#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2rgl h LEU 7 N 0.00 0.00 -0.57 5.87 3.38 -1.95 -3.48 115.31 118.56 2rgl h LEU 7 Ca 0.00 0.00 -0.41 0.00 0.09 0.00 0.00 57.88 57.56 2rgl h LEU 7 Cb 0.00 0.00 0.10 0.00 0.09 0.00 0.00 40.66 40.85 2rgl h LEU 7 CO 0.00 0.42 -0.68 0.61 0.09 0.00 0.00 178.44 178.88 2rgl n GLY 8 N 1.00 -0.54 2.89 0.83 0.00 -1.26 -1.75 105.19 106.36 2rgl n GLY 8 Ca 0.02 0.23 0.00 0.00 0.00 0.00 0.00 46.02 46.27 2rgl n GLY 8 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2rgl n GLY 9 N -1.89 0.93 3.81 -0.02 0.00 -1.26 -5.02 105.19 101.75 2rgl n GLY 9 Ca -0.00 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 2rgl n GLY 9 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2rgl s LEU 10 N 0.00 4.42 0.08 0.99 1.43 -0.72 -4.81 118.68 120.08 2rgl s LEU 10 Ca 0.00 1.44 -0.26 0.00 -1.03 0.00 0.00 54.13 54.28 2rgl s LEU 10 Cb 0.00 -3.43 0.09 0.00 0.03 0.00 0.00 46.19 42.87 2rgl s LEU 10 CO 0.00 0.10 1.14 -0.94 0.23 0.00 0.00 176.35 176.88 2rgl s SER 11 N -1.48 -0.04 0.53 2.29 1.04 -1.26 -4.82 113.70 109.95 2rgl s SER 11 Ca 0.40 -0.39 0.18 0.00 0.48 0.00 0.00 55.95 56.61 2rgl s SER 11 Cb -0.18 0.33 1.33 0.00 0.10 0.00 0.00 66.02 67.60 2rgl s SER 11 CO 0.22 -0.65 2.15 0.03 0.98 0.00 0.00 173.24 175.97 2rgl h ARG 12 N 2.00 0.00 0.00 4.02 3.08 -1.85 -1.03 114.38 120.60 2rgl h ARG 12 Ca -0.26 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 59.77 2rgl h ARG 12 Cb 1.21 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.26 2rgl h ARG 12 CO 0.31 0.00 -0.06 0.00 -1.07 0.00 0.00 179.97 179.15 2rgl h ALA 13 N 1.99 1.06 -0.00 0.04 0.00 -1.95 -2.64 119.26 117.75 2rgl h ALA 13 Ca 0.01 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2rgl h ALA 13 Cb 0.05 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.83 2rgl h ALA 13 CO -0.00 0.07 -0.05 0.00 0.00 0.00 0.00 179.25 179.27 2rgl n ALA 14 N -2.15 2.69 -2.41 0.00 0.00 -0.39 -4.86 120.51 113.41 2rgl n ALA 14 Ca -0.01 -0.28 -0.21 0.00 0.00 0.00 0.00 53.44 52.94 2rgl n ALA 14 Cb 0.27 -1.35 -0.10 0.00 0.00 0.00 0.00 19.45 18.27 2rgl n ALA 14 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 2rgl s PHE 15 N -2.24 1.98 0.86 0.00 0.40 -1.00 -4.96 117.98 113.02 2rgl s PHE 15 Ca 0.36 -0.48 -0.13 0.00 -0.60 0.00 0.00 56.93 56.08 2rgl s PHE 15 Cb 0.21 -0.91 0.07 0.00 0.51 0.00 0.00 43.02 42.90 2rgl s PHE 15 CO 0.42 0.51 0.89 -2.30 0.70 0.00 0.00 175.22 175.44 2rgl n PRO 16 N -0.50 -0.07 -1.81 0.24 -0.02 -1.26 -4.88 135.00 126.70 2rgl n PRO 16 Ca -0.07 0.04 -0.41 0.00 -2.02 0.00 0.00 63.50 61.05 2rgl n PRO 16 Cb 0.60 -2.19 -0.01 0.00 -0.02 0.00 0.00 33.50 31.89 2rgl n PRO 16 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 2rgl s LYS 17 N -3.92 4.13 -0.08 -0.52 3.01 -1.26 -2.01 119.74 119.09 2rgl s LYS 17 Ca 0.67 2.56 0.00 0.00 -1.01 0.00 0.00 55.97 58.18 2rgl s LYS 17 Cb -0.26 -3.00 0.00 0.00 -1.01 0.00 0.00 37.83 33.56 2rgl s LYS 17 CO 0.58 -0.57 0.00 0.54 0.51 0.00 0.00 175.35 176.41 2rgl n ARG 18 N 1.31 -1.12 -1.80 1.68 5.12 -1.26 -4.98 116.66 115.61 2rgl n ARG 18 Ca 0.04 0.32 -0.42 0.00 -1.93 0.00 0.00 57.85 55.87 2rgl n ARG 18 Cb 0.38 -4.18 -0.02 0.00 -1.16 0.00 0.00 32.46 27.48 2rgl n ARG 18 CO 0.00 0.00 0.00 0.12 -1.93 0.00 0.00 177.63 175.82 2rgl s PHE 19 N -1.49 2.89 -0.19 -1.55 5.36 -0.85 -4.96 117.98 117.18 2rgl s PHE 19 Ca 0.00 0.60 -0.17 0.00 -0.96 0.00 0.00 56.93 56.39 2rgl s PHE 19 Cb 0.00 -4.06 -0.04 0.00 -0.34 0.00 0.00 43.02 38.59 2rgl s PHE 19 CO 0.00 -3.79 0.47 0.08 -1.46 0.00 0.00 175.22 170.52 2rgl s VAL 20 N 0.66 5.15 -0.17 3.12 1.01 -0.84 -4.99 120.40 124.33 2rgl s VAL 20 Ca 0.69 0.86 -0.02 0.00 0.00 0.00 0.00 61.98 63.51 2rgl s VAL 20 Cb -0.47 -3.80 -0.01 0.00 0.00 0.00 0.00 36.38 32.10 2rgl s VAL 20 CO 0.38 0.23 -0.08 -0.36 0.00 0.00 0.00 175.10 175.27 2rgl s PHE 21 N 1.37 2.90 0.29 5.22 0.08 -1.26 -0.42 117.98 126.16 2rgl s PHE 21 Ca 0.22 -0.73 0.04 0.00 0.12 0.00 0.00 56.93 56.58 2rgl s PHE 21 Cb -0.15 -1.97 -0.01 0.00 -0.57 0.00 0.00 43.02 40.32 2rgl s PHE 21 CO 0.09 -0.33 0.30 0.41 -0.10 0.00 0.00 175.22 175.59 2rgl n GLY 22 N 4.05 2.80 3.60 4.36 0.00 -0.11 0.16 105.19 120.04 2rgl n GLY 22 Ca -0.18 -1.77 -0.27 0.00 0.00 0.00 0.00 46.02 43.80 2rgl n GLY 22 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2rgl s THR 23 N -3.02 2.13 0.01 2.61 -4.23 -1.14 -1.25 115.64 110.74 2rgl s THR 23 Ca 0.31 -2.06 0.02 0.00 -1.18 0.00 0.00 61.69 58.79 2rgl s THR 23 Cb 0.01 -2.86 -0.01 0.00 1.34 0.00 0.00 72.50 70.98 2rgl s THR 23 CO 0.22 -0.08 -0.08 -0.69 -0.54 0.00 0.00 174.62 173.45 2rgl s VAL 24 N -2.66 0.61 0.31 2.29 1.01 -0.69 -0.82 120.40 120.45 2rgl s VAL 24 Ca 0.34 -0.55 0.04 0.00 0.00 0.00 0.00 61.98 61.81 2rgl s VAL 24 Cb 0.06 -0.56 -0.03 0.00 0.00 0.00 0.00 36.38 35.85 2rgl s VAL 24 CO 0.18 0.02 0.19 0.42 0.00 0.00 0.00 175.10 175.91 2rgl s THR 25 N -0.51 0.21 0.15 3.92 -4.23 -0.50 -2.54 115.64 112.14 2rgl s THR 25 Ca -0.00 -2.00 0.06 0.00 -1.18 0.00 0.00 61.69 58.57 2rgl s THR 25 Cb -0.05 -2.49 -0.04 0.00 1.34 0.00 0.00 72.50 71.26 2rgl s THR 25 CO 0.00 0.00 -0.13 -0.94 -0.54 0.00 0.00 174.62 173.01 2rgl s SER 26 N -3.37 2.06 0.09 3.99 1.04 -1.26 -4.12 113.70 112.13 2rgl s SER 26 Ca 0.36 -0.93 -0.36 0.00 0.48 0.00 0.00 55.95 55.51 2rgl s SER 26 Cb 0.04 -0.06 -0.17 0.00 0.10 0.00 0.00 66.02 65.93 2rgl s SER 26 CO 0.20 -0.21 1.57 0.00 0.98 0.00 0.00 173.24 175.77 2rgl h ALA 27 N 3.04 -1.11 -0.22 5.32 0.00 -1.91 -2.29 119.26 122.10 2rgl h ALA 27 Ca -0.38 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 54.33 2rgl h ALA 27 Cb 1.20 0.74 -0.01 0.00 0.00 0.00 0.00 17.79 19.72 2rgl h ALA 27 CO 0.58 -1.17 0.04 -0.92 0.00 0.00 0.00 179.25 177.78 2rgl h TYR 28 N -0.97 0.31 0.00 0.00 3.20 -1.93 0.60 116.97 118.17 2rgl h TYR 28 Ca -0.05 -0.01 -0.08 0.00 3.14 0.00 0.00 58.73 61.73 2rgl h TYR 28 Cb 0.86 -0.10 -0.01 0.00 1.54 0.00 0.00 36.73 39.02 2rgl h TYR 28 CO -0.28 0.29 -0.37 1.96 -1.64 0.00 0.00 178.16 178.13 2rgl h GLN 29 N 0.31 0.00 0.00 1.82 4.20 -1.74 -3.40 115.11 116.31 2rgl h GLN 29 Ca 0.08 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.79 2rgl h GLN 29 Cb 0.15 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.93 2rgl h GLN 29 CO -0.00 0.37 -0.77 1.33 -0.67 0.00 0.00 178.83 179.08 2rgl n VAL 30 N -3.37 0.00 -0.01 -0.54 0.24 -0.90 -2.00 118.33 111.76 2rgl n VAL 30 Ca 0.01 0.00 -0.11 0.00 -2.04 0.00 0.00 64.34 62.20 2rgl n VAL 30 Cb 0.57 -0.64 -0.05 0.00 -1.47 0.00 0.00 33.84 32.24 2rgl n VAL 30 CO 0.00 0.00 0.00 -0.33 -2.14 0.00 0.00 176.83 174.36 2rgl h GLU 31 N 0.00 0.14 0.00 7.34 5.08 -1.09 -1.91 114.58 124.14 2rgl h GLU 31 Ca 0.00 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 2rgl h GLU 31 Cb 0.69 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.91 2rgl h GLU 31 CO 0.00 0.13 0.00 0.41 -1.00 0.00 0.00 179.01 178.55 2rgl n GLY 32 N -1.04 -0.04 4.17 -3.84 0.00 -1.18 -1.64 105.19 101.61 2rgl n GLY 32 Ca -0.05 -1.01 -0.32 0.00 0.00 0.00 0.00 46.02 44.64 2rgl n GLY 32 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2rgl n MET 33 N 0.00 -2.75 0.03 1.61 2.81 -0.66 -4.85 117.12 113.31 2rgl n MET 33 Ca 0.00 0.33 -0.02 0.00 -1.81 0.00 0.00 57.70 56.20 2rgl n MET 33 Cb 0.00 -4.67 0.23 0.00 -0.71 0.00 0.00 33.22 28.07 2rgl n MET 33 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2rgl h ALA 34 N 0.87 1.17 -0.24 3.04 0.00 -1.74 -2.79 119.26 119.57 2rgl h ALA 34 Ca -0.61 -0.32 -0.18 0.00 0.00 0.00 0.00 54.91 53.80 2rgl h ALA 34 Cb 1.38 -0.12 -0.15 0.00 0.00 0.00 0.00 17.79 18.91 2rgl h ALA 34 CO 0.73 0.53 -0.62 0.00 0.00 0.00 0.00 179.25 179.88 2rgl n ALA 35 N -2.48 4.04 -2.37 0.00 0.00 -1.26 -4.66 120.51 113.78 2rgl n ALA 35 Ca -0.00 -3.43 -0.20 0.00 0.00 0.00 0.00 53.44 49.81 2rgl n ALA 35 Cb 0.38 -0.36 -0.09 0.00 0.00 0.00 0.00 19.45 19.38 2rgl n ALA 35 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 2rgl s SER 36 N -3.33 1.78 -1.89 0.00 0.01 -1.05 -4.84 113.70 104.38 2rgl s SER 36 Ca 0.42 -1.55 0.00 0.00 1.31 0.00 0.00 55.95 56.13 2rgl s SER 36 Cb 0.38 0.35 0.00 0.00 0.21 0.00 0.00 66.02 66.96 2rgl s SER 36 CO -0.04 -0.86 0.00 0.61 0.41 0.00 0.00 173.24 173.36 2rgl n GLY 37 N -0.63 0.59 2.61 3.44 0.00 -1.26 -2.05 105.19 107.89 2rgl n GLY 37 Ca -0.00 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 45.97 2rgl n GLY 37 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2rgl n GLY 38 N -0.80 1.86 3.73 -0.02 0.00 -1.26 -3.93 105.19 104.77 2rgl n GLY 38 Ca -0.22 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.38 2rgl n GLY 38 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2rgl n ARG 39 N -2.00 2.72 -2.58 1.61 0.63 -0.87 -4.75 116.66 111.43 2rgl n ARG 39 Ca 0.00 0.97 -0.28 0.00 -0.92 0.00 0.00 57.85 57.63 2rgl n ARG 39 Cb 0.00 -2.79 0.00 0.00 0.45 0.00 0.00 32.46 30.12 2rgl n ARG 39 CO 0.00 0.00 0.00 0.20 -2.51 0.00 0.00 177.63 175.32 2rgl s GLY 40 N 0.90 1.51 0.47 5.14 0.00 -0.06 -4.53 107.32 110.75 2rgl s GLY 40 Ca 0.71 -0.48 -0.23 0.00 0.00 0.00 0.00 44.72 44.72 2rgl s GLY 40 CO 0.39 -0.31 1.16 2.56 0.00 0.00 0.00 173.10 176.91 2rgl s PRO 41 N -4.78 3.72 0.48 2.90 0.04 -1.26 -4.58 135.00 131.53 2rgl s PRO 41 Ca 0.48 1.77 0.09 0.00 0.04 0.00 0.00 61.00 63.37 2rgl s PRO 41 Cb -0.10 -2.38 0.04 0.00 0.04 0.00 0.00 34.50 32.10 2rgl s PRO 41 CO 0.46 -0.58 0.64 -1.54 0.04 0.00 0.00 177.00 176.02 2rgl s SER 42 N -1.38 5.40 0.57 6.66 1.04 -1.26 -0.66 113.70 124.06 2rgl s SER 42 Ca 0.64 -0.61 0.27 0.00 0.48 0.00 0.00 55.95 56.73 2rgl s SER 42 Cb -0.28 -0.27 1.68 0.00 0.10 0.00 0.00 66.02 67.25 2rgl s SER 42 CO 0.34 -0.99 2.21 0.16 0.98 0.00 0.00 173.24 175.95 2rgl h ILE 43 N 0.48 0.61 0.01 -1.02 3.07 -1.17 -2.60 117.51 116.89 2rgl h ILE 43 Ca -0.36 -0.10 -0.20 0.00 1.55 0.00 0.00 64.86 65.75 2rgl h ILE 43 Cb 1.28 1.06 -0.01 0.00 -0.27 0.00 0.00 36.82 38.88 2rgl h ILE 43 CO 0.44 0.02 -0.89 -0.50 -1.05 0.00 0.00 178.15 176.17 2rgl h TRP 44 N 0.00 0.26 -0.17 0.16 4.06 -1.84 -2.16 115.95 116.26 2rgl h TRP 44 Ca -0.00 -0.15 0.03 0.00 2.06 0.00 0.00 58.89 60.83 2rgl h TRP 44 Cb 0.06 -0.03 -0.03 0.00 -1.00 0.00 0.00 29.16 28.16 2rgl h TRP 44 CO 0.00 0.97 -0.02 -0.44 -3.56 0.00 0.00 178.44 175.39 2rgl h ASP 45 N 0.09 -0.11 -0.52 -3.49 5.19 -1.85 0.19 116.42 115.92 2rgl h ASP 45 Ca -0.04 0.05 -0.10 0.00 -0.62 0.00 0.00 57.03 56.31 2rgl h ASP 45 Cb 1.53 0.09 -0.02 0.00 0.18 0.00 0.00 39.33 41.11 2rgl h ASP 45 CO 0.13 -0.03 -0.06 0.00 -3.12 0.00 0.00 179.24 176.16 2rgl h ALA 46 N 1.16 0.70 0.03 3.45 0.00 -1.56 -2.27 119.26 120.78 2rgl h ALA 46 Ca 0.08 -0.32 -0.00 0.00 0.00 0.00 0.00 54.91 54.67 2rgl h ALA 46 Cb 0.11 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.72 2rgl h ALA 46 CO -0.16 0.57 -0.02 0.35 0.00 0.00 0.00 179.25 179.99 2rgl h PHE 47 N 0.81 -0.04 0.00 0.00 3.57 -1.28 -3.06 116.94 116.94 2rgl h PHE 47 Ca 0.14 -0.00 -0.05 0.00 3.53 0.00 0.00 57.97 61.58 2rgl h PHE 47 Cb 0.61 0.01 -0.01 0.00 2.79 0.00 0.00 35.95 39.35 2rgl h PHE 47 CO 0.04 0.11 -0.26 0.00 -2.23 0.00 0.00 178.31 175.97 2rgl h ALA 48 N 0.78 1.35 -0.00 2.41 0.00 -0.58 -2.56 119.26 120.66 2rgl h ALA 48 Ca -0.00 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.67 2rgl h ALA 48 Cb 0.17 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.92 2rgl h ALA 48 CO 0.01 0.33 -0.09 0.72 0.00 0.00 0.00 179.25 180.21 2rgl n HIS 49 N -3.92 0.00 -2.82 0.00 8.25 -0.86 -4.64 115.22 111.24 2rgl n HIS 49 Ca -0.02 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.02 2rgl n HIS 49 Cb 0.34 -0.22 -0.04 0.00 1.12 0.00 0.00 29.99 31.20 2rgl n HIS 49 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 2rgl s THR 50 N -2.53 4.77 0.25 1.59 2.01 -0.97 -5.01 115.64 115.74 2rgl s THR 50 Ca 0.28 1.67 -0.30 0.00 0.31 0.00 0.00 61.69 63.64 2rgl s THR 50 Cb 0.20 -4.19 -0.15 0.00 0.01 0.00 0.00 72.50 68.37 2rgl s THR 50 CO 0.48 -0.15 1.09 -2.65 -0.69 0.00 0.00 174.62 172.70 2rgl n PRO 51 N 6.17 1.33 0.00 4.92 -0.02 -1.26 -1.98 135.00 144.16 2rgl n PRO 51 Ca 0.08 0.47 0.00 0.00 -2.02 0.00 0.00 63.50 62.02 2rgl n PRO 51 Cb 0.47 -1.90 0.00 0.00 -0.02 0.00 0.00 33.50 32.05 2rgl n PRO 51 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2rgl n GLY 52 N 1.56 2.80 0.25 -1.23 0.00 -1.26 -4.90 105.19 102.40 2rgl n GLY 52 Ca 0.12 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.01 2rgl n GLY 52 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 2rgl h ASN 53 N 0.00 0.91 -3.72 1.61 2.35 -1.67 -3.45 115.58 111.61 2rgl h ASN 53 Ca 0.00 -0.46 -0.68 0.00 -0.55 0.00 0.00 56.30 54.61 2rgl h ASN 53 Cb 0.00 -0.26 -0.20 0.00 0.05 0.00 0.00 38.32 37.91 2rgl h ASN 53 CO 0.00 1.24 -0.84 -0.69 -1.65 0.00 0.00 177.43 175.49 2rgl s VAL 54 N -4.20 2.46 -0.01 2.81 1.01 -1.26 -4.86 120.40 116.35 2rgl s VAL 54 Ca -0.10 -1.73 -0.38 0.00 0.00 0.00 0.00 61.98 59.77 2rgl s VAL 54 Cb 0.11 -2.12 -0.17 0.00 0.00 0.00 0.00 36.38 34.20 2rgl s VAL 54 CO 0.88 0.05 1.43 0.00 0.00 0.00 0.00 175.10 177.46 2rgl n ALA 55 N 0.75 -0.90 -1.66 5.51 0.00 -0.29 -1.17 120.51 122.74 2rgl n ALA 55 Ca -0.16 0.49 -0.20 0.00 0.00 0.00 0.00 53.44 53.57 2rgl n ALA 55 Cb 0.53 -2.10 -0.08 0.00 0.00 0.00 0.00 19.45 17.81 2rgl n ALA 55 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2rgl n GLY 56 N 2.90 1.65 2.43 0.00 0.00 -1.26 -2.25 105.19 108.65 2rgl n GLY 56 Ca 0.21 -0.07 -0.15 0.00 0.00 0.00 0.00 46.02 46.00 2rgl n GLY 56 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2rgl n ASN 57 N -1.23 -4.59 -4.89 1.61 3.02 -0.32 -4.97 115.26 103.89 2rgl n ASN 57 Ca -0.20 0.13 -0.29 0.00 -0.03 0.00 0.00 54.58 54.19 2rgl n ASN 57 Cb 0.65 -3.87 0.03 0.00 -0.61 0.00 0.00 39.78 35.98 2rgl n ASN 57 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 2rgl s GLN 58 N -5.02 3.10 0.34 3.52 -1.52 -0.96 -4.94 119.66 114.17 2rgl s GLN 58 Ca 0.00 0.33 -0.06 0.00 -1.95 0.00 0.00 55.36 53.68 2rgl s GLN 58 Cb 0.00 -2.16 0.01 0.00 -0.22 0.00 0.00 33.01 30.64 2rgl s GLN 58 CO 0.00 -0.74 0.52 0.54 -0.25 0.00 0.00 175.29 175.36 2rgl s ASN 59 N -4.28 0.64 -0.23 5.90 4.22 -1.26 -4.69 114.94 115.24 2rgl s ASN 59 Ca 0.55 -1.36 0.07 0.00 -2.14 0.00 0.00 52.86 49.98 2rgl s ASN 59 Cb -0.11 0.68 0.54 0.00 1.28 0.00 0.00 41.25 43.64 2rgl s ASN 59 CO 0.49 -1.33 1.49 0.61 -2.04 0.00 0.00 177.10 176.32 2rgl n GLY 60 N -0.53 3.05 0.21 0.45 0.00 -1.26 -4.49 105.19 102.61 2rgl n GLY 60 Ca -0.01 -0.70 -0.01 0.00 0.00 0.00 0.00 46.02 45.30 2rgl n GLY 60 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2rgl h ASP 61 N 1.95 -0.08 0.00 1.61 3.32 -1.94 -3.35 116.42 117.94 2rgl h ASP 61 Ca 0.19 0.11 -0.19 0.00 0.02 0.00 0.00 57.03 57.15 2rgl h ASP 61 Cb 1.87 0.16 -0.03 0.00 0.22 0.00 0.00 39.33 41.55 2rgl h ASP 61 CO 0.53 -0.02 -1.71 0.52 -1.72 0.00 0.00 179.24 176.84 2rgl n VAL 62 N -5.16 0.71 0.00 -1.35 0.31 -1.26 -1.65 118.33 109.92 2rgl n VAL 62 Ca 0.06 -0.25 0.00 0.00 -0.01 0.00 0.00 64.34 64.14 2rgl n VAL 62 Cb 0.28 -1.08 0.00 0.00 -0.91 0.00 0.00 33.84 32.12 2rgl n VAL 62 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2rgl n ALA 63 N -3.01 0.00 1.27 3.52 0.00 -1.25 -0.55 120.51 120.49 2rgl n ALA 63 Ca -0.23 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.34 2rgl n ALA 63 Cb 0.72 0.00 0.33 0.00 0.00 0.00 0.00 19.45 20.50 2rgl n ALA 63 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2rgl n THR 64 N 0.00 0.00 -3.82 0.00 -2.24 -1.07 -4.94 114.28 102.21 2rgl n THR 64 Ca 0.00 -0.32 -0.28 0.00 -2.27 0.00 0.00 64.05 61.18 2rgl n THR 64 Cb 0.00 0.87 0.04 0.00 -2.10 0.00 0.00 70.33 69.15 2rgl n THR 64 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 2rgl n ASP 65 N 0.44 -5.33 0.18 3.42 2.03 0.29 -4.88 116.55 112.70 2rgl n ASP 65 Ca 0.16 -0.71 0.06 0.00 0.52 0.00 0.00 54.79 54.82 2rgl n ASP 65 Cb 0.44 -4.23 0.52 0.00 -0.72 0.00 0.00 41.12 37.13 2rgl n ASP 65 CO 0.00 0.00 0.00 -0.61 -1.92 0.00 0.00 177.20 174.67 2rgl h GLN 66 N -2.28 0.13 -0.93 -0.67 4.15 -0.98 -2.25 115.11 112.28 2rgl h GLN 66 Ca -0.58 -0.02 0.27 0.00 0.77 0.00 0.00 58.65 59.09 2rgl h GLN 66 Cb 1.37 -0.02 -0.14 0.00 0.21 0.00 0.00 27.48 28.90 2rgl h GLN 66 CO 0.64 0.18 0.35 -0.92 -1.93 0.00 0.00 178.83 177.14 2rgl h TYR 67 N 0.13 0.55 0.00 3.99 3.20 -1.54 0.23 116.97 123.53 2rgl h TYR 67 Ca 0.03 0.05 -0.05 0.00 3.14 0.00 0.00 58.73 61.89 2rgl h TYR 67 Cb 0.15 -0.09 -0.01 0.00 1.54 0.00 0.00 36.73 38.32 2rgl h TYR 67 CO 0.00 -0.20 -1.47 0.72 -1.64 0.00 0.00 178.16 175.57 2rgl n HIS 68 N -5.17 0.62 -0.43 -3.82 8.25 -0.93 -4.50 115.22 109.24 2rgl n HIS 68 Ca 0.25 0.19 0.07 0.00 -0.26 0.00 0.00 57.72 57.97 2rgl n HIS 68 Cb 0.79 -0.85 0.20 0.00 1.12 0.00 0.00 29.99 31.26 2rgl n HIS 68 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 2rgl n ARG 69 N -2.59 2.96 -0.17 -0.41 1.74 -0.17 -4.74 116.66 113.27 2rgl n ARG 69 Ca -0.05 -2.35 0.11 0.00 -0.77 0.00 0.00 57.85 54.79 2rgl n ARG 69 Cb 0.65 -1.48 0.43 0.00 -1.02 0.00 0.00 32.46 31.03 2rgl n ARG 69 CO 0.00 0.00 0.00 0.10 -1.52 0.00 0.00 177.63 176.21 2rgl h TYR 70 N 2.25 0.63 -0.53 -1.55 -0.00 -0.85 -0.73 116.97 116.19 2rgl h TYR 70 Ca 0.00 0.02 -0.10 0.00 -0.00 0.00 0.00 58.73 58.65 2rgl h TYR 70 Cb 0.98 -0.20 -0.02 0.00 -0.00 0.00 0.00 36.73 37.49 2rgl h TYR 70 CO 0.36 0.29 -0.07 0.87 -0.00 0.00 0.00 178.16 179.60 2rgl h LYS 71 N 0.59 0.96 -0.49 0.10 1.57 -1.86 0.11 116.57 117.54 2rgl h LYS 71 Ca 0.34 -0.33 0.02 0.00 -1.87 0.00 0.00 60.65 58.81 2rgl h LYS 71 Cb 0.53 -0.08 -0.03 0.00 0.08 0.00 0.00 32.23 32.73 2rgl h LYS 71 CO -0.12 0.99 0.29 1.49 -0.57 0.00 0.00 179.45 181.54 2rgl h GLU 72 N 0.87 0.57 -0.43 3.15 4.81 -1.52 -0.90 114.58 121.12 2rgl h GLU 72 Ca 0.15 -0.03 -0.14 0.00 -0.13 0.00 0.00 59.36 59.20 2rgl h GLU 72 Cb 0.61 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 29.85 2rgl h GLU 72 CO 0.04 0.38 -0.29 -0.44 -0.73 0.00 0.00 179.01 177.97 2rgl h ASP 73 N 0.58 0.97 -0.41 1.04 3.32 -1.02 -1.81 116.42 119.11 2rgl h ASP 73 Ca 0.20 -0.40 -0.03 0.00 0.02 0.00 0.00 57.03 56.82 2rgl h ASP 73 Cb 0.02 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.28 2rgl h ASP 73 CO -0.09 1.18 0.14 0.58 -1.72 0.00 0.00 179.24 179.33 2rgl h VAL 74 N 0.79 1.21 -0.80 -1.35 2.07 -0.74 -1.43 116.25 116.02 2rgl h VAL 74 Ca 0.09 -0.70 0.09 0.00 0.82 0.00 0.00 66.70 67.01 2rgl h VAL 74 Cb 0.86 0.89 -0.07 0.00 -1.52 0.00 0.00 31.29 31.45 2rgl h VAL 74 CO 0.08 0.25 0.44 0.78 0.02 0.00 0.00 177.57 179.14 2rgl h ASN 75 N 0.52 0.63 -0.05 0.57 2.35 -1.06 -1.59 115.58 116.95 2rgl h ASN 75 Ca 0.13 0.05 -0.00 0.00 -0.55 0.00 0.00 56.30 55.93 2rgl h ASN 75 Cb 0.25 -0.07 -0.00 0.00 0.05 0.00 0.00 38.32 38.55 2rgl h ASN 75 CO -0.01 0.36 0.02 0.25 -1.65 0.00 0.00 177.43 176.41 2rgl h LEU 76 N 0.75 0.06 -1.01 1.61 5.85 -1.06 -0.70 115.31 120.80 2rgl h LEU 76 Ca 0.39 -0.09 -0.06 0.00 0.84 0.00 0.00 57.88 58.95 2rgl h LEU 76 Cb 0.36 -0.02 -0.02 0.00 0.37 0.00 0.00 40.66 41.36 2rgl h LEU 76 CO -0.25 0.14 0.04 0.00 -0.34 0.00 0.00 178.44 178.03 2rgl h MET 77 N -0.02 0.76 -0.51 1.25 -0.00 -0.97 -1.96 114.93 113.48 2rgl h MET 77 Ca 0.02 -0.18 -0.05 0.00 -0.00 0.00 0.00 59.70 59.49 2rgl h MET 77 Cb 0.09 -0.10 -0.02 0.00 -0.00 0.00 0.00 31.60 31.57 2rgl h MET 77 CO -0.00 0.74 0.12 -0.22 -0.00 0.00 0.00 176.91 177.55 2rgl h LYS 78 N 0.72 0.81 0.00 -0.10 3.64 -1.19 -2.66 116.57 117.79 2rgl h LYS 78 Ca 0.15 -0.20 0.00 0.00 -1.27 0.00 0.00 60.65 59.33 2rgl h LYS 78 Cb 0.38 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.09 2rgl h LYS 78 CO 0.01 0.78 0.00 0.66 -2.27 0.00 0.00 179.45 178.63 2rgl h SER 79 N 0.70 0.00 -0.50 4.20 4.64 -0.47 -1.27 113.55 120.85 2rgl h SER 79 Ca 0.16 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.48 2rgl h SER 79 Cb 0.34 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.43 2rgl h SER 79 CO 0.00 0.00 0.00 0.18 -0.87 0.00 0.00 176.83 176.14 2rgl n LEU 80 N -3.08 2.74 -0.69 5.97 4.77 -0.80 -4.95 117.00 120.96 2rgl n LEU 80 Ca -0.01 -1.36 -0.09 0.00 -0.03 0.00 0.00 56.01 54.52 2rgl n LEU 80 Cb 0.19 -0.33 -0.04 0.00 -2.33 0.00 0.00 43.42 40.91 2rgl n LEU 80 CO 0.24 0.68 -0.09 0.59 -1.33 0.00 0.00 177.39 177.48 2rgl n ASN 81 N 1.00 -4.40 -4.78 -1.43 3.02 -0.48 -3.53 115.26 104.66 2rgl n ASN 81 Ca 0.17 0.22 -0.34 0.00 -0.03 0.00 0.00 54.58 54.61 2rgl n ASN 81 Cb 0.44 -2.70 0.02 0.00 -0.61 0.00 0.00 39.78 36.94 2rgl n ASN 81 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 2rgl s PHE 82 N -2.23 2.69 -0.12 3.10 0.40 -1.11 -4.83 117.98 115.88 2rgl s PHE 82 Ca 0.00 1.55 0.19 0.00 -0.60 0.00 0.00 56.93 58.07 2rgl s PHE 82 Cb 0.00 -3.19 -0.26 0.00 0.51 0.00 0.00 43.02 40.07 2rgl s PHE 82 CO 0.00 -1.55 0.36 -0.25 0.70 0.00 0.00 175.22 174.48 2rgl n ASP 83 N -1.91 0.14 -3.83 1.36 8.00 0.12 -4.74 116.55 115.70 2rgl n ASP 83 Ca 0.11 0.06 -0.09 0.00 0.71 0.00 0.00 54.79 55.58 2rgl n ASP 83 Cb 0.52 1.26 -0.07 0.00 -0.02 0.00 0.00 41.12 42.81 2rgl n ASP 83 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2rgl s ALA 84 N -2.98 -0.33 -0.06 2.24 0.00 -1.02 -0.79 121.76 118.82 2rgl s ALA 84 Ca -0.08 -0.54 -0.01 0.00 0.00 0.00 0.00 51.96 51.32 2rgl s ALA 84 Cb 0.10 0.58 0.03 0.00 0.00 0.00 0.00 23.12 23.82 2rgl s ALA 84 CO 0.86 -0.56 0.01 -0.47 0.00 0.00 0.00 175.76 175.60 2rgl s TYR 85 N -3.87 0.53 -0.30 0.00 5.04 -0.05 -2.91 117.35 115.81 2rgl s TYR 85 Ca 0.06 -0.08 -0.15 0.00 -2.44 0.00 0.00 57.07 54.46 2rgl s TYR 85 Cb 0.04 -0.69 -0.03 0.00 0.35 0.00 0.00 41.96 41.63 2rgl s TYR 85 CO -0.10 -0.27 0.37 0.50 -1.34 0.00 0.00 175.55 174.71 2rgl s ARG 86 N 1.82 3.86 0.22 4.97 3.52 -0.00 -1.01 118.95 132.33 2rgl s ARG 86 Ca 0.02 -0.12 0.01 0.00 -0.13 0.00 0.00 55.73 55.51 2rgl s ARG 86 Cb -0.12 -3.71 -0.05 0.00 -1.56 0.00 0.00 34.95 29.51 2rgl s ARG 86 CO -0.04 -0.37 0.09 -0.59 -0.81 0.00 0.00 175.30 173.58 2rgl s PHE 87 N 2.07 1.36 0.14 5.12 -0.12 -0.85 -1.40 117.98 124.29 2rgl s PHE 87 Ca 0.14 -1.21 0.10 0.00 -0.05 0.00 0.00 56.93 55.91 2rgl s PHE 87 Cb -0.16 -0.76 -0.04 0.00 -0.63 0.00 0.00 43.02 41.43 2rgl s PHE 87 CO 0.11 -0.40 -0.19 -1.54 -0.05 0.00 0.00 175.22 173.15 2rgl s SER 88 N -3.24 3.80 -0.16 1.98 1.04 -1.26 -1.13 113.70 114.73 2rgl s SER 88 Ca 0.35 -0.63 -0.18 0.00 0.48 0.00 0.00 55.95 55.97 2rgl s SER 88 Cb 0.07 -0.48 -0.04 0.00 0.10 0.00 0.00 66.02 65.67 2rgl s SER 88 CO 0.11 0.16 0.48 -0.63 0.98 0.00 0.00 173.24 174.33 2rgl s ILE 89 N -1.30 5.16 -0.32 -1.02 1.01 0.29 -4.19 121.20 120.83 2rgl s ILE 89 Ca 0.19 0.91 -0.29 0.00 0.00 0.00 0.00 60.65 61.46 2rgl s ILE 89 Cb -0.10 -3.81 0.01 0.00 0.01 0.00 0.00 42.46 38.57 2rgl s ILE 89 CO 0.10 0.26 1.25 -0.55 0.00 0.00 0.00 174.94 176.01 2rgl s SER 90 N 0.88 6.71 0.18 3.58 0.15 -1.26 -4.37 113.70 119.57 2rgl s SER 90 Ca 0.24 1.13 -0.13 0.00 0.70 0.00 0.00 55.95 57.89 2rgl s SER 90 Cb -0.15 -2.54 0.16 0.00 -1.71 0.00 0.00 66.02 61.78 2rgl s SER 90 CO 0.09 -1.06 1.75 -0.25 1.20 0.00 0.00 173.24 174.97 2rgl h TRP 91 N 9.10 0.29 0.00 3.44 2.91 -1.80 -1.35 115.95 128.53 2rgl h TRP 91 Ca -0.25 0.02 0.00 0.00 1.13 0.00 0.00 58.89 59.80 2rgl h TRP 91 Cb 1.09 -0.06 0.00 0.00 -0.51 0.00 0.00 29.16 29.68 2rgl h TRP 91 CO 0.88 0.09 0.00 -1.13 -1.03 0.00 0.00 178.44 177.25 2rgl n SER 92 N -5.02 0.03 0.08 2.65 3.41 -1.26 -0.32 113.62 113.20 2rgl n SER 92 Ca 0.05 0.50 -0.05 0.00 -0.26 0.00 0.00 58.87 59.11 2rgl n SER 92 Cb 0.19 -0.51 -0.03 0.00 -0.26 0.00 0.00 64.21 63.60 2rgl n SER 92 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 2rgl h ARG 93 N 0.00 0.00 0.00 4.33 2.43 -1.50 -0.09 114.38 119.55 2rgl h ARG 93 Ca 0.00 0.00 -0.13 0.00 -0.81 0.00 0.00 59.98 59.04 2rgl h ARG 93 Cb 0.39 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 29.92 2rgl h ARG 93 CO 0.00 0.88 -0.72 0.82 -1.51 0.00 0.00 179.97 179.44 2rgl h ILE 94 N 0.00 1.19 -3.45 1.20 1.08 -1.19 -3.37 117.51 112.96 2rgl h ILE 94 Ca -0.01 -2.17 -0.64 0.00 -0.39 0.00 0.00 64.86 61.65 2rgl h ILE 94 Cb 1.56 2.52 -0.41 0.00 -3.07 0.00 0.00 36.82 37.43 2rgl h ILE 94 CO 0.11 0.40 -0.67 -0.36 -0.69 0.00 0.00 178.15 176.95 2rgl s PHE 95 N -2.28 3.27 0.54 1.37 0.40 0.56 -0.10 117.98 121.74 2rgl s PHE 95 Ca -0.24 -3.04 0.26 0.00 -0.60 0.00 0.00 56.93 53.31 2rgl s PHE 95 Cb 0.02 -2.77 1.44 0.00 0.51 0.00 0.00 43.02 42.22 2rgl s PHE 95 CO 0.60 -0.82 2.00 -1.35 0.70 0.00 0.00 175.22 176.36 2rgl h PRO 96 N 6.92 0.00 -0.44 0.24 0.11 -1.70 0.33 132.00 137.46 2rgl h PRO 96 Ca -0.06 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.05 2rgl h PRO 96 Cb 0.94 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.05 2rgl h PRO 96 CO 0.62 0.00 0.00 -0.25 -0.21 0.00 0.00 178.00 178.16 2rgl n ASP 97 N -4.23 3.44 0.00 -2.05 8.00 -1.26 -4.39 116.55 116.06 2rgl n ASP 97 Ca 0.08 -1.97 0.00 0.00 0.71 0.00 0.00 54.79 53.62 2rgl n ASP 97 Cb 0.56 -0.29 0.00 0.00 -0.02 0.00 0.00 41.12 41.37 2rgl n ASP 97 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2rgl n GLY 98 N 1.39 2.74 3.53 0.44 0.00 0.12 -4.30 105.19 109.10 2rgl n GLY 98 Ca 0.19 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.12 2rgl n GLY 98 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2rgl s GLU 99 N -0.18 1.40 7.15 1.61 -1.05 -1.26 -4.88 118.70 121.49 2rgl s GLU 99 Ca 0.00 -0.93 0.00 0.00 -0.15 0.00 0.00 54.97 53.89 2rgl s GLU 99 Cb 0.00 0.51 0.00 0.00 -0.44 0.00 0.00 34.13 34.20 2rgl s GLU 99 CO 0.00 -0.59 0.00 0.41 0.95 0.00 0.00 175.26 176.03 2rgl n GLY 100 N -0.34 2.26 3.72 -3.83 0.00 -1.26 -4.83 105.19 100.92 2rgl n GLY 100 Ca -0.09 -0.23 -0.42 0.00 0.00 0.00 0.00 46.02 45.28 2rgl n GLY 100 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2rgl s ARG 101 N 0.00 4.28 -0.05 1.61 3.52 -1.26 -5.00 118.95 122.05 2rgl s ARG 101 Ca 0.00 2.21 -0.22 0.00 -0.13 0.00 0.00 55.73 57.58 2rgl s ARG 101 Cb 0.00 -3.19 -0.04 0.00 -1.56 0.00 0.00 34.95 30.16 2rgl s ARG 101 CO 0.00 -0.48 0.65 0.08 -0.81 0.00 0.00 175.30 174.74 2rgl s VAL 102 N 0.87 5.00 -0.70 7.11 1.01 -1.26 -4.17 120.40 128.27 2rgl s VAL 102 Ca 0.65 1.35 -0.22 0.00 0.00 0.00 0.00 61.98 63.76 2rgl s VAL 102 Cb -0.40 -3.99 0.08 0.00 0.00 0.00 0.00 36.38 32.07 2rgl s VAL 102 CO 0.33 0.31 1.00 0.21 0.00 0.00 0.00 175.10 176.95 2rgl s ASN 103 N 0.45 6.24 0.41 3.32 2.47 0.86 -4.93 114.94 123.76 2rgl s ASN 103 Ca 0.34 -1.13 0.11 0.00 0.42 0.00 0.00 52.86 52.60 2rgl s ASN 103 Cb -0.18 -2.42 0.88 0.00 -1.45 0.00 0.00 41.25 38.08 2rgl s ASN 103 CO 0.17 -1.40 1.97 1.56 -3.72 0.00 0.00 177.10 175.68 2rgl h GLN 104 N 9.48 0.20 -0.85 0.43 1.08 -1.89 -1.45 115.11 122.10 2rgl h GLN 104 Ca -0.22 -0.04 -0.02 0.00 -1.45 0.00 0.00 58.65 56.92 2rgl h GLN 104 Cb 1.06 -0.03 -0.04 0.00 -0.05 0.00 0.00 27.48 28.42 2rgl h GLN 104 CO 1.18 0.30 0.46 1.49 -0.95 0.00 0.00 178.83 181.31 2rgl h GLU 105 N 0.19 1.19 -0.33 1.46 4.81 -1.92 -0.57 114.58 119.42 2rgl h GLU 105 Ca 0.04 -0.14 -0.04 0.00 -0.13 0.00 0.00 59.36 59.09 2rgl h GLU 105 Cb 0.28 -0.23 -0.01 0.00 0.63 0.00 0.00 28.75 29.42 2rgl h GLU 105 CO 0.01 0.88 0.07 0.78 -0.73 0.00 0.00 179.01 180.02 2rgl h GLY 106 N 1.19 0.58 0.62 1.92 0.00 -1.41 -2.02 103.07 103.96 2rgl h GLY 106 Ca 0.30 -0.37 0.06 0.00 0.00 0.00 0.00 47.33 47.32 2rgl h GLY 106 CO -0.05 0.35 0.27 -2.08 0.00 0.00 0.00 176.54 175.03 2rgl h VAL 107 N 0.37 0.91 -0.74 4.60 2.07 -1.30 -2.57 116.25 119.59 2rgl h VAL 107 Ca 0.10 -0.18 -0.01 0.00 0.82 0.00 0.00 66.70 67.43 2rgl h VAL 107 Cb 0.33 0.35 -0.04 0.00 -1.52 0.00 0.00 31.29 30.41 2rgl h VAL 107 CO 0.00 0.09 0.42 0.00 0.02 0.00 0.00 177.57 178.10 2rgl h ALA 108 N 1.33 1.34 0.11 1.67 0.00 -0.88 -1.14 119.26 121.69 2rgl h ALA 108 Ca 0.26 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.07 2rgl h ALA 108 Cb 0.21 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 2rgl h ALA 108 CO -0.20 0.55 -0.09 -0.92 0.00 0.00 0.00 179.25 178.59 2rgl h TYR 109 N 1.03 -0.22 -0.30 0.00 3.20 -0.96 -0.44 116.97 119.28 2rgl h TYR 109 Ca 0.26 -0.00 -0.11 0.00 3.14 0.00 0.00 58.73 62.02 2rgl h TYR 109 Cb 0.01 0.08 -0.01 0.00 1.54 0.00 0.00 36.73 38.35 2rgl h TYR 109 CO 0.01 -0.14 -0.29 1.88 -1.64 0.00 0.00 178.16 177.98 2rgl h TYR 110 N -0.20 0.70 -0.29 -3.82 0.05 -1.33 -0.05 116.97 112.04 2rgl h TYR 110 Ca -0.00 -0.17 0.05 0.00 0.05 0.00 0.00 58.73 58.66 2rgl h TYR 110 Cb 0.19 -0.16 -0.05 0.00 1.01 0.00 0.00 36.73 37.72 2rgl h TYR 110 CO -0.10 0.83 -0.01 -0.91 -1.05 0.00 0.00 178.16 176.93 2rgl h ASN 111 N 0.53 -0.12 -0.32 3.88 2.35 -1.09 0.69 115.58 121.49 2rgl h ASN 111 Ca 0.07 0.07 0.01 0.00 -0.55 0.00 0.00 56.30 55.89 2rgl h ASN 111 Cb 0.76 0.12 -0.02 0.00 0.05 0.00 0.00 38.32 39.23 2rgl h ASN 111 CO 0.06 -0.03 0.20 0.78 -1.65 0.00 0.00 177.43 176.79 2rgl h ASN 112 N 0.08 0.34 0.20 5.81 2.35 -0.63 0.66 115.58 124.38 2rgl h ASN 112 Ca 0.14 -0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.87 2rgl h ASN 112 Cb 0.18 -0.08 0.00 0.00 0.05 0.00 0.00 38.32 38.48 2rgl h ASN 112 CO -0.23 0.24 -0.09 0.25 -1.65 0.00 0.00 177.43 175.94 2rgl h LEU 113 N 0.41 -0.23 -0.35 1.61 5.85 -0.86 -0.82 115.31 120.92 2rgl h LEU 113 Ca 0.12 0.01 0.02 0.00 0.84 0.00 0.00 57.88 58.87 2rgl h LEU 113 Cb -0.02 0.06 -0.03 0.00 0.37 0.00 0.00 40.66 41.04 2rgl h LEU 113 CO -0.04 -0.16 0.18 0.40 -0.34 0.00 0.00 178.44 178.48 2rgl h ILE 114 N -0.26 0.99 -0.61 4.05 2.04 -0.75 -0.52 117.51 122.45 2rgl h ILE 114 Ca -0.03 -0.13 -0.01 0.00 1.00 0.00 0.00 64.86 65.70 2rgl h ILE 114 Cb 0.20 0.59 -0.03 0.00 -0.74 0.00 0.00 36.82 36.84 2rgl h ILE 114 CO 0.04 0.07 0.35 0.78 0.00 0.00 0.00 178.15 179.39 2rgl h ASN 115 N 0.38 0.75 -0.54 1.72 2.35 -0.83 -1.78 115.58 117.64 2rgl h ASN 115 Ca 0.15 -0.08 -0.06 0.00 -0.55 0.00 0.00 56.30 55.75 2rgl h ASN 115 Cb 0.05 -0.19 -0.02 0.00 0.05 0.00 0.00 38.32 38.21 2rgl h ASN 115 CO -0.10 0.61 0.09 0.22 -1.65 0.00 0.00 177.43 176.61 2rgl h TYR 116 N 0.83 0.94 -0.24 1.19 3.20 -0.81 -0.38 116.97 121.70 2rgl h TYR 116 Ca 0.22 -0.13 0.05 0.00 3.14 0.00 0.00 58.73 62.00 2rgl h TYR 116 Cb 0.02 -0.26 -0.04 0.00 1.54 0.00 0.00 36.73 37.99 2rgl h TYR 116 CO -0.01 0.84 -0.05 -0.07 -1.64 0.00 0.00 178.16 177.22 2rgl h LEU 117 N 0.77 -0.20 -0.75 2.82 3.38 -0.91 -1.17 115.31 119.25 2rgl h LEU 117 Ca 0.16 0.07 -0.08 0.00 0.09 0.00 0.00 57.88 58.12 2rgl h LEU 117 Cb 0.40 0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.26 2rgl h LEU 117 CO 0.01 -0.07 0.03 -0.07 0.09 0.00 0.00 178.44 178.43 2rgl h LEU 118 N 0.01 0.94 -0.99 1.67 3.38 -1.17 0.39 115.31 119.55 2rgl h LEU 118 Ca 0.11 -0.24 0.08 0.00 0.09 0.00 0.00 57.88 57.92 2rgl h LEU 118 Cb 0.17 -0.25 -0.07 0.00 0.09 0.00 0.00 40.66 40.59 2rgl h LEU 118 CO -0.24 0.99 0.63 -0.61 0.09 0.00 0.00 178.44 179.30 2rgl h GLN 119 N 0.90 1.07 -0.24 1.13 4.15 -0.71 -2.21 115.11 119.20 2rgl h GLN 119 Ca 0.17 -0.06 0.00 0.00 0.77 0.00 0.00 58.65 59.53 2rgl h GLN 119 Cb 0.49 -0.24 0.00 0.00 0.21 0.00 0.00 27.48 27.94 2rgl h GLN 119 CO 0.02 0.71 0.00 1.63 -1.93 0.00 0.00 178.83 179.26 2rgl n LYS 120 N -4.55 1.69 -1.99 1.69 4.76 -0.47 -4.92 118.16 114.37 2rgl n LYS 120 Ca 0.16 -1.06 -0.10 0.00 -2.87 0.00 0.00 58.31 54.44 2rgl n LYS 120 Cb 0.24 -1.31 -0.01 0.00 -1.84 0.00 0.00 35.03 32.11 2rgl n LYS 120 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2rgl n GLY 121 N 1.04 0.22 3.45 0.72 0.00 -0.83 -4.96 105.19 104.83 2rgl n GLY 121 Ca 0.13 -0.49 -0.34 0.00 0.00 0.00 0.00 46.02 45.31 2rgl n GLY 121 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2rgl s ILE 122 N -2.47 3.84 -0.15 -0.61 -1.09 0.07 -4.85 121.20 115.95 2rgl s ILE 122 Ca 0.00 -0.36 -0.29 0.00 -2.23 0.00 0.00 60.65 57.77 2rgl s ILE 122 Cb 0.00 -2.72 -0.01 0.00 -1.58 0.00 0.00 42.46 38.16 2rgl s ILE 122 CO 0.00 0.45 1.07 -0.89 -1.23 0.00 0.00 174.94 174.34 2rgl s THR 123 N 0.81 4.63 -0.01 2.92 2.01 0.03 -3.69 115.64 122.34 2rgl s THR 123 Ca -0.00 1.94 -0.30 0.00 0.31 0.00 0.00 61.69 63.63 2rgl s THR 123 Cb -0.14 -4.25 -0.03 0.00 0.01 0.00 0.00 72.50 68.08 2rgl s THR 123 CO 0.02 -0.08 1.08 -2.16 -0.69 0.00 0.00 174.62 172.79 2rgl s PRO 124 N 2.61 4.46 -0.30 4.92 0.04 -1.26 -0.87 135.00 144.60 2rgl s PRO 124 Ca 0.48 1.55 -0.02 0.00 0.04 0.00 0.00 61.00 63.05 2rgl s PRO 124 Cb -0.18 -3.46 0.05 0.00 0.04 0.00 0.00 34.50 30.94 2rgl s PRO 124 CO 0.14 -0.22 0.00 0.71 0.04 0.00 0.00 177.00 177.66 2rgl s TYR 125 N 1.43 3.24 -0.22 0.56 1.51 -0.18 -4.21 117.35 119.48 2rgl s TYR 125 Ca 0.54 -1.80 -0.04 0.00 -1.01 0.00 0.00 57.07 54.75 2rgl s TYR 125 Cb -0.23 -2.11 -0.01 0.00 -0.11 0.00 0.00 41.96 39.49 2rgl s TYR 125 CO 0.25 -0.79 -0.03 0.08 -1.11 0.00 0.00 175.55 173.96 2rgl s VAL 126 N 1.27 3.53 -0.05 0.71 1.01 0.21 -2.01 120.40 125.07 2rgl s VAL 126 Ca -0.04 -0.44 -0.21 0.00 0.00 0.00 0.00 61.98 61.29 2rgl s VAL 126 Cb -0.19 -2.61 -0.05 0.00 0.00 0.00 0.00 36.38 33.53 2rgl s VAL 126 CO -0.01 0.41 0.59 0.21 0.00 0.00 0.00 175.10 176.30 2rgl s ASN 127 N 1.44 6.89 0.26 3.32 2.47 -0.28 0.02 114.94 129.07 2rgl s ASN 127 Ca 0.05 1.07 0.16 0.00 0.42 0.00 0.00 52.86 54.56 2rgl s ASN 127 Cb -0.14 -2.35 0.05 0.00 -1.45 0.00 0.00 41.25 37.35 2rgl s ASN 127 CO -0.02 0.01 1.35 -0.07 -3.72 0.00 0.00 177.10 174.65 2rgl h LEU 128 N 6.25 0.00 -7.35 3.21 3.38 -1.08 0.84 115.31 120.56 2rgl h LEU 128 Ca -0.43 0.00 -0.22 0.00 0.09 0.00 0.00 57.88 57.32 2rgl h LEU 128 Cb 1.19 0.00 -0.31 0.00 0.09 0.00 0.00 40.66 41.63 2rgl h LEU 128 CO 0.73 0.45 -0.54 -0.47 0.09 0.00 0.00 178.44 178.70 2rgl s TYR 129 N -2.99 -0.27 -0.44 1.13 5.04 -0.79 -4.50 117.35 114.52 2rgl s TYR 129 Ca 0.03 0.70 0.05 0.00 -2.44 0.00 0.00 57.07 55.41 2rgl s TYR 129 Cb 0.08 -0.03 0.19 0.00 0.35 0.00 0.00 41.96 42.54 2rgl s TYR 129 CO 0.75 -0.23 0.48 1.58 -1.34 0.00 0.00 175.55 176.79 2rgl n HIS 130 N 4.47 -1.62 -0.83 4.97 -0.00 -1.26 -2.77 115.22 118.17 2rgl n HIS 130 Ca -0.21 -2.83 0.00 0.00 0.46 0.00 0.00 57.72 55.13 2rgl n HIS 130 Cb 0.52 0.52 0.00 0.00 -0.12 0.00 0.00 29.99 30.90 2rgl n HIS 130 CO 0.00 0.00 0.00 0.66 0.46 0.00 0.00 176.34 177.46 2rgl n TYR 131 N 2.60 0.00 -2.42 1.57 4.02 -1.26 -4.84 117.16 116.84 2rgl n TYR 131 Ca 0.25 0.00 -0.29 0.00 -0.01 0.00 0.00 57.90 57.85 2rgl n TYR 131 Cb 0.51 -1.05 0.00 0.00 -0.02 0.00 0.00 39.34 38.79 2rgl n TYR 131 CO 0.00 0.00 0.00 -0.40 -1.01 0.00 0.00 176.86 175.45 2rgl n ASP 132 N -0.28 5.11 -4.65 7.72 5.75 -1.26 -4.60 116.55 124.34 2rgl n ASP 132 Ca 0.00 -3.74 -0.48 0.00 -0.01 0.00 0.00 54.79 50.56 2rgl n ASP 132 Cb 0.14 -0.55 -0.05 0.00 -1.03 0.00 0.00 41.12 39.63 2rgl n ASP 132 CO 0.00 0.00 0.00 -0.11 -0.11 0.00 0.00 177.20 176.98 2rgl n LEU 133 N -0.48 2.80 -4.65 -2.12 7.94 -1.26 -4.55 117.00 114.68 2rgl n LEU 133 Ca 0.41 1.08 -0.49 0.00 -1.11 0.00 0.00 56.01 55.90 2rgl n LEU 133 Cb 0.59 -1.36 -0.05 0.00 0.53 0.00 0.00 43.42 43.13 2rgl n LEU 133 CO 0.36 -0.43 1.14 -2.65 -1.11 0.00 0.00 177.39 174.70 2rgl n PRO 134 N 3.69 1.76 -0.23 1.96 -0.02 -1.26 -0.67 135.00 140.23 2rgl n PRO 134 Ca 0.18 0.64 0.16 0.00 -2.02 0.00 0.00 63.50 62.46 2rgl n PRO 134 Cb 0.26 -2.37 0.46 0.00 -0.02 0.00 0.00 33.50 31.84 2rgl n PRO 134 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 2rgl h LEU 135 N 5.92 0.49 -1.30 2.45 5.85 -1.09 -0.19 115.31 127.44 2rgl h LEU 135 Ca -0.46 0.04 0.06 0.00 0.84 0.00 0.00 57.88 58.35 2rgl h LEU 135 Cb 1.29 -0.06 -0.05 0.00 0.37 0.00 0.00 40.66 42.21 2rgl h LEU 135 CO 0.86 0.23 0.51 0.00 -0.34 0.00 0.00 178.44 179.70 2rgl h ALA 136 N 1.62 1.62 -0.09 1.25 0.00 -1.84 -1.71 119.26 120.11 2rgl h ALA 136 Ca 0.44 -0.03 -0.17 0.00 0.00 0.00 0.00 54.91 55.15 2rgl h ALA 136 Cb 0.94 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.49 2rgl h ALA 136 CO -0.18 0.28 -0.69 -0.07 0.00 0.00 0.00 179.25 178.59 2rgl h LEU 137 N 0.86 0.45 -0.32 0.00 3.38 -1.22 -1.45 115.31 117.01 2rgl h LEU 137 Ca 0.33 -0.28 -0.01 0.00 0.09 0.00 0.00 57.88 58.00 2rgl h LEU 137 Cb 0.18 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 2rgl h LEU 137 CO -0.11 1.01 0.14 -0.08 0.09 0.00 0.00 178.44 179.49 2rgl h GLU 138 N 0.27 0.47 -0.30 1.13 4.57 -1.25 -1.60 114.58 117.87 2rgl h GLU 138 Ca -0.02 -0.08 -0.19 0.00 -1.18 0.00 0.00 59.36 57.89 2rgl h GLU 138 Cb 1.25 -0.08 0.00 0.00 -0.16 0.00 0.00 28.75 29.76 2rgl h GLU 138 CO 0.12 0.46 -0.54 0.87 -1.18 0.00 0.00 179.01 178.73 2rgl h LYS 139 N 0.38 0.89 0.19 1.92 1.57 -1.24 -1.30 116.57 118.97 2rgl h LYS 139 Ca 0.11 -0.56 -0.32 0.00 -1.87 0.00 0.00 60.65 58.00 2rgl h LYS 139 Cb 0.15 0.06 0.02 0.00 0.08 0.00 0.00 32.23 32.54 2rgl h LYS 139 CO -0.01 1.20 -1.51 -0.22 -0.57 0.00 0.00 179.45 178.34 2rgl h LYS 140 N 0.68 0.40 0.00 3.15 3.64 -1.29 -3.40 116.57 119.75 2rgl h LYS 140 Ca 0.02 -0.68 0.00 0.00 -1.27 0.00 0.00 60.65 58.71 2rgl h LYS 140 Cb 1.15 0.25 0.00 0.00 -0.41 0.00 0.00 32.23 33.23 2rgl h LYS 140 CO 0.12 1.31 -0.92 0.66 -2.27 0.00 0.00 179.45 178.35 2rgl n TYR 141 N -3.60 0.00 -1.27 1.91 4.02 -0.61 -5.01 117.16 112.60 2rgl n TYR 141 Ca -0.17 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.72 2rgl n TYR 141 Cb 1.07 -0.09 0.00 0.00 -0.02 0.00 0.00 39.34 40.30 2rgl n TYR 141 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2rgl n GLY 142 N 1.76 0.43 7.00 2.72 0.00 -0.49 -4.46 105.19 112.15 2rgl n GLY 142 Ca -0.00 -0.97 0.00 0.00 0.00 0.00 0.00 46.02 45.05 2rgl n GLY 142 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2rgl n GLY 143 N -2.26 2.34 0.00 -0.02 0.00 -1.18 -2.86 105.19 101.21 2rgl n GLY 143 Ca 0.00 -0.28 0.06 0.00 0.00 0.00 0.00 46.02 45.80 2rgl n GLY 143 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 2rgl n TRP 144 N 14.00 0.00 0.22 1.61 7.02 -1.26 -1.10 117.44 137.93 2rgl n TRP 144 Ca 0.00 0.00 0.11 0.00 -1.02 0.00 0.00 57.50 56.59 2rgl n TRP 144 Cb 0.00 -0.22 0.40 0.00 -2.42 0.00 0.00 31.31 29.07 2rgl n TRP 144 CO 0.00 0.00 0.00 -0.07 -2.02 0.00 0.00 177.69 175.60 2rgl h LEU 145 N 0.00 0.00 -9.02 -0.99 3.38 -1.87 -3.37 115.31 103.44 2rgl h LEU 145 Ca 0.00 0.00 -0.62 0.00 0.09 0.00 0.00 57.88 57.35 2rgl h LEU 145 Cb 0.09 0.00 -0.14 0.00 0.09 0.00 0.00 40.66 40.70 2rgl h LEU 145 CO 0.00 0.17 -0.30 0.21 0.09 0.00 0.00 178.44 178.61 2rgl s ASN 146 N -6.11 6.26 0.65 -0.43 3.84 -0.26 -4.93 114.94 113.96 2rgl s ASN 146 Ca 0.02 0.30 0.36 0.00 0.21 0.00 0.00 52.86 53.75 2rgl s ASN 146 Cb 0.09 -2.19 1.99 0.00 -0.55 0.00 0.00 41.25 40.58 2rgl s ASN 146 CO 0.63 -0.10 2.16 0.00 -2.79 0.00 0.00 177.10 177.01 2rgl h ALA 147 N 7.83 1.30 0.00 1.71 0.00 -1.86 -1.21 119.26 127.03 2rgl h ALA 147 Ca -0.34 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.57 2rgl h ALA 147 Cb 1.17 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.96 2rgl h ALA 147 CO 0.66 -0.18 0.00 -0.22 0.00 0.00 0.00 179.25 179.51 2rgl h LYS 148 N 0.00 0.00 -0.90 0.00 1.63 -1.93 -2.69 116.57 112.69 2rgl h LYS 148 Ca 0.02 0.00 0.22 0.00 -0.85 0.00 0.00 60.65 60.03 2rgl h LYS 148 Cb 0.33 0.00 -0.06 0.00 -0.60 0.00 0.00 32.23 31.90 2rgl h LYS 148 CO -0.00 0.00 0.60 0.52 -3.45 0.00 0.00 179.45 177.12 2rgl h MET 149 N 0.00 0.31 -0.23 1.90 2.86 -1.51 -1.88 114.93 116.38 2rgl h MET 149 Ca 0.00 -0.02 0.01 0.00 -2.06 0.00 0.00 59.70 57.64 2rgl h MET 149 Cb 0.03 -0.07 -0.02 0.00 0.06 0.00 0.00 31.60 31.60 2rgl h MET 149 CO 0.00 0.20 0.11 0.00 1.06 0.00 0.00 176.91 178.29 2rgl h ALA 150 N 1.60 0.27 -0.05 6.32 0.00 -1.72 0.28 119.26 125.96 2rgl h ALA 150 Ca 0.46 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.38 2rgl h ALA 150 Cb 1.29 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 19.04 2rgl h ALA 150 CO -0.15 -0.30 0.03 -0.44 0.00 0.00 0.00 179.25 178.39 2rgl h ASP 151 N 0.24 0.07 -0.54 0.00 3.45 -1.62 -1.56 116.42 116.44 2rgl h ASP 151 Ca 0.09 -0.11 -0.00 0.00 0.43 0.00 0.00 57.03 57.44 2rgl h ASP 151 Cb 0.02 -0.02 -0.03 0.00 -0.56 0.00 0.00 39.33 38.75 2rgl h ASP 151 CO -0.06 0.16 0.32 -0.07 -1.57 0.00 0.00 179.24 178.02 2rgl h LEU 152 N -0.03 0.66 -0.50 1.55 3.38 -1.17 -0.72 115.31 118.47 2rgl h LEU 152 Ca 0.02 -0.06 -0.13 0.00 0.09 0.00 0.00 57.88 57.79 2rgl h LEU 152 Cb 0.11 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.68 2rgl h LEU 152 CO -0.00 0.53 -0.24 0.15 0.09 0.00 0.00 178.44 178.97 2rgl h PHE 153 N 0.73 1.12 -0.62 1.13 3.57 -0.47 -2.55 116.94 119.86 2rgl h PHE 153 Ca 0.19 -0.28 -0.02 0.00 3.53 0.00 0.00 57.97 61.39 2rgl h PHE 153 Cb -0.01 -0.26 -0.03 0.00 2.79 0.00 0.00 35.95 38.45 2rgl h PHE 153 CO -0.02 1.10 0.30 1.15 -2.23 0.00 0.00 178.31 178.61 2rgl h THR 154 N 0.84 1.21 -0.83 4.41 2.02 -0.99 0.32 112.91 119.89 2rgl h THR 154 Ca 0.10 -0.60 -0.03 0.00 0.77 0.00 0.00 66.41 66.65 2rgl h THR 154 Cb 0.81 0.46 -0.04 0.00 -1.74 0.00 0.00 68.15 67.65 2rgl h THR 154 CO 0.07 0.25 0.40 -0.33 0.37 0.00 0.00 175.52 176.28 2rgl h GLU 155 N 0.85 1.20 0.11 6.66 4.39 -1.11 0.20 114.58 126.89 2rgl h GLU 155 Ca 0.21 -0.18 -0.01 0.00 0.34 0.00 0.00 59.36 59.73 2rgl h GLU 155 Cb 0.11 -0.22 0.00 0.00 -0.10 0.00 0.00 28.75 28.54 2rgl h GLU 155 CO -0.03 0.92 -0.05 -0.92 -1.16 0.00 0.00 179.01 177.77 2rgl h TYR 156 N 1.19 -0.13 -0.79 4.33 3.20 -1.04 -2.37 116.97 121.35 2rgl h TYR 156 Ca 0.29 -0.00 0.03 0.00 3.14 0.00 0.00 58.73 62.18 2rgl h TYR 156 Cb 0.12 0.04 -0.05 0.00 1.54 0.00 0.00 36.73 38.38 2rgl h TYR 156 CO 0.01 0.03 0.51 0.00 -1.64 0.00 0.00 178.16 177.07 2rgl h ALA 157 N 0.61 1.04 -0.31 1.82 0.00 -0.13 -2.32 119.26 119.96 2rgl h ALA 157 Ca -0.01 -0.03 0.05 0.00 0.00 0.00 0.00 54.91 54.91 2rgl h ALA 157 Cb 0.22 -0.27 -0.05 0.00 0.00 0.00 0.00 17.79 17.70 2rgl h ALA 157 CO 0.02 0.33 0.02 0.22 0.00 0.00 0.00 179.25 179.84 2rgl h ASP 158 N 0.99 -0.07 -0.57 0.00 1.82 -0.54 0.48 116.42 118.52 2rgl h ASP 158 Ca 0.32 0.06 0.03 0.00 -0.39 0.00 0.00 57.03 57.04 2rgl h ASP 158 Cb 0.00 0.10 -0.04 0.00 0.68 0.00 0.00 39.33 40.08 2rgl h ASP 158 CO -0.11 -0.00 0.35 0.15 -1.61 0.00 0.00 179.24 178.01 2rgl h PHE 159 N 0.12 0.65 -0.57 0.28 3.57 -1.00 -0.70 116.94 119.29 2rgl h PHE 159 Ca 0.15 0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.62 2rgl h PHE 159 Cb 0.19 -0.21 -0.02 0.00 2.79 0.00 0.00 35.95 38.69 2rgl h PHE 159 CO -0.21 0.37 0.18 0.00 -2.23 0.00 0.00 178.31 176.43 2rgl h PHE 161 N 0.80 0.08 -0.46 0.00 0.04 -0.61 -0.55 116.94 116.24 2rgl h PHE 161 Ca 0.18 0.00 0.06 0.00 2.80 0.00 0.00 57.97 61.02 2rgl h PHE 161 Cb 0.27 -0.03 -0.05 0.00 2.20 0.00 0.00 35.95 38.34 2rgl h PHE 161 CO 0.02 0.07 0.15 -0.22 -0.60 0.00 0.00 178.31 177.73 2rgl h LYS 162 N 0.06 0.31 0.22 1.51 3.64 -1.05 -0.03 116.57 121.22 2rgl h LYS 162 Ca 0.02 -0.02 -0.32 0.00 -1.27 0.00 0.00 60.65 59.06 2rgl h LYS 162 Cb 0.02 -0.07 0.03 0.00 -0.41 0.00 0.00 32.23 31.79 2rgl h LYS 162 CO -0.00 0.21 -1.41 1.15 -2.27 0.00 0.00 179.45 177.12 2rgl h THR 163 N 0.32 1.34 0.00 1.00 2.02 -0.96 -3.40 112.91 113.24 2rgl h THR 163 Ca 0.22 -2.80 0.00 0.00 0.77 0.00 0.00 66.41 64.60 2rgl h THR 163 Cb 0.22 3.01 0.00 0.00 -1.74 0.00 0.00 68.15 69.64 2rgl h THR 163 CO -0.23 0.83 -0.80 0.49 0.37 0.00 0.00 175.52 176.18 2rgl n PHE 164 N -3.67 0.00 0.30 3.16 3.72 -0.23 -4.76 117.46 115.99 2rgl n PHE 164 Ca -0.14 0.00 0.19 0.00 -0.05 0.00 0.00 57.45 57.44 2rgl n PHE 164 Cb 1.08 -0.06 0.90 0.00 -0.94 0.00 0.00 39.48 40.47 2rgl n PHE 164 CO 0.00 0.00 0.00 0.78 -0.05 0.00 0.00 176.76 177.49 2rgl h GLY 165 N 0.78 0.00 2.00 1.37 0.00 -1.00 0.19 103.07 106.41 2rgl h GLY 165 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.31 2rgl h GLY 165 CO 0.00 0.00 -0.12 3.43 0.00 0.00 0.00 176.54 179.85 2rgl h ASN 166 N 0.00 0.00 0.00 0.19 2.35 -1.84 -3.30 115.58 112.97 2rgl h ASN 166 Ca 0.00 0.00 -0.19 0.00 -0.55 0.00 0.00 56.30 55.56 2rgl h ASN 166 Cb 0.23 0.00 -0.04 0.00 0.05 0.00 0.00 38.32 38.56 2rgl h ASN 166 CO 0.00 0.12 -1.72 0.54 -1.65 0.00 0.00 177.43 174.71 2rgl n ARG 167 N -3.47 1.10 -3.15 0.81 1.74 -0.38 -4.98 116.66 108.34 2rgl n ARG 167 Ca -0.01 0.04 -0.40 0.00 -0.77 0.00 0.00 57.85 56.71 2rgl n ARG 167 Cb 0.27 -1.26 -0.06 0.00 -1.02 0.00 0.00 32.46 30.39 2rgl n ARG 167 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2rgl s VAL 168 N -2.25 5.03 -0.73 1.55 1.01 0.53 -4.93 120.40 120.61 2rgl s VAL 168 Ca -0.13 1.11 0.06 0.00 0.00 0.00 0.00 61.98 63.02 2rgl s VAL 168 Cb 0.04 -3.91 0.03 0.00 0.00 0.00 0.00 36.38 32.54 2rgl s VAL 168 CO 0.35 0.10 0.63 0.29 0.00 0.00 0.00 175.10 176.47 2rgl n LYS 169 N 5.20 0.71 -3.73 2.72 4.76 -1.26 -4.49 118.16 122.07 2rgl n LYS 169 Ca -0.02 -0.75 -0.29 0.00 -2.87 0.00 0.00 58.31 54.38 2rgl n LYS 169 Cb 0.50 -1.07 -0.16 0.00 -1.84 0.00 0.00 35.03 32.46 2rgl n LYS 169 CO 0.00 0.00 0.00 -1.01 -1.37 0.00 0.00 177.40 175.02 2rgl s HIS 170 N -0.70 1.40 0.09 2.13 3.76 -1.26 -0.94 115.29 119.77 2rgl s HIS 170 Ca 0.07 -1.34 0.05 0.00 -0.15 0.00 0.00 55.06 53.68 2rgl s HIS 170 Cb 0.05 -1.39 -0.04 0.00 1.11 0.00 0.00 32.58 32.32 2rgl s HIS 170 CO 0.11 -0.77 -0.02 -1.58 -0.85 0.00 0.00 174.74 171.63 2rgl s TRP 171 N 1.73 2.95 0.05 1.40 0.52 -0.07 -0.62 118.94 124.89 2rgl s TRP 171 Ca 0.05 -0.04 0.09 0.00 0.02 0.00 0.00 56.10 56.21 2rgl s TRP 171 Cb -0.17 -1.53 -0.03 0.00 -1.15 0.00 0.00 33.47 30.59 2rgl s TRP 171 CO -0.18 0.47 -0.24 -0.06 0.02 0.00 0.00 176.95 176.95 2rgl s PHE 172 N -1.28 2.10 -0.01 -1.98 0.40 0.10 -0.78 117.98 116.53 2rgl s PHE 172 Ca 0.24 -0.40 -0.00 0.00 -0.60 0.00 0.00 56.93 56.18 2rgl s PHE 172 Cb -0.12 -1.25 -0.00 0.00 0.51 0.00 0.00 43.02 42.17 2rgl s PHE 172 CO 0.17 0.12 -0.00 1.79 0.70 0.00 0.00 175.22 178.00 2rgl h THR 173 N 4.26 0.00 -2.09 0.64 1.35 -1.48 -0.74 112.91 114.86 2rgl h THR 173 Ca -0.45 -0.15 -0.59 0.00 -0.55 0.00 0.00 66.41 64.68 2rgl h THR 173 Cb 1.15 0.00 -0.12 0.00 -1.73 0.00 0.00 68.15 67.45 2rgl h THR 173 CO 0.43 0.00 -0.68 -0.36 -0.25 0.00 0.00 175.52 174.67 2rgl s PHE 174 N -1.08 2.49 -0.22 4.73 0.40 -1.26 -1.89 117.98 121.15 2rgl s PHE 174 Ca -0.00 -0.35 0.02 0.00 -0.60 0.00 0.00 56.93 55.99 2rgl s PHE 174 Cb 0.00 -1.24 0.05 0.00 0.51 0.00 0.00 43.02 42.34 2rgl s PHE 174 CO 0.00 0.60 -0.11 1.21 0.70 0.00 0.00 175.22 177.62 2rgl s ASN 175 N -3.63 3.80 -1.13 1.36 2.47 -1.11 -0.79 114.94 115.90 2rgl s ASN 175 Ca 0.32 -1.08 -0.10 0.00 0.42 0.00 0.00 52.86 52.42 2rgl s ASN 175 Cb -0.03 -1.36 -0.03 0.00 -1.45 0.00 0.00 41.25 38.38 2rgl s ASN 175 CO 0.18 -0.16 0.85 -0.62 -3.72 0.00 0.00 177.10 173.63 2rgl n GLU 176 N 4.59 -2.61 0.23 0.43 1.02 0.57 -4.71 120.64 120.16 2rgl n GLU 176 Ca -0.15 0.69 0.18 0.00 -0.02 0.00 0.00 57.16 57.86 2rgl n GLU 176 Cb 0.45 -5.15 0.87 0.00 -0.02 0.00 0.00 31.44 27.59 2rgl n GLU 176 CO 0.00 0.00 0.00 -1.00 1.18 0.00 0.00 177.13 177.31 2rgl h PRO 177 N -1.54 0.00 -0.95 3.49 0.13 -1.91 -1.29 132.00 129.94 2rgl h PRO 177 Ca -0.63 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.50 2rgl h PRO 177 Cb 1.34 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.42 2rgl h PRO 177 CO 0.48 0.00 0.60 -0.09 -0.23 0.00 0.00 178.00 178.76 2rgl h ARG 178 N 0.00 1.27 -0.05 0.86 2.43 -1.93 -1.77 114.38 115.18 2rgl h ARG 178 Ca 0.07 -0.10 -0.22 0.00 -0.81 0.00 0.00 59.98 58.93 2rgl h ARG 178 Cb 0.46 -0.28 0.00 0.00 -0.42 0.00 0.00 29.97 29.74 2rgl h ARG 178 CO -0.00 0.86 -0.86 0.82 -1.51 0.00 0.00 179.97 179.28 2rgl h ILE 179 N 1.29 1.35 0.27 1.20 1.08 -1.60 0.23 117.51 121.34 2rgl h ILE 179 Ca 0.34 -2.24 0.00 0.00 -0.39 0.00 0.00 64.86 62.58 2rgl h ILE 179 Cb -0.10 2.24 -0.02 0.00 -3.07 0.00 0.00 36.82 35.87 2rgl h ILE 179 CO -0.07 0.68 -0.28 0.58 -0.69 0.00 0.00 178.15 178.37 2rgl h VAL 180 N 0.32 0.40 -0.09 1.67 2.07 -1.43 0.33 116.25 119.52 2rgl h VAL 180 Ca -0.07 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.48 2rgl h VAL 180 Cb 1.48 0.40 -0.03 0.00 -1.52 0.00 0.00 31.29 31.63 2rgl h VAL 180 CO 0.16 0.00 -0.08 0.00 0.02 0.00 0.00 177.57 177.66 2rgl h ALA 181 N 0.03 -0.01 0.78 1.67 0.00 -1.20 0.12 119.26 120.66 2rgl h ALA 181 Ca -0.01 0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.90 2rgl h ALA 181 Cb 0.54 0.18 0.01 0.00 0.00 0.00 0.00 17.79 18.52 2rgl h ALA 181 CO -0.07 -0.55 -0.38 1.25 0.00 0.00 0.00 179.25 179.51 2rgl h LEU 182 N -0.10 -0.89 0.00 0.00 5.85 -0.40 -2.16 115.31 117.60 2rgl h LEU 182 Ca 0.07 0.02 -0.19 0.00 0.84 0.00 0.00 57.88 58.62 2rgl h LEU 182 Cb 0.20 0.23 -0.03 0.00 0.37 0.00 0.00 40.66 41.43 2rgl h LEU 182 CO -0.16 -0.54 -0.96 -0.07 -0.34 0.00 0.00 178.44 176.37 2rgl h LEU 183 N -1.23 0.00 0.00 2.25 3.38 -0.38 0.71 115.31 120.04 2rgl h LEU 183 Ca -0.11 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.76 2rgl h LEU 183 Cb 0.82 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.55 2rgl h LEU 183 CO 0.18 0.84 -0.80 1.23 0.09 0.00 0.00 178.44 179.97 2rgl h GLY 184 N 3.23 0.00 0.00 0.83 0.00 -0.83 0.17 103.07 106.47 2rgl h GLY 184 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.28 2rgl h GLY 184 CO 0.10 0.00 -0.11 -1.72 0.00 0.00 0.00 176.54 174.81 2rgl n TYR 185 N -3.04 0.00 -0.05 5.60 4.01 -0.86 -1.02 117.16 121.80 2rgl n TYR 185 Ca -0.02 0.00 -0.05 0.00 -0.16 0.00 0.00 57.90 57.67 2rgl n TYR 185 Cb 0.72 0.00 -0.02 0.00 -0.31 0.00 0.00 39.34 39.74 2rgl n TYR 185 CO 0.00 0.00 0.00 -3.47 -0.46 0.00 0.00 176.86 172.93 2rgl n ASP 186 N -0.27 1.21 0.07 7.72 -0.08 -0.53 -4.05 116.55 120.62 2rgl n ASP 186 Ca 0.00 0.20 -0.00 0.00 -1.51 0.00 0.00 54.79 53.48 2rgl n ASP 186 Cb 0.00 -0.62 -0.06 0.00 2.34 0.00 0.00 41.12 42.78 2rgl n ASP 186 CO 0.00 0.00 0.00 1.56 0.12 0.00 0.00 177.20 178.88 2rgl h GLN 187 N -0.60 0.00 -1.28 -0.67 4.20 -1.11 -3.42 115.11 112.23 2rgl h GLN 187 Ca 0.00 0.00 -0.17 0.00 0.06 0.00 0.00 58.65 58.54 2rgl h GLN 187 Cb 0.60 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.37 2rgl h GLN 187 CO 0.00 0.43 -0.22 0.41 -0.67 0.00 0.00 178.83 178.78 2rgl n GLY 188 N 1.35 0.02 0.00 3.46 0.00 -0.67 -4.88 105.19 104.48 2rgl n GLY 188 Ca -0.06 -0.52 0.09 0.00 0.00 0.00 0.00 46.02 45.54 2rgl n GLY 188 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2rgl n THR 189 N -3.99 0.00 -4.40 2.61 -2.24 0.46 -4.48 114.28 102.24 2rgl n THR 189 Ca -0.10 -0.22 -0.24 0.00 -2.27 0.00 0.00 64.05 61.22 2rgl n THR 189 Cb 0.58 0.59 -0.09 0.00 -2.10 0.00 0.00 70.33 69.31 2rgl n THR 189 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 2rgl s ASN 190 N -3.45 3.97 0.47 3.42 -0.87 -0.41 -4.95 114.94 113.13 2rgl s ASN 190 Ca 0.01 -0.88 -0.23 0.00 -1.57 0.00 0.00 52.86 50.18 2rgl s ASN 190 Cb 0.14 -0.52 -0.08 0.00 -0.02 0.00 0.00 41.25 40.77 2rgl s ASN 190 CO 0.80 0.01 1.18 -0.81 -2.57 0.00 0.00 177.10 175.72 2rgl n PRO 191 N -0.74 1.60 -0.05 -0.60 -0.04 -1.26 0.15 135.00 134.07 2rgl n PRO 191 Ca -0.06 0.58 0.00 0.00 -0.04 0.00 0.00 63.50 63.99 2rgl n PRO 191 Cb 0.60 -2.31 0.02 0.00 -0.04 0.00 0.00 33.50 31.77 2rgl n PRO 191 CO 0.00 0.00 0.00 -0.35 -0.04 0.00 0.00 175.50 175.11 2rgl n PRO 192 N -0.29 1.20 -3.57 0.54 -0.04 -1.26 -4.43 135.00 127.15 2rgl n PRO 192 Ca 0.09 -0.18 -0.20 0.00 -0.04 0.00 0.00 63.50 63.17 2rgl n PRO 192 Cb 0.42 -1.44 0.07 0.00 -0.04 0.00 0.00 33.50 32.51 2rgl n PRO 192 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 2rgl n LYS 193 N -0.05 -6.21 -4.10 0.54 5.02 0.12 -4.88 118.16 108.60 2rgl n LYS 193 Ca 0.02 0.76 -0.33 0.00 -2.02 0.00 0.00 58.31 56.73 2rgl n LYS 193 Cb 0.25 -5.63 -0.07 0.00 -0.02 0.00 0.00 35.03 29.55 2rgl n LYS 193 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 2rgl s ARG 194 N -5.77 3.11 -0.02 1.97 0.52 -0.19 -4.31 118.95 114.25 2rgl s ARG 194 Ca 0.13 -0.45 -0.30 0.00 -0.52 0.00 0.00 55.73 54.59 2rgl s ARG 194 Cb -0.06 -2.89 0.12 0.00 0.52 0.00 0.00 34.95 32.64 2rgl s ARG 194 CO 0.76 0.66 1.30 0.00 0.02 0.00 0.00 175.30 178.05 2rgl h THR 196 N 2.00 0.96 -0.21 0.00 2.02 -1.81 -2.62 112.91 113.26 2rgl h THR 196 Ca -0.29 -0.13 0.00 0.00 0.77 0.00 0.00 66.41 66.77 2rgl h THR 196 Cb 1.20 0.57 0.00 0.00 -1.74 0.00 0.00 68.15 68.17 2rgl h THR 196 CO 0.29 0.07 0.00 2.29 0.37 0.00 0.00 175.52 178.54 2rgl n LYS 197 N -4.95 1.80 -2.89 6.66 2.85 -1.26 -4.73 118.16 115.64 2rgl n LYS 197 Ca 0.01 -1.21 -0.35 0.00 -1.05 0.00 0.00 58.31 55.72 2rgl n LYS 197 Cb 0.10 -1.39 -0.07 0.00 -0.65 0.00 0.00 35.03 33.03 2rgl n LYS 197 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2rgl h ALA 199 N 2.68 1.43 0.00 0.00 0.00 -1.90 -1.59 119.26 119.89 2rgl h ALA 199 Ca -0.48 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.38 2rgl h ALA 199 Cb 1.19 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 18.65 2rgl h ALA 199 CO 0.64 0.52 0.00 0.00 0.00 0.00 0.00 179.25 180.41 2rgl n ALA 200 N -2.41 1.62 0.00 0.00 0.00 -1.26 -5.01 120.51 113.45 2rgl n ALA 200 Ca 0.09 -0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.51 2rgl n ALA 200 Cb 0.04 -1.25 0.00 0.00 0.00 0.00 0.00 19.45 18.25 2rgl n ALA 200 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2rgl n GLY 201 N -0.10 0.46 0.00 0.00 0.00 -0.60 -4.98 105.19 99.97 2rgl n GLY 201 Ca 0.03 -2.07 0.00 0.00 0.00 0.00 0.00 46.02 43.98 2rgl n GLY 201 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2rgl n GLY 202 N 0.24 0.90 3.15 -0.02 0.00 -1.19 -2.05 105.19 106.23 2rgl n GLY 202 Ca 0.00 -2.06 0.05 0.00 0.00 0.00 0.00 46.02 44.01 2rgl n GLY 202 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2rgl s ASN 203 N -1.38 -1.08 0.45 1.61 3.84 -1.24 -4.22 114.94 112.91 2rgl s ASN 203 Ca 0.00 0.23 0.31 0.00 0.21 0.00 0.00 52.86 53.60 2rgl s ASN 203 Cb 0.00 1.73 1.44 0.00 -0.55 0.00 0.00 41.25 43.87 2rgl s ASN 203 CO 0.00 -0.20 1.92 0.28 -2.79 0.00 0.00 177.10 176.31 2rgl h SER 204 N 7.75 0.00 1.17 -4.21 0.02 -1.77 -2.07 113.55 114.44 2rgl h SER 204 Ca -0.07 0.00 -0.07 0.00 -0.84 0.00 0.00 61.79 60.81 2rgl h SER 204 Cb 1.18 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.71 2rgl h SER 204 CO 0.05 0.00 -0.87 0.00 -1.14 0.00 0.00 176.83 174.88 2rgl h ALA 205 N 2.08 0.66 0.00 3.77 0.00 -1.86 -2.36 119.26 121.54 2rgl h ALA 205 Ca 0.00 -0.33 -0.09 0.00 0.00 0.00 0.00 54.91 54.49 2rgl h ALA 205 Cb 0.27 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 2rgl h ALA 205 CO 0.00 0.38 -1.30 0.25 0.00 0.00 0.00 179.25 178.58 2rgl n THR 206 N -2.91 0.30 -0.26 0.00 -2.24 -1.06 -4.65 114.28 103.45 2rgl n THR 206 Ca -0.02 -0.09 -0.04 0.00 -2.27 0.00 0.00 64.05 61.63 2rgl n THR 206 Cb 0.66 -1.24 0.11 0.00 -2.10 0.00 0.00 70.33 67.76 2rgl n THR 206 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 2rgl h GLU 207 N -0.12 1.11 -0.84 -0.78 5.08 -1.64 -2.17 114.58 115.21 2rgl h GLU 207 Ca -0.13 -0.18 0.13 0.00 -1.00 0.00 0.00 59.36 58.18 2rgl h GLU 207 Cb 1.14 -0.19 -0.06 0.00 0.50 0.00 0.00 28.75 30.14 2rgl h GLU 207 CO -0.06 0.89 0.55 -1.35 -1.00 0.00 0.00 179.01 178.04 2rgl h PRO 208 N 1.09 0.63 -0.05 2.33 0.11 -1.78 -0.44 132.00 133.89 2rgl h PRO 208 Ca 0.26 -0.04 -0.20 0.00 0.11 0.00 0.00 66.00 66.12 2rgl h PRO 208 Cb 0.18 -0.14 -0.00 0.00 0.11 0.00 0.00 31.00 31.15 2rgl h PRO 208 CO -0.02 0.42 -0.82 1.88 -0.21 0.00 0.00 178.00 179.24 2rgl h TYR 209 N 0.65 0.62 -0.08 0.65 0.05 -1.72 -2.37 116.97 114.76 2rgl h TYR 209 Ca 0.42 -0.30 -0.00 0.00 0.05 0.00 0.00 58.73 58.89 2rgl h TYR 209 Cb 0.68 -0.09 -0.00 0.00 1.01 0.00 0.00 36.73 38.34 2rgl h TYR 209 CO -0.00 1.09 0.03 0.82 -1.05 0.00 0.00 178.16 179.05 2rgl h ILE 210 N 0.28 1.14 -0.42 -2.88 2.04 -0.99 -2.48 117.51 114.19 2rgl h ILE 210 Ca -0.05 -0.40 0.04 0.00 1.00 0.00 0.00 64.86 65.44 2rgl h ILE 210 Cb 1.42 1.26 -0.04 0.00 -0.74 0.00 0.00 36.82 38.72 2rgl h ILE 210 CO 0.14 0.12 0.21 0.58 0.00 0.00 0.00 178.15 179.20 2rgl h VAL 211 N -0.02 0.96 -0.63 1.67 2.07 -1.10 -2.22 116.25 116.98 2rgl h VAL 211 Ca 0.03 -0.14 -0.05 0.00 0.82 0.00 0.00 66.70 67.35 2rgl h VAL 211 Cb 0.16 0.51 -0.03 0.00 -1.52 0.00 0.00 31.29 30.41 2rgl h VAL 211 CO -0.00 0.08 0.20 0.00 0.02 0.00 0.00 177.57 177.86 2rgl h ALA 212 N 1.23 0.83 -0.69 1.67 0.00 -1.43 -1.44 119.26 119.43 2rgl h ALA 212 Ca 0.18 -0.21 0.02 0.00 0.00 0.00 0.00 54.91 54.90 2rgl h ALA 212 Cb 0.10 -0.24 -0.04 0.00 0.00 0.00 0.00 17.79 17.60 2rgl h ALA 212 CO -0.13 0.50 0.45 1.25 0.00 0.00 0.00 179.25 181.31 2rgl h HIS 213 N 0.91 0.84 -0.23 0.00 6.17 -1.27 -1.27 115.15 120.31 2rgl h HIS 213 Ca 0.20 0.02 -0.13 0.00 0.71 0.00 0.00 60.37 61.18 2rgl h HIS 213 Cb 0.29 -0.28 -0.01 0.00 2.52 0.00 0.00 27.41 29.93 2rgl h HIS 213 CO 0.02 0.51 -0.40 -0.91 0.71 0.00 0.00 177.93 177.85 2rgl h ASN 214 N 0.89 0.57 -0.44 3.26 2.35 -1.04 -0.27 115.58 120.90 2rgl h ASN 214 Ca 0.26 -0.25 0.00 0.00 -0.55 0.00 0.00 56.30 55.77 2rgl h ASN 214 Cb -0.05 -0.16 -0.02 0.00 0.05 0.00 0.00 38.32 38.14 2rgl h ASN 214 CO -0.08 0.91 0.28 -0.26 -1.65 0.00 0.00 177.43 176.63 2rgl h PHE 215 N 0.44 0.57 -0.26 1.19 -1.00 -0.99 0.12 116.94 117.01 2rgl h PHE 215 Ca 0.04 0.01 -0.02 0.00 2.81 0.00 0.00 57.97 60.81 2rgl h PHE 215 Cb 0.89 -0.19 -0.01 0.00 3.61 0.00 0.00 35.95 40.25 2rgl h PHE 215 CO 0.03 0.38 0.09 -0.07 -1.61 0.00 0.00 178.31 177.14 2rgl h LEU 216 N 0.59 0.37 -0.72 1.54 3.38 -0.98 0.50 115.31 120.00 2rgl h LEU 216 Ca 0.16 -0.18 -0.09 0.00 0.09 0.00 0.00 57.88 57.86 2rgl h LEU 216 Cb -0.03 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.60 2rgl h LEU 216 CO -0.03 0.45 0.00 -0.07 0.09 0.00 0.00 178.44 178.88 2rgl h LEU 217 N 0.26 0.96 -0.53 1.67 3.38 -1.01 -1.65 115.31 118.39 2rgl h LEU 217 Ca 0.08 -0.26 -0.07 0.00 0.09 0.00 0.00 57.88 57.72 2rgl h LEU 217 Cb 0.21 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.68 2rgl h LEU 217 CO -0.00 1.01 0.05 0.28 0.09 0.00 0.00 178.44 179.87 2rgl h SER 218 N 0.91 0.88 -0.23 -0.43 0.02 -0.66 -1.75 113.55 112.29 2rgl h SER 218 Ca 0.17 -0.28 0.02 0.00 -0.84 0.00 0.00 61.79 60.85 2rgl h SER 218 Cb 0.52 -0.23 -0.02 0.00 0.14 0.00 0.00 62.40 62.81 2rgl h SER 218 CO 0.03 0.94 0.09 -0.74 -1.14 0.00 0.00 176.83 176.01 2rgl h HIS 219 N 0.78 0.16 -0.79 3.45 -0.00 -0.73 -1.99 115.15 116.05 2rgl h HIS 219 Ca 0.16 0.01 -0.04 0.00 -0.00 0.00 0.00 60.37 60.50 2rgl h HIS 219 Cb 0.46 -0.04 -0.04 0.00 -0.00 0.00 0.00 27.41 27.80 2rgl h HIS 219 CO 0.03 0.08 0.33 0.00 -0.00 0.00 0.00 177.93 178.38 2rgl h ALA 220 N 1.13 1.10 -0.48 5.26 0.00 -1.22 -1.61 119.26 123.45 2rgl h ALA 220 Ca 0.10 -0.18 -0.09 0.00 0.00 0.00 0.00 54.91 54.73 2rgl h ALA 220 Cb 0.05 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.52 2rgl h ALA 220 CO -0.09 0.65 -0.06 0.00 0.00 0.00 0.00 179.25 179.75 2rgl h ALA 221 N 1.22 0.65 -0.55 0.00 0.00 -1.20 -0.75 119.26 118.63 2rgl h ALA 221 Ca 0.27 -0.31 -0.11 0.00 0.00 0.00 0.00 54.91 54.76 2rgl h ALA 221 Cb 0.18 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 2rgl h ALA 221 CO -0.03 0.51 -0.07 0.00 0.00 0.00 0.00 179.25 179.66 2rgl h ALA 222 N 0.90 0.75 -0.24 0.00 0.00 -1.12 -1.88 119.26 117.67 2rgl h ALA 222 Ca 0.13 -0.34 -0.06 0.00 0.00 0.00 0.00 54.91 54.64 2rgl h ALA 222 Cb 0.59 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 2rgl h ALA 222 CO 0.04 0.64 -0.09 0.28 0.00 0.00 0.00 179.25 180.11 2rgl h VAL 223 N 0.90 1.30 -0.66 0.00 2.07 -1.28 -0.46 116.25 118.11 2rgl h VAL 223 Ca 0.15 -1.14 0.11 0.00 0.82 0.00 0.00 66.70 66.63 2rgl h VAL 223 Cb 0.64 1.54 -0.08 0.00 -1.52 0.00 0.00 31.29 31.86 2rgl h VAL 223 CO 0.04 0.36 0.26 0.00 0.02 0.00 0.00 177.57 178.25 2rgl h ALA 224 N 0.74 0.88 -0.38 1.67 0.00 -1.07 0.12 119.26 121.22 2rgl h ALA 224 Ca 0.06 0.09 -0.00 0.00 0.00 0.00 0.00 54.91 55.05 2rgl h ALA 224 Cb 0.58 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.41 2rgl h ALA 224 CO 0.03 -0.18 0.22 -0.09 0.00 0.00 0.00 179.25 179.23 2rgl h ARG 225 N 0.44 0.52 0.04 0.00 9.65 -1.16 -0.61 114.38 123.26 2rgl h ARG 225 Ca 0.34 -0.05 0.02 0.00 -1.10 0.00 0.00 59.98 59.19 2rgl h ARG 225 Cb 0.45 -0.11 -0.03 0.00 -1.39 0.00 0.00 29.97 28.89 2rgl h ARG 225 CO -0.33 0.41 -0.18 -0.92 2.80 0.00 0.00 179.97 181.74 2rgl h TYR 226 N 0.49 -0.47 -0.71 2.20 3.20 -0.27 -0.87 116.97 120.54 2rgl h TYR 226 Ca 0.13 0.01 -0.04 0.00 3.14 0.00 0.00 58.73 61.97 2rgl h TYR 226 Cb 0.03 0.20 -0.03 0.00 1.54 0.00 0.00 36.73 38.47 2rgl h TYR 226 CO -0.03 -0.26 0.27 0.00 -1.64 0.00 0.00 178.16 176.50 2rgl h ARG 227 N -0.31 1.07 0.02 1.82 3.08 -0.61 0.15 114.38 119.59 2rgl h ARG 227 Ca 0.04 -0.20 -0.20 0.00 0.07 0.00 0.00 59.98 59.69 2rgl h ARG 227 Cb 0.36 -0.17 -0.02 0.00 0.08 0.00 0.00 29.97 30.23 2rgl h ARG 227 CO -0.14 0.89 -0.94 1.79 -1.07 0.00 0.00 179.97 180.50 2rgl h THR 228 N 1.02 1.59 0.00 2.04 1.35 -1.08 -3.38 112.91 114.46 2rgl h THR 228 Ca 0.24 -2.98 -0.20 0.00 -0.55 0.00 0.00 66.41 62.92 2rgl h THR 228 Cb 0.23 2.66 -0.04 0.00 -1.73 0.00 0.00 68.15 69.27 2rgl h THR 228 CO -0.02 0.86 -1.74 1.17 -0.25 0.00 0.00 175.52 175.54 2rgl n LYS 229 N -3.52 1.01 -0.04 4.72 4.81 -0.34 -4.87 118.16 119.93 2rgl n LYS 229 Ca -0.02 0.05 -0.04 0.00 -0.87 0.00 0.00 58.31 57.43 2rgl n LYS 229 Cb 0.87 -1.27 -0.06 0.00 0.02 0.00 0.00 35.03 34.59 2rgl n LYS 229 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 2rgl n TYR 230 N -2.72 0.00 -0.36 5.64 4.01 0.33 -4.80 117.16 119.27 2rgl n TYR 230 Ca -0.21 0.00 -0.03 0.00 -0.16 0.00 0.00 57.90 57.50 2rgl n TYR 230 Cb 0.78 -0.38 0.10 0.00 -0.31 0.00 0.00 39.34 39.53 2rgl n TYR 230 CO 0.00 0.00 0.00 0.37 -0.46 0.00 0.00 176.86 176.77 2rgl h GLN 231 N 0.00 1.30 -0.53 -0.72 -0.00 -1.18 -0.45 115.11 113.53 2rgl h GLN 231 Ca -0.21 -0.11 0.06 0.00 -0.00 0.00 0.00 58.65 58.39 2rgl h GLN 231 Cb 1.47 -0.28 -0.05 0.00 0.00 0.00 0.00 27.48 28.62 2rgl h GLN 231 CO 0.01 0.89 0.23 0.00 0.00 0.00 0.00 178.83 179.96 2rgl h ALA 232 N 1.33 0.66 0.12 3.38 0.00 -1.86 0.29 119.26 123.19 2rgl h ALA 232 Ca 0.35 0.05 -0.16 0.00 0.00 0.00 0.00 54.91 55.14 2rgl h ALA 232 Cb -0.08 -0.01 0.02 0.00 0.00 0.00 0.00 17.79 17.72 2rgl h ALA 232 CO -0.07 -0.15 -0.72 0.00 0.00 0.00 0.00 179.25 178.31 2rgl h ALA 233 N 1.32 -0.07 0.05 0.00 0.00 -1.83 -3.39 119.26 115.33 2rgl h ALA 233 Ca 0.25 -0.67 -0.27 0.00 0.00 0.00 0.00 54.91 54.21 2rgl h ALA 233 Cb 0.22 0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.07 2rgl h ALA 233 CO -0.22 0.34 -1.43 1.96 0.00 0.00 0.00 179.25 179.90 2rgl h GLN 234 N -0.42 0.10 -5.99 0.00 4.20 -0.96 -3.48 115.11 108.57 2rgl h GLN 234 Ca -0.12 -0.17 -0.42 0.00 0.06 0.00 0.00 58.65 57.99 2rgl h GLN 234 Cb 1.56 0.06 0.08 0.00 0.30 0.00 0.00 27.48 29.49 2rgl h GLN 234 CO 0.14 0.90 -0.71 1.04 -0.67 0.00 0.00 178.83 179.52 2rgl n GLN 235 N -3.30 -7.08 -1.04 1.46 1.13 0.10 -4.96 117.38 103.68 2rgl n GLN 235 Ca -0.12 0.75 0.00 0.00 -1.94 0.00 0.00 57.00 55.69 2rgl n GLN 235 Cb 1.01 -5.74 0.00 0.00 0.11 0.00 0.00 30.24 25.62 2rgl n GLN 235 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2rgl n GLY 236 N -1.86 2.34 3.09 1.08 0.00 -1.26 -5.00 105.19 103.58 2rgl n GLY 236 Ca -0.01 -2.13 -0.10 0.00 0.00 0.00 0.00 46.02 43.78 2rgl n GLY 236 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2rgl s LYS 237 N -1.54 0.60 -0.05 1.61 1.02 -0.11 -5.01 119.74 116.26 2rgl s LYS 237 Ca 0.00 -1.03 0.00 0.00 0.02 0.00 0.00 55.97 54.96 2rgl s LYS 237 Cb 0.00 -0.05 0.03 0.00 -0.52 0.00 0.00 37.83 37.29 2rgl s LYS 237 CO 0.00 -0.03 -0.02 0.08 -0.92 0.00 0.00 175.35 174.46 2rgl s VAL 238 N -2.76 0.38 0.00 3.17 1.01 -1.26 -0.89 120.40 120.04 2rgl s VAL 238 Ca -0.00 0.02 0.00 0.00 0.00 0.00 0.00 61.98 61.99 2rgl s VAL 238 Cb -0.01 -0.47 0.00 0.00 0.00 0.00 0.00 36.38 35.91 2rgl s VAL 238 CO -0.04 0.21 0.00 0.61 0.00 0.00 0.00 175.10 175.88 2rgl n GLY 239 N 4.41 7.24 3.19 4.51 0.00 0.04 -0.99 105.19 123.60 2rgl n GLY 239 Ca -0.20 -1.90 -0.13 0.00 0.00 0.00 0.00 46.02 43.79 2rgl n GLY 239 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2rgl s ILE 240 N 0.70 0.07 -0.19 -0.61 2.07 -1.24 -1.28 121.20 120.71 2rgl s ILE 240 Ca 0.00 -0.54 -0.04 0.00 -1.41 0.00 0.00 60.65 58.66 2rgl s ILE 240 Cb 0.00 -0.55 -0.02 0.00 0.13 0.00 0.00 42.46 42.02 2rgl s ILE 240 CO 0.00 -0.30 -0.03 -0.69 -1.91 0.00 0.00 174.94 172.01 2rgl s VAL 241 N -1.32 3.66 -0.01 4.00 1.01 0.03 -0.34 120.40 127.43 2rgl s VAL 241 Ca -0.14 -0.42 0.07 0.00 0.00 0.00 0.00 61.98 61.50 2rgl s VAL 241 Cb -0.06 -2.64 -0.02 0.00 0.00 0.00 0.00 36.38 33.66 2rgl s VAL 241 CO 0.03 0.45 -0.23 -0.76 0.00 0.00 0.00 175.10 174.59 2rgl s LEU 242 N 1.00 2.06 0.24 3.92 1.43 0.14 -0.32 118.68 127.15 2rgl s LEU 242 Ca 0.01 -0.43 -0.29 0.00 -1.03 0.00 0.00 54.13 52.39 2rgl s LEU 242 Cb -0.15 -1.17 -0.09 0.00 0.03 0.00 0.00 46.19 44.82 2rgl s LEU 242 CO 0.01 0.27 0.92 1.51 0.23 0.00 0.00 176.35 179.29 2rgl s ASP 243 N -0.62 7.59 -0.20 2.29 -4.77 -1.26 -0.51 116.67 119.18 2rgl s ASP 243 Ca 0.09 1.91 -0.04 0.00 -3.30 0.00 0.00 52.55 51.20 2rgl s ASP 243 Cb -0.09 -2.60 0.09 0.00 -1.09 0.00 0.00 42.92 39.24 2rgl s ASP 243 CO -0.01 0.14 0.21 0.12 0.70 0.00 0.00 175.17 176.33 2rgl s PHE 244 N -1.23 -0.24 -0.07 2.11 5.36 -0.54 -4.72 117.98 118.65 2rgl s PHE 244 Ca 0.42 0.16 -0.04 0.00 -0.96 0.00 0.00 56.93 56.51 2rgl s PHE 244 Cb -0.25 -0.39 -0.04 0.00 -0.34 0.00 0.00 43.02 42.00 2rgl s PHE 244 CO 0.30 -0.61 0.10 -0.80 -1.46 0.00 0.00 175.22 172.76 2rgl s ASN 245 N 2.31 5.96 0.39 6.13 0.01 -1.26 -4.34 114.94 124.14 2rgl s ASN 245 Ca 0.07 0.31 -0.25 0.00 -0.71 0.00 0.00 52.86 52.27 2rgl s ASN 245 Cb -0.16 -1.82 -0.09 0.00 0.41 0.00 0.00 41.25 39.59 2rgl s ASN 245 CO -0.12 0.35 1.11 0.86 -1.51 0.00 0.00 177.10 177.78 2rgl s TRP 246 N -1.07 3.20 -0.12 2.20 -0.11 -0.31 -4.91 118.94 117.81 2rgl s TRP 246 Ca 0.18 1.61 0.03 0.00 1.22 0.00 0.00 56.10 59.14 2rgl s TRP 246 Cb -0.12 -3.26 0.01 0.00 -1.50 0.00 0.00 33.47 28.60 2rgl s TRP 246 CO 0.08 -0.93 -0.21 0.71 -4.62 0.00 0.00 176.95 171.98 2rgl s TYR 247 N -1.51 2.43 -0.11 5.86 1.51 -1.26 -0.73 117.35 123.54 2rgl s TYR 247 Ca 0.57 -1.13 0.03 0.00 -1.01 0.00 0.00 57.07 55.53 2rgl s TYR 247 Cb -0.27 -1.66 0.00 0.00 -0.11 0.00 0.00 41.96 39.92 2rgl s TYR 247 CO 0.33 -0.51 -0.23 -2.00 -1.11 0.00 0.00 175.55 172.03 2rgl s GLU 248 N 0.70 3.05 0.24 -0.62 2.56 -0.08 -4.91 118.70 119.63 2rgl s GLU 248 Ca -0.11 -0.87 -0.31 0.00 0.00 0.00 0.00 54.97 53.68 2rgl s GLU 248 Cb -0.16 -2.34 -0.13 0.00 2.00 0.00 0.00 34.13 33.49 2rgl s GLU 248 CO 0.02 0.13 1.49 0.00 -0.56 0.00 0.00 175.26 176.34 2rgl n ALA 249 N 3.65 1.54 -0.29 6.30 0.00 -1.26 -0.47 120.51 129.98 2rgl n ALA 249 Ca -0.19 0.41 -0.01 0.00 0.00 0.00 0.00 53.44 53.65 2rgl n ALA 249 Cb 0.53 -2.34 0.18 0.00 0.00 0.00 0.00 19.45 17.81 2rgl n ALA 249 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 2rgl h LEU 250 N 4.71 1.01 -8.80 0.00 5.85 -1.12 -3.44 115.31 113.52 2rgl h LEU 250 Ca -0.45 -0.03 -0.41 0.00 0.84 0.00 0.00 57.88 57.83 2rgl h LEU 250 Cb 1.26 -0.25 -0.13 0.00 0.37 0.00 0.00 40.66 41.91 2rgl h LEU 250 CO 0.79 0.74 -0.46 -0.94 -0.34 0.00 0.00 178.44 178.23 2rgl s SER 251 N -6.25 1.33 0.00 1.25 1.04 -1.26 -5.00 113.70 104.81 2rgl s SER 251 Ca -0.12 -1.66 0.12 0.00 0.48 0.00 0.00 55.95 54.77 2rgl s SER 251 Cb 0.18 0.55 0.40 0.00 0.10 0.00 0.00 66.02 67.24 2rgl s SER 251 CO 0.80 -1.06 1.31 -3.20 0.98 0.00 0.00 173.24 172.07 2rgl n ASN 252 N -1.33 1.62 -4.74 7.02 5.15 -1.26 -4.14 115.26 117.57 2rgl n ASN 252 Ca 0.06 -1.92 -0.37 0.00 -0.60 0.00 0.00 54.58 51.74 2rgl n ASN 252 Cb 0.63 -0.18 0.06 0.00 -0.53 0.00 0.00 39.78 39.75 2rgl n ASN 252 CO 0.00 0.00 0.00 -0.94 1.40 0.00 0.00 177.26 177.72 2rgl s SER 253 N -1.13 4.86 0.29 1.20 1.04 -1.26 -4.80 113.70 113.89 2rgl s SER 253 Ca 0.23 2.61 0.03 0.00 0.48 0.00 0.00 55.95 59.30 2rgl s SER 253 Cb 0.12 -2.62 0.65 0.00 0.10 0.00 0.00 66.02 64.27 2rgl s SER 253 CO 0.17 -1.84 1.77 0.74 0.98 0.00 0.00 173.24 175.06 2rgl h THR 254 N 0.80 0.72 -0.23 2.02 2.02 -1.99 -1.10 112.91 115.14 2rgl h THR 254 Ca -0.51 -0.24 -0.18 0.00 0.77 0.00 0.00 66.41 66.25 2rgl h THR 254 Cb 1.32 -0.06 0.00 0.00 -1.74 0.00 0.00 68.15 67.68 2rgl h THR 254 CO 0.54 0.13 -0.56 -0.08 0.37 0.00 0.00 175.52 175.92 2rgl h GLU 255 N 0.71 0.80 -0.41 6.66 4.81 -1.95 -1.11 114.58 124.09 2rgl h GLU 255 Ca 0.53 -0.54 -0.15 0.00 -0.13 0.00 0.00 59.36 59.06 2rgl h GLU 255 Cb 0.79 0.08 -0.01 0.00 0.63 0.00 0.00 28.75 30.24 2rgl h GLU 255 CO -0.38 1.17 -0.35 -0.44 -0.73 0.00 0.00 179.01 178.29 2rgl h ASP 256 N 0.55 1.01 -0.76 1.04 3.32 -1.78 -1.81 116.42 117.99 2rgl h ASP 256 Ca -0.00 -0.44 -0.02 0.00 0.02 0.00 0.00 57.03 56.58 2rgl h ASP 256 Cb 1.18 -0.28 -0.04 0.00 0.22 0.00 0.00 39.33 40.41 2rgl h ASP 256 CO 0.12 1.25 0.38 1.56 -1.72 0.00 0.00 179.24 180.83 2rgl h GLN 257 N 0.79 1.08 -0.67 3.56 1.08 -1.22 -1.03 115.11 118.71 2rgl h GLN 257 Ca 0.07 -0.15 -0.06 0.00 -1.45 0.00 0.00 58.65 57.07 2rgl h GLN 257 Cb 0.94 -0.20 -0.03 0.00 -0.05 0.00 0.00 27.48 28.14 2rgl h GLN 257 CO 0.09 0.83 0.19 0.00 -0.95 0.00 0.00 178.83 178.99 2rgl h ALA 258 N 1.19 1.08 -0.19 3.87 0.00 -1.14 -2.42 119.26 121.64 2rgl h ALA 258 Ca 0.26 -0.22 -0.04 0.00 0.00 0.00 0.00 54.91 54.92 2rgl h ALA 258 Cb 0.09 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 2rgl h ALA 258 CO -0.04 0.62 -0.02 0.00 0.00 0.00 0.00 179.25 179.82 2rgl h ALA 259 N 1.21 0.26 -0.82 0.00 0.00 -0.89 -0.11 119.26 118.92 2rgl h ALA 259 Ca 0.21 -0.22 0.05 0.00 0.00 0.00 0.00 54.91 54.95 2rgl h ALA 259 Cb 0.31 -0.07 -0.05 0.00 0.00 0.00 0.00 17.79 17.98 2rgl h ALA 259 CO -0.00 0.00 0.54 0.00 0.00 0.00 0.00 179.25 179.78 2rgl h ALA 260 N 0.76 1.56 -0.10 0.00 0.00 -1.15 -1.49 119.26 118.84 2rgl h ALA 260 Ca 0.05 -0.03 -0.20 0.00 0.00 0.00 0.00 54.91 54.73 2rgl h ALA 260 Cb 0.44 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.97 2rgl h ALA 260 CO 0.01 0.34 -0.77 0.37 0.00 0.00 0.00 179.25 179.20 2rgl h GLN 261 N 0.95 0.56 -0.74 0.00 5.75 -1.20 -2.31 115.11 118.11 2rgl h GLN 261 Ca 0.34 -0.47 0.00 0.00 -0.15 0.00 0.00 58.65 58.37 2rgl h GLN 261 Cb 0.14 0.10 -0.04 0.00 1.07 0.00 0.00 27.48 28.76 2rgl h GLN 261 CO -0.11 1.09 0.47 0.00 -2.65 0.00 0.00 178.83 177.64 2rgl h ARG 262 N 0.38 0.99 -0.35 1.69 3.08 -0.62 -1.56 114.38 117.99 2rgl h ARG 262 Ca -0.04 -0.07 -0.01 0.00 0.07 0.00 0.00 59.98 59.92 2rgl h ARG 262 Cb 1.37 -0.22 -0.02 0.00 0.08 0.00 0.00 29.97 31.19 2rgl h ARG 262 CO 0.14 0.67 0.18 0.00 -1.07 0.00 0.00 179.97 179.90 2rgl h ALA 263 N 1.26 0.45 -0.53 0.04 0.00 -1.22 -0.00 119.26 119.26 2rgl h ALA 263 Ca 0.27 -0.09 0.05 0.00 0.00 0.00 0.00 54.91 55.15 2rgl h ALA 263 Cb -0.08 -0.14 -0.05 0.00 0.00 0.00 0.00 17.79 17.52 2rgl h ALA 263 CO -0.06 -0.01 0.25 0.00 0.00 0.00 0.00 179.25 179.44 2rgl h ARG 264 N 0.44 0.48 -0.39 0.00 3.08 -1.24 0.01 114.38 116.75 2rgl h ARG 264 Ca 0.12 -0.03 -0.05 0.00 0.07 0.00 0.00 59.98 60.09 2rgl h ARG 264 Cb 0.08 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 30.01 2rgl h ARG 264 CO -0.02 0.31 0.05 -0.44 -1.07 0.00 0.00 179.97 178.81 2rgl h ASP 265 N 0.49 0.63 0.85 7.04 3.32 -1.02 0.72 116.42 128.45 2rgl h ASP 265 Ca 0.24 -0.27 -0.06 0.00 0.02 0.00 0.00 57.03 56.95 2rgl h ASP 265 Cb 0.17 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 39.54 2rgl h ASP 265 CO -0.18 0.74 -0.30 -0.26 -1.72 0.00 0.00 179.24 177.52 2rgl h PHE 266 N 0.49 0.00 0.00 4.55 -1.00 -0.82 0.14 116.94 120.30 2rgl h PHE 266 Ca 0.12 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.90 2rgl h PHE 266 Cb 0.39 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.95 2rgl h PHE 266 CO 0.03 0.30 -0.11 1.25 -1.61 0.00 0.00 178.31 178.16 2rgl h HIS 267 N 0.00 0.00 0.00 -0.55 2.76 -0.86 -3.41 115.15 113.10 2rgl h HIS 267 Ca -0.00 0.00 -0.38 0.00 -2.20 0.00 0.00 60.37 57.79 2rgl h HIS 267 Cb 0.80 0.00 -0.07 0.00 1.55 0.00 0.00 27.41 29.69 2rgl h HIS 267 CO 0.00 0.00 -2.44 1.51 -1.30 0.00 0.00 177.93 175.70 2rgl n ILE 268 N -3.15 1.45 -0.11 6.26 0.13 0.20 -4.40 119.36 119.73 2rgl n ILE 268 Ca -0.02 -0.65 0.03 0.00 -1.10 0.00 0.00 62.75 61.01 2rgl n ILE 268 Cb 0.06 -1.13 0.35 0.00 -0.84 0.00 0.00 39.64 38.08 2rgl n ILE 268 CO 0.00 0.00 0.00 1.23 2.80 0.00 0.00 176.55 180.58 2rgl h GLY 269 N 2.58 0.81 -0.79 4.50 0.00 -1.08 0.12 103.07 109.21 2rgl h GLY 269 Ca -0.57 -0.30 0.38 0.00 0.00 0.00 0.00 47.33 46.84 2rgl h GLY 269 CO -0.05 0.28 0.72 -0.25 0.00 0.00 0.00 176.54 177.24 2rgl h TRP 270 N 0.76 0.68 0.00 5.60 7.01 -0.94 -0.83 115.95 128.23 2rgl h TRP 270 Ca 0.22 0.03 -0.29 0.00 2.11 0.00 0.00 58.89 60.96 2rgl h TRP 270 Cb -0.05 -0.17 -0.05 0.00 -2.10 0.00 0.00 29.16 26.78 2rgl h TRP 270 CO -0.00 -0.18 -2.08 0.66 -2.79 0.00 0.00 178.44 174.05 2rgl n TYR 271 N -4.82 0.00 0.02 2.65 4.02 -0.73 -4.55 117.16 113.75 2rgl n TYR 271 Ca 0.34 0.00 -0.12 0.00 -0.01 0.00 0.00 57.90 58.11 2rgl n TYR 271 Cb 1.21 -0.74 -0.00 0.00 -0.02 0.00 0.00 39.34 39.79 2rgl n TYR 271 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 176.86 175.78 2rgl h LEU 272 N 0.00 0.64 -0.27 7.72 3.38 -0.76 -1.72 115.31 124.30 2rgl h LEU 272 Ca -0.42 -0.42 -0.01 0.00 0.09 0.00 0.00 57.88 57.12 2rgl h LEU 272 Cb 1.72 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 42.26 2rgl h LEU 272 CO -0.05 1.17 0.12 0.44 0.09 0.00 0.00 178.44 180.22 2rgl h ASP 273 N 0.37 0.36 -0.30 -0.43 3.32 -1.37 0.13 116.42 118.50 2rgl h ASP 273 Ca -0.04 -0.14 0.04 0.00 0.02 0.00 0.00 57.03 56.92 2rgl h ASP 273 Cb 1.33 -0.09 -0.04 0.00 0.22 0.00 0.00 39.33 40.75 2rgl h ASP 273 CO 0.14 0.40 0.07 -0.65 -1.72 0.00 0.00 179.24 177.47 2rgl h PRO 274 N 0.29 0.18 -0.06 3.56 0.11 -1.00 0.31 132.00 135.39 2rgl h PRO 274 Ca 0.09 -0.01 -0.08 0.00 0.11 0.00 0.00 66.00 66.11 2rgl h PRO 274 Cb 0.14 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 31.20 2rgl h PRO 274 CO -0.01 0.12 -0.33 -0.07 -0.21 0.00 0.00 178.00 177.50 2rgl h LEU 275 N 0.18 0.12 0.00 2.35 3.38 -1.04 -1.67 115.31 118.63 2rgl h LEU 275 Ca 0.14 -0.04 -0.37 0.00 0.09 0.00 0.00 57.88 57.70 2rgl h LEU 275 Cb 0.14 -0.03 -0.06 0.00 0.09 0.00 0.00 40.66 40.79 2rgl h LEU 275 CO -0.17 0.45 -2.35 -0.38 0.09 0.00 0.00 178.44 176.08 2rgl n ILE 276 N -4.12 1.35 0.42 1.22 2.08 0.42 -0.61 119.36 120.12 2rgl n ILE 276 Ca -0.02 -0.47 0.05 0.00 0.56 0.00 0.00 62.75 62.87 2rgl n ILE 276 Cb 0.40 -1.47 -0.02 0.00 -0.75 0.00 0.00 39.64 37.80 2rgl n ILE 276 CO 0.00 0.00 0.00 0.59 0.56 0.00 0.00 176.55 177.70 2rgl n ASN 277 N -3.44 0.92 -0.76 4.38 3.02 0.96 -4.57 115.26 115.77 2rgl n ASN 277 Ca -0.44 -0.96 -0.08 0.00 -0.03 0.00 0.00 54.58 53.08 2rgl n ASN 277 Cb 0.92 0.65 -0.02 0.00 -0.61 0.00 0.00 39.78 40.72 2rgl n ASN 277 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2rgl n GLY 278 N 0.99 0.46 3.38 7.41 0.00 -0.34 -4.93 105.19 112.16 2rgl n GLY 278 Ca 0.03 -0.62 -0.12 0.00 0.00 0.00 0.00 46.02 45.31 2rgl n GLY 278 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 2rgl s HIS 279 N -2.35 -0.39 0.65 1.61 -3.43 -1.16 -4.80 115.29 105.43 2rgl s HIS 279 Ca 0.00 0.25 -0.16 0.00 -0.80 0.00 0.00 55.06 54.36 2rgl s HIS 279 Cb 0.00 0.38 -0.01 0.00 -1.43 0.00 0.00 32.58 31.52 2rgl s HIS 279 CO 0.00 -0.72 1.12 0.71 -2.00 0.00 0.00 174.74 173.85 2rgl s TYR 280 N -3.24 2.58 0.40 0.38 2.02 -1.26 -0.86 117.35 117.37 2rgl s TYR 280 Ca -0.01 1.55 -0.26 0.00 -0.37 0.00 0.00 57.07 57.99 2rgl s TYR 280 Cb 0.00 -3.21 -0.11 0.00 -0.40 0.00 0.00 41.96 38.25 2rgl s TYR 280 CO -0.08 -1.74 1.21 -2.30 -1.57 0.00 0.00 175.55 171.07 2rgl n PRO 281 N -2.29 1.83 -0.27 -1.71 -0.02 -1.26 -4.82 135.00 126.46 2rgl n PRO 281 Ca 0.11 0.65 0.01 0.00 -2.02 0.00 0.00 63.50 62.25 2rgl n PRO 281 Cb 0.52 -2.28 0.14 0.00 -0.02 0.00 0.00 33.50 31.86 2rgl n PRO 281 CO 0.00 0.00 0.00 0.37 1.98 0.00 0.00 175.50 177.85 2rgl h GLN 282 N 2.06 0.71 -0.35 -0.52 5.75 -1.99 -2.08 115.11 118.70 2rgl h GLN 282 Ca -0.46 -0.04 -0.03 0.00 -0.15 0.00 0.00 58.65 57.96 2rgl h GLN 282 Cb 1.30 -0.16 -0.02 0.00 1.07 0.00 0.00 27.48 29.67 2rgl h GLN 282 CO 0.60 0.47 0.07 0.97 -2.65 0.00 0.00 178.83 178.29 2rgl h ILE 283 N 0.73 1.17 -0.33 2.39 6.09 -1.99 0.14 117.51 125.72 2rgl h ILE 283 Ca 0.36 -0.62 -0.10 0.00 -1.37 0.00 0.00 64.86 63.13 2rgl h ILE 283 Cb 0.30 0.83 -0.01 0.00 0.47 0.00 0.00 36.82 38.41 2rgl h ILE 283 CO -0.23 0.22 -0.19 0.24 -3.07 0.00 0.00 178.15 175.12 2rgl h MET 284 N 0.51 0.70 -0.50 2.19 2.86 -1.76 -0.39 114.93 118.54 2rgl h MET 284 Ca 0.12 -0.32 0.04 0.00 -2.06 0.00 0.00 59.70 57.48 2rgl h MET 284 Cb 0.22 -0.01 -0.04 0.00 0.06 0.00 0.00 31.60 31.82 2rgl h MET 284 CO -0.00 0.92 0.25 1.96 1.06 0.00 0.00 176.91 181.10 2rgl h GLN 285 N 0.47 0.47 -0.56 1.72 4.20 -0.92 0.12 115.11 120.60 2rgl h GLN 285 Ca 0.07 -0.03 -0.04 0.00 0.06 0.00 0.00 58.65 58.71 2rgl h GLN 285 Cb 0.73 -0.11 -0.02 0.00 0.30 0.00 0.00 27.48 28.38 2rgl h GLN 285 CO 0.05 0.31 0.19 -0.44 -0.67 0.00 0.00 178.83 178.27 2rgl h ASP 286 N 0.48 0.81 0.17 1.46 3.32 -0.87 -2.42 116.42 119.37 2rgl h ASP 286 Ca 0.22 -0.20 -0.36 0.00 0.02 0.00 0.00 57.03 56.72 2rgl h ASP 286 Cb 0.14 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.45 2rgl h ASP 286 CO -0.16 0.79 -1.97 0.18 -1.72 0.00 0.00 179.24 176.36 2rgl n LEU 287 N -4.45 2.38 0.03 1.55 4.77 -0.17 -4.38 117.00 116.74 2rgl n LEU 287 Ca 0.03 0.23 -0.03 0.00 -0.03 0.00 0.00 56.01 56.21 2rgl n LEU 287 Cb 0.19 -0.92 -0.09 0.00 -2.33 0.00 0.00 43.42 40.28 2rgl n LEU 287 CO 0.39 0.79 -0.22 0.58 -1.33 0.00 0.00 177.39 177.60 2rgl h VAL 288 N 0.06 0.76 0.00 4.08 2.07 -0.90 -3.49 116.25 118.83 2rgl h VAL 288 Ca -0.41 -2.36 0.00 0.00 0.82 0.00 0.00 66.70 64.75 2rgl h VAL 288 Cb 2.03 2.27 0.00 0.00 -1.52 0.00 0.00 31.29 34.07 2rgl h VAL 288 CO 0.08 0.43 0.00 0.29 0.02 0.00 0.00 177.57 178.39 2rgl n LYS 289 N -3.02 0.00 0.00 1.57 5.02 -0.91 -2.27 118.16 118.55 2rgl n LYS 289 Ca -0.09 0.00 0.13 0.00 -2.02 0.00 0.00 58.31 56.33 2rgl n LYS 289 Cb 0.90 0.00 0.67 0.00 -0.02 0.00 0.00 35.03 36.57 2rgl n LYS 289 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 2rgl n ASP 290 N 5.55 0.00 0.14 4.39 10.43 -1.26 -1.81 116.55 133.99 2rgl n ASP 290 Ca 0.00 -0.13 0.13 0.00 2.57 0.00 0.00 54.79 57.36 2rgl n ASP 290 Cb 0.00 -0.27 0.41 0.00 1.84 0.00 0.00 41.12 43.10 2rgl n ASP 290 CO 0.00 0.00 0.00 0.03 -1.07 0.00 0.00 177.20 176.16 2rgl h ARG 291 N 0.00 0.00 -5.26 -1.24 3.08 -1.83 -3.42 114.38 105.71 2rgl h ARG 291 Ca 0.00 0.00 -0.64 0.00 0.07 0.00 0.00 59.98 59.41 2rgl h ARG 291 Cb 0.23 0.00 -0.15 0.00 0.08 0.00 0.00 29.97 30.13 2rgl h ARG 291 CO 0.00 0.00 -0.04 -1.17 -1.07 0.00 0.00 179.97 177.69 2rgl s LEU 292 N -4.85 4.32 0.74 3.04 2.96 -0.75 -4.73 118.68 119.40 2rgl s LEU 292 Ca 0.08 0.03 -0.15 0.00 -0.22 0.00 0.00 54.13 53.86 2rgl s LEU 292 Cb 0.10 -2.60 0.04 0.00 0.50 0.00 0.00 46.19 44.23 2rgl s LEU 292 CO 0.56 -0.47 1.19 -2.65 -1.32 0.00 0.00 176.35 173.67 2rgl n PRO 293 N 5.74 0.57 -3.91 0.98 -0.02 -1.26 -4.92 135.00 132.18 2rgl n PRO 293 Ca -0.05 0.26 -0.35 0.00 -2.02 0.00 0.00 63.50 61.34 2rgl n PRO 293 Cb 0.49 -2.43 -0.10 0.00 -0.02 0.00 0.00 33.50 31.44 2rgl n PRO 293 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 2rgl s LYS 294 N -3.71 3.96 0.19 -0.52 3.01 -1.26 -5.03 119.74 116.37 2rgl s LYS 294 Ca 0.77 -0.34 -0.30 0.00 -1.01 0.00 0.00 55.97 55.08 2rgl s LYS 294 Cb -0.33 -3.29 -0.09 0.00 -1.01 0.00 0.00 37.83 33.11 2rgl s LYS 294 CO 0.47 0.19 1.31 -0.06 0.51 0.00 0.00 175.35 177.76 2rgl s PHE 295 N 0.63 3.27 0.83 3.18 0.08 -1.26 -5.04 117.98 119.67 2rgl s PHE 295 Ca 0.04 1.21 -0.11 0.00 0.12 0.00 0.00 56.93 58.20 2rgl s PHE 295 Cb -0.13 -3.60 0.09 0.00 -0.57 0.00 0.00 43.02 38.82 2rgl s PHE 295 CO 0.01 -1.87 1.10 0.95 -0.10 0.00 0.00 175.22 175.32 2rgl s THR 296 N 0.20 2.90 0.31 0.64 -4.23 -1.26 -4.76 115.64 109.44 2rgl s THR 296 Ca 0.57 0.29 0.08 0.00 -1.18 0.00 0.00 61.69 61.45 2rgl s THR 296 Cb -0.36 -2.65 0.31 0.00 1.34 0.00 0.00 72.50 71.14 2rgl s THR 296 CO 0.37 -0.38 1.75 -0.65 -0.54 0.00 0.00 174.62 175.18 2rgl h PRO 297 N -1.41 0.64 -0.23 3.99 0.11 -1.99 0.07 132.00 133.19 2rgl h PRO 297 Ca -0.45 -0.04 -0.08 0.00 0.11 0.00 0.00 66.00 65.55 2rgl h PRO 297 Cb 1.25 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 32.21 2rgl h PRO 297 CO 0.49 0.43 -0.16 0.93 -0.21 0.00 0.00 178.00 179.48 2rgl h GLU 298 N 0.66 0.52 -0.33 1.05 3.07 -1.99 -1.42 114.58 116.14 2rgl h GLU 298 Ca 0.61 -0.24 -0.01 0.00 -0.50 0.00 0.00 59.36 59.22 2rgl h GLU 298 Cb 1.08 -0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 28.97 2rgl h GLU 298 CO -0.43 0.81 0.16 1.96 -1.40 0.00 0.00 179.01 180.11 2rgl h GLN 299 N 0.22 0.48 -0.98 2.33 4.20 -1.82 -1.27 115.11 118.27 2rgl h GLN 299 Ca 0.05 -0.07 0.03 0.00 0.06 0.00 0.00 58.65 58.71 2rgl h GLN 299 Cb 0.68 -0.09 -0.05 0.00 0.30 0.00 0.00 27.48 28.32 2rgl h GLN 299 CO 0.04 0.45 0.64 0.00 -0.67 0.00 0.00 178.83 179.29 2rgl h ALA 300 N 1.01 1.27 -0.03 3.87 0.00 -0.94 -0.20 119.26 124.25 2rgl h ALA 300 Ca 0.11 -0.05 -0.09 0.00 0.00 0.00 0.00 54.91 54.89 2rgl h ALA 300 Cb 0.12 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 2rgl h ALA 300 CO -0.01 0.56 -0.39 -0.09 0.00 0.00 0.00 179.25 179.32 2rgl h ARG 301 N 1.27 0.05 -0.22 0.00 9.65 -0.97 0.14 114.38 124.29 2rgl h ARG 301 Ca 0.38 -0.02 -0.18 0.00 -1.10 0.00 0.00 59.98 59.05 2rgl h ARG 301 Cb -0.06 -0.00 -0.00 0.00 -1.39 0.00 0.00 29.97 28.52 2rgl h ARG 301 CO -0.11 0.43 -0.60 1.25 2.80 0.00 0.00 179.97 183.75 2rgl h LEU 302 N 0.05 0.83 0.03 3.80 5.85 -0.42 -3.33 115.31 122.12 2rgl h LEU 302 Ca 0.00 -0.46 -0.16 0.00 0.84 0.00 0.00 57.88 58.10 2rgl h LEU 302 Cb 0.71 -0.24 0.01 0.00 0.37 0.00 0.00 40.66 41.51 2rgl h LEU 302 CO 0.05 1.23 -0.63 0.58 -0.34 0.00 0.00 178.44 179.34 2rgl h VAL 303 N 0.55 1.46 -2.53 1.05 2.07 -0.79 -3.39 116.25 114.66 2rgl h VAL 303 Ca -0.00 -2.18 -0.53 0.00 0.82 0.00 0.00 66.70 64.81 2rgl h VAL 303 Cb 1.19 2.76 0.05 0.00 -1.52 0.00 0.00 31.29 33.76 2rgl h VAL 303 CO 0.12 0.63 1.09 1.17 0.02 0.00 0.00 177.57 180.60 2rgl n LYS 304 N -4.21 2.80 -0.98 1.57 4.81 0.46 -2.14 118.16 120.46 2rgl n LYS 304 Ca -0.11 1.02 0.00 0.00 -0.87 0.00 0.00 58.31 58.34 2rgl n LYS 304 Cb 0.70 -2.90 0.00 0.00 0.02 0.00 0.00 35.03 32.85 2rgl n LYS 304 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2rgl n GLY 305 N 4.17 0.55 0.07 3.14 0.00 0.22 -4.90 105.19 108.45 2rgl n GLY 305 Ca 0.18 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.27 2rgl n GLY 305 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2rgl n SER 306 N -0.09 0.22 -4.12 1.61 3.41 -0.91 -4.67 113.62 109.07 2rgl n SER 306 Ca 0.00 -1.57 -0.33 0.00 -0.26 0.00 0.00 58.87 56.71 2rgl n SER 306 Cb 0.05 -0.02 -0.16 0.00 -0.26 0.00 0.00 64.21 63.82 2rgl n SER 306 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2rgl s ALA 307 N -1.97 2.35 0.24 7.33 0.00 -1.26 -4.84 121.76 123.61 2rgl s ALA 307 Ca 0.23 -1.27 0.22 0.00 0.00 0.00 0.00 51.96 51.14 2rgl s ALA 307 Cb 0.11 -1.22 0.96 0.00 0.00 0.00 0.00 23.12 22.97 2rgl s ALA 307 CO 0.18 -0.43 1.86 -0.44 0.00 0.00 0.00 175.76 176.93 2rgl h ASP 308 N 7.92 0.00 -5.08 0.00 3.32 -1.33 -3.45 116.42 117.80 2rgl h ASP 308 Ca -0.43 0.00 -0.04 0.00 0.02 0.00 0.00 57.03 56.58 2rgl h ASP 308 Cb 1.13 0.00 -0.12 0.00 0.22 0.00 0.00 39.33 40.56 2rgl h ASP 308 CO 0.62 0.26 -0.02 -0.72 -1.72 0.00 0.00 179.24 177.66 2rgl s TYR 309 N -3.83 -0.17 -0.27 4.55 -0.85 -1.26 -4.75 117.35 110.78 2rgl s TYR 309 Ca -0.01 -0.15 -0.05 0.00 -0.52 0.00 0.00 57.07 56.34 2rgl s TYR 309 Cb 0.12 0.32 0.01 0.00 0.38 0.00 0.00 41.96 42.78 2rgl s TYR 309 CO 0.65 -0.80 0.02 0.42 -1.52 0.00 0.00 175.55 174.32 2rgl s ILE 310 N -3.83 3.59 -0.08 -3.49 -1.09 -0.02 -3.62 121.20 112.66 2rgl s ILE 310 Ca 0.06 -0.73 -0.30 0.00 -2.23 0.00 0.00 60.65 57.45 2rgl s ILE 310 Cb 0.01 -2.81 -0.02 0.00 -1.58 0.00 0.00 42.46 38.06 2rgl s ILE 310 CO -0.08 0.17 1.07 -0.83 -1.23 0.00 0.00 174.94 174.04 2rgl s GLY 311 N 1.45 2.32 -0.21 6.18 0.00 0.53 -0.90 107.32 116.69 2rgl s GLY 311 Ca 0.03 0.47 -0.03 0.00 0.00 0.00 0.00 44.72 45.18 2rgl s GLY 311 CO -0.00 1.99 -0.08 -0.42 0.00 0.00 0.00 173.10 174.59 2rgl s ILE 312 N 1.99 3.08 -0.46 0.90 -1.09 0.56 0.24 121.20 126.42 2rgl s ILE 312 Ca 0.51 -0.61 -0.22 0.00 -2.23 0.00 0.00 60.65 58.10 2rgl s ILE 312 Cb -0.21 -2.39 0.03 0.00 -1.58 0.00 0.00 42.46 38.31 2rgl s ILE 312 CO 0.20 0.44 0.75 0.20 -1.23 0.00 0.00 174.94 175.30 2rgl s ASN 313 N 1.43 6.37 -0.16 3.58 0.01 0.33 -1.07 114.94 125.44 2rgl s ASN 313 Ca 0.05 -0.25 0.01 0.00 -0.71 0.00 0.00 52.86 51.96 2rgl s ASN 313 Cb -0.14 -2.37 0.01 0.00 0.41 0.00 0.00 41.25 39.16 2rgl s ASN 313 CO -0.05 -0.91 -0.17 -1.58 -1.51 0.00 0.00 177.10 172.87 2rgl s GLN 314 N 3.20 3.13 0.00 -0.60 -0.44 -0.56 -1.47 119.66 122.93 2rgl s GLN 314 Ca 0.27 -0.78 0.00 0.00 -2.50 0.00 0.00 55.36 52.35 2rgl s GLN 314 Cb -0.13 -2.60 0.00 0.00 -1.64 0.00 0.00 33.01 28.64 2rgl s GLN 314 CO 0.21 -0.06 0.00 0.66 0.50 0.00 0.00 175.29 176.60 2rgl n TYR 315 N 4.24 0.00 -3.91 1.67 4.02 -1.26 -4.26 117.16 117.66 2rgl n TYR 315 Ca -0.20 0.00 -0.09 0.00 -0.01 0.00 0.00 57.90 57.60 2rgl n TYR 315 Cb 0.51 0.10 -0.02 0.00 -0.02 0.00 0.00 39.34 39.90 2rgl n TYR 315 CO 0.00 0.00 0.00 -2.37 -1.01 0.00 0.00 176.86 173.48 2rgl n THR 316 N -2.60 0.00 -3.82 -0.72 5.66 -1.26 -4.65 114.28 106.89 2rgl n THR 316 Ca 0.00 -1.14 -0.11 0.00 -3.05 0.00 0.00 64.05 59.75 2rgl n THR 316 Cb 0.35 0.68 -0.09 0.00 -1.55 0.00 0.00 70.33 69.72 2rgl n THR 316 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2rgl s ALA 317 N -2.38 -0.50 0.03 1.79 0.00 -1.26 -1.16 121.76 118.27 2rgl s ALA 317 Ca 0.19 -0.07 0.02 0.00 0.00 0.00 0.00 51.96 52.10 2rgl s ALA 317 Cb -0.00 0.20 -0.02 0.00 0.00 0.00 0.00 23.12 23.30 2rgl s ALA 317 CO 0.13 -0.31 -0.07 -1.12 0.00 0.00 0.00 175.76 174.39 2rgl s SER 318 N -1.75 0.81 0.27 0.00 0.01 0.09 -4.85 113.70 108.29 2rgl s SER 318 Ca -0.09 -0.40 -0.29 0.00 1.31 0.00 0.00 55.95 56.48 2rgl s SER 318 Cb -0.03 -0.00 -0.09 0.00 0.21 0.00 0.00 66.02 66.10 2rgl s SER 318 CO -0.01 -0.10 0.98 -0.31 0.41 0.00 0.00 173.24 174.21 2rgl s TYR 319 N -0.94 3.81 -0.06 2.43 2.02 -0.96 -0.90 117.35 122.74 2rgl s TYR 319 Ca -0.05 1.83 0.05 0.00 -0.37 0.00 0.00 57.07 58.53 2rgl s TYR 319 Cb -0.07 -3.05 -0.01 0.00 -0.40 0.00 0.00 41.96 38.43 2rgl s TYR 319 CO 0.00 0.13 -0.24 -1.64 -1.57 0.00 0.00 175.55 172.23 2rgl s MET 320 N -1.46 2.55 -0.06 -0.62 -1.94 0.38 -1.74 119.30 116.41 2rgl s MET 320 Ca 0.44 -0.86 0.03 0.00 -1.71 0.00 0.00 55.69 53.60 2rgl s MET 320 Cb -0.26 -2.11 -0.02 0.00 2.01 0.00 0.00 34.83 34.45 2rgl s MET 320 CO 0.32 0.32 -0.14 0.21 -0.01 0.00 0.00 175.02 175.72 2rgl s LYS 321 N -0.02 2.62 0.08 2.03 2.20 0.13 -0.61 119.74 126.17 2rgl s LYS 321 Ca -0.07 -0.70 0.00 0.00 -0.36 0.00 0.00 55.97 54.84 2rgl s LYS 321 Cb -0.14 -2.41 0.01 0.00 -1.51 0.00 0.00 37.83 33.78 2rgl s LYS 321 CO 0.05 0.56 0.11 0.41 -0.36 0.00 0.00 175.35 176.11 2rgl n GLY 322 N 2.49 1.06 3.59 5.54 0.00 -1.25 -1.43 105.19 115.19 2rgl n GLY 322 Ca -0.17 -2.01 -0.04 0.00 0.00 0.00 0.00 46.02 43.79 2rgl n GLY 322 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2rgl s GLN 323 N -2.58 0.51 0.09 1.61 -2.07 -1.26 -4.83 119.66 111.12 2rgl s GLN 323 Ca 0.07 -0.22 -0.30 0.00 -1.82 0.00 0.00 55.36 53.09 2rgl s GLN 323 Cb -0.00 0.22 -0.06 0.00 -1.09 0.00 0.00 33.01 32.07 2rgl s GLN 323 CO 0.05 -0.23 1.19 -1.14 -1.32 0.00 0.00 175.29 173.84 2rgl s GLN 324 N -2.65 4.45 0.09 9.60 -0.44 -1.26 -4.96 119.66 124.50 2rgl s GLN 324 Ca 0.09 1.78 -0.31 0.00 -2.50 0.00 0.00 55.36 54.42 2rgl s GLN 324 Cb -0.00 -3.33 -0.09 0.00 -1.64 0.00 0.00 33.01 27.95 2rgl s GLN 324 CO -0.05 -0.21 1.75 -0.51 0.50 0.00 0.00 175.29 176.78 2rgl s LEU 325 N 0.78 4.38 0.03 3.68 1.43 -1.26 -4.99 118.68 122.73 2rgl s LEU 325 Ca 0.57 2.62 0.06 0.00 -1.03 0.00 0.00 54.13 56.35 2rgl s LEU 325 Cb -0.30 -3.56 -0.03 0.00 0.03 0.00 0.00 46.19 42.33 2rgl s LEU 325 CO 0.31 -0.95 -0.14 -0.04 0.23 0.00 0.00 176.35 175.75 2rgl s MET 326 N 2.81 2.25 -0.09 1.70 -1.94 -1.26 -5.09 119.30 117.67 2rgl s MET 326 Ca 0.78 -0.89 -0.30 0.00 -1.71 0.00 0.00 55.69 53.58 2rgl s MET 326 Cb -0.43 -2.30 -0.04 0.00 2.01 0.00 0.00 34.83 34.08 2rgl s MET 326 CO 0.35 0.56 1.50 -1.14 -0.01 0.00 0.00 175.02 176.28 2rgl s GLN 327 N -1.41 4.20 -0.00 2.03 2.00 -1.26 -5.00 119.66 120.22 2rgl s GLN 327 Ca 0.15 1.99 0.01 0.00 -2.00 0.00 0.00 55.36 55.52 2rgl s GLN 327 Cb -0.11 -3.89 -0.00 0.00 0.80 0.00 0.00 33.01 29.81 2rgl s GLN 327 CO 0.06 -0.78 -0.04 -0.65 -0.50 0.00 0.00 175.29 173.37 2rgl s GLN 328 N 3.76 0.34 0.13 1.67 -0.21 -1.26 -5.11 119.66 118.98 2rgl s GLN 328 Ca 0.66 -0.16 -0.31 0.00 0.02 0.00 0.00 55.36 55.57 2rgl s GLN 328 Cb -0.29 -0.33 -0.10 0.00 1.00 0.00 0.00 33.01 33.29 2rgl s GLN 328 CO 0.24 0.09 1.80 0.99 -2.12 0.00 0.00 175.29 176.29 2rgl s THR 329 N -0.12 2.53 0.25 -0.19 2.01 -1.26 -4.94 115.64 113.92 2rgl s THR 329 Ca 0.01 0.09 -0.30 0.00 0.31 0.00 0.00 61.69 61.80 2rgl s THR 329 Cb -0.02 -3.06 -0.11 0.00 0.01 0.00 0.00 72.50 69.33 2rgl s THR 329 CO -0.00 0.00 1.52 -2.84 -0.69 0.00 0.00 174.62 172.61 2rgl s PRO 330 N 2.58 4.21 0.00 4.92 0.02 -1.26 -4.92 135.00 140.55 2rgl s PRO 330 Ca 0.80 2.41 0.00 0.00 0.02 0.00 0.00 61.00 64.22 2rgl s PRO 330 Cb -0.46 -3.09 0.00 0.00 0.02 0.00 0.00 34.50 30.97 2rgl s PRO 330 CO 0.36 -0.53 0.00 0.25 -0.33 0.00 0.00 177.00 176.75 2rgl n THR 331 N 2.59 0.00 -3.54 0.99 -2.24 -1.26 -4.94 114.28 105.88 2rgl n THR 331 Ca 0.09 0.00 -0.08 0.00 -2.27 0.00 0.00 64.05 61.79 2rgl n THR 331 Cb 0.39 -0.49 -0.02 0.00 -2.10 0.00 0.00 70.33 68.11 2rgl n THR 331 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2rgl s SER 332 N -3.73 -0.36 0.20 3.42 1.04 -1.26 -3.16 113.70 109.85 2rgl s SER 332 Ca 0.00 -0.08 -0.11 0.00 0.48 0.00 0.00 55.95 56.24 2rgl s SER 332 Cb 0.00 0.44 0.25 0.00 0.10 0.00 0.00 66.02 66.81 2rgl s SER 332 CO 0.00 -0.73 1.71 0.22 0.98 0.00 0.00 173.24 175.42 2rgl h TYR 333 N 2.00 0.17 -0.54 5.02 3.20 -1.69 -1.50 116.97 123.63 2rgl h TYR 333 Ca -0.24 0.03 0.06 0.00 3.14 0.00 0.00 58.73 61.72 2rgl h TYR 333 Cb 1.25 0.01 -0.05 0.00 1.54 0.00 0.00 36.73 39.48 2rgl h TYR 333 CO 0.28 -0.03 0.25 0.77 -1.64 0.00 0.00 178.16 177.79 2rgl h SER 334 N 0.24 0.34 1.55 -2.11 0.02 -1.96 -2.63 113.55 109.01 2rgl h SER 334 Ca 0.29 0.04 0.00 0.00 -0.84 0.00 0.00 61.79 61.28 2rgl h SER 334 Cb 0.41 -0.02 0.00 0.00 0.14 0.00 0.00 62.40 62.93 2rgl h SER 334 CO -0.38 0.23 0.00 0.00 -1.14 0.00 0.00 176.83 175.55 2rgl h ALA 335 N 1.31 1.00 0.00 3.77 0.00 -1.88 -3.19 119.26 120.26 2rgl h ALA 335 Ca 0.25 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.14 2rgl h ALA 335 Cb 0.19 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.98 2rgl h ALA 335 CO -0.19 0.00 -0.10 -0.44 0.00 0.00 0.00 179.25 178.52 2rgl h ASP 336 N 0.00 0.00 0.31 0.00 3.32 -0.88 -2.82 116.42 116.34 2rgl h ASP 336 Ca 0.00 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 57.00 2rgl h ASP 336 Cb 0.77 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.32 2rgl h ASP 336 CO 0.00 0.10 -0.25 -0.50 -1.72 0.00 0.00 179.24 176.87 2rgl h TRP 337 N 0.00 0.00 -6.17 4.55 4.06 -1.63 -3.48 115.95 113.28 2rgl h TRP 337 Ca -0.00 0.00 -0.42 0.00 2.06 0.00 0.00 58.89 60.52 2rgl h TRP 337 Cb 0.22 0.00 0.06 0.00 -1.00 0.00 0.00 29.16 28.44 2rgl h TRP 337 CO 0.00 0.25 -0.89 1.04 -3.56 0.00 0.00 178.44 175.28 2rgl n GLN 338 N -4.09 -2.75 -4.31 0.49 6.02 -1.07 -4.84 117.38 106.83 2rgl n GLN 338 Ca -0.02 0.53 -0.17 0.00 -0.01 0.00 0.00 57.00 57.33 2rgl n GLN 338 Cb 0.31 -4.65 -0.10 0.00 1.02 0.00 0.00 30.24 26.82 2rgl n GLN 338 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 177.06 176.19 2rgl s VAL 339 N -3.61 1.24 -0.19 5.09 -7.23 -1.26 -4.63 120.40 109.81 2rgl s VAL 339 Ca 0.25 -2.08 0.01 0.00 -1.81 0.00 0.00 61.98 58.35 2rgl s VAL 339 Cb -0.08 -2.12 0.04 0.00 0.56 0.00 0.00 36.38 34.78 2rgl s VAL 339 CO 0.84 -0.53 -0.11 -0.89 -0.31 0.00 0.00 175.10 174.10 2rgl s THR 340 N -3.28 1.63 0.30 5.32 2.01 -0.52 -5.00 115.64 116.10 2rgl s THR 340 Ca 0.23 -0.91 -0.29 0.00 0.31 0.00 0.00 61.69 61.03 2rgl s THR 340 Cb 0.03 -1.66 -0.10 0.00 0.01 0.00 0.00 72.50 70.79 2rgl s THR 340 CO 0.06 0.25 1.23 -0.31 -0.69 0.00 0.00 174.62 175.15 2rgl s TYR 341 N 1.42 3.27 -0.02 4.92 1.51 -1.26 -0.69 117.35 126.49 2rgl s TYR 341 Ca 0.00 1.52 -0.01 0.00 -1.01 0.00 0.00 57.07 57.57 2rgl s TYR 341 Cb -0.15 -3.52 0.02 0.00 -0.11 0.00 0.00 41.96 38.20 2rgl s TYR 341 CO -0.09 -1.35 0.04 0.08 -1.11 0.00 0.00 175.55 173.12 2rgl s VAL 342 N -1.07 -0.04 -0.45 0.71 1.01 -0.71 -4.90 120.40 114.95 2rgl s VAL 342 Ca 0.48 0.13 0.12 0.00 0.00 0.00 0.00 61.98 62.71 2rgl s VAL 342 Cb -0.37 -0.08 0.32 0.00 0.00 0.00 0.00 36.38 36.25 2rgl s VAL 342 CO 0.47 0.05 1.25 0.49 0.00 0.00 0.00 175.10 177.37 2rgl n PHE 343 N 3.77 0.48 -4.02 5.22 3.72 -1.26 -2.26 117.46 123.10 2rgl n PHE 343 Ca -0.22 -0.67 -0.13 0.00 -0.05 0.00 0.00 57.45 56.38 2rgl n PHE 343 Cb 0.54 -0.13 -0.13 0.00 -0.94 0.00 0.00 39.48 38.82 2rgl n PHE 343 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2rgl s ALA 344 N -1.76 0.28 -0.01 4.37 0.00 -1.26 -1.90 121.76 121.48 2rgl s ALA 344 Ca 0.26 -0.34 0.02 0.00 0.00 0.00 0.00 51.96 51.89 2rgl s ALA 344 Cb 0.18 0.00 0.00 0.00 0.00 0.00 0.00 23.12 23.31 2rgl s ALA 344 CO 0.10 0.00 -0.05 0.21 0.00 0.00 0.00 175.76 176.02 2rgl s LYS 345 N -0.64 0.53 -1.52 0.00 2.20 -0.38 -4.85 119.74 115.09 2rgl s LYS 345 Ca -0.04 -0.16 -0.13 0.00 -0.36 0.00 0.00 55.97 55.28 2rgl s LYS 345 Cb -0.05 -0.54 0.09 0.00 -1.51 0.00 0.00 37.83 35.83 2rgl s LYS 345 CO -0.00 0.06 0.87 0.09 -0.36 0.00 0.00 175.35 176.01 2rgl n ASN 346 N 3.28 -4.61 0.00 1.43 3.02 -1.26 -1.58 115.26 115.54 2rgl n ASN 346 Ca -0.17 -0.71 0.00 0.00 -0.03 0.00 0.00 54.58 53.67 2rgl n ASN 346 Cb 0.56 -3.71 0.00 0.00 -0.61 0.00 0.00 39.78 36.02 2rgl n ASN 346 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2rgl n GLY 347 N -1.57 0.69 3.42 7.41 0.00 -1.26 -5.02 105.19 108.85 2rgl n GLY 347 Ca 0.03 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.73 2rgl n GLY 347 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2rgl s LYS 348 N -0.25 2.38 0.61 1.61 -0.14 -0.62 -5.11 119.74 118.22 2rgl s LYS 348 Ca 0.00 -0.78 -0.18 0.00 -1.36 0.00 0.00 55.97 53.65 2rgl s LYS 348 Cb 0.00 -2.26 -0.03 0.00 -1.68 0.00 0.00 37.83 33.86 2rgl s LYS 348 CO 0.00 0.60 1.21 -2.14 -0.76 0.00 0.00 175.35 174.26 2rgl s PRO 349 N -0.67 2.88 0.42 -1.68 0.02 -1.26 -1.24 135.00 133.45 2rgl s PRO 349 Ca 0.11 1.82 0.12 0.00 0.02 0.00 0.00 61.00 63.07 2rgl s PRO 349 Cb -0.10 -1.92 0.97 0.00 0.02 0.00 0.00 34.50 33.46 2rgl s PRO 349 CO 0.00 -1.28 1.97 0.97 -0.33 0.00 0.00 177.00 178.33 2rgl h ILE 350 N 0.75 0.91 -1.73 2.83 2.10 -1.75 -3.46 117.51 117.16 2rgl h ILE 350 Ca -0.50 -0.17 0.26 0.00 1.08 0.00 0.00 64.86 65.53 2rgl h ILE 350 Cb 1.30 0.38 -0.13 0.00 -1.09 0.00 0.00 36.82 37.28 2rgl h ILE 350 CO 0.55 0.09 0.72 -0.83 -1.08 0.00 0.00 178.15 177.59 2rgl s GLY 351 N -3.75 -0.35 0.77 8.18 0.00 -1.26 -4.80 107.32 106.12 2rgl s GLY 351 Ca -0.08 0.76 -0.11 0.00 0.00 0.00 0.00 44.72 45.29 2rgl s GLY 351 CO 0.76 0.19 1.09 2.56 0.00 0.00 0.00 173.10 177.69 2rgl s PRO 352 N -2.68 2.26 -0.03 2.90 0.04 -1.26 -4.64 135.00 131.59 2rgl s PRO 352 Ca 0.12 1.08 -0.07 0.00 0.04 0.00 0.00 61.00 62.17 2rgl s PRO 352 Cb 0.02 -1.90 -0.05 0.00 0.04 0.00 0.00 34.50 32.61 2rgl s PRO 352 CO -0.03 -1.61 0.24 -0.65 0.04 0.00 0.00 177.00 174.98 2rgl s GLN 353 N -4.94 3.56 0.00 4.56 -0.21 -1.26 0.08 119.66 121.45 2rgl s GLN 353 Ca 0.61 -0.07 0.00 0.00 0.02 0.00 0.00 55.36 55.92 2rgl s GLN 353 Cb -0.17 -3.12 0.00 0.00 1.00 0.00 0.00 33.01 30.72 2rgl s GLN 353 CO 0.56 0.69 0.00 0.00 -2.12 0.00 0.00 175.29 174.42 2rgl n ALA 354 N 1.38 0.00 -0.13 6.09 0.00 -0.37 -4.92 120.51 122.56 2rgl n ALA 354 Ca -0.14 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.19 2rgl n ALA 354 Cb 0.53 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.96 2rgl n ALA 354 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 177.50 176.53 2rgl h ASN 355 N 0.00 0.84 -3.04 0.00 -1.24 -1.73 -3.43 115.58 106.99 2rgl h ASN 355 Ca 0.00 -0.40 -0.53 0.00 0.71 0.00 0.00 56.30 56.07 2rgl h ASN 355 Cb 0.00 -0.23 0.01 0.00 0.73 0.00 0.00 38.32 38.83 2rgl h ASN 355 CO 0.00 1.06 0.70 -0.44 -1.29 0.00 0.00 177.43 177.46 2rgl s SER 356 N -6.53 6.92 0.44 1.15 0.01 -1.26 -4.92 113.70 109.51 2rgl s SER 356 Ca -0.12 2.16 0.12 0.00 1.31 0.00 0.00 55.95 59.42 2rgl s SER 356 Cb 0.10 -2.58 1.01 0.00 0.21 0.00 0.00 66.02 64.77 2rgl s SER 356 CO 0.84 -0.61 2.04 0.78 0.41 0.00 0.00 173.24 176.70 2rgl h ASN 357 N 7.07 0.34 1.31 2.44 2.35 -1.99 -1.24 115.58 125.85 2rgl h ASN 357 Ca -0.41 -0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.34 2rgl h ASN 357 Cb 1.20 -0.08 0.00 0.00 0.05 0.00 0.00 38.32 39.50 2rgl h ASN 357 CO 0.86 0.23 0.00 4.11 -1.65 0.00 0.00 177.43 180.97 2rgl h TRP 358 N 0.39 0.00 -2.99 1.19 5.08 -1.95 -3.43 115.95 114.24 2rgl h TRP 358 Ca 0.18 0.00 -0.72 0.00 1.08 0.00 0.00 58.89 59.42 2rgl h TRP 358 Cb 0.21 0.00 -0.21 0.00 -3.00 0.00 0.00 29.16 26.16 2rgl h TRP 358 CO -0.00 0.00 0.39 -1.17 -1.28 0.00 0.00 178.44 176.38 2rgl s LEU 359 N -4.92 5.66 -0.11 0.11 0.20 -0.47 -4.92 118.68 114.23 2rgl s LEU 359 Ca 0.07 -2.04 -0.19 0.00 0.69 0.00 0.00 54.13 52.66 2rgl s LEU 359 Cb 0.10 -2.31 -0.04 0.00 -0.43 0.00 0.00 46.19 43.51 2rgl s LEU 359 CO 0.55 -0.94 0.52 -0.31 -0.29 0.00 0.00 176.35 175.88 2rgl s TYR 360 N 1.95 3.52 -0.65 5.38 1.51 -1.26 -1.23 117.35 126.56 2rgl s TYR 360 Ca 0.22 0.96 -0.27 0.00 -1.01 0.00 0.00 57.07 56.96 2rgl s TYR 360 Cb -0.12 -2.60 0.02 0.00 -0.11 0.00 0.00 41.96 39.15 2rgl s TYR 360 CO -0.04 0.15 1.32 0.42 -1.11 0.00 0.00 175.55 176.29 2rgl s ILE 361 N 0.68 3.79 -0.41 2.71 1.01 0.11 -4.39 121.20 124.70 2rgl s ILE 361 Ca 0.28 0.59 0.02 0.00 0.00 0.00 0.00 60.65 61.54 2rgl s ILE 361 Cb -0.16 -4.70 0.15 0.00 0.01 0.00 0.00 42.46 37.77 2rgl s ILE 361 CO 0.12 -1.51 0.29 -0.69 0.00 0.00 0.00 174.94 173.15 2rgl s VAL 362 N 5.81 0.59 0.41 2.92 1.01 -1.26 -4.15 120.40 125.74 2rgl s VAL 362 Ca 0.43 -2.38 0.08 0.00 0.00 0.00 0.00 61.98 60.11 2rgl s VAL 362 Cb -0.09 -1.42 0.24 0.00 0.00 0.00 0.00 36.38 35.11 2rgl s VAL 362 CO 0.20 -1.08 2.02 -0.65 0.00 0.00 0.00 175.10 175.60 2rgl h PRO 363 N 6.32 0.43 0.00 2.72 0.11 -1.91 -1.60 132.00 138.07 2rgl h PRO 363 Ca 0.14 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.20 2rgl h PRO 363 Cb 0.92 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 31.95 2rgl h PRO 363 CO 0.37 0.35 0.00 0.11 -0.21 0.00 0.00 178.00 178.61 2rgl h TRP 364 N 0.44 0.00 -0.12 0.65 5.08 -1.95 -2.30 115.95 117.75 2rgl h TRP 364 Ca 0.11 0.00 -0.02 0.00 1.08 0.00 0.00 58.89 60.06 2rgl h TRP 364 Cb 0.06 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 26.21 2rgl h TRP 364 CO 0.00 0.00 -0.03 0.78 -1.28 0.00 0.00 178.44 177.91 2rgl h GLY 365 N 1.03 0.18 0.90 11.11 0.00 -1.62 -0.09 103.07 114.57 2rgl h GLY 365 Ca 0.00 -0.08 -0.03 0.00 0.00 0.00 0.00 47.33 47.22 2rgl h GLY 365 CO 0.00 0.08 0.08 1.98 0.00 0.00 0.00 176.54 178.69 2rgl h MET 366 N 0.16 0.46 -0.48 4.80 1.85 -1.56 -0.79 114.93 119.37 2rgl h MET 366 Ca 0.04 -0.10 -0.00 0.00 -0.61 0.00 0.00 59.70 59.02 2rgl h MET 366 Cb 0.17 -0.06 -0.02 0.00 0.43 0.00 0.00 31.60 32.12 2rgl h MET 366 CO 0.01 0.52 0.28 -0.92 -0.40 0.00 0.00 176.91 176.40 2rgl h TYR 367 N 0.31 0.63 -0.18 1.39 3.20 -1.59 -2.61 116.97 118.13 2rgl h TYR 367 Ca 0.09 -0.01 0.05 0.00 3.14 0.00 0.00 58.73 62.01 2rgl h TYR 367 Cb 0.26 -0.21 -0.07 0.00 1.54 0.00 0.00 36.73 38.26 2rgl h TYR 367 CO 0.01 0.45 -0.28 0.78 -1.64 0.00 0.00 178.16 177.48 2rgl h GLY 368 N 0.63 -0.30 0.90 1.82 0.00 -0.74 -0.34 103.07 105.05 2rgl h GLY 368 Ca 0.17 0.34 -0.01 0.00 0.00 0.00 0.00 47.33 47.83 2rgl h GLY 368 CO -0.03 -0.21 0.09 0.00 0.00 0.00 0.00 176.54 176.40 2rgl h VAL 370 N 0.21 1.36 -0.86 0.00 2.07 -1.35 -2.13 116.25 115.55 2rgl h VAL 370 Ca 0.07 -1.40 0.03 0.00 0.82 0.00 0.00 66.70 66.23 2rgl h VAL 370 Cb 0.16 1.93 -0.05 0.00 -1.52 0.00 0.00 31.29 31.80 2rgl h VAL 370 CO -0.01 0.41 0.56 -1.13 0.02 0.00 0.00 177.57 177.42 2rgl h ASN 371 N 0.01 0.94 -0.24 0.57 -1.24 -1.10 -1.49 115.58 113.03 2rgl h ASN 371 Ca 0.02 -0.01 -0.01 0.00 0.71 0.00 0.00 56.30 57.00 2rgl h ASN 371 Cb 0.75 -0.21 -0.01 0.00 0.73 0.00 0.00 38.32 39.57 2rgl h ASN 371 CO 0.05 0.65 0.09 0.22 -1.29 0.00 0.00 177.43 177.15 2rgl h TYR 372 N 1.10 0.37 -0.64 0.67 3.20 -1.17 -1.06 116.97 119.43 2rgl h TYR 372 Ca 0.34 -0.03 -0.02 0.00 3.14 0.00 0.00 58.73 62.16 2rgl h TYR 372 Cb -0.02 -0.11 -0.03 0.00 1.54 0.00 0.00 36.73 38.11 2rgl h TYR 372 CO -0.02 0.39 0.34 0.82 -1.64 0.00 0.00 178.16 178.05 2rgl h ILE 373 N 0.23 1.21 -0.05 1.81 2.04 -1.29 -0.66 117.51 120.81 2rgl h ILE 373 Ca 0.08 -0.55 0.03 0.00 1.00 0.00 0.00 64.86 65.42 2rgl h ILE 373 Cb 0.18 0.40 -0.04 0.00 -0.74 0.00 0.00 36.82 36.62 2rgl h ILE 373 CO -0.01 0.23 -0.19 0.50 0.00 0.00 0.00 178.15 178.69 2rgl h LYS 374 N 0.88 -0.28 -0.17 2.37 3.64 -1.10 -1.69 116.57 120.23 2rgl h LYS 374 Ca 0.22 0.02 -0.15 0.00 -1.27 0.00 0.00 60.65 59.47 2rgl h LYS 374 Cb 0.07 0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 31.94 2rgl h LYS 374 CO -0.03 -0.18 -0.53 1.96 -2.27 0.00 0.00 179.45 178.39 2rgl h GLN 375 N -0.29 0.48 0.04 1.90 1.08 -1.05 -1.59 115.11 115.68 2rgl h GLN 375 Ca 0.07 -0.29 -0.33 0.00 -1.45 0.00 0.00 58.65 56.66 2rgl h GLN 375 Cb 0.38 0.03 -0.04 0.00 -0.05 0.00 0.00 27.48 27.80 2rgl h GLN 375 CO -0.21 0.89 -1.88 1.17 -0.95 0.00 0.00 178.83 177.84 2rgl n LYS 376 N -3.96 0.68 -0.57 1.46 4.81 -0.27 -4.48 118.16 115.84 2rgl n LYS 376 Ca -0.03 0.26 0.03 0.00 -0.87 0.00 0.00 58.31 57.71 2rgl n LYS 376 Cb 0.59 -1.74 0.23 0.00 0.02 0.00 0.00 35.03 34.13 2rgl n LYS 376 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 2rgl n TYR 377 N -3.18 0.97 -2.51 5.64 4.01 -0.64 -4.95 117.16 116.50 2rgl n TYR 377 Ca -0.24 -1.17 -0.13 0.00 -0.16 0.00 0.00 57.90 56.19 2rgl n TYR 377 Cb 1.06 -0.38 0.01 0.00 -0.31 0.00 0.00 39.34 39.71 2rgl n TYR 377 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2rgl n GLY 378 N -0.82 -0.10 3.65 2.72 0.00 -1.24 -3.94 105.19 105.45 2rgl n GLY 378 Ca 0.26 -0.28 -0.27 0.00 0.00 0.00 0.00 46.02 45.73 2rgl n GLY 378 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2rgl n ASN 379 N -0.67 -4.47 -4.74 1.61 4.05 -0.60 -4.95 115.26 105.49 2rgl n ASN 379 Ca -0.11 -0.94 -0.30 0.00 0.45 0.00 0.00 54.58 53.68 2rgl n ASN 379 Cb 0.59 -3.71 0.11 0.00 1.23 0.00 0.00 39.78 38.01 2rgl n ASN 379 CO 0.00 0.00 0.00 -2.16 -3.05 0.00 0.00 177.26 172.05 2rgl s PRO 380 N -5.80 1.74 -0.03 1.20 0.04 -1.25 -4.65 135.00 126.24 2rgl s PRO 380 Ca 0.36 0.95 -0.30 0.00 0.04 0.00 0.00 61.00 62.06 2rgl s PRO 380 Cb -0.11 -1.85 -0.06 0.00 0.04 0.00 0.00 34.50 32.51 2rgl s PRO 380 CO 0.84 -1.95 1.70 0.99 0.04 0.00 0.00 177.00 178.63 2rgl s THR 381 N -2.94 3.44 -0.05 1.26 2.01 -1.26 -4.53 115.64 113.58 2rgl s THR 381 Ca 0.62 0.58 0.04 0.00 0.31 0.00 0.00 61.69 63.24 2rgl s THR 381 Cb -0.17 -3.37 -0.03 0.00 0.01 0.00 0.00 72.50 68.94 2rgl s THR 381 CO 0.56 -0.05 -0.15 -0.69 -0.69 0.00 0.00 174.62 173.61 2rgl s VAL 382 N 3.94 3.01 -0.12 3.82 1.01 0.18 -0.84 120.40 131.40 2rgl s VAL 382 Ca 0.76 -0.74 0.03 0.00 0.00 0.00 0.00 61.98 62.03 2rgl s VAL 382 Cb -0.35 -2.17 0.00 0.00 0.00 0.00 0.00 36.38 33.85 2rgl s VAL 382 CO 0.32 0.59 -0.22 -0.69 0.00 0.00 0.00 175.10 175.10 2rgl s VAL 383 N -0.71 2.17 -0.65 2.92 1.01 -0.08 -0.20 120.40 124.86 2rgl s VAL 383 Ca 0.11 -0.97 -0.27 0.00 0.00 0.00 0.00 61.98 60.85 2rgl s VAL 383 Cb -0.11 -1.85 0.02 0.00 0.00 0.00 0.00 36.38 34.44 2rgl s VAL 383 CO 0.00 0.55 1.38 -0.63 0.00 0.00 0.00 175.10 176.41 2rgl s ILE 384 N 0.53 3.74 -0.78 2.22 -1.09 -0.38 -0.33 121.20 125.11 2rgl s ILE 384 Ca -0.14 0.53 0.25 0.00 -2.23 0.00 0.00 60.65 59.06 2rgl s ILE 384 Cb -0.17 -4.62 0.03 0.00 -1.58 0.00 0.00 42.46 36.12 2rgl s ILE 384 CO 0.05 -1.45 1.36 0.35 -1.23 0.00 0.00 174.94 174.01 2rgl n THR 385 N 6.67 0.20 -3.65 2.92 -2.24 -0.23 -0.39 114.28 117.57 2rgl n THR 385 Ca 0.09 -0.16 -0.11 0.00 -2.27 0.00 0.00 64.05 61.59 2rgl n THR 385 Cb 0.49 0.01 -0.08 0.00 -2.10 0.00 0.00 70.33 68.66 2rgl n THR 385 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 2rgl s GLU 386 N -3.10 0.71 -0.28 -0.78 2.02 -1.22 -4.66 118.70 111.39 2rgl s GLU 386 Ca 0.08 1.02 -0.18 0.00 0.02 0.00 0.00 54.97 55.91 2rgl s GLU 386 Cb 0.15 0.25 0.08 0.00 0.10 0.00 0.00 34.13 34.71 2rgl s GLU 386 CO 0.71 -0.12 0.70 1.21 0.02 0.00 0.00 175.26 177.78 2rgl s ASN 387 N 0.92 -0.91 0.00 -0.19 3.04 -1.06 -1.49 114.94 115.25 2rgl s ASN 387 Ca -0.05 1.50 0.00 0.00 0.04 0.00 0.00 52.86 54.36 2rgl s ASN 387 Cb -0.05 1.40 0.00 0.00 -1.54 0.00 0.00 41.25 41.06 2rgl s ASN 387 CO -0.08 -0.24 0.00 0.61 -3.04 0.00 0.00 177.10 174.35 2rgl n GLY 388 N 4.01 -1.70 3.22 1.21 0.00 -1.25 -1.49 105.19 109.19 2rgl n GLY 388 Ca -0.19 -1.11 -0.09 0.00 0.00 0.00 0.00 46.02 44.63 2rgl n GLY 388 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 2rgl s MET 389 N -1.95 0.89 0.12 1.61 0.23 -1.26 -4.95 119.30 113.99 2rgl s MET 389 Ca 0.00 -1.02 0.08 0.00 -1.03 0.00 0.00 55.69 53.71 2rgl s MET 389 Cb 0.00 0.34 -0.04 0.00 -1.53 0.00 0.00 34.83 33.60 2rgl s MET 389 CO 0.00 -0.29 -0.11 0.16 -2.03 0.00 0.00 175.02 172.76 2rgl s ASP 390 N -2.89 4.31 0.25 -1.18 -4.77 -1.26 -4.38 116.67 106.76 2rgl s ASP 390 Ca 0.08 -0.45 0.02 0.00 -3.30 0.00 0.00 52.55 48.90 2rgl s ASP 390 Cb 0.05 -0.78 -0.03 0.00 -1.09 0.00 0.00 42.92 41.06 2rgl s ASP 390 CO -0.09 0.16 0.41 -1.10 0.70 0.00 0.00 175.17 175.25 2rgl s GLN 391 N -2.35 3.47 0.88 2.11 -0.21 -0.01 -2.05 119.66 121.51 2rgl s GLN 391 Ca 0.22 -0.52 -0.13 0.00 0.02 0.00 0.00 55.36 54.95 2rgl s GLN 391 Cb -0.11 -2.82 0.15 0.00 1.00 0.00 0.00 33.01 31.23 2rgl s GLN 391 CO 0.14 0.36 1.24 -1.25 -2.12 0.00 0.00 175.29 173.65 2rgl s PRO 392 N -3.82 1.20 0.96 2.91 0.04 -1.26 -1.71 135.00 133.32 2rgl s PRO 392 Ca 0.37 -0.29 -0.12 0.00 0.04 0.00 0.00 61.00 61.00 2rgl s PRO 392 Cb -0.10 -1.93 0.17 0.00 0.04 0.00 0.00 34.50 32.68 2rgl s PRO 392 CO 0.31 -2.03 1.09 0.00 0.04 0.00 0.00 177.00 176.40 2rgl s ALA 393 N -3.71 1.15 -0.10 8.56 0.00 -0.75 -4.41 121.76 122.50 2rgl s ALA 393 Ca 0.69 -0.21 0.00 0.00 0.00 0.00 0.00 51.96 52.44 2rgl s ALA 393 Cb -0.07 -3.16 0.00 0.00 0.00 0.00 0.00 23.12 19.90 2rgl s ALA 393 CO 0.51 -2.68 0.00 0.09 0.00 0.00 0.00 175.76 173.68 2rgl n ASN 394 N -4.09 -4.04 -4.89 0.00 3.02 -1.26 -5.01 115.26 98.99 2rgl n ASN 394 Ca 0.06 0.02 -0.29 0.00 -0.03 0.00 0.00 54.58 54.34 2rgl n ASN 394 Cb 0.56 -1.63 0.03 0.00 -0.61 0.00 0.00 39.78 38.14 2rgl n ASN 394 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2rgl s LEU 395 N -0.21 3.10 0.77 3.41 1.43 -1.26 -5.06 118.68 120.86 2rgl s LEU 395 Ca 0.00 1.10 -0.11 0.00 -1.03 0.00 0.00 54.13 54.09 2rgl s LEU 395 Cb 0.00 -3.98 0.05 0.00 0.03 0.00 0.00 46.19 42.30 2rgl s LEU 395 CO 0.00 -1.12 1.10 -0.94 0.23 0.00 0.00 176.35 175.62 2rgl s SER 396 N -4.29 4.75 0.16 2.29 1.04 -1.26 -4.89 113.70 111.50 2rgl s SER 396 Ca 0.56 1.26 -0.19 0.00 0.48 0.00 0.00 55.95 58.06 2rgl s SER 396 Cb -0.11 -2.01 0.06 0.00 0.10 0.00 0.00 66.02 64.06 2rgl s SER 396 CO 0.50 -1.80 1.66 -0.09 0.98 0.00 0.00 173.24 174.49 2rgl h ARG 397 N -0.97 -0.10 -0.86 4.02 2.43 -2.00 -2.15 114.38 114.76 2rgl h ARG 397 Ca -0.46 0.01 0.07 0.00 -0.81 0.00 0.00 59.98 58.78 2rgl h ARG 397 Cb 1.26 0.02 -0.06 0.00 -0.42 0.00 0.00 29.97 30.78 2rgl h ARG 397 CO 0.60 -0.06 0.56 0.22 -1.51 0.00 0.00 179.97 179.78 2rgl h ASP 398 N -0.10 0.85 -0.60 -3.80 1.82 -1.99 -1.10 116.42 111.49 2rgl h ASP 398 Ca 0.16 0.01 -0.09 0.00 -0.39 0.00 0.00 57.03 56.72 2rgl h ASP 398 Cb 0.35 -0.18 -0.02 0.00 0.68 0.00 0.00 39.33 40.16 2rgl h ASP 398 CO -0.38 0.55 0.03 1.56 -1.61 0.00 0.00 179.24 179.39 2rgl h GLN 399 N 0.96 1.06 -0.73 0.28 4.20 -1.80 -2.51 115.11 116.58 2rgl h GLN 399 Ca 0.37 -0.31 -0.05 0.00 0.06 0.00 0.00 58.65 58.72 2rgl h GLN 399 Cb 0.22 -0.11 -0.03 0.00 0.30 0.00 0.00 27.48 27.86 2rgl h GLN 399 CO -0.14 1.01 0.26 1.88 -0.67 0.00 0.00 178.83 181.18 2rgl h TYR 400 N 0.97 1.12 -0.00 2.96 -1.99 -0.62 -3.15 116.97 116.26 2rgl h TYR 400 Ca 0.18 -0.09 -0.14 0.00 2.00 0.00 0.00 58.73 60.68 2rgl h TYR 400 Cb 0.51 -0.33 -0.02 0.00 2.00 0.00 0.00 36.73 38.89 2rgl h TYR 400 CO 0.04 0.87 -0.67 -0.07 -0.00 0.00 0.00 178.16 178.32 2rgl h LEU 401 N 1.06 0.01 -5.63 3.88 3.38 -1.14 -3.30 115.31 113.57 2rgl h LEU 401 Ca 0.24 -0.00 -0.74 0.00 0.09 0.00 0.00 57.88 57.47 2rgl h LEU 401 Cb 0.25 -0.00 -0.11 0.00 0.09 0.00 0.00 40.66 40.88 2rgl h LEU 401 CO -0.01 0.68 2.52 0.54 0.09 0.00 0.00 178.44 182.25 2rgl n ARG 402 N -3.74 4.47 -2.12 1.13 1.74 -0.96 -0.57 116.66 116.60 2rgl n ARG 402 Ca -0.01 -3.36 -0.41 0.00 -0.77 0.00 0.00 57.85 53.30 2rgl n ARG 402 Cb 0.66 -2.66 -0.00 0.00 -1.02 0.00 0.00 32.46 29.44 2rgl n ARG 402 CO 0.00 0.00 0.00 -0.40 -1.52 0.00 0.00 177.63 175.71 2rgl n ASP 403 N 2.01 6.56 0.21 0.55 5.75 -1.24 -4.71 116.55 125.67 2rgl n ASP 403 Ca 0.63 -3.10 0.06 0.00 -0.01 0.00 0.00 54.79 52.37 2rgl n ASP 403 Cb 0.25 -1.43 0.44 0.00 -1.03 0.00 0.00 41.12 39.35 2rgl n ASP 403 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2rgl h THR 404 N 3.20 0.95 -0.45 2.12 1.03 -1.92 -1.07 112.91 116.76 2rgl h THR 404 Ca 0.56 -1.17 -0.14 0.00 -0.01 0.00 0.00 66.41 65.65 2rgl h THR 404 Cb 0.47 1.69 -0.01 0.00 -1.07 0.00 0.00 68.15 69.22 2rgl h THR 404 CO 1.58 0.30 -0.26 0.74 -0.01 0.00 0.00 175.52 177.86 2rgl h THR 405 N 0.00 1.27 -0.46 0.00 2.02 -1.99 -1.99 112.91 111.76 2rgl h THR 405 Ca -0.00 -1.43 -0.09 0.00 0.77 0.00 0.00 66.41 65.66 2rgl h THR 405 Cb 0.66 1.19 -0.02 0.00 -1.74 0.00 0.00 68.15 68.25 2rgl h THR 405 CO 0.04 0.49 -0.05 -0.09 0.37 0.00 0.00 175.52 176.28 2rgl h ARG 406 N 0.83 0.85 -0.23 6.66 2.43 -1.74 0.81 114.38 123.99 2rgl h ARG 406 Ca 0.10 -0.30 0.06 0.00 -0.81 0.00 0.00 59.98 59.03 2rgl h ARG 406 Cb 0.84 -0.06 -0.06 0.00 -0.42 0.00 0.00 29.97 30.27 2rgl h ARG 406 CO 0.07 0.92 -0.17 0.28 -1.51 0.00 0.00 179.97 179.57 2rgl h VAL 407 N 0.69 0.53 -0.82 0.20 2.07 -1.18 -0.73 116.25 117.01 2rgl h VAL 407 Ca 0.12 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.63 2rgl h VAL 407 Cb 0.58 0.53 -0.04 0.00 -1.52 0.00 0.00 31.29 30.84 2rgl h VAL 407 CO 0.03 0.00 0.45 -0.74 0.02 0.00 0.00 177.57 177.34 2rgl h HIS 408 N -0.16 1.13 -0.14 1.57 -0.00 -1.26 -1.98 115.15 114.30 2rgl h HIS 408 Ca 0.13 -0.03 0.05 0.00 -0.00 0.00 0.00 60.37 60.52 2rgl h HIS 408 Cb 0.36 -0.36 -0.06 0.00 -0.00 0.00 0.00 27.41 27.35 2rgl h HIS 408 CO -0.33 0.78 -0.22 0.35 -0.00 0.00 0.00 177.93 178.52 2rgl h PHE 409 N 1.14 -0.57 -0.32 5.26 3.57 -0.33 -1.30 116.94 124.39 2rgl h PHE 409 Ca 0.29 0.03 -0.13 0.00 3.53 0.00 0.00 57.97 61.68 2rgl h PHE 409 Cb 0.03 0.27 -0.00 0.00 2.79 0.00 0.00 35.95 39.04 2rgl h PHE 409 CO 0.00 -0.30 -0.32 1.88 -2.23 0.00 0.00 178.31 177.35 2rgl h TYR 410 N -0.27 0.95 -0.30 0.41 0.05 -0.99 -1.03 116.97 115.78 2rgl h TYR 410 Ca 0.10 -0.28 0.05 0.00 0.05 0.00 0.00 58.73 58.65 2rgl h TYR 410 Cb 0.42 -0.20 -0.05 0.00 1.01 0.00 0.00 36.73 37.92 2rgl h TYR 410 CO -0.33 1.06 -0.00 -0.09 -1.05 0.00 0.00 178.16 177.75 2rgl h ARG 411 N 0.56 0.08 -0.05 4.88 2.43 -1.29 -0.45 114.38 120.54 2rgl h ARG 411 Ca 0.05 -0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.21 2rgl h ARG 411 Cb 0.90 -0.02 -0.00 0.00 -0.42 0.00 0.00 29.97 30.43 2rgl h ARG 411 CO 0.08 0.05 0.00 0.77 -1.51 0.00 0.00 179.97 179.37 2rgl h SER 412 N 0.08 0.08 -0.61 -3.80 0.02 -1.16 -1.51 113.55 106.65 2rgl h SER 412 Ca 0.15 -0.28 -0.09 0.00 -0.84 0.00 0.00 61.79 60.73 2rgl h SER 412 Cb 0.20 -0.02 -0.02 0.00 0.14 0.00 0.00 62.40 62.69 2rgl h SER 412 CO -0.25 0.33 0.03 1.88 -1.14 0.00 0.00 176.83 177.68 2rgl h TYR 413 N -0.19 1.15 -0.05 3.45 -1.99 -1.18 -2.04 116.97 116.13 2rgl h TYR 413 Ca 0.01 -0.19 -0.10 0.00 2.00 0.00 0.00 58.73 60.45 2rgl h TYR 413 Cb 0.29 -0.30 -0.01 0.00 2.00 0.00 0.00 36.73 38.71 2rgl h TYR 413 CO 0.02 1.01 -0.45 -0.07 -0.00 0.00 0.00 178.16 178.67 2rgl h LEU 414 N 0.96 0.13 -0.59 3.88 3.38 -1.11 -0.84 115.31 121.12 2rgl h LEU 414 Ca 0.18 -0.06 -0.06 0.00 0.09 0.00 0.00 57.88 58.03 2rgl h LEU 414 Cb 0.53 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 41.22 2rgl h LEU 414 CO 0.03 0.56 0.12 0.74 0.09 0.00 0.00 178.44 179.99 2rgl h THR 415 N 0.10 1.25 -0.29 0.22 2.02 -1.02 -0.38 112.91 114.81 2rgl h THR 415 Ca 0.01 -0.94 -0.13 0.00 0.77 0.00 0.00 66.41 66.12 2rgl h THR 415 Cb 0.84 0.72 -0.01 0.00 -1.74 0.00 0.00 68.15 67.96 2rgl h THR 415 CO 0.06 0.35 -0.35 1.56 0.37 0.00 0.00 175.52 177.51 2rgl h GLN 416 N 0.87 0.65 -0.10 6.66 1.08 -1.16 -1.04 115.11 122.08 2rgl h GLN 416 Ca 0.18 -0.31 -0.01 0.00 -1.45 0.00 0.00 58.65 57.06 2rgl h GLN 416 Cb 0.38 -0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 27.80 2rgl h GLN 416 CO 0.01 0.91 0.03 1.25 -0.95 0.00 0.00 178.83 180.07 2rgl h LEU 417 N 0.55 0.14 -0.69 1.46 5.85 -1.03 -2.50 115.31 119.09 2rgl h LEU 417 Ca 0.06 -0.20 0.11 0.00 0.84 0.00 0.00 57.88 58.69 2rgl h LEU 417 Cb 0.86 -0.04 -0.08 0.00 0.37 0.00 0.00 40.66 41.77 2rgl h LEU 417 CO 0.07 0.31 0.28 0.50 -0.34 0.00 0.00 178.44 179.26 2rgl h LYS 418 N -0.03 0.44 -0.43 1.25 3.64 -0.94 0.62 116.57 121.11 2rgl h LYS 418 Ca 0.03 -0.03 0.08 0.00 -1.27 0.00 0.00 60.65 59.47 2rgl h LYS 418 Cb 0.22 -0.10 -0.08 0.00 -0.41 0.00 0.00 32.23 31.86 2rgl h LYS 418 CO -0.00 0.29 -0.06 -0.22 -2.27 0.00 0.00 179.45 177.19 2rgl h LYS 419 N 0.45 0.04 -0.61 1.90 3.64 -1.08 0.16 116.57 121.07 2rgl h LYS 419 Ca 0.36 -0.00 -0.07 0.00 -1.27 0.00 0.00 60.65 59.66 2rgl h LYS 419 Cb 0.48 -0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.27 2rgl h LYS 419 CO -0.34 0.03 0.10 0.00 -2.27 0.00 0.00 179.45 176.96 2rgl h ALA 420 N 1.41 0.81 -0.32 5.00 0.00 -0.84 -2.15 119.26 123.18 2rgl h ALA 420 Ca 0.21 -0.26 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 2rgl h ALA 420 Cb 0.32 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 2rgl h ALA 420 CO -0.41 0.57 0.08 0.82 0.00 0.00 0.00 179.25 180.31 2rgl h ILE 421 N 0.92 1.22 0.00 0.00 2.04 -0.57 -2.13 117.51 118.99 2rgl h ILE 421 Ca 0.18 -0.74 -0.01 0.00 1.00 0.00 0.00 64.86 65.29 2rgl h ILE 421 Cb 0.43 1.10 -0.00 0.00 -0.74 0.00 0.00 36.82 37.61 2rgl h ILE 421 CO 0.01 0.25 -0.06 0.44 0.00 0.00 0.00 178.15 178.79 2rgl h ASP 422 N 0.36 0.00 0.16 1.72 3.32 -0.62 0.74 116.42 122.09 2rgl h ASP 422 Ca 0.10 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.15 2rgl h ASP 422 Cb 0.30 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.85 2rgl h ASP 422 CO 0.00 0.06 -0.03 -0.62 -1.72 0.00 0.00 179.24 176.93 2rgl n GLU 423 N -3.55 0.98 0.00 3.56 1.02 -0.82 -4.93 120.64 116.90 2rgl n GLU 423 Ca -0.02 -0.24 0.00 0.00 -0.02 0.00 0.00 57.16 56.88 2rgl n GLU 423 Cb 0.17 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.10 2rgl n GLU 423 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2rgl n GLY 424 N 1.14 0.98 3.71 0.62 0.00 0.25 -5.08 105.19 106.80 2rgl n GLY 424 Ca 0.19 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.79 2rgl n GLY 424 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2rgl s ALA 425 N -2.00 3.81 -1.34 4.61 0.00 -0.83 -4.90 121.76 121.11 2rgl s ALA 425 Ca 0.00 1.42 -0.13 0.00 0.00 0.00 0.00 51.96 53.25 2rgl s ALA 425 Cb 0.00 -3.67 -0.04 0.00 0.00 0.00 0.00 23.12 19.41 2rgl s ALA 425 CO 0.00 -0.90 2.41 0.09 0.00 0.00 0.00 175.76 177.36 2rgl n ASN 426 N 4.34 5.41 -4.65 0.00 3.02 -1.26 -4.58 115.26 117.54 2rgl n ASN 426 Ca 0.15 -2.66 -0.38 0.00 -0.03 0.00 0.00 54.58 51.66 2rgl n ASN 426 Cb 0.38 -1.47 -0.08 0.00 -0.61 0.00 0.00 39.78 38.00 2rgl n ASN 426 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2rgl s VAL 427 N 3.16 5.20 -0.08 2.41 1.01 -1.26 -0.65 120.40 130.18 2rgl s VAL 427 Ca 0.55 0.65 0.22 0.00 0.00 0.00 0.00 61.98 63.40 2rgl s VAL 427 Cb 0.15 -3.71 -0.26 0.00 0.00 0.00 0.00 36.38 32.55 2rgl s VAL 427 CO -0.04 0.23 0.60 0.00 0.00 0.00 0.00 175.10 175.88 2rgl n ALA 428 N 4.71 2.71 -3.73 5.51 0.00 0.71 -4.94 120.51 125.48 2rgl n ALA 428 Ca -0.09 -0.48 -0.04 0.00 0.00 0.00 0.00 53.44 52.84 2rgl n ALA 428 Cb 0.51 -0.82 -0.01 0.00 0.00 0.00 0.00 19.45 19.13 2rgl n ALA 428 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2rgl s GLY 429 N -4.51 -0.26 -0.13 0.00 0.00 -1.26 -1.99 107.32 99.18 2rgl s GLY 429 Ca -0.06 0.21 -0.07 0.00 0.00 0.00 0.00 44.72 44.79 2rgl s GLY 429 CO 0.88 0.04 0.32 -0.47 0.00 0.00 0.00 173.10 173.86 2rgl s TYR 430 N -3.29 -0.44 -0.10 1.90 6.14 0.44 -1.24 117.35 120.75 2rgl s TYR 430 Ca 0.11 1.00 0.01 0.00 0.64 0.00 0.00 57.07 58.83 2rgl s TYR 430 Cb -0.01 0.14 0.02 0.00 0.42 0.00 0.00 41.96 42.53 2rgl s TYR 430 CO 0.01 -0.28 -0.11 -0.06 0.64 0.00 0.00 175.55 175.75 2rgl s PHE 431 N 1.27 1.64 -0.24 4.97 0.40 0.48 -0.94 117.98 125.56 2rgl s PHE 431 Ca -0.09 -0.76 -0.26 0.00 -0.60 0.00 0.00 56.93 55.22 2rgl s PHE 431 Cb -0.09 -1.25 -0.00 0.00 0.51 0.00 0.00 43.02 42.19 2rgl s PHE 431 CO -0.10 -0.44 0.90 0.00 0.70 0.00 0.00 175.22 176.28 2rgl s ALA 432 N 1.19 3.66 -0.42 5.36 0.00 -0.38 -2.56 121.76 128.61 2rgl s ALA 432 Ca -0.04 -0.03 -0.23 0.00 0.00 0.00 0.00 51.96 51.66 2rgl s ALA 432 Cb -0.14 -3.37 0.02 0.00 0.00 0.00 0.00 23.12 19.63 2rgl s ALA 432 CO -0.03 -0.95 0.79 -0.46 0.00 0.00 0.00 175.76 175.10 2rgl s TRP 433 N 2.93 3.03 0.18 0.00 -0.11 -0.56 -1.71 118.94 122.71 2rgl s TRP 433 Ca 0.38 0.32 0.03 0.00 1.22 0.00 0.00 56.10 58.05 2rgl s TRP 433 Cb -0.15 -3.58 -0.05 0.00 -1.50 0.00 0.00 33.47 28.20 2rgl s TRP 433 CO 0.07 -0.89 -0.03 0.45 -4.62 0.00 0.00 176.95 171.93 2rgl s SER 434 N 2.03 1.51 0.23 5.86 0.15 -0.84 -3.95 113.70 118.69 2rgl s SER 434 Ca 0.31 -1.14 -0.06 0.00 0.70 0.00 0.00 55.95 55.76 2rgl s SER 434 Cb -0.12 0.06 0.38 0.00 -1.71 0.00 0.00 66.02 64.62 2rgl s SER 434 CO 0.21 -0.49 1.74 0.25 1.20 0.00 0.00 173.24 176.15 2rgl h LEU 435 N 2.67 0.28 -8.29 3.45 5.85 -1.58 -0.83 115.31 116.86 2rgl h LEU 435 Ca -0.37 0.09 -0.41 0.00 0.84 0.00 0.00 57.88 58.04 2rgl h LEU 435 Cb 1.20 0.07 -0.24 0.00 0.37 0.00 0.00 40.66 42.06 2rgl h LEU 435 CO 0.63 0.13 -0.78 -0.76 -0.34 0.00 0.00 178.44 177.33 2rgl s LEU 436 N -10.42 2.19 0.34 2.25 1.43 -1.26 -1.28 118.68 111.92 2rgl s LEU 436 Ca -0.13 -0.47 -0.28 0.00 -1.03 0.00 0.00 54.13 52.23 2rgl s LEU 436 Cb 0.19 -0.50 -0.12 0.00 0.03 0.00 0.00 46.19 45.78 2rgl s LEU 436 CO 0.76 -0.01 1.29 0.47 0.23 0.00 0.00 176.35 179.08 2rgl n ASP 437 N 1.82 2.72 -1.45 2.29 8.00 -0.92 -3.94 116.55 125.08 2rgl n ASP 437 Ca -0.19 1.21 -0.03 0.00 0.71 0.00 0.00 54.79 56.49 2rgl n ASP 437 Cb 0.55 -1.48 0.00 0.00 -0.02 0.00 0.00 41.12 40.17 2rgl n ASP 437 CO 0.00 0.00 0.00 -0.46 -0.39 0.00 0.00 177.20 176.35 2rgl n ASN 438 N 0.82 -0.46 -4.56 -2.24 0.23 -1.26 -4.72 115.26 103.07 2rgl n ASN 438 Ca 0.05 -1.42 -0.40 0.00 -0.53 0.00 0.00 54.58 52.28 2rgl n ASN 438 Cb 0.36 0.79 -0.03 0.00 -2.08 0.00 0.00 39.78 38.82 2rgl n ASN 438 CO 0.00 0.00 0.00 0.12 -0.93 0.00 0.00 177.26 176.45 2rgl s PHE 439 N -6.13 2.01 -1.34 -2.53 5.36 -0.85 -4.56 117.98 109.94 2rgl s PHE 439 Ca 0.05 0.52 -0.06 0.00 -0.96 0.00 0.00 56.93 56.48 2rgl s PHE 439 Cb -0.01 -4.30 0.10 0.00 -0.34 0.00 0.00 43.02 38.47 2rgl s PHE 439 CO 0.04 -2.20 2.45 -1.91 -1.46 0.00 0.00 175.22 172.14 2rgl n GLU 440 N 8.95 4.49 0.00 10.12 4.07 0.12 -4.68 120.64 143.71 2rgl n GLU 440 Ca 0.15 -3.33 0.00 0.00 -0.06 0.00 0.00 57.16 53.92 2rgl n GLU 440 Cb 0.50 -2.64 0.00 0.00 -0.06 0.00 0.00 31.44 29.24 2rgl n GLU 440 CO 0.00 0.00 0.00 0.91 -0.06 0.00 0.00 177.13 177.98 2rgl n TRP 441 N 1.89 0.00 0.15 4.31 7.02 -1.26 -1.09 117.44 128.47 2rgl n TRP 441 Ca 0.64 0.00 0.05 0.00 -1.02 0.00 0.00 57.50 57.17 2rgl n TRP 441 Cb 0.25 0.00 0.48 0.00 -2.42 0.00 0.00 31.31 29.61 2rgl n TRP 441 CO 0.00 0.00 0.00 -0.07 -2.02 0.00 0.00 177.69 175.60 2rgl h LEU 442 N 0.00 0.17 0.00 -0.99 3.38 -1.94 -1.84 115.31 114.08 2rgl h LEU 442 Ca 0.00 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.95 2rgl h LEU 442 Cb 0.00 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 40.71 2rgl h LEU 442 CO 0.00 0.25 0.00 -1.20 0.09 0.00 0.00 178.44 177.58 2rgl n SER 443 N -4.38 0.00 0.00 -0.43 7.64 -0.25 -1.14 113.62 115.06 2rgl n SER 443 Ca -0.01 -0.12 0.00 0.00 1.01 0.00 0.00 58.87 59.75 2rgl n SER 443 Cb 0.19 -0.29 0.00 0.00 -1.01 0.00 0.00 64.21 63.10 2rgl n SER 443 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2rgl n GLY 444 N 1.18 3.06 1.58 0.23 0.00 -0.69 -1.04 105.19 109.52 2rgl n GLY 444 Ca 0.14 0.08 0.08 0.00 0.00 0.00 0.00 46.02 46.32 2rgl n GLY 444 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2rgl n TYR 445 N 14.00 1.54 1.32 1.61 4.02 -1.26 0.11 117.16 138.50 2rgl n TYR 445 Ca 0.00 -0.58 0.14 0.00 -0.01 0.00 0.00 57.90 57.45 2rgl n TYR 445 Cb 0.00 -0.31 0.55 0.00 -0.02 0.00 0.00 39.34 39.57 2rgl n TYR 445 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 176.86 176.10 2rgl n THR 446 N 0.90 0.00 -4.46 -0.72 -2.24 -0.20 -4.77 114.28 102.78 2rgl n THR 446 Ca 0.24 -0.06 -0.29 0.00 -2.27 0.00 0.00 64.05 61.68 2rgl n THR 446 Cb 0.92 -0.04 -0.17 0.00 -2.10 0.00 0.00 70.33 68.94 2rgl n THR 446 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 2rgl s SER 447 N -2.56 2.49 -0.40 3.42 0.15 -1.26 -1.82 113.70 113.73 2rgl s SER 447 Ca 0.26 -0.44 0.01 0.00 0.70 0.00 0.00 55.95 56.48 2rgl s SER 447 Cb 0.20 -1.12 0.11 0.00 -1.71 0.00 0.00 66.02 63.50 2rgl s SER 447 CO 0.50 0.02 0.15 -0.54 1.20 0.00 0.00 173.24 174.57 2rgl s LYS 448 N 0.99 1.78 0.00 5.44 3.01 -0.69 -4.52 119.74 125.75 2rgl s LYS 448 Ca -0.06 -1.95 0.24 0.00 -1.01 0.00 0.00 55.97 53.19 2rgl s LYS 448 Cb -0.15 -3.39 0.32 0.00 -1.01 0.00 0.00 37.83 33.60 2rgl s LYS 448 CO -0.02 -1.02 1.29 1.19 0.51 0.00 0.00 175.35 177.30 2rgl n PHE 449 N 4.25 0.00 -2.15 3.18 3.72 -1.26 -0.83 117.46 124.37 2rgl n PHE 449 Ca 0.02 0.00 -0.33 0.00 -0.05 0.00 0.00 57.45 57.09 2rgl n PHE 449 Cb 0.41 -0.08 -0.00 0.00 -0.94 0.00 0.00 39.48 38.86 2rgl n PHE 449 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 2rgl s GLY 450 N -2.65 2.17 0.22 1.37 0.00 -1.25 -1.98 107.32 105.20 2rgl s GLY 450 Ca 0.18 0.40 0.24 0.00 0.00 0.00 0.00 44.72 45.54 2rgl s GLY 450 CO 0.62 0.72 1.37 0.16 0.00 0.00 0.00 173.10 175.96 2rgl h ILE 451 N 0.64 0.00 -3.32 0.90 3.07 -1.08 -3.44 117.51 114.28 2rgl h ILE 451 Ca -0.47 -0.72 -0.65 0.00 1.55 0.00 0.00 64.86 64.57 2rgl h ILE 451 Cb 1.22 1.42 -0.24 0.00 -0.27 0.00 0.00 36.82 38.95 2rgl h ILE 451 CO 0.58 0.00 -0.71 -0.69 -1.05 0.00 0.00 178.15 176.28 2rgl s VAL 452 N -3.22 3.48 0.21 0.16 1.01 -0.41 -0.90 120.40 120.74 2rgl s VAL 452 Ca 0.05 -0.50 -0.30 0.00 0.00 0.00 0.00 61.98 61.23 2rgl s VAL 452 Cb 0.11 -2.51 -0.08 0.00 0.00 0.00 0.00 36.38 33.90 2rgl s VAL 452 CO 0.71 0.50 1.15 -0.47 0.00 0.00 0.00 175.10 176.99 2rgl s TYR 453 N 0.48 3.49 -0.20 5.22 5.04 0.98 -2.16 117.35 130.20 2rgl s TYR 453 Ca -0.06 1.54 -0.00 0.00 -2.44 0.00 0.00 57.07 56.11 2rgl s TYR 453 Cb -0.15 -3.36 0.02 0.00 0.35 0.00 0.00 41.96 38.81 2rgl s TYR 453 CO 0.04 -0.91 -0.15 0.08 -1.34 0.00 0.00 175.55 173.26 2rgl s VAL 454 N -0.43 2.43 -0.44 3.14 1.01 -1.26 -0.96 120.40 123.89 2rgl s VAL 454 Ca 0.50 -0.87 -0.29 0.00 0.00 0.00 0.00 61.98 61.32 2rgl s VAL 454 Cb -0.32 -2.08 0.02 0.00 0.00 0.00 0.00 36.38 34.00 2rgl s VAL 454 CO 0.38 0.47 1.28 -0.62 0.00 0.00 0.00 175.10 176.61 2rgl s ASP 455 N 1.33 6.49 0.00 3.32 -1.08 -0.59 -4.90 116.67 121.24 2rgl s ASP 455 Ca 0.04 0.68 0.29 0.00 -0.52 0.00 0.00 52.55 53.04 2rgl s ASP 455 Cb -0.14 -2.54 1.73 0.00 -1.46 0.00 0.00 42.92 40.51 2rgl s ASP 455 CO -0.10 -1.33 2.09 0.49 0.52 0.00 0.00 175.17 176.83 2rgl n PHE 456 N 8.31 0.00 -0.01 -5.34 3.72 -1.26 0.13 117.46 123.01 2rgl n PHE 456 Ca 0.14 0.00 -0.22 0.00 -0.05 0.00 0.00 57.45 57.33 2rgl n PHE 456 Cb 0.48 0.00 -0.13 0.00 -0.94 0.00 0.00 39.48 38.89 2rgl n PHE 456 CO 0.00 0.00 0.00 -0.91 -0.05 0.00 0.00 176.76 175.80 2rgl h ASN 457 N 0.00 0.34 0.00 4.37 2.35 -1.98 -3.41 115.58 117.24 2rgl h ASN 457 Ca 0.00 -0.83 0.00 0.00 -0.55 0.00 0.00 56.30 54.92 2rgl h ASN 457 Cb 0.00 -0.11 0.00 0.00 0.05 0.00 0.00 38.32 38.26 2rgl h ASN 457 CO 0.00 1.71 -1.47 0.35 -1.65 0.00 0.00 177.43 176.37 2rgl n THR 458 N -3.81 0.00 -0.93 2.81 -2.24 -1.14 -5.00 114.28 103.97 2rgl n THR 458 Ca -0.30 -0.30 0.00 0.00 -2.27 0.00 0.00 64.05 61.19 2rgl n THR 458 Cb 0.93 0.40 0.00 0.00 -2.10 0.00 0.00 70.33 69.57 2rgl n THR 458 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 2rgl n LEU 459 N -1.87 0.55 -4.76 3.22 4.77 0.34 -5.01 117.00 114.24 2rgl n LEU 459 Ca -0.01 0.00 -0.40 0.00 -0.03 0.00 0.00 56.01 55.57 2rgl n LEU 459 Cb 0.40 -1.41 0.02 0.00 -2.33 0.00 0.00 43.42 40.09 2rgl n LEU 459 CO 0.37 -0.48 1.05 -1.61 -1.33 0.00 0.00 177.39 175.38 2rgl s GLU 460 N -0.97 3.66 -0.13 3.23 2.02 -1.24 -4.70 118.70 120.58 2rgl s GLU 460 Ca 0.00 2.37 -0.07 0.00 0.02 0.00 0.00 54.97 57.29 2rgl s GLU 460 Cb 0.00 -2.63 -0.04 0.00 0.10 0.00 0.00 34.13 31.56 2rgl s GLU 460 CO 0.00 -0.82 0.11 1.03 0.02 0.00 0.00 175.26 175.61 2rgl s ARG 461 N -2.47 3.51 -0.14 1.61 3.00 -1.26 -1.54 118.95 121.65 2rgl s ARG 461 Ca 0.62 -0.20 -0.04 0.00 0.00 0.00 0.00 55.73 56.11 2rgl s ARG 461 Cb -0.43 -3.16 0.05 0.00 0.00 0.00 0.00 34.95 31.41 2rgl s ARG 461 CO 0.54 0.67 0.06 -1.01 0.00 0.00 0.00 175.30 175.57 2rgl s HIS 462 N -0.73 0.40 0.28 -0.53 3.76 -0.14 -4.99 115.29 113.34 2rgl s HIS 462 Ca 0.13 -0.32 -0.30 0.00 -0.15 0.00 0.00 55.06 54.42 2rgl s HIS 462 Cb -0.12 -0.74 -0.13 0.00 1.11 0.00 0.00 32.58 32.71 2rgl s HIS 462 CO 0.03 -0.46 1.46 -2.30 -0.85 0.00 0.00 174.74 172.61 2rgl n PRO 463 N 5.22 2.29 -2.28 8.40 -0.02 -1.26 -0.01 135.00 147.33 2rgl n PRO 463 Ca -0.07 0.81 -0.25 0.00 -2.02 0.00 0.00 63.50 61.97 2rgl n PRO 463 Cb 0.49 -2.50 0.08 0.00 -0.02 0.00 0.00 33.50 31.55 2rgl n PRO 463 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 2rgl s LYS 464 N -0.69 2.02 0.41 -0.52 1.02 -0.07 -4.80 119.74 117.10 2rgl s LYS 464 Ca 0.65 -0.45 0.13 0.00 0.02 0.00 0.00 55.97 56.31 2rgl s LYS 464 Cb -0.58 -2.20 0.97 0.00 -0.52 0.00 0.00 37.83 35.49 2rgl s LYS 464 CO 0.51 -1.32 1.94 0.00 -0.92 0.00 0.00 175.35 175.56 2rgl h ALA 465 N -0.61 1.98 -0.45 5.17 0.00 -1.12 -1.71 119.26 122.52 2rgl h ALA 465 Ca -0.43 -0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.44 2rgl h ALA 465 Cb 1.30 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.97 2rgl h ALA 465 CO 0.54 -0.15 0.15 0.66 0.00 0.00 0.00 179.25 180.45 2rgl h SER 466 N 0.50 0.60 -0.38 0.00 4.64 -1.83 0.23 113.55 117.31 2rgl h SER 466 Ca 0.34 -0.08 -0.02 0.00 -0.47 0.00 0.00 61.79 61.56 2rgl h SER 466 Cb 0.64 -0.15 -0.02 0.00 -0.31 0.00 0.00 62.40 62.56 2rgl h SER 466 CO -0.11 0.57 0.15 0.00 -0.87 0.00 0.00 176.83 176.57 2rgl h ALA 467 N 1.52 0.49 -0.08 5.18 0.00 -1.39 -1.29 119.26 123.70 2rgl h ALA 467 Ca 0.15 -0.14 -0.12 0.00 0.00 0.00 0.00 54.91 54.81 2rgl h ALA 467 Cb 0.18 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 2rgl h ALA 467 CO -0.01 0.10 -0.48 1.88 0.00 0.00 0.00 179.25 180.74 2rgl h TYR 468 N 0.47 0.24 -0.18 0.00 -1.99 -1.21 -0.17 116.97 114.13 2rgl h TYR 468 Ca 0.13 -0.07 0.02 0.00 2.00 0.00 0.00 58.73 60.80 2rgl h TYR 468 Cb 0.19 -0.05 -0.02 0.00 2.00 0.00 0.00 36.73 38.85 2rgl h TYR 468 CO -0.00 0.64 0.06 2.35 -0.00 0.00 0.00 178.16 181.22 2rgl h TRP 469 N 0.16 0.11 -0.59 4.88 7.01 -0.43 -0.67 115.95 126.43 2rgl h TRP 469 Ca 0.01 0.01 -0.01 0.00 2.11 0.00 0.00 58.89 61.01 2rgl h TRP 469 Cb 0.91 -0.02 -0.03 0.00 -2.10 0.00 0.00 29.16 27.92 2rgl h TRP 469 CO 0.01 0.06 0.35 0.74 -2.79 0.00 0.00 178.44 176.81 2rgl h PHE 470 N 0.15 0.78 -0.48 2.65 0.04 -0.95 0.07 116.94 119.20 2rgl h PHE 470 Ca 0.08 -0.01 0.04 0.00 2.80 0.00 0.00 57.97 60.88 2rgl h PHE 470 Cb 0.05 -0.25 -0.04 0.00 2.20 0.00 0.00 35.95 37.90 2rgl h PHE 470 CO -0.11 0.54 0.24 -0.09 -0.60 0.00 0.00 178.31 178.29 2rgl h ARG 471 N 0.79 0.47 0.02 1.51 2.43 -0.84 0.89 114.38 119.64 2rgl h ARG 471 Ca 0.21 -0.03 -0.00 0.00 -0.81 0.00 0.00 59.98 59.35 2rgl h ARG 471 Cb -0.00 -0.11 0.00 0.00 -0.42 0.00 0.00 29.97 29.44 2rgl h ARG 471 CO -0.04 0.31 -0.01 -0.44 -1.51 0.00 0.00 179.97 178.28 2rgl h ASP 472 N 0.48 -0.02 -0.69 -3.80 3.45 -0.94 -2.87 116.42 112.03 2rgl h ASP 472 Ca 0.21 -0.05 -0.04 0.00 0.43 0.00 0.00 57.03 57.58 2rgl h ASP 472 Cb 0.11 0.01 -0.03 0.00 -0.56 0.00 0.00 39.33 38.86 2rgl h ASP 472 CO -0.14 0.03 0.27 -0.03 -1.57 0.00 0.00 179.24 177.80 2rgl h MET 473 N -0.08 1.06 -0.05 3.56 4.05 -0.58 -3.18 114.93 119.70 2rgl h MET 473 Ca -0.00 -0.19 0.00 0.00 -0.28 0.00 0.00 59.70 59.23 2rgl h MET 473 Cb 0.07 -0.17 0.00 0.00 -0.80 0.00 0.00 31.60 30.70 2rgl h MET 473 CO 0.00 0.87 0.00 1.28 0.23 0.00 0.00 176.91 179.29 2rgl n LEU 474 N -4.29 2.00 -4.74 3.39 4.77 0.27 -3.32 117.00 115.09 2rgl n LEU 474 Ca 0.06 -0.70 -0.42 0.00 -0.03 0.00 0.00 56.01 54.92 2rgl n LEU 474 Cb 0.19 -0.02 -0.01 0.00 -2.33 0.00 0.00 43.42 41.24 2rgl n LEU 474 CO 0.40 0.35 1.13 2.29 -1.33 0.00 0.00 177.39 180.23 2rgl n LYS 475 N 0.56 2.52 0.00 3.23 2.85 -1.09 -4.87 118.16 121.36 2rgl n LYS 475 Ca 0.17 0.89 0.16 0.00 -1.05 0.00 0.00 58.31 58.48 2rgl n LYS 475 Cb 0.43 -2.61 0.95 0.00 -0.65 0.00 0.00 35.03 33.15 2rgl n LYS 475 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 177.40 178.07