0.73 0.00 0.00 -1.74 0.00 0.00 68.15 68.40 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 -3.51 2.83 -2.38 6.66 1.13 -1.26 -4.91 117.38 115.94 2rgk n GLN 223 Ca 0.03 -2.19 -0.19 0.00 -1.94 0.00 0.00 57.00 52.71 2rgk n GLN 223 Cb 0.44 -1.64 -0.01 0.00 0.11 0.00 0.00 30.24 29.14 2rgk n GLN 223 CO 0.00 0.00 0.00 0.91 -1.44 0.00 0.00 177.06 176.53 2rgk n TRP 224 N 0.99 -0.93 -3.26 1.08 7.02 0.13 -4.99 117.44 117.48 2rgk n TRP 224 Ca 0.20 0.02 -0.38 0.00 -1.02 0.00 0.00 57.50 56.32 2rgk n TRP 224 Cb 0.63 -3.68 -0.06 0.00 -2.42 0.00 0.00 31.31 25.79 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 -2.19 6.88 0.41 -0.99 0.01 -1.25 -4.80 114.94 113.01 2rgk s ASN 225 Ca 0.01 1.05 -0.26 0.00 -0.71 0.00 0.00 52.86 52.95 2rgk s ASN 225 Cb -0.01 -2.33 -0.08 0.00 0.41 0.00 0.00 41.25 39.24 2rgk s ASN 225 CO 0.02 0.09 1.25 -2.16 -1.51 0.00 0.00 177.10 174.79 2rgk s PRO 226 N -0.02 3.96 -0.72 -0.60 0.04 -1.26 -0.58 135.00 135.83 2rgk s PRO 226 Ca 0.29 2.04 0.04 0.00 0.04 0.00 0.00 61.00 63.41 2rgk s PRO 226 Cb -0.17 -2.70 0.21 0.00 0.04 0.00 0.00 34.50 31.88 2rgk s PRO 226 CO 0.15 -0.46 0.67 1.28 0.04 0.00 0.00 177.00 178.68 2rgk n LEU 227 N 0.06 3.59 0.18 -3.56 4.77 0.44 -4.85 117.00 117.63 2rgk n LEU 227 Ca 0.04 -5.30 0.17 0.00 -0.03 0.00 0.00 56.01 50.89 2rgk n LEU 227 Cb 0.45 -0.78 0.80 0.00 -2.33 0.00 0.00 43.42 41.55 2rgk n LEU 227 CO 0.54 1.86 1.15 1.55 -1.33 0.00 0.00 177.39 181.15 2rgk h PRO 228 N 4.96 0.00 -0.63 3.23 0.13 -1.94 -1.90 132.00 135.85 2rgk h PRO 228 Ca 0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.30 2rgk h PRO 228 Cb 0.72 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.85 2rgk h PRO 228 CO 0.81 0.00 0.00 -0.25 -0.23 0.00 0.00 178.00 178.33 2rgk n ASP 229 N -3.89 3.53 -4.67 1.44 10.43 -1.26 -4.53 116.55 117.60 2rgk n ASP 229 Ca 0.03 -2.08 -0.46 0.00 2.57 0.00 0.00 54.79 54.84 2rgk n ASP 229 Cb 0.37 -0.44 -0.04 0.00 1.84 0.00 0.00 41.12 42.84 2rgk n ASP 229 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 2rgk n TYR 230 N 1.25 2.32 -1.59 1.24 9.36 -0.72 -0.89 117.16 128.13 2rgk n TYR 230 Ca 0.21 0.15 -0.19 0.00 3.32 0.00 0.00 57.90 61.40 2rgk n TYR 230 Cb 0.58 -2.60 -0.08 0.00 -0.63 0.00 0.00 39.34 36.62 2rgk n TYR 230 CO 0.00 0.00 0.00 0.09 0.22 0.00 0.00 176.86 177.17 2rgk n ASN 231 N 4.61 -5.25 -0.14 2.98 3.02 -1.26 -4.09 115.26 115.12 2rgk n ASN 231 Ca 0.19 0.43 0.03 0.00 -0.03 0.00 0.00 54.58 55.20 2rgk n ASN 231 Cb 0.30 -4.39 0.33 0.00 -0.61 0.00 0.00 39.78 35.41 2rgk n ASN 231 CO 0.00 0.00 0.00 0.50 -2.62 0.00 0.00 177.26 175.14 2rgk h LYS 232 N 0.00 0.77 -0.16 3.52 3.64 -1.37 -1.55 116.57 121.43 2rgk h LYS 232 Ca -0.38 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 58.95 2rgk h LYS 232 Cb 1.22 -0.17 0.00 0.00 -0.41 0.00 0.00 32.23 32.87 2rgk h LYS 232 CO 0.56 0.51 0.00 -0.40 -2.27 0.00 0.00 179.45 177.85 2rgk n ASP 233 N -4.45 0.16 -2.79 4.20 5.75 -1.26 -3.67 116.55 114.49 2rgk n ASP 233 Ca 0.07 -2.00 -0.10 0.00 -0.01 0.00 0.00 54.79 52.75 2rgk n ASP 233 Cb 0.09 -0.08 0.08 0.00 -1.03 0.00 0.00 41.12 40.18 2rgk n ASP 233 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68 2rgk n ASN 234 N -0.42 -1.75 -0.17 -1.12 4.13 -0.59 -5.01 115.26 110.33 2rgk n ASN 234 Ca 0.00 -3.40 0.29 0.00 1.68 0.00 0.00 54.58 53.15 2rgk n ASN 234 Cb 0.04 1.39 0.72 0.00 -1.54 0.00 0.00 39.78 40.39 2rgk n ASN 234 CO 0.00 0.00 0.00 -0.65 0.28 0.00 0.00 177.26 176.89 2rgk h PRO 235 N 2.85 0.00 -0.04 3.52 0.11 -1.61 -2.28 132.00 134.55 2rgk h PRO 235 Ca -0.10 0.00 -0.21 0.00 0.11 0.00 0.00 66.00 65.80 2rgk h PRO 235 Cb 1.11 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.22 2rgk h PRO 235 CO 0.16 0.00 -0.85 0.00 -0.21 0.00 0.00 178.00 177.10 2rgk h ALA 236 N 1.42 0.45 -1.60 -0.75 0.00 -1.94 -3.39 119.26 113.46 2rgk h ALA 236 Ca 0.43 -0.66 -0.69 0.00 0.00 0.00 0.00 54.91 53.99 2rgk h ALA 236 Cb 1.85 -0.04 0.06 0.00 0.00 0.00 0.00 17.79 19.67 2rgk h ALA 236 CO -0.00 0.79 0.38 0.72 0.00 0.00 0.00 179.25 181.13 2rgk n HIS 237 N -3.79 1.36 0.03 0.00 8.25 -0.86 -4.90 115.22 115.30 2rgk n HIS 237 Ca -0.06 0.70 -0.11 0.00 -0.26 0.00 0.00 57.72 57.99 2rgk n HIS 237 Cb 0.78 -2.29 -0.08 0.00 1.12 0.00 0.00 29.99 29.51 2rgk n HIS 237 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2rgk h ARG 238 N 4.21 -0.15 -6.33 -0.41 2.47 -1.90 -3.34 114.38 108.94 2rgk h ARG 238 Ca -0.48 0.01 -0.57 0.00 -1.26 0.00 0.00 59.98 57.69 2rgk h ARG 238 Cb 1.35 0.03 0.02 0.00 -1.65 0.00 0.00 29.97 29.72 2rgk h ARG 238 CO 0.75 0.35 1.17 0.34 0.56 0.00 0.00 179.97 183.14 2rgk n PHE 239 N -4.87 2.44 -3.79 3.04 7.35 -1.26 -1.79 117.46 118.57 2rgk n PHE 239 Ca -0.08 -0.21 -0.27 0.00 -0.76 0.00 0.00 57.45 56.13 2rgk n PHE 239 Cb 0.28 -2.74 0.02 0.00 0.35 0.00 0.00 39.48 37.38 2rgk n PHE 239 CO 0.00 0.00 0.00 0.54 -0.76 0.00 0.00 176.76 176.54 2rgk n ARG 240 N 7.09 -2.84 -1.85 -4.13 1.74 -1.26 -4.88 116.66 110.52 2rgk n ARG 240 Ca 0.21 0.47 -0.37 0.00 -0.77 0.00 0.00 57.85 57.39 2rgk n ARG 240 Cb 0.36 -4.53 0.04 0.00 -1.02 0.00 0.00 32.46 27.32 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 -3.71 2.65 0.63 7.54 0.00 -0.74 -4.75 121.76 123.38 2rgk s ALA 241 Ca 0.18 1.21 -0.18 0.00 0.00 0.00 0.00 51.96 53.17 2rgk s ALA 241 Cb -0.06 -3.53 -0.02 0.00 0.00 0.00 0.00 23.12 19.51 2rgk s ALA 241 CO 0.86 -1.35 1.24 0.12 0.00 0.00 0.00 175.76 176.63 2rgk s PHE 242 N -1.40 2.23 0.00 0.00 2.19 -1.26 -4.82 117.98 114.92 2rgk s PHE 242 Ca 0.75 1.51 0.00 0.00 0.33 0.00 0.00 56.93 59.53 2rgk s PHE 242 Cb -0.37 -3.56 0.00 0.00 -1.31 0.00 0.00 43.02 37.78 2rgk s PHE 242 CO 0.41 -2.54 0.00 0.41 1.83 0.00 0.00 175.22 175.34 2rgk n GLY 243 N 0.63 -0.94 3.74 13.12 0.00 -1.26 -4.75 105.19 115.72 2rgk n GLY 243 Ca 0.14 -1.20 -0.29 0.00 0.00 0.00 0.00 46.02 44.67 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 -0.27 1.90 -0.43 -0.02 0.00 -0.50 -4.62 107.32 103.39 2rgk s GLY 244 Ca 0.00 -1.12 -0.03 0.00 0.00 0.00 0.00 44.72 43.57 2rgk s GLY 244 CO 0.00 -1.11 0.22 -1.59 0.00 0.00 0.00 173.10 170.63 2rgk s THR 245 N -1.47 3.32 0.41 0.90 2.01 -1.26 -1.60 115.64 117.94 2rgk s THR 245 Ca 0.28 -2.13 0.22 0.00 0.31 0.00 0.00 61.69 60.37 2rgk s THR 245 Cb -0.11 -3.27 0.42 0.00 0.01 0.00 0.00 72.50 69.55 2rgk s THR 245 CO 0.21 -0.71 1.74 -0.65 -0.69 0.00 0.00 174.62 174.52 2rgk h PRO 246 N 7.96 0.29 -0.93 4.92 0.11 -1.85 0.19 132.00 142.70 2rgk h PRO 246 Ca -0.12 -0.02 0.10 0.00 0.11 0.00 0.00 66.00 66.07 2rgk h PRO 246 Cb 1.04 -0.07 -0.07 0.00 0.11 0.00 0.00 31.00 32.01 2rgk h PRO 246 CO 0.70 0.19 0.60 0.78 -0.21 0.00 0.00 178.00 180.06 2rgk h GLY 247 N 0.30 1.39 1.41 -0.55 0.00 -1.85 -1.00 103.07 102.77 2rgk h GLY 247 Ca 0.65 -0.39 -0.21 0.00 0.00 0.00 0.00 47.33 47.38 2rgk h GLY 247 CO -0.32 0.20 -0.81 0.45 0.00 0.00 0.00 176.54 176.07 2rgk h HIS 248 N 0.93 0.78 -0.15 5.60 3.86 -1.02 -2.53 115.15 122.62 2rgk h HIS 248 Ca 0.44 -0.36 0.03 0.00 -1.16 0.00 0.00 60.37 59.32 2rgk h HIS 248 Cb 0.42 -0.11 -0.03 0.00 1.06 0.00 0.00 27.41 28.75 2rgk h HIS 248 CO -0.00 1.16 -0.04 -1.49 0.86 0.00 0.00 177.93 178.42 2rgk h TRP 249 N 0.37 -0.09 -0.25 2.45 6.55 -0.95 -0.73 115.95 123.30 2rgk h TRP 249 Ca -0.05 0.01 -0.03 0.00 0.95 0.00 0.00 58.89 59.77 2rgk h TRP 249 Cb 1.41 0.06 -0.01 0.00 -0.86 0.00 0.00 29.16 29.76 2rgk h TRP 249 CO 0.07 -0.07 0.01 0.97 -1.05 0.00 0.00 178.44 178.37 2rgk h ILE 250 N -0.01 1.15 -0.13 1.49 6.09 -1.23 -2.60 117.51 122.27 2rgk h ILE 250 Ca 0.07 -0.57 -0.03 0.00 -1.37 0.00 0.00 64.86 62.96 2rgk h ILE 250 Cb 0.12 0.95 -0.00 0.00 0.47 0.00 0.00 36.82 38.36 2rgk h ILE 250 CO -0.15 0.19 -0.04 -0.33 -3.07 0.00 0.00 178.15 174.75 2rgk h GLU 251 N 0.36 0.26 -0.77 2.19 5.08 -0.89 -2.93 114.58 117.89 2rgk h GLU 251 Ca 0.08 -0.10 0.16 0.00 -1.00 0.00 0.00 59.36 58.50 2rgk h GLU 251 Cb 0.22 -0.01 -0.05 0.00 0.50 0.00 0.00 28.75 29.41 2rgk h GLU 251 CO 0.00 0.56 0.51 -1.49 -1.00 0.00 0.00 179.01 177.59 2rgk h TRP 252 N -0.06 0.47 -0.14 4.33 4.06 -0.80 -1.98 115.95 121.83 2rgk h TRP 252 Ca 0.03 0.01 -0.01 0.00 2.06 0.00 0.00 58.89 60.98 2rgk h TRP 252 Cb 0.47 -0.15 -0.01 0.00 -1.00 0.00 0.00 29.16 28.47 2rgk h TRP 252 CO 0.05 0.17 0.03 0.78 -3.56 0.00 0.00 178.44 175.92 2rgk h GLY 253 N 0.40 0.23 0.87 1.49 0.00 -1.29 -1.64 103.07 103.14 2rgk h GLY 253 Ca 0.38 -0.14 -0.01 0.00 0.00 0.00 0.00 47.33 47.56 2rgk h GLY 253 CO -0.12 0.13 0.05 -0.09 0.00 0.00 0.00 176.54 176.52 2rgk h ARG 254 N 0.02 0.21 -0.94 4.80 2.43 -1.32 -2.37 114.38 117.21 2rgk h ARG 254 Ca 0.04 -0.04 0.13 0.00 -0.81 0.00 0.00 59.98 59.31 2rgk h ARG 254 Cb 0.25 -0.03 -0.09 0.00 -0.42 0.00 0.00 29.97 29.68 2rgk h ARG 254 CO 0.00 0.30 0.56 -0.07 -1.51 0.00 0.00 179.97 179.25 2rgk h LEU 255 N 0.07 0.77 -1.50 3.80 3.38 -1.34 0.42 115.31 120.92 2rgk h LEU 255 Ca 0.05 0.06 -0.04 0.00 0.09 0.00 0.00 57.88 58.05 2rgk h LEU 255 Cb 0.17 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 2rgk h LEU 255 CO -0.00 0.38 -0.17 0.24 0.09 0.00 0.00 178.44 178.98 2rgk h MET 256 N 0.84 0.00 0.00 1.13 2.86 -1.08 -1.62 114.93 117.07 2rgk h MET 256 Ca 0.48 0.00 -0.19 0.00 -2.06 0.00 0.00 59.70 57.93 2rgk h MET 256 Cb 0.56 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.20 2rgk h MET 256 CO -0.30 0.17 -0.91 -0.07 1.06 0.00 0.00 176.91 176.85 2rgk h LEU 257 N 0.00 0.00 -0.75 1.22 3.38 0.26 -1.51 115.31 117.92 2rgk h LEU 257 Ca -0.00 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.87 2rgk h LEU 257 Cb 0.56 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.29 2rgk h LEU 257 CO 0.02 0.91 -0.08 0.45 0.09 0.00 0.00 178.44 179.84 2rgk h HIS 258 N 0.00 0.96 0.13 1.13 3.86 -0.13 0.72 115.15 121.83 2rgk h HIS 258 Ca -0.01 -0.17 -0.01 0.00 -1.16 0.00 0.00 60.37 59.02 2rgk h HIS 258 Cb 1.69 -0.25 0.00 0.00 1.06 0.00 0.00 27.41 29.92 2rgk h HIS 258 CO 0.00 0.91 -0.06 0.82 0.86 0.00 0.00 177.93 180.45 2rgk h ILE 259 N 0.80 0.97 -0.71 2.45 2.04 -1.22 -0.61 117.51 121.22 2rgk h ILE 259 Ca 0.14 -0.43 0.15 0.00 1.00 0.00 0.00 64.86 65.71 2rgk h ILE 259 Cb 0.58 1.24 -0.10 0.00 -0.74 0.00 0.00 36.82 37.80 2rgk h ILE 259 CO 0.04 0.10 0.20 -0.74 0.00 0.00 0.00 178.15 177.75 2rgk h HIS 260 N -0.39 0.31 -0.25 1.37 2.76 -1.02 0.48 115.15 118.42 2rgk h HIS 260 Ca -0.02 0.04 -0.11 0.00 -2.20 0.00 0.00 60.37 58.08 2rgk h HIS 260 Cb 0.31 -0.03 -0.01 0.00 1.55 0.00 0.00 27.41 29.23 2rgk h HIS 260 CO -0.01 -0.04 -0.30 0.00 -1.30 0.00 0.00 177.93 176.29 2rgk h ALA 261 N 1.57 1.02 -0.55 5.26 0.00 -0.68 -2.63 119.26 123.26 2rgk h ALA 261 Ca 0.40 -0.37 -0.06 0.00 0.00 0.00 0.00 54.91 54.87 2rgk h ALA 261 Cb 0.64 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.29 2rgk h ALA 261 CO -0.47 0.59 0.09 0.00 0.00 0.00 0.00 179.25 179.47 2rgk h ALA 262 N 1.24 1.13 -0.34 0.00 0.00 0.67 -0.53 119.26 121.43 2rgk h ALA 262 Ca 0.06 -0.23 -0.17 0.00 0.00 0.00 0.00 54.91 54.56 2rgk h ALA 262 Cb 0.74 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.31 2rgk h ALA 262 CO 0.06 0.58 -0.47 -0.07 0.00 0.00 0.00 179.25 179.34 2rgk h LEU 263 N 0.83 1.00 -0.58 0.00 3.38 -1.01 -3.14 115.31 115.79 2rgk h LEU 263 Ca 0.17 -0.50 -0.11 0.00 0.09 0.00 0.00 57.88 57.54 2rgk h LEU 263 Cb 0.36 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.81 2rgk h LEU 263 CO 0.01 1.30 -0.07 -0.33 0.09 0.00 0.00 178.44 179.44 2rgk h GLU 264 N 0.72 1.06 -0.87 1.13 5.08 -1.25 0.53 114.58 120.98 2rgk h GLU 264 Ca 0.04 -0.37 0.19 0.00 -1.00 0.00 0.00 59.36 58.21 2rgk h GLU 264 Cb 1.07 -0.08 -0.06 0.00 0.50 0.00 0.00 28.75 30.18 2rgk h GLU 264 CO 0.11 1.07 0.58 0.00 -1.00 0.00 0.00 179.01 179.77 2rgk h ALA 265 N 0.95 2.16 -0.91 3.43 0.00 -1.05 0.71 119.26 124.56 2rgk h ALA 265 Ca 0.15 0.01 -0.48 0.00 0.00 0.00 0.00 54.91 54.60 2rgk h ALA 265 Cb 0.64 -0.04 -0.28 0.00 0.00 0.00 0.00 17.79 18.11 2rgk h ALA 265 CO 0.04 -0.43 0.55 2.89 0.00 0.00 0.00 179.25 182.31 2rgk n ARG 266 N -4.51 2.22 -3.79 0.00 1.85 -1.05 -4.93 116.66 106.46 2rgk n ARG 266 Ca 0.18 -3.06 -0.26 0.00 -1.00 0.00 0.00 57.85 53.71 2rgk n ARG 266 Cb 0.65 -2.13 0.04 0.00 -1.05 0.00 0.00 32.46 29.96 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 -6.33 1.65 -0.24 0.00 2.12 0.15 -5.01 118.70 111.04 2rgk s GLU 268 Ca 0.42 -0.85 -0.35 0.00 0.36 0.00 0.00 54.97 54.55 2rgk s GLU 268 Cb -0.20 -2.43 -0.11 0.00 0.26 0.00 0.00 34.13 31.64 2rgk s GLU 268 CO 0.81 -0.53 2.04 0.94 -0.54 0.00 0.00 175.26 177.98 2rgk n GLN 269 N 4.73 1.54 -2.20 4.30 7.27 -1.26 -3.35 117.38 128.40 2rgk n GLN 269 Ca -0.12 0.50 -0.38 0.00 0.07 0.00 0.00 57.00 57.07 2rgk n GLN 269 Cb 0.45 -2.58 -0.01 0.00 2.41 0.00 0.00 30.24 30.52 2rgk n GLN 269 CO 0.00 0.00 0.00 -1.25 0.07 0.00 0.00 177.06 175.88 2rgk s PRO 270 N 5.25 3.80 0.25 3.69 0.04 -1.26 -4.93 135.00 141.83 2rgk s PRO 270 Ca 1.02 1.87 -0.31 0.00 0.04 0.00 0.00 61.00 63.62 2rgk s PRO 270 Cb -0.77 -2.50 -0.12 0.00 0.04 0.00 0.00 34.50 31.15 2rgk s PRO 270 CO 0.50 -0.55 1.55 -2.30 0.04 0.00 0.00 177.00 176.25 2rgk n PRO 271 N -0.33 2.43 0.28 0.56 -0.02 -1.26 -4.84 135.00 131.81 2rgk n PRO 271 Ca 0.06 0.87 0.16 0.00 -2.02 0.00 0.00 63.50 62.57 2rgk n PRO 271 Cb 0.47 -2.62 0.89 0.00 -0.02 0.00 0.00 33.50 32.22 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 5.00 1.60 0.00 3.55 0.00 -2.03 -2.74 119.26 124.63 2rgk h ALA 272 Ca -0.46 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.45 2rgk h ALA 272 Cb 1.24 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.03 2rgk h ALA 272 CO 0.81 -0.07 0.00 0.11 0.00 0.00 0.00 179.25 180.10 2rgk h TRP 273 N 0.00 0.00 0.03 0.00 5.08 -1.99 -2.52 115.95 116.56 2rgk h TRP 273 Ca 0.02 0.00 -0.00 0.00 1.08 0.00 0.00 58.89 59.99 2rgk h TRP 273 Cb 0.12 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.28 2rgk h TRP 273 CO 0.00 0.00 -0.02 -0.07 -1.28 0.00 0.00 178.44 177.07 2rgk h LEU 274 N 0.00 -0.04 -0.16 0.11 3.38 -1.84 0.35 115.31 117.11 2rgk h LEU 274 Ca 0.00 -0.10 -0.06 0.00 0.09 0.00 0.00 57.88 57.81 2rgk h LEU 274 Cb 0.17 0.01 -0.00 0.00 0.09 0.00 0.00 40.66 40.93 2rgk h LEU 274 CO 0.00 0.07 -0.13 0.25 0.09 0.00 0.00 178.44 178.72 2rgk h LEU 275 N -0.15 0.40 -0.46 1.67 5.85 -1.71 -2.12 115.31 118.80 2rgk h LEU 275 Ca -0.00 -0.46 0.07 0.00 0.84 0.00 0.00 57.88 58.33 2rgk h LEU 275 Cb 0.13 -0.11 -0.06 0.00 0.37 0.00 0.00 40.66 40.99 2rgk h LEU 275 CO 0.01 0.77 0.10 -0.33 -0.34 0.00 0.00 178.44 178.65 2rgk h GLU 276 N 0.03 0.23 -0.08 1.25 5.08 -1.39 -0.36 114.58 119.34 2rgk h GLU 276 Ca 0.03 -0.01 -0.12 0.00 -1.00 0.00 0.00 59.36 58.25 2rgk h GLU 276 Cb 0.65 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.83 2rgk h GLU 276 CO 0.03 0.15 -0.50 -0.44 -1.00 0.00 0.00 179.01 177.26 2rgk h ASP 277 N 0.24 0.22 -0.49 1.42 3.32 -0.95 -1.33 116.42 118.86 2rgk h ASP 277 Ca 0.22 -0.11 -0.05 0.00 0.02 0.00 0.00 57.03 57.12 2rgk h ASP 277 Cb 0.28 -0.06 -0.02 0.00 0.22 0.00 0.00 39.33 39.75 2rgk h ASP 277 CO -0.28 0.69 0.11 0.00 -1.72 0.00 0.00 179.24 178.03 2rgk h ALA 278 N 1.32 0.65 -0.11 3.45 0.00 -0.63 -0.65 119.26 123.28 2rgk h ALA 278 Ca 0.01 -0.21 -0.00 0.00 0.00 0.00 0.00 54.91 54.70 2rgk h ALA 278 Cb 0.94 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.54 2rgk h ALA 278 CO 0.08 0.35 0.06 0.87 0.00 0.00 0.00 179.25 180.60 2rgk h LYS 279 N 0.67 0.16 -0.34 0.00 1.57 -0.85 -1.66 116.57 116.12 2rgk h LYS 279 Ca 0.15 -0.02 0.04 0.00 -1.87 0.00 0.00 60.65 58.95 2rgk h LYS 279 Cb 0.35 -0.03 -0.04 0.00 0.08 0.00 0.00 32.23 32.59 2rgk h LYS 279 CO 0.00 0.21 0.10 0.78 -0.57 0.00 0.00 179.45 179.98 2rgk h GLY 280 N 0.06 0.41 1.00 3.86 0.00 -1.00 0.14 103.07 107.55 2rgk h GLY 280 Ca 0.04 -0.05 -0.00 0.00 0.00 0.00 0.00 47.33 47.31 2rgk h GLY 280 CO -0.01 0.01 0.36 1.41 0.00 0.00 0.00 176.54 178.32 2rgk h LEU 281 N 0.24 0.72 -0.19 3.11 3.38 -1.06 0.38 115.31 121.89 2rgk h LEU 281 Ca 0.15 -0.06 -0.01 0.00 0.09 0.00 0.00 57.88 58.06 2rgk h LEU 281 Cb 0.14 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 2rgk h LEU 281 CO -0.17 0.57 0.09 0.15 0.09 0.00 0.00 178.44 179.17 2rgk h PHE 282 N 0.81 0.28 -0.73 1.13 3.57 -0.85 -1.59 116.94 119.56 2rgk h PHE 282 Ca 0.21 -0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.69 2rgk h PHE 282 Cb -0.02 -0.09 -0.04 0.00 2.79 0.00 0.00 35.95 38.60 2rgk h PHE 282 CO -0.02 0.30 0.43 -0.97 -2.23 0.00 0.00 178.31 175.82 2rgk h ASN 283 N 0.18 0.90 -0.29 0.41 -1.24 -0.32 -2.11 115.58 113.11 2rgk h ASN 283 Ca 0.07 -0.08 -0.04 0.00 0.71 0.00 0.00 56.30 56.96 2rgk h ASN 283 Cb 0.13 -0.23 -0.02 0.00 0.73 0.00 0.00 38.32 38.93 2rgk h ASN 283 CO -0.01 0.71 0.06 0.00 -1.29 0.00 0.00 177.43 176.90 2rgk h ALA 284 N 1.22 1.40 -0.18 1.57 0.00 -0.05 -0.26 119.26 122.96 2rgk h ALA 284 Ca 0.26 -0.18 -0.03 0.00 0.00 0.00 0.00 54.91 54.96 2rgk h ALA 284 Cb -0.00 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 2rgk h ALA 284 CO -0.05 0.43 -0.01 1.15 0.00 0.00 0.00 179.25 180.77 2rgk h THR 285 N 0.55 1.26 -0.34 0.00 2.02 -0.64 -1.60 112.91 114.16 2rgk h THR 285 Ca 0.12 -0.90 -0.14 0.00 0.77 0.00 0.00 66.41 66.27 2rgk h THR 285 Cb 0.27 1.49 -0.01 0.00 -1.74 0.00 0.00 68.15 68.16 2rgk h THR 285 CO 0.00 0.27 -0.35 -0.37 0.37 0.00 0.00 175.52 175.44 2rgk h VAL 286 N 0.07 1.28 -0.22 3.16 -1.51 -1.32 0.25 116.25 117.96 2rgk h VAL 286 Ca 0.05 -1.52 0.04 0.00 -1.23 0.00 0.00 66.70 64.04 2rgk h VAL 286 Cb 0.41 1.39 -0.04 0.00 -2.13 0.00 0.00 31.29 30.93 2rgk h VAL 286 CO 0.01 0.50 -0.01 -0.09 -1.23 0.00 0.00 177.57 176.75 2rgk h ARG 287 N 0.66 0.06 0.00 5.19 2.43 -0.90 -3.11 114.38 118.70 2rgk h ARG 287 Ca 0.06 -0.00 -0.36 0.00 -0.81 0.00 0.00 59.98 58.87 2rgk h ARG 287 Cb 0.90 -0.01 -0.07 0.00 -0.42 0.00 0.00 29.97 30.37 2rgk h ARG 287 CO 0.08 0.04 -2.38 -0.25 -1.51 0.00 0.00 179.97 175.95 2rgk n ASP 288 N -5.15 1.59 0.03 -3.80 8.00 -0.62 -4.75 116.55 111.85 2rgk n ASP 288 Ca -0.02 -0.10 0.11 0.00 0.71 0.00 0.00 54.79 55.50 2rgk n ASP 288 Cb 0.12 -0.02 0.00 0.00 -0.02 0.00 0.00 41.12 41.21 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 -3.08 3.28 -2.63 2.24 0.00 0.06 -4.63 120.51 115.75 2rgk n ALA 289 Ca -0.40 -0.40 -0.39 0.00 0.00 0.00 0.00 53.44 52.25 2rgk n ALA 289 Cb 1.01 -0.97 -0.08 0.00 0.00 0.00 0.00 19.45 19.41 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 -3.24 3.29 -1.58 0.00 -0.11 -1.14 -1.40 118.94 114.77 2rgk s TRP 290 Ca 0.02 0.60 -0.04 0.00 1.22 0.00 0.00 56.10 57.90 2rgk s TRP 290 Cb 0.14 -2.64 0.03 0.00 -1.50 0.00 0.00 33.47 29.50 2rgk s TRP 290 CO 0.81 -0.20 0.16 0.00 -4.62 0.00 0.00 176.95 173.10 2rgk n ALA 291 N 5.19 -1.89 0.54 5.86 0.00 -0.32 -4.86 120.51 125.04 2rgk n ALA 291 Ca -0.06 -0.36 0.12 0.00 0.00 0.00 0.00 53.44 53.15 2rgk n ALA 291 Cb 0.50 -1.19 0.25 0.00 0.00 0.00 0.00 19.45 19.01 2rgk n ALA 291 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 2rgk h PRO 292 N -1.67 0.00 -0.52 0.00 0.13 -1.78 -3.39 132.00 124.76 2rgk h PRO 292 Ca -0.65 0.00 -0.37 0.00 -0.87 0.00 0.00 66.00 64.11 2rgk h PRO 292 Cb 1.39 0.00 -0.27 0.00 0.13 0.00 0.00 31.00 32.25 2rgk h PRO 292 CO 0.72 0.00 -0.57 -0.40 -0.23 0.00 0.00 178.00 177.52 2rgk n ASP 293 N -2.26 3.97 0.00 1.44 5.68 -1.26 -4.94 116.55 119.18 2rgk n ASP 293 Ca 0.04 -3.80 0.00 0.00 -0.50 0.00 0.00 54.79 50.53 2rgk n ASP 293 Cb 0.45 -0.46 0.00 0.00 -1.14 0.00 0.00 41.12 39.97 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 -0.87 0.71 3.34 6.12 0.00 -1.26 -5.03 105.19 108.19 2rgk n GLY 294 Ca 0.37 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.28 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 -2.29 -1.07 0.75 4.61 0.00 -1.26 -5.14 121.76 117.36 2rgk s ALA 295 Ca 0.00 0.08 -0.11 0.00 0.00 0.00 0.00 51.96 51.92 2rgk s ALA 295 Cb 0.00 0.72 0.04 0.00 0.00 0.00 0.00 23.12 23.88 2rgk s ALA 295 CO 0.00 -0.66 1.09 -0.51 0.00 0.00 0.00 175.76 175.68 2rgk s ASP 296 N -2.76 4.92 0.00 0.00 1.11 -1.26 -4.02 116.67 114.67 2rgk s ASP 296 Ca 0.02 1.31 0.00 0.00 0.18 0.00 0.00 52.55 54.06 2rgk s ASP 296 Cb 0.01 -2.09 0.00 0.00 1.07 0.00 0.00 42.92 41.91 2rgk s ASP 296 CO -0.12 -1.70 0.00 0.61 1.18 0.00 0.00 175.17 175.14 2rgk n GLY 297 N -2.33 2.75 3.41 0.21 0.00 -1.26 -4.78 105.19 103.18 2rgk n GLY 297 Ca 0.07 -2.06 -0.40 0.00 0.00 0.00 0.00 46.02 43.64 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 -2.45 4.59 1.14 -0.61 -1.09 -1.26 -1.17 121.20 120.35 2rgk s ILE 298 Ca 0.00 -0.64 -0.12 0.00 -2.23 0.00 0.00 60.65 57.66 2rgk s ILE 298 Cb 0.00 -3.45 0.27 0.00 -1.58 0.00 0.00 42.46 37.70 2rgk s ILE 298 CO 0.00 -0.08 1.04 1.33 -1.23 0.00 0.00 174.94 176.00 2rgk n VAL 299 N 4.99 0.00 -0.08 2.92 0.24 -0.50 -4.38 118.33 121.52 2rgk n VAL 299 Ca -0.13 -0.38 -0.14 0.00 -2.04 0.00 0.00 64.34 61.65 2rgk n VAL 299 Cb 0.48 -1.00 -0.10 0.00 -1.47 0.00 0.00 33.84 31.75 2rgk n VAL 299 CO 0.00 0.00 0.00 0.22 -2.14 0.00 0.00 176.83 174.91 2rgk h TYR 300 N -2.59 0.00 -3.76 6.34 3.20 -1.08 -3.44 116.97 115.64 2rgk h TYR 300 Ca -0.59 0.00 -0.25 0.00 3.14 0.00 0.00 58.73 61.02 2rgk h TYR 300 Cb 1.32 0.00 -0.16 0.00 1.54 0.00 0.00 36.73 39.44 2rgk h TYR 300 CO 0.30 0.94 -0.71 0.95 -1.64 0.00 0.00 178.16 178.01 2rgk s THR 301 N -2.19 0.78 0.03 1.81 -4.23 -1.06 -3.67 115.64 107.12 2rgk s THR 301 Ca -0.20 -1.83 -0.03 0.00 -1.18 0.00 0.00 61.69 58.45 2rgk s THR 301 Cb 0.01 -1.56 -0.02 0.00 1.34 0.00 0.00 72.50 72.27 2rgk s THR 301 CO 0.52 -0.77 0.03 0.68 -0.54 0.00 0.00 174.62 174.54 2rgk s VAL 302 N -3.22 0.15 0.00 2.29 -7.23 -0.63 -0.48 120.40 111.27 2rgk s VAL 302 Ca 0.10 -1.21 0.00 0.00 -1.81 0.00 0.00 61.98 59.06 2rgk s VAL 302 Cb 0.02 -0.85 0.00 0.00 0.56 0.00 0.00 36.38 36.11 2rgk s VAL 302 CO -0.03 -0.66 0.00 -0.90 -0.31 0.00 0.00 175.10 173.20 2rgk n ASP 303 N 0.86 0.00 0.00 4.85 5.68 0.12 -1.40 116.55 126.65 2rgk n ASP 303 Ca -0.19 -0.97 0.04 0.00 -0.50 0.00 0.00 54.79 53.17 2rgk n ASP 303 Cb 0.58 0.00 0.24 0.00 -1.14 0.00 0.00 41.12 40.80 2rgk n ASP 303 CO 0.00 0.00 0.00 0.79 -1.33 0.00 0.00 177.20 176.66 2rgk n TRP 304 N -1.93 0.00 0.47 2.11 5.03 -1.26 -1.66 117.44 120.20 2rgk n TRP 304 Ca 0.00 0.00 0.06 0.00 3.03 0.00 0.00 57.50 60.59 2rgk n TRP 304 Cb 0.00 0.00 -0.07 0.00 -1.03 0.00 0.00 31.31 30.21 2rgk n TRP 304 CO 0.00 0.00 0.00 -1.91 -0.03 0.00 0.00 177.69 175.75 2rgk n GLU 305 N -0.63 2.47 -0.36 -0.99 4.07 -1.26 -4.96 120.64 118.98 2rgk n GLU 305 Ca 0.06 -0.02 0.00 0.00 -0.06 0.00 0.00 57.16 57.14 2rgk n GLU 305 Cb 0.03 -1.12 0.00 0.00 -0.06 0.00 0.00 31.44 30.29 2rgk n GLU 305 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2rgk n GLY 306 N 1.38 0.78 3.69 8.31 0.00 -0.67 -5.05 105.19 113.64 2rgk n GLY 306 Ca 0.01 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.63 2rgk n GLY 306 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2rgk s LYS 307 N -0.64 4.37 0.21 1.61 2.20 -1.26 -4.71 119.74 121.52 2rgk s LYS 307 Ca 0.00 0.95 -0.32 0.00 -0.36 0.00 0.00 55.97 56.24 2rgk s LYS 307 Cb 0.00 -3.51 -0.14 0.00 -1.51 0.00 0.00 37.83 32.67 2rgk s LYS 307 CO 0.00 -0.14 1.41 -2.30 -0.36 0.00 0.00 175.35 173.96 2rgk n PRO 308 N 4.51 1.93 -0.00 4.03 -0.02 -1.26 0.11 135.00 144.29 2rgk n PRO 308 Ca 0.02 0.69 -0.00 0.00 -2.02 0.00 0.00 63.50 62.18 2rgk n PRO 308 Cb 0.50 -2.35 -0.00 0.00 -0.02 0.00 0.00 33.50 31.63 2rgk n PRO 308 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 2rgk n VAL 309 N 2.17 0.03 -3.16 -1.45 0.31 0.36 -4.82 118.33 111.77 2rgk n VAL 309 Ca 0.13 0.29 -0.43 0.00 -0.01 0.00 0.00 64.34 64.33 2rgk n VAL 309 Cb 0.30 -1.31 -0.07 0.00 -0.91 0.00 0.00 33.84 31.85 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 -1.03 4.89 -2.28 2.52 1.01 -1.21 -4.93 120.40 119.36 2rgk s VAL 310 Ca -0.00 0.12 0.27 0.00 0.00 0.00 0.00 61.98 62.37 2rgk s VAL 310 Cb 0.00 -4.14 0.44 0.00 0.00 0.00 0.00 36.38 32.68 2rgk s VAL 310 CO 0.00 -0.50 1.66 0.54 0.00 0.00 0.00 175.10 176.81 2rgk n ARG 311 N 6.08 1.43 -1.97 2.72 1.74 -1.26 -1.42 116.66 123.98 2rgk n ARG 311 Ca -0.03 -0.86 -0.40 0.00 -0.77 0.00 0.00 57.85 55.79 2rgk n ARG 311 Cb 0.48 -1.48 -0.00 0.00 -1.02 0.00 0.00 32.46 30.43 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 -2.16 4.02 -0.56 5.56 8.01 -1.26 -4.08 118.70 128.24 2rgk s GLU 312 Ca 0.33 2.30 -0.18 0.00 0.01 0.00 0.00 54.97 57.43 2rgk s GLU 312 Cb 0.20 -2.85 0.10 0.00 -4.31 0.00 0.00 34.13 27.28 2rgk s GLU 312 CO 0.39 -0.50 0.61 1.03 0.01 0.00 0.00 175.26 176.81 2rgk s ARG 313 N -2.16 3.03 0.46 1.61 1.81 -0.02 -2.83 118.95 120.86 2rgk s ARG 313 Ca 0.55 -1.38 -0.20 0.00 -1.72 0.00 0.00 55.73 52.98 2rgk s ARG 313 Cb -0.41 -4.25 -0.09 0.00 -0.45 0.00 0.00 34.95 29.75 2rgk s ARG 313 CO 0.54 -1.41 1.00 0.08 -0.68 0.00 0.00 175.30 174.83 2rgk s VAL 314 N 2.30 4.10 0.12 3.52 1.01 -1.26 -1.66 120.40 128.52 2rgk s VAL 314 Ca 0.09 1.29 -0.19 0.00 0.00 0.00 0.00 61.98 63.17 2rgk s VAL 314 Cb -0.25 -3.53 -0.05 0.00 0.00 0.00 0.00 36.38 32.55 2rgk s VAL 314 CO 0.06 -0.30 1.73 -0.09 0.00 0.00 0.00 175.10 176.49 2rgk h ARG 315 N 1.67 0.36 -0.30 2.72 2.43 -1.24 -3.32 114.38 116.70 2rgk h ARG 315 Ca -0.49 -0.04 -0.02 0.00 -0.81 0.00 0.00 59.98 58.62 2rgk h ARG 315 Cb 1.20 -0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 30.66 2rgk h ARG 315 CO 0.60 0.31 0.11 0.11 -1.51 0.00 0.00 179.97 179.59 2rgk h TRP 316 N 0.32 0.41 -0.28 2.20 5.08 -1.93 -3.04 115.95 118.71 2rgk h TRP 316 Ca 0.09 -0.01 0.01 0.00 1.08 0.00 0.00 58.89 60.07 2rgk h TRP 316 Cb 0.05 -0.13 -0.02 0.00 -3.00 0.00 0.00 29.16 26.06 2rgk h TRP 316 CO -0.04 0.33 0.15 -1.35 -1.28 0.00 0.00 178.44 176.26 2rgk h PRO 317 N 0.42 0.30 0.00 0.12 0.11 -1.91 0.44 132.00 131.47 2rgk h PRO 317 Ca 0.10 -0.02 -0.10 0.00 0.11 0.00 0.00 66.00 66.10 2rgk h PRO 317 Cb 0.10 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 31.13 2rgk h PRO 317 CO -0.01 0.20 -0.45 0.97 -0.21 0.00 0.00 178.00 178.50 2rgk h ILE 318 N 0.31 1.13 -0.23 4.15 2.10 -1.75 -0.35 117.51 122.86 2rgk h ILE 318 Ca 0.11 -1.67 -0.02 0.00 1.08 0.00 0.00 64.86 64.37 2rgk h ILE 318 Cb 0.02 1.95 -0.01 0.00 -1.09 0.00 0.00 36.82 37.69 2rgk h ILE 318 CO -0.07 0.44 0.08 0.58 -1.08 0.00 0.00 178.15 178.11 2rgk h VAL 319 N 0.00 1.18 -0.53 2.19 2.07 -1.29 -2.35 116.25 117.52 2rgk h VAL 319 Ca -0.00 -0.57 -0.10 0.00 0.82 0.00 0.00 66.70 66.84 2rgk h VAL 319 Cb 0.91 1.13 -0.02 0.00 -1.52 0.00 0.00 31.29 31.79 2rgk h VAL 319 CO 0.06 0.19 -0.06 -0.33 0.02 0.00 0.00 177.57 177.45 2rgk h GLU 320 N 0.21 0.98 -0.87 1.57 4.39 -0.65 -2.64 114.58 117.57 2rgk h GLU 320 Ca 0.08 -0.34 0.16 0.00 0.34 0.00 0.00 59.36 59.60 2rgk h GLU 320 Cb 0.21 -0.07 -0.07 0.00 -0.10 0.00 0.00 28.75 28.72 2rgk h GLU 320 CO -0.00 1.01 0.57 0.00 -1.16 0.00 0.00 179.01 179.43 2rgk h ALA 321 N 0.93 1.98 -0.34 3.43 0.00 -0.89 0.01 119.26 124.38 2rgk h ALA 321 Ca 0.14 0.02 -0.17 0.00 0.00 0.00 0.00 54.91 54.90 2rgk h ALA 321 Cb 0.61 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.31 2rgk h ALA 321 CO 0.04 -0.23 -0.44 0.52 0.00 0.00 0.00 179.25 179.14 2rgk h MET 322 N 0.57 0.90 -0.46 0.00 2.86 -1.07 0.13 114.93 117.85 2rgk h MET 322 Ca 0.45 -0.51 -0.01 0.00 -2.06 0.00 0.00 59.70 57.57 2rgk h MET 322 Cb 0.87 0.04 -0.02 0.00 0.06 0.00 0.00 31.60 32.55 2rgk h MET 322 CO -0.19 1.16 0.25 0.78 1.06 0.00 0.00 176.91 179.96 2rgk h GLY 323 N 0.70 0.69 1.07 8.32 0.00 -0.85 -1.37 103.07 111.63 2rgk h GLY 323 Ca 0.04 -0.31 -0.08 0.00 0.00 0.00 0.00 47.33 46.98 2rgk h GLY 323 CO 0.10 0.30 0.11 -0.84 0.00 0.00 0.00 176.54 176.21 2rgk h THR 324 N 0.60 1.27 -1.01 4.70 2.02 -1.03 -0.82 112.91 118.64 2rgk h THR 324 Ca 0.16 -1.05 0.07 0.00 0.77 0.00 0.00 66.41 66.37 2rgk h THR 324 Cb 0.06 0.62 -0.07 0.00 -1.74 0.00 0.00 68.15 67.02 2rgk h THR 324 CO -0.03 0.40 0.65 0.00 0.37 0.00 0.00 175.52 176.91 2rgk h ALA 325 N 1.05 1.42 -0.21 6.16 0.00 -0.56 0.13 119.26 127.25 2rgk h ALA 325 Ca 0.21 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 55.07 2rgk h ALA 325 Cb 0.45 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 2rgk h ALA 325 CO 0.01 0.42 0.03 -0.92 0.00 0.00 0.00 179.25 178.78 2rgk h TYR 326 N 1.16 0.38 0.07 0.00 3.20 -0.58 -1.96 116.97 119.23 2rgk h TYR 326 Ca 0.44 -0.06 0.01 0.00 3.14 0.00 0.00 58.73 62.27 2rgk h TYR 326 Cb 0.22 -0.10 -0.02 0.00 1.54 0.00 0.00 36.73 38.37 2rgk h TYR 326 CO -0.00 0.50 -0.11 0.00 -1.64 0.00 0.00 178.16 176.91 2rgk h ALA 327 N 0.83 -0.19 -0.78 1.82 0.00 -0.04 0.21 119.26 121.11 2rgk h ALA 327 Ca 0.06 -0.02 0.01 0.00 0.00 0.00 0.00 54.91 54.96 2rgk h ALA 327 Cb 0.34 0.18 -0.04 0.00 0.00 0.00 0.00 17.79 18.26 2rgk h ALA 327 CO 0.01 -0.63 0.51 -0.07 0.00 0.00 0.00 179.25 179.07 2rgk h LEU 328 N -0.23 0.89 -0.59 0.00 3.38 -0.81 -1.88 115.31 116.07 2rgk h LEU 328 Ca 0.02 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2rgk h LEU 328 Cb 0.24 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.74 2rgk h LEU 328 CO -0.06 0.65 0.38 0.22 0.09 0.00 0.00 178.44 179.71 2rgk h TYR 329 N 1.05 0.76 -0.68 1.13 3.20 -1.09 0.15 116.97 121.49 2rgk h TYR 329 Ca 0.28 0.01 0.01 0.00 3.14 0.00 0.00 58.73 62.17 2rgk h TYR 329 Cb -0.12 -0.25 -0.03 0.00 1.54 0.00 0.00 36.73 37.86 2rgk h TYR 329 CO -0.02 0.49 0.45 1.15 -1.64 0.00 0.00 178.16 178.59 2rgk h THR 330 N 0.80 1.17 0.08 1.81 2.02 -0.24 0.82 112.91 119.37 2rgk h THR 330 Ca 0.21 -0.32 -0.23 0.00 0.77 0.00 0.00 66.41 66.85 2rgk h THR 330 Cb -0.06 0.18 -0.01 0.00 -1.74 0.00 0.00 68.15 66.52 2rgk h THR 330 CO -0.04 0.17 -1.16 0.58 0.37 0.00 0.00 175.52 175.43 2rgk h VAL 331 N 0.92 1.14 0.00 3.16 2.07 -1.05 -3.40 116.25 119.08 2rgk h VAL 331 Ca 0.25 -2.36 -0.28 0.00 0.82 0.00 0.00 66.70 65.13 2rgk h VAL 331 Cb -0.10 2.74 -0.05 0.00 -1.52 0.00 0.00 31.29 32.36 2rgk h VAL 331 CO -0.05 0.62 -1.67 0.35 0.02 0.00 0.00 177.57 176.83 2rgk n THR 332 N -4.12 1.55 -0.97 2.57 -2.24 0.51 -4.97 114.28 106.61 2rgk n THR 332 Ca -0.24 -0.78 0.00 0.00 -2.27 0.00 0.00 64.05 60.76 2rgk n THR 332 Cb 0.80 -1.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.03 2rgk n THR 332 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2rgk n GLY 333 N 1.53 0.87 3.62 3.38 0.00 0.28 -4.97 105.19 109.92 2rgk n GLY 333 Ca -0.16 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.43 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 -2.80 6.19 0.64 1.61 -1.08 -1.26 -4.87 116.67 115.10 2rgk s ASP 334 Ca 0.00 1.67 0.39 0.00 -0.52 0.00 0.00 52.55 54.09 2rgk s ASP 334 Cb 0.00 -2.53 2.18 0.00 -1.46 0.00 0.00 42.92 41.11 2rgk s ASP 334 CO 0.00 -1.40 2.32 0.03 0.52 0.00 0.00 175.17 176.64 2rgk h ARG 335 N 11.59 0.00 -0.40 4.34 2.47 -1.93 -2.14 114.38 128.31 2rgk h ARG 335 Ca -0.36 0.00 0.05 0.00 -1.26 0.00 0.00 59.98 58.41 2rgk h ARG 335 Cb 1.17 0.00 -0.02 0.00 -1.65 0.00 0.00 29.97 29.47 2rgk h ARG 335 CO 1.00 0.00 0.27 1.96 0.56 0.00 0.00 179.97 183.76 2rgk h GLN 336 N 0.00 0.33 -0.23 0.04 4.20 -2.00 0.16 115.11 117.61 2rgk h GLN 336 Ca -0.00 -0.02 -0.07 0.00 0.06 0.00 0.00 58.65 58.62 2rgk h GLN 336 Cb 0.02 -0.08 -0.01 0.00 0.30 0.00 0.00 27.48 27.71 2rgk h GLN 336 CO 0.00 0.22 -0.17 1.88 -0.67 0.00 0.00 178.83 180.09 2rgk h TYR 337 N 0.34 0.42 -0.31 2.96 0.99 -1.70 -2.15 116.97 117.52 2rgk h TYR 337 Ca 0.17 -0.07 -0.15 0.00 2.00 0.00 0.00 58.73 60.68 2rgk h TYR 337 Cb 0.24 -0.11 -0.00 0.00 1.00 0.00 0.00 36.73 37.86 2rgk h TYR 337 CO -0.00 0.55 -0.41 1.49 -0.00 0.00 0.00 178.16 179.79 2rgk h GLU 338 N 0.36 0.82 -1.00 4.88 4.81 -1.14 -1.84 114.58 121.46 2rgk h GLU 338 Ca 0.06 -0.47 0.04 0.00 -0.13 0.00 0.00 59.36 58.87 2rgk h GLU 338 Cb 0.51 0.04 -0.06 0.00 0.63 0.00 0.00 28.75 29.87 2rgk h GLU 338 CO 0.03 1.11 0.65 1.15 -0.73 0.00 0.00 179.01 181.22 2rgk h THR 339 N 0.60 1.15 -0.48 0.32 2.02 -0.93 0.16 112.91 115.75 2rgk h THR 339 Ca 0.04 -0.43 -0.10 0.00 0.77 0.00 0.00 66.41 66.68 2rgk h THR 339 Cb 1.00 -0.20 -0.02 0.00 -1.74 0.00 0.00 68.15 67.20 2rgk h THR 339 CO 0.10 0.23 -0.11 -0.50 0.37 0.00 0.00 175.52 175.61 2rgk h TRP 340 N 1.25 1.04 -0.60 3.16 4.06 -1.28 0.10 115.95 123.67 2rgk h TRP 340 Ca 0.41 -0.22 0.07 0.00 2.06 0.00 0.00 58.89 61.21 2rgk h TRP 340 Cb 0.04 -0.25 -0.06 0.00 -1.00 0.00 0.00 29.16 27.88 2rgk h TRP 340 CO -0.00 1.00 0.28 -0.92 -3.56 0.00 0.00 178.44 175.23 2rgk h TYR 341 N 0.78 0.50 -0.27 0.49 3.20 -0.30 0.01 116.97 121.37 2rgk h TYR 341 Ca 0.12 0.03 -0.18 0.00 3.14 0.00 0.00 58.73 61.84 2rgk h TYR 341 Cb 0.66 -0.13 0.00 0.00 1.54 0.00 0.00 36.73 38.80 2rgk h TYR 341 CO 0.05 0.19 -0.54 1.96 -1.64 0.00 0.00 178.16 178.18 2rgk h GLN 342 N 0.51 0.85 -0.52 1.82 4.20 -0.46 -1.37 115.11 120.13 2rgk h GLN 342 Ca 0.29 -0.55 0.04 0.00 0.06 0.00 0.00 58.65 58.49 2rgk h GLN 342 Cb 0.28 0.07 -0.04 0.00 0.30 0.00 0.00 27.48 28.08 2rgk h GLN 342 CO -0.24 1.18 0.28 1.15 -0.67 0.00 0.00 178.83 180.53 2rgk h THR 343 N 0.62 0.99 -0.17 -0.54 2.02 -0.35 -0.90 112.91 114.59 2rgk h THR 343 Ca 0.01 -0.19 -0.12 0.00 0.77 0.00 0.00 66.41 66.88 2rgk h THR 343 Cb 1.15 0.40 -0.01 0.00 -1.74 0.00 0.00 68.15 67.95 2rgk h THR 343 CO 0.12 0.10 -0.41 -0.50 0.37 0.00 0.00 175.52 175.20 2rgk h TRP 344 N 0.54 0.46 -0.13 3.16 6.55 -0.89 -2.42 115.95 123.21 2rgk h TRP 344 Ca 0.22 -0.13 -0.12 0.00 0.95 0.00 0.00 58.89 59.81 2rgk h TRP 344 Cb 0.10 -0.10 -0.01 0.00 -0.86 0.00 0.00 29.16 28.29 2rgk h TRP 344 CO -0.09 0.74 -0.45 -1.49 -1.05 0.00 0.00 178.44 176.10 2rgk h TRP 345 N 0.32 0.37 -0.60 0.49 -0.00 -0.76 0.96 115.95 116.73 2rgk h TRP 345 Ca 0.03 -0.11 -0.05 0.00 -0.00 0.00 0.00 58.89 58.75 2rgk h TRP 345 Cb 0.86 -0.08 -0.02 0.00 -0.00 0.00 0.00 29.16 29.92 2rgk h TRP 345 CO 0.02 0.71 0.16 0.93 -0.00 0.00 0.00 178.44 180.27 2rgk h GLU 346 N 0.26 0.95 -0.18 0.49 4.39 -0.98 -1.88 114.58 117.63 2rgk h GLU 346 Ca 0.02 -0.22 -0.03 0.00 0.34 0.00 0.00 59.36 59.46 2rgk h GLU 346 Cb 0.90 -0.13 -0.01 0.00 -0.10 0.00 0.00 28.75 29.41 2rgk h GLU 346 CO 0.07 0.87 -0.03 -0.92 -1.16 0.00 0.00 179.01 177.84 2rgk h TYR 347 N 0.87 0.37 -0.17 4.33 3.20 -1.15 -2.98 116.97 121.44 2rgk h TYR 347 Ca 0.19 -0.07 0.02 0.00 3.14 0.00 0.00 58.73 62.00 2rgk h TYR 347 Cb 0.33 -0.09 -0.02 0.00 1.54 0.00 0.00 36.73 38.49 2rgk h TYR 347 CO 0.02 0.57 0.06 0.00 -1.64 0.00 0.00 178.16 177.17 2rgk h ILE 349 N 0.14 0.48 0.16 0.00 2.10 -1.42 0.21 117.51 119.19 2rgk h ILE 349 Ca 0.07 -0.79 -0.23 0.00 1.08 0.00 0.00 64.86 65.00 2rgk h ILE 349 Cb 0.04 1.54 0.02 0.00 -1.09 0.00 0.00 36.82 37.34 2rgk h ILE 349 CO -0.07 0.15 -1.03 0.50 -1.08 0.00 0.00 178.15 176.62 2rgk h LYS 350 N 0.00 0.35 0.00 2.19 3.64 -1.27 -3.40 116.57 118.07 2rgk h LYS 350 Ca -0.00 -0.59 0.00 0.00 -1.27 0.00 0.00 60.65 58.79 2rgk h LYS 350 Cb 0.53 0.22 0.00 0.00 -0.41 0.00 0.00 32.23 32.57 2rgk h LYS 350 CO 0.02 1.28 -0.84 0.66 -2.27 0.00 0.00 179.45 178.30 2rgk n TYR 351 N -4.01 0.00 -0.10 1.91 4.02 -0.44 -4.87 117.16 113.66 2rgk n TYR 351 Ca -0.16 0.00 -0.16 0.00 -0.01 0.00 0.00 57.90 57.58 2rgk n TYR 351 Cb 0.89 -0.07 -0.09 0.00 -0.02 0.00 0.00 39.34 40.06 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 -1.46 2.71 -4.71 7.72 4.77 0.62 -4.85 117.00 121.80 2rgk n LEU 352 Ca -0.00 -0.04 -0.42 0.00 -0.03 0.00 0.00 56.01 55.52 2rgk n LEU 352 Cb 0.10 -0.69 -0.03 0.00 -2.33 0.00 0.00 43.42 40.47 2rgk n LEU 352 CO 0.09 0.77 1.21 -0.04 -1.33 0.00 0.00 177.39 178.08 2rgk s MET 353 N -2.40 4.24 -0.58 3.23 -1.94 -0.43 -0.03 119.30 121.39 2rgk s MET 353 Ca -0.28 2.28 -0.00 0.00 -1.71 0.00 0.00 55.69 55.98 2rgk s MET 353 Cb 0.08 -3.26 0.15 0.00 2.01 0.00 0.00 34.83 33.81 2rgk s MET 353 CO 0.45 -0.59 0.37 0.34 -0.01 0.00 0.00 175.02 175.58 2rgk s ASP 354 N 1.36 4.93 0.39 3.03 -1.08 0.20 -4.85 116.67 120.65 2rgk s ASP 354 Ca 0.69 -2.88 0.21 0.00 -0.52 0.00 0.00 52.55 50.05 2rgk s ASP 354 Cb -0.41 -1.78 0.67 0.00 -1.46 0.00 0.00 42.92 39.94 2rgk s ASP 354 CO 0.31 -0.33 1.72 1.88 0.52 0.00 0.00 175.17 179.27 2rgk h TYR 355 N 6.88 0.00 0.09 -5.34 -1.99 -1.88 0.14 116.97 114.87 2rgk h TYR 355 Ca -0.04 0.00 -0.00 0.00 2.00 0.00 0.00 58.73 60.69 2rgk h TYR 355 Cb 0.93 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.67 2rgk h TYR 355 CO 0.64 0.30 -0.04 1.49 -0.00 0.00 0.00 178.16 180.55 2rgk h GLU 356 N 0.00 -0.11 0.00 4.88 4.81 -1.94 -3.36 114.58 118.86 2rgk h GLU 356 Ca -0.00 0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 2rgk h GLU 356 Cb 0.92 0.03 0.00 0.00 0.63 0.00 0.00 28.75 30.33 2rgk h GLU 356 CO 0.04 0.43 -1.08 0.09 -0.73 0.00 0.00 179.01 177.76 2rgk n ASN 357 N -4.84 0.73 0.00 1.04 3.02 -1.25 -5.08 115.26 108.88 2rgk n ASN 357 Ca -0.08 -0.61 0.00 0.00 -0.03 0.00 0.00 54.58 53.86 2rgk n ASN 357 Cb 0.29 1.00 0.00 0.00 -0.61 0.00 0.00 39.78 40.46 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 1.44 2.52 7.00 7.41 0.00 0.04 -4.39 105.19 119.21 2rgk n GLY 358 Ca 0.03 -1.78 0.00 0.00 0.00 0.00 0.00 46.02 44.27 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 -4.37 1.61 2.88 -1.22 -4.58 113.62 107.94 2rgk n SER 359 Ca 0.00 0.00 -0.22 0.00 -1.33 0.00 0.00 58.87 57.32 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 1.90 0.78 0.66 0.52 -1.26 -0.63 118.94 120.91 2rgk s TRP 360 Ca 0.00 -0.47 -0.10 0.00 0.02 0.00 0.00 56.10 55.55 2rgk s TRP 360 Cb 0.00 -0.91 0.06 0.00 -1.15 0.00 0.00 33.47 31.48 2rgk s TRP 360 CO 0.00 0.41 1.09 -1.58 0.02 0.00 0.00 176.95 176.90 2rgk s TRP 361 N -2.36 2.53 -0.15 -1.98 0.52 0.96 -4.83 118.94 113.63 2rgk s TRP 361 Ca 0.20 1.56 -0.00 0.00 0.02 0.00 0.00 56.10 57.88 2rgk s TRP 361 Cb -0.04 -3.06 -0.24 0.00 -1.15 0.00 0.00 33.47 28.98 2rgk s TRP 361 CO 0.08 -1.86 0.25 0.94 0.02 0.00 0.00 176.95 176.38 2rgk n GLN 362 N -3.57 0.71 -3.70 4.98 -0.06 -1.26 -4.63 117.38 109.86 2rgk n GLN 362 Ca 0.09 0.22 -0.14 0.00 -2.00 0.00 0.00 57.00 55.18 2rgk n GLN 362 Cb 0.53 -1.67 -0.09 0.00 -4.06 0.00 0.00 30.24 24.96 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 -2.55 0.62 0.20 3.69 2.12 -1.26 -0.82 118.70 120.69 2rgk s GLU 363 Ca -0.22 0.65 0.10 0.00 0.36 0.00 0.00 54.97 55.86 2rgk s GLU 363 Cb 0.07 0.30 -0.04 0.00 0.26 0.00 0.00 34.13 34.72 2rgk s GLU 363 CO 0.74 -0.09 -0.19 -0.51 -0.54 0.00 0.00 175.26 174.67 2rgk s LEU 364 N 0.13 2.48 0.00 2.70 1.43 -0.67 -2.87 118.68 121.89 2rgk s LEU 364 Ca -0.01 -0.91 -0.09 0.00 -1.03 0.00 0.00 54.13 52.08 2rgk s LEU 364 Cb -0.03 -0.94 0.13 0.00 0.03 0.00 0.00 46.19 45.38 2rgk s LEU 364 CO 0.01 -0.00 0.69 -0.90 0.23 0.00 0.00 176.35 176.38 2rgk n ASP 365 N 0.06 -0.34 0.06 2.29 5.68 -0.36 -0.84 116.55 123.09 2rgk n ASP 365 Ca -0.11 -1.16 0.06 0.00 -0.50 0.00 0.00 54.79 53.07 2rgk n ASP 365 Cb 0.58 -0.55 0.27 0.00 -1.14 0.00 0.00 41.12 40.28 2rgk n ASP 365 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2rgk n ALA 366 N -3.59 1.24 -0.42 2.12 0.00 -1.26 -1.32 120.51 117.28 2rgk n ALA 366 Ca -0.11 0.05 0.09 0.00 0.00 0.00 0.00 53.44 53.46 2rgk n ALA 366 Cb 0.31 -1.18 0.27 0.00 0.00 0.00 0.00 19.45 18.86 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 -1.78 3.83 -1.58 0.00 8.00 -1.26 -4.79 116.55 118.96 2rgk n ASP 367 Ca 0.01 -2.18 -0.14 0.00 0.71 0.00 0.00 54.79 53.18 2rgk n ASP 367 Cb 0.07 -0.43 -0.01 0.00 -0.02 0.00 0.00 41.12 40.73 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 1.01 -4.31 -4.80 -2.24 3.02 -0.43 -5.02 115.26 102.49 2rgk n ASN 368 Ca 0.21 -0.01 -0.34 0.00 -0.03 0.00 0.00 54.58 54.41 2rgk n ASN 368 Cb 0.65 -3.46 -0.07 0.00 -0.61 0.00 0.00 39.78 36.28 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 -4.66 3.18 0.46 3.52 1.02 -1.26 -4.85 119.74 117.14 2rgk s LYS 369 Ca 0.00 -0.36 -0.25 0.00 0.02 0.00 0.00 55.97 55.39 2rgk s LYS 369 Cb 0.00 -2.95 -0.08 0.00 -0.52 0.00 0.00 37.83 34.28 2rgk s LYS 369 CO 0.00 0.70 1.37 0.08 -0.92 0.00 0.00 175.35 176.58 2rgk s VAL 370 N -1.09 2.26 0.06 3.17 1.01 -1.26 -1.23 120.40 123.32 2rgk s VAL 370 Ca 0.19 0.22 0.04 0.00 0.00 0.00 0.00 61.98 62.43 2rgk s VAL 370 Cb -0.12 -3.13 -0.03 0.00 0.00 0.00 0.00 36.38 33.11 2rgk s VAL 370 CO 0.09 0.02 -0.12 0.42 0.00 0.00 0.00 175.10 175.51 2rgk s THR 371 N -1.25 0.95 0.00 3.92 -4.23 -1.14 -4.82 115.64 109.07 2rgk s THR 371 Ca 0.62 -1.24 0.04 0.00 -1.18 0.00 0.00 61.69 59.93 2rgk s THR 371 Cb -0.41 -0.94 -0.01 0.00 1.34 0.00 0.00 72.50 72.48 2rgk s THR 371 CO 0.52 -0.27 -0.13 0.42 -0.54 0.00 0.00 174.62 174.61 2rgk s THR 372 N -1.31 1.06 0.00 3.99 -4.23 -1.26 -4.71 115.64 109.17 2rgk s THR 372 Ca -0.04 -0.69 0.00 0.00 -1.18 0.00 0.00 61.69 59.77 2rgk s THR 372 Cb -0.10 -0.91 0.00 0.00 1.34 0.00 0.00 72.50 72.84 2rgk s THR 372 CO 0.02 0.20 0.00 0.61 -0.54 0.00 0.00 174.62 174.91 2rgk n GLY 377 N 2.50 1.55 2.48 3.99 0.00 -1.26 -5.15 105.19 109.30 2rgk n GLY 377 Ca -0.15 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.67 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 1.79 0.00 1.61 5.02 0.61 -4.35 118.16 122.84 2rgk n LYS 378 Ca 0.00 -3.85 0.11 0.00 -2.02 0.00 0.00 58.31 52.55 2rgk n LYS 378 Cb 0.00 -1.83 0.60 0.00 -0.02 0.00 0.00 35.03 33.78 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 0.04 0.50 -4.27 1.97 0.00 -0.99 -4.45 117.38 110.18 2rgk n GLN 379 Ca 0.26 0.04 -0.18 0.00 0.00 0.00 0.00 57.00 57.11 2rgk n GLN 379 Cb 0.61 -1.50 -0.13 0.00 0.00 0.00 0.00 30.24 29.22 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 -2.29 1.49 0.00 2.61 2.15 -1.26 -4.69 116.67 114.68 2rgk s ASP 380 Ca 0.27 -0.48 0.00 0.00 0.43 0.00 0.00 52.55 52.77 2rgk s ASP 380 Cb 0.15 -0.07 0.00 0.00 -0.30 0.00 0.00 42.92 42.70 2rgk s ASP 380 CO 0.29 -0.02 0.01 2.30 -0.17 0.00 0.00 175.17 177.58 2rgk n ILE 381 N 1.78 0.00 -0.17 4.11 -5.35 -1.26 -4.87 119.36 113.60 2rgk n ILE 381 Ca -0.19 -0.06 -0.03 0.00 -0.27 0.00 0.00 62.75 62.20 2rgk n ILE 381 Cb 0.55 1.15 0.07 0.00 -1.74 0.00 0.00 39.64 39.67 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 0.40 -0.52 4.28 3.20 -1.93 -2.38 116.97 120.02 2rgk h TYR 382 Ca 0.00 0.02 -0.03 0.00 3.14 0.00 0.00 58.73 61.86 2rgk h TYR 382 Cb 0.08 -0.10 -0.03 0.00 1.54 0.00 0.00 36.73 38.22 2rgk h TYR 382 CO 0.00 0.16 0.20 0.45 -1.64 0.00 0.00 178.16 177.33 2rgk h HIS 383 N 0.43 0.76 -0.15 -3.82 3.86 -1.99 -3.04 115.15 111.19 2rgk h HIS 383 Ca 0.25 -0.04 0.04 0.00 -1.16 0.00 0.00 60.37 59.46 2rgk h HIS 383 Cb 0.22 -0.23 -0.01 0.00 1.06 0.00 0.00 27.41 28.45 2rgk h HIS 383 CO -0.13 0.60 0.16 -0.07 0.86 0.00 0.00 177.93 179.34 2rgk h LEU 384 N 0.75 0.00 -1.22 2.43 3.38 -1.78 -1.14 115.31 117.72 2rgk h LEU 384 Ca 0.18 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.13 2rgk h LEU 384 Cb 0.16 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.91 2rgk h LEU 384 CO -0.02 0.00 -0.07 -0.07 0.09 0.00 0.00 178.44 178.38 2rgk h LEU 385 N 0.00 0.00 -0.78 1.67 3.38 -1.60 -1.90 115.31 116.08 2rgk h LEU 385 Ca 0.07 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.04 2rgk h LEU 385 Cb 0.40 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.15 2rgk h LEU 385 CO -0.00 0.07 0.00 0.45 0.09 0.00 0.00 178.44 179.04 2rgk h HIS 386 N 0.00 0.00 -0.00 1.13 3.86 -1.39 0.16 115.15 118.91 2rgk h HIS 386 Ca -0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 2rgk h HIS 386 Cb 0.63 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.10 2rgk h HIS 386 CO 0.00 0.00 -0.03 0.00 0.86 0.00 0.00 177.93 178.76 2rgk n LEU 388 N -0.08 2.91 -0.13 0.00 4.77 -0.74 -4.76 117.00 118.98 2rgk n LEU 388 Ca 0.02 -0.05 -0.23 0.00 -0.03 0.00 0.00 56.01 55.71 2rgk n LEU 388 Cb 0.07 -0.40 -0.10 0.00 -2.33 0.00 0.00 43.42 40.66 2rgk n LEU 388 CO 0.03 0.68 -1.35 0.52 -1.33 0.00 0.00 177.39 175.93 2rgk n VAL 389 N -2.86 1.40 -0.31 4.08 0.31 0.49 -4.59 118.33 116.84 2rgk n VAL 389 Ca -0.20 -0.43 0.14 0.00 -0.01 0.00 0.00 64.34 63.84 2rgk n VAL 389 Cb 0.71 -1.65 0.32 0.00 -0.91 0.00 0.00 33.84 32.31 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 -0.56 0.49 0.00 2.52 2.04 -1.59 0.24 117.51 120.65 2rgk h ILE 390 Ca -0.61 -0.15 0.00 0.00 1.00 0.00 0.00 64.86 65.11 2rgk h ILE 390 Cb 1.68 0.02 0.00 0.00 -0.74 0.00 0.00 36.82 37.78 2rgk h ILE 390 CO -0.27 0.08 0.00 -2.65 0.00 0.00 0.00 178.15 175.30 2rgk n PRO 391 N -5.02 0.26 -0.00 2.37 -0.02 -1.26 -2.43 135.00 128.89 2rgk n PRO 391 Ca 0.23 0.10 0.08 0.00 -2.02 0.00 0.00 63.50 61.89 2rgk n PRO 391 Cb 0.66 -1.50 -0.10 0.00 -0.02 0.00 0.00 33.50 32.55 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 -1.17 1.41 -4.31 -0.52 1.74 0.84 -4.63 116.66 110.03 2rgk n ARG 392 Ca 0.07 -0.00 -0.17 0.00 -0.77 0.00 0.00 57.85 56.98 2rgk n ARG 392 Cb 0.07 -1.30 -0.10 0.00 -1.02 0.00 0.00 32.46 30.11 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 -2.60 1.35 0.95 0.55 -4.36 -1.02 -0.42 121.20 115.65 2rgk s ILE 393 Ca 0.06 -2.11 -0.12 0.00 -0.26 0.00 0.00 60.65 58.23 2rgk s ILE 393 Cb 0.13 -2.05 0.16 0.00 1.25 0.00 0.00 42.46 41.95 2rgk s ILE 393 CO 0.69 -0.59 1.09 -2.16 0.24 0.00 0.00 174.94 174.22 2rgk s PRO 394 N -3.74 0.85 0.13 0.37 0.04 -1.26 -4.92 135.00 126.47 2rgk s PRO 394 Ca 0.22 0.87 0.23 0.00 0.04 0.00 0.00 61.00 62.36 2rgk s PRO 394 Cb 0.02 -1.76 0.90 0.00 0.04 0.00 0.00 34.50 33.71 2rgk s PRO 394 CO 0.05 -2.54 1.71 1.28 0.04 0.00 0.00 177.00 177.54 2rgk n LEU 395 N -4.09 0.40 -3.79 -3.56 4.77 -1.26 -4.68 117.00 104.79 2rgk n LEU 395 Ca 0.07 0.57 -0.14 0.00 -0.03 0.00 0.00 56.01 56.48 2rgk n LEU 395 Cb 0.55 -0.48 -0.15 0.00 -2.33 0.00 0.00 43.42 41.01 2rgk n LEU 395 CO 0.55 -0.28 -0.30 0.00 -1.33 0.00 0.00 177.39 176.03 2rgk s ALA 396 N -3.12 -0.08 1.00 -1.18 0.00 -1.26 -4.40 121.76 112.72 2rgk s ALA 396 Ca 0.08 0.34 0.00 0.00 0.00 0.00 0.00 51.96 52.39 2rgk s ALA 396 Cb 0.12 -0.24 0.00 0.00 0.00 0.00 0.00 23.12 23.00 2rgk s ALA 396 CO 0.44 -0.09 0.00 -0.35 0.00 0.00 0.00 175.76 175.76 2rgk n PRO 397 N 3.79 -0.07 -0.51 0.00 -0.04 -1.26 -5.00 135.00 131.91 2rgk n PRO 397 Ca -0.22 0.00 -0.29 0.00 -0.04 0.00 0.00 63.50 62.95 2rgk n PRO 397 Cb 0.54 0.00 0.24 0.00 -0.04 0.00 0.00 33.50 34.24 2rgk n PRO 397 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2rgk n GLY 398 N 4.72 -2.30 0.16 0.55 0.00 -1.26 -4.39 105.19 102.67 2rgk n GLY 398 Ca 0.00 -1.11 -0.05 0.00 0.00 0.00 0.00 46.02 44.85 2rgk n GLY 398 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 2rgk h MET 399 N -2.62 -0.22 -0.23 1.61 4.05 -1.91 0.49 114.93 116.10 2rgk h MET 399 Ca -0.61 0.02 0.06 0.00 -0.28 0.00 0.00 59.70 58.88 2rgk h MET 399 Cb 1.34 0.05 -0.06 0.00 -0.80 0.00 0.00 31.60 32.13 2rgk h MET 399 CO 0.46 -0.15 -0.17 0.00 0.23 0.00 0.00 176.91 177.28 2rgk h ALA 400 N -1.14 -0.02 -0.59 0.39 0.00 -1.94 0.56 119.26 116.52 2rgk h ALA 400 Ca 0.00 0.08 0.05 0.00 0.00 0.00 0.00 54.91 55.04 2rgk h ALA 400 Cb 0.25 0.37 -0.05 0.00 0.00 0.00 0.00 17.79 18.36 2rgk h ALA 400 CO -0.12 -0.59 0.33 -1.35 0.00 0.00 0.00 179.25 177.52 2rgk h PRO 401 N -0.17 0.61 -0.48 0.00 0.11 -1.86 0.14 132.00 130.36 2rgk h PRO 401 Ca 0.13 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 66.18 2rgk h PRO 401 Cb 0.36 -0.14 -0.02 0.00 0.11 0.00 0.00 31.00 31.31 2rgk h PRO 401 CO -0.33 0.41 0.21 0.00 -0.21 0.00 0.00 178.00 178.07 2rgk h ALA 402 N 1.30 0.62 -0.43 -0.75 0.00 0.73 0.21 119.26 120.95 2rgk h ALA 402 Ca 0.26 -0.14 -0.11 0.00 0.00 0.00 0.00 54.91 54.91 2rgk h ALA 402 Cb 0.12 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 2rgk h ALA 402 CO -0.15 0.22 -0.19 0.28 0.00 0.00 0.00 179.25 179.40 2rgk h VAL 403 N 0.64 1.27 0.00 0.00 2.07 -0.66 -0.66 116.25 118.91 2rgk h VAL 403 Ca 0.16 -1.31 -0.07 0.00 0.82 0.00 0.00 66.70 66.30 2rgk h VAL 403 Cb 0.17 1.14 -0.01 0.00 -1.52 0.00 0.00 31.29 31.07 2rgk h VAL 403 CO -0.02 0.45 -0.35 0.00 0.02 0.00 0.00 177.57 177.67 2rgk h ALA 404 N 1.04 1.33 -0.03 1.67 0.00 -0.33 -1.83 119.26 121.12 2rgk h ALA 404 Ca 0.11 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.70 2rgk h ALA 404 Cb 0.72 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.45 2rgk h ALA 404 CO 0.06 0.43 0.00 0.00 0.00 0.00 0.00 179.25 179.74 2rgk n ALA 405 N -2.43 2.61 -2.08 0.00 0.00 0.71 -4.91 120.51 114.42 2rgk n ALA 405 Ca -0.02 -0.32 -0.02 0.00 0.00 0.00 0.00 53.44 53.08 2rgk n ALA 405 Cb 0.40 -1.30 -0.00 0.00 0.00 0.00 0.00 19.45 18.55 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 1.05 0.34 0.61 0.00 0.00 -0.69 -4.97 105.19 101.54 2rgk n GLY 406 Ca 0.20 -0.80 0.12 0.00 0.00 0.00 0.00 46.02 45.54 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 -0.31 1.86 -4.67 0.99 4.77 -0.29 -4.85 117.00 114.49 2rgk n LEU 407 Ca -0.02 -0.73 -0.44 0.00 -0.03 0.00 0.00 56.01 54.78 2rgk n LEU 407 Cb 0.52 -0.09 -0.04 0.00 -2.33 0.00 0.00 43.42 41.48 2rgk n LEU 407 CO 0.03 0.37 1.52 -0.11 -1.33 0.00 0.00 177.39 177.86 2rgk n LEU 408 N 0.45 3.85 0.00 2.23 7.94 -1.26 -1.38 117.00 128.82 2rgk n LEU 408 Ca 0.17 0.95 0.00 0.00 -1.11 0.00 0.00 56.01 56.02 2rgk n LEU 408 Cb 0.38 -1.47 0.00 0.00 0.53 0.00 0.00 43.42 42.85 2rgk n LEU 408 CO 0.14 0.08 0.00 0.47 -1.11 0.00 0.00 177.39 176.98 2rgk n ASP 409 N 6.62 -4.12 -0.35 1.96 8.00 0.44 -4.88 116.55 124.21 2rgk n ASP 409 Ca 0.20 0.00 0.36 0.00 0.71 0.00 0.00 54.79 56.07 2rgk n ASP 409 Cb 0.36 -2.08 0.75 0.00 -0.02 0.00 0.00 41.12 40.13 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 0.38 -0.02 0.53 6.09 -1.38 0.46 117.51 123.56 2rgk h ILE 410 Ca 0.00 -0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.49 2rgk h ILE 410 Cb 0.49 0.37 0.00 0.00 0.47 0.00 0.00 36.82 38.15 2rgk h ILE 410 CO 0.00 0.00 -0.12 0.59 -3.07 0.00 0.00 178.15 175.55 2rgk n ASN 411 N -4.17 2.32 -4.90 2.19 3.02 -1.26 -5.01 115.26 107.45 2rgk n ASN 411 Ca 0.27 -1.66 -0.28 0.00 -0.03 0.00 0.00 54.58 52.88 2rgk n ASN 411 Cb 1.30 0.15 0.00 0.00 -0.61 0.00 0.00 39.78 40.63 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 -1.75 3.32 0.00 5.41 0.00 0.15 -4.83 121.76 124.06 2rgk s ALA 412 Ca 0.20 -0.40 0.00 0.00 0.00 0.00 0.00 51.96 51.76 2rgk s ALA 412 Cb 0.15 -2.72 0.00 0.00 0.00 0.00 0.00 23.12 20.56 2rgk s ALA 412 CO 0.31 -0.44 0.00 1.63 0.00 0.00 0.00 175.76 177.26