#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 3.43 -0.03 2.12 1.02 -1.26 -4.95 119.74 120.07 2rgk s LYS 2 Ca 0.00 -0.63 -0.01 0.00 0.02 0.00 0.00 55.97 55.35 2rgk s LYS 2 Cb 0.00 -2.87 -0.01 0.00 -0.52 0.00 0.00 37.83 34.43 2rgk s LYS 2 CO 0.00 0.01 -0.04 0.91 -0.92 0.00 0.00 175.35 175.31 2rgk n TRP 3 N 4.16 0.00 -1.58 3.18 7.02 -1.26 -4.93 117.44 124.03 2rgk n TRP 3 Ca -0.18 0.00 -0.48 0.00 -1.02 0.00 0.00 57.50 55.82 2rgk n TRP 3 Cb 0.52 -0.11 -0.04 0.00 -2.42 0.00 0.00 31.31 29.26 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 -3.13 1.33 -2.39 -5.99 0.99 -1.26 -2.15 117.46 104.86 2rgk n PHE 4 Ca -0.06 0.67 -0.21 0.00 -0.00 0.00 0.00 57.45 57.85 2rgk n PHE 4 Cb 0.54 -2.28 -0.01 0.00 -1.00 0.00 0.00 39.48 36.73 2rgk n PHE 4 CO 0.00 0.00 0.00 0.09 -0.00 0.00 0.00 176.76 176.85 2rgk n ASN 5 N 1.91 -5.87 -4.22 4.37 5.03 -1.26 -4.99 115.26 110.22 2rgk n ASN 5 Ca 0.14 -0.00 -0.32 0.00 0.87 0.00 0.00 54.58 55.27 2rgk n ASN 5 Cb 0.26 -4.90 -0.17 0.00 -1.02 0.00 0.00 39.78 33.96 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 -3.03 2.02 0.46 3.41 -4.23 -0.92 -1.42 115.64 111.93 2rgk s THR 6 Ca 0.00 -1.01 0.14 0.00 -1.18 0.00 0.00 61.69 59.64 2rgk s THR 6 Cb 0.00 -1.74 0.31 0.00 1.34 0.00 0.00 72.50 72.41 2rgk s THR 6 CO 0.00 0.55 2.04 -0.07 -0.54 0.00 0.00 174.62 176.61 2rgk h LEU 7 N 6.59 0.27 -0.28 4.79 3.38 -0.20 -2.01 115.31 127.85 2rgk h LEU 7 Ca -0.22 -0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.72 2rgk h LEU 7 Cb 1.22 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.91 2rgk h LEU 7 CO 0.47 0.18 0.06 0.77 0.09 0.00 0.00 178.44 180.01 2rgk h SER 8 N 0.31 0.42 -0.21 -0.43 4.64 -1.93 0.82 113.55 117.17 2rgk h SER 8 Ca 0.18 -0.24 -0.02 0.00 -0.47 0.00 0.00 61.79 61.23 2rgk h SER 8 Cb 0.31 -0.11 -0.01 0.00 -0.31 0.00 0.00 62.40 62.28 2rgk h SER 8 CO -0.04 0.56 0.03 -0.74 -0.87 0.00 0.00 176.83 175.77 2rgk h HIS 9 N 0.27 0.36 -0.28 4.77 -0.00 -1.76 -2.61 115.15 115.91 2rgk h HIS 9 Ca 0.09 -0.05 0.02 0.00 -0.00 0.00 0.00 60.37 60.43 2rgk h HIS 9 Cb 0.30 -0.10 -0.01 0.00 -0.00 0.00 0.00 27.41 27.60 2rgk h HIS 9 CO 0.02 0.48 0.19 -0.91 -0.00 0.00 0.00 177.93 177.71 2rgk h ASN 10 N 0.14 0.24 -0.04 3.26 4.21 -1.25 0.18 115.58 122.32 2rgk h ASN 10 Ca 0.06 -0.00 -0.12 0.00 1.21 0.00 0.00 56.30 57.44 2rgk h ASN 10 Cb 0.31 -0.06 -0.01 0.00 -1.12 0.00 0.00 38.32 37.45 2rgk h ASN 10 CO 0.00 0.17 -0.37 0.03 -1.29 0.00 0.00 177.43 175.97 2rgk h ARG 11 N 0.28 0.55 -0.27 0.81 3.08 -0.60 -1.10 114.38 117.13 2rgk h ARG 11 Ca 0.11 -0.26 -0.10 0.00 0.07 0.00 0.00 59.98 59.80 2rgk h ARG 11 Cb 0.10 -0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.14 2rgk h ARG 11 CO -0.02 0.83 -0.27 2.35 -1.07 0.00 0.00 179.97 181.79 2rgk h TRP 12 N 0.46 0.61 -0.25 3.04 7.01 -0.66 -1.86 115.95 124.29 2rgk h TRP 12 Ca 0.05 -0.14 -0.06 0.00 2.11 0.00 0.00 58.89 60.85 2rgk h TRP 12 Cb 0.85 -0.14 -0.01 0.00 -2.10 0.00 0.00 29.16 27.76 2rgk h TRP 12 CO 0.03 0.76 -0.06 -0.07 -2.79 0.00 0.00 178.44 176.31 2rgk h LEU 13 N 0.47 0.49 -0.99 0.65 3.38 -0.69 -2.39 115.31 116.23 2rgk h LEU 13 Ca 0.06 -0.37 -0.02 0.00 0.09 0.00 0.00 57.88 57.65 2rgk h LEU 13 Cb 0.72 -0.13 -0.04 0.00 0.09 0.00 0.00 40.66 41.29 2rgk h LEU 13 CO 0.06 0.75 0.42 -0.08 0.09 0.00 0.00 178.44 179.67 2rgk h GLU 14 N 0.23 1.13 -0.55 1.13 4.81 -1.05 0.30 114.58 120.59 2rgk h GLU 14 Ca 0.06 -0.14 -0.06 0.00 -0.13 0.00 0.00 59.36 59.09 2rgk h GLU 14 Cb 0.53 -0.22 -0.02 0.00 0.63 0.00 0.00 28.75 29.67 2rgk h GLU 14 CO 0.03 0.85 0.09 1.96 -0.73 0.00 0.00 179.01 181.20 2rgk h GLN 15 N 1.14 0.87 -0.06 1.92 4.20 -1.26 -0.38 115.11 121.53 2rgk h GLN 15 Ca 0.28 -0.20 -0.17 0.00 0.06 0.00 0.00 58.65 58.62 2rgk h GLN 15 Cb 0.06 -0.12 -0.01 0.00 0.30 0.00 0.00 27.48 27.71 2rgk h GLN 15 CO -0.04 0.81 -0.72 1.49 -0.67 0.00 0.00 178.83 179.70 2rgk h GLU 16 N 0.83 0.31 -0.52 1.46 4.57 -0.85 -2.82 114.58 117.55 2rgk h GLU 16 Ca 0.17 -0.25 0.00 0.00 -1.18 0.00 0.00 59.36 58.10 2rgk h GLU 16 Cb 0.37 0.05 -0.03 0.00 -0.16 0.00 0.00 28.75 28.98 2rgk h GLU 16 CO 0.01 0.90 0.33 1.15 -1.18 0.00 0.00 179.01 180.22 2rgk h THR 17 N 0.21 1.15 -0.71 0.32 2.02 0.44 -1.74 112.91 114.60 2rgk h THR 17 Ca -0.02 -0.31 -0.04 0.00 0.77 0.00 0.00 66.41 66.81 2rgk h THR 17 Cb 1.28 0.41 -0.03 0.00 -1.74 0.00 0.00 68.15 68.07 2rgk h THR 17 CO 0.12 0.15 0.29 0.44 0.37 0.00 0.00 175.52 176.88 2rgk h ASP 18 N 0.71 0.98 -0.75 4.18 3.32 -1.03 0.18 116.42 124.01 2rgk h ASP 18 Ca 0.19 -0.17 0.03 0.00 0.02 0.00 0.00 57.03 57.10 2rgk h ASP 18 Cb -0.04 -0.25 -0.04 0.00 0.22 0.00 0.00 39.33 39.21 2rgk h ASP 18 CO -0.04 0.88 0.50 -0.09 -1.72 0.00 0.00 179.24 178.77 2rgk h ARG 19 N 1.02 0.92 -0.04 3.56 2.43 -1.22 0.17 114.38 121.21 2rgk h ARG 19 Ca 0.24 -0.06 -0.04 0.00 -0.81 0.00 0.00 59.98 59.31 2rgk h ARG 19 Cb 0.21 -0.21 0.00 0.00 -0.42 0.00 0.00 29.97 29.55 2rgk h ARG 19 CO -0.02 0.61 -0.13 0.82 -1.51 0.00 0.00 179.97 179.74 2rgk h ILE 20 N 0.95 1.45 -0.72 1.20 1.08 -0.54 -1.98 117.51 118.95 2rgk h ILE 20 Ca 0.29 -1.52 0.09 0.00 -0.39 0.00 0.00 64.86 63.33 2rgk h ILE 20 Cb 0.00 2.34 -0.07 0.00 -3.07 0.00 0.00 36.82 36.03 2rgk h ILE 20 CO -0.08 0.42 0.37 -0.26 -0.69 0.00 0.00 178.15 177.91 2rgk h PHE 21 N -0.37 0.66 -0.37 1.37 0.04 -0.22 -1.02 116.94 117.03 2rgk h PHE 21 Ca -0.00 0.03 0.06 0.00 2.80 0.00 0.00 57.97 60.85 2rgk h PHE 21 Cb 0.74 -0.19 -0.05 0.00 2.20 0.00 0.00 35.95 38.65 2rgk h PHE 21 CO 0.13 0.25 0.06 -0.44 -0.60 0.00 0.00 178.31 177.71 2rgk h ASP 22 N 0.63 -0.01 -0.46 2.17 3.45 -0.63 -2.80 116.42 118.78 2rgk h ASP 22 Ca 0.35 0.07 0.03 0.00 0.43 0.00 0.00 57.03 57.90 2rgk h ASP 22 Cb 0.35 0.09 -0.03 0.00 -0.56 0.00 0.00 39.33 39.18 2rgk h ASP 22 CO -0.26 0.03 0.25 0.15 -1.57 0.00 0.00 179.24 177.84 2rgk h PHE 23 N 0.18 0.47 0.00 4.55 3.57 -0.41 -2.68 116.94 122.61 2rgk h PHE 23 Ca 0.18 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.70 2rgk h PHE 23 Cb 0.21 -0.14 0.00 0.00 2.79 0.00 0.00 35.95 38.81 2rgk h PHE 23 CO -0.20 0.26 0.00 0.41 -2.23 0.00 0.00 178.31 176.54 2rgk n GLY 24 N -1.23 -0.98 0.26 2.40 0.00 -0.80 -3.52 105.19 101.33 2rgk n GLY 24 Ca 0.03 -0.03 0.02 0.00 0.00 0.00 0.00 46.02 46.04 2rgk n GLY 24 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2rgk h LYS 25 N 0.00 0.39 0.00 1.61 1.57 -1.36 -2.68 116.57 116.09 2rgk h LYS 25 Ca 0.00 -0.07 0.00 0.00 -1.87 0.00 0.00 60.65 58.71 2rgk h LYS 25 Cb 0.24 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.48 2rgk h LYS 25 CO 0.00 0.42 0.00 0.09 -0.57 0.00 0.00 179.45 179.39 2rgk n ASN 26 N -4.32 0.00 0.00 0.86 5.03 -1.23 -3.10 115.26 112.50 2rgk n ASN 26 Ca 0.01 -0.17 0.14 0.00 0.87 0.00 0.00 54.58 55.43 2rgk n ASN 26 Cb 0.22 -0.18 0.61 0.00 -1.02 0.00 0.00 39.78 39.41 2rgk n ASN 26 CO 0.00 0.00 0.00 -1.54 -1.83 0.00 0.00 177.26 173.89 2rgk n SER 27 N -1.18 0.01 -4.68 6.41 3.41 -1.01 -4.70 113.62 111.88 2rgk n SER 27 Ca 0.10 0.50 -0.45 0.00 -0.26 0.00 0.00 58.87 58.76 2rgk n SER 27 Cb 0.10 -0.51 -0.04 0.00 -0.26 0.00 0.00 64.21 63.51 2rgk n SER 27 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 2rgk n VAL 28 N -1.51 0.14 -4.07 -3.33 0.31 -1.18 0.28 118.33 108.97 2rgk n VAL 28 Ca 0.07 -0.03 -0.07 0.00 -0.01 0.00 0.00 64.34 64.30 2rgk n VAL 28 Cb 0.34 -1.76 -0.10 0.00 -0.91 0.00 0.00 33.84 31.41 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 1.71 0.21 0.29 2.52 -7.23 -0.52 -4.76 120.40 112.62 2rgk s VAL 29 Ca 0.81 -1.76 0.03 0.00 -1.81 0.00 0.00 61.98 59.25 2rgk s VAL 29 Cb -0.62 -1.50 0.28 0.00 0.56 0.00 0.00 36.38 35.10 2rgk s VAL 29 CO 0.39 -0.97 1.72 -0.65 -0.31 0.00 0.00 175.10 175.27 2rgk h PRO 30 N 3.12 0.46 -0.01 4.82 0.11 -2.01 -1.70 132.00 136.80 2rgk h PRO 30 Ca -0.34 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.74 2rgk h PRO 30 Cb 1.14 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.15 2rgk h PRO 30 CO 0.65 0.31 -0.18 0.25 -0.21 0.00 0.00 178.00 178.82 2rgk n THR 31 N -4.98 0.00 0.00 -1.15 -2.24 -1.26 -4.92 114.28 99.73 2rgk n THR 31 Ca 0.21 -0.12 0.00 0.00 -2.27 0.00 0.00 64.05 61.87 2rgk n THR 31 Cb 0.60 0.26 0.00 0.00 -2.10 0.00 0.00 70.33 69.09 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 1.30 -0.33 3.01 3.38 0.00 -0.64 -4.68 105.19 107.23 2rgk n GLY 32 Ca 0.14 0.01 -0.24 0.00 0.00 0.00 0.00 46.02 45.92 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 1.41 0.86 1.61 0.08 -1.26 -1.43 117.98 119.24 2rgk s PHE 33 Ca 0.00 -0.52 -0.15 0.00 0.12 0.00 0.00 56.93 56.38 2rgk s PHE 33 Cb 0.00 -1.05 0.20 0.00 -0.57 0.00 0.00 43.02 41.60 2rgk s PHE 33 CO 0.00 -0.28 1.10 0.41 -0.10 0.00 0.00 175.22 176.35 2rgk n GLY 34 N 3.87 -1.63 3.33 4.36 0.00 0.82 -4.39 105.19 111.55 2rgk n GLY 34 Ca -0.23 -1.67 -0.43 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 -3.36 3.28 0.17 1.61 -0.11 -1.26 -4.84 118.94 114.43 2rgk s TRP 35 Ca 0.63 -1.21 -0.30 0.00 1.22 0.00 0.00 56.10 56.45 2rgk s TRP 35 Cb -0.02 -3.23 -0.08 0.00 -1.50 0.00 0.00 33.47 28.64 2rgk s TRP 35 CO 0.45 -0.86 1.15 -0.51 -4.62 0.00 0.00 176.95 172.56 2rgk s LEU 36 N 1.56 4.46 0.00 5.86 1.43 -1.26 -0.72 118.68 130.01 2rgk s LEU 36 Ca 0.04 2.14 -0.03 0.00 -1.03 0.00 0.00 54.13 55.24 2rgk s LEU 36 Cb -0.25 -3.60 0.07 0.00 0.03 0.00 0.00 46.19 42.43 2rgk s LEU 36 CO 0.04 -0.30 0.41 0.61 0.23 0.00 0.00 176.35 177.34 2rgk n GLY 37 N 2.20 -0.45 0.33 -3.19 0.00 0.44 -1.14 105.19 103.38 2rgk n GLY 37 Ca 0.04 -1.81 0.21 0.00 0.00 0.00 0.00 46.02 44.46 2rgk n GLY 37 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 2rgk h ASN 38 N -0.44 0.00 -0.19 1.61 -0.26 -1.86 -0.62 115.58 113.81 2rgk h ASN 38 Ca -0.13 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.61 2rgk h ASN 38 Cb 0.41 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.67 2rgk h ASN 38 CO 0.11 0.00 0.00 0.29 -1.06 0.00 0.00 177.43 176.77 2rgk n LYS 39 N -3.26 1.89 -0.50 0.81 4.76 -1.26 -4.69 118.16 115.90 2rgk n LYS 39 Ca -0.03 -1.82 0.00 0.00 -2.87 0.00 0.00 58.31 53.59 2rgk n LYS 39 Cb 0.07 -1.37 0.00 0.00 -1.84 0.00 0.00 35.03 31.90 2rgk n LYS 39 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2rgk n GLY 40 N 1.03 0.75 3.91 0.72 0.00 -0.24 -4.90 105.19 106.47 2rgk n GLY 40 Ca 0.13 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.88 2rgk n GLY 40 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2rgk s GLN 41 N -0.50 3.33 -0.04 1.61 0.00 -1.26 -4.66 119.66 118.13 2rgk s GLN 41 Ca 0.00 0.07 -0.25 0.00 -0.00 0.00 0.00 55.36 55.18 2rgk s GLN 41 Cb 0.00 -2.37 -0.04 0.00 0.00 0.00 0.00 33.01 30.60 2rgk s GLN 41 CO 0.00 -0.34 0.77 0.42 0.00 0.00 0.00 175.29 176.14 2rgk s ILE 42 N -2.78 4.99 -0.74 3.63 1.01 -1.26 0.17 121.20 126.22 2rgk s ILE 42 Ca 0.49 1.59 -0.16 0.00 0.00 0.00 0.00 60.65 62.57 2rgk s ILE 42 Cb -0.10 -4.11 0.17 0.00 0.01 0.00 0.00 42.46 38.43 2rgk s ILE 42 CO 0.44 0.24 0.74 -0.54 0.00 0.00 0.00 174.94 175.82 2rgk s LYS 43 N 0.79 3.37 0.40 2.79 1.02 0.10 -4.87 119.74 123.34 2rgk s LYS 43 Ca 0.41 -2.03 0.10 0.00 0.02 0.00 0.00 55.97 54.47 2rgk s LYS 43 Cb -0.19 -4.43 0.91 0.00 -0.52 0.00 0.00 37.83 33.60 2rgk s LYS 43 CO 0.21 -1.40 1.96 0.93 -0.92 0.00 0.00 175.35 176.14 2rgk h GLU 44 N 8.38 0.54 0.00 1.68 5.08 -1.93 -1.69 114.58 126.64 2rgk h GLU 44 Ca -0.05 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.28 2rgk h GLU 44 Cb 1.06 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 30.19 2rgk h GLU 44 CO 0.92 0.36 0.00 1.05 -1.00 0.00 0.00 179.01 180.33 2rgk h GLU 45 N 0.56 0.00 0.00 2.33 -0.00 -1.98 -0.34 114.58 115.15 2rgk h GLU 45 Ca 0.30 0.00 0.00 0.00 -0.00 0.00 0.00 59.36 59.66 2rgk h GLU 45 Cb 0.44 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 29.19 2rgk h GLU 45 CO -0.10 0.00 -0.22 0.52 -0.00 0.00 0.00 179.01 179.22 2rgk h MET 46 N 0.00 0.00 0.00 1.06 2.86 -1.69 -3.50 114.93 113.67 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 0.10 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.76 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 1.21 0.09 3.09 8.32 0.00 -0.14 -4.58 105.19 113.18 2rgk n GLY 47 Ca 0.04 -0.96 -0.35 0.00 0.00 0.00 0.00 46.02 44.75 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 3.36 0.37 2.61 2.01 0.17 -4.15 115.64 120.01 2rgk s THR 48 Ca 0.00 -2.59 -0.24 0.00 0.31 0.00 0.00 61.69 59.17 2rgk s THR 48 Cb 0.00 -3.26 -0.10 0.00 0.01 0.00 0.00 72.50 69.15 2rgk s THR 48 CO 0.00 -0.78 0.98 -1.00 -0.69 0.00 0.00 174.62 173.13 2rgk s HIS 49 N 0.46 3.48 0.03 4.92 3.76 -1.26 -1.99 115.29 124.69 2rgk s HIS 49 Ca 0.13 1.71 -0.25 0.00 -0.15 0.00 0.00 55.06 56.49 2rgk s HIS 49 Cb -0.22 -2.98 -0.17 0.00 1.11 0.00 0.00 32.58 30.32 2rgk s HIS 49 CO -0.04 -0.13 1.45 1.25 -0.85 0.00 0.00 174.74 176.42 2rgk h LEU 50 N 2.72 -0.12 -0.81 0.89 5.85 -1.46 -1.97 115.31 120.42 2rgk h LEU 50 Ca -0.48 -0.21 0.11 0.00 0.84 0.00 0.00 57.88 58.14 2rgk h LEU 50 Cb 1.20 0.03 -0.08 0.00 0.37 0.00 0.00 40.66 42.18 2rgk h LEU 50 CO 0.63 0.15 0.43 4.11 -0.34 0.00 0.00 178.44 183.42 2rgk h TRP 51 N -0.40 0.78 -0.48 1.25 5.08 -1.83 0.26 115.95 120.60 2rgk h TRP 51 Ca -0.01 0.03 -0.11 0.00 1.08 0.00 0.00 58.89 59.87 2rgk h TRP 51 Cb 0.33 -0.23 -0.01 0.00 -3.00 0.00 0.00 29.16 26.25 2rgk h TRP 51 CO 0.01 0.27 -0.14 0.82 -1.28 0.00 0.00 178.44 178.12 2rgk h ILE 52 N 0.70 1.27 -0.44 0.12 2.04 -1.91 -0.42 117.51 118.87 2rgk h ILE 52 Ca 0.41 -1.29 -0.05 0.00 1.00 0.00 0.00 64.86 64.93 2rgk h ILE 52 Cb 0.45 1.09 -0.02 0.00 -0.74 0.00 0.00 36.82 37.60 2rgk h ILE 52 CO -0.29 0.45 0.09 0.74 0.00 0.00 0.00 178.15 179.14 2rgk h THR 53 N 0.80 1.24 -0.40 -0.27 2.02 -0.51 -1.28 112.91 114.51 2rgk h THR 53 Ca 0.12 -0.85 -0.02 0.00 0.77 0.00 0.00 66.41 66.43 2rgk h THR 53 Cb 0.71 0.94 -0.02 0.00 -1.74 0.00 0.00 68.15 68.04 2rgk h THR 53 CO 0.05 0.30 0.19 0.00 0.37 0.00 0.00 175.52 176.43 2rgk h ALA 54 N 0.96 0.52 -0.48 6.16 0.00 -0.40 -2.14 119.26 123.87 2rgk h ALA 54 Ca 0.14 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 2rgk h ALA 54 Cb 0.35 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 2rgk h ALA 54 CO 0.00 0.08 0.27 0.00 0.00 0.00 0.00 179.25 179.61 2rgk h ARG 55 N 0.51 0.66 -0.82 0.00 3.08 -0.89 -2.32 114.38 114.61 2rgk h ARG 55 Ca 0.14 -0.07 -0.02 0.00 0.07 0.00 0.00 59.98 60.09 2rgk h ARG 55 Cb 0.12 -0.13 -0.04 0.00 0.08 0.00 0.00 29.97 30.00 2rgk h ARG 55 CO -0.02 0.51 0.42 0.52 -1.07 0.00 0.00 179.97 180.34 2rgk h MET 56 N 0.64 1.15 -0.56 0.04 2.86 -1.13 0.24 114.93 118.16 2rgk h MET 56 Ca 0.17 -0.15 0.05 0.00 -2.06 0.00 0.00 59.70 57.72 2rgk h MET 56 Cb 0.03 -0.22 -0.05 0.00 0.06 0.00 0.00 31.60 31.42 2rgk h MET 56 CO -0.03 0.86 0.29 1.25 1.06 0.00 0.00 176.91 180.34 2rgk h LEU 57 N 1.15 0.41 -0.43 1.22 5.85 -1.03 -0.88 115.31 121.60 2rgk h LEU 57 Ca 0.29 0.03 -0.07 0.00 0.84 0.00 0.00 57.88 58.97 2rgk h LEU 57 Cb 0.06 -0.04 -0.02 0.00 0.37 0.00 0.00 40.66 41.03 2rgk h LEU 57 CO -0.04 0.28 -0.00 -0.74 -0.34 0.00 0.00 178.44 177.59 2rgk h HIS 58 N 0.55 0.83 -0.03 1.25 2.76 -0.81 -2.54 115.15 117.16 2rgk h HIS 58 Ca 0.25 -0.14 -0.00 0.00 -2.20 0.00 0.00 60.37 58.28 2rgk h HIS 58 Cb 0.17 -0.22 -0.00 0.00 1.55 0.00 0.00 27.41 28.91 2rgk h HIS 58 CO -0.10 0.82 0.02 0.28 -1.30 0.00 0.00 177.93 177.65 2rgk h VAL 59 N 0.60 1.05 0.00 5.26 2.07 0.01 -2.67 116.25 122.57 2rgk h VAL 59 Ca 0.12 -0.14 0.00 0.00 0.82 0.00 0.00 66.70 67.50 2rgk h VAL 59 Cb 0.49 1.09 0.00 0.00 -1.52 0.00 0.00 31.29 31.35 2rgk h VAL 59 CO 0.02 0.04 0.00 -1.22 0.02 0.00 0.00 177.57 176.43 2rgk n TYR 60 N -5.04 0.32 0.03 1.57 4.01 -0.39 -1.50 117.16 116.16 2rgk n TYR 60 Ca -0.07 0.12 -0.13 0.00 -0.16 0.00 0.00 57.90 57.66 2rgk n TYR 60 Cb 0.06 -0.69 -0.01 0.00 -0.31 0.00 0.00 39.34 38.38 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 0.64 -0.39 7.72 0.02 -1.11 -1.65 113.55 118.79 2rgk h SER 61 Ca 0.00 -0.44 -0.13 0.00 -0.84 0.00 0.00 61.79 60.39 2rgk h SER 61 Cb 0.36 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 62.70 2rgk h SER 61 CO 0.00 1.20 -0.24 0.58 -1.14 0.00 0.00 176.83 177.23 2rgk h VAL 62 N 0.36 1.28 -0.40 2.27 2.07 -1.08 -2.64 116.25 118.10 2rgk h VAL 62 Ca -0.05 -1.40 -0.08 0.00 0.82 0.00 0.00 66.70 65.99 2rgk h VAL 62 Cb 1.38 1.33 -0.02 0.00 -1.52 0.00 0.00 31.29 32.46 2rgk h VAL 62 CO 0.14 0.47 -0.09 0.00 0.02 0.00 0.00 177.57 178.11 2rgk h ALA 63 N 0.80 1.08 -0.34 1.67 0.00 -1.39 -2.25 119.26 118.82 2rgk h ALA 63 Ca 0.08 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 54.69 2rgk h ALA 63 Cb 0.81 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.42 2rgk h ALA 63 CO 0.07 0.57 0.19 0.00 0.00 0.00 0.00 179.25 180.08 2rgk h ALA 64 N 1.26 0.44 0.00 0.00 0.00 -1.20 -1.69 119.26 118.07 2rgk h ALA 64 Ca 0.11 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 2rgk h ALA 64 Cb 0.54 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.19 2rgk h ALA 64 CO 0.03 -0.04 -0.11 0.00 0.00 0.00 0.00 179.25 179.14 2rgk h ALA 65 N 1.06 1.38 -0.03 0.00 0.00 -1.24 -1.23 119.26 119.19 2rgk h ALA 65 Ca 0.12 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.93 2rgk h ALA 65 Cb 0.05 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.82 2rgk h ALA 65 CO -0.02 0.14 0.00 -1.33 0.00 0.00 0.00 179.25 178.04 2rgk n MET 66 N -3.77 1.23 -1.86 0.00 2.81 -0.67 -4.77 117.12 110.09 2rgk n MET 66 Ca -0.02 -0.34 -0.00 0.00 -1.81 0.00 0.00 57.70 55.53 2rgk n MET 66 Cb 0.22 -1.41 -0.00 0.00 -0.71 0.00 0.00 33.22 31.31 2rgk n MET 66 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2rgk n GLY 67 N 0.98 0.37 3.48 3.03 0.00 -0.46 -5.03 105.19 107.56 2rgk n GLY 67 Ca 0.19 -0.92 -0.43 0.00 0.00 0.00 0.00 46.02 44.86 2rgk n GLY 67 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2rgk s ARG 68 N -3.72 3.20 0.19 1.61 3.00 -1.02 -5.03 118.95 117.19 2rgk s ARG 68 Ca 0.00 -0.62 -0.33 0.00 0.00 0.00 0.00 55.73 54.78 2rgk s ARG 68 Cb 0.00 -4.03 -0.14 0.00 0.00 0.00 0.00 34.95 30.78 2rgk s ARG 68 CO 0.00 -1.17 1.56 -2.30 0.00 0.00 0.00 175.30 173.39 2rgk n PRO 69 N 6.35 2.21 0.00 3.54 -0.02 -1.26 -2.00 135.00 143.82 2rgk n PRO 69 Ca -0.04 0.79 0.00 0.00 -2.02 0.00 0.00 63.50 62.24 2rgk n PRO 69 Cb 0.47 -2.55 0.00 0.00 -0.02 0.00 0.00 33.50 31.40 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 3.15 2.11 0.28 -1.23 0.00 -1.26 -4.93 105.19 103.30 2rgk n GLY 70 Ca 0.15 -0.39 -0.06 0.00 0.00 0.00 0.00 46.02 45.73 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 0.87 -0.98 4.61 0.00 -1.73 -2.31 119.26 119.72 2rgk h ALA 71 Ca 0.00 -0.07 0.02 0.00 0.00 0.00 0.00 54.91 54.85 2rgk h ALA 71 Cb 0.00 -0.28 -0.05 0.00 0.00 0.00 0.00 17.79 17.46 2rgk h ALA 71 CO 0.00 0.33 0.65 -0.92 0.00 0.00 0.00 179.25 179.31 2rgk h TYR 72 N 0.93 1.23 -0.66 0.00 3.20 -1.79 -0.53 116.97 119.35 2rgk h TYR 72 Ca 0.25 0.03 -0.03 0.00 3.14 0.00 0.00 58.73 62.11 2rgk h TYR 72 Cb -0.05 -0.41 -0.03 0.00 1.54 0.00 0.00 36.73 37.78 2rgk h TYR 72 CO -0.02 0.76 0.28 0.77 -1.64 0.00 0.00 178.16 178.31 2rgk h SER 73 N 1.31 0.87 -0.16 -2.11 0.02 -1.82 0.15 113.55 111.81 2rgk h SER 73 Ca 0.37 -0.11 -0.12 0.00 -0.84 0.00 0.00 61.79 61.09 2rgk h SER 73 Cb -0.11 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 62.19 2rgk h SER 73 CO -0.09 0.77 -0.31 -0.07 -1.14 0.00 0.00 176.83 175.99 2rgk h LEU 74 N 0.94 0.68 -0.88 5.07 3.38 -0.84 0.40 115.31 124.06 2rgk h LEU 74 Ca 0.23 -0.27 -0.05 0.00 0.09 0.00 0.00 57.88 57.88 2rgk h LEU 74 Cb 0.16 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 40.69 2rgk h LEU 74 CO -0.02 0.94 0.25 0.58 0.09 0.00 0.00 178.44 180.28 2rgk h VAL 75 N 0.56 1.25 -0.47 1.22 2.07 -0.23 0.18 116.25 120.83 2rgk h VAL 75 Ca 0.07 -0.82 -0.06 0.00 0.82 0.00 0.00 66.70 66.70 2rgk h VAL 75 Cb 0.80 0.44 -0.02 0.00 -1.52 0.00 0.00 31.29 30.99 2rgk h VAL 75 CO 0.07 0.33 0.05 -0.78 0.02 0.00 0.00 177.57 177.26 2rgk h ASP 76 N 1.04 0.77 -0.43 0.57 3.58 -0.19 -0.99 116.42 120.75 2rgk h ASP 76 Ca 0.23 -0.27 -0.05 0.00 0.42 0.00 0.00 57.03 57.36 2rgk h ASP 76 Cb 0.25 -0.20 -0.02 0.00 1.72 0.00 0.00 39.33 41.07 2rgk h ASP 76 CO -0.01 0.85 0.10 -0.74 -2.88 0.00 0.00 179.24 176.55 2rgk h HIS 77 N 0.66 0.79 -0.44 0.28 2.76 -0.32 -1.27 115.15 117.61 2rgk h HIS 77 Ca 0.14 -0.08 -0.08 0.00 -2.20 0.00 0.00 60.37 58.16 2rgk h HIS 77 Cb 0.42 -0.23 -0.02 0.00 1.55 0.00 0.00 27.41 29.14 2rgk h HIS 77 CO 0.03 0.68 -0.02 0.78 -1.30 0.00 0.00 177.93 178.10 2rgk h GLY 78 N 0.94 0.86 1.74 5.26 0.00 -0.25 -0.96 103.07 110.66 2rgk h GLY 78 Ca 0.16 -0.65 -0.08 0.00 0.00 0.00 0.00 47.33 46.76 2rgk h GLY 78 CO 0.00 0.59 -0.27 -2.22 0.00 0.00 0.00 176.54 174.64 2rgk h ILE 79 N 0.63 1.26 0.00 2.60 2.04 -0.85 -1.54 117.51 121.66 2rgk h ILE 79 Ca 0.12 -1.21 -0.13 0.00 1.00 0.00 0.00 64.86 64.64 2rgk h ILE 79 Cb 0.52 1.44 -0.02 0.00 -0.74 0.00 0.00 36.82 38.02 2rgk h ILE 79 CO 0.03 0.37 -0.62 0.11 0.00 0.00 0.00 178.15 178.04 2rgk h LYS 80 N 0.27 0.00 -0.04 2.37 1.57 -1.01 -2.87 116.57 116.86 2rgk h LYS 80 Ca 0.04 0.00 -0.15 0.00 -1.87 0.00 0.00 60.65 58.67 2rgk h LYS 80 Cb 0.63 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.93 2rgk h LYS 80 CO 0.05 0.62 -0.64 0.00 -0.57 0.00 0.00 179.45 178.90 2rgk h ALA 81 N 1.38 0.86 0.00 3.86 0.00 -0.66 -2.67 119.26 122.03 2rgk h ALA 81 Ca -0.01 -0.57 0.00 0.00 0.00 0.00 0.00 54.91 54.33 2rgk h ALA 81 Cb 1.26 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.97 2rgk h ALA 81 CO 0.08 0.76 0.00 -1.33 0.00 0.00 0.00 179.25 178.76 2rgk n MET 82 N -3.83 0.15 -0.23 0.00 2.81 -0.63 -2.42 117.12 112.98 2rgk n MET 82 Ca -0.02 0.21 0.07 0.00 -1.81 0.00 0.00 57.70 56.15 2rgk n MET 82 Cb 0.64 -1.71 0.19 0.00 -0.71 0.00 0.00 33.22 31.63 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 -1.98 3.19 0.00 7.83 3.02 -1.08 -4.45 115.26 121.79 2rgk n ASN 83 Ca 0.05 -2.06 0.00 0.00 -0.03 0.00 0.00 54.58 52.54 2rgk n ASN 83 Cb 0.34 -0.30 0.00 0.00 -0.61 0.00 0.00 39.78 39.21 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 0.67 4.34 0.45 7.41 0.00 -1.02 -4.90 105.19 112.16 2rgk n GLY 84 Ca 0.15 -1.48 0.27 0.00 0.00 0.00 0.00 46.02 44.95 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 0.63 2.70 0.00 4.61 0.00 -1.88 0.65 119.26 125.97 2rgk h ALA 85 Ca 0.00 -0.03 -0.11 0.00 0.00 0.00 0.00 54.91 54.77 2rgk h ALA 85 Cb 0.00 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 2rgk h ALA 85 CO 0.00 -1.04 -0.52 -0.07 0.00 0.00 0.00 179.25 177.62 2rgk h LEU 86 N 0.00 0.00 -9.30 0.00 3.38 -1.84 -3.44 115.31 104.12 2rgk h LEU 86 Ca 0.38 0.00 -0.56 0.00 0.09 0.00 0.00 57.88 57.79 2rgk h LEU 86 Cb 1.63 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 42.33 2rgk h LEU 86 CO -0.00 0.52 0.38 -0.60 0.09 0.00 0.00 178.44 178.82 2rgk s ARG 87 N -3.80 4.43 -0.71 1.13 3.52 0.22 -0.43 118.95 123.32 2rgk s ARG 87 Ca -0.02 1.20 -0.25 0.00 -0.13 0.00 0.00 55.73 56.54 2rgk s ARG 87 Cb 0.13 -3.51 0.05 0.00 -1.56 0.00 0.00 34.95 30.06 2rgk s ARG 87 CO 0.74 -0.17 1.12 0.34 -0.81 0.00 0.00 175.30 176.52 2rgk s ASP 88 N 1.03 6.18 0.00 -2.12 -1.08 -0.15 -4.86 116.67 115.66 2rgk s ASP 88 Ca 0.45 -0.75 0.25 0.00 -0.52 0.00 0.00 52.55 51.97 2rgk s ASP 88 Cb -0.18 -2.49 1.08 0.00 -1.46 0.00 0.00 42.92 39.86 2rgk s ASP 88 CO 0.19 -1.63 1.80 0.29 0.52 0.00 0.00 175.17 176.34 2rgk n LYS 89 N 8.51 0.02 -0.05 4.34 5.02 -1.26 0.46 118.16 135.20 2rgk n LYS 89 Ca 0.00 0.07 -0.22 0.00 -2.02 0.00 0.00 58.31 56.15 2rgk n LYS 89 Cb 0.47 -1.50 -0.13 0.00 -0.02 0.00 0.00 35.03 33.85 2rgk n LYS 89 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05 2rgk n LYS 90 N -1.49 0.69 -0.01 1.97 4.81 -1.26 -4.59 118.16 118.28 2rgk n LYS 90 Ca 0.06 0.35 0.07 0.00 -0.87 0.00 0.00 58.31 57.92 2rgk n LYS 90 Cb 0.29 -1.69 -0.12 0.00 0.02 0.00 0.00 35.03 33.52 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 -3.79 0.00 0.00 5.64 4.01 -1.23 -5.12 117.16 116.67 2rgk n TYR 91 Ca -0.34 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.40 2rgk n TYR 91 Cb 0.93 -0.36 0.00 0.00 -0.31 0.00 0.00 39.34 39.59 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 1.65 2.08 7.00 2.72 0.00 0.17 -4.96 105.19 113.85 2rgk n GLY 92 Ca -0.04 -1.92 0.00 0.00 0.00 0.00 0.00 46.02 44.06 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 1.98 -1.26 3.09 -0.02 0.00 -1.26 -4.51 105.19 103.22 2rgk n GLY 93 Ca 0.00 -1.26 -0.18 0.00 0.00 0.00 0.00 46.02 44.58 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 1.00 0.62 1.61 0.51 -1.26 -0.98 118.94 120.44 2rgk s TRP 94 Ca 0.00 -0.32 -0.18 0.00 -2.12 0.00 0.00 56.10 53.48 2rgk s TRP 94 Cb 0.00 -0.60 -0.02 0.00 -0.81 0.00 0.00 33.47 32.04 2rgk s TRP 94 CO 0.00 0.00 1.18 0.71 -0.51 0.00 0.00 176.95 178.33 2rgk s TYR 95 N -0.78 2.40 0.26 -1.98 2.02 0.43 -4.69 117.35 115.02 2rgk s TYR 95 Ca -0.00 1.54 0.02 0.00 -0.37 0.00 0.00 57.07 58.25 2rgk s TYR 95 Cb -0.07 -3.41 0.36 0.00 -0.40 0.00 0.00 41.96 38.44 2rgk s TYR 95 CO 0.01 -2.12 1.69 0.00 -1.57 0.00 0.00 175.55 173.55 2rgk h ALA 96 N 0.61 1.03 -2.02 3.71 0.00 -0.80 -3.40 119.26 118.39 2rgk h ALA 96 Ca -0.49 -0.37 -0.03 0.00 0.00 0.00 0.00 54.91 54.01 2rgk h ALA 96 Cb 1.28 -0.12 -0.21 0.00 0.00 0.00 0.00 17.79 18.75 2rgk h ALA 96 CO 0.54 0.59 0.10 0.00 0.00 0.00 0.00 179.25 180.47 2rgk s VAL 98 N 0.63 0.04 0.00 0.00 -7.23 -0.84 0.56 120.40 113.56 2rgk s VAL 98 Ca -0.02 -1.75 0.00 0.00 -1.81 0.00 0.00 61.98 58.40 2rgk s VAL 98 Cb -0.05 -2.19 0.00 0.00 0.56 0.00 0.00 36.38 34.70 2rgk s VAL 98 CO -0.03 -0.18 0.00 -0.46 -0.31 0.00 0.00 175.10 174.11 2rgk n ASN 99 N -0.23 0.00 0.28 4.85 0.23 0.17 0.43 115.26 120.99 2rgk n ASN 99 Ca -0.03 -0.90 0.13 0.00 -0.53 0.00 0.00 54.58 53.26 2rgk n ASN 99 Cb 0.64 0.00 0.79 0.00 -2.08 0.00 0.00 39.78 39.14 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 0.00 0.86 0.53 3.32 -2.00 -2.49 116.42 116.63 2rgk h ASP 100 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2rgk h ASP 100 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 2rgk h ASP 100 CO 0.00 0.07 -0.61 -0.62 -1.72 0.00 0.00 179.24 176.36 2rgk n GLU 101 N -3.76 0.28 -0.52 3.56 4.71 -1.26 -5.06 120.64 118.59 2rgk n GLU 101 Ca -0.02 0.08 0.00 0.00 -0.01 0.00 0.00 57.16 57.21 2rgk n GLU 101 Cb 0.17 -1.68 0.00 0.00 -1.01 0.00 0.00 31.44 28.92 2rgk n GLU 101 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 2rgk n GLY 102 N 1.34 0.62 3.71 0.62 0.00 -0.94 -5.09 105.19 105.45 2rgk n GLY 102 Ca 0.03 -1.62 -0.42 0.00 0.00 0.00 0.00 46.02 44.01 2rgk n GLY 102 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2rgk s VAL 103 N -3.35 4.52 -0.22 1.61 1.01 -1.26 -0.65 120.40 122.06 2rgk s VAL 103 Ca 0.00 1.81 -0.17 0.00 0.00 0.00 0.00 61.98 63.61 2rgk s VAL 103 Cb 0.00 -4.16 -0.14 0.00 0.00 0.00 0.00 36.38 32.08 2rgk s VAL 103 CO 0.00 0.12 -0.04 0.52 0.00 0.00 0.00 175.10 175.70 2rgk n VAL 104 N 4.02 1.51 -3.90 2.92 0.31 0.19 -4.88 118.33 118.52 2rgk n VAL 104 Ca 0.08 -0.08 -0.28 0.00 -0.01 0.00 0.00 64.34 64.05 2rgk n VAL 104 Cb 0.49 -2.07 -0.16 0.00 -0.91 0.00 0.00 33.84 31.18 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 -6.80 2.79 0.00 4.52 3.68 0.22 -4.95 116.67 116.13 2rgk s ASP 105 Ca -0.30 -0.64 0.22 0.00 2.13 0.00 0.00 52.55 53.97 2rgk s ASP 105 Cb 0.08 -0.92 0.66 0.00 -1.45 0.00 0.00 42.92 41.29 2rgk s ASP 105 CO 0.50 -0.18 1.51 0.00 0.13 0.00 0.00 175.17 177.13 2rgk n ALA 106 N 4.87 2.50 -1.20 3.66 0.00 -1.26 -1.08 120.51 128.01 2rgk n ALA 106 Ca -0.12 -0.63 -0.31 0.00 0.00 0.00 0.00 53.44 52.38 2rgk n ALA 106 Cb 0.48 -1.03 0.10 0.00 0.00 0.00 0.00 19.45 19.00 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 -1.59 4.28 -0.57 0.00 1.04 -1.26 -3.69 113.70 111.90 2rgk s SER 107 Ca 0.34 1.84 -0.05 0.00 0.48 0.00 0.00 55.95 58.56 2rgk s SER 107 Cb 0.19 -2.51 0.15 0.00 0.10 0.00 0.00 66.02 63.95 2rgk s SER 107 CO 0.28 -2.18 0.40 -0.54 0.98 0.00 0.00 173.24 172.18 2rgk s LYS 108 N -4.88 2.52 -0.02 4.02 -0.14 -0.44 -2.51 119.74 118.28 2rgk s LYS 108 Ca 0.62 -2.26 -0.29 0.00 -1.36 0.00 0.00 55.97 52.68 2rgk s LYS 108 Cb -0.18 -3.79 -0.03 0.00 -1.68 0.00 0.00 37.83 32.15 2rgk s LYS 108 CO 0.56 -1.17 0.94 -0.65 -0.76 0.00 0.00 175.35 174.28 2rgk s GLN 109 N 0.43 4.53 0.06 1.68 -1.52 -1.26 -1.72 119.66 121.86 2rgk s GLN 109 Ca 0.13 1.34 -0.27 0.00 -1.95 0.00 0.00 55.36 54.61 2rgk s GLN 109 Cb -0.21 -3.47 -0.17 0.00 -0.22 0.00 0.00 33.01 28.94 2rgk s GLN 109 CO -0.04 -0.06 1.59 0.78 -0.25 0.00 0.00 175.29 177.31 2rgk h GLY 110 N 6.92 -0.45 0.83 3.09 0.00 -0.94 -1.57 103.07 110.94 2rgk h GLY 110 Ca -0.40 0.17 0.09 0.00 0.00 0.00 0.00 47.33 47.19 2rgk h GLY 110 CO 0.76 -0.16 0.53 0.10 0.00 0.00 0.00 176.54 177.77 2rgk h TYR 111 N -0.51 0.82 -0.20 5.60 -0.00 -1.82 0.95 116.97 121.81 2rgk h TYR 111 Ca -0.04 0.02 -0.12 0.00 0.00 0.00 0.00 58.73 58.59 2rgk h TYR 111 Cb 0.38 -0.27 -0.01 0.00 0.00 0.00 0.00 36.73 36.83 2rgk h TYR 111 CO -0.03 0.39 -0.39 1.96 -0.00 0.00 0.00 178.16 180.09 2rgk h GLN 112 N 0.77 0.46 -0.01 0.10 4.20 -1.90 -0.99 115.11 117.73 2rgk h GLN 112 Ca 0.37 -0.22 -0.14 0.00 0.06 0.00 0.00 58.65 58.72 2rgk h GLN 112 Cb 0.42 -0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.18 2rgk h GLN 112 CO -0.15 0.78 -0.65 0.45 -0.67 0.00 0.00 178.83 178.59 2rgk h HIS 113 N 0.38 0.07 0.00 2.96 3.86 -0.01 -1.24 115.15 121.17 2rgk h HIS 113 Ca 0.04 -0.03 -0.12 0.00 -1.16 0.00 0.00 60.37 59.10 2rgk h HIS 113 Cb 0.85 -0.01 -0.02 0.00 1.06 0.00 0.00 27.41 29.29 2rgk h HIS 113 CO 0.03 0.69 -0.57 0.74 0.86 0.00 0.00 177.93 179.68 2rgk h PHE 114 N 0.04 0.00 -0.03 2.45 0.04 -0.53 -0.36 116.94 118.56 2rgk h PHE 114 Ca -0.01 0.00 -0.12 0.00 2.80 0.00 0.00 57.97 60.64 2rgk h PHE 114 Cb 1.15 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 39.29 2rgk h PHE 114 CO 0.01 0.57 -0.56 0.74 -0.60 0.00 0.00 178.31 178.46 2rgk h PHE 115 N 0.00 0.10 -0.20 -0.55 0.04 -0.83 -0.11 116.94 115.40 2rgk h PHE 115 Ca -0.01 -0.04 -0.11 0.00 2.80 0.00 0.00 57.97 60.62 2rgk h PHE 115 Cb 1.05 -0.02 -0.01 0.00 2.20 0.00 0.00 35.95 39.17 2rgk h PHE 115 CO 0.00 0.62 -0.34 0.00 -0.60 0.00 0.00 178.31 178.00 2rgk h ALA 116 N 1.37 1.06 -0.21 2.45 0.00 -0.43 -0.10 119.26 123.41 2rgk h ALA 116 Ca -0.00 -0.38 -0.15 0.00 0.00 0.00 0.00 54.91 54.37 2rgk h ALA 116 Cb 1.01 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.68 2rgk h ALA 116 CO 0.08 0.58 -0.49 1.25 0.00 0.00 0.00 179.25 180.67 2rgk h LEU 117 N 0.35 0.60 -0.06 0.00 5.85 -0.30 -2.09 115.31 119.66 2rgk h LEU 117 Ca 0.04 -0.30 -0.02 0.00 0.84 0.00 0.00 57.88 58.45 2rgk h LEU 117 Cb 0.76 -0.17 -0.00 0.00 0.37 0.00 0.00 40.66 41.62 2rgk h LEU 117 CO 0.06 0.99 -0.03 0.25 -0.34 0.00 0.00 178.44 179.37 2rgk h LEU 118 N 0.44 0.13 -1.29 2.25 5.85 -0.56 -1.77 115.31 120.36 2rgk h LEU 118 Ca 0.02 -0.42 0.03 0.00 0.84 0.00 0.00 57.88 58.35 2rgk h LEU 118 Cb 1.01 -0.04 -0.04 0.00 0.37 0.00 0.00 40.66 41.97 2rgk h LEU 118 CO 0.09 0.52 0.50 1.23 -0.34 0.00 0.00 178.44 180.44 2rgk h GLY 119 N -0.26 1.06 0.54 3.75 0.00 -1.01 -0.24 103.07 106.91 2rgk h GLY 119 Ca 0.01 -0.37 -0.00 0.00 0.00 0.00 0.00 47.33 46.97 2rgk h GLY 119 CO 0.01 0.33 -0.01 0.00 0.00 0.00 0.00 176.54 176.87 2rgk h ALA 120 N 1.55 0.01 -0.89 3.60 0.00 -1.33 -0.74 119.26 121.46 2rgk h ALA 120 Ca 0.30 -0.24 0.06 0.00 0.00 0.00 0.00 54.91 55.03 2rgk h ALA 120 Cb 0.03 -0.00 -0.06 0.00 0.00 0.00 0.00 17.79 17.76 2rgk h ALA 120 CO -0.08 -0.25 0.56 0.00 0.00 0.00 0.00 179.25 179.48 2rgk h ALA 121 N 0.54 1.22 -0.30 0.00 0.00 -1.01 -1.30 119.26 118.40 2rgk h ALA 121 Ca 0.00 -0.02 -0.17 0.00 0.00 0.00 0.00 54.91 54.73 2rgk h ALA 121 Cb 0.48 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 18.00 2rgk h ALA 121 CO 0.00 0.34 -0.48 0.77 0.00 0.00 0.00 179.25 179.87 2rgk h SER 122 N 1.04 0.89 -0.09 0.00 0.02 -1.04 -2.85 113.55 111.52 2rgk h SER 122 Ca 0.38 -0.45 -0.01 0.00 -0.84 0.00 0.00 61.79 60.87 2rgk h SER 122 Cb 0.14 -0.25 -0.01 0.00 0.14 0.00 0.00 62.40 62.42 2rgk h SER 122 CO -0.16 1.22 0.03 0.00 -1.14 0.00 0.00 176.83 176.77 2rgk h ALA 123 N 0.81 1.77 0.00 3.77 0.00 -0.59 -1.12 119.26 123.89 2rgk h ALA 123 Ca 0.03 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 2rgk h ALA 123 Cb 1.07 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.78 2rgk h ALA 123 CO 0.11 0.19 -0.05 0.28 0.00 0.00 0.00 179.25 179.78 2rgk h VAL 124 N 0.21 0.99 0.00 0.00 2.07 -1.00 -1.58 116.25 116.94 2rgk h VAL 124 Ca 0.05 -0.16 0.00 0.00 0.82 0.00 0.00 66.70 67.41 2rgk h VAL 124 Cb 0.10 1.09 0.00 0.00 -1.52 0.00 0.00 31.29 30.96 2rgk h VAL 124 CO -0.00 0.05 0.00 0.35 0.02 0.00 0.00 177.57 177.98 2rgk n THR 125 N -4.43 0.47 0.61 2.57 -2.24 -0.42 -1.92 114.28 108.91 2rgk n THR 125 Ca -0.03 0.12 0.12 0.00 -2.27 0.00 0.00 64.05 61.99 2rgk n THR 125 Cb 0.13 -0.79 0.18 0.00 -2.10 0.00 0.00 70.33 67.75 2rgk n THR 125 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 2rgk n THR 126 N -1.34 0.32 -0.99 4.28 -2.24 -0.60 -4.90 114.28 108.81 2rgk n THR 126 Ca 0.08 -0.25 0.00 0.00 -2.27 0.00 0.00 64.05 61.61 2rgk n THR 126 Cb 0.17 -0.10 0.00 0.00 -2.10 0.00 0.00 70.33 68.30 2rgk n THR 126 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2rgk n GLY 127 N 1.35 0.61 3.66 3.38 0.00 -0.81 -4.98 105.19 108.41 2rgk n GLY 127 Ca 0.03 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.58 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 -2.69 2.16 0.25 1.61 -0.00 -1.26 -4.83 115.22 110.46 2rgk n HIS 128 Ca 0.00 0.31 0.13 0.00 -0.00 0.00 0.00 57.72 58.16 2rgk n HIS 128 Cb 0.01 -2.52 0.71 0.00 -0.00 0.00 0.00 29.99 28.20 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 5.96 0.00 -0.00 1.57 0.13 -1.96 -1.84 132.00 135.86 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 1.27 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.40 2rgk h PRO 129 CO 0.88 0.00 -0.68 0.39 -0.23 0.00 0.00 178.00 178.36 2rgk n GLU 130 N -2.56 2.00 0.20 0.86 -0.58 -1.26 -4.64 120.64 114.67 2rgk n GLU 130 Ca -0.02 -0.07 -0.15 0.00 -0.42 0.00 0.00 57.16 56.50 2rgk n GLU 130 Cb 0.24 -1.22 -0.08 0.00 -0.57 0.00 0.00 31.44 29.81 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 2.19 -0.45 -0.72 0.62 0.00 -1.66 -2.11 119.26 117.12 2rgk h ALA 131 Ca 0.00 -0.10 0.09 0.00 0.00 0.00 0.00 54.91 54.90 2rgk h ALA 131 Cb 0.37 0.17 -0.07 0.00 0.00 0.00 0.00 17.79 18.27 2rgk h ALA 131 CO 0.00 -0.75 0.38 -0.09 0.00 0.00 0.00 179.25 178.78 2rgk h ARG 132 N -0.45 0.62 -0.31 0.00 9.65 -1.82 0.35 114.38 122.42 2rgk h ARG 132 Ca -0.05 -0.04 -0.03 0.00 -1.10 0.00 0.00 59.98 58.77 2rgk h ARG 132 Cb 0.34 -0.14 -0.02 0.00 -1.39 0.00 0.00 29.97 28.77 2rgk h ARG 132 CO 0.07 0.41 0.07 -0.22 2.80 0.00 0.00 179.97 183.10 2rgk h LYS 133 N 0.64 0.45 -0.10 0.20 3.64 -1.81 -0.71 116.57 118.89 2rgk h LYS 133 Ca 0.35 -0.07 -0.21 0.00 -1.27 0.00 0.00 60.65 59.46 2rgk h LYS 133 Cb 0.35 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.09 2rgk h LYS 133 CO -0.26 0.43 -0.78 1.25 -2.27 0.00 0.00 179.45 177.82 2rgk h LEU 134 N 0.45 0.68 0.19 5.20 5.85 -0.31 -2.47 115.31 124.90 2rgk h LEU 134 Ca 0.11 -0.46 -0.01 0.00 0.84 0.00 0.00 57.88 58.36 2rgk h LEU 134 Cb 0.19 -0.20 0.00 0.00 0.37 0.00 0.00 40.66 41.02 2rgk h LEU 134 CO -0.00 1.23 -0.09 0.25 -0.34 0.00 0.00 178.44 179.49 2rgk h LEU 135 N 0.38 -0.22 -0.89 2.25 5.85 -0.65 -1.42 115.31 120.62 2rgk h LEU 135 Ca -0.05 -0.10 0.12 0.00 0.84 0.00 0.00 57.88 58.69 2rgk h LEU 135 Cb 1.38 0.06 -0.08 0.00 0.37 0.00 0.00 40.66 42.39 2rgk h LEU 135 CO 0.15 -0.03 0.51 0.44 -0.34 0.00 0.00 178.44 179.17 2rgk h ASP 136 N -0.39 0.70 -0.21 1.25 3.32 -1.14 0.14 116.42 120.09 2rgk h ASP 136 Ca -0.03 0.06 -0.04 0.00 0.02 0.00 0.00 57.03 57.05 2rgk h ASP 136 Cb 0.30 -0.07 -0.01 0.00 0.22 0.00 0.00 39.33 39.78 2rgk h ASP 136 CO 0.04 0.36 -0.01 0.22 -1.72 0.00 0.00 179.24 178.13 2rgk h TYR 137 N 0.79 0.41 -0.66 4.55 3.20 -1.35 -2.50 116.97 121.42 2rgk h TYR 137 Ca 0.45 -0.07 0.04 0.00 3.14 0.00 0.00 58.73 62.29 2rgk h TYR 137 Cb 0.51 -0.11 -0.05 0.00 1.54 0.00 0.00 36.73 38.63 2rgk h TYR 137 CO -0.05 0.58 0.39 1.15 -1.64 0.00 0.00 178.16 178.59 2rgk h THR 138 N 0.13 1.03 -0.32 1.81 2.02 -0.31 -1.69 112.91 115.59 2rgk h THR 138 Ca 0.06 -0.26 0.06 0.00 0.77 0.00 0.00 66.41 67.04 2rgk h THR 138 Cb 0.42 0.22 -0.05 0.00 -1.74 0.00 0.00 68.15 66.99 2rgk h THR 138 CO 0.01 0.14 -0.01 0.40 0.37 0.00 0.00 175.52 176.43 2rgk h ILE 139 N 0.75 0.76 -0.63 3.11 2.04 -0.63 0.26 117.51 123.17 2rgk h ILE 139 Ca 0.28 -0.03 0.08 0.00 1.00 0.00 0.00 64.86 66.19 2rgk h ILE 139 Cb 0.10 0.67 -0.06 0.00 -0.74 0.00 0.00 36.82 36.79 2rgk h ILE 139 CO -0.14 0.02 0.30 -0.33 0.00 0.00 0.00 178.15 178.00 2rgk h GLU 140 N 0.08 0.53 -0.37 2.37 5.08 -0.87 0.82 114.58 122.22 2rgk h GLU 140 Ca 0.15 -0.03 -0.04 0.00 -1.00 0.00 0.00 59.36 58.44 2rgk h GLU 140 Cb 0.21 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.33 2rgk h GLU 140 CO -0.26 0.35 0.07 0.82 -1.00 0.00 0.00 179.01 178.98 2rgk h ILE 141 N 0.55 1.23 -0.40 3.13 1.08 -0.63 -2.08 117.51 120.40 2rgk h ILE 141 Ca 0.30 -0.82 -0.02 0.00 -0.39 0.00 0.00 64.86 63.93 2rgk h ILE 141 Cb 0.28 1.07 -0.02 0.00 -3.07 0.00 0.00 36.82 35.08 2rgk h ILE 141 CO -0.24 0.28 0.17 0.40 -0.69 0.00 0.00 178.15 178.08 2rgk h ILE 142 N 0.45 1.18 0.00 -0.67 1.08 -0.45 0.36 117.51 119.46 2rgk h ILE 142 Ca 0.11 -0.55 0.00 0.00 -0.39 0.00 0.00 64.86 64.03 2rgk h ILE 142 Cb 0.34 0.81 0.00 0.00 -3.07 0.00 0.00 36.82 34.91 2rgk h ILE 142 CO 0.01 0.20 0.00 -0.62 -0.69 0.00 0.00 178.15 177.05 2rgk n GLU 143 N -4.67 0.07 -0.12 2.37 1.02 0.23 -0.51 120.64 119.02 2rgk n GLU 143 Ca -0.00 0.26 -0.19 0.00 -0.02 0.00 0.00 57.16 57.21 2rgk n GLU 143 Cb 0.13 -1.62 -0.12 0.00 -0.02 0.00 0.00 31.44 29.81 2rgk n GLU 143 CO 0.00 0.00 0.00 1.17 1.18 0.00 0.00 177.13 179.48 2rgk n LYS 144 N -1.74 0.65 -0.00 3.49 4.81 -0.79 -4.72 118.16 119.87 2rgk n LYS 144 Ca 0.04 0.17 0.00 0.00 -0.87 0.00 0.00 58.31 57.65 2rgk n LYS 144 Cb 0.22 -1.53 -0.00 0.00 0.02 0.00 0.00 35.03 33.73 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 -3.37 0.00 0.14 5.64 4.01 0.07 -4.86 117.16 118.79 2rgk n TYR 145 Ca -0.46 0.00 0.04 0.00 -0.16 0.00 0.00 57.90 57.32 2rgk n TYR 145 Cb 0.98 -0.01 -0.05 0.00 -0.31 0.00 0.00 39.34 39.95 2rgk n TYR 145 CO 0.00 0.00 0.00 1.19 -0.46 0.00 0.00 176.86 177.59 2rgk n PHE 146 N -1.45 0.00 -3.66 -0.72 3.72 -0.17 -4.75 117.46 110.44 2rgk n PHE 146 Ca -0.00 0.00 -0.39 0.00 -0.05 0.00 0.00 57.45 57.01 2rgk n PHE 146 Cb 0.01 -0.11 -0.11 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 -2.20 3.33 -0.03 1.38 -0.11 0.33 -1.24 118.94 120.40 2rgk s TRP 147 Ca -0.01 -1.54 -0.30 0.00 1.22 0.00 0.00 56.10 55.47 2rgk s TRP 147 Cb 0.05 -2.76 -0.05 0.00 -1.50 0.00 0.00 33.47 29.21 2rgk s TRP 147 CO 0.31 -0.81 1.40 0.45 -4.62 0.00 0.00 176.95 173.68 2rgk s SER 148 N 1.87 6.85 0.12 5.86 0.15 -0.19 -4.75 113.70 123.61 2rgk s SER 148 Ca 0.02 2.07 -0.13 0.00 0.70 0.00 0.00 55.95 58.61 2rgk s SER 148 Cb -0.22 -2.55 -0.05 0.00 -1.71 0.00 0.00 66.02 61.48 2rgk s SER 148 CO 0.02 -0.74 1.46 -0.08 1.20 0.00 0.00 173.24 175.10 2rgk h GLU 149 N 8.04 0.84 0.07 5.44 4.22 -1.92 0.33 114.58 131.59 2rgk h GLU 149 Ca -0.37 -0.42 -0.25 0.00 0.08 0.00 0.00 59.36 58.40 2rgk h GLU 149 Cb 1.17 0.01 -0.00 0.00 0.50 0.00 0.00 28.75 30.43 2rgk h GLU 149 CO 0.91 1.06 -1.10 1.05 -2.18 0.00 0.00 179.01 178.76 2rgk h GLU 150 N 0.63 0.28 0.01 1.92 4.11 -1.96 -3.31 114.58 116.26 2rgk h GLU 150 Ca 0.06 -0.40 -0.25 0.00 0.07 0.00 0.00 59.36 58.85 2rgk h GLU 150 Cb 0.88 0.13 -0.03 0.00 0.50 0.00 0.00 28.75 30.23 2rgk h GLU 150 CO 0.08 1.14 -1.29 0.93 0.07 0.00 0.00 179.01 179.94 2rgk h GLU 151 N 0.11 0.02 -5.94 1.06 5.08 -1.96 -3.48 114.58 109.48 2rgk h GLU 151 Ca -0.10 -0.04 -0.39 0.00 -1.00 0.00 0.00 59.36 57.83 2rgk h GLU 151 Cb 1.79 0.01 0.09 0.00 0.50 0.00 0.00 28.75 31.15 2rgk h GLU 151 CO 0.18 0.84 -0.80 1.04 -1.00 0.00 0.00 179.01 179.26 2rgk n GLN 152 N -3.26 -5.59 -3.92 2.33 1.13 0.12 -4.98 117.38 103.21 2rgk n GLN 152 Ca -0.07 0.70 -0.10 0.00 -1.94 0.00 0.00 57.00 55.59 2rgk n GLN 152 Cb 0.99 -5.44 -0.02 0.00 0.11 0.00 0.00 30.24 25.88 2rgk n GLN 152 CO 0.00 0.00 0.00 -1.64 -1.44 0.00 0.00 177.06 173.98 2rgk s MET 153 N -5.80 1.93 -0.14 -1.09 -1.94 -1.24 -4.73 119.30 106.29 2rgk s MET 153 Ca 0.04 -1.38 -0.07 0.00 -1.71 0.00 0.00 55.69 52.57 2rgk s MET 153 Cb -0.02 0.55 -0.04 0.00 2.01 0.00 0.00 34.83 37.33 2rgk s MET 153 CO 0.78 -0.86 0.11 0.00 -0.01 0.00 0.00 175.02 175.04 2rgk s LEU 155 N -0.48 2.34 -0.20 0.00 1.43 -0.37 -4.75 118.68 116.64 2rgk s LEU 155 Ca 0.11 1.35 -0.18 0.00 -1.03 0.00 0.00 54.13 54.38 2rgk s LEU 155 Cb -0.12 -3.83 -0.14 0.00 0.03 0.00 0.00 46.19 42.13 2rgk s LEU 155 CO 0.02 -2.38 0.06 1.21 0.23 0.00 0.00 176.35 175.49 2rgk n GLU 156 N -3.70 0.54 -3.76 1.70 4.07 -1.26 -4.66 120.64 113.57 2rgk n GLU 156 Ca 0.07 0.53 -0.03 0.00 -0.06 0.00 0.00 57.16 57.67 2rgk n GLU 156 Cb 0.56 -1.71 -0.01 0.00 -0.06 0.00 0.00 31.44 30.22 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 -6.61 -0.16 0.13 4.31 1.04 -1.26 -0.32 113.70 110.82 2rgk s SER 157 Ca -0.26 -0.41 -0.02 0.00 0.48 0.00 0.00 55.95 55.73 2rgk s SER 157 Cb 0.06 0.48 -0.03 0.00 0.10 0.00 0.00 66.02 66.62 2rgk s SER 157 CO 0.49 -0.89 0.09 0.26 0.98 0.00 0.00 173.24 174.17 2rgk s TRP 158 N -3.22 0.73 0.83 5.02 0.52 -0.70 0.10 118.94 122.23 2rgk s TRP 158 Ca 0.13 -1.12 -0.12 0.00 0.02 0.00 0.00 56.10 55.00 2rgk s TRP 158 Cb -0.01 -0.39 0.09 0.00 -1.15 0.00 0.00 33.47 32.01 2rgk s TRP 158 CO 0.02 -0.54 1.13 0.16 0.02 0.00 0.00 176.95 177.75 2rgk s ASP 159 N -3.02 4.22 0.22 2.95 -4.77 -1.20 -1.33 116.67 113.75 2rgk s ASP 159 Ca 0.21 1.03 -0.14 0.00 -3.30 0.00 0.00 52.55 50.34 2rgk s ASP 159 Cb 0.07 -1.65 0.25 0.00 -1.09 0.00 0.00 42.92 40.50 2rgk s ASP 159 CO -0.00 -2.11 1.60 -0.08 0.70 0.00 0.00 175.17 175.28 2rgk h GLU 160 N -1.19 -0.04 -0.13 2.11 4.81 -1.90 -0.94 114.58 117.30 2rgk h GLU 160 Ca -0.48 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.75 2rgk h GLU 160 Cb 1.31 0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.69 2rgk h GLU 160 CO 0.62 -0.03 0.00 0.00 -0.73 0.00 0.00 179.01 178.88 2rgk n ALA 161 N -3.20 2.50 -3.81 2.92 0.00 -1.26 -4.88 120.51 112.78 2rgk n ALA 161 Ca 0.08 -0.16 -0.24 0.00 0.00 0.00 0.00 53.44 53.13 2rgk n ALA 161 Cb 0.37 -0.99 0.01 0.00 0.00 0.00 0.00 19.45 18.84 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 -0.23 -1.86 -0.04 0.00 3.72 -0.36 -4.90 117.46 113.80 2rgk n PHE 162 Ca 0.03 0.82 0.02 0.00 -0.05 0.00 0.00 57.45 58.26 2rgk n PHE 162 Cb 0.09 -4.14 -0.13 0.00 -0.94 0.00 0.00 39.48 34.36 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 -3.01 0.94 -3.68 4.37 3.41 -1.26 -4.95 113.62 109.44 2rgk n SER 163 Ca -0.27 0.00 -0.13 0.00 -0.26 0.00 0.00 58.87 58.21 2rgk n SER 163 Cb 0.66 1.42 -0.13 0.00 -0.26 0.00 0.00 64.21 65.91 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 -2.88 0.15 0.24 4.33 2.47 -1.26 -5.06 119.74 117.74 2rgk s LYS 164 Ca -0.07 0.67 -0.17 0.00 -1.56 0.00 0.00 55.97 54.84 2rgk s LYS 164 Cb 0.09 -0.08 -0.08 0.00 -1.46 0.00 0.00 37.83 36.29 2rgk s LYS 164 CO 0.71 -0.25 0.69 -0.08 0.16 0.00 0.00 175.35 176.58 2rgk s THR 165 N 2.07 4.67 0.34 3.43 -1.32 -1.26 -3.24 115.64 120.33 2rgk s THR 165 Ca -0.02 1.06 -0.29 0.00 -1.21 0.00 0.00 61.69 61.24 2rgk s THR 165 Cb -0.12 -3.75 -0.11 0.00 -1.51 0.00 0.00 72.50 67.01 2rgk s THR 165 CO -0.08 0.09 1.47 -0.70 -2.21 0.00 0.00 174.62 173.19 2rgk s GLU 166 N -2.30 4.17 -1.39 7.08 2.12 0.12 -4.88 118.70 123.62 2rgk s GLU 166 Ca 0.45 2.48 -0.09 0.00 0.36 0.00 0.00 54.97 58.18 2rgk s GLU 166 Cb -0.14 -3.01 0.08 0.00 0.26 0.00 0.00 34.13 31.32 2rgk s GLU 166 CO 0.20 -0.48 2.31 0.39 -0.54 0.00 0.00 175.26 177.13 2rgk n GLU 167 N 1.08 3.83 -3.57 4.30 1.02 -1.26 -4.70 120.64 121.34 2rgk n GLU 167 Ca 0.03 -3.10 -0.16 0.00 -0.02 0.00 0.00 57.16 53.91 2rgk n GLU 167 Cb 0.39 -2.87 -0.06 0.00 -0.02 0.00 0.00 31.44 28.89 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 0.68 -0.52 -0.05 -0.32 5.04 -1.26 -4.53 117.35 116.39 2rgk s TYR 168 Ca 0.51 0.81 -0.01 0.00 -2.44 0.00 0.00 57.07 55.94 2rgk s TYR 168 Cb 0.15 0.35 0.03 0.00 0.35 0.00 0.00 41.96 42.84 2rgk s TYR 168 CO -0.05 -0.59 0.00 1.03 -1.34 0.00 0.00 175.55 174.59 2rgk s ARG 169 N -1.61 0.49 0.27 4.97 1.81 -0.93 -4.02 118.95 119.92 2rgk s ARG 169 Ca -0.10 0.09 0.12 0.00 -1.72 0.00 0.00 55.73 54.13 2rgk s ARG 169 Cb -0.01 -0.76 -0.05 0.00 -0.45 0.00 0.00 34.95 33.68 2rgk s ARG 169 CO 0.05 -0.22 -0.20 0.20 -0.68 0.00 0.00 175.30 174.45 2rgk s GLY 170 N 1.56 1.86 0.09 -3.53 0.00 -1.26 -0.98 107.32 105.06 2rgk s GLY 170 Ca -0.02 -1.84 -0.13 0.00 0.00 0.00 0.00 44.72 42.73 2rgk s GLY 170 CO -0.03 -1.93 1.26 -1.33 0.00 0.00 0.00 173.10 171.07 2rgk h GLY 171 N 2.36 0.84 0.99 0.20 0.00 -1.49 -3.24 103.07 102.74 2rgk h GLY 171 Ca -0.41 -1.31 -0.01 0.00 0.00 0.00 0.00 47.33 45.61 2rgk h GLY 171 CO 0.59 1.16 0.31 -0.57 0.00 0.00 0.00 176.54 178.02 2rgk h ASN 172 N 0.48 0.66 -0.28 0.19 -0.73 -1.96 0.18 115.58 114.12 2rgk h ASN 172 Ca -0.09 -0.08 0.00 0.00 1.87 0.00 0.00 56.30 58.01 2rgk h ASN 172 Cb 1.53 -0.17 -0.01 0.00 0.27 0.00 0.00 38.32 39.94 2rgk h ASN 172 CO 0.18 0.55 0.18 0.00 -0.37 0.00 0.00 177.43 177.97 2rgk h ALA 173 N 1.14 0.35 0.00 1.57 0.00 -1.95 -1.97 119.26 118.41 2rgk h ALA 173 Ca 0.19 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 55.00 2rgk h ALA 173 Cb 0.02 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 2rgk h ALA 173 CO -0.03 -0.17 -0.37 -0.91 0.00 0.00 0.00 179.25 177.76 2rgk h ASN 174 N 0.37 0.00 -0.16 0.00 4.21 -1.52 -2.46 115.58 116.02 2rgk h ASN 174 Ca 0.10 0.00 -0.04 0.00 1.21 0.00 0.00 56.30 57.57 2rgk h ASN 174 Cb -0.03 0.00 -0.00 0.00 -1.12 0.00 0.00 38.32 37.16 2rgk h ASN 174 CO -0.02 0.37 -0.05 -0.03 -1.29 0.00 0.00 177.43 176.41 2rgk h MET 175 N 0.00 0.32 0.00 0.81 4.05 -0.20 -1.73 114.93 118.18 2rgk h MET 175 Ca -0.00 -0.12 0.00 0.00 -0.28 0.00 0.00 59.70 59.29 2rgk h MET 175 Cb 0.68 -0.02 0.00 0.00 -0.80 0.00 0.00 31.60 31.47 2rgk h MET 175 CO 0.05 0.60 0.00 0.45 0.23 0.00 0.00 176.91 178.24 2rgk h HIS 176 N 0.01 0.00 -0.11 1.39 3.86 -1.30 -0.08 115.15 118.92 2rgk h HIS 176 Ca 0.04 0.00 -0.14 0.00 -1.16 0.00 0.00 60.37 59.11 2rgk h HIS 176 Cb 0.49 0.00 0.01 0.00 1.06 0.00 0.00 27.41 28.97 2rgk h HIS 176 CO 0.05 0.00 -0.49 0.00 0.86 0.00 0.00 177.93 178.36 2rgk h ALA 177 N 2.09 0.21 0.25 2.45 0.00 -1.11 0.17 119.26 123.32 2rgk h ALA 177 Ca 0.00 -0.50 0.00 0.00 0.00 0.00 0.00 54.91 54.41 2rgk h ALA 177 Cb 0.45 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.21 2rgk h ALA 177 CO 0.00 0.38 -0.25 0.28 0.00 0.00 0.00 179.25 179.67 2rgk h VAL 178 N 0.13 0.47 -0.55 0.00 2.07 -0.26 0.89 116.25 119.01 2rgk h VAL 178 Ca -0.03 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.60 2rgk h VAL 178 Cb 1.13 0.47 -0.09 0.00 -1.52 0.00 0.00 31.29 31.28 2rgk h VAL 178 CO 0.10 0.00 0.02 -0.08 0.02 0.00 0.00 177.57 177.63 2rgk h GLU 179 N -0.52 0.13 -0.51 1.57 4.81 -1.04 -1.16 114.58 117.85 2rgk h GLU 179 Ca -0.01 -0.01 -0.10 0.00 -0.13 0.00 0.00 59.36 59.12 2rgk h GLU 179 Cb 0.49 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.82 2rgk h GLU 179 CO -0.05 0.09 -0.07 0.00 -0.73 0.00 0.00 179.01 178.24 2rgk h ALA 180 N 1.48 0.69 -0.72 2.92 0.00 -0.35 -3.04 119.26 120.25 2rgk h ALA 180 Ca 0.28 -0.33 0.02 0.00 0.00 0.00 0.00 54.91 54.89 2rgk h ALA 180 Cb 0.43 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 18.00 2rgk h ALA 180 CO -0.45 0.57 0.48 0.74 0.00 0.00 0.00 179.25 180.58 2rgk h PHE 181 N 0.81 0.87 -0.16 0.00 0.04 0.18 -2.06 116.94 116.62 2rgk h PHE 181 Ca 0.14 0.02 0.02 0.00 2.80 0.00 0.00 57.97 60.95 2rgk h PHE 181 Cb 0.62 -0.29 -0.02 0.00 2.20 0.00 0.00 35.95 38.45 2rgk h PHE 181 CO 0.05 0.52 0.02 -0.07 -0.60 0.00 0.00 178.31 178.23 2rgk h LEU 182 N 0.92 -0.02 -0.53 1.54 3.38 -1.13 0.64 115.31 120.11 2rgk h LEU 182 Ca 0.28 0.03 -0.15 0.00 0.09 0.00 0.00 57.88 58.13 2rgk h LEU 182 Cb -0.02 0.05 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 2rgk h LEU 182 CO -0.07 0.01 -0.40 0.40 0.09 0.00 0.00 178.44 178.47 2rgk h ILE 183 N 0.07 1.29 -0.86 1.22 1.08 -1.55 -1.27 117.51 117.49 2rgk h ILE 183 Ca 0.07 -1.58 -0.01 0.00 -0.39 0.00 0.00 64.86 62.96 2rgk h ILE 183 Cb 0.07 1.47 -0.04 0.00 -3.07 0.00 0.00 36.82 35.26 2rgk h ILE 183 CO -0.11 0.51 0.51 0.58 -0.69 0.00 0.00 178.15 178.96 2rgk h VAL 184 N 0.62 1.24 -0.54 1.67 2.07 -1.15 -1.10 116.25 119.05 2rgk h VAL 184 Ca 0.05 -0.54 -0.01 0.00 0.82 0.00 0.00 66.70 67.02 2rgk h VAL 184 Cb 0.95 0.03 -0.03 0.00 -1.52 0.00 0.00 31.29 30.73 2rgk h VAL 184 CO 0.09 0.26 0.30 0.22 0.02 0.00 0.00 177.57 178.45 2rgk h TYR 185 N 1.19 0.74 -0.16 1.57 3.20 -0.47 -2.11 116.97 120.93 2rgk h TYR 185 Ca 0.31 -0.02 -0.05 0.00 3.14 0.00 0.00 58.73 62.12 2rgk h TYR 185 Cb -0.04 -0.24 -0.01 0.00 1.54 0.00 0.00 36.73 37.98 2rgk h TYR 185 CO 0.01 0.54 -0.12 -0.44 -1.64 0.00 0.00 178.16 176.50 2rgk h ASP 186 N 0.73 0.23 -0.65 -2.11 3.32 -0.10 0.62 116.42 118.45 2rgk h ASP 186 Ca 0.19 -0.05 0.00 0.00 0.02 0.00 0.00 57.03 57.20 2rgk h ASP 186 Cb 0.04 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 39.53 2rgk h ASP 186 CO -0.03 0.38 0.00 1.33 -1.72 0.00 0.00 179.24 179.20 2rgk n VAL 187 N -4.28 1.33 0.00 -1.35 0.24 -0.53 -4.45 118.33 109.29 2rgk n VAL 187 Ca -0.01 -1.09 0.00 0.00 -2.04 0.00 0.00 64.34 61.20 2rgk n VAL 187 Cb 0.26 0.35 0.00 0.00 -1.47 0.00 0.00 33.84 32.98 2rgk n VAL 187 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 2rgk n THR 188 N 1.29 0.00 -3.59 3.34 -2.24 -0.81 -5.01 114.28 107.27 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 0.71 -0.15 0.02 0.00 -2.10 0.00 0.00 70.33 68.80 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 -0.72 -2.12 -3.37 4.78 -0.00 0.21 -4.91 115.22 109.09 2rgk n HIS 189 Ca 0.00 0.72 -0.45 0.00 -0.00 0.00 0.00 57.72 57.99 2rgk n HIS 189 Cb 0.08 -3.82 -0.06 0.00 -0.00 0.00 0.00 29.99 26.20 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 -3.02 6.10 0.56 0.41 -1.08 -1.26 -4.96 116.67 113.42 2rgk s ASP 190 Ca 0.53 -1.73 0.47 0.00 -0.52 0.00 0.00 52.55 51.29 2rgk s ASP 190 Cb -0.26 -2.17 1.61 0.00 -1.46 0.00 0.00 42.92 40.63 2rgk s ASP 190 CO 0.65 -0.80 1.51 1.17 0.52 0.00 0.00 175.17 178.23 2rgk n LYS 191 N 5.18 0.00 0.15 4.34 4.81 -1.26 -1.83 118.16 129.55 2rgk n LYS 191 Ca -0.13 1.07 0.06 0.00 -0.87 0.00 0.00 58.31 58.44 2rgk n LYS 191 Cb 0.41 -2.50 0.54 0.00 0.02 0.00 0.00 35.03 33.49 2rgk n LYS 191 CO 0.00 0.00 0.00 1.57 1.17 0.00 0.00 177.40 180.14 2rgk h LYS 192 N 0.00 0.23 -0.34 1.64 2.10 -1.99 -1.09 116.57 117.12 2rgk h LYS 192 Ca 0.87 -0.02 -0.14 0.00 -2.00 0.00 0.00 60.65 59.36 2rgk h LYS 192 Cb 3.65 -0.05 -0.01 0.00 -0.90 0.00 0.00 32.23 34.92 2rgk h LYS 192 CO -0.01 0.17 -0.35 -1.49 -2.00 0.00 0.00 179.45 175.77 2rgk h TRP 193 N 0.24 0.92 -0.02 0.07 4.06 -1.70 -0.64 115.95 118.88 2rgk h TRP 193 Ca 0.06 -0.26 -0.18 0.00 2.06 0.00 0.00 58.89 60.57 2rgk h TRP 193 Cb 0.00 -0.20 -0.01 0.00 -1.00 0.00 0.00 29.16 27.95 2rgk h TRP 193 CO 0.00 1.02 -0.79 1.25 -3.56 0.00 0.00 178.44 176.36 2rgk h LEU 194 N 0.65 0.29 -0.27 -4.49 5.85 -1.64 -1.79 115.31 113.92 2rgk h LEU 194 Ca 0.06 -0.21 0.00 0.00 0.84 0.00 0.00 57.88 58.57 2rgk h LEU 194 Cb 0.90 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.82 2rgk h LEU 194 CO 0.08 0.97 0.18 0.44 -0.34 0.00 0.00 178.44 179.77 2rgk h ASP 195 N 0.15 0.32 -0.42 1.25 3.45 -0.99 -1.64 116.42 118.54 2rgk h ASP 195 Ca -0.03 -0.02 -0.09 0.00 0.43 0.00 0.00 57.03 57.31 2rgk h ASP 195 Cb 1.38 -0.08 -0.02 0.00 -0.56 0.00 0.00 39.33 40.05 2rgk h ASP 195 CO 0.12 0.25 -0.06 0.03 -1.57 0.00 0.00 179.24 178.01 2rgk h ARG 196 N 0.36 0.86 0.45 3.56 3.08 -1.04 -1.74 114.38 119.90 2rgk h ARG 196 Ca 0.10 -0.27 -0.01 0.00 0.07 0.00 0.00 59.98 59.87 2rgk h ARG 196 Cb -0.02 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 29.93 2rgk h ARG 196 CO -0.02 0.90 -0.35 0.00 -1.07 0.00 0.00 179.97 179.43 2rgk h ALA 197 N 1.14 -0.80 -0.56 0.04 0.00 -0.91 -0.19 119.26 117.98 2rgk h ALA 197 Ca 0.14 -0.14 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 2rgk h ALA 197 Cb 0.55 0.46 -0.03 0.00 0.00 0.00 0.00 17.79 18.78 2rgk h ALA 197 CO 0.03 -0.98 0.24 0.97 0.00 0.00 0.00 179.25 179.51 2rgk h ILE 198 N -0.78 1.20 0.13 0.00 2.10 -1.26 -2.34 117.51 116.56 2rgk h ILE 198 Ca -0.04 -0.59 -0.01 0.00 1.08 0.00 0.00 64.86 65.30 2rgk h ILE 198 Cb 0.67 0.51 0.00 0.00 -1.09 0.00 0.00 36.82 36.92 2rgk h ILE 198 CO -0.00 0.24 -0.06 -0.09 -1.08 0.00 0.00 178.15 177.15 2rgk h ARG 199 N 0.79 -0.17 -0.78 2.19 9.65 -0.93 0.11 114.38 125.23 2rgk h ARG 199 Ca 0.19 0.01 0.08 0.00 -1.10 0.00 0.00 59.98 59.16 2rgk h ARG 199 Cb 0.13 0.04 -0.06 0.00 -1.39 0.00 0.00 29.97 28.68 2rgk h ARG 199 CO -0.02 -0.11 0.45 0.28 2.80 0.00 0.00 179.97 183.37 2rgk h VAL 200 N -0.18 0.95 -0.47 0.20 2.07 -0.75 -2.33 116.25 115.75 2rgk h VAL 200 Ca -0.02 -0.27 -0.11 0.00 0.82 0.00 0.00 66.70 67.12 2rgk h VAL 200 Cb 0.14 0.09 -0.02 0.00 -1.52 0.00 0.00 31.29 29.98 2rgk h VAL 200 CO 0.03 0.14 -0.13 0.00 0.02 0.00 0.00 177.57 177.63 2rgk h ALA 201 N 1.41 0.89 -0.32 1.67 0.00 -1.00 -2.18 119.26 119.73 2rgk h ALA 201 Ca 0.36 -0.34 -0.06 0.00 0.00 0.00 0.00 54.91 54.87 2rgk h ALA 201 Cb 0.27 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 2rgk h ALA 201 CO -0.21 0.63 -0.07 0.66 0.00 0.00 0.00 179.25 180.26 2rgk h SER 202 N 0.78 0.50 0.28 0.00 4.64 -0.29 0.23 113.55 119.69 2rgk h SER 202 Ca 0.12 -0.12 -0.01 0.00 -0.47 0.00 0.00 61.79 61.31 2rgk h SER 202 Cb 0.65 -0.13 0.00 0.00 -0.31 0.00 0.00 62.40 62.61 2rgk h SER 202 CO 0.05 0.62 -0.13 0.58 -0.87 0.00 0.00 176.83 177.07 2rgk h VAL 203 N 0.49 0.38 -0.11 0.95 2.07 -1.29 0.14 116.25 118.88 2rgk h VAL 203 Ca 0.10 -0.85 -0.20 0.00 0.82 0.00 0.00 66.70 66.57 2rgk h VAL 203 Cb 0.43 0.63 0.01 0.00 -1.52 0.00 0.00 31.29 30.84 2rgk h VAL 203 CO 0.02 0.10 -0.70 0.40 0.02 0.00 0.00 177.57 177.41 2rgk h ILE 204 N -1.01 1.32 0.00 4.57 2.04 -1.41 -3.22 117.51 119.80 2rgk h ILE 204 Ca -0.04 -1.96 -0.00 0.00 1.00 0.00 0.00 64.86 63.86 2rgk h ILE 204 Cb 0.45 2.14 -0.00 0.00 -0.74 0.00 0.00 36.82 38.66 2rgk h ILE 204 CO 0.06 0.60 -0.76 -0.38 0.00 0.00 0.00 178.15 177.68 2rgk n ILE 205 N -4.05 1.46 -0.21 -0.67 2.08 0.71 -2.45 119.36 116.22 2rgk n ILE 205 Ca -0.08 0.18 -0.01 0.00 0.56 0.00 0.00 62.75 63.39 2rgk n ILE 205 Cb 0.71 -2.37 0.21 0.00 -0.75 0.00 0.00 39.64 37.43 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 -1.00 0.97 0.00 1.39 2.76 -1.28 -0.18 115.15 117.81 2rgk h HIS 206 Ca -0.01 -0.01 -0.12 0.00 -2.20 0.00 0.00 60.37 58.04 2rgk h HIS 206 Cb 0.75 -0.32 -0.02 0.00 1.55 0.00 0.00 27.41 29.38 2rgk h HIS 206 CO -0.32 0.67 -1.43 -0.25 -1.30 0.00 0.00 177.93 175.30 2rgk n ASP 207 N -4.37 0.70 0.03 3.26 10.43 0.49 -4.45 116.55 122.65 2rgk n ASP 207 Ca 0.07 0.30 -0.01 0.00 2.57 0.00 0.00 54.79 57.72 2rgk n ASP 207 Cb 0.09 0.50 -0.00 0.00 1.84 0.00 0.00 41.12 43.55 2rgk n ASP 207 CO 0.00 0.00 0.00 0.52 -1.07 0.00 0.00 177.20 176.65 2rgk n VAL 208 N -2.75 1.21 -0.16 2.53 0.31 -1.22 -4.53 118.33 113.72 2rgk n VAL 208 Ca -0.08 0.35 -0.05 0.00 -0.01 0.00 0.00 64.34 64.55 2rgk n VAL 208 Cb 0.75 -1.68 0.05 0.00 -0.91 0.00 0.00 33.84 32.05 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 -0.13 0.61 -0.61 3.52 0.00 -1.17 -1.12 119.26 120.36 2rgk h ALA 209 Ca -0.01 0.03 0.08 0.00 0.00 0.00 0.00 54.91 55.01 2rgk h ALA 209 Cb 0.19 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 17.89 2rgk h ALA 209 CO -0.00 -0.13 0.41 -0.09 0.00 0.00 0.00 179.25 179.44 2rgk h ARG 210 N 0.46 0.49 -0.05 0.00 2.43 -1.25 0.28 114.38 116.74 2rgk h ARG 210 Ca 0.22 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.36 2rgk h ARG 210 Cb 0.14 -0.11 0.00 0.00 -0.42 0.00 0.00 29.97 29.58 2rgk h ARG 210 CO -0.16 0.33 0.00 -1.71 -1.51 0.00 0.00 179.97 176.91 2rgk n ASN 211 N -4.48 0.81 -2.51 -3.80 5.15 -0.49 -3.98 115.26 105.96 2rgk n ASN 211 Ca 0.09 -1.42 -0.14 0.00 -0.60 0.00 0.00 54.58 52.51 2rgk n ASN 211 Cb 0.30 -0.03 0.03 0.00 -0.53 0.00 0.00 39.78 39.55 2rgk n ASN 211 CO 0.00 0.00 0.00 -3.20 1.40 0.00 0.00 177.26 175.46 2rgk n ASN 212 N -0.31 3.06 -1.89 1.20 4.05 0.57 -4.93 115.26 117.03 2rgk n ASN 212 Ca 0.18 -3.00 -0.19 0.00 0.45 0.00 0.00 54.58 52.02 2rgk n ASN 212 Cb 0.22 -0.45 -0.05 0.00 1.23 0.00 0.00 39.78 40.72 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 -0.46 -0.47 -1.68 1.20 8.25 -1.22 -1.13 115.22 119.71 2rgk n HIS 213 Ca 0.24 0.00 -0.13 0.00 -0.26 0.00 0.00 57.72 57.57 2rgk n HIS 213 Cb 0.82 -3.47 -0.04 0.00 1.12 0.00 0.00 29.99 28.41 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 -2.90 -0.21 -3.23 4.41 4.02 0.66 -4.78 117.16 115.13 2rgk n TYR 214 Ca -0.21 0.00 -0.43 0.00 -0.01 0.00 0.00 57.90 57.25 2rgk n TYR 214 Cb 0.65 -2.55 -0.08 0.00 -0.02 0.00 0.00 39.34 37.35 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 -3.64 3.20 0.11 -0.72 0.52 -0.29 -4.72 118.95 113.42 2rgk s ARG 215 Ca 0.00 -0.56 -0.31 0.00 -0.52 0.00 0.00 55.73 54.33 2rgk s ARG 215 Cb 0.00 -3.95 -0.08 0.00 0.52 0.00 0.00 34.95 31.44 2rgk s ARG 215 CO 0.00 -0.91 1.45 0.08 0.02 0.00 0.00 175.30 175.94 2rgk s VAL 216 N 2.44 3.18 -0.24 3.52 1.01 -1.26 -4.57 120.40 124.48 2rgk s VAL 216 Ca 0.17 0.81 -0.22 0.00 0.00 0.00 0.00 61.98 62.74 2rgk s VAL 216 Cb -0.16 -3.52 -0.02 0.00 0.00 0.00 0.00 36.38 32.69 2rgk s VAL 216 CO 0.16 0.05 0.69 0.21 0.00 0.00 0.00 175.10 176.21 2rgk s ASN 217 N 1.29 6.68 -0.08 3.32 3.84 -1.26 -4.49 114.94 124.24 2rgk s ASN 217 Ca 0.66 0.84 -0.13 0.00 0.21 0.00 0.00 52.86 54.44 2rgk s ASN 217 Cb -0.38 -2.37 -0.29 0.00 -0.55 0.00 0.00 41.25 37.67 2rgk s ASN 217 CO 0.30 -0.39 0.58 -0.08 -2.79 0.00 0.00 177.10 174.72 2rgk h GLU 218 N 7.74 0.31 -5.50 0.43 4.57 -1.94 -3.43 114.58 116.75 2rgk h GLU 218 Ca -0.27 -0.53 -0.61 0.00 -1.18 0.00 0.00 59.36 56.77 2rgk h GLU 218 Cb 1.12 0.20 -0.10 0.00 -0.16 0.00 0.00 28.75 29.81 2rgk h GLU 218 CO 0.80 1.26 -0.41 -1.01 -1.18 0.00 0.00 179.01 178.47 2rgk s HIS 219 N -2.53 3.50 0.09 0.92 0.09 -1.26 -1.34 115.29 114.76 2rgk s HIS 219 Ca -0.19 0.53 0.01 0.00 -0.00 0.00 0.00 55.06 55.41 2rgk s HIS 219 Cb 0.05 -2.18 -0.04 0.00 -0.00 0.00 0.00 32.58 30.41 2rgk s HIS 219 CO 0.80 0.41 -0.05 -0.06 -0.00 0.00 0.00 174.74 175.85 2rgk s PHE 220 N -0.07 0.78 0.76 1.40 0.40 -0.15 -0.77 117.98 120.33 2rgk s PHE 220 Ca 0.14 -0.98 -0.02 0.00 -0.60 0.00 0.00 56.93 55.47 2rgk s PHE 220 Cb -0.12 -0.48 0.15 0.00 0.51 0.00 0.00 43.02 43.07 2rgk s PHE 220 CO 0.03 -0.24 1.04 0.16 0.70 0.00 0.00 175.22 176.91 2rgk s ASP 221 N -3.01 4.12 0.36 1.36 1.47 -0.36 -2.18 116.67 118.43 2rgk s ASP 221 Ca 0.11 -0.41 0.26 0.00 1.18 0.00 0.00 52.55 53.69 2rgk s ASP 221 Cb 0.06 0.14 1.31 0.00 -0.34 0.00 0.00 42.92 44.09 2rgk s ASP 221 CO -0.06 -2.03 1.78 0.71 0.68 0.00 0.00 175.17 176.26 2rgk h THR 222 N -0.68 0.00 -0.13 2.11 1.35 -1.89 0.15 112.91 113.82 2rgk h THR 222 Ca -0.36 -0.08 0.00 0.00 -0.55 0.00 0.00 66.41 65.43 2rgk h THR 222 Cb 1.26 0.71 0.00 0.00 -1.73 0.00 0.00 68.15 68.38 2rgk h THR 222 CO 0.38 0.00 0.00 0.00 -0.25 0.00 0.00 175.52 175.65 2rgk n GLN 223 N -2.40 1.94 -2.26 4.72 1.13 -1.26 -4.92 117.38 114.32 2rgk n GLN 223 Ca -0.01 -1.39 -0.11 0.00 -1.94 0.00 0.00 57.00 53.56 2rgk n GLN 223 Cb 0.09 -1.45 -0.00 0.00 0.11 0.00 0.00 30.24 28.99 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 0.64 -0.57 -3.48 1.08 7.02 0.51 -5.02 117.44 117.62 2rgk n TRP 224 Ca 0.17 0.04 -0.38 0.00 -1.02 0.00 0.00 57.50 56.31 2rgk n TRP 224 Cb 0.43 -2.54 -0.06 0.00 -2.42 0.00 0.00 31.31 26.72 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 -2.57 6.66 0.55 -0.99 0.01 -1.26 -4.82 114.94 112.53 2rgk s ASN 225 Ca 0.02 0.79 -0.22 0.00 -0.71 0.00 0.00 52.86 52.74 2rgk s ASN 225 Cb -0.01 -2.23 -0.05 0.00 0.41 0.00 0.00 41.25 39.37 2rgk s ASN 225 CO 0.03 0.19 1.34 -2.65 -1.51 0.00 0.00 177.10 174.49 2rgk n PRO 226 N 2.76 1.64 -3.19 -0.60 -0.02 -1.26 -1.22 135.00 133.11 2rgk n PRO 226 Ca -0.12 0.60 -0.25 0.00 -2.02 0.00 0.00 63.50 61.71 2rgk n PRO 226 Cb 0.52 -2.55 -0.06 0.00 -0.02 0.00 0.00 33.50 31.40 2rgk n PRO 226 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 2rgk n LEU 227 N -0.98 3.16 0.03 2.45 4.77 0.05 -4.82 117.00 121.66 2rgk n LEU 227 Ca 0.11 -5.37 0.22 0.00 -0.03 0.00 0.00 56.01 50.93 2rgk n LEU 227 Cb 0.45 -0.27 0.71 0.00 -2.33 0.00 0.00 43.42 41.98 2rgk n LEU 227 CO 0.53 2.20 1.20 1.55 -1.33 0.00 0.00 177.39 181.53 2rgk h PRO 228 N 3.58 0.00 -0.68 3.23 0.13 -1.93 -0.03 132.00 136.29 2rgk h PRO 228 Ca 0.14 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.27 2rgk h PRO 228 Cb 0.67 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.80 2rgk h PRO 228 CO 0.74 0.00 0.00 -0.25 -0.23 0.00 0.00 178.00 178.26 2rgk n ASP 229 N -3.70 3.88 -4.67 1.44 10.43 -1.26 -4.45 116.55 118.21 2rgk n ASP 229 Ca 0.10 -2.10 -0.47 0.00 2.57 0.00 0.00 54.79 54.88 2rgk n ASP 229 Cb 0.75 -0.48 -0.05 0.00 1.84 0.00 0.00 41.12 43.18 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 1.40 2.28 -1.54 1.24 9.36 -0.03 -0.86 117.16 129.01 2rgk n TYR 230 Ca 0.23 0.14 -0.18 0.00 3.32 0.00 0.00 57.90 61.41 2rgk n TYR 230 Cb 0.64 -2.60 -0.08 0.00 -0.63 0.00 0.00 39.34 36.68 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 5.05 -5.16 -0.08 2.98 5.03 -1.26 -4.14 115.26 117.69 2rgk n ASN 231 Ca 0.20 0.43 0.03 0.00 0.87 0.00 0.00 54.58 56.12 2rgk n ASN 231 Cb 0.29 -4.24 0.37 0.00 -1.02 0.00 0.00 39.78 35.18 2rgk n ASN 231 CO 0.00 0.00 0.00 0.50 -1.83 0.00 0.00 177.26 175.93 2rgk h LYS 232 N 0.00 0.67 0.00 3.52 3.64 -1.35 -1.60 116.57 121.45 2rgk h LYS 232 Ca -0.37 -0.04 -0.03 0.00 -1.27 0.00 0.00 60.65 58.94 2rgk h LYS 232 Cb 1.17 -0.15 -0.00 0.00 -0.41 0.00 0.00 32.23 32.84 2rgk h LYS 232 CO 0.54 0.45 -0.16 -0.44 -2.27 0.00 0.00 179.45 177.56 2rgk h ASP 233 N 0.69 0.00 -2.14 4.20 3.32 -1.89 -3.27 116.42 117.33 2rgk h ASP 233 Ca 0.20 0.00 -0.59 0.00 0.02 0.00 0.00 57.03 56.66 2rgk h ASP 233 Cb -0.04 0.00 -0.41 0.00 0.22 0.00 0.00 39.33 39.10 2rgk h ASP 233 CO -0.05 0.16 -0.73 0.59 -1.72 0.00 0.00 179.24 177.49 2rgk n ASN 234 N -4.29 2.82 -0.25 6.45 5.03 -0.61 -4.98 115.26 119.43 2rgk n ASN 234 Ca -0.02 -3.25 0.05 0.00 0.87 0.00 0.00 54.58 52.22 2rgk n ASN 234 Cb 0.23 -0.66 0.15 0.00 -1.02 0.00 0.00 39.78 38.48 2rgk n ASN 234 CO 0.00 0.00 0.00 -0.65 -1.83 0.00 0.00 177.26 174.78 2rgk h PRO 235 N 4.08 0.11 -0.13 3.52 0.11 -1.61 -2.74 132.00 135.34 2rgk h PRO 235 Ca 0.16 -0.01 -0.10 0.00 0.11 0.00 0.00 66.00 66.16 2rgk h PRO 235 Cb 0.72 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 31.79 2rgk h PRO 235 CO 0.74 0.07 -0.37 0.00 -0.21 0.00 0.00 178.00 178.23 2rgk h ALA 236 N 1.69 1.13 -1.20 -0.75 0.00 -1.94 -3.38 119.26 114.81 2rgk h ALA 236 Ca 0.40 -0.39 -0.78 0.00 0.00 0.00 0.00 54.91 54.14 2rgk h ALA 236 Cb 0.71 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 18.41 2rgk h ALA 236 CO -0.65 0.57 0.91 0.72 0.00 0.00 0.00 179.25 180.80 2rgk n HIS 237 N -4.06 1.85 -0.08 0.00 8.25 -1.03 -4.86 115.22 115.29 2rgk n HIS 237 Ca -0.01 0.74 -0.11 0.00 -0.26 0.00 0.00 57.72 58.08 2rgk n HIS 237 Cb 0.45 -2.37 0.02 0.00 1.12 0.00 0.00 29.99 29.21 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 6.99 0.80 -6.37 -0.41 -0.00 -1.90 -3.33 114.38 110.16 2rgk h ARG 238 Ca -0.41 -0.43 -0.54 0.00 -0.50 0.00 0.00 59.98 58.10 2rgk h ARG 238 Cb 1.34 0.02 0.01 0.00 0.00 0.00 0.00 29.97 31.34 2rgk h ARG 238 CO 0.98 1.06 1.04 0.12 0.00 0.00 0.00 179.97 183.18 2rgk s PHE 239 N -4.30 2.20 -1.38 3.04 5.36 -1.26 -2.52 117.98 119.12 2rgk s PHE 239 Ca -0.10 0.24 -0.04 0.00 -0.96 0.00 0.00 56.93 56.07 2rgk s PHE 239 Cb 0.11 -3.95 0.00 0.00 -0.34 0.00 0.00 43.02 38.84 2rgk s PHE 239 CO 0.86 -3.92 0.43 0.54 -1.46 0.00 0.00 175.22 171.67 2rgk n ARG 240 N 6.27 -2.65 -1.49 10.12 1.74 -1.26 -4.85 116.66 124.52 2rgk n ARG 240 Ca 0.16 0.36 -0.37 0.00 -0.77 0.00 0.00 57.85 57.24 2rgk n ARG 240 Cb 0.41 -4.28 0.07 0.00 -1.02 0.00 0.00 32.46 27.64 2rgk n ARG 240 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2rgk n ALA 241 N -4.43 -0.19 -1.77 7.54 0.00 -1.05 -4.76 120.51 115.86 2rgk n ALA 241 Ca -0.28 -0.09 -0.38 0.00 0.00 0.00 0.00 53.44 52.70 2rgk n ALA 241 Cb 0.67 -2.07 -0.01 0.00 0.00 0.00 0.00 19.45 18.04 2rgk n ALA 241 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 2rgk s PHE 242 N -1.66 2.85 0.00 0.00 2.19 -1.26 -4.84 117.98 115.25 2rgk s PHE 242 Ca 0.74 1.51 0.00 0.00 0.33 0.00 0.00 56.93 59.52 2rgk s PHE 242 Cb -0.39 -3.44 0.00 0.00 -1.31 0.00 0.00 43.02 37.88 2rgk s PHE 242 CO 0.49 -1.65 0.00 0.41 1.83 0.00 0.00 175.22 176.30 2rgk n GLY 243 N 0.52 -1.17 3.88 13.12 0.00 -1.26 -4.73 105.19 115.55 2rgk n GLY 243 Ca 0.07 -1.25 -0.29 0.00 0.00 0.00 0.00 46.02 44.55 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 -0.09 1.99 -0.52 -0.02 0.00 -0.13 -4.60 107.32 103.96 2rgk s GLY 244 Ca 0.00 -0.96 -0.01 0.00 0.00 0.00 0.00 44.72 43.75 2rgk s GLY 244 CO 0.00 -0.95 0.30 -1.59 0.00 0.00 0.00 173.10 170.86 2rgk s THR 245 N -1.56 3.21 0.34 0.90 2.01 -1.26 -0.61 115.64 118.68 2rgk s THR 245 Ca 0.33 -2.75 0.20 0.00 0.31 0.00 0.00 61.69 59.78 2rgk s THR 245 Cb -0.12 -3.17 0.33 0.00 0.01 0.00 0.00 72.50 69.55 2rgk s THR 245 CO 0.26 -0.78 1.42 -2.65 -0.69 0.00 0.00 174.62 172.17 2rgk n PRO 246 N 3.76 -0.05 -0.08 4.92 -0.02 -1.24 -0.42 135.00 141.87 2rgk n PRO 246 Ca 0.04 1.22 -0.07 0.00 -2.02 0.00 0.00 63.50 62.68 2rgk n PRO 246 Cb 0.38 -2.22 -0.00 0.00 -0.02 0.00 0.00 33.50 31.63 2rgk n PRO 246 CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 2rgk h GLY 247 N 0.00 0.12 1.11 -1.23 0.00 -1.85 -1.79 103.07 99.43 2rgk h GLY 247 Ca 0.77 0.17 -0.05 0.00 0.00 0.00 0.00 47.33 48.21 2rgk h GLY 247 CO -0.66 -0.15 0.24 0.45 0.00 0.00 0.00 176.54 176.42 2rgk h HIS 248 N -0.08 1.15 -0.29 5.60 3.86 -1.13 -2.62 115.15 121.64 2rgk h HIS 248 Ca 0.15 -0.11 0.07 0.00 -1.16 0.00 0.00 60.37 59.33 2rgk h HIS 248 Cb 0.32 -0.34 -0.07 0.00 1.06 0.00 0.00 27.41 28.37 2rgk h HIS 248 CO -0.33 0.90 -0.23 -1.49 0.86 0.00 0.00 177.93 177.64 2rgk h TRP 249 N 1.08 -0.61 0.00 2.45 6.55 -1.15 0.07 115.95 124.34 2rgk h TRP 249 Ca 0.24 0.04 -0.04 0.00 0.95 0.00 0.00 58.89 60.08 2rgk h TRP 249 Cb 0.28 0.31 -0.01 0.00 -0.86 0.00 0.00 29.16 28.89 2rgk h TRP 249 CO 0.02 -0.31 -0.21 0.97 -1.05 0.00 0.00 178.44 177.87 2rgk h ILE 250 N -0.21 0.75 -0.07 1.49 2.10 -1.32 -2.56 117.51 117.68 2rgk h ILE 250 Ca 0.15 -0.85 -0.02 0.00 1.08 0.00 0.00 64.86 65.22 2rgk h ILE 250 Cb 0.45 1.52 -0.00 0.00 -1.09 0.00 0.00 36.82 37.70 2rgk h ILE 250 CO -0.41 0.20 -0.05 -0.33 -1.08 0.00 0.00 178.15 176.48 2rgk h GLU 251 N 0.00 0.16 -0.94 2.19 5.08 -0.68 -2.86 114.58 117.52 2rgk h GLU 251 Ca -0.00 -0.07 0.18 0.00 -1.00 0.00 0.00 59.36 58.47 2rgk h GLU 251 Cb 0.50 -0.00 -0.08 0.00 0.50 0.00 0.00 28.75 29.67 2rgk h GLU 251 CO 0.03 0.55 0.60 -1.49 -1.00 0.00 0.00 179.01 177.70 2rgk h TRP 252 N -0.24 0.79 -0.13 4.33 4.06 -0.70 -1.24 115.95 122.83 2rgk h TRP 252 Ca 0.01 0.02 -0.00 0.00 2.06 0.00 0.00 58.89 60.99 2rgk h TRP 252 Cb 0.51 -0.24 -0.01 0.00 -1.00 0.00 0.00 29.16 28.42 2rgk h TRP 252 CO 0.08 0.22 0.08 0.78 -3.56 0.00 0.00 178.44 176.03 2rgk h GLY 253 N 0.61 0.20 0.84 1.49 0.00 -1.27 -1.23 103.07 103.71 2rgk h GLY 253 Ca 0.50 -0.09 -0.00 0.00 0.00 0.00 0.00 47.33 47.74 2rgk h GLY 253 CO -0.25 0.08 0.00 -0.09 0.00 0.00 0.00 176.54 176.29 2rgk h ARG 254 N 0.13 0.01 -0.84 4.80 2.43 -1.10 -2.52 114.38 117.28 2rgk h ARG 254 Ca 0.05 -0.00 0.12 0.00 -0.81 0.00 0.00 59.98 59.34 2rgk h ARG 254 Cb 0.06 -0.00 -0.06 0.00 -0.42 0.00 0.00 29.97 29.55 2rgk h ARG 254 CO -0.01 0.17 0.55 -0.07 -1.51 0.00 0.00 179.97 179.10 2rgk h LEU 255 N -0.15 0.65 -0.88 3.80 3.38 -1.17 0.35 115.31 121.29 2rgk h LEU 255 Ca 0.00 0.03 -0.11 0.00 0.09 0.00 0.00 57.88 57.89 2rgk h LEU 255 Cb 0.16 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.79 2rgk h LEU 255 CO -0.00 0.36 -0.55 0.24 0.09 0.00 0.00 178.44 178.58 2rgk h MET 256 N 0.70 0.00 -0.00 1.13 2.86 -1.02 -2.44 114.93 116.16 2rgk h MET 256 Ca 0.41 0.00 -0.16 0.00 -2.06 0.00 0.00 59.70 57.89 2rgk h MET 256 Cb 0.60 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.24 2rgk h MET 256 CO -0.17 0.55 -0.74 -0.07 1.06 0.00 0.00 176.91 177.54 2rgk h LEU 257 N 0.00 0.05 -1.33 1.22 3.38 -0.55 -0.24 115.31 117.83 2rgk h LEU 257 Ca -0.01 -0.03 -0.06 0.00 0.09 0.00 0.00 57.88 57.87 2rgk h LEU 257 Cb 0.99 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.71 2rgk h LEU 257 CO 0.07 0.77 -0.19 0.45 0.09 0.00 0.00 178.44 179.63 2rgk h HIS 258 N 0.02 0.23 -0.06 1.13 3.86 -0.82 0.31 115.15 119.82 2rgk h HIS 258 Ca -0.01 -0.03 -0.07 0.00 -1.16 0.00 0.00 60.37 59.10 2rgk h HIS 258 Cb 1.31 -0.06 0.00 0.00 1.06 0.00 0.00 27.41 29.72 2rgk h HIS 258 CO 0.00 0.40 -0.24 0.82 0.86 0.00 0.00 177.93 179.77 2rgk h ILE 259 N 0.20 1.44 -0.81 2.45 2.04 -0.99 -1.61 117.51 120.23 2rgk h ILE 259 Ca 0.04 -1.66 0.11 0.00 1.00 0.00 0.00 64.86 64.35 2rgk h ILE 259 Cb 0.46 2.35 -0.08 0.00 -0.74 0.00 0.00 36.82 38.81 2rgk h ILE 259 CO 0.03 0.47 0.44 -0.74 0.00 0.00 0.00 178.15 178.35 2rgk h HIS 260 N -0.25 0.79 -0.25 1.37 2.76 -0.48 -1.23 115.15 117.85 2rgk h HIS 260 Ca -0.01 0.03 -0.16 0.00 -2.20 0.00 0.00 60.37 58.02 2rgk h HIS 260 Cb 0.88 -0.23 -0.00 0.00 1.55 0.00 0.00 27.41 29.61 2rgk h HIS 260 CO 0.13 0.28 -0.50 0.00 -1.30 0.00 0.00 177.93 176.53 2rgk h ALA 261 N 1.48 0.64 -0.77 5.26 0.00 -0.39 -2.68 119.26 122.80 2rgk h ALA 261 Ca 0.41 -0.49 -0.02 0.00 0.00 0.00 0.00 54.91 54.81 2rgk h ALA 261 Cb 0.45 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.11 2rgk h ALA 261 CO -0.29 0.68 0.42 0.00 0.00 0.00 0.00 179.25 180.06 2rgk h ALA 262 N 0.89 0.99 -0.47 0.00 0.00 -0.24 0.12 119.26 120.55 2rgk h ALA 262 Ca 0.02 -0.12 -0.05 0.00 0.00 0.00 0.00 54.91 54.76 2rgk h ALA 262 Cb 1.07 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 18.53 2rgk h ALA 262 CO 0.10 0.51 0.09 -0.07 0.00 0.00 0.00 179.25 179.88 2rgk h LEU 263 N 1.07 0.73 -0.93 0.00 3.38 -1.23 -2.71 115.31 115.62 2rgk h LEU 263 Ca 0.27 -0.25 -0.08 0.00 0.09 0.00 0.00 57.88 57.91 2rgk h LEU 263 Cb 0.04 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.58 2rgk h LEU 263 CO -0.04 0.80 -0.12 -0.33 0.09 0.00 0.00 178.44 178.83 2rgk h GLU 264 N 0.64 0.65 -0.00 1.13 5.08 -1.12 0.06 114.58 121.01 2rgk h GLU 264 Ca 0.14 -0.21 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 2rgk h GLU 264 Cb 0.37 -0.06 -0.00 0.00 0.50 0.00 0.00 28.75 29.56 2rgk h GLU 264 CO 0.01 0.75 0.01 0.00 -1.00 0.00 0.00 179.01 178.78 2rgk h ALA 265 N 1.27 1.36 -0.43 3.43 0.00 -0.45 -0.10 119.26 124.34 2rgk h ALA 265 Ca 0.10 -0.00 -0.14 0.00 0.00 0.00 0.00 54.91 54.88 2rgk h ALA 265 Cb 0.56 0.00 -0.08 0.00 0.00 0.00 0.00 17.79 18.27 2rgk h ALA 265 CO 0.03 -0.01 0.07 2.89 0.00 0.00 0.00 179.25 182.23 2rgk n ARG 266 N -3.60 2.68 -3.05 0.00 1.85 -0.90 -4.94 116.66 108.69 2rgk n ARG 266 Ca -0.03 -3.02 -0.23 0.00 -1.00 0.00 0.00 57.85 53.57 2rgk n ARG 266 Cb 0.09 -1.93 0.04 0.00 -1.05 0.00 0.00 32.46 29.60 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 -5.74 2.59 -0.11 0.00 2.12 -0.04 -5.00 118.70 112.52 2rgk s GLU 268 Ca 0.32 -1.13 -0.31 0.00 0.36 0.00 0.00 54.97 54.21 2rgk s GLU 268 Cb -0.14 -2.93 -0.09 0.00 0.26 0.00 0.00 34.13 31.24 2rgk s GLU 268 CO 0.39 -0.47 2.05 0.94 -0.54 0.00 0.00 175.26 177.63 2rgk n GLN 269 N 4.57 2.27 -1.96 4.30 7.27 -1.26 -3.38 117.38 129.20 2rgk n GLN 269 Ca -0.16 0.77 -0.33 0.00 0.07 0.00 0.00 57.00 57.35 2rgk n GLN 269 Cb 0.45 -2.94 0.02 0.00 2.41 0.00 0.00 30.24 30.18 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 5.11 3.15 0.38 3.69 0.04 -1.26 -4.98 135.00 141.12 2rgk s PRO 270 Ca 0.95 1.29 -0.28 0.00 0.04 0.00 0.00 61.00 63.00 2rgk s PRO 270 Cb -0.51 -2.00 -0.10 0.00 0.04 0.00 0.00 34.50 31.93 2rgk s PRO 270 CO 0.43 -0.96 1.42 -2.14 0.04 0.00 0.00 177.00 175.79 2rgk s PRO 271 N -4.04 4.11 0.51 0.56 0.02 -1.26 -4.89 135.00 130.01 2rgk s PRO 271 Ca 0.65 2.42 0.23 0.00 0.02 0.00 0.00 61.00 64.33 2rgk s PRO 271 Cb -0.18 -2.94 1.37 0.00 0.02 0.00 0.00 34.50 32.77 2rgk s PRO 271 CO 0.38 -0.47 2.08 0.00 -0.33 0.00 0.00 177.00 178.66 2rgk h ALA 272 N 2.99 1.48 0.00 -1.55 0.00 -2.03 -2.89 119.26 117.26 2rgk h ALA 272 Ca -0.50 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.30 2rgk h ALA 272 Cb 1.24 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.01 2rgk h ALA 272 CO 0.64 0.14 0.00 0.11 0.00 0.00 0.00 179.25 180.14 2rgk h TRP 273 N 0.00 0.00 0.46 0.00 5.08 -1.98 -2.01 115.95 117.51 2rgk h TRP 273 Ca -0.00 0.00 -0.02 0.00 1.08 0.00 0.00 58.89 59.95 2rgk h TRP 273 Cb 0.26 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.43 2rgk h TRP 273 CO 0.00 0.00 -0.22 -0.07 -1.28 0.00 0.00 178.44 176.87 2rgk h LEU 274 N 0.00 -0.53 -0.47 0.11 3.38 -1.88 0.08 115.31 116.01 2rgk h LEU 274 Ca 0.00 -0.07 -0.11 0.00 0.09 0.00 0.00 57.88 57.79 2rgk h LEU 274 Cb 0.09 0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.97 2rgk h LEU 274 CO 0.00 -0.23 -0.15 0.25 0.09 0.00 0.00 178.44 178.40 2rgk h LEU 275 N -0.82 0.95 -0.69 1.67 5.85 -1.71 -1.95 115.31 118.61 2rgk h LEU 275 Ca -0.06 -0.37 0.03 0.00 0.84 0.00 0.00 57.88 58.31 2rgk h LEU 275 Cb 0.56 -0.26 -0.04 0.00 0.37 0.00 0.00 40.66 41.29 2rgk h LEU 275 CO 0.10 1.11 0.42 -0.33 -0.34 0.00 0.00 178.44 179.41 2rgk h GLU 276 N 0.78 0.80 -0.09 1.25 5.08 -1.36 -1.38 114.58 119.67 2rgk h GLU 276 Ca 0.12 -0.05 -0.19 0.00 -1.00 0.00 0.00 59.36 58.24 2rgk h GLU 276 Cb 0.71 -0.18 -0.00 0.00 0.50 0.00 0.00 28.75 29.78 2rgk h GLU 276 CO 0.05 0.53 -0.74 -0.44 -1.00 0.00 0.00 179.01 177.42 2rgk h ASP 277 N 0.83 0.53 -0.54 1.42 3.32 -0.90 -2.31 116.42 118.76 2rgk h ASP 277 Ca 0.28 -0.35 -0.04 0.00 0.02 0.00 0.00 57.03 56.94 2rgk h ASP 277 Cb 0.04 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 39.40 2rgk h ASP 277 CO -0.11 1.10 0.20 0.00 -1.72 0.00 0.00 179.24 178.70 2rgk h ALA 278 N 0.89 0.71 -0.25 3.45 0.00 -1.06 0.53 119.26 123.52 2rgk h ALA 278 Ca -0.03 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.71 2rgk h ALA 278 Cb 1.32 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.88 2rgk h ALA 278 CO 0.13 0.34 0.16 0.87 0.00 0.00 0.00 179.25 180.75 2rgk h LYS 279 N 0.74 0.34 -0.31 0.00 1.57 -1.21 -1.57 116.57 116.12 2rgk h LYS 279 Ca 0.18 -0.03 -0.00 0.00 -1.87 0.00 0.00 60.65 58.93 2rgk h LYS 279 Cb 0.23 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.45 2rgk h LYS 279 CO -0.01 0.25 0.18 0.78 -0.57 0.00 0.00 179.45 180.07 2rgk h GLY 280 N 0.33 0.46 1.03 3.86 0.00 -1.09 0.84 103.07 108.51 2rgk h GLY 280 Ca 0.09 -0.20 0.01 0.00 0.00 0.00 0.00 47.33 47.23 2rgk h GLY 280 CO -0.02 0.20 0.64 1.41 0.00 0.00 0.00 176.54 178.77 2rgk h LEU 281 N 0.39 1.13 -0.22 3.11 3.38 -0.78 0.15 115.31 122.47 2rgk h LEU 281 Ca 0.11 -0.04 -0.04 0.00 0.09 0.00 0.00 57.88 58.00 2rgk h LEU 281 Cb 0.04 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.50 2rgk h LEU 281 CO -0.02 0.83 -0.03 0.15 0.09 0.00 0.00 178.44 179.47 2rgk h PHE 282 N 1.33 0.44 -0.35 1.13 3.57 -0.89 -1.89 116.94 120.28 2rgk h PHE 282 Ca 0.36 -0.09 0.02 0.00 3.53 0.00 0.00 57.97 61.79 2rgk h PHE 282 Cb -0.14 -0.11 -0.03 0.00 2.79 0.00 0.00 35.95 38.46 2rgk h PHE 282 CO 0.00 0.61 0.19 -0.97 -2.23 0.00 0.00 178.31 175.91 2rgk h ASN 283 N 0.15 0.29 -0.73 0.41 -0.73 -0.32 -2.09 115.58 112.55 2rgk h ASN 283 Ca 0.06 0.01 0.02 0.00 1.87 0.00 0.00 56.30 58.26 2rgk h ASN 283 Cb 0.45 -0.05 -0.04 0.00 0.27 0.00 0.00 38.32 38.96 2rgk h ASN 283 CO 0.02 0.21 0.48 0.00 -0.37 0.00 0.00 177.43 177.77 2rgk h ALA 284 N 1.17 1.54 -0.17 1.57 0.00 -0.64 0.11 119.26 122.83 2rgk h ALA 284 Ca 0.14 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 2rgk h ALA 284 Cb 0.03 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.55 2rgk h ALA 284 CO -0.09 0.41 0.05 1.15 0.00 0.00 0.00 179.25 180.77 2rgk h THR 285 N 0.92 1.18 -0.21 0.00 2.02 -0.67 -1.33 112.91 114.83 2rgk h THR 285 Ca 0.28 -0.58 -0.18 0.00 0.77 0.00 0.00 66.41 66.70 2rgk h THR 285 Cb -0.02 1.24 -0.00 0.00 -1.74 0.00 0.00 68.15 67.63 2rgk h THR 285 CO -0.07 0.18 -0.60 -0.37 0.37 0.00 0.00 175.52 175.02 2rgk h VAL 286 N 0.10 1.30 -0.18 3.16 -1.51 -1.18 0.17 116.25 118.11 2rgk h VAL 286 Ca 0.06 -1.83 0.05 0.00 -1.23 0.00 0.00 66.70 63.74 2rgk h VAL 286 Cb 0.23 1.77 -0.05 0.00 -2.13 0.00 0.00 31.29 31.11 2rgk h VAL 286 CO -0.00 0.58 -0.12 -0.09 -1.23 0.00 0.00 177.57 176.71 2rgk h ARG 287 N 0.53 -0.11 0.03 5.19 2.43 -0.66 -2.98 114.38 118.81 2rgk h ARG 287 Ca -0.00 0.01 -0.38 0.00 -0.81 0.00 0.00 59.98 58.79 2rgk h ARG 287 Cb 1.19 0.03 -0.06 0.00 -0.42 0.00 0.00 29.97 30.71 2rgk h ARG 287 CO 0.12 -0.08 -2.35 -0.25 -1.51 0.00 0.00 179.97 175.91 2rgk n ASP 288 N -5.27 1.94 0.03 -3.80 8.00 -0.51 -4.72 116.55 112.20 2rgk n ASP 288 Ca -0.02 -0.04 0.11 0.00 0.71 0.00 0.00 54.79 55.55 2rgk n ASP 288 Cb 0.19 -0.47 0.07 0.00 -0.02 0.00 0.00 41.12 40.89 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 -3.17 3.45 -2.64 2.24 0.00 0.60 -4.65 120.51 116.35 2rgk n ALA 289 Ca -0.42 -0.39 -0.39 0.00 0.00 0.00 0.00 53.44 52.25 2rgk n ALA 289 Cb 1.01 -1.01 -0.08 0.00 0.00 0.00 0.00 19.45 19.38 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 -3.15 3.31 -1.36 0.00 -0.11 -1.13 -1.53 118.94 114.99 2rgk s TRP 290 Ca 0.05 0.59 -0.12 0.00 1.22 0.00 0.00 56.10 57.85 2rgk s TRP 290 Cb 0.15 -2.61 0.02 0.00 -1.50 0.00 0.00 33.47 29.53 2rgk s TRP 290 CO 0.78 -0.15 0.22 0.00 -4.62 0.00 0.00 176.95 173.18 2rgk n ALA 291 N 5.00 -2.15 0.49 5.86 0.00 -0.20 -4.86 120.51 124.65 2rgk n ALA 291 Ca -0.07 -0.46 0.12 0.00 0.00 0.00 0.00 53.44 53.03 2rgk n ALA 291 Cb 0.51 -1.31 0.15 0.00 0.00 0.00 0.00 19.45 18.79 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 -1.88 0.00 -0.42 0.00 0.13 -1.80 -3.40 132.00 124.63 2rgk h PRO 292 Ca -0.64 0.00 -0.29 0.00 -0.87 0.00 0.00 66.00 64.19 2rgk h PRO 292 Cb 1.32 0.00 -0.21 0.00 0.13 0.00 0.00 31.00 32.24 2rgk h PRO 292 CO 0.61 0.00 -0.48 -0.40 -0.23 0.00 0.00 178.00 177.50 2rgk n ASP 293 N -2.23 3.47 0.00 1.44 5.68 -1.26 -4.94 116.55 118.71 2rgk n ASP 293 Ca 0.03 -3.82 0.00 0.00 -0.50 0.00 0.00 54.79 50.50 2rgk n ASP 293 Cb 0.46 -0.50 0.00 0.00 -1.14 0.00 0.00 41.12 39.94 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 -0.94 0.75 3.35 6.12 0.00 -1.26 -5.05 105.19 108.16 2rgk n GLY 294 Ca 0.34 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.25 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 -2.25 -1.14 0.97 4.61 0.00 -1.26 -5.13 121.76 117.56 2rgk s ALA 295 Ca 0.00 0.17 -0.12 0.00 0.00 0.00 0.00 51.96 52.01 2rgk s ALA 295 Cb 0.00 0.69 0.17 0.00 0.00 0.00 0.00 23.12 23.98 2rgk s ALA 295 CO 0.00 -0.65 1.10 -0.51 0.00 0.00 0.00 175.76 175.70 2rgk s ASP 296 N -2.66 2.86 0.00 0.00 1.01 -1.26 -3.91 116.67 112.71 2rgk s ASP 296 Ca 0.01 1.19 0.00 0.00 0.71 0.00 0.00 52.55 54.46 2rgk s ASP 296 Cb 0.01 -1.85 0.00 0.00 1.01 0.00 0.00 42.92 42.09 2rgk s ASP 296 CO -0.11 -2.98 0.00 0.61 0.21 0.00 0.00 175.17 172.90 2rgk n GLY 297 N -1.27 2.87 3.31 0.21 0.00 -1.26 -4.73 105.19 104.32 2rgk n GLY 297 Ca 0.06 -1.97 -0.39 0.00 0.00 0.00 0.00 46.02 43.72 2rgk n GLY 297 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2rgk s ILE 298 N -2.88 4.04 0.93 -0.61 1.01 -1.25 -1.03 121.20 121.40 2rgk s ILE 298 Ca 0.00 -1.01 -0.11 0.00 0.00 0.00 0.00 60.65 59.53 2rgk s ILE 298 Cb 0.00 -3.26 0.11 0.00 0.01 0.00 0.00 42.46 39.32 2rgk s ILE 298 CO 0.00 -0.17 0.88 1.33 0.00 0.00 0.00 174.94 176.98 2rgk n VAL 299 N 4.87 0.00 -0.05 2.92 0.24 -0.58 -4.46 118.33 121.26 2rgk n VAL 299 Ca -0.12 -0.07 -0.12 0.00 -2.04 0.00 0.00 64.34 61.99 2rgk n VAL 299 Cb 0.45 -0.86 -0.11 0.00 -1.47 0.00 0.00 33.84 31.85 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 -1.79 -0.01 -3.47 6.34 3.20 -1.03 -3.43 116.97 116.78 2rgk h TYR 300 Ca -0.43 -0.00 -0.47 0.00 3.14 0.00 0.00 58.73 60.97 2rgk h TYR 300 Cb 1.27 0.00 -0.18 0.00 1.54 0.00 0.00 36.73 39.37 2rgk h TYR 300 CO 0.46 0.77 -0.77 0.95 -1.64 0.00 0.00 178.16 177.93 2rgk s THR 301 N -2.37 1.55 0.02 1.81 -4.23 -0.94 -3.71 115.64 107.78 2rgk s THR 301 Ca -0.16 -1.80 0.02 0.00 -1.18 0.00 0.00 61.69 58.57 2rgk s THR 301 Cb -0.02 -1.67 -0.02 0.00 1.34 0.00 0.00 72.50 72.13 2rgk s THR 301 CO 0.58 -0.36 -0.06 -0.69 -0.54 0.00 0.00 174.62 173.55 2rgk s VAL 302 N -2.08 0.40 0.50 2.29 1.01 0.23 -1.33 120.40 121.41 2rgk s VAL 302 Ca 0.12 -0.78 -0.07 0.00 0.00 0.00 0.00 61.98 61.25 2rgk s VAL 302 Cb -0.05 -0.45 0.11 0.00 0.00 0.00 0.00 36.38 35.99 2rgk s VAL 302 CO 0.05 -0.26 0.68 -0.90 0.00 0.00 0.00 175.10 174.66 2rgk n ASP 303 N 1.94 0.24 0.00 3.32 5.75 0.80 -0.95 116.55 127.64 2rgk n ASP 303 Ca -0.20 -1.36 0.08 0.00 -0.01 0.00 0.00 54.79 53.30 2rgk n ASP 303 Cb 0.56 -0.50 0.47 0.00 -1.03 0.00 0.00 41.12 40.62 2rgk n ASP 303 CO 0.00 0.00 0.00 0.79 -0.11 0.00 0.00 177.20 177.88 2rgk n TRP 304 N -2.78 0.00 0.72 2.11 5.03 -1.26 -1.53 117.44 119.73 2rgk n TRP 304 Ca 0.09 0.00 0.08 0.00 3.03 0.00 0.00 57.50 60.70 2rgk n TRP 304 Cb 0.32 0.00 -0.02 0.00 -1.03 0.00 0.00 31.31 30.58 2rgk n TRP 304 CO 0.00 0.00 0.00 0.39 -0.03 0.00 0.00 177.69 178.05 2rgk n GLU 305 N -0.82 1.71 -0.15 -0.99 -0.58 -1.26 -4.94 120.64 113.61 2rgk n GLU 305 Ca 0.12 -0.66 0.00 0.00 -0.42 0.00 0.00 57.16 56.20 2rgk n GLU 305 Cb 0.05 -1.27 0.00 0.00 -0.57 0.00 0.00 31.44 29.66 2rgk n GLU 305 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2rgk n GLY 306 N 1.19 1.30 3.71 0.62 0.00 -0.58 -5.02 105.19 106.41 2rgk n GLY 306 Ca 0.06 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.66 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 -0.49 4.38 0.54 1.61 2.20 -1.26 -4.65 119.74 122.08 2rgk s LYS 307 Ca 0.00 1.83 -0.21 0.00 -0.36 0.00 0.00 55.97 57.22 2rgk s LYS 307 Cb 0.00 -3.40 -0.06 0.00 -1.51 0.00 0.00 37.83 32.86 2rgk s LYS 307 CO 0.00 -0.36 1.20 -2.30 -0.36 0.00 0.00 175.35 173.53 2rgk n PRO 308 N 4.35 1.41 0.00 4.03 -0.02 -1.26 -0.14 135.00 143.37 2rgk n PRO 308 Ca 0.10 0.52 0.00 0.00 -2.02 0.00 0.00 63.50 62.10 2rgk n PRO 308 Cb 0.45 -2.38 0.00 0.00 -0.02 0.00 0.00 33.50 31.55 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 -1.16 0.00 -3.00 -1.45 0.31 -0.45 -4.77 118.33 107.81 2rgk n VAL 309 Ca 0.11 0.00 -0.43 0.00 -0.01 0.00 0.00 64.34 64.01 2rgk n VAL 309 Cb 0.45 -0.77 -0.05 0.00 -0.91 0.00 0.00 33.84 32.55 2rgk n VAL 309 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 2rgk s VAL 310 N -0.76 4.64 -2.27 2.52 1.01 -1.22 -4.90 120.40 119.42 2rgk s VAL 310 Ca 0.00 -0.08 0.20 0.00 0.00 0.00 0.00 61.98 62.10 2rgk s VAL 310 Cb 0.00 -4.41 0.45 0.00 0.00 0.00 0.00 36.38 32.42 2rgk s VAL 310 CO 0.00 -0.93 1.52 0.54 0.00 0.00 0.00 175.10 176.23 2rgk n ARG 311 N 6.78 1.76 -2.17 2.72 1.74 -1.26 -1.13 116.66 125.10 2rgk n ARG 311 Ca -0.02 -1.15 -0.40 0.00 -0.77 0.00 0.00 57.85 55.51 2rgk n ARG 311 Cb 0.47 -1.39 -0.02 0.00 -1.02 0.00 0.00 32.46 30.49 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 -1.76 4.19 -0.61 5.56 8.01 -1.26 -3.84 118.70 128.99 2rgk s GLU 312 Ca 0.32 2.07 -0.21 0.00 0.01 0.00 0.00 54.97 57.16 2rgk s GLU 312 Cb 0.17 -2.89 0.08 0.00 -4.31 0.00 0.00 34.13 27.18 2rgk s GLU 312 CO 0.26 -0.27 0.84 1.03 0.01 0.00 0.00 175.26 177.13 2rgk s ARG 313 N -2.01 3.11 0.31 1.61 3.00 0.11 -3.00 118.95 122.07 2rgk s ARG 313 Ca 0.53 -0.96 -0.16 0.00 0.00 0.00 0.00 55.73 55.13 2rgk s ARG 313 Cb -0.36 -4.21 -0.09 0.00 0.00 0.00 0.00 34.95 30.28 2rgk s ARG 313 CO 0.47 -1.63 0.75 0.08 0.00 0.00 0.00 175.30 174.97 2rgk s VAL 314 N 3.44 4.63 0.09 3.52 1.01 -1.26 -0.27 120.40 131.55 2rgk s VAL 314 Ca 0.18 1.06 -0.22 0.00 0.00 0.00 0.00 61.98 63.01 2rgk s VAL 314 Cb -0.19 -3.66 -0.12 0.00 0.00 0.00 0.00 36.38 32.40 2rgk s VAL 314 CO 0.10 -0.11 1.67 -0.09 0.00 0.00 0.00 175.10 176.67 2rgk h ARG 315 N 2.47 0.12 -0.19 2.72 2.43 -1.04 -3.33 114.38 117.57 2rgk h ARG 315 Ca -0.48 -0.02 -0.04 0.00 -0.81 0.00 0.00 59.98 58.64 2rgk h ARG 315 Cb 1.18 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 30.69 2rgk h ARG 315 CO 0.65 0.17 -0.04 0.11 -1.51 0.00 0.00 179.97 179.35 2rgk h TRP 316 N 0.04 0.28 -0.10 2.20 5.08 -1.94 -2.84 115.95 118.68 2rgk h TRP 316 Ca 0.03 -0.02 0.02 0.00 1.08 0.00 0.00 58.89 60.00 2rgk h TRP 316 Cb 0.08 -0.08 -0.02 0.00 -3.00 0.00 0.00 29.16 26.14 2rgk h TRP 316 CO -0.04 0.33 -0.02 -1.35 -1.28 0.00 0.00 178.44 176.08 2rgk h PRO 317 N 0.27 0.01 -0.11 0.12 0.11 -1.91 0.26 132.00 130.74 2rgk h PRO 317 Ca 0.06 -0.00 -0.11 0.00 0.11 0.00 0.00 66.00 66.06 2rgk h PRO 317 Cb 0.26 -0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.35 2rgk h PRO 317 CO 0.01 0.01 -0.41 0.97 -0.21 0.00 0.00 178.00 178.37 2rgk h ILE 318 N 0.01 1.31 -0.37 4.15 2.10 -1.75 0.60 117.51 123.55 2rgk h ILE 318 Ca 0.05 -1.51 -0.02 0.00 1.08 0.00 0.00 64.86 64.46 2rgk h ILE 318 Cb 0.06 1.67 -0.02 0.00 -1.09 0.00 0.00 36.82 37.45 2rgk h ILE 318 CO -0.09 0.45 0.17 0.58 -1.08 0.00 0.00 178.15 178.18 2rgk h VAL 319 N 0.21 1.17 -0.54 2.19 2.07 -1.18 -2.19 116.25 117.98 2rgk h VAL 319 Ca 0.02 -0.51 -0.09 0.00 0.82 0.00 0.00 66.70 66.94 2rgk h VAL 319 Cb 0.81 0.82 -0.02 0.00 -1.52 0.00 0.00 31.29 31.38 2rgk h VAL 319 CO 0.06 0.19 -0.01 -0.33 0.02 0.00 0.00 177.57 177.50 2rgk h GLU 320 N 0.46 0.95 -0.93 1.57 4.39 -0.17 -2.85 114.58 118.01 2rgk h GLU 320 Ca 0.13 -0.31 0.17 0.00 0.34 0.00 0.00 59.36 59.69 2rgk h GLU 320 Cb 0.14 -0.08 -0.10 0.00 -0.10 0.00 0.00 28.75 28.60 2rgk h GLU 320 CO -0.01 0.97 0.52 0.00 -1.16 0.00 0.00 179.01 179.32 2rgk h ALA 321 N 0.95 1.47 -0.32 3.43 0.00 -0.55 -0.24 119.26 124.01 2rgk h ALA 321 Ca 0.15 0.09 -0.07 0.00 0.00 0.00 0.00 54.91 55.08 2rgk h ALA 321 Cb 0.54 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.27 2rgk h ALA 321 CO 0.03 -0.07 -0.10 0.52 0.00 0.00 0.00 179.25 179.63 2rgk h MET 322 N 0.69 0.53 -0.30 0.00 2.86 -1.17 -0.39 114.93 117.15 2rgk h MET 322 Ca 0.52 -0.15 -0.13 0.00 -2.06 0.00 0.00 59.70 57.88 2rgk h MET 322 Cb 0.78 -0.06 -0.00 0.00 0.06 0.00 0.00 31.60 32.38 2rgk h MET 322 CO -0.38 0.63 -0.33 0.78 1.06 0.00 0.00 176.91 178.67 2rgk h GLY 323 N 0.91 0.82 0.99 8.32 0.00 -1.02 -2.37 103.07 110.72 2rgk h GLY 323 Ca 0.09 -0.85 -0.06 0.00 0.00 0.00 0.00 47.33 46.51 2rgk h GLY 323 CO 0.03 0.77 0.08 -0.84 0.00 0.00 0.00 176.54 176.57 2rgk h THR 324 N 0.50 1.25 -0.83 4.70 2.02 -1.11 -0.27 112.91 119.17 2rgk h THR 324 Ca 0.04 -0.95 0.08 0.00 0.77 0.00 0.00 66.41 66.35 2rgk h THR 324 Cb 0.91 0.88 -0.07 0.00 -1.74 0.00 0.00 68.15 68.13 2rgk h THR 324 CO 0.08 0.34 0.50 0.00 0.37 0.00 0.00 175.52 176.81 2rgk h ALA 325 N 0.97 1.17 -0.57 6.16 0.00 -1.02 0.21 119.26 126.18 2rgk h ALA 325 Ca 0.15 0.01 -0.09 0.00 0.00 0.00 0.00 54.91 54.99 2rgk h ALA 325 Cb 0.41 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 2rgk h ALA 325 CO 0.01 0.18 0.01 -0.92 0.00 0.00 0.00 179.25 178.53 2rgk h TYR 326 N 0.87 1.05 -0.30 0.00 3.20 -0.89 -0.91 116.97 119.98 2rgk h TYR 326 Ca 0.38 -0.16 -0.04 0.00 3.14 0.00 0.00 58.73 62.05 2rgk h TYR 326 Cb 0.27 -0.28 -0.01 0.00 1.54 0.00 0.00 36.73 38.25 2rgk h TYR 326 CO -0.05 0.93 0.02 0.00 -1.64 0.00 0.00 178.16 177.42 2rgk h ALA 327 N 1.11 0.40 -0.51 1.82 0.00 0.40 -0.26 119.26 122.22 2rgk h ALA 327 Ca 0.17 -0.22 -0.07 0.00 0.00 0.00 0.00 54.91 54.79 2rgk h ALA 327 Cb 0.51 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 2rgk h ALA 327 CO 0.02 0.12 0.03 -0.07 0.00 0.00 0.00 179.25 179.36 2rgk h LEU 328 N 0.32 0.80 -0.37 0.00 3.38 -0.54 -2.32 115.31 116.58 2rgk h LEU 328 Ca 0.09 -0.19 -0.08 0.00 0.09 0.00 0.00 57.88 57.80 2rgk h LEU 328 Cb 0.40 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.92 2rgk h LEU 328 CO 0.01 0.85 -0.07 0.22 0.09 0.00 0.00 178.44 179.54 2rgk h TYR 329 N 0.79 0.77 -0.95 1.13 3.20 -1.04 0.57 116.97 121.44 2rgk h TYR 329 Ca 0.16 -0.16 0.11 0.00 3.14 0.00 0.00 58.73 61.98 2rgk h TYR 329 Cb 0.43 -0.19 -0.07 0.00 1.54 0.00 0.00 36.73 38.43 2rgk h TYR 329 CO 0.02 0.83 0.61 1.15 -1.64 0.00 0.00 178.16 179.13 2rgk h THR 330 N 0.49 0.94 0.00 1.81 2.02 -0.57 0.82 112.91 118.42 2rgk h THR 330 Ca 0.09 -0.32 -0.31 0.00 0.77 0.00 0.00 66.41 66.64 2rgk h THR 330 Cb 0.57 -0.07 -0.06 0.00 -1.74 0.00 0.00 68.15 66.85 2rgk h THR 330 CO 0.03 0.17 -1.96 0.55 0.37 0.00 0.00 175.52 174.68 2rgk n VAL 331 N -4.57 1.49 -0.04 3.16 3.14 -0.91 -4.51 118.33 116.08 2rgk n VAL 331 Ca 0.17 -0.81 -0.07 0.00 -2.96 0.00 0.00 64.34 60.67 2rgk n VAL 331 Cb 0.34 -0.79 -0.14 0.00 -1.06 0.00 0.00 33.84 32.19 2rgk n VAL 331 CO 0.00 0.00 0.00 0.35 -6.46 0.00 0.00 176.83 170.72 2rgk n THR 332 N -2.92 1.38 -0.93 1.55 -2.24 0.18 -4.97 114.28 106.34 2rgk n THR 332 Ca -0.23 -0.79 0.00 0.00 -2.27 0.00 0.00 64.05 60.76 2rgk n THR 332 Cb 1.08 -0.71 0.00 0.00 -2.10 0.00 0.00 70.33 68.60 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 1.60 0.60 3.60 3.38 0.00 0.28 -4.95 105.19 109.70 2rgk n GLY 333 Ca -0.22 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.37 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 -2.43 6.38 0.59 1.61 -1.08 -1.26 -4.91 116.67 115.56 2rgk s ASP 334 Ca 0.00 0.87 0.29 0.00 -0.52 0.00 0.00 52.55 53.19 2rgk s ASP 334 Cb 0.00 -2.54 1.53 0.00 -1.46 0.00 0.00 42.92 40.45 2rgk s ASP 334 CO 0.00 -1.39 1.97 0.03 0.52 0.00 0.00 175.17 176.30 2rgk h ARG 335 N 10.53 0.00 -0.43 4.34 2.47 -1.94 -1.90 114.38 127.44 2rgk h ARG 335 Ca -0.27 0.00 0.06 0.00 -1.26 0.00 0.00 59.98 58.51 2rgk h ARG 335 Cb 1.10 0.00 -0.02 0.00 -1.65 0.00 0.00 29.97 29.40 2rgk h ARG 335 CO 1.08 0.00 0.29 1.96 0.56 0.00 0.00 179.97 183.86 2rgk h GLN 336 N 0.00 0.32 -0.26 0.04 4.20 -1.99 0.18 115.11 117.60 2rgk h GLN 336 Ca 0.17 -0.02 -0.07 0.00 0.06 0.00 0.00 58.65 58.79 2rgk h GLN 336 Cb 0.93 -0.07 -0.02 0.00 0.30 0.00 0.00 27.48 28.63 2rgk h GLN 336 CO -0.00 0.21 -0.13 1.88 -0.67 0.00 0.00 178.83 180.12 2rgk h TYR 337 N 0.33 0.48 -0.27 2.96 0.99 -1.66 -1.14 116.97 118.66 2rgk h TYR 337 Ca 0.19 -0.07 -0.18 0.00 2.00 0.00 0.00 58.73 60.67 2rgk h TYR 337 Cb 0.33 -0.13 -0.00 0.00 1.00 0.00 0.00 36.73 37.93 2rgk h TYR 337 CO -0.00 0.57 -0.53 1.49 -0.00 0.00 0.00 178.16 179.69 2rgk h GLU 338 N 0.41 0.81 -0.60 4.88 4.81 -0.87 -2.00 114.58 122.02 2rgk h GLU 338 Ca 0.08 -0.51 0.04 0.00 -0.13 0.00 0.00 59.36 58.84 2rgk h GLU 338 Cb 0.49 0.06 -0.04 0.00 0.63 0.00 0.00 28.75 29.88 2rgk h GLU 338 CO 0.03 1.14 0.35 1.15 -0.73 0.00 0.00 179.01 180.95 2rgk h THR 339 N 0.63 1.04 -0.72 0.32 2.02 -0.24 0.06 112.91 116.01 2rgk h THR 339 Ca 0.02 -0.24 -0.05 0.00 0.77 0.00 0.00 66.41 66.91 2rgk h THR 339 Cb 1.13 0.29 -0.03 0.00 -1.74 0.00 0.00 68.15 67.79 2rgk h THR 339 CO 0.12 0.13 0.26 -0.50 0.37 0.00 0.00 175.52 175.89 2rgk h TRP 340 N 0.69 1.12 -0.58 3.16 4.06 -1.17 -1.65 115.95 121.57 2rgk h TRP 340 Ca 0.25 -0.10 0.09 0.00 2.06 0.00 0.00 58.89 61.19 2rgk h TRP 340 Cb 0.07 -0.33 -0.07 0.00 -1.00 0.00 0.00 29.16 27.83 2rgk h TRP 340 CO -0.07 0.88 0.21 -0.92 -3.56 0.00 0.00 178.44 174.98 2rgk h TYR 341 N 1.05 0.37 -0.35 0.49 3.20 -0.46 -1.17 116.97 120.09 2rgk h TYR 341 Ca 0.24 0.03 -0.12 0.00 3.14 0.00 0.00 58.73 62.02 2rgk h TYR 341 Cb 0.25 -0.08 -0.01 0.00 1.54 0.00 0.00 36.73 38.44 2rgk h TYR 341 CO 0.02 0.10 -0.24 1.96 -1.64 0.00 0.00 178.16 178.36 2rgk h GLN 342 N 0.39 0.78 0.00 1.82 4.20 -0.56 -1.66 115.11 120.08 2rgk h GLN 342 Ca 0.29 -0.37 -0.06 0.00 0.06 0.00 0.00 58.65 58.57 2rgk h GLN 342 Cb 0.35 -0.01 -0.01 0.00 0.30 0.00 0.00 27.48 28.11 2rgk h GLN 342 CO -0.29 1.00 -0.30 0.00 -0.67 0.00 0.00 178.83 178.56 2rgk h THR 343 N 0.57 0.92 0.03 -0.54 1.03 -1.01 -0.51 112.91 113.40 2rgk h THR 343 Ca 0.07 -1.16 -0.23 0.00 -0.01 0.00 0.00 66.41 65.08 2rgk h THR 343 Cb 0.80 1.69 -0.00 0.00 -1.07 0.00 0.00 68.15 69.56 2rgk h THR 343 CO 0.06 0.30 -0.99 -0.50 -0.01 0.00 0.00 175.52 174.38 2rgk h TRP 344 N 0.00 0.45 -0.37 0.00 6.55 -1.04 -2.31 115.95 119.23 2rgk h TRP 344 Ca -0.00 -0.27 -0.09 0.00 0.95 0.00 0.00 58.89 59.48 2rgk h TRP 344 Cb 0.66 -0.04 -0.01 0.00 -0.86 0.00 0.00 29.16 28.91 2rgk h TRP 344 CO 0.00 1.11 -0.11 -1.49 -1.05 0.00 0.00 178.44 176.90 2rgk h TRP 345 N 0.14 0.83 -0.86 0.49 -0.00 -0.88 0.62 115.95 116.28 2rgk h TRP 345 Ca -0.08 -0.19 0.09 0.00 -0.00 0.00 0.00 58.89 58.72 2rgk h TRP 345 Cb 1.65 -0.20 -0.07 0.00 -0.00 0.00 0.00 29.16 30.54 2rgk h TRP 345 CO 0.05 0.89 0.51 0.93 -0.00 0.00 0.00 178.44 180.82 2rgk h GLU 346 N 0.53 0.84 -0.07 0.49 4.39 -1.07 -1.46 114.58 118.23 2rgk h GLU 346 Ca 0.09 -0.05 -0.02 0.00 0.34 0.00 0.00 59.36 59.73 2rgk h GLU 346 Cb 0.63 -0.19 -0.00 0.00 -0.10 0.00 0.00 28.75 29.09 2rgk h GLU 346 CO 0.04 0.56 -0.02 -0.92 -1.16 0.00 0.00 179.01 177.51 2rgk h TYR 347 N 0.87 0.16 -0.15 4.33 3.20 -1.09 -2.99 116.97 121.29 2rgk h TYR 347 Ca 0.41 -0.03 0.04 0.00 3.14 0.00 0.00 58.73 62.29 2rgk h TYR 347 Cb 0.34 -0.04 -0.04 0.00 1.54 0.00 0.00 36.73 38.53 2rgk h TYR 347 CO -0.05 0.46 -0.09 0.00 -1.64 0.00 0.00 178.16 176.84 2rgk h ILE 349 N -0.09 0.27 0.18 0.00 2.10 -1.39 0.37 117.51 118.95 2rgk h ILE 349 Ca 0.09 -0.58 -0.33 0.00 1.08 0.00 0.00 64.86 65.13 2rgk h ILE 349 Cb 0.23 1.45 0.01 0.00 -1.09 0.00 0.00 36.82 37.42 2rgk h ILE 349 CO -0.21 0.08 -1.54 0.50 -1.08 0.00 0.00 178.15 175.90 2rgk h LYS 350 N 0.00 0.39 0.00 2.19 3.64 -1.17 -3.41 116.57 118.21 2rgk h LYS 350 Ca -0.00 -0.67 -0.00 0.00 -1.27 0.00 0.00 60.65 58.71 2rgk h LYS 350 Cb 0.44 0.25 -0.00 0.00 -0.41 0.00 0.00 32.23 32.51 2rgk h LYS 350 CO 0.01 1.30 -1.02 0.66 -2.27 0.00 0.00 179.45 178.12 2rgk n TYR 351 N -3.59 0.00 -0.13 1.91 4.02 -0.06 -4.92 117.16 114.40 2rgk n TYR 351 Ca -0.18 0.00 -0.25 0.00 -0.01 0.00 0.00 57.90 57.46 2rgk n TYR 351 Cb 1.07 -0.01 -0.10 0.00 -0.02 0.00 0.00 39.34 40.28 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 -1.62 2.07 -4.71 7.72 4.77 0.12 -4.83 117.00 120.50 2rgk n LEU 352 Ca -0.00 0.21 -0.43 0.00 -0.03 0.00 0.00 56.01 55.75 2rgk n LEU 352 Cb 0.12 -0.76 -0.02 0.00 -2.33 0.00 0.00 43.42 40.42 2rgk n LEU 352 CO 0.01 0.62 1.18 0.23 -1.33 0.00 0.00 177.39 178.10 2rgk n MET 353 N -3.91 2.46 -3.92 3.23 2.81 -0.36 0.02 117.12 117.46 2rgk n MET 353 Ca -0.48 0.88 -0.30 0.00 -1.81 0.00 0.00 57.70 55.99 2rgk n MET 353 Cb 0.88 -2.63 -0.14 0.00 -0.71 0.00 0.00 33.22 30.62 2rgk n MET 353 CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 2rgk s ASP 354 N 0.55 4.27 0.23 7.83 -1.08 0.80 -4.81 116.67 124.46 2rgk s ASP 354 Ca 0.68 -2.78 0.08 0.00 -0.52 0.00 0.00 52.55 50.01 2rgk s ASP 354 Cb -0.56 -1.52 0.19 0.00 -1.46 0.00 0.00 42.92 39.58 2rgk s ASP 354 CO 0.46 -0.27 1.52 1.88 0.52 0.00 0.00 175.17 179.28 2rgk h TYR 355 N 6.76 0.09 -0.00 -5.34 -1.99 -1.87 0.15 116.97 114.78 2rgk h TYR 355 Ca -0.06 -0.04 -0.00 0.00 2.00 0.00 0.00 58.73 60.62 2rgk h TYR 355 Cb 0.92 -0.01 0.00 0.00 2.00 0.00 0.00 36.73 39.64 2rgk h TYR 355 CO 0.50 0.76 -0.00 1.49 -0.00 0.00 0.00 178.16 180.91 2rgk h GLU 356 N 0.04 0.00 -0.01 4.88 4.81 -1.94 -3.35 114.58 119.01 2rgk h GLU 356 Ca -0.01 -0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.22 2rgk h GLU 356 Cb 1.26 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.64 2rgk h GLU 356 CO 0.10 0.56 -0.45 0.09 -0.73 0.00 0.00 179.01 178.58 2rgk n ASN 357 N -4.82 1.91 0.00 1.04 3.02 -1.25 -5.08 115.26 110.08 2rgk n ASN 357 Ca -0.09 -1.46 0.00 0.00 -0.03 0.00 0.00 54.58 53.01 2rgk n ASN 357 Cb 0.28 0.49 0.00 0.00 -0.61 0.00 0.00 39.78 39.94 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 1.35 2.38 7.00 7.41 0.00 0.04 -4.39 105.19 118.98 2rgk n GLY 358 Ca 0.08 -1.76 0.00 0.00 0.00 0.00 0.00 46.02 44.35 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 -4.26 1.61 2.88 -1.21 -4.52 113.62 108.12 2rgk n SER 359 Ca 0.00 0.00 -0.19 0.00 -1.33 0.00 0.00 58.87 57.35 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 1.51 0.67 0.66 0.52 -1.26 -0.14 118.94 120.90 2rgk s TRP 360 Ca 0.00 -0.52 -0.15 0.00 0.02 0.00 0.00 56.10 55.45 2rgk s TRP 360 Cb 0.00 -0.79 0.00 0.00 -1.15 0.00 0.00 33.47 31.53 2rgk s TRP 360 CO 0.00 0.18 1.14 -1.58 0.02 0.00 0.00 176.95 176.71 2rgk s TRP 361 N -1.95 2.47 -0.07 -1.98 0.52 0.10 -4.84 118.94 113.19 2rgk s TRP 361 Ca 0.09 1.56 -0.05 0.00 0.02 0.00 0.00 56.10 57.72 2rgk s TRP 361 Cb -0.06 -3.27 -0.28 0.00 -1.15 0.00 0.00 33.47 28.72 2rgk s TRP 361 CO 0.04 -1.93 0.59 0.37 0.02 0.00 0.00 176.95 176.03 2rgk h GLN 362 N 0.07 0.28 -2.64 4.98 5.75 -1.90 -3.42 115.11 118.22 2rgk h GLN 362 Ca -0.47 -0.48 -0.11 0.00 -0.15 0.00 0.00 58.65 57.44 2rgk h GLN 362 Cb 1.26 0.18 -0.23 0.00 1.07 0.00 0.00 27.48 29.76 2rgk h GLN 362 CO 0.53 1.16 -0.17 -2.00 -2.65 0.00 0.00 178.83 175.70 2rgk s GLU 363 N -2.58 0.58 0.26 1.69 2.12 -1.26 -0.48 118.70 119.02 2rgk s GLU 363 Ca -0.16 0.52 0.09 0.00 0.36 0.00 0.00 54.97 55.78 2rgk s GLU 363 Cb 0.06 0.28 -0.05 0.00 0.26 0.00 0.00 34.13 34.68 2rgk s GLU 363 CO 0.82 -0.09 -0.14 -0.51 -0.54 0.00 0.00 175.26 174.80 2rgk s LEU 364 N -0.00 2.57 0.00 2.70 1.43 0.63 -2.02 118.68 123.99 2rgk s LEU 364 Ca -0.02 -1.08 -0.03 0.00 -1.03 0.00 0.00 54.13 51.98 2rgk s LEU 364 Cb -0.03 -0.82 0.04 0.00 0.03 0.00 0.00 46.19 45.40 2rgk s LEU 364 CO 0.01 -0.15 0.25 -0.90 0.23 0.00 0.00 176.35 175.79 2rgk n ASP 365 N -0.53 0.06 0.29 2.29 5.68 -0.39 0.04 116.55 123.98 2rgk n ASP 365 Ca -0.06 -1.11 0.19 0.00 -0.50 0.00 0.00 54.79 53.30 2rgk n ASP 365 Cb 0.61 -0.18 0.96 0.00 -1.14 0.00 0.00 41.12 41.37 2rgk n ASP 365 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2rgk h ALA 366 N -1.70 1.00 -0.52 2.12 0.00 -1.91 -1.31 119.26 116.93 2rgk h ALA 366 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.83 2rgk h ALA 366 Cb 0.23 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.02 2rgk h ALA 366 CO 0.06 0.00 0.00 -0.25 0.00 0.00 0.00 179.25 179.06 2rgk n ASP 367 N -2.90 4.95 -2.58 0.00 8.00 -1.26 -4.78 116.55 117.98 2rgk n ASP 367 Ca -0.02 -2.76 -0.21 0.00 0.71 0.00 0.00 54.79 52.51 2rgk n ASP 367 Cb 0.13 -0.60 0.01 0.00 -0.02 0.00 0.00 41.12 40.63 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 0.54 -5.94 -4.88 -2.24 3.02 -0.49 -5.01 115.26 100.27 2rgk n ASN 368 Ca 0.25 -0.12 -0.34 0.00 -0.03 0.00 0.00 54.58 54.34 2rgk n ASN 368 Cb 1.01 -4.87 -0.05 0.00 -0.61 0.00 0.00 39.78 35.25 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 -5.28 3.38 0.34 3.52 1.02 -1.26 -4.82 119.74 116.64 2rgk s LYS 369 Ca 0.12 -0.30 -0.29 0.00 0.02 0.00 0.00 55.97 55.52 2rgk s LYS 369 Cb -0.05 -3.08 -0.12 0.00 -0.52 0.00 0.00 37.83 34.06 2rgk s LYS 369 CO 0.14 0.70 1.46 0.28 -0.92 0.00 0.00 175.35 177.01 2rgk n VAL 370 N 1.27 1.75 -4.38 3.17 0.31 -1.26 -1.26 118.33 117.92 2rgk n VAL 370 Ca -0.14 -0.44 -0.25 0.00 -0.01 0.00 0.00 64.34 63.51 2rgk n VAL 370 Cb 0.53 -1.84 -0.12 0.00 -0.91 0.00 0.00 33.84 31.50 2rgk n VAL 370 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 2rgk s THR 371 N -0.83 2.13 -0.01 2.52 2.01 -0.86 -4.83 115.64 115.77 2rgk s THR 371 Ca 0.57 -1.97 -0.00 0.00 0.31 0.00 0.00 61.69 60.59 2rgk s THR 371 Cb -0.51 -2.00 0.01 0.00 0.01 0.00 0.00 72.50 70.02 2rgk s THR 371 CO 0.60 -0.19 0.02 0.42 -0.69 0.00 0.00 174.62 174.78 2rgk s THR 372 N -1.79 -0.03 0.00 -0.82 -4.23 -1.26 -4.72 115.64 102.79 2rgk s THR 372 Ca 0.18 0.10 0.00 0.00 -1.18 0.00 0.00 61.69 60.79 2rgk s THR 372 Cb -0.07 -0.05 0.00 0.00 1.34 0.00 0.00 72.50 73.72 2rgk s THR 372 CO 0.08 0.04 0.00 0.61 -0.54 0.00 0.00 174.62 174.82 2rgk n GLY 377 N 3.59 1.25 2.53 3.99 0.00 -1.26 -5.19 105.19 110.10 2rgk n GLY 377 Ca -0.19 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.71 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 1.16 0.00 1.61 5.02 -0.29 -4.22 118.16 121.43 2rgk n LYS 378 Ca 0.00 -3.32 0.04 0.00 -2.02 0.00 0.00 58.31 53.01 2rgk n LYS 378 Cb 0.00 -1.40 0.25 0.00 -0.02 0.00 0.00 35.03 33.87 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 0.02 0.53 -3.90 1.97 0.00 -1.04 -4.54 117.38 110.41 2rgk n GLN 379 Ca 0.14 0.00 -0.11 0.00 0.00 0.00 0.00 57.00 57.03 2rgk n GLN 379 Cb 0.77 -1.25 -0.13 0.00 0.00 0.00 0.00 30.24 29.63 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 -1.74 0.06 0.00 2.61 2.15 -1.26 -4.69 116.67 113.80 2rgk s ASP 380 Ca 0.13 -0.13 0.00 0.00 0.43 0.00 0.00 52.55 52.98 2rgk s ASP 380 Cb 0.06 0.03 0.00 0.00 -0.30 0.00 0.00 42.92 42.71 2rgk s ASP 380 CO 0.10 -0.08 0.07 2.30 -0.17 0.00 0.00 175.17 177.39 2rgk n ILE 381 N 2.70 0.00 -0.01 4.11 -5.35 -1.26 -4.87 119.36 114.68 2rgk n ILE 381 Ca -0.15 -0.19 -0.09 0.00 -0.27 0.00 0.00 62.75 62.05 2rgk n ILE 381 Cb 0.59 1.23 -0.03 0.00 -1.74 0.00 0.00 39.64 39.69 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 -0.35 -0.88 4.28 3.20 -1.93 -2.60 116.97 118.68 2rgk h TYR 382 Ca 0.00 0.02 0.05 0.00 3.14 0.00 0.00 58.73 61.95 2rgk h TYR 382 Cb 0.12 0.18 -0.06 0.00 1.54 0.00 0.00 36.73 38.50 2rgk h TYR 382 CO 0.00 -0.21 0.56 0.45 -1.64 0.00 0.00 178.16 177.32 2rgk h HIS 383 N -0.16 1.03 -1.07 -3.82 3.86 -1.99 -2.88 115.15 110.12 2rgk h HIS 383 Ca 0.10 0.03 0.29 0.00 -1.16 0.00 0.00 60.37 59.63 2rgk h HIS 383 Cb 0.30 -0.34 -0.10 0.00 1.06 0.00 0.00 27.41 28.33 2rgk h HIS 383 CO -0.27 0.55 0.68 -0.07 0.86 0.00 0.00 177.93 179.68 2rgk h LEU 384 N 1.03 0.44 -2.05 2.43 3.38 -1.82 0.21 115.31 118.93 2rgk h LEU 384 Ca 0.37 0.10 0.00 0.00 0.09 0.00 0.00 57.88 58.45 2rgk h LEU 384 Cb 0.12 0.04 0.00 0.00 0.09 0.00 0.00 40.66 40.91 2rgk h LEU 384 CO -0.16 0.04 0.00 -0.07 0.09 0.00 0.00 178.44 178.34 2rgk h LEU 385 N 0.36 0.00 -0.89 1.67 3.38 -1.57 -1.74 115.31 116.53 2rgk h LEU 385 Ca 0.64 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.60 2rgk h LEU 385 Cb 1.64 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.39 2rgk h LEU 385 CO -0.35 0.00 -0.04 0.45 0.09 0.00 0.00 178.44 178.59 2rgk h HIS 386 N 0.00 0.00 -0.06 1.13 3.86 -0.76 0.12 115.15 119.43 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 0.17 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.64 2rgk h HIS 386 CO 0.00 0.04 0.00 0.00 0.86 0.00 0.00 177.93 178.83 2rgk n LEU 388 N 0.37 2.66 -0.12 0.00 4.77 -0.83 -4.76 117.00 119.07 2rgk n LEU 388 Ca 0.05 -0.02 -0.21 0.00 -0.03 0.00 0.00 56.01 55.81 2rgk n LEU 388 Cb 0.22 -0.18 -0.11 0.00 -2.33 0.00 0.00 43.42 41.03 2rgk n LEU 388 CO 0.05 0.53 -1.33 0.52 -1.33 0.00 0.00 177.39 175.82 2rgk n VAL 389 N -2.73 1.41 -0.18 4.08 0.31 0.34 -4.61 118.33 116.95 2rgk n VAL 389 Ca -0.09 -0.47 -0.04 0.00 -0.01 0.00 0.00 64.34 63.72 2rgk n VAL 389 Cb 0.60 -1.54 0.03 0.00 -0.91 0.00 0.00 33.84 32.02 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 -0.33 0.29 0.00 2.52 1.08 -1.56 0.23 117.51 119.74 2rgk h ILE 390 Ca -0.59 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 63.88 2rgk h ILE 390 Cb 1.75 0.29 0.00 0.00 -3.07 0.00 0.00 36.82 35.79 2rgk h ILE 390 CO -0.20 0.00 0.00 -0.81 -0.69 0.00 0.00 178.15 176.45 2rgk n PRO 391 N -5.42 0.39 0.00 2.37 -0.04 -1.26 -2.14 135.00 128.89 2rgk n PRO 391 Ca 0.05 0.00 0.04 0.00 -0.04 0.00 0.00 63.50 63.55 2rgk n PRO 391 Cb 0.33 -1.11 0.03 0.00 -0.04 0.00 0.00 33.50 32.72 2rgk n PRO 391 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2rgk n ARG 392 N -0.61 0.54 -4.20 0.54 1.74 0.07 -4.58 116.66 110.15 2rgk n ARG 392 Ca 0.02 -0.95 -0.12 0.00 -0.77 0.00 0.00 57.85 56.04 2rgk n ARG 392 Cb 0.01 -1.15 -0.10 0.00 -1.02 0.00 0.00 32.46 30.20 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 -0.81 0.53 0.96 0.55 -4.36 -0.91 0.20 121.20 117.36 2rgk s ILE 393 Ca 0.10 -1.95 -0.12 0.00 -0.26 0.00 0.00 60.65 58.41 2rgk s ILE 393 Cb 0.07 -2.01 0.17 0.00 1.25 0.00 0.00 42.46 41.94 2rgk s ILE 393 CO 0.13 -0.55 1.11 -2.16 0.24 0.00 0.00 174.94 173.70 2rgk s PRO 394 N -3.93 0.70 0.02 0.37 0.04 -1.26 -4.93 135.00 126.01 2rgk s PRO 394 Ca 0.21 0.39 0.26 0.00 0.04 0.00 0.00 61.00 61.91 2rgk s PRO 394 Cb 0.06 -1.78 1.08 0.00 0.04 0.00 0.00 34.50 33.90 2rgk s PRO 394 CO 0.02 -2.52 1.82 1.28 0.04 0.00 0.00 177.00 177.64 2rgk n LEU 395 N -4.01 0.08 -3.79 -3.56 4.77 -1.26 -4.73 117.00 104.51 2rgk n LEU 395 Ca 0.06 0.51 -0.13 0.00 -0.03 0.00 0.00 56.01 56.42 2rgk n LEU 395 Cb 0.58 -0.49 -0.14 0.00 -2.33 0.00 0.00 43.42 41.05 2rgk n LEU 395 CO 0.57 -0.08 -0.25 0.00 -1.33 0.00 0.00 177.39 176.31 2rgk s ALA 396 N -3.02 -0.23 1.00 -1.18 0.00 -1.26 -4.40 121.76 112.67 2rgk s ALA 396 Ca 0.12 0.47 0.00 0.00 0.00 0.00 0.00 51.96 52.55 2rgk s ALA 396 Cb 0.16 -0.31 0.00 0.00 0.00 0.00 0.00 23.12 22.98 2rgk s ALA 396 CO 0.48 -0.10 0.00 -0.35 0.00 0.00 0.00 175.76 175.79 2rgk n PRO 397 N 3.67 -0.03 -0.71 0.00 -0.04 -1.26 -5.01 135.00 131.61 2rgk n PRO 397 Ca -0.20 0.00 -0.28 0.00 -0.04 0.00 0.00 63.50 62.97 2rgk n PRO 397 Cb 0.55 0.00 0.24 0.00 -0.04 0.00 0.00 33.50 34.25 2rgk n PRO 397 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 2rgk s GLY 398 N -2.10 1.54 0.00 0.55 0.00 -1.26 -4.50 107.32 101.55 2rgk s GLY 398 Ca 0.00 -0.29 0.00 0.00 0.00 0.00 0.00 44.72 44.43 2rgk s GLY 398 CO 0.00 0.44 0.93 -0.13 0.00 0.00 0.00 173.10 174.34 2rgk n MET 399 N -4.80 0.00 -0.07 2.90 1.56 -1.26 0.81 117.12 116.26 2rgk n MET 399 Ca 0.04 0.76 -0.08 0.00 -0.27 0.00 0.00 57.70 58.15 2rgk n MET 399 Cb 0.56 -1.43 -0.01 0.00 2.15 0.00 0.00 33.22 34.48 2rgk n MET 399 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24 2rgk h ALA 400 N -1.43 -0.09 -0.61 -5.12 0.00 -1.95 0.59 119.26 110.65 2rgk h ALA 400 Ca 0.00 0.09 0.05 0.00 0.00 0.00 0.00 54.91 55.05 2rgk h ALA 400 Cb 0.00 0.51 -0.04 0.00 0.00 0.00 0.00 17.79 18.27 2rgk h ALA 400 CO 0.00 -0.65 0.40 -1.35 0.00 0.00 0.00 179.25 177.65 2rgk h PRO 401 N -0.23 0.61 -0.15 0.00 0.11 -1.88 0.57 132.00 131.04 2rgk h PRO 401 Ca 0.15 -0.04 -0.04 0.00 0.11 0.00 0.00 66.00 66.19 2rgk h PRO 401 Cb 0.46 -0.14 -0.00 0.00 0.11 0.00 0.00 31.00 31.43 2rgk h PRO 401 CO -0.41 0.41 -0.05 0.00 -0.21 0.00 0.00 178.00 177.74 2rgk h ALA 402 N 1.66 0.21 -0.53 -0.75 0.00 0.22 -1.07 119.26 119.01 2rgk h ALA 402 Ca 0.25 -0.24 -0.08 0.00 0.00 0.00 0.00 54.91 54.84 2rgk h ALA 402 Cb 0.21 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 2rgk h ALA 402 CO -0.07 -0.02 0.02 0.28 0.00 0.00 0.00 179.25 179.46 2rgk h VAL 403 N -0.01 1.26 -0.82 0.00 2.07 -0.64 -1.35 116.25 116.77 2rgk h VAL 403 Ca 0.04 -1.06 0.01 0.00 0.82 0.00 0.00 66.70 66.51 2rgk h VAL 403 Cb 0.49 0.90 -0.04 0.00 -1.52 0.00 0.00 31.29 31.12 2rgk h VAL 403 CO 0.02 0.38 0.54 0.00 0.02 0.00 0.00 177.57 178.53 2rgk h ALA 404 N 0.96 1.42 0.00 1.67 0.00 -0.84 0.62 119.26 123.09 2rgk h ALA 404 Ca 0.15 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.01 2rgk h ALA 404 Cb 0.50 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 17.96 2rgk h ALA 404 CO 0.02 0.53 0.00 0.00 0.00 0.00 0.00 179.25 179.81 2rgk n ALA 405 N -2.41 2.54 -2.12 0.00 0.00 -0.41 -4.89 120.51 113.23 2rgk n ALA 405 Ca 0.09 -0.13 -0.07 0.00 0.00 0.00 0.00 53.44 53.33 2rgk n ALA 405 Cb 0.03 -1.34 -0.00 0.00 0.00 0.00 0.00 19.45 18.13 2rgk n ALA 405 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2rgk n GLY 406 N 0.71 0.09 0.29 0.00 0.00 0.21 -4.94 105.19 101.56 2rgk n GLY 406 Ca 0.16 -0.59 0.14 0.00 0.00 0.00 0.00 46.02 45.73 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 -1.01 0.91 -4.67 0.99 4.77 -0.54 -4.84 117.00 112.61 2rgk n LEU 407 Ca -0.08 -0.31 -0.49 0.00 -0.03 0.00 0.00 56.01 55.09 2rgk n LEU 407 Cb 0.56 -0.01 -0.05 0.00 -2.33 0.00 0.00 43.42 41.59 2rgk n LEU 407 CO 0.10 0.16 1.33 -0.11 -1.33 0.00 0.00 177.39 177.53 2rgk n LEU 408 N -0.28 3.02 -0.20 2.23 7.94 -1.26 -1.01 117.00 127.45 2rgk n LEU 408 Ca 0.20 1.03 -0.03 0.00 -1.11 0.00 0.00 56.01 56.11 2rgk n LEU 408 Cb 0.25 -1.34 -0.01 0.00 0.53 0.00 0.00 43.42 42.86 2rgk n LEU 408 CO 0.17 -0.27 -0.03 0.47 -1.11 0.00 0.00 177.39 176.62 2rgk n ASP 409 N 5.15 -5.48 -0.33 1.96 8.00 0.13 -4.86 116.55 121.12 2rgk n ASP 409 Ca 0.21 0.07 0.20 0.00 0.71 0.00 0.00 54.79 55.98 2rgk n ASP 409 Cb 0.26 -3.21 0.46 0.00 -0.02 0.00 0.00 41.12 38.61 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 0.55 -0.00 0.53 6.09 -1.25 -0.01 117.51 123.41 2rgk h ILE 410 Ca -0.05 -0.16 0.00 0.00 -1.37 0.00 0.00 64.86 63.27 2rgk h ILE 410 Cb 0.89 0.04 0.00 0.00 0.47 0.00 0.00 36.82 38.22 2rgk h ILE 410 CO 0.08 0.09 -0.66 0.59 -3.07 0.00 0.00 178.15 175.18 2rgk n ASN 411 N -4.69 0.98 -4.86 2.19 3.02 -1.26 -4.96 115.26 105.68 2rgk n ASN 411 Ca 0.25 -0.80 -0.30 0.00 -0.03 0.00 0.00 54.58 53.69 2rgk n ASN 411 Cb 0.81 0.56 0.04 0.00 -0.61 0.00 0.00 39.78 40.58 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 -2.86 2.81 0.00 5.41 0.00 -0.02 -4.84 121.76 122.26 2rgk s ALA 412 Ca 0.13 -0.20 0.00 0.00 0.00 0.00 0.00 51.96 51.89 2rgk s ALA 412 Cb 0.17 -3.07 0.00 0.00 0.00 0.00 0.00 23.12 20.22 2rgk s ALA 412 CO 0.72 -1.13 0.00 1.17 0.00 0.00 0.00 175.76 176.52