#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pmo s GLN 5 N 0.00 4.15 0.00 1.64 -0.21 -1.26 -4.96 119.66 119.03 1pmo s GLN 5 Ca 0.00 1.00 0.00 0.00 0.02 0.00 0.00 55.36 56.38 1pmo s GLN 5 Cb 0.00 -2.24 0.00 0.00 1.00 0.00 0.00 33.01 31.77 1pmo s GLN 5 CO 0.00 0.00 0.10 1.33 -2.12 0.00 0.00 175.29 174.60 1pmo n VAL 6 N -0.64 0.00 -3.13 1.09 0.24 -1.26 -5.12 118.33 109.52 1pmo n VAL 6 Ca 0.06 -0.09 -0.19 0.00 -2.04 0.00 0.00 64.34 62.08 1pmo n VAL 6 Cb 0.54 1.81 0.01 0.00 -1.47 0.00 0.00 33.84 34.73 1pmo n VAL 6 CO 0.00 0.00 0.00 0.42 -2.14 0.00 0.00 176.83 175.11 1pmo s THR 7 N -0.00 3.48 -0.39 3.34 -4.23 -1.26 -5.09 115.64 111.50 1pmo s THR 7 Ca 0.00 -0.90 0.01 0.00 -1.18 0.00 0.00 61.69 59.62 1pmo s THR 7 Cb 0.00 -3.21 0.13 0.00 1.34 0.00 0.00 72.50 70.76 1pmo s THR 7 CO 0.00 -0.10 0.21 -0.62 -0.54 0.00 0.00 174.62 173.57 1pmo s ASP 8 N -4.28 3.47 0.28 3.99 2.15 -1.26 -5.12 116.67 115.89 1pmo s ASP 8 Ca 0.51 -2.30 0.09 0.00 0.43 0.00 0.00 52.55 51.28 1pmo s ASP 8 Cb -0.10 -0.77 -0.04 0.00 -0.30 0.00 0.00 42.92 41.71 1pmo s ASP 8 CO 0.34 -0.31 0.05 -0.76 -0.17 0.00 0.00 175.17 174.32 1pmo s LEU 9 N 0.82 3.28 0.06 -1.34 1.43 -1.26 -5.14 118.68 116.54 1pmo s LEU 9 Ca 0.16 -0.62 0.04 0.00 -1.03 0.00 0.00 54.13 52.68 1pmo s LEU 9 Cb -0.23 -1.80 -0.04 0.00 0.03 0.00 0.00 46.19 44.16 1pmo s LEU 9 CO -0.04 -0.06 -0.04 -0.13 0.23 0.00 0.00 176.35 176.31 1pmo s ARG 10 N -3.73 2.50 -1.00 1.70 3.00 -1.26 -5.05 118.95 115.12 1pmo s ARG 10 Ca 0.33 -0.81 -0.02 0.00 0.00 0.00 0.00 55.73 55.23 1pmo s ARG 10 Cb -0.06 -2.51 0.28 0.00 0.00 0.00 0.00 34.95 32.67 1pmo s ARG 10 CO 0.21 0.56 2.01 0.43 0.00 0.00 0.00 175.30 178.51 1pmo n SER 11 N 0.95 7.45 -3.61 0.23 7.64 -1.26 -4.89 113.62 120.14 1pmo n SER 11 Ca -0.13 -3.62 -0.09 0.00 1.01 0.00 0.00 58.87 56.04 1pmo n SER 11 Cb 0.52 -1.18 -0.06 0.00 -1.01 0.00 0.00 64.21 62.48 1pmo n SER 11 CO 0.00 0.00 0.00 -1.83 -3.01 0.00 0.00 175.04 170.20 1pmo s GLU 12 N -3.68 0.52 0.11 1.43 -1.05 -1.26 -5.13 118.70 109.64 1pmo s GLU 12 Ca 0.45 0.32 -0.31 0.00 -0.15 0.00 0.00 54.97 55.28 1pmo s GLU 12 Cb 0.26 0.25 -0.09 0.00 -0.44 0.00 0.00 34.13 34.10 1pmo s GLU 12 CO -0.20 -0.12 1.63 -1.17 0.95 0.00 0.00 175.26 176.35 1pmo s LEU 13 N -0.52 4.37 0.31 1.83 2.96 -1.26 -4.94 118.68 121.43 1pmo s LEU 13 Ca 0.01 2.56 0.09 0.00 -0.22 0.00 0.00 54.13 56.56 1pmo s LEU 13 Cb -0.02 -3.58 -0.04 0.00 0.50 0.00 0.00 46.19 43.05 1pmo s LEU 13 CO -0.03 -0.87 0.09 -0.76 -1.32 0.00 0.00 176.35 173.46 1pmo s LEU 14 N 1.99 3.25 -0.13 -0.68 1.43 -1.26 -0.24 118.68 123.04 1pmo s LEU 14 Ca 0.73 -0.72 -0.01 0.00 -1.03 0.00 0.00 54.13 53.10 1pmo s LEU 14 Cb -0.42 -1.74 -0.02 0.00 0.03 0.00 0.00 46.19 44.05 1pmo s LEU 14 CO 0.32 -0.18 -0.12 -0.62 0.23 0.00 0.00 176.35 175.98 1pmo s ASP 15 N -3.78 4.14 0.17 2.29 -1.08 0.08 -4.50 116.67 113.99 1pmo s ASP 15 Ca 0.35 -0.29 0.24 0.00 -0.52 0.00 0.00 52.55 52.33 1pmo s ASP 15 Cb -0.04 -1.62 0.90 0.00 -1.46 0.00 0.00 42.92 40.70 1pmo s ASP 15 CO 0.22 0.17 1.72 -1.54 0.52 0.00 0.00 175.17 176.26 1pmo n SER 16 N 3.50 0.52 0.00 -0.34 3.41 -1.26 -0.96 113.62 118.49 1pmo n SER 16 Ca -0.18 0.59 -0.20 0.00 -0.26 0.00 0.00 58.87 58.82 1pmo n SER 16 Cb 0.53 -0.71 -0.14 0.00 -0.26 0.00 0.00 64.21 63.62 1pmo n SER 16 CO 0.00 0.00 0.00 0.03 -0.16 0.00 0.00 175.04 174.91 1pmo h ARG 17 N 0.00 0.21 0.00 4.33 3.08 -1.96 -3.38 114.38 116.66 1pmo h ARG 17 Ca 0.00 -0.37 0.00 0.00 0.07 0.00 0.00 59.98 59.68 1pmo h ARG 17 Cb 0.48 0.14 0.00 0.00 0.08 0.00 0.00 29.97 30.66 1pmo h ARG 17 CO 0.00 1.18 -0.88 1.19 -1.07 0.00 0.00 179.97 180.39 1pmo n PHE 18 N -4.08 0.01 -3.73 3.04 3.72 -1.22 -4.97 117.46 110.23 1pmo n PHE 18 Ca -0.21 0.00 -0.26 0.00 -0.05 0.00 0.00 57.45 56.93 1pmo n PHE 18 Cb 0.82 -0.09 0.05 0.00 -0.94 0.00 0.00 39.48 39.33 1pmo n PHE 18 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1pmo n GLY 19 N 1.49 -0.47 3.41 1.37 0.00 -0.13 -4.96 105.19 105.90 1pmo n GLY 19 Ca 0.04 0.20 -0.17 0.00 0.00 0.00 0.00 46.02 46.09 1pmo n GLY 19 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pmo s ALA 20 N -3.36 1.27 0.29 4.61 0.00 -1.23 -4.96 121.76 118.37 1pmo s ALA 20 Ca 0.49 -1.78 -0.30 0.00 0.00 0.00 0.00 51.96 50.37 1pmo s ALA 20 Cb -0.23 1.29 -0.12 0.00 0.00 0.00 0.00 23.12 24.06 1pmo s ALA 20 CO 0.78 -0.74 1.56 1.17 0.00 0.00 0.00 175.76 178.53 1pmo n LYS 21 N -0.61 2.58 -2.06 0.00 4.81 -1.26 -0.74 118.16 120.88 1pmo n LYS 21 Ca 0.04 0.92 -0.41 0.00 -0.87 0.00 0.00 58.31 57.99 1pmo n LYS 21 Cb 0.62 -2.67 -0.02 0.00 0.02 0.00 0.00 35.03 32.97 1pmo n LYS 21 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 1pmo s SER 22 N 0.42 6.70 -0.27 3.14 0.15 0.67 -4.61 113.70 119.90 1pmo s SER 22 Ca 0.64 2.71 0.03 0.00 0.70 0.00 0.00 55.95 60.03 1pmo s SER 22 Cb -0.52 -2.64 0.06 0.00 -1.71 0.00 0.00 66.02 61.21 1pmo s SER 22 CO 0.50 -0.62 -0.08 -0.63 1.20 0.00 0.00 173.24 173.61 1pmo s ILE 23 N -0.75 2.25 -0.03 6.45 1.01 -1.26 -4.97 121.20 123.90 1pmo s ILE 23 Ca 0.53 -1.69 -0.16 0.00 0.00 0.00 0.00 60.65 59.33 1pmo s ILE 23 Cb -0.41 -2.36 -0.05 0.00 0.01 0.00 0.00 42.46 39.64 1pmo s ILE 23 CO 0.51 -0.10 0.42 -0.55 0.00 0.00 0.00 174.94 175.22 1pmo s SER 24 N 1.10 6.78 0.16 3.58 0.15 -1.26 -4.96 113.70 119.25 1pmo s SER 24 Ca -0.07 0.93 0.22 0.00 0.70 0.00 0.00 55.95 57.73 1pmo s SER 24 Cb -0.20 -2.26 -0.06 0.00 -1.71 0.00 0.00 66.02 61.79 1pmo s SER 24 CO -0.05 0.25 0.94 0.35 1.20 0.00 0.00 173.24 175.93 1pmo n THR 25 N 2.26 0.58 0.07 6.45 -2.24 -1.26 -4.05 114.28 116.09 1pmo n THR 25 Ca -0.12 -0.55 -0.15 0.00 -2.27 0.00 0.00 64.05 60.95 1pmo n THR 25 Cb 0.52 -0.32 -0.14 0.00 -2.10 0.00 0.00 70.33 68.29 1pmo n THR 25 CO 0.00 0.00 0.00 0.40 -0.57 0.00 0.00 175.07 174.90 1pmo h ILE 26 N 0.00 1.31 -3.01 2.28 2.04 -1.97 -3.37 117.51 114.79 1pmo h ILE 26 Ca -0.02 -2.94 -0.54 0.00 1.00 0.00 0.00 64.86 62.37 1pmo h ILE 26 Cb 1.05 2.82 0.00 0.00 -0.74 0.00 0.00 36.82 39.95 1pmo h ILE 26 CO 0.00 0.84 0.74 0.00 0.00 0.00 0.00 178.15 179.73 1pmo s ALA 27 N -2.64 3.53 -1.49 1.87 0.00 -1.26 -2.81 121.76 118.97 1pmo s ALA 27 Ca -0.06 0.88 -0.13 0.00 0.00 0.00 0.00 51.96 52.65 1pmo s ALA 27 Cb 0.07 -3.54 0.07 0.00 0.00 0.00 0.00 23.12 19.72 1pmo s ALA 27 CO 0.86 -0.74 1.04 0.39 0.00 0.00 0.00 175.76 177.31 1pmo n GLU 28 N 4.79 -6.19 -0.19 0.00 1.02 -1.26 -4.82 120.64 113.99 1pmo n GLU 28 Ca 0.12 0.66 0.02 0.00 -0.02 0.00 0.00 57.16 57.94 1pmo n GLU 28 Cb 0.44 -5.60 0.11 0.00 -0.02 0.00 0.00 31.44 26.37 1pmo n GLU 28 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 1pmo n SER 29 N -2.88 1.85 -0.10 1.62 3.41 -1.12 -3.16 113.62 113.25 1pmo n SER 29 Ca 0.04 -2.16 0.01 0.00 -0.26 0.00 0.00 58.87 56.50 1pmo n SER 29 Cb 0.53 -0.39 0.02 0.00 -0.26 0.00 0.00 64.21 64.11 1pmo n SER 29 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1pmo n LYS 30 N 0.15 0.51 -4.29 4.33 5.02 -1.26 -5.00 118.16 117.62 1pmo n LYS 30 Ca 0.07 -0.95 -0.23 0.00 -2.02 0.00 0.00 58.31 55.18 1pmo n LYS 30 Cb 0.38 -1.04 -0.12 0.00 -0.02 0.00 0.00 35.03 34.23 1pmo n LYS 30 CO 0.00 0.00 0.00 -0.98 -0.52 0.00 0.00 177.40 175.90 1pmo s ARG 31 N -0.45 1.15 0.14 1.97 1.70 -1.19 -5.10 118.95 117.17 1pmo s ARG 31 Ca 0.03 -1.22 -0.31 0.00 -0.47 0.00 0.00 55.73 53.77 1pmo s ARG 31 Cb 0.02 -1.36 -0.08 0.00 -0.57 0.00 0.00 34.95 32.96 1pmo s ARG 31 CO 0.03 0.31 1.37 0.12 -1.08 0.00 0.00 175.30 176.04 1pmo s PHE 32 N -1.38 3.25 0.33 5.89 2.19 -1.26 -4.92 117.98 122.07 1pmo s PHE 32 Ca 0.08 1.02 -0.26 0.00 0.33 0.00 0.00 56.93 58.10 1pmo s PHE 32 Cb -0.09 -3.66 -0.13 0.00 -1.31 0.00 0.00 43.02 37.83 1pmo s PHE 32 CO 0.05 -2.25 0.90 -2.30 1.83 0.00 0.00 175.22 173.45 1pmo n PRO 33 N 3.61 1.14 -0.04 10.12 -0.02 -1.26 -4.95 135.00 143.59 1pmo n PRO 33 Ca 0.10 0.40 -0.21 0.00 -2.02 0.00 0.00 63.50 61.77 1pmo n PRO 33 Cb 0.42 -1.77 -0.13 0.00 -0.02 0.00 0.00 33.50 32.01 1pmo n PRO 33 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 1pmo h LEU 34 N 1.65 0.22-10.13 2.45 3.38 -1.99 -3.49 115.31 107.41 1pmo h LEU 34 Ca -0.40 -0.74 -0.50 0.00 0.09 0.00 0.00 57.88 56.33 1pmo h LEU 34 Cb 1.36 -0.07 -0.04 0.00 0.09 0.00 0.00 40.66 42.00 1pmo h LEU 34 CO 0.58 1.62 -0.40 -1.00 0.09 0.00 0.00 178.44 179.33 1pmo s HIS 35 N -2.45 2.73 0.71 1.13 3.76 -1.26 -5.13 115.29 114.79 1pmo s HIS 35 Ca -0.24 -0.47 -0.10 0.00 -0.15 0.00 0.00 55.06 54.10 1pmo s HIS 35 Cb 0.05 -2.09 0.04 0.00 1.11 0.00 0.00 32.58 31.69 1pmo s HIS 35 CO 0.69 -0.05 1.07 -1.21 -0.85 0.00 0.00 174.74 174.39 1pmo s GLU 36 N -4.09 2.55 -0.01 1.40 2.02 -1.26 -5.10 118.70 114.21 1pmo s GLU 36 Ca 0.46 0.18 -0.12 0.00 0.02 0.00 0.00 54.97 55.51 1pmo s GLU 36 Cb -0.03 -2.08 0.01 0.00 0.10 0.00 0.00 34.13 32.14 1pmo s GLU 36 CO 0.27 -1.14 0.24 1.41 0.02 0.00 0.00 175.26 176.07 1pmo s MET 37 N -5.32 0.58 0.21 1.61 -2.45 -1.26 -5.12 119.30 107.55 1pmo s MET 37 Ca 0.59 -0.26 -0.32 0.00 -1.25 0.00 0.00 55.69 54.45 1pmo s MET 37 Cb -0.11 0.25 -0.14 0.00 1.25 0.00 0.00 34.83 36.09 1pmo s MET 37 CO 0.49 -0.15 1.46 0.54 1.05 0.00 0.00 175.02 178.40 1pmo n ARG 38 N 1.40 2.03 -0.13 4.11 1.74 -1.26 -4.87 116.66 119.68 1pmo n ARG 38 Ca -0.22 0.73 -0.04 0.00 -0.77 0.00 0.00 57.85 57.55 1pmo n ARG 38 Cb 0.56 -2.42 0.04 0.00 -1.02 0.00 0.00 32.46 29.62 1pmo n ARG 38 CO 0.00 0.00 0.00 -0.44 -1.52 0.00 0.00 177.63 175.67 1pmo h ASP 39 N 4.75 0.03 0.26 0.55 3.32 -1.99 -2.04 116.42 121.29 1pmo h ASP 39 Ca -0.45 0.07 -0.04 0.00 0.02 0.00 0.00 57.03 56.63 1pmo h ASP 39 Cb 1.27 0.09 -0.01 0.00 0.22 0.00 0.00 39.33 40.91 1pmo h ASP 39 CO 0.80 0.05 -0.19 0.44 -1.72 0.00 0.00 179.24 178.62 1pmo h ASP 40 N 0.23 0.00 -0.12 6.45 3.32 -1.99 -1.28 116.42 123.02 1pmo h ASP 40 Ca 0.20 0.00 -0.19 0.00 0.02 0.00 0.00 57.03 57.06 1pmo h ASP 40 Cb 0.24 0.00 0.01 0.00 0.22 0.00 0.00 39.33 39.80 1pmo h ASP 40 CO -0.26 0.19 -0.68 0.58 -1.72 0.00 0.00 179.24 177.35 1pmo h VAL 41 N 0.00 1.32 -0.79 -1.35 2.07 -1.79 -1.49 116.25 114.22 1pmo h VAL 41 Ca -0.00 -1.93 -0.04 0.00 0.82 0.00 0.00 66.70 65.54 1pmo h VAL 41 Cb 0.37 2.11 -0.04 0.00 -1.52 0.00 0.00 31.29 32.21 1pmo h VAL 41 CO 0.02 0.60 0.33 0.00 0.02 0.00 0.00 177.57 178.54 1pmo h ALA 42 N 0.50 1.08 -0.03 1.67 0.00 -0.98 -0.76 119.26 120.74 1pmo h ALA 42 Ca -0.05 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 54.67 1pmo h ALA 42 Cb 1.32 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 18.80 1pmo h ALA 42 CO 0.14 0.66 0.01 0.35 0.00 0.00 0.00 179.25 180.41 1pmo h PHE 43 N 1.15 0.05 -0.33 0.00 3.57 -1.16 -2.04 116.94 118.17 1pmo h PHE 43 Ca 0.27 -0.00 -0.05 0.00 3.53 0.00 0.00 57.97 61.71 1pmo h PHE 43 Cb 0.20 -0.01 -0.02 0.00 2.79 0.00 0.00 35.95 38.91 1pmo h PHE 43 CO 0.02 0.19 -0.02 1.96 -2.23 0.00 0.00 178.31 178.23 1pmo h GLN 44 N -0.11 0.51 -0.31 1.11 4.20 -1.05 0.25 115.11 119.71 1pmo h GLN 44 Ca 0.01 -0.11 -0.03 0.00 0.06 0.00 0.00 58.65 58.58 1pmo h GLN 44 Cb 0.16 -0.07 -0.01 0.00 0.30 0.00 0.00 27.48 27.85 1pmo h GLN 44 CO -0.00 0.55 0.08 0.82 -0.67 0.00 0.00 178.83 179.61 1pmo h ILE 45 N 0.49 1.22 -0.22 2.54 2.04 -1.00 0.13 117.51 122.70 1pmo h ILE 45 Ca 0.10 -0.72 -0.16 0.00 1.00 0.00 0.00 64.86 65.08 1pmo h ILE 45 Cb 0.34 1.10 0.00 0.00 -0.74 0.00 0.00 36.82 37.52 1pmo h ILE 45 CO 0.01 0.24 -0.50 0.40 0.00 0.00 0.00 178.15 178.30 1pmo h ILE 46 N 0.34 1.30 -0.54 -0.67 2.04 -1.05 -2.87 117.51 116.06 1pmo h ILE 46 Ca 0.10 -1.71 0.03 0.00 1.00 0.00 0.00 64.86 64.28 1pmo h ILE 46 Cb 0.28 1.81 -0.04 0.00 -0.74 0.00 0.00 36.82 38.14 1pmo h ILE 46 CO 0.00 0.54 0.31 -1.13 0.00 0.00 0.00 178.15 177.87 1pmo h ASN 47 N 0.45 0.48 -0.53 1.72 -1.24 -0.43 -2.17 115.58 113.86 1pmo h ASN 47 Ca 0.00 0.01 -0.06 0.00 0.71 0.00 0.00 56.30 56.97 1pmo h ASN 47 Cb 1.11 -0.08 -0.03 0.00 0.73 0.00 0.00 38.32 40.05 1pmo h ASN 47 CO 0.11 0.33 0.12 0.44 -1.29 0.00 0.00 177.43 177.14 1pmo h ASP 48 N 0.60 0.85 1.74 1.15 3.32 -0.92 -2.81 116.42 120.34 1pmo h ASP 48 Ca 0.23 -0.17 0.00 0.00 0.02 0.00 0.00 57.03 57.11 1pmo h ASP 48 Cb 0.08 -0.22 0.00 0.00 0.22 0.00 0.00 39.33 39.40 1pmo h ASP 48 CO -0.12 0.84 0.00 1.05 -1.72 0.00 0.00 179.24 179.29 1pmo h GLU 49 N 0.86 0.00 0.00 3.56 4.11 -1.27 -2.96 114.58 118.88 1pmo h GLU 49 Ca 0.18 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.61 1pmo h GLU 49 Cb 0.34 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.59 1pmo h GLU 49 CO 0.00 0.00 0.00 -0.07 0.07 0.00 0.00 179.01 179.01 1pmo h LEU 50 N 0.00 0.00 -1.11 3.06 3.38 -1.12 -1.28 115.31 118.23 1pmo h LEU 50 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1pmo h LEU 50 Cb 0.87 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.62 1pmo h LEU 50 CO 0.00 0.00 0.00 1.88 0.09 0.00 0.00 178.44 180.41 1pmo h TYR 51 N 0.00 0.00 0.00 1.13 -1.99 -1.57 -1.65 116.97 112.89 1pmo h TYR 51 Ca 0.00 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.73 1pmo h TYR 51 Cb 0.35 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.08 1pmo h TYR 51 CO 0.00 0.00 0.00 -0.07 -0.00 0.00 0.00 178.16 178.09 1pmo h LEU 52 N 0.00 0.00-10.10 3.88 3.38 -1.44 -3.44 115.31 107.60 1pmo h LEU 52 Ca 0.00 0.00 -0.45 0.00 0.09 0.00 0.00 57.88 57.52 1pmo h LEU 52 Cb 0.27 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.02 1pmo h LEU 52 CO 0.00 0.00 0.36 -1.81 0.09 0.00 0.00 178.44 177.08 1pmo s ASP 53 N -4.53 6.72 0.78 -0.43 1.01 -0.62 -5.06 116.67 114.54 1pmo s ASP 53 Ca 0.07 1.71 -0.09 0.00 0.71 0.00 0.00 52.55 54.95 1pmo s ASP 53 Cb 0.11 -2.54 0.09 0.00 1.01 0.00 0.00 42.92 41.59 1pmo s ASP 53 CO 0.51 -0.52 1.11 -0.83 0.21 0.00 0.00 175.17 175.65 1pmo s GLY 54 N -2.37 1.68 0.00 0.21 0.00 -1.26 -4.98 107.32 100.59 1pmo s GLY 54 Ca 0.62 -0.93 0.17 0.00 0.00 0.00 0.00 44.72 44.59 1pmo s GLY 54 CO 0.19 -0.43 1.02 1.16 0.00 0.00 0.00 173.10 175.04 1pmo n ASN 55 N -3.16 2.29 0.00 1.64 0.23 -1.26 -4.98 115.26 110.02 1pmo n ASN 55 Ca 0.09 -1.65 0.00 0.00 -0.53 0.00 0.00 54.58 52.50 1pmo n ASN 55 Cb 0.60 0.10 0.00 0.00 -2.08 0.00 0.00 39.78 38.41 1pmo n ASN 55 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1pmo n ALA 56 N 0.75 0.00 0.07 -2.53 0.00 -1.26 -4.84 120.51 112.70 1pmo n ALA 56 Ca 0.10 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.55 1pmo n ALA 56 Cb 0.42 -1.14 0.36 0.00 0.00 0.00 0.00 19.45 19.09 1pmo n ALA 56 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1pmo h ARG 57 N 0.25 0.36 -0.65 0.00 2.47 -1.93 -1.80 114.38 113.08 1pmo h ARG 57 Ca 0.00 -0.07 0.00 0.00 -1.26 0.00 0.00 59.98 58.65 1pmo h ARG 57 Cb 0.61 -0.05 0.00 0.00 -1.65 0.00 0.00 29.97 28.88 1pmo h ARG 57 CO 0.00 0.43 0.00 1.04 0.56 0.00 0.00 179.97 182.00 1pmo n GLN 58 N -4.30 3.01 -3.08 0.04 6.02 -1.26 -4.87 117.38 112.94 1pmo n GLN 58 Ca 0.00 -2.64 -0.42 0.00 -0.01 0.00 0.00 57.00 53.94 1pmo n GLN 58 Cb 0.24 -1.61 -0.06 0.00 1.02 0.00 0.00 30.24 29.82 1pmo n GLN 58 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.06 177.26 1pmo s ASN 59 N -1.00 6.49 -0.24 1.08 3.84 -0.68 -1.71 114.94 122.71 1pmo s ASN 59 Ca 0.46 0.32 0.13 0.00 0.21 0.00 0.00 52.86 53.98 1pmo s ASN 59 Cb 0.26 -2.34 0.60 0.00 -0.55 0.00 0.00 41.25 39.21 1pmo s ASN 59 CO 0.28 -0.57 1.55 0.18 -2.79 0.00 0.00 177.10 175.75 1pmo n LEU 60 N 6.04 4.62 -0.10 3.21 4.77 -0.09 -4.50 117.00 130.94 1pmo n LEU 60 Ca -0.00 -3.23 -0.17 0.00 -0.03 0.00 0.00 56.01 52.58 1pmo n LEU 60 Cb 0.49 -0.63 -0.13 0.00 -2.33 0.00 0.00 43.42 40.82 1pmo n LEU 60 CO 0.48 0.83 -1.23 0.00 -1.33 0.00 0.00 177.39 176.15 1pmo n ALA 61 N -0.50 1.38 -1.87 -1.18 0.00 -1.22 -1.34 120.51 115.77 1pmo n ALA 61 Ca 0.29 -1.06 -0.32 0.00 0.00 0.00 0.00 53.44 52.35 1pmo n ALA 61 Cb 1.07 -0.21 -0.03 0.00 0.00 0.00 0.00 19.45 20.28 1pmo n ALA 61 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 1pmo s THR 62 N -2.52 4.57 -0.26 0.00 -1.32 -1.25 -4.81 115.64 110.05 1pmo s THR 62 Ca -0.29 1.14 0.22 0.00 -1.21 0.00 0.00 61.69 61.55 1pmo s THR 62 Cb 0.08 -3.73 -0.31 0.00 -1.51 0.00 0.00 72.50 67.03 1pmo s THR 62 CO 0.66 -0.71 0.58 0.49 -2.21 0.00 0.00 174.62 173.44 1pmo n PHE 63 N -1.65 0.01 -2.19 9.09 3.01 -1.26 -4.86 117.46 119.61 1pmo n PHE 63 Ca 0.06 0.00 -0.39 0.00 1.01 0.00 0.00 57.45 58.13 1pmo n PHE 63 Cb 0.54 -0.39 -0.01 0.00 -0.01 0.00 0.00 39.48 39.61 1pmo n PHE 63 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1pmo n GLN 65 N 0.21 2.43 0.00 0.00 1.13 -0.48 -4.89 117.38 115.78 1pmo n GLN 65 Ca 0.03 0.87 0.00 0.00 -1.94 0.00 0.00 57.00 55.97 1pmo n GLN 65 Cb 0.45 -2.66 0.00 0.00 0.11 0.00 0.00 30.24 28.14 1pmo n GLN 65 CO 0.00 0.00 0.00 0.25 -1.44 0.00 0.00 177.06 175.87 1pmo n THR 66 N 3.37 0.03 -2.16 5.09 -2.24 -1.26 -4.77 114.28 112.33 1pmo n THR 66 Ca 0.15 -0.23 -0.29 0.00 -2.27 0.00 0.00 64.05 61.41 1pmo n THR 66 Cb 0.32 1.52 0.01 0.00 -2.10 0.00 0.00 70.33 70.08 1pmo n THR 66 CO 0.00 0.00 0.00 0.86 -0.57 0.00 0.00 175.07 175.36 1pmo s TRP 67 N -0.03 3.53 -0.14 4.78 -0.00 -1.26 -4.88 118.94 120.95 1pmo s TRP 67 Ca 0.00 1.05 0.01 0.00 -0.00 0.00 0.00 56.10 57.16 1pmo s TRP 67 Cb 0.00 -2.63 0.00 0.00 -0.00 0.00 0.00 33.47 30.84 1pmo s TRP 67 CO 0.00 -0.64 -0.19 -0.51 -0.00 0.00 0.00 176.95 175.62 1pmo s ASP 68 N -4.19 3.40 -0.16 5.86 1.01 -1.26 -5.10 116.67 116.23 1pmo s ASP 68 Ca 0.53 -0.53 0.01 0.00 0.71 0.00 0.00 52.55 53.27 1pmo s ASP 68 Cb -0.11 -1.50 0.02 0.00 1.01 0.00 0.00 42.92 42.34 1pmo s ASP 68 CO 0.50 0.09 -0.18 -0.62 0.21 0.00 0.00 175.17 175.17 1pmo s ASP 69 N 0.75 2.96 0.25 0.27 -1.08 -1.26 -5.04 116.67 113.52 1pmo s ASP 69 Ca -0.08 -0.59 -0.03 0.00 -0.52 0.00 0.00 52.55 51.34 1pmo s ASP 69 Cb -0.16 -1.37 0.49 0.00 -1.46 0.00 0.00 42.92 40.43 1pmo s ASP 69 CO 0.00 -0.01 1.73 -0.08 0.52 0.00 0.00 175.17 177.34 1pmo h GLU 70 N 7.88 0.46 -0.24 4.34 4.81 -1.99 -1.22 114.58 128.62 1pmo h GLU 70 Ca -0.42 -0.03 -0.06 0.00 -0.13 0.00 0.00 59.36 58.73 1pmo h GLU 70 Cb 1.15 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 30.41 1pmo h GLU 70 CO 0.59 0.31 -0.10 -0.91 -0.73 0.00 0.00 179.01 178.16 1pmo h ASN 71 N 0.48 0.37 -0.17 1.04 2.35 -1.99 -1.15 115.58 116.51 1pmo h ASN 71 Ca 0.43 -0.08 -0.14 0.00 -0.55 0.00 0.00 56.30 55.96 1pmo h ASN 71 Cb 0.66 -0.10 -0.01 0.00 0.05 0.00 0.00 38.32 38.93 1pmo h ASN 71 CO -0.41 0.52 -0.38 0.58 -1.65 0.00 0.00 177.43 176.09 1pmo h VAL 72 N 0.37 1.29 -0.51 2.81 2.07 -1.67 -0.68 116.25 119.93 1pmo h VAL 72 Ca 0.07 -1.55 -0.02 0.00 0.82 0.00 0.00 66.70 66.02 1pmo h VAL 72 Cb 0.41 1.47 -0.02 0.00 -1.52 0.00 0.00 31.29 31.63 1pmo h VAL 72 CO 0.02 0.50 0.23 0.45 0.02 0.00 0.00 177.57 178.79 1pmo h HIS 73 N 0.58 0.74 -0.40 1.57 3.86 -0.81 -0.98 115.15 119.71 1pmo h HIS 73 Ca 0.05 -0.04 -0.05 0.00 -1.16 0.00 0.00 60.37 59.17 1pmo h HIS 73 Cb 0.92 -0.23 -0.02 0.00 1.06 0.00 0.00 27.41 29.14 1pmo h HIS 73 CO 0.04 0.60 0.06 0.87 0.86 0.00 0.00 177.93 180.36 1pmo h LYS 74 N 0.68 0.66 -0.69 2.45 1.57 -0.98 -0.38 116.57 119.87 1pmo h LYS 74 Ca 0.17 -0.18 -0.01 0.00 -1.87 0.00 0.00 60.65 58.76 1pmo h LYS 74 Cb 0.14 -0.08 -0.03 0.00 0.08 0.00 0.00 32.23 32.34 1pmo h LYS 74 CO -0.02 0.72 0.38 -0.07 -0.57 0.00 0.00 179.45 179.89 1pmo h LEU 75 N 0.51 0.87 -0.36 2.94 3.38 -0.96 -1.43 115.31 120.27 1pmo h LEU 75 Ca 0.12 -0.09 -0.05 0.00 0.09 0.00 0.00 57.88 57.95 1pmo h LEU 75 Cb 0.38 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 1pmo h LEU 75 CO 0.01 0.71 0.05 0.24 0.09 0.00 0.00 178.44 179.54 1pmo h MET 76 N 0.95 0.60 -0.96 1.13 2.86 -1.07 -2.35 114.93 116.09 1pmo h MET 76 Ca 0.24 -0.17 0.04 0.00 -2.06 0.00 0.00 59.70 57.76 1pmo h MET 76 Cb 0.04 -0.07 -0.06 0.00 0.06 0.00 0.00 31.60 31.57 1pmo h MET 76 CO -0.04 0.68 0.63 0.22 1.06 0.00 0.00 176.91 179.46 1pmo h ASP 77 N 0.43 1.03 1.22 1.22 3.58 -0.77 -1.30 116.42 121.83 1pmo h ASP 77 Ca 0.11 -0.01 -0.02 0.00 0.42 0.00 0.00 57.03 57.53 1pmo h ASP 77 Cb 0.38 -0.23 -0.00 0.00 1.72 0.00 0.00 39.33 41.20 1pmo h ASP 77 CO 0.01 0.69 -0.08 -0.07 -2.88 0.00 0.00 179.24 176.92 1pmo h LEU 78 N 1.19 0.00 -2.32 2.28 3.38 -1.10 -3.24 115.31 115.49 1pmo h LEU 78 Ca 0.39 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.36 1pmo h LEU 78 Cb 0.05 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.80 1pmo h LEU 78 CO -0.13 0.08 0.00 -1.20 0.09 0.00 0.00 178.44 177.28 1pmo n SER 79 N -3.17 3.27 -0.36 -0.43 7.64 -0.54 -4.62 113.62 115.40 1pmo n SER 79 Ca 0.01 -1.94 0.29 0.00 1.01 0.00 0.00 58.87 58.24 1pmo n SER 79 Cb 0.40 -0.23 0.58 0.00 -1.01 0.00 0.00 64.21 63.95 1pmo n SER 79 CO 0.00 0.00 0.00 -0.29 -3.01 0.00 0.00 175.04 171.74 1pmo h ILE 80 N 3.95 0.39 -0.02 0.44 2.10 -1.46 -0.63 117.51 122.28 1pmo h ILE 80 Ca 0.00 -0.09 0.00 0.00 1.08 0.00 0.00 64.86 65.85 1pmo h ILE 80 Cb 0.91 0.11 0.00 0.00 -1.09 0.00 0.00 36.82 36.75 1pmo h ILE 80 CO 0.00 0.05 -0.03 0.59 -1.08 0.00 0.00 178.15 177.68 1pmo n ASN 81 N -4.58 2.33 -4.63 2.19 3.02 -1.26 -4.86 115.26 107.46 1pmo n ASN 81 Ca 0.29 -1.67 -0.43 0.00 -0.03 0.00 0.00 54.58 52.75 1pmo n ASN 81 Cb 1.09 0.04 -0.02 0.00 -0.61 0.00 0.00 39.78 40.29 1pmo n ASN 81 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 1pmo s LYS 82 N -1.45 3.90 -0.38 3.52 1.02 -0.24 -4.97 119.74 121.13 1pmo s LYS 82 Ca 0.19 1.34 -0.24 0.00 0.02 0.00 0.00 55.97 57.27 1pmo s LYS 82 Cb 0.14 -3.91 0.01 0.00 -0.52 0.00 0.00 37.83 33.56 1pmo s LYS 82 CO 0.23 -1.14 0.85 1.21 -0.92 0.00 0.00 175.35 175.58 1pmo s ASN 83 N 3.05 6.58 0.37 2.83 3.84 -1.26 -1.29 114.94 129.06 1pmo s ASN 83 Ca 0.59 0.38 0.12 0.00 0.21 0.00 0.00 52.86 54.16 1pmo s ASN 83 Cb -0.18 -2.43 0.90 0.00 -0.55 0.00 0.00 41.25 38.99 1pmo s ASN 83 CO 0.24 -0.83 1.85 -0.25 -2.79 0.00 0.00 177.10 175.32 1pmo h TRP 84 N 8.58 0.76 0.00 0.43 7.01 -0.72 -2.13 115.95 129.88 1pmo h TRP 84 Ca -0.24 0.02 -0.05 0.00 2.11 0.00 0.00 58.89 60.73 1pmo h TRP 84 Cb 1.09 -0.24 -0.01 0.00 -2.10 0.00 0.00 29.16 27.90 1pmo h TRP 84 CO 0.82 0.23 -0.30 0.97 -2.79 0.00 0.00 178.44 177.38 1pmo h ILE 85 N 0.60 0.38 -1.36 2.65 6.09 -1.78 -3.40 117.51 120.69 1pmo h ILE 85 Ca 0.48 -1.54 -0.72 0.00 -1.37 0.00 0.00 64.86 61.70 1pmo h ILE 85 Cb 0.91 2.16 -0.13 0.00 0.47 0.00 0.00 36.82 40.23 1pmo h ILE 85 CO -0.22 0.21 1.97 -0.67 -3.07 0.00 0.00 178.15 176.37 1pmo n ASP 86 N -3.13 4.94 0.22 2.19 -0.08 -0.80 -4.78 116.55 115.10 1pmo n ASP 86 Ca 0.03 -2.97 0.10 0.00 -1.51 0.00 0.00 54.79 50.44 1pmo n ASP 86 Cb 0.63 -1.61 0.65 0.00 2.34 0.00 0.00 41.12 43.12 1pmo n ASP 86 CO 0.00 0.00 0.00 0.11 0.12 0.00 0.00 177.20 177.43 1pmo h LYS 87 N 6.83 0.00 0.40 -0.67 6.56 -1.81 -2.22 116.57 125.65 1pmo h LYS 87 Ca 0.40 0.00 -0.02 0.00 -1.06 0.00 0.00 60.65 59.97 1pmo h LYS 87 Cb 0.79 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.46 1pmo h LYS 87 CO 1.47 0.00 -0.19 1.49 -2.06 0.00 0.00 179.45 180.15 1pmo h GLU 88 N 0.00 -0.52 0.00 3.15 4.81 -1.96 -2.94 114.58 117.12 1pmo h GLU 88 Ca 0.04 0.04 -0.13 0.00 -0.13 0.00 0.00 59.36 59.17 1pmo h GLU 88 Cb 0.15 0.12 -0.02 0.00 0.63 0.00 0.00 28.75 29.63 1pmo h GLU 88 CO -0.00 -0.26 -0.64 1.49 -0.73 0.00 0.00 179.01 178.87 1pmo h GLU 89 N -0.70 0.00 -2.15 1.92 4.57 -1.93 -3.37 114.58 112.91 1pmo h GLU 89 Ca -0.06 0.00 -0.59 0.00 -1.18 0.00 0.00 59.36 57.54 1pmo h GLU 89 Cb 0.50 0.00 -0.41 0.00 -0.16 0.00 0.00 28.75 28.68 1pmo h GLU 89 CO 0.09 0.64 -0.73 0.66 -1.18 0.00 0.00 179.01 178.49 1pmo n TYR 90 N -3.36 2.66 -0.26 0.92 4.02 -0.85 -4.93 117.16 115.36 1pmo n TYR 90 Ca 0.01 -4.00 -0.05 0.00 -0.01 0.00 0.00 57.90 53.85 1pmo n TYR 90 Cb 0.75 -0.50 0.06 0.00 -0.02 0.00 0.00 39.34 39.63 1pmo n TYR 90 CO 0.00 0.00 0.00 -1.35 -1.01 0.00 0.00 176.86 174.50 1pmo h PRO 91 N 4.01 0.94 -0.21 -0.72 0.11 -1.69 -2.38 132.00 132.05 1pmo h PRO 91 Ca 0.16 -0.06 -0.13 0.00 0.11 0.00 0.00 66.00 66.08 1pmo h PRO 91 Cb 0.71 -0.21 -0.01 0.00 0.11 0.00 0.00 31.00 31.60 1pmo h PRO 91 CO 0.74 0.62 -0.43 0.37 -0.21 0.00 0.00 178.00 179.09 1pmo h GLN 92 N 0.97 0.52 -0.36 1.05 5.75 -1.92 -0.57 115.11 120.54 1pmo h GLN 92 Ca 0.27 -0.27 -0.10 0.00 -0.15 0.00 0.00 58.65 58.40 1pmo h GLN 92 Cb -0.09 0.01 -0.02 0.00 1.07 0.00 0.00 27.48 28.45 1pmo h GLN 92 CO -0.07 0.85 -0.18 0.77 -2.65 0.00 0.00 178.83 177.55 1pmo h SER 93 N 0.42 0.68 -0.55 -0.69 0.02 -1.92 -1.21 113.55 110.30 1pmo h SER 93 Ca 0.03 -0.22 -0.08 0.00 -0.84 0.00 0.00 61.79 60.68 1pmo h SER 93 Cb 0.92 -0.19 -0.02 0.00 0.14 0.00 0.00 62.40 63.26 1pmo h SER 93 CO 0.08 0.87 0.03 0.00 -1.14 0.00 0.00 176.83 176.66 1pmo h ALA 94 N 1.19 0.74 -0.32 3.77 0.00 -1.09 -1.62 119.26 121.94 1pmo h ALA 94 Ca 0.09 -0.28 -0.03 0.00 0.00 0.00 0.00 54.91 54.69 1pmo h ALA 94 Cb 0.65 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 1pmo h ALA 94 CO 0.05 0.55 0.10 0.00 0.00 0.00 0.00 179.25 179.94 1pmo h ALA 95 N 0.97 0.42 -0.87 0.00 0.00 -0.84 -1.85 119.26 117.08 1pmo h ALA 95 Ca 0.16 -0.16 0.04 0.00 0.00 0.00 0.00 54.91 54.95 1pmo h ALA 95 Cb 0.50 -0.12 -0.05 0.00 0.00 0.00 0.00 17.79 18.12 1pmo h ALA 95 CO 0.02 0.06 0.57 0.82 0.00 0.00 0.00 179.25 180.72 1pmo h ILE 96 N 0.36 1.14 -0.62 0.00 2.04 -1.06 -1.42 117.51 117.95 1pmo h ILE 96 Ca 0.10 -0.37 -0.04 0.00 1.00 0.00 0.00 64.86 65.55 1pmo h ILE 96 Cb 0.25 -0.04 -0.03 0.00 -0.74 0.00 0.00 36.82 36.27 1pmo h ILE 96 CO -0.00 0.20 0.23 -0.78 0.00 0.00 0.00 178.15 177.80 1pmo h ASP 97 N 1.08 0.88 -0.76 1.72 3.58 -0.97 -1.86 116.42 120.10 1pmo h ASP 97 Ca 0.35 -0.18 -0.03 0.00 0.42 0.00 0.00 57.03 57.58 1pmo h ASP 97 Cb 0.04 -0.23 -0.03 0.00 1.72 0.00 0.00 39.33 40.83 1pmo h ASP 97 CO -0.11 0.82 0.34 -0.07 -2.88 0.00 0.00 179.24 177.35 1pmo h LEU 98 N 0.88 1.01 -0.25 2.28 3.38 -0.50 -2.09 115.31 120.02 1pmo h LEU 98 Ca 0.21 -0.15 0.01 0.00 0.09 0.00 0.00 57.88 58.04 1pmo h LEU 98 Cb 0.23 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.71 1pmo h LEU 98 CO -0.01 0.87 0.15 0.03 0.09 0.00 0.00 178.44 179.57 1pmo h ARG 99 N 1.07 0.30 -0.77 1.13 3.08 -0.96 -2.15 114.38 116.09 1pmo h ARG 99 Ca 0.26 -0.02 0.06 0.00 0.07 0.00 0.00 59.98 60.35 1pmo h ARG 99 Cb 0.15 -0.07 -0.06 0.00 0.08 0.00 0.00 29.97 30.07 1pmo h ARG 99 CO -0.03 0.20 0.46 0.00 -1.07 0.00 0.00 179.97 179.53 1pmo h VAL 101 N 0.84 1.08 -0.39 0.00 2.07 -1.08 -0.12 116.25 118.64 1pmo h VAL 101 Ca 0.34 -0.15 0.00 0.00 0.82 0.00 0.00 66.70 67.71 1pmo h VAL 101 Cb 0.18 0.71 -0.02 0.00 -1.52 0.00 0.00 31.29 30.64 1pmo h VAL 101 CO -0.18 0.07 0.25 0.78 0.02 0.00 0.00 177.57 178.51 1pmo h ASN 102 N 0.35 0.46 -0.69 0.57 2.35 -0.76 -0.27 115.58 117.58 1pmo h ASN 102 Ca 0.10 -0.03 -0.04 0.00 -0.55 0.00 0.00 56.30 55.77 1pmo h ASN 102 Cb -0.03 -0.12 -0.03 0.00 0.05 0.00 0.00 38.32 38.20 1pmo h ASN 102 CO -0.02 0.35 0.29 0.24 -1.65 0.00 0.00 177.43 176.64 1pmo h MET 103 N 0.52 1.05 -0.38 0.81 2.86 -0.55 0.18 114.93 119.42 1pmo h MET 103 Ca 0.14 -0.18 -0.12 0.00 -2.06 0.00 0.00 59.70 57.48 1pmo h MET 103 Cb -0.03 -0.18 -0.01 0.00 0.06 0.00 0.00 31.60 31.44 1pmo h MET 103 CO -0.03 0.85 -0.24 0.28 1.06 0.00 0.00 176.91 178.84 1pmo h VAL 104 N 1.03 1.28 -0.64 -2.22 2.07 -0.77 -0.71 116.25 116.30 1pmo h VAL 104 Ca 0.24 -1.39 0.00 0.00 0.82 0.00 0.00 66.70 66.37 1pmo h VAL 104 Cb 0.19 1.35 -0.03 0.00 -1.52 0.00 0.00 31.29 31.28 1pmo h VAL 104 CO -0.02 0.46 0.41 0.00 0.02 0.00 0.00 177.57 178.44 1pmo h ALA 105 N 0.79 0.81 -0.54 1.67 0.00 -0.58 -1.74 119.26 119.68 1pmo h ALA 105 Ca 0.08 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 1pmo h ALA 105 Cb 0.81 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.31 1pmo h ALA 105 CO 0.07 0.26 0.25 0.22 0.00 0.00 0.00 179.25 180.05 1pmo h ASP 106 N 0.87 0.71 -0.59 0.00 3.58 -0.49 -1.31 116.42 119.20 1pmo h ASP 106 Ca 0.23 -0.14 0.07 0.00 0.42 0.00 0.00 57.03 57.61 1pmo h ASP 106 Cb -0.07 -0.18 -0.04 0.00 1.72 0.00 0.00 39.33 40.76 1pmo h ASP 106 CO -0.05 0.66 0.39 0.25 -2.88 0.00 0.00 179.24 177.61 1pmo h LEU 107 N 0.72 0.48 -2.53 2.28 5.85 -0.51 -1.79 115.31 119.81 1pmo h LEU 107 Ca 0.18 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.91 1pmo h LEU 107 Cb 0.14 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 41.07 1pmo h LEU 107 CO -0.02 0.31 0.00 0.79 -0.34 0.00 0.00 178.44 179.18 1pmo n TRP 108 N -4.48 1.18 -2.86 1.25 8.01 -0.71 -4.93 117.44 114.90 1pmo n TRP 108 Ca 0.08 -0.47 -0.20 0.00 -1.31 0.00 0.00 57.50 55.60 1pmo n TRP 108 Cb 0.25 -0.20 0.03 0.00 -2.01 0.00 0.00 31.31 29.38 1pmo n TRP 108 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 177.69 177.40 1pmo n HIS 109 N 0.85 -1.66 -2.17 -5.99 8.25 -0.67 -2.34 115.22 111.49 1pmo n HIS 109 Ca 0.20 0.41 -0.39 0.00 -0.26 0.00 0.00 57.72 57.68 1pmo n HIS 109 Cb 0.72 -4.14 -0.01 0.00 1.12 0.00 0.00 29.99 27.68 1pmo n HIS 109 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1pmo s ALA 110 N -3.10 3.20 0.47 -1.41 0.00 -0.54 -4.43 121.76 115.95 1pmo s ALA 110 Ca 0.23 1.10 -0.23 0.00 0.00 0.00 0.00 51.96 53.07 1pmo s ALA 110 Cb -0.10 -3.44 -0.09 0.00 0.00 0.00 0.00 23.12 19.49 1pmo s ALA 110 CO 0.29 -0.69 1.09 -2.30 0.00 0.00 0.00 175.76 174.15 1pmo n PRO 111 N 0.09 1.43 -1.69 0.00 -0.02 -1.26 -4.82 135.00 128.73 1pmo n PRO 111 Ca 0.04 0.52 -0.44 0.00 -2.02 0.00 0.00 63.50 61.59 1pmo n PRO 111 Cb 0.45 -2.19 -0.04 0.00 -0.02 0.00 0.00 33.50 31.70 1pmo n PRO 111 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1pmo n ALA 112 N -0.72 1.95 -1.61 3.55 0.00 -1.26 -4.86 120.51 117.56 1pmo n ALA 112 Ca 0.10 0.41 -0.50 0.00 0.00 0.00 0.00 53.44 53.45 1pmo n ALA 112 Cb 0.41 -2.44 -0.05 0.00 0.00 0.00 0.00 19.45 17.37 1pmo n ALA 112 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1pmo n PRO 113 N 3.91 1.40 0.00 0.00 -0.02 -1.26 -4.80 135.00 134.23 1pmo n PRO 113 Ca 0.17 0.50 0.00 0.00 -2.02 0.00 0.00 63.50 62.15 1pmo n PRO 113 Cb 0.32 -2.15 0.00 0.00 -0.02 0.00 0.00 33.50 31.64 1pmo n PRO 113 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 1pmo n LYS 114 N 2.57 0.81 0.04 -0.52 4.81 -1.26 -4.19 118.16 120.42 1pmo n LYS 114 Ca 0.17 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.61 1pmo n LYS 114 Cb 0.23 -1.15 0.00 0.00 0.02 0.00 0.00 35.03 34.12 1pmo n LYS 114 CO 0.00 0.00 0.00 0.27 1.17 0.00 0.00 177.40 178.84 1pmo n ASN 115 N -0.28 -0.44 0.00 3.14 0.23 -1.26 -5.08 115.26 111.58 1pmo n ASN 115 Ca 0.00 0.15 0.00 0.00 -0.53 0.00 0.00 54.58 54.20 1pmo n ASN 115 Cb 0.08 0.60 0.00 0.00 -2.08 0.00 0.00 39.78 38.38 1pmo n ASN 115 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1pmo n GLY 116 N 0.19 0.00 2.94 4.83 0.00 -1.26 -5.15 105.19 106.75 1pmo n GLY 116 Ca 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.83 1pmo n GLY 116 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1pmo s GLN 117 N 0.00 0.72 0.74 1.61 2.00 -1.26 -4.97 119.66 118.50 1pmo s GLN 117 Ca 0.00 -0.19 -0.12 0.00 -2.00 0.00 0.00 55.36 53.05 1pmo s GLN 117 Cb 0.00 -0.71 0.04 0.00 0.80 0.00 0.00 33.01 33.15 1pmo s GLN 117 CO 0.00 0.04 1.11 0.00 -0.50 0.00 0.00 175.29 175.94 1pmo s ALA 118 N 0.36 2.24 -0.39 1.58 0.00 -1.26 -4.80 121.76 119.49 1pmo s ALA 118 Ca -0.05 0.44 -0.19 0.00 0.00 0.00 0.00 51.96 52.16 1pmo s ALA 118 Cb -0.09 -3.32 0.01 0.00 0.00 0.00 0.00 23.12 19.72 1pmo s ALA 118 CO 0.00 -1.70 0.54 0.08 0.00 0.00 0.00 175.76 174.68 1pmo s VAL 119 N -2.62 4.97 0.00 0.00 1.01 -1.26 -4.91 120.40 117.58 1pmo s VAL 119 Ca 0.65 0.16 0.00 0.00 0.00 0.00 0.00 61.98 62.79 1pmo s VAL 119 Cb -0.20 -4.05 0.00 0.00 0.00 0.00 0.00 36.38 32.13 1pmo s VAL 119 CO 0.50 -0.37 0.00 0.61 0.00 0.00 0.00 175.10 175.85 1pmo n GLY 120 N 4.91 -0.64 3.39 4.51 0.00 -1.26 -0.32 105.19 115.78 1pmo n GLY 120 Ca -0.04 -1.09 -0.13 0.00 0.00 0.00 0.00 46.02 44.76 1pmo n GLY 120 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1pmo s THR 121 N -2.00 0.03 0.46 2.61 -1.32 -0.37 -5.00 115.64 110.05 1pmo s THR 121 Ca 0.00 -0.24 -0.12 0.00 -1.21 0.00 0.00 61.69 60.12 1pmo s THR 121 Cb 0.00 -1.02 -0.06 0.00 -1.51 0.00 0.00 72.50 69.91 1pmo s THR 121 CO 0.00 -0.13 0.85 0.21 -2.21 0.00 0.00 174.62 173.34 1pmo s ASN 122 N -2.29 6.50 0.28 8.08 3.84 -1.26 -2.23 114.94 127.86 1pmo s ASN 122 Ca -0.02 1.26 -0.01 0.00 0.21 0.00 0.00 52.86 54.30 1pmo s ASN 122 Cb -0.00 -2.38 -0.02 0.00 -0.55 0.00 0.00 41.25 38.30 1pmo s ASN 122 CO -0.06 -0.51 0.32 0.42 -2.79 0.00 0.00 177.10 174.48 1pmo s THR 123 N -2.54 0.00 0.29 -5.21 -4.23 -0.37 -4.93 115.64 98.64 1pmo s THR 123 Ca 0.53 -1.80 0.08 0.00 -1.18 0.00 0.00 61.69 59.32 1pmo s THR 123 Cb -0.10 -2.50 0.01 0.00 1.34 0.00 0.00 72.50 71.25 1pmo s THR 123 CO 0.34 0.00 1.66 0.40 -0.54 0.00 0.00 174.62 176.49 1pmo h ILE 124 N 2.29 1.35 -1.61 2.99 5.03 -1.85 0.24 117.51 125.95 1pmo h ILE 124 Ca -0.29 -1.73 0.03 0.00 -0.12 0.00 0.00 64.86 62.75 1pmo h ILE 124 Cb 1.24 1.86 -0.01 0.00 -3.03 0.00 0.00 36.82 36.89 1pmo h ILE 124 CO 0.42 0.51 0.09 0.61 -0.68 0.00 0.00 178.15 179.10 1pmo n GLY 125 N -0.02 1.05 0.20 5.37 0.00 -1.26 -0.85 105.19 109.68 1pmo n GLY 125 Ca -0.02 -0.93 0.05 0.00 0.00 0.00 0.00 46.02 45.12 1pmo n GLY 125 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1pmo h SER 126 N 0.28 0.00 0.47 1.61 0.02 -1.84 -2.86 113.55 111.23 1pmo h SER 126 Ca -0.04 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.90 1pmo h SER 126 Cb 0.17 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.70 1pmo h SER 126 CO 0.05 0.31 -0.33 0.28 -1.14 0.00 0.00 176.83 176.01 1pmo h SER 127 N 0.00 -0.83 -0.65 3.07 0.02 -1.96 0.36 113.55 113.55 1pmo h SER 127 Ca -0.00 0.06 0.01 0.00 -0.84 0.00 0.00 61.79 61.01 1pmo h SER 127 Cb 0.60 0.26 -0.03 0.00 0.14 0.00 0.00 62.40 63.37 1pmo h SER 127 CO 0.04 -0.50 0.43 -0.08 -1.14 0.00 0.00 176.83 175.58 1pmo h GLU 128 N -0.77 0.85 -0.84 3.45 4.81 -1.97 -0.63 114.58 119.48 1pmo h GLU 128 Ca -0.05 -0.05 0.07 0.00 -0.13 0.00 0.00 59.36 59.20 1pmo h GLU 128 Cb 0.65 -0.19 -0.06 0.00 0.63 0.00 0.00 28.75 29.77 1pmo h GLU 128 CO 0.03 0.56 0.51 0.00 -0.73 0.00 0.00 179.01 179.37 1pmo h ALA 129 N 1.25 1.16 -0.33 2.92 0.00 -1.23 -0.75 119.26 122.27 1pmo h ALA 129 Ca 0.24 0.00 -0.15 0.00 0.00 0.00 0.00 54.91 55.01 1pmo h ALA 129 Cb -0.08 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.50 1pmo h ALA 129 CO -0.06 0.22 -0.39 0.00 0.00 0.00 0.00 179.25 179.02 1pmo h MET 131 N 0.65 0.32 -0.45 0.00 2.07 -0.29 0.39 114.93 117.62 1pmo h MET 131 Ca 0.05 -0.03 -0.00 0.00 -2.07 0.00 0.00 59.70 57.66 1pmo h MET 131 Cb 0.95 -0.07 -0.02 0.00 -1.87 0.00 0.00 31.60 30.59 1pmo h MET 131 CO 0.09 0.24 0.27 -0.07 1.07 0.00 0.00 176.91 178.51 1pmo h LEU 132 N 0.31 0.54 -0.92 1.22 3.38 -1.11 0.12 115.31 118.85 1pmo h LEU 132 Ca 0.09 -0.06 -0.05 0.00 0.09 0.00 0.00 57.88 57.95 1pmo h LEU 132 Cb -0.00 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 40.58 1pmo h LEU 132 CO -0.02 0.45 0.24 1.23 0.09 0.00 0.00 178.44 180.43 1pmo h GLY 133 N 0.60 1.11 0.97 0.83 0.00 -0.88 -1.75 103.07 103.94 1pmo h GLY 133 Ca 0.16 -0.61 -0.07 0.00 0.00 0.00 0.00 47.33 46.81 1pmo h GLY 133 CO -0.03 0.58 -0.00 -1.33 0.00 0.00 0.00 176.54 175.75 1pmo h GLY 134 N 1.07 0.84 0.96 4.60 0.00 0.38 -1.68 103.07 109.24 1pmo h GLY 134 Ca 0.23 -0.62 -0.05 0.00 0.00 0.00 0.00 47.33 46.89 1pmo h GLY 134 CO -0.01 0.57 0.10 -0.33 0.00 0.00 0.00 176.54 176.87 1pmo h MET 135 N 0.61 0.73 -0.77 4.80 2.07 -0.60 -0.88 114.93 120.89 1pmo h MET 135 Ca 0.12 -0.18 0.01 0.00 -2.07 0.00 0.00 59.70 57.58 1pmo h MET 135 Cb 0.50 -0.09 -0.04 0.00 -1.87 0.00 0.00 31.60 30.09 1pmo h MET 135 CO 0.02 0.74 0.51 0.00 1.07 0.00 0.00 176.91 179.25 1pmo h ALA 136 N 0.97 0.98 -0.42 6.32 0.00 -1.24 0.37 119.26 126.23 1pmo h ALA 136 Ca 0.14 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1pmo h ALA 136 Cb 0.34 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 1pmo h ALA 136 CO 0.00 0.38 0.28 1.98 0.00 0.00 0.00 179.25 181.89 1pmo h MET 137 N 1.03 0.56 -0.52 0.00 -1.53 -1.01 -0.08 114.93 113.37 1pmo h MET 137 Ca 0.29 -0.04 -0.03 0.00 -3.44 0.00 0.00 59.70 56.48 1pmo h MET 137 Cb -0.10 -0.12 -0.02 0.00 -0.55 0.00 0.00 31.60 30.80 1pmo h MET 137 CO -0.07 0.37 0.22 -0.22 0.14 0.00 0.00 176.91 177.36 1pmo h LYS 138 N 0.57 0.77 -0.49 0.39 3.64 -0.52 -1.75 116.57 119.18 1pmo h LYS 138 Ca 0.15 -0.13 -0.04 0.00 -1.27 0.00 0.00 60.65 59.36 1pmo h LYS 138 Cb -0.06 -0.13 -0.02 0.00 -0.41 0.00 0.00 32.23 31.61 1pmo h LYS 138 CO -0.03 0.67 0.14 -1.49 -2.27 0.00 0.00 179.45 176.47 1pmo h TRP 139 N 0.70 0.79 -0.42 1.91 6.55 -0.64 0.42 115.95 125.26 1pmo h TRP 139 Ca 0.18 -0.08 -0.01 0.00 0.95 0.00 0.00 58.89 59.93 1pmo h TRP 139 Cb 0.17 -0.23 -0.02 0.00 -0.86 0.00 0.00 29.16 28.22 1pmo h TRP 139 CO 0.00 0.70 0.24 0.00 -1.05 0.00 0.00 178.44 178.33 1pmo h ARG 140 N 0.66 0.57 -0.55 0.49 3.08 -0.86 -0.95 114.38 116.82 1pmo h ARG 140 Ca 0.16 -0.06 -0.01 0.00 0.07 0.00 0.00 59.98 60.14 1pmo h ARG 140 Cb 0.29 -0.12 -0.03 0.00 0.08 0.00 0.00 29.97 30.19 1pmo h ARG 140 CO -0.00 0.44 0.30 2.35 -1.07 0.00 0.00 179.97 181.98 1pmo h TRP 141 N 0.54 0.76 -0.28 3.04 7.01 -1.12 -2.47 115.95 123.44 1pmo h TRP 141 Ca 0.15 -0.02 -0.00 0.00 2.11 0.00 0.00 58.89 61.12 1pmo h TRP 141 Cb 0.03 -0.24 -0.01 0.00 -2.10 0.00 0.00 29.16 26.83 1pmo h TRP 141 CO -0.03 0.56 0.16 0.00 -2.79 0.00 0.00 178.44 176.34 1pmo h ARG 142 N 0.74 0.38 -0.93 2.65 3.08 -0.56 -2.23 114.38 117.50 1pmo h ARG 142 Ca 0.19 -0.04 0.13 0.00 0.07 0.00 0.00 59.98 60.33 1pmo h ARG 142 Cb 0.06 -0.08 -0.07 0.00 0.08 0.00 0.00 29.97 29.95 1pmo h ARG 142 CO -0.03 0.31 0.59 0.87 -1.07 0.00 0.00 179.97 180.64 1pmo h LYS 143 N 0.34 0.80 0.76 0.04 1.57 -0.98 -1.95 116.57 117.16 1pmo h LYS 143 Ca 0.10 -0.05 -0.04 0.00 -1.87 0.00 0.00 60.65 58.79 1pmo h LYS 143 Cb 0.03 -0.18 0.01 0.00 0.08 0.00 0.00 32.23 32.17 1pmo h LYS 143 CO -0.02 0.53 -0.37 0.00 -0.57 0.00 0.00 179.45 179.03 1pmo h ARG 144 N 0.83 -0.99 -0.82 3.15 3.08 -0.95 -2.77 114.38 115.91 1pmo h ARG 144 Ca 0.46 0.07 0.17 0.00 0.07 0.00 0.00 59.98 60.75 1pmo h ARG 144 Cb 0.58 0.22 -0.11 0.00 0.08 0.00 0.00 29.97 30.75 1pmo h ARG 144 CO -0.22 -0.66 0.35 0.52 -1.07 0.00 0.00 179.97 178.89 1pmo h MET 145 N -1.21 0.45 -0.13 0.04 2.86 -1.20 0.13 114.93 115.86 1pmo h MET 145 Ca -0.10 -0.03 -0.03 0.00 -2.06 0.00 0.00 59.70 57.48 1pmo h MET 145 Cb 0.78 -0.10 -0.01 0.00 0.06 0.00 0.00 31.60 32.33 1pmo h MET 145 CO 0.17 0.30 -0.03 0.93 1.06 0.00 0.00 176.91 179.33 1pmo h GLU 146 N 0.46 0.19 0.00 1.72 5.08 -1.38 0.17 114.58 120.82 1pmo h GLU 146 Ca 0.47 -0.03 -0.02 0.00 -1.00 0.00 0.00 59.36 58.79 1pmo h GLU 146 Cb 0.78 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.99 1pmo h GLU 146 CO -0.44 0.24 -0.08 0.00 -1.00 0.00 0.00 179.01 177.72 1pmo h ALA 147 N 1.78 0.96 -0.02 3.43 0.00 -0.48 -2.86 119.26 122.07 1pmo h ALA 147 Ca 0.04 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1pmo h ALA 147 Cb 0.19 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.97 1pmo h ALA 147 CO 0.01 0.10 -0.18 0.00 0.00 0.00 0.00 179.25 179.18 1pmo n ALA 148 N -2.12 2.90 -1.15 0.00 0.00 -0.12 -4.95 120.51 115.07 1pmo n ALA 148 Ca 0.03 -0.60 -0.05 0.00 0.00 0.00 0.00 53.44 52.81 1pmo n ALA 148 Cb 0.49 -0.90 -0.02 0.00 0.00 0.00 0.00 19.45 19.02 1pmo n ALA 148 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1pmo n GLY 149 N 1.34 0.76 3.93 0.00 0.00 0.35 -5.02 105.19 106.56 1pmo n GLY 149 Ca 0.13 -0.49 -0.25 0.00 0.00 0.00 0.00 46.02 45.42 1pmo n GLY 149 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1pmo s LYS 150 N -2.03 3.50 0.18 1.61 3.01 0.20 -4.99 119.74 121.23 1pmo s LYS 150 Ca 0.00 -0.24 -0.30 0.00 -1.01 0.00 0.00 55.97 54.42 1pmo s LYS 150 Cb 0.00 -2.62 -0.08 0.00 -1.01 0.00 0.00 37.83 34.12 1pmo s LYS 150 CO 0.00 0.10 1.08 -2.14 0.51 0.00 0.00 175.35 174.91 1pmo s PRO 151 N -4.32 4.61 -0.47 -1.68 0.02 -1.26 -4.21 135.00 127.69 1pmo s PRO 151 Ca 0.41 1.69 0.03 0.00 0.02 0.00 0.00 61.00 63.16 1pmo s PRO 151 Cb -0.10 -3.28 0.49 0.00 0.02 0.00 0.00 34.50 31.63 1pmo s PRO 151 CO 0.37 0.11 1.69 0.25 -0.33 0.00 0.00 177.00 179.09 1pmo n THR 152 N 2.31 3.08 0.08 0.99 -2.24 -1.26 -4.64 114.28 112.60 1pmo n THR 152 Ca 0.02 -3.11 0.05 0.00 -2.27 0.00 0.00 64.05 58.74 1pmo n THR 152 Cb 0.46 -0.90 -0.03 0.00 -2.10 0.00 0.00 70.33 67.76 1pmo n THR 152 CO 0.00 0.00 0.00 -0.78 -0.57 0.00 0.00 175.07 173.72 1pmo h ASP 153 N 1.73 0.00 -2.13 3.42 3.58 -2.01 -3.41 116.42 117.59 1pmo h ASP 153 Ca 0.48 0.00 -0.56 0.00 0.42 0.00 0.00 57.03 57.36 1pmo h ASP 153 Cb 1.43 0.00 -0.41 0.00 1.72 0.00 0.00 39.33 42.07 1pmo h ASP 153 CO 1.08 0.35 -0.85 0.29 -2.88 0.00 0.00 179.24 177.23 1pmo n LYS 154 N -2.87 1.96 -2.24 0.28 5.02 -1.26 -5.10 118.16 113.95 1pmo n LYS 154 Ca -0.04 -4.12 -0.39 0.00 -2.02 0.00 0.00 58.31 51.74 1pmo n LYS 154 Cb 0.71 -1.89 -0.02 0.00 -0.02 0.00 0.00 35.03 33.82 1pmo n LYS 154 CO 0.00 0.00 0.00 -2.14 -0.52 0.00 0.00 177.40 174.74 1pmo s PRO 155 N -2.41 4.10 0.10 1.97 0.02 -1.26 -4.79 135.00 132.73 1pmo s PRO 155 Ca 0.41 1.94 0.01 0.00 0.02 0.00 0.00 61.00 63.38 1pmo s PRO 155 Cb 0.23 -2.77 -0.04 0.00 0.02 0.00 0.00 34.50 31.94 1pmo s PRO 155 CO -0.08 -0.31 -0.04 0.54 -0.33 0.00 0.00 177.00 176.79 1pmo s ASN 156 N -0.97 0.92 -0.06 2.53 2.20 -0.45 -0.99 114.94 118.12 1pmo s ASN 156 Ca 0.55 -1.04 0.01 0.00 -0.94 0.00 0.00 52.86 51.44 1pmo s ASN 156 Cb -0.33 0.14 0.02 0.00 -2.00 0.00 0.00 41.25 39.08 1pmo s ASN 156 CO 0.42 -0.53 -0.07 -0.22 -2.94 0.00 0.00 177.10 173.76 1pmo s LEU 157 N -3.03 1.38 -0.15 3.54 1.98 0.48 -0.55 118.68 122.32 1pmo s LEU 157 Ca 0.13 -0.19 -0.10 0.00 -2.89 0.00 0.00 54.13 51.08 1pmo s LEU 157 Cb 0.06 -0.59 -0.05 0.00 0.66 0.00 0.00 46.19 46.27 1pmo s LEU 157 CO -0.04 -0.04 0.17 -0.69 -1.89 0.00 0.00 176.35 173.86 1pmo s VAL 158 N 0.95 5.41 0.37 1.68 1.01 -0.98 -0.16 120.40 128.68 1pmo s VAL 158 Ca -0.10 0.28 -0.17 0.00 0.00 0.00 0.00 61.98 61.99 1pmo s VAL 158 Cb -0.15 -3.48 0.05 0.00 0.00 0.00 0.00 36.38 32.81 1pmo s VAL 158 CO 0.00 0.51 0.79 0.00 0.00 0.00 0.00 175.10 176.40 1pmo n GLY 160 N -0.53 2.99 3.14 0.00 0.00 -1.26 -0.21 105.19 109.32 1pmo n GLY 160 Ca -0.08 -1.80 -0.41 0.00 0.00 0.00 0.00 46.02 43.73 1pmo n GLY 160 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1pmo n PRO 161 N 0.00 1.88 -1.25 1.61 -0.04 -1.26 -4.54 135.00 131.40 1pmo n PRO 161 Ca 0.00 -2.18 -0.30 0.00 -0.04 0.00 0.00 63.50 60.98 1pmo n PRO 161 Cb 0.00 -3.16 0.13 0.00 -0.04 0.00 0.00 33.50 30.43 1pmo n PRO 161 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1pmo s VAL 162 N 5.60 2.77 0.58 0.52 -7.23 -1.26 -4.65 120.40 116.73 1pmo s VAL 162 Ca 0.57 0.25 -0.10 0.00 -1.81 0.00 0.00 61.98 60.89 1pmo s VAL 162 Cb 0.11 -2.77 -0.04 0.00 0.56 0.00 0.00 36.38 34.24 1pmo s VAL 162 CO 0.08 -0.33 0.97 -1.58 -0.31 0.00 0.00 175.10 173.93 1pmo s GLN 163 N -4.96 3.62 0.58 4.82 -0.44 -1.26 -4.94 119.66 117.08 1pmo s GLN 163 Ca 0.63 0.64 0.31 0.00 -2.50 0.00 0.00 55.36 54.44 1pmo s GLN 163 Cb -0.17 -2.15 1.39 0.00 -1.64 0.00 0.00 33.01 30.43 1pmo s GLN 163 CO 0.56 -0.46 1.75 0.97 0.50 0.00 0.00 175.29 178.62 1pmo h ILE 164 N -0.08 0.30 -0.09 -2.34 2.10 -1.96 -1.44 117.51 114.00 1pmo h ILE 164 Ca -0.45 0.00 0.03 0.00 1.08 0.00 0.00 64.86 65.52 1pmo h ILE 164 Cb 1.19 0.43 -0.00 0.00 -1.09 0.00 0.00 36.82 37.35 1pmo h ILE 164 CO 0.62 0.00 0.06 0.00 -1.08 0.00 0.00 178.15 177.75 1pmo h TRP 166 N 0.00 0.14 -0.56 0.00 4.06 -1.63 -0.57 115.95 117.40 1pmo h TRP 166 Ca 0.04 -0.08 -0.10 0.00 2.06 0.00 0.00 58.89 60.81 1pmo h TRP 166 Cb 0.17 -0.01 -0.02 0.00 -1.00 0.00 0.00 29.16 28.29 1pmo h TRP 166 CO 0.00 0.92 -0.03 0.45 -3.56 0.00 0.00 178.44 176.22 1pmo h HIS 167 N 0.05 1.09 -0.34 0.49 3.86 -1.37 -0.63 115.15 118.30 1pmo h HIS 167 Ca -0.03 -0.19 -0.07 0.00 -1.16 0.00 0.00 60.37 58.92 1pmo h HIS 167 Cb 1.53 -0.28 -0.01 0.00 1.06 0.00 0.00 27.41 29.70 1pmo h HIS 167 CO 0.02 0.98 -0.05 0.87 0.86 0.00 0.00 177.93 180.61 1pmo h LYS 168 N 0.91 0.63 -0.22 2.45 1.57 -1.10 -1.40 116.57 119.41 1pmo h LYS 168 Ca 0.16 -0.23 0.01 0.00 -1.87 0.00 0.00 60.65 58.72 1pmo h LYS 168 Cb 0.57 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.83 1pmo h LYS 168 CO 0.03 0.79 0.13 0.35 -0.57 0.00 0.00 179.45 180.18 1pmo h PHE 169 N 0.42 0.24 -0.37 -1.35 3.57 -0.86 0.32 116.94 118.91 1pmo h PHE 169 Ca 0.09 0.01 0.04 0.00 3.53 0.00 0.00 57.97 61.64 1pmo h PHE 169 Cb 0.53 -0.08 -0.04 0.00 2.79 0.00 0.00 35.95 39.16 1pmo h PHE 169 CO 0.05 0.14 0.14 0.00 -2.23 0.00 0.00 178.31 176.41 1pmo h ALA 170 N 1.09 0.44 0.12 2.41 0.00 -1.04 -0.56 119.26 121.72 1pmo h ALA 170 Ca 0.08 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 1pmo h ALA 170 Cb -0.01 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1pmo h ALA 170 CO -0.04 -0.24 -0.06 -0.09 0.00 0.00 0.00 179.25 178.82 1pmo h ARG 171 N 0.30 -0.16 0.00 0.00 9.65 -0.93 0.13 114.38 123.38 1pmo h ARG 171 Ca 0.17 0.01 -0.07 0.00 -1.10 0.00 0.00 59.98 58.98 1pmo h ARG 171 Cb 0.13 0.04 -0.01 0.00 -1.39 0.00 0.00 29.97 28.73 1pmo h ARG 171 CO -0.16 0.10 -0.36 1.88 2.80 0.00 0.00 179.97 184.24 1pmo h TYR 172 N -0.40 0.00 -0.27 2.20 0.05 -0.23 -3.13 116.97 115.19 1pmo h TYR 172 Ca -0.02 0.00 -0.01 0.00 0.05 0.00 0.00 58.73 58.75 1pmo h TYR 172 Cb 0.33 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.06 1pmo h TYR 172 CO 0.00 0.36 0.00 0.91 -1.05 0.00 0.00 178.16 178.38 1pmo n TRP 173 N -3.95 0.96 -3.89 4.88 8.01 -0.23 -5.00 117.44 118.22 1pmo n TRP 173 Ca -0.02 -0.92 -0.37 0.00 -1.31 0.00 0.00 57.50 54.88 1pmo n TRP 173 Cb 0.41 -0.33 0.02 0.00 -2.01 0.00 0.00 31.31 29.41 1pmo n TRP 173 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.69 176.43 1pmo n ASP 174 N -0.56 -4.05 -4.19 -0.99 8.00 -0.82 -4.99 116.55 108.96 1pmo n ASP 174 Ca 0.22 -1.13 -0.31 0.00 0.71 0.00 0.00 54.79 54.28 1pmo n ASP 174 Cb 0.91 -2.64 -0.17 0.00 -0.02 0.00 0.00 41.12 39.20 1pmo n ASP 174 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1pmo s VAL 175 N -3.59 1.91 0.04 2.53 1.01 -0.03 -4.73 120.40 117.54 1pmo s VAL 175 Ca 0.41 -0.93 -0.30 0.00 0.00 0.00 0.00 61.98 61.15 1pmo s VAL 175 Cb -0.18 -1.66 -0.07 0.00 0.00 0.00 0.00 36.38 34.47 1pmo s VAL 175 CO 0.91 0.53 1.47 -0.70 0.00 0.00 0.00 175.10 177.31 1pmo s GLU 176 N 0.39 4.26 -0.42 2.72 2.12 -0.16 -4.51 118.70 123.10 1pmo s GLU 176 Ca -0.18 2.09 -0.19 0.00 0.36 0.00 0.00 54.97 57.04 1pmo s GLU 176 Cb -0.18 -3.53 0.02 0.00 0.26 0.00 0.00 34.13 30.70 1pmo s GLU 176 CO 0.08 -0.60 0.57 -1.17 -0.54 0.00 0.00 175.26 173.59 1pmo s LEU 177 N 2.29 4.58 -0.98 2.70 1.98 -1.26 -0.39 118.68 127.60 1pmo s LEU 177 Ca 0.67 -0.38 -0.11 0.00 -2.89 0.00 0.00 54.13 51.42 1pmo s LEU 177 Cb -0.35 -2.61 0.25 0.00 0.66 0.00 0.00 46.19 44.14 1pmo s LEU 177 CO 0.29 -0.68 0.94 -0.13 -1.89 0.00 0.00 176.35 174.88 1pmo s ARG 178 N 2.57 3.89 -0.31 1.98 0.52 0.77 -4.94 118.95 123.42 1pmo s ARG 178 Ca 0.19 -2.90 -0.22 0.00 -0.52 0.00 0.00 55.73 52.29 1pmo s ARG 178 Cb -0.15 -4.46 -0.00 0.00 0.52 0.00 0.00 34.95 30.85 1pmo s ARG 178 CO 0.17 -1.26 0.70 -2.00 0.02 0.00 0.00 175.30 172.92 1pmo s GLU 179 N -0.66 3.91 0.03 3.54 2.12 -1.26 -2.13 118.70 124.26 1pmo s GLU 179 Ca 0.25 0.41 -0.30 0.00 0.36 0.00 0.00 54.97 55.69 1pmo s GLU 179 Cb -0.10 -3.73 -0.08 0.00 0.26 0.00 0.00 34.13 30.48 1pmo s GLU 179 CO -0.08 -0.63 1.73 0.42 -0.54 0.00 0.00 175.26 176.15 1pmo s ILE 180 N 2.77 3.18 0.45 -3.70 1.09 0.70 -4.92 121.20 120.76 1pmo s ILE 180 Ca 0.28 0.44 -0.25 0.00 -1.10 0.00 0.00 60.65 60.02 1pmo s ILE 180 Cb -0.15 -3.28 -0.09 0.00 -1.06 0.00 0.00 42.46 37.89 1pmo s ILE 180 CO 0.12 -0.02 1.37 -2.65 -0.10 0.00 0.00 174.94 173.67 1pmo n PRO 181 N 6.49 2.11 -2.72 2.79 -0.02 -1.26 -4.33 135.00 138.06 1pmo n PRO 181 Ca 0.17 0.75 -0.41 0.00 -2.02 0.00 0.00 63.50 61.99 1pmo n PRO 181 Cb 0.41 -2.54 -0.04 0.00 -0.02 0.00 0.00 33.50 31.30 1pmo n PRO 181 CO 0.00 0.00 0.00 1.41 1.98 0.00 0.00 175.50 178.89 1pmo s MET 182 N -2.39 4.68 0.04 -0.52 1.75 -1.26 -4.80 119.30 116.80 1pmo s MET 182 Ca 0.62 1.46 -0.07 0.00 -1.25 0.00 0.00 55.69 56.45 1pmo s MET 182 Cb -0.47 -3.38 -0.00 0.00 2.84 0.00 0.00 34.83 33.82 1pmo s MET 182 CO 0.57 0.19 0.13 1.03 -0.65 0.00 0.00 175.02 176.29 1pmo s ARG 183 N 0.06 0.62 0.24 4.11 0.52 -0.98 0.51 118.95 124.02 1pmo s ARG 183 Ca 0.47 -0.68 -0.31 0.00 -0.52 0.00 0.00 55.73 54.69 1pmo s ARG 183 Cb -0.23 0.25 -0.12 0.00 0.52 0.00 0.00 34.95 35.36 1pmo s ARG 183 CO 0.30 -0.16 1.64 -2.30 0.02 0.00 0.00 175.30 174.80 1pmo n PRO 184 N 0.79 2.63 0.00 3.54 -0.02 -1.26 -0.55 135.00 140.14 1pmo n PRO 184 Ca -0.19 0.94 0.00 0.00 -2.02 0.00 0.00 63.50 62.23 1pmo n PRO 184 Cb 0.58 -2.75 0.00 0.00 -0.02 0.00 0.00 33.50 31.32 1pmo n PRO 184 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1pmo n GLY 185 N 3.12 2.90 3.02 -1.23 0.00 -1.26 -4.88 105.19 106.86 1pmo n GLY 185 Ca 0.13 -0.37 -0.06 0.00 0.00 0.00 0.00 46.02 45.72 1pmo n GLY 185 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1pmo s GLN 186 N 0.00 0.72 0.00 1.61 -2.07 0.29 -5.00 119.66 115.21 1pmo s GLN 186 Ca 0.00 -0.45 0.27 0.00 -1.82 0.00 0.00 55.36 53.36 1pmo s GLN 186 Cb 0.00 -0.23 1.18 0.00 -1.09 0.00 0.00 33.01 32.87 1pmo s GLN 186 CO 0.00 -1.18 1.88 1.28 -1.32 0.00 0.00 175.29 175.95 1pmo n LEU 187 N 4.43 0.00 -4.64 2.60 4.77 -1.07 -2.32 117.00 120.77 1pmo n LEU 187 Ca 0.10 0.48 -0.29 0.00 -0.03 0.00 0.00 56.01 56.27 1pmo n LEU 187 Cb 0.52 -0.48 -0.10 0.00 -2.33 0.00 0.00 43.42 41.03 1pmo n LEU 187 CO 0.04 -0.03 -0.28 -0.36 -1.33 0.00 0.00 177.39 175.42 1pmo s PHE 188 N -2.96 2.35 -0.39 -1.77 0.08 -1.26 -4.53 117.98 109.50 1pmo s PHE 188 Ca 0.14 -0.75 -0.29 0.00 0.12 0.00 0.00 56.93 56.15 1pmo s PHE 188 Cb 0.18 -1.71 0.01 0.00 -0.57 0.00 0.00 43.02 40.92 1pmo s PHE 188 CO 0.49 0.37 1.33 1.41 -0.10 0.00 0.00 175.22 178.72 1pmo s MET 189 N -3.75 3.70 0.31 0.44 -2.45 -1.26 -4.99 119.30 111.30 1pmo s MET 189 Ca 0.29 0.96 0.05 0.00 -1.25 0.00 0.00 55.69 55.73 1pmo s MET 189 Cb 0.08 -3.96 -0.02 0.00 1.25 0.00 0.00 34.83 32.18 1pmo s MET 189 CO 0.15 -1.40 0.46 0.16 1.05 0.00 0.00 175.02 175.44 1pmo s ASP 190 N 3.32 6.12 0.20 1.11 -4.77 -1.26 -4.92 116.67 116.47 1pmo s ASP 190 Ca 0.57 0.03 -0.12 0.00 -3.30 0.00 0.00 52.55 49.74 1pmo s ASP 190 Cb -0.13 -1.59 0.24 0.00 -1.09 0.00 0.00 42.92 40.35 1pmo s ASP 190 CO 0.30 -0.31 1.70 -0.65 0.70 0.00 0.00 175.17 176.90 1pmo h PRO 191 N 0.92 0.21 0.71 2.11 0.11 -1.95 -1.26 132.00 132.86 1pmo h PRO 191 Ca -0.49 -0.01 -0.03 0.00 0.11 0.00 0.00 66.00 65.58 1pmo h PRO 191 Cb 1.24 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.31 1pmo h PRO 191 CO 0.57 0.14 -0.39 -0.22 -0.21 0.00 0.00 178.00 177.89 1pmo h LYS 192 N 0.22 -0.99 0.00 1.05 3.64 -1.98 -1.44 116.57 117.07 1pmo h LYS 192 Ca 0.28 0.07 -0.04 0.00 -1.27 0.00 0.00 60.65 59.69 1pmo h LYS 192 Cb 0.41 0.23 -0.01 0.00 -0.41 0.00 0.00 32.23 32.45 1pmo h LYS 192 CO -0.39 -0.66 -0.18 0.00 -2.27 0.00 0.00 179.45 175.96 1pmo h ARG 193 N -1.03 0.00 0.15 1.90 3.08 -1.96 -1.72 114.38 114.81 1pmo h ARG 193 Ca -0.09 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 59.95 1pmo h ARG 193 Cb 0.81 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.86 1pmo h ARG 193 CO 0.12 0.18 -0.07 1.98 -1.07 0.00 0.00 179.97 181.11 1pmo h MET 194 N 0.00 -0.20 -0.71 0.04 4.05 -1.01 -2.88 114.93 114.23 1pmo h MET 194 Ca -0.00 0.01 -0.01 0.00 -0.28 0.00 0.00 59.70 59.43 1pmo h MET 194 Cb 0.33 0.04 -0.03 0.00 -0.80 0.00 0.00 31.60 31.14 1pmo h MET 194 CO 0.02 0.04 0.42 0.82 0.23 0.00 0.00 176.91 178.44 1pmo h ILE 195 N -0.42 1.20 0.00 1.77 5.03 -0.90 -1.36 117.51 122.83 1pmo h ILE 195 Ca -0.02 -0.46 -0.00 0.00 -0.12 0.00 0.00 64.86 64.26 1pmo h ILE 195 Cb 0.33 0.21 -0.00 0.00 -3.03 0.00 0.00 36.82 34.33 1pmo h ILE 195 CO 0.03 0.21 -0.01 -0.33 -0.68 0.00 0.00 178.15 177.38 1pmo h GLU 196 N 0.98 0.00 0.00 2.37 5.08 -1.19 -2.01 114.58 119.80 1pmo h GLU 196 Ca 0.25 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.61 1pmo h GLU 196 Cb -0.02 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.23 1pmo h GLU 196 CO -0.05 0.01 -0.73 0.00 -1.00 0.00 0.00 179.01 177.24 1pmo n ALA 197 N -2.37 3.57 -2.09 3.43 0.00 -0.54 -4.95 120.51 117.55 1pmo n ALA 197 Ca -0.03 -0.38 -0.35 0.00 0.00 0.00 0.00 53.44 52.68 1pmo n ALA 197 Cb 0.09 -1.04 -0.06 0.00 0.00 0.00 0.00 19.45 18.44 1pmo n ALA 197 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1pmo n ASP 199 N 0.29 0.00 0.30 0.00 5.68 -1.26 -5.02 116.55 116.54 1pmo n ASP 199 Ca 0.00 -0.93 0.17 0.00 -0.50 0.00 0.00 54.79 53.53 1pmo n ASP 199 Cb 0.52 0.00 0.95 0.00 -1.14 0.00 0.00 41.12 41.45 1pmo n ASP 199 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 1pmo h GLU 200 N 0.00 0.00 -0.01 0.11 3.07 -2.00 -2.49 114.58 113.26 1pmo h GLU 200 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1pmo h GLU 200 Cb 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.91 1pmo h GLU 200 CO 0.00 0.03 -0.20 0.09 -1.40 0.00 0.00 179.01 177.53 1pmo n ASN 201 N -3.53 1.69 -4.61 1.42 3.02 -1.26 -4.88 115.26 107.11 1pmo n ASN 201 Ca -0.03 -1.37 -0.43 0.00 -0.03 0.00 0.00 54.58 52.73 1pmo n ASN 201 Cb 0.13 0.15 -0.02 0.00 -0.61 0.00 0.00 39.78 39.43 1pmo n ASN 201 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1pmo s THR 202 N -2.28 3.66 -0.17 3.41 2.01 -0.94 -1.34 115.64 119.99 1pmo s THR 202 Ca 0.27 0.71 0.29 0.00 0.31 0.00 0.00 61.69 63.27 1pmo s THR 202 Cb 0.20 -3.78 0.36 0.00 0.01 0.00 0.00 72.50 69.28 1pmo s THR 202 CO 0.45 -0.42 1.84 0.16 -0.69 0.00 0.00 174.62 175.95 1pmo h ILE 203 N 6.44 0.00 0.00 1.82 3.07 -1.17 -3.48 117.51 124.20 1pmo h ILE 203 Ca -0.32 -0.63 0.00 0.00 1.55 0.00 0.00 64.86 65.46 1pmo h ILE 203 Cb 1.15 1.60 0.00 0.00 -0.27 0.00 0.00 36.82 39.30 1pmo h ILE 203 CO 1.03 0.00 0.00 0.61 -1.05 0.00 0.00 178.15 178.74 1pmo n GLY 204 N 0.42 0.98 3.44 0.16 0.00 -1.26 -4.66 105.19 104.27 1pmo n GLY 204 Ca 0.02 -1.12 -0.32 0.00 0.00 0.00 0.00 46.02 44.59 1pmo n GLY 204 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1pmo s VAL 205 N -2.00 2.82 -0.48 1.61 1.01 -0.51 -2.32 120.40 120.53 1pmo s VAL 205 Ca 0.00 -0.83 0.03 0.00 0.00 0.00 0.00 61.98 61.18 1pmo s VAL 205 Cb 0.00 -2.08 0.12 0.00 0.00 0.00 0.00 36.38 34.42 1pmo s VAL 205 CO 0.00 0.58 0.21 -0.69 0.00 0.00 0.00 175.10 175.20 1pmo s VAL 206 N -0.71 2.60 0.36 2.92 1.01 -0.22 -1.79 120.40 124.56 1pmo s VAL 206 Ca 0.11 -3.01 -0.25 0.00 0.00 0.00 0.00 61.98 58.84 1pmo s VAL 206 Cb -0.10 -2.83 -0.10 0.00 0.00 0.00 0.00 36.38 33.35 1pmo s VAL 206 CO 0.00 -0.75 0.98 -2.84 0.00 0.00 0.00 175.10 172.49 1pmo s PRO 207 N 0.08 4.42 -0.45 2.72 0.02 -1.22 -4.18 135.00 136.39 1pmo s PRO 207 Ca 0.15 1.36 -0.12 0.00 0.02 0.00 0.00 61.00 62.42 1pmo s PRO 207 Cb -0.24 -2.66 0.08 0.00 0.02 0.00 0.00 34.50 31.71 1pmo s PRO 207 CO -0.02 0.12 0.33 0.99 -0.33 0.00 0.00 177.00 178.08 1pmo s THR 208 N -1.69 4.64 -1.47 0.99 2.01 -1.26 -1.76 115.64 117.10 1pmo s THR 208 Ca 0.54 -1.31 -0.13 0.00 0.31 0.00 0.00 61.69 61.10 1pmo s THR 208 Cb -0.19 -3.83 0.03 0.00 0.01 0.00 0.00 72.50 68.52 1pmo s THR 208 CO 0.24 -0.57 2.32 0.33 -0.69 0.00 0.00 174.62 176.25 1pmo n PHE 209 N 5.04 3.35 0.00 4.92 7.35 -0.33 -2.46 117.46 135.33 1pmo n PHE 209 Ca -0.11 -2.99 0.00 0.00 -0.76 0.00 0.00 57.45 53.59 1pmo n PHE 209 Cb 0.43 -2.52 0.00 0.00 0.35 0.00 0.00 39.48 37.74 1pmo n PHE 209 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1pmo n GLY 210 N 3.95 0.93 3.70 7.13 0.00 -1.20 -2.39 105.19 117.30 1pmo n GLY 210 Ca 0.55 -0.41 -0.42 0.00 0.00 0.00 0.00 46.02 45.74 1pmo n GLY 210 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1pmo s VAL 211 N 0.00 2.87 0.21 1.61 1.01 0.76 -4.72 120.40 122.14 1pmo s VAL 211 Ca 0.00 0.47 -0.10 0.00 0.00 0.00 0.00 61.98 62.35 1pmo s VAL 211 Cb 0.00 -3.30 0.16 0.00 0.00 0.00 0.00 36.38 33.24 1pmo s VAL 211 CO 0.00 0.01 1.71 0.74 0.00 0.00 0.00 175.10 177.57 1pmo h THR 212 N 4.50 0.67 0.00 3.92 2.02 -1.90 0.38 112.91 122.49 1pmo h THR 212 Ca -0.43 -0.10 -0.09 0.00 0.77 0.00 0.00 66.41 66.56 1pmo h THR 212 Cb 1.20 0.35 -0.01 0.00 -1.74 0.00 0.00 68.15 67.95 1pmo h THR 212 CO 0.92 0.05 -0.44 1.88 0.37 0.00 0.00 175.52 178.30 1pmo h TYR 213 N 0.29 0.00 0.00 3.16 0.05 -1.88 -3.39 116.97 115.20 1pmo h TYR 213 Ca 0.31 0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.09 1pmo h TYR 213 Cb 0.45 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.19 1pmo h TYR 213 CO -0.23 0.44 -0.62 0.25 -1.05 0.00 0.00 178.16 176.95 1pmo n THR 214 N -3.82 0.00 0.00 -2.88 -2.24 -1.10 -4.91 114.28 99.33 1pmo n THR 214 Ca -0.01 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.77 1pmo n THR 214 Cb 0.50 -0.53 0.00 0.00 -2.10 0.00 0.00 70.33 68.19 1pmo n THR 214 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1pmo n GLY 215 N 2.00 0.25 3.81 3.38 0.00 0.13 -4.51 105.19 110.25 1pmo n GLY 215 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 1pmo n GLY 215 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1pmo s ASN 216 N -2.22 6.25 0.13 1.61 0.01 -1.26 -1.37 114.94 118.09 1pmo s ASN 216 Ca 0.00 1.78 -0.15 0.00 -0.71 0.00 0.00 52.86 53.78 1pmo s ASN 216 Cb 0.00 -2.54 -0.07 0.00 0.41 0.00 0.00 41.25 39.06 1pmo s ASN 216 CO 0.00 -0.84 0.55 -0.31 -1.51 0.00 0.00 177.10 174.99 1pmo s TYR 217 N -2.33 3.64 -0.30 2.20 2.02 -0.13 -0.17 117.35 122.29 1pmo s TYR 217 Ca 0.63 1.10 -0.10 0.00 -0.37 0.00 0.00 57.07 58.34 1pmo s TYR 217 Cb -0.14 -2.39 -0.02 0.00 -0.40 0.00 0.00 41.96 39.00 1pmo s TYR 217 CO 0.28 0.46 0.16 -1.21 -1.57 0.00 0.00 175.55 173.68 1pmo s GLU 218 N -1.79 3.58 -0.37 -0.62 2.02 -1.03 -4.87 118.70 115.62 1pmo s GLU 218 Ca 0.36 -0.56 -0.29 0.00 0.02 0.00 0.00 54.97 54.50 1pmo s GLU 218 Cb -0.16 -3.59 0.02 0.00 0.10 0.00 0.00 34.13 30.50 1pmo s GLU 218 CO 0.19 -0.32 1.16 -0.06 0.02 0.00 0.00 175.26 176.25 1pmo s PHE 219 N 1.67 2.92 0.42 1.61 0.08 -1.26 -4.46 117.98 118.95 1pmo s PHE 219 Ca 0.06 0.96 0.12 0.00 0.12 0.00 0.00 56.93 58.19 1pmo s PHE 219 Cb -0.16 -3.99 0.90 0.00 -0.57 0.00 0.00 43.02 39.19 1pmo s PHE 219 CO 0.08 -1.17 1.96 -1.35 -0.10 0.00 0.00 175.22 174.63 1pmo h PRO 220 N 8.80 0.12 0.17 0.24 0.11 -1.89 -3.31 132.00 136.24 1pmo h PRO 220 Ca -0.23 -0.02 0.01 0.00 0.11 0.00 0.00 66.00 65.87 1pmo h PRO 220 Cb 1.07 -0.02 -0.02 0.00 0.11 0.00 0.00 31.00 32.14 1pmo h PRO 220 CO 1.06 0.28 -0.20 0.37 -0.21 0.00 0.00 178.00 179.30 1pmo h GLN 221 N 0.11 -0.41 -0.42 1.05 4.15 -1.93 0.40 115.11 118.08 1pmo h GLN 221 Ca 0.02 0.03 -0.01 0.00 0.77 0.00 0.00 58.65 59.46 1pmo h GLN 221 Cb 0.34 0.09 -0.02 0.00 0.21 0.00 0.00 27.48 28.10 1pmo h GLN 221 CO 0.02 -0.27 0.21 -1.35 -1.93 0.00 0.00 178.83 175.51 1pmo h PRO 222 N -0.42 0.58 -0.33 -2.39 0.11 -1.93 -0.57 132.00 127.04 1pmo h PRO 222 Ca 0.01 -0.06 -0.12 0.00 0.11 0.00 0.00 66.00 65.94 1pmo h PRO 222 Cb 0.41 -0.12 -0.01 0.00 0.11 0.00 0.00 31.00 31.39 1pmo h PRO 222 CO -0.07 0.44 -0.30 -0.07 -0.21 0.00 0.00 178.00 177.79 1pmo h LEU 223 N 0.58 0.73 -0.62 2.35 3.38 -1.55 -2.38 115.31 117.80 1pmo h LEU 223 Ca 0.15 -0.29 -0.04 0.00 0.09 0.00 0.00 57.88 57.79 1pmo h LEU 223 Cb 0.05 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.57 1pmo h LEU 223 CO -0.02 0.98 0.24 -0.74 0.09 0.00 0.00 178.44 178.98 1pmo h HIS 224 N 0.60 0.96 -0.33 1.13 2.76 0.10 -1.51 115.15 118.86 1pmo h HIS 224 Ca 0.07 -0.08 -0.00 0.00 -2.20 0.00 0.00 60.37 58.16 1pmo h HIS 224 Cb 0.81 -0.29 -0.02 0.00 1.55 0.00 0.00 27.41 29.47 1pmo h HIS 224 CO 0.04 0.77 0.20 -0.44 -1.30 0.00 0.00 177.93 177.20 1pmo h ASP 225 N 0.87 0.40 -0.77 3.26 3.32 -0.93 -1.51 116.42 121.07 1pmo h ASP 225 Ca 0.21 -0.05 0.03 0.00 0.02 0.00 0.00 57.03 57.23 1pmo h ASP 225 Cb 0.22 -0.10 -0.04 0.00 0.22 0.00 0.00 39.33 39.63 1pmo h ASP 225 CO -0.01 0.33 0.51 0.00 -1.72 0.00 0.00 179.24 178.34 1pmo h ALA 226 N 1.09 1.52 0.00 3.45 0.00 -1.10 -1.03 119.26 123.18 1pmo h ALA 226 Ca 0.12 -0.04 -0.11 0.00 0.00 0.00 0.00 54.91 54.88 1pmo h ALA 226 Cb 0.00 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.50 1pmo h ALA 226 CO -0.02 0.42 -0.51 -0.07 0.00 0.00 0.00 179.25 179.07 1pmo h LEU 227 N 0.97 0.00 -0.25 0.00 3.38 -0.84 -0.09 115.31 118.48 1pmo h LEU 227 Ca 0.30 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 58.20 1pmo h LEU 227 Cb 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 1pmo h LEU 227 CO -0.08 0.51 -0.13 0.44 0.09 0.00 0.00 178.44 179.27 1pmo h ASP 228 N 0.00 0.55 -0.46 -0.43 3.32 -0.19 -1.69 116.42 117.51 1pmo h ASP 228 Ca -0.01 -0.41 -0.06 0.00 0.02 0.00 0.00 57.03 56.57 1pmo h ASP 228 Cb 0.97 -0.15 -0.02 0.00 0.22 0.00 0.00 39.33 40.35 1pmo h ASP 228 CO 0.07 0.84 0.09 0.11 -1.72 0.00 0.00 179.24 178.62 1pmo h LYS 229 N 0.26 0.83 -0.14 3.56 1.57 -1.09 -1.81 116.57 119.75 1pmo h LYS 229 Ca 0.06 -0.19 -0.00 0.00 -1.87 0.00 0.00 60.65 58.64 1pmo h LYS 229 Cb 0.64 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 32.83 1pmo h LYS 229 CO 0.04 0.78 0.08 0.35 -0.57 0.00 0.00 179.45 180.12 1pmo h PHE 230 N 0.79 0.20 -0.40 -1.35 3.57 -0.82 -0.03 116.94 118.90 1pmo h PHE 230 Ca 0.17 -0.00 -0.04 0.00 3.53 0.00 0.00 57.97 61.62 1pmo h PHE 230 Cb 0.35 -0.06 -0.02 0.00 2.79 0.00 0.00 35.95 39.01 1pmo h PHE 230 CO 0.02 0.20 0.07 0.37 -2.23 0.00 0.00 178.31 176.74 1pmo h GLN 231 N 0.13 0.60 -0.58 1.11 4.15 -1.09 0.09 115.11 119.51 1pmo h GLN 231 Ca 0.05 -0.11 -0.05 0.00 0.77 0.00 0.00 58.65 59.31 1pmo h GLN 231 Cb 0.07 -0.10 -0.02 0.00 0.21 0.00 0.00 27.48 27.64 1pmo h GLN 231 CO -0.01 0.57 0.18 0.00 -1.93 0.00 0.00 178.83 177.64 1pmo h ALA 232 N 1.50 0.76 0.00 3.38 0.00 -0.72 0.48 119.26 124.66 1pmo h ALA 232 Ca 0.13 -0.20 -0.06 0.00 0.00 0.00 0.00 54.91 54.78 1pmo h ALA 232 Cb 0.27 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 1pmo h ALA 232 CO 0.00 0.43 -0.57 -0.44 0.00 0.00 0.00 179.25 178.67 1pmo h ASP 233 N 0.82 0.00 0.00 0.00 3.32 -0.60 -3.40 116.42 116.56 1pmo h ASP 233 Ca 0.19 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.24 1pmo h ASP 233 Cb 0.29 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.84 1pmo h ASP 233 CO -0.01 0.25 -0.52 0.35 -1.72 0.00 0.00 179.24 177.59 1pmo n THR 234 N -3.03 0.00 -0.02 0.35 -2.24 -0.02 -5.01 114.28 104.31 1pmo n THR 234 Ca 0.01 -0.06 0.00 0.00 -2.27 0.00 0.00 64.05 61.73 1pmo n THR 234 Cb 0.65 0.44 0.00 0.00 -2.10 0.00 0.00 70.33 69.32 1pmo n THR 234 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1pmo n GLY 235 N 1.42 1.87 3.65 3.38 0.00 0.17 -5.00 105.19 110.68 1pmo n GLY 235 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 1pmo n GLY 235 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1pmo s ILE 236 N -2.65 4.25 -0.48 -0.61 1.01 -1.26 -4.93 121.20 116.53 1pmo s ILE 236 Ca 0.00 1.49 -0.16 0.00 0.00 0.00 0.00 60.65 61.98 1pmo s ILE 236 Cb 0.00 -4.05 0.07 0.00 0.01 0.00 0.00 42.46 38.50 1pmo s ILE 236 CO 0.00 -0.23 0.42 -0.62 0.00 0.00 0.00 174.94 174.52 1pmo s ASP 237 N 2.19 6.16 -0.12 3.58 2.15 -1.26 -3.55 116.67 125.81 1pmo s ASP 237 Ca 0.55 -1.31 -0.02 0.00 0.43 0.00 0.00 52.55 52.21 1pmo s ASP 237 Cb -0.20 -2.20 -0.03 0.00 -0.30 0.00 0.00 42.92 40.20 1pmo s ASP 237 CO 0.17 -0.68 -0.06 -0.63 -0.17 0.00 0.00 175.17 173.79 1pmo s ILE 238 N 1.74 3.68 0.56 4.11 1.01 -1.26 -5.07 121.20 125.97 1pmo s ILE 238 Ca 0.05 -0.45 0.09 0.00 0.00 0.00 0.00 60.65 60.34 1pmo s ILE 238 Cb -0.24 -2.57 0.07 0.00 0.01 0.00 0.00 42.46 39.74 1pmo s ILE 238 CO 0.07 0.53 0.72 -1.81 0.00 0.00 0.00 174.94 174.45 1pmo s ASP 239 N 0.00 5.08 0.12 3.58 1.01 -1.26 -4.95 116.67 120.24 1pmo s ASP 239 Ca -0.01 -0.87 0.05 0.00 0.71 0.00 0.00 52.55 52.44 1pmo s ASP 239 Cb -0.14 0.23 -0.04 0.00 1.01 0.00 0.00 42.92 43.99 1pmo s ASP 239 CO 0.03 -1.26 -0.13 -0.04 0.21 0.00 0.00 175.17 173.98 1pmo s MET 240 N -4.58 1.00 -0.09 8.23 -1.94 -0.46 -1.42 119.30 120.03 1pmo s MET 240 Ca 0.57 -1.24 0.01 0.00 -1.71 0.00 0.00 55.69 53.32 1pmo s MET 240 Cb -0.05 -0.81 0.02 0.00 2.01 0.00 0.00 34.83 35.99 1pmo s MET 240 CO 0.36 0.15 -0.10 -1.58 -0.01 0.00 0.00 175.02 173.84 1pmo s HIS 241 N -2.30 1.47 -0.22 -0.03 2.46 -0.74 -1.76 115.29 114.17 1pmo s HIS 241 Ca 0.09 -0.64 -0.15 0.00 0.47 0.00 0.00 55.06 54.82 1pmo s HIS 241 Cb -0.04 -1.15 -0.04 0.00 -0.13 0.00 0.00 32.58 31.22 1pmo s HIS 241 CO 0.02 -0.40 0.38 0.42 -2.47 0.00 0.00 174.74 172.70 1pmo s ILE 242 N 1.20 5.20 -0.87 0.89 1.09 -0.66 -3.45 121.20 124.59 1pmo s ILE 242 Ca -0.05 0.65 -0.19 0.00 -1.10 0.00 0.00 60.65 59.97 1pmo s ILE 242 Cb -0.14 -3.71 0.13 0.00 -1.06 0.00 0.00 42.46 37.68 1pmo s ILE 242 CO -0.03 0.23 1.06 -0.62 -0.10 0.00 0.00 174.94 175.49 1pmo s ASP 243 N 1.18 6.56 -0.54 3.58 -1.08 -0.72 -1.95 116.67 123.70 1pmo s ASP 243 Ca 0.18 -1.92 0.01 0.00 -0.52 0.00 0.00 52.55 50.30 1pmo s ASP 243 Cb -0.15 -2.38 0.50 0.00 -1.46 0.00 0.00 42.92 39.42 1pmo s ASP 243 CO 0.08 -1.08 1.83 0.00 0.52 0.00 0.00 175.17 176.52 1pmo n ALA 244 N 6.52 5.83 -0.31 3.66 0.00 0.15 -1.19 120.51 135.17 1pmo n ALA 244 Ca 0.18 -3.40 0.07 0.00 0.00 0.00 0.00 53.44 50.29 1pmo n ALA 244 Cb 0.48 -1.40 0.15 0.00 0.00 0.00 0.00 19.45 18.68 1pmo n ALA 244 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1pmo n ALA 245 N -0.95 0.26 -0.10 0.00 0.00 -1.20 -0.90 120.51 117.63 1pmo n ALA 245 Ca 0.57 0.96 -0.18 0.00 0.00 0.00 0.00 53.44 54.79 1pmo n ALA 245 Cb 0.92 -0.60 -0.08 0.00 0.00 0.00 0.00 19.45 19.69 1pmo n ALA 245 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1pmo n SER 246 N -5.39 1.90 0.25 0.00 3.41 -1.26 -1.23 113.62 111.30 1pmo n SER 246 Ca 0.15 0.10 0.08 0.00 -0.26 0.00 0.00 58.87 58.94 1pmo n SER 246 Cb 0.49 -0.46 0.62 0.00 -0.26 0.00 0.00 64.21 64.60 1pmo n SER 246 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 1pmo h GLY 247 N 0.21 0.00 1.36 5.00 0.00 -1.40 -3.07 103.07 105.16 1pmo h GLY 247 Ca -0.47 0.00 0.02 0.00 0.00 0.00 0.00 47.33 46.88 1pmo h GLY 247 CO -0.20 0.00 0.30 -1.33 0.00 0.00 0.00 176.54 175.31 1pmo h GLY 248 N 0.29 0.00 -0.41 4.60 0.00 -1.25 -0.28 103.07 106.02 1pmo h GLY 248 Ca -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.33 1pmo h GLY 248 CO 0.01 0.00 -0.03 0.69 0.00 0.00 0.00 176.54 177.22 1pmo n PHE 249 N -3.10 0.21 0.02 5.60 3.72 -1.16 -4.67 117.46 118.08 1pmo n PHE 249 Ca -0.00 -1.01 -0.00 0.00 -0.05 0.00 0.00 57.45 56.38 1pmo n PHE 249 Cb 0.37 -0.20 -0.00 0.00 -0.94 0.00 0.00 39.48 38.72 1pmo n PHE 249 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 1pmo n LEU 250 N -1.23 0.42 -0.36 4.37 4.77 -0.15 -4.78 117.00 120.04 1pmo n LEU 250 Ca 0.18 0.05 0.10 0.00 -0.03 0.00 0.00 56.01 56.30 1pmo n LEU 250 Cb 0.70 -0.14 0.27 0.00 -2.33 0.00 0.00 43.42 41.92 1pmo n LEU 250 CO 0.04 -0.59 1.22 0.00 -1.33 0.00 0.00 177.39 176.73 1pmo h ALA 251 N -0.07 1.58 -0.01 -1.18 0.00 -1.78 -1.08 119.26 116.72 1pmo h ALA 251 Ca 0.00 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1pmo h ALA 251 Cb 0.02 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 17.65 1pmo h ALA 251 CO 0.00 0.11 0.08 -1.35 0.00 0.00 0.00 179.25 178.09 1pmo h PRO 252 N 0.90 0.00 0.00 0.00 0.11 -1.80 0.12 132.00 131.33 1pmo h PRO 252 Ca 0.53 0.00 -0.38 0.00 0.11 0.00 0.00 66.00 66.26 1pmo h PRO 252 Cb 0.66 0.00 -0.06 0.00 0.11 0.00 0.00 31.00 31.71 1pmo h PRO 252 CO -0.32 0.00 -2.32 1.19 -0.21 0.00 0.00 178.00 176.34 1pmo n PHE 253 N -3.12 0.00 0.67 0.65 3.72 -0.48 -4.46 117.46 114.43 1pmo n PHE 253 Ca -0.03 0.00 0.11 0.00 -0.05 0.00 0.00 57.45 57.48 1pmo n PHE 253 Cb 0.15 -0.86 -0.08 0.00 -0.94 0.00 0.00 39.48 37.75 1pmo n PHE 253 CO 0.00 0.00 0.00 1.33 -0.05 0.00 0.00 176.76 178.04 1pmo n VAL 254 N -3.76 0.04 -3.00 -4.37 0.24 -0.76 -4.67 118.33 102.05 1pmo n VAL 254 Ca -0.45 -0.17 -0.15 0.00 -2.04 0.00 0.00 64.34 61.53 1pmo n VAL 254 Cb 0.87 0.54 0.01 0.00 -1.47 0.00 0.00 33.84 33.78 1pmo n VAL 254 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1pmo n ALA 255 N -1.75 0.81 0.11 2.33 0.00 0.37 -4.92 120.51 117.45 1pmo n ALA 255 Ca 0.02 -2.57 0.16 0.00 0.00 0.00 0.00 53.44 51.05 1pmo n ALA 255 Cb 0.41 -1.03 0.68 0.00 0.00 0.00 0.00 19.45 19.51 1pmo n ALA 255 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 1pmo h PRO 256 N 3.35 0.00 0.00 0.00 0.11 -1.64 -2.61 132.00 131.22 1pmo h PRO 256 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 1pmo h PRO 256 Cb 1.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.11 1pmo h PRO 256 CO 0.36 0.00 0.00 -0.44 -0.21 0.00 0.00 178.00 177.71 1pmo h ASP 257 N 0.00 0.00 -2.78 -2.05 3.32 -1.94 -3.43 116.42 109.55 1pmo h ASP 257 Ca 0.15 0.00 -0.56 0.00 0.02 0.00 0.00 57.03 56.65 1pmo h ASP 257 Cb 0.63 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.15 1pmo h ASP 257 CO -0.00 0.00 0.97 -0.63 -1.72 0.00 0.00 179.24 177.86 1pmo s ILE 258 N -3.67 3.90 -0.57 0.35 1.01 -0.98 -4.94 121.20 116.29 1pmo s ILE 258 Ca 0.01 1.11 -0.20 0.00 0.00 0.00 0.00 60.65 61.57 1pmo s ILE 258 Cb 0.09 -3.72 0.07 0.00 0.01 0.00 0.00 42.46 38.92 1pmo s ILE 258 CO 0.52 -0.09 0.76 -0.69 0.00 0.00 0.00 174.94 175.44 1pmo s VAL 259 N 3.58 4.69 0.00 2.92 1.01 -1.26 -4.74 120.40 126.60 1pmo s VAL 259 Ca 0.64 -0.54 0.00 0.00 0.00 0.00 0.00 61.98 62.09 1pmo s VAL 259 Cb -0.28 -4.47 0.00 0.00 0.00 0.00 0.00 36.38 31.63 1pmo s VAL 259 CO 0.23 -1.08 0.00 -2.67 0.00 0.00 0.00 175.10 171.58 1pmo n TRP 260 N 6.68 0.00 -0.34 5.22 4.27 -1.26 -3.82 117.44 128.19 1pmo n TRP 260 Ca -0.06 0.00 0.00 0.00 -3.89 0.00 0.00 57.50 53.55 1pmo n TRP 260 Cb 0.45 0.00 0.00 0.00 -1.36 0.00 0.00 31.31 30.40 1pmo n TRP 260 CO 0.00 0.00 0.00 -0.40 -2.29 0.00 0.00 177.69 175.00 1pmo n ASP 261 N -0.41 0.00 0.00 -0.67 5.68 -1.26 -4.86 116.55 115.03 1pmo n ASP 261 Ca 0.00 0.00 0.07 0.00 -0.50 0.00 0.00 54.79 54.36 1pmo n ASP 261 Cb 0.00 0.00 0.37 0.00 -1.14 0.00 0.00 41.12 40.35 1pmo n ASP 261 CO 0.00 0.00 0.00 0.49 -1.33 0.00 0.00 177.20 176.36 1pmo n PHE 262 N 0.00 0.00 0.27 2.11 3.72 -0.99 -1.90 117.46 120.67 1pmo n PHE 262 Ca 0.00 0.00 0.15 0.00 -0.05 0.00 0.00 57.45 57.55 1pmo n PHE 262 Cb 0.00 -0.21 0.76 0.00 -0.94 0.00 0.00 39.48 39.09 1pmo n PHE 262 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1pmo h ARG 263 N 0.00 0.00 -5.45 -1.08 3.08 -1.78 -3.39 114.38 105.76 1pmo h ARG 263 Ca 0.00 0.00 -0.61 0.00 0.07 0.00 0.00 59.98 59.44 1pmo h ARG 263 Cb 0.10 0.00 -0.12 0.00 0.08 0.00 0.00 29.97 30.03 1pmo h ARG 263 CO 0.00 0.09 0.09 -0.51 -1.07 0.00 0.00 179.97 178.58 1pmo s LEU 264 N -6.89 4.06 0.29 3.04 1.43 -0.80 -4.98 118.68 114.83 1pmo s LEU 264 Ca -0.02 0.64 0.04 0.00 -1.03 0.00 0.00 54.13 53.75 1pmo s LEU 264 Cb 0.12 -2.78 0.72 0.00 0.03 0.00 0.00 46.19 44.28 1pmo s LEU 264 CO 0.56 -0.34 1.71 -0.65 0.23 0.00 0.00 176.35 177.86 1pmo h PRO 265 N 7.93 0.45 0.00 1.29 0.11 -1.88 -1.92 132.00 137.98 1pmo h PRO 265 Ca -0.28 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.81 1pmo h PRO 265 Cb 1.13 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.14 1pmo h PRO 265 CO 0.75 0.30 0.00 0.00 -0.21 0.00 0.00 178.00 178.84 1pmo h ARG 266 N 0.46 0.00 -6.21 1.05 3.08 -1.93 -3.42 114.38 107.42 1pmo h ARG 266 Ca 0.56 0.00 -0.53 0.00 0.07 0.00 0.00 59.98 60.07 1pmo h ARG 266 Cb 1.02 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 31.02 1pmo h ARG 266 CO -0.49 0.00 1.24 0.08 -1.07 0.00 0.00 179.97 179.72 1pmo s VAL 267 N -3.54 3.55 -0.17 2.04 1.01 -0.73 -1.35 120.40 121.21 1pmo s VAL 267 Ca 0.03 0.45 0.20 0.00 0.00 0.00 0.00 61.98 62.65 1pmo s VAL 267 Cb 0.08 -4.07 -0.10 0.00 0.00 0.00 0.00 36.38 32.30 1pmo s VAL 267 CO 0.56 -0.90 0.86 0.29 0.00 0.00 0.00 175.10 175.91 1pmo n LYS 268 N 8.81 0.62 -3.55 2.72 4.01 -0.72 -4.71 118.16 125.34 1pmo n LYS 268 Ca 0.18 0.13 -0.14 0.00 -0.51 0.00 0.00 58.31 57.97 1pmo n LYS 268 Cb 0.50 -1.78 -0.05 0.00 -0.51 0.00 0.00 35.03 33.19 1pmo n LYS 268 CO 0.00 0.00 0.00 -1.54 -1.11 0.00 0.00 177.40 174.75 1pmo s SER 269 N -5.45 -0.48 0.01 4.39 1.04 -1.24 -0.88 113.70 111.09 1pmo s SER 269 Ca -0.03 0.20 0.00 0.00 0.48 0.00 0.00 55.95 56.61 1pmo s SER 269 Cb 0.09 0.51 -0.01 0.00 0.10 0.00 0.00 66.02 66.72 1pmo s SER 269 CO 0.81 -0.75 -0.02 -0.63 0.98 0.00 0.00 173.24 173.64 1pmo s ILE 270 N -2.52 0.08 0.09 -1.02 1.01 -0.23 -1.65 121.20 116.97 1pmo s ILE 270 Ca -0.05 -0.34 0.04 0.00 0.00 0.00 0.00 60.65 60.31 1pmo s ILE 270 Cb -0.01 -0.13 -0.03 0.00 0.01 0.00 0.00 42.46 42.30 1pmo s ILE 270 CO -0.02 -0.16 -0.12 -0.94 0.00 0.00 0.00 174.94 173.70 1pmo s SER 271 N -0.52 1.59 0.20 3.58 1.04 -0.82 -0.65 113.70 118.12 1pmo s SER 271 Ca -0.05 -0.75 -0.22 0.00 0.48 0.00 0.00 55.95 55.41 1pmo s SER 271 Cb -0.04 -0.02 0.05 0.00 0.10 0.00 0.00 66.02 66.11 1pmo s SER 271 CO -0.00 -0.19 0.63 0.00 0.98 0.00 0.00 173.24 174.65 1pmo s ALA 272 N -2.06 -1.40 -0.26 5.32 0.00 -0.02 -0.68 121.76 122.68 1pmo s ALA 272 Ca 0.04 0.15 -0.09 0.00 0.00 0.00 0.00 51.96 52.05 1pmo s ALA 272 Cb -0.05 0.87 -0.04 0.00 0.00 0.00 0.00 23.12 23.89 1pmo s ALA 272 CO 0.01 -0.86 0.14 -1.12 0.00 0.00 0.00 175.76 173.93 1pmo s SER 273 N -2.82 5.72 0.18 0.00 0.01 -0.36 -0.92 113.70 115.51 1pmo s SER 273 Ca 0.05 -0.05 -0.04 0.00 1.31 0.00 0.00 55.95 57.23 1pmo s SER 273 Cb -0.03 -2.04 0.09 0.00 0.21 0.00 0.00 66.02 64.25 1pmo s SER 273 CO -0.05 -0.01 1.49 1.23 0.41 0.00 0.00 173.24 176.31 1pmo h GLY 274 N 8.04 0.62 -0.11 3.44 0.00 -1.09 -3.00 103.07 110.96 1pmo h GLY 274 Ca -0.37 -0.74 0.00 0.00 0.00 0.00 0.00 47.33 46.23 1pmo h GLY 274 CO 0.59 0.66 0.00 -2.39 0.00 0.00 0.00 176.54 175.40 1pmo n HIS 275 N -3.95 0.00 0.00 5.60 1.44 -0.99 -0.38 115.22 116.94 1pmo n HIS 275 Ca -0.03 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.68 1pmo n HIS 275 Cb 0.62 -0.01 0.00 0.00 0.12 0.00 0.00 29.99 30.72 1pmo n HIS 275 CO 0.00 0.00 0.00 1.63 -2.81 0.00 0.00 176.34 175.16 1pmo n LYS 276 N -0.44 0.00 0.00 -1.40 5.02 -1.14 -1.38 118.16 118.82 1pmo n LYS 276 Ca 0.00 0.00 0.12 0.00 -2.02 0.00 0.00 58.31 56.41 1pmo n LYS 276 Cb 0.03 0.00 0.68 0.00 -0.02 0.00 0.00 35.03 35.71 1pmo n LYS 276 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 1pmo n PHE 277 N 0.00 0.00 0.56 2.13 3.01 -1.26 -1.83 117.46 120.08 1pmo n PHE 277 Ca 0.00 0.00 0.12 0.00 1.01 0.00 0.00 57.45 58.58 1pmo n PHE 277 Cb 0.00 -0.03 0.45 0.00 -0.01 0.00 0.00 39.48 39.90 1pmo n PHE 277 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1pmo n GLY 278 N 0.46 -1.40 2.84 1.37 0.00 -1.08 -4.86 105.19 102.53 1pmo n GLY 278 Ca 0.17 0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.19 1pmo n GLY 278 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1pmo n LEU 279 N -2.03 0.28 -4.88 0.99 4.77 -0.47 -4.90 117.00 110.76 1pmo n LEU 279 Ca 0.04 0.00 -0.30 0.00 -0.03 0.00 0.00 56.01 55.72 1pmo n LEU 279 Cb 0.30 -0.70 0.01 0.00 -2.33 0.00 0.00 43.42 40.70 1pmo n LEU 279 CO 0.23 -0.20 0.69 0.00 -1.33 0.00 0.00 177.39 176.78 1pmo s ALA 280 N -2.53 3.12 0.67 -1.18 0.00 0.49 -4.96 121.76 117.35 1pmo s ALA 280 Ca 0.00 -0.18 -0.14 0.00 0.00 0.00 0.00 51.96 51.64 1pmo s ALA 280 Cb 0.00 -3.01 0.00 0.00 0.00 0.00 0.00 23.12 20.11 1pmo s ALA 280 CO 0.00 -0.70 1.08 -2.14 0.00 0.00 0.00 175.76 174.00 1pmo s PRO 281 N -5.15 2.89 0.13 0.00 0.02 -1.26 -3.87 135.00 127.75 1pmo s PRO 281 Ca 0.54 1.21 -0.33 0.00 0.02 0.00 0.00 61.00 62.45 1pmo s PRO 281 Cb -0.11 -1.97 -0.18 0.00 0.02 0.00 0.00 34.50 32.26 1pmo s PRO 281 CO 0.53 -1.16 0.86 1.28 -0.33 0.00 0.00 177.00 178.17 1pmo n LEU 282 N -2.63 -0.15 0.00 -5.54 4.77 -1.26 -3.82 117.00 108.37 1pmo n LEU 282 Ca 0.09 1.14 0.00 0.00 -0.03 0.00 0.00 56.01 57.22 1pmo n LEU 282 Cb 0.53 -1.01 0.00 0.00 -2.33 0.00 0.00 43.42 40.61 1pmo n LEU 282 CO 0.50 -2.22 0.00 0.61 -1.33 0.00 0.00 177.39 174.95 1pmo n GLY 283 N 1.80 1.92 2.78 -0.72 0.00 -1.25 -4.92 105.19 104.80 1pmo n GLY 283 Ca 0.18 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 46.03 1pmo n GLY 283 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pmo s GLY 285 N 1.74 1.66 -0.09 0.00 0.00 0.83 -0.50 107.32 110.95 1pmo s GLY 285 Ca -0.02 -1.83 -0.10 0.00 0.00 0.00 0.00 44.72 42.78 1pmo s GLY 285 CO -0.04 -1.56 0.27 -0.98 0.00 0.00 0.00 173.10 170.79 1pmo s TRP 286 N -3.81 -0.28 -0.03 1.90 0.52 -0.10 -1.24 118.94 115.90 1pmo s TRP 286 Ca 0.37 0.68 -0.01 0.00 0.02 0.00 0.00 56.10 57.17 1pmo s TRP 286 Cb 0.08 0.10 0.03 0.00 -1.15 0.00 0.00 33.47 32.52 1pmo s TRP 286 CO 0.13 -0.17 0.03 0.54 0.02 0.00 0.00 176.95 177.50 1pmo s VAL 287 N 0.01 -0.02 0.05 4.03 0.11 -0.95 -0.84 120.40 122.79 1pmo s VAL 287 Ca -0.01 0.25 0.09 0.00 -2.93 0.00 0.00 61.98 59.38 1pmo s VAL 287 Cb -0.02 -0.15 -0.03 0.00 -1.53 0.00 0.00 36.38 34.65 1pmo s VAL 287 CO 0.01 0.13 -0.24 -0.63 -3.33 0.00 0.00 175.10 171.03 1pmo s ILE 288 N 1.42 1.98 0.08 7.04 -1.09 0.18 -1.23 121.20 129.58 1pmo s ILE 288 Ca -0.04 -1.34 0.06 0.00 -2.23 0.00 0.00 60.65 57.09 1pmo s ILE 288 Cb -0.13 -1.71 -0.04 0.00 -1.58 0.00 0.00 42.46 39.01 1pmo s ILE 288 CO -0.03 0.30 -0.09 0.26 -1.23 0.00 0.00 174.94 174.15 1pmo s TRP 289 N -0.82 2.78 0.22 3.97 0.51 0.56 -1.07 118.94 125.10 1pmo s TRP 289 Ca 0.10 -0.13 -0.08 0.00 -2.12 0.00 0.00 56.10 53.88 1pmo s TRP 289 Cb -0.10 -1.48 0.33 0.00 -0.81 0.00 0.00 33.47 31.41 1pmo s TRP 289 CO 0.02 0.41 1.74 -0.09 -0.51 0.00 0.00 176.95 178.52 1pmo h ARG 290 N 3.86 0.42 0.00 4.98 2.43 -1.29 -3.39 114.38 121.38 1pmo h ARG 290 Ca -0.49 -0.03 0.07 0.00 -0.81 0.00 0.00 59.98 58.73 1pmo h ARG 290 Cb 1.17 -0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 30.61 1pmo h ARG 290 CO 0.53 0.28 0.40 -0.40 -1.51 0.00 0.00 179.97 179.27 1pmo n ASP 291 N -4.99 -1.72 -0.29 -3.80 5.68 -1.26 -4.13 116.55 106.05 1pmo n ASP 291 Ca 0.10 -2.03 0.03 0.00 -0.50 0.00 0.00 54.79 52.39 1pmo n ASP 291 Cb 0.31 2.82 0.16 0.00 -1.14 0.00 0.00 41.12 43.27 1pmo n ASP 291 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 1pmo h GLU 292 N 0.00 0.75 -0.24 0.11 4.39 -1.93 -1.50 114.58 116.16 1pmo h GLU 292 Ca -0.26 -0.04 0.04 0.00 0.34 0.00 0.00 59.36 59.43 1pmo h GLU 292 Cb 1.06 -0.17 -0.01 0.00 -0.10 0.00 0.00 28.75 29.53 1pmo h GLU 292 CO 0.34 0.49 0.16 0.93 -1.16 0.00 0.00 179.01 179.78 1pmo h GLU 293 N 0.77 0.16 0.00 2.33 5.08 -2.00 -1.86 114.58 119.06 1pmo h GLU 293 Ca 0.39 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.74 1pmo h GLU 293 Cb 0.37 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.58 1pmo h GLU 293 CO -0.25 0.10 0.00 0.00 -1.00 0.00 0.00 179.01 177.86 1pmo h ALA 294 N 1.87 1.00 -3.46 3.43 0.00 -1.62 -3.40 119.26 117.08 1pmo h ALA 294 Ca 0.10 0.00 -0.68 0.00 0.00 0.00 0.00 54.91 54.33 1pmo h ALA 294 Cb 0.21 0.00 -0.35 0.00 0.00 0.00 0.00 17.79 17.65 1pmo h ALA 294 CO -0.02 0.00 -0.66 -1.17 0.00 0.00 0.00 179.25 177.40 1pmo s LEU 295 N -5.60 4.50 -0.12 0.00 2.96 -0.70 -4.87 118.68 114.84 1pmo s LEU 295 Ca 0.03 -1.73 -0.35 0.00 -0.22 0.00 0.00 54.13 51.86 1pmo s LEU 295 Cb 0.09 -1.72 -0.12 0.00 0.50 0.00 0.00 46.19 44.94 1pmo s LEU 295 CO 0.51 -0.37 1.88 -2.65 -1.32 0.00 0.00 176.35 174.39 1pmo n PRO 296 N 4.51 2.03 0.30 0.98 -0.02 -1.26 -4.83 135.00 136.71 1pmo n PRO 296 Ca -0.06 0.74 0.20 0.00 -2.02 0.00 0.00 63.50 62.36 1pmo n PRO 296 Cb 0.42 -2.58 1.08 0.00 -0.02 0.00 0.00 33.50 32.40 1pmo n PRO 296 CO 0.00 0.00 0.00 1.96 1.98 0.00 0.00 175.50 179.44 1pmo h GLN 297 N 9.11 0.00 0.00 -0.52 1.08 -1.95 -1.53 115.11 121.31 1pmo h GLN 297 Ca -0.48 0.00 -0.00 0.00 -1.45 0.00 0.00 58.65 56.72 1pmo h GLN 297 Cb 1.28 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 28.71 1pmo h GLN 297 CO 0.95 0.00 -0.01 0.93 -0.95 0.00 0.00 178.83 179.75 1pmo h GLU 298 N 0.00 0.00 0.00 1.46 3.07 -2.03 -1.91 114.58 115.17 1pmo h GLU 298 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1pmo h GLU 298 Cb 0.02 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.93 1pmo h GLU 298 CO 0.00 0.01 -0.68 1.28 -1.40 0.00 0.00 179.01 178.22 1pmo n LEU 299 N -3.13 0.68 -4.75 1.33 4.77 -0.57 -4.87 117.00 110.46 1pmo n LEU 299 Ca -0.01 0.19 -0.39 0.00 -0.03 0.00 0.00 56.01 55.77 1pmo n LEU 299 Cb 0.18 -0.17 -0.06 0.00 -2.33 0.00 0.00 43.42 41.04 1pmo n LEU 299 CO 0.24 -0.04 0.27 -0.69 -1.33 0.00 0.00 177.39 175.84 1pmo s VAL 300 N -3.17 5.01 -0.12 4.08 1.01 -0.72 -4.67 120.40 121.82 1pmo s VAL 300 Ca 0.06 1.19 -0.01 0.00 0.00 0.00 0.00 61.98 63.22 1pmo s VAL 300 Cb 0.14 -3.91 -0.02 0.00 0.00 0.00 0.00 36.38 32.58 1pmo s VAL 300 CO 0.73 0.37 -0.09 -0.36 0.00 0.00 0.00 175.10 175.75 1pmo s PHE 301 N 0.15 2.90 -0.22 5.22 0.40 0.37 -4.86 117.98 121.93 1pmo s PHE 301 Ca 0.30 -0.39 -0.09 0.00 -0.60 0.00 0.00 56.93 56.16 1pmo s PHE 301 Cb -0.17 -1.85 -0.04 0.00 0.51 0.00 0.00 43.02 41.47 1pmo s PHE 301 CO 0.15 -0.04 0.11 -0.80 0.70 0.00 0.00 175.22 175.34 1pmo s ASN 302 N 0.10 5.72 0.12 1.36 0.01 -1.26 0.44 114.94 121.42 1pmo s ASN 302 Ca -0.04 0.02 0.08 0.00 -0.71 0.00 0.00 52.86 52.22 1pmo s ASN 302 Cb -0.14 -2.02 -0.04 0.00 0.41 0.00 0.00 41.25 39.46 1pmo s ASN 302 CO 0.04 0.07 -0.14 0.68 -1.51 0.00 0.00 177.10 176.24 1pmo s VAL 303 N 1.00 3.08 0.12 1.60 -7.23 -1.08 -4.97 120.40 112.93 1pmo s VAL 303 Ca 0.06 -1.43 -0.28 0.00 -1.81 0.00 0.00 61.98 58.52 1pmo s VAL 303 Cb -0.14 -2.43 -0.07 0.00 0.56 0.00 0.00 36.38 34.30 1pmo s VAL 303 CO 0.03 0.08 0.88 -1.81 -0.31 0.00 0.00 175.10 173.98 1pmo s ASP 304 N -2.23 7.43 0.17 4.85 1.01 -1.26 -2.34 116.67 124.30 1pmo s ASP 304 Ca 0.20 1.71 0.07 0.00 0.71 0.00 0.00 52.55 55.24 1pmo s ASP 304 Cb -0.11 -2.55 -0.04 0.00 1.01 0.00 0.00 42.92 41.23 1pmo s ASP 304 CO 0.12 0.04 -0.15 -0.31 0.21 0.00 0.00 175.17 175.08 1pmo s TYR 305 N -0.40 1.63 0.28 4.23 2.02 -1.15 -4.94 117.35 119.02 1pmo s TYR 305 Ca 0.42 -0.56 0.28 0.00 -0.37 0.00 0.00 57.07 56.84 1pmo s TYR 305 Cb -0.23 -0.79 1.51 0.00 -0.40 0.00 0.00 41.96 42.05 1pmo s TYR 305 CO 0.28 0.28 1.83 1.25 -1.57 0.00 0.00 175.55 177.62 1pmo h LEU 306 N 2.96 0.00 -4.01 -1.29 5.85 -1.98 -1.87 115.31 114.97 1pmo h LEU 306 Ca -0.39 0.00 -0.42 0.00 0.84 0.00 0.00 57.88 57.91 1pmo h LEU 306 Cb 1.21 0.00 -0.38 0.00 0.37 0.00 0.00 40.66 41.86 1pmo h LEU 306 CO 0.57 0.00 -0.86 0.61 -0.34 0.00 0.00 178.44 178.42 1pmo n GLY 307 N -1.22 5.13 0.00 3.75 0.00 -1.26 -5.08 105.19 106.50 1pmo n GLY 307 Ca -0.02 -2.14 0.00 0.00 0.00 0.00 0.00 46.02 43.87 1pmo n GLY 307 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pmo n GLY 308 N -0.69 2.50 3.77 -0.02 0.00 -0.70 -5.03 105.19 105.02 1pmo n GLY 308 Ca 0.32 -1.84 -0.39 0.00 0.00 0.00 0.00 46.02 44.12 1pmo n GLY 308 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1pmo s GLN 309 N -3.46 4.33 -0.08 1.61 -2.07 -1.26 -2.91 119.66 115.82 1pmo s GLN 309 Ca 0.00 0.79 0.01 0.00 -1.82 0.00 0.00 55.36 54.34 1pmo s GLN 309 Cb 0.00 -3.32 -0.03 0.00 -1.09 0.00 0.00 33.01 28.57 1pmo s GLN 309 CO 0.00 0.41 -0.07 0.42 -1.32 0.00 0.00 175.29 174.72 1pmo s ILE 310 N -0.36 3.65 0.31 3.63 1.01 -0.99 -4.90 121.20 123.55 1pmo s ILE 310 Ca 0.32 -0.49 -0.22 0.00 0.00 0.00 0.00 60.65 60.26 1pmo s ILE 310 Cb -0.19 -2.50 -0.09 0.00 0.01 0.00 0.00 42.46 39.69 1pmo s ILE 310 CO 0.19 0.59 0.85 -0.83 0.00 0.00 0.00 174.94 175.73 1pmo s GLY 311 N -0.66 2.61 -0.02 6.18 0.00 -1.26 -2.62 107.32 111.55 1pmo s GLY 311 Ca 0.10 0.33 -0.01 0.00 0.00 0.00 0.00 44.72 45.13 1pmo s GLY 311 CO 0.02 0.68 0.06 -1.08 0.00 0.00 0.00 173.10 172.78 1pmo s THR 312 N -1.73 -0.02 -0.41 0.90 -1.32 0.17 -4.92 115.64 108.31 1pmo s THR 312 Ca 0.50 0.07 0.01 0.00 -1.21 0.00 0.00 61.69 61.07 1pmo s THR 312 Cb -0.15 -0.10 0.13 0.00 -1.51 0.00 0.00 72.50 70.87 1pmo s THR 312 CO 0.20 0.03 0.21 0.12 -2.21 0.00 0.00 174.62 172.97 1pmo s PHE 313 N 0.41 1.77 0.08 9.09 5.36 -1.26 -0.48 117.98 132.95 1pmo s PHE 313 Ca -0.03 -2.21 -0.18 0.00 -0.96 0.00 0.00 56.93 53.55 1pmo s PHE 313 Cb -0.05 -1.73 0.04 0.00 -0.34 0.00 0.00 43.02 40.94 1pmo s PHE 313 CO -0.01 -0.81 0.42 0.00 -1.46 0.00 0.00 175.22 173.36 1pmo s ALA 314 N 0.66 -1.03 -0.10 11.12 0.00 -1.26 -4.95 121.76 126.20 1pmo s ALA 314 Ca 0.16 0.19 -0.14 0.00 0.00 0.00 0.00 51.96 52.18 1pmo s ALA 314 Cb -0.23 0.51 -0.27 0.00 0.00 0.00 0.00 23.12 23.13 1pmo s ALA 314 CO -0.03 -0.55 0.53 0.82 0.00 0.00 0.00 175.76 176.53 1pmo h ILE 315 N 2.69 0.95 -3.79 0.00 2.04 -1.98 -3.47 117.51 113.95 1pmo h ILE 315 Ca -0.32 -2.40 -0.50 0.00 1.00 0.00 0.00 64.86 62.64 1pmo h ILE 315 Cb 1.23 2.67 0.04 0.00 -0.74 0.00 0.00 36.82 40.02 1pmo h ILE 315 CO 0.45 0.74 0.19 0.20 0.00 0.00 0.00 178.15 179.73 1pmo s ASN 316 N -7.07 6.29 0.00 1.72 0.01 -1.26 -5.07 114.94 109.56 1pmo s ASN 316 Ca -0.20 1.09 0.00 0.00 -0.71 0.00 0.00 52.86 53.04 1pmo s ASN 316 Cb 0.05 -2.32 0.00 0.00 0.41 0.00 0.00 41.25 39.39 1pmo s ASN 316 CO 0.77 -0.63 0.00 0.33 -1.51 0.00 0.00 177.10 176.06 1pmo n PHE 317 N -2.26 0.00 -1.86 2.20 7.35 -1.26 -5.05 117.46 116.58 1pmo n PHE 317 Ca 0.02 0.00 -0.41 0.00 -0.76 0.00 0.00 57.45 56.30 1pmo n PHE 317 Cb 0.55 0.00 -0.01 0.00 0.35 0.00 0.00 39.48 40.36 1pmo n PHE 317 CO 0.00 0.00 0.00 -1.12 -0.76 0.00 0.00 176.76 174.88 1pmo s SER 318 N 0.63 6.45 -0.16 -2.13 0.01 -1.26 -4.37 113.70 112.87 1pmo s SER 318 Ca 0.00 2.90 -0.34 0.00 1.31 0.00 0.00 55.95 59.82 1pmo s SER 318 Cb 0.00 -2.64 0.14 0.00 0.21 0.00 0.00 66.02 63.72 1pmo s SER 318 CO 0.00 -0.83 1.24 0.00 0.41 0.00 0.00 173.24 174.06 1pmo s ARG 319 N -1.07 0.30 0.49 12.44 1.70 -1.26 -4.99 118.95 126.55 1pmo s ARG 319 Ca 0.58 -0.13 -0.24 0.00 -0.47 0.00 0.00 55.73 55.47 1pmo s ARG 319 Cb -0.46 0.13 -0.07 0.00 -0.57 0.00 0.00 34.95 33.98 1pmo s ARG 319 CO 0.52 -0.13 1.41 -2.30 -1.08 0.00 0.00 175.30 173.72 1pmo n PRO 320 N -0.17 2.05 -0.11 3.89 -0.02 -1.26 -0.08 135.00 139.29 1pmo n PRO 320 Ca -0.01 0.74 0.09 0.00 -2.02 0.00 0.00 63.50 62.30 1pmo n PRO 320 Cb 0.59 -2.61 0.15 0.00 -0.02 0.00 0.00 33.50 31.60 1pmo n PRO 320 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1pmo n ALA 321 N -0.52 2.40 -0.29 3.55 0.00 -0.41 -4.50 120.51 120.73 1pmo n ALA 321 Ca 0.07 -0.88 -0.02 0.00 0.00 0.00 0.00 53.44 52.62 1pmo n ALA 321 Cb 0.43 -0.66 0.11 0.00 0.00 0.00 0.00 19.45 19.32 1pmo n ALA 321 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1pmo h GLY 322 N 3.50 1.18 1.24 0.00 0.00 -1.82 -2.51 103.07 104.67 1pmo h GLY 322 Ca 0.00 -0.39 -0.07 0.00 0.00 0.00 0.00 47.33 46.88 1pmo h GLY 322 CO 0.00 0.32 0.09 1.46 0.00 0.00 0.00 176.54 178.41 1pmo h GLN 323 N 0.99 0.93 -0.44 4.80 7.50 -1.88 0.10 115.11 127.12 1pmo h GLN 323 Ca 0.33 -0.23 -0.00 0.00 0.50 0.00 0.00 58.65 59.25 1pmo h GLN 323 Cb 0.04 -0.12 -0.02 0.00 0.05 0.00 0.00 27.48 27.43 1pmo h GLN 323 CO -0.13 0.87 0.25 0.28 -1.50 0.00 0.00 178.83 178.60 1pmo h VAL 324 N 0.88 1.15 -0.50 -0.54 2.07 -1.83 0.36 116.25 117.83 1pmo h VAL 324 Ca 0.18 -0.35 -0.01 0.00 0.82 0.00 0.00 66.70 67.34 1pmo h VAL 324 Cb 0.39 0.59 -0.02 0.00 -1.52 0.00 0.00 31.29 30.73 1pmo h VAL 324 CO 0.01 0.15 0.28 0.40 0.02 0.00 0.00 177.57 178.43 1pmo h ILE 325 N 0.58 1.17 -0.50 4.57 2.04 -1.01 -0.08 117.51 124.27 1pmo h ILE 325 Ca 0.16 -0.42 -0.07 0.00 1.00 0.00 0.00 64.86 65.52 1pmo h ILE 325 Cb 0.02 0.53 -0.02 0.00 -0.74 0.00 0.00 36.82 36.61 1pmo h ILE 325 CO -0.03 0.18 0.03 0.00 0.00 0.00 0.00 178.15 178.33 1pmo h ALA 326 N 1.12 1.11 -0.60 1.87 0.00 -0.42 -1.35 119.26 121.00 1pmo h ALA 326 Ca 0.18 -0.25 -0.04 0.00 0.00 0.00 0.00 54.91 54.79 1pmo h ALA 326 Cb 0.04 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.60 1pmo h ALA 326 CO -0.03 0.57 0.21 0.37 0.00 0.00 0.00 179.25 180.38 1pmo h GLN 327 N 0.77 0.91 -0.84 0.00 5.75 0.32 -2.08 115.11 119.93 1pmo h GLN 327 Ca 0.15 -0.18 -0.01 0.00 -0.15 0.00 0.00 58.65 58.46 1pmo h GLN 327 Cb 0.42 -0.14 -0.04 0.00 1.07 0.00 0.00 27.48 28.79 1pmo h GLN 327 CO 0.02 0.80 0.48 -0.92 -2.65 0.00 0.00 178.83 176.55 1pmo h TYR 328 N 0.84 1.13 -0.96 3.99 3.20 -0.62 -1.53 116.97 123.02 1pmo h TYR 328 Ca 0.20 -0.02 0.05 0.00 3.14 0.00 0.00 58.73 62.10 1pmo h TYR 328 Cb 0.25 -0.37 -0.06 0.00 1.54 0.00 0.00 36.73 38.09 1pmo h TYR 328 CO 0.01 0.77 0.62 -0.92 -1.64 0.00 0.00 178.16 177.01 1pmo h TYR 329 N 1.16 1.16 -0.29 -3.82 3.20 -0.72 0.66 116.97 118.32 1pmo h TYR 329 Ca 0.30 0.03 -0.06 0.00 3.14 0.00 0.00 58.73 62.14 1pmo h TYR 329 Cb -0.00 -0.38 -0.01 0.00 1.54 0.00 0.00 36.73 37.88 1pmo h TYR 329 CO 0.00 0.63 -0.04 0.93 -1.64 0.00 0.00 178.16 178.05 1pmo h GLU 330 N 1.17 0.54 -0.46 1.82 4.39 -0.73 -1.22 114.58 120.08 1pmo h GLU 330 Ca 0.40 -0.19 0.03 0.00 0.34 0.00 0.00 59.36 59.94 1pmo h GLU 330 Cb 0.08 -0.04 -0.04 0.00 -0.10 0.00 0.00 28.75 28.66 1pmo h GLU 330 CO -0.15 0.72 0.25 0.74 -1.16 0.00 0.00 179.01 179.41 1pmo h PHE 331 N 0.31 0.46 -0.30 4.33 0.04 -0.70 -1.39 116.94 119.68 1pmo h PHE 331 Ca 0.08 0.02 -0.06 0.00 2.80 0.00 0.00 57.97 60.81 1pmo h PHE 331 Cb 0.50 -0.14 -0.01 0.00 2.20 0.00 0.00 35.95 38.50 1pmo h PHE 331 CO 0.04 0.24 -0.05 -0.07 -0.60 0.00 0.00 178.31 177.88 1pmo h LEU 332 N 0.49 0.56 -0.44 1.54 3.38 -0.79 -1.21 115.31 118.85 1pmo h LEU 332 Ca 0.20 -0.35 -0.15 0.00 0.09 0.00 0.00 57.88 57.67 1pmo h LEU 332 Cb 0.08 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.66 1pmo h LEU 332 CO -0.12 0.77 -0.73 0.08 0.09 0.00 0.00 178.44 178.53 1pmo h ARG 333 N 0.34 0.00 0.00 1.13 0.11 -1.17 -3.39 114.38 111.40 1pmo h ARG 333 Ca 0.08 0.00 -0.16 0.00 0.10 0.00 0.00 59.98 60.00 1pmo h ARG 333 Cb 0.51 0.00 -0.02 0.00 1.11 0.00 0.00 29.97 31.57 1pmo h ARG 333 CO 0.02 0.73 -1.37 1.28 0.10 0.00 0.00 179.97 180.73 1pmo n LEU 334 N -3.56 1.91 0.00 0.08 4.77 -0.53 -4.90 117.00 114.76 1pmo n LEU 334 Ca -0.00 0.41 0.07 0.00 -0.03 0.00 0.00 56.01 56.45 1pmo n LEU 334 Cb 0.74 -0.82 -0.02 0.00 -2.33 0.00 0.00 43.42 40.99 1pmo n LEU 334 CO 0.43 -0.00 -0.09 0.61 -1.33 0.00 0.00 177.39 177.01 1pmo n GLY 335 N 1.43 -1.88 0.30 -0.72 0.00 -0.46 -0.38 105.19 103.49 1pmo n GLY 335 Ca -0.27 -1.29 -0.05 0.00 0.00 0.00 0.00 46.02 44.42 1pmo n GLY 335 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1pmo h ARG 336 N 0.00 1.03 -0.17 1.61 3.08 -1.98 -1.21 114.38 116.74 1pmo h ARG 336 Ca 0.01 -0.08 0.05 0.00 0.07 0.00 0.00 59.98 60.03 1pmo h ARG 336 Cb 0.47 -0.23 -0.05 0.00 0.08 0.00 0.00 29.97 30.24 1pmo h ARG 336 CO 0.00 0.70 -0.16 1.49 -1.07 0.00 0.00 179.97 180.93 1pmo h GLU 337 N 1.05 -0.18 -0.25 0.04 4.81 -2.01 -1.37 114.58 116.68 1pmo h GLU 337 Ca 0.28 0.01 -0.12 0.00 -0.13 0.00 0.00 59.36 59.40 1pmo h GLU 337 Cb -0.09 0.04 -0.00 0.00 0.63 0.00 0.00 28.75 29.33 1pmo h GLU 337 CO -0.06 -0.12 -0.32 0.78 -0.73 0.00 0.00 179.01 178.57 1pmo h GLY 338 N -0.18 0.72 1.28 1.92 0.00 -0.42 -3.10 103.07 103.28 1pmo h GLY 338 Ca 0.11 -0.77 -0.02 0.00 0.00 0.00 0.00 47.33 46.65 1pmo h GLY 338 CO -0.28 0.70 0.35 -0.97 0.00 0.00 0.00 176.54 176.34 1pmo h TYR 339 N 0.37 0.93 -0.55 5.60 -1.99 -1.12 -1.27 116.97 118.95 1pmo h TYR 339 Ca 0.03 -0.02 0.01 0.00 2.00 0.00 0.00 58.73 60.75 1pmo h TYR 339 Cb 0.90 -0.30 -0.03 0.00 2.00 0.00 0.00 36.73 39.30 1pmo h TYR 339 CO 0.08 0.66 0.36 1.15 -0.00 0.00 0.00 178.16 180.41 1pmo h THR 340 N 0.95 1.12 -0.40 -2.88 2.02 -1.24 0.64 112.91 113.12 1pmo h THR 340 Ca 0.24 -0.25 -0.13 0.00 0.77 0.00 0.00 66.41 67.04 1pmo h THR 340 Cb 0.05 0.34 -0.01 0.00 -1.74 0.00 0.00 68.15 66.79 1pmo h THR 340 CO -0.04 0.13 -0.26 0.11 0.37 0.00 0.00 175.52 175.84 1pmo h LYS 341 N 0.72 0.88 -0.10 6.66 1.57 -1.40 -0.79 116.57 124.12 1pmo h LYS 341 Ca 0.20 -0.42 -0.01 0.00 -1.87 0.00 0.00 60.65 58.56 1pmo h LYS 341 Cb -0.06 -0.01 -0.00 0.00 0.08 0.00 0.00 32.23 32.23 1pmo h LYS 341 CO -0.05 1.06 0.02 0.28 -0.57 0.00 0.00 179.45 180.19 1pmo h VAL 342 N 0.70 1.21 -0.49 0.50 2.07 -0.94 -1.86 116.25 117.43 1pmo h VAL 342 Ca 0.08 -0.65 -0.04 0.00 0.82 0.00 0.00 66.70 66.90 1pmo h VAL 342 Cb 0.84 1.46 -0.02 0.00 -1.52 0.00 0.00 31.29 32.04 1pmo h VAL 342 CO 0.07 0.19 0.13 1.56 0.02 0.00 0.00 177.57 179.54 1pmo h GLN 343 N -0.06 0.77 -0.91 1.57 7.50 -0.91 -2.77 115.11 120.31 1pmo h GLN 343 Ca 0.03 -0.18 0.06 0.00 0.50 0.00 0.00 58.65 59.06 1pmo h GLN 343 Cb 0.28 -0.11 -0.06 0.00 0.05 0.00 0.00 27.48 27.64 1pmo h GLN 343 CO 0.00 0.74 0.59 -0.91 -1.50 0.00 0.00 178.83 177.76 1pmo h ASN 344 N 0.66 0.91 -0.97 1.46 2.35 -1.07 -1.40 115.58 117.53 1pmo h ASN 344 Ca 0.16 0.01 0.02 0.00 -0.55 0.00 0.00 56.30 55.93 1pmo h ASN 344 Cb 0.31 -0.19 -0.05 0.00 0.05 0.00 0.00 38.32 38.44 1pmo h ASN 344 CO -0.00 0.59 0.64 0.00 -1.65 0.00 0.00 177.43 177.00 1pmo h ALA 345 N 1.51 1.34 -0.21 -0.83 0.00 -1.05 0.01 119.26 120.02 1pmo h ALA 345 Ca 0.39 -0.06 -0.17 0.00 0.00 0.00 0.00 54.91 55.07 1pmo h ALA 345 Cb 0.19 -0.37 -0.00 0.00 0.00 0.00 0.00 17.79 17.61 1pmo h ALA 345 CO -0.15 0.59 -0.55 0.77 0.00 0.00 0.00 179.25 179.91 1pmo h SER 346 N 1.27 0.72 -0.42 0.00 0.02 -1.17 -2.59 113.55 111.38 1pmo h SER 346 Ca 0.37 -0.39 -0.06 0.00 -0.84 0.00 0.00 61.79 60.87 1pmo h SER 346 Cb -0.08 -0.21 -0.02 0.00 0.14 0.00 0.00 62.40 62.23 1pmo h SER 346 CO -0.10 1.13 0.06 1.88 -1.14 0.00 0.00 176.83 178.66 1pmo h TYR 347 N 0.50 0.81 -0.65 3.45 0.05 -0.73 -1.08 116.97 119.32 1pmo h TYR 347 Ca 0.01 -0.09 -0.08 0.00 0.05 0.00 0.00 58.73 58.61 1pmo h TYR 347 Cb 1.12 -0.23 -0.03 0.00 1.01 0.00 0.00 36.73 38.60 1pmo h TYR 347 CO 0.05 0.72 0.08 1.96 -1.05 0.00 0.00 178.16 179.93 1pmo h GLN 348 N 0.74 1.09 -0.12 4.88 4.20 -0.84 0.22 115.11 125.28 1pmo h GLN 348 Ca 0.15 -0.30 -0.02 0.00 0.06 0.00 0.00 58.65 58.54 1pmo h GLN 348 Cb 0.37 -0.12 -0.00 0.00 0.30 0.00 0.00 27.48 28.02 1pmo h GLN 348 CO 0.01 1.01 -0.02 0.28 -0.67 0.00 0.00 178.83 179.44 1pmo h VAL 349 N 1.01 1.28 -0.21 -0.54 2.07 -1.07 -1.66 116.25 117.13 1pmo h VAL 349 Ca 0.20 -0.93 0.01 0.00 0.82 0.00 0.00 66.70 66.80 1pmo h VAL 349 Cb 0.46 1.65 -0.01 0.00 -1.52 0.00 0.00 31.29 31.87 1pmo h VAL 349 CO 0.02 0.27 0.12 0.00 0.02 0.00 0.00 177.57 177.99 1pmo h ALA 350 N 0.71 0.26 -0.78 1.67 0.00 -1.08 -0.84 119.26 119.20 1pmo h ALA 350 Ca 0.03 -0.00 0.01 0.00 0.00 0.00 0.00 54.91 54.95 1pmo h ALA 350 Cb 0.42 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.12 1pmo h ALA 350 CO 0.01 -0.29 0.52 0.00 0.00 0.00 0.00 179.25 179.49 1pmo h ALA 351 N 1.10 1.46 -0.28 0.00 0.00 -0.94 -1.07 119.26 119.53 1pmo h ALA 351 Ca 0.08 -0.05 -0.04 0.00 0.00 0.00 0.00 54.91 54.90 1pmo h ALA 351 Cb 0.00 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.47 1pmo h ALA 351 CO -0.04 0.49 0.01 -0.92 0.00 0.00 0.00 179.25 178.79 1pmo h TYR 352 N 1.04 0.53 -0.62 0.00 3.20 -0.74 -2.23 116.97 118.15 1pmo h TYR 352 Ca 0.29 -0.09 -0.04 0.00 3.14 0.00 0.00 58.73 62.04 1pmo h TYR 352 Cb -0.09 -0.14 -0.03 0.00 1.54 0.00 0.00 36.73 38.02 1pmo h TYR 352 CO -0.00 0.62 0.24 -0.07 -1.64 0.00 0.00 178.16 177.31 1pmo h LEU 353 N 0.28 0.86 0.01 2.82 3.38 -0.72 -0.79 115.31 121.15 1pmo h LEU 353 Ca 0.08 -0.18 0.01 0.00 0.09 0.00 0.00 57.88 57.88 1pmo h LEU 353 Cb 0.41 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.93 1pmo h LEU 353 CO 0.01 0.81 -0.04 0.00 0.09 0.00 0.00 178.44 179.31 1pmo h ALA 354 N 1.09 -0.04 -0.69 1.53 0.00 -1.14 0.29 119.26 120.30 1pmo h ALA 354 Ca 0.21 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 55.08 1pmo h ALA 354 Cb 0.22 0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.04 1pmo h ALA 354 CO -0.02 -0.54 0.30 -0.44 0.00 0.00 0.00 179.25 178.56 1pmo h ASP 355 N -0.07 0.91 -0.00 0.00 5.19 -1.24 -1.73 116.42 119.47 1pmo h ASP 355 Ca 0.01 -0.12 -0.24 0.00 -0.62 0.00 0.00 57.03 56.07 1pmo h ASP 355 Cb 0.09 -0.23 0.02 0.00 0.18 0.00 0.00 39.33 39.38 1pmo h ASP 355 CO -0.04 0.79 -0.94 -0.33 -3.12 0.00 0.00 179.24 175.61 1pmo h GLU 356 N 0.98 0.64 -0.41 3.56 4.39 -0.83 -3.28 114.58 119.64 1pmo h GLU 356 Ca 0.23 -0.69 -0.07 0.00 0.34 0.00 0.00 59.36 59.18 1pmo h GLU 356 Cb 0.15 0.20 -0.02 0.00 -0.10 0.00 0.00 28.75 28.98 1pmo h GLU 356 CO -0.02 1.28 -0.02 0.82 -1.16 0.00 0.00 179.01 179.90 1pmo h ILE 357 N 0.28 1.23 -0.12 3.13 2.04 -0.34 -2.66 117.51 121.07 1pmo h ILE 357 Ca -0.12 -0.95 0.03 0.00 1.00 0.00 0.00 64.86 64.83 1pmo h ILE 357 Cb 1.61 0.94 -0.00 0.00 -0.74 0.00 0.00 36.82 38.63 1pmo h ILE 357 CO 0.19 0.33 0.12 0.00 0.00 0.00 0.00 178.15 178.78 1pmo h ALA 358 N 1.35 1.80 -0.00 1.87 0.00 -1.37 -0.49 119.26 122.43 1pmo h ALA 358 Ca 0.13 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.03 1pmo h ALA 358 Cb 0.43 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.23 1pmo h ALA 358 CO 0.02 -0.18 -0.07 1.63 0.00 0.00 0.00 179.25 180.65 1pmo n LYS 359 N -3.99 0.33 0.00 0.00 5.02 -1.00 -3.98 118.16 114.54 1pmo n LYS 359 Ca -0.00 -0.05 0.10 0.00 -2.02 0.00 0.00 58.31 56.34 1pmo n LYS 359 Cb 0.23 -1.50 -0.10 0.00 -0.02 0.00 0.00 35.03 33.64 1pmo n LYS 359 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1pmo n LEU 360 N -1.29 0.83 -3.81 -0.35 4.77 -0.19 -5.05 117.00 111.92 1pmo n LEU 360 Ca 0.12 -0.39 -0.03 0.00 -0.03 0.00 0.00 56.01 55.68 1pmo n LEU 360 Cb 0.29 -0.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.36 1pmo n LEU 360 CO 0.25 0.20 0.81 -0.83 -1.33 0.00 0.00 177.39 176.50 1pmo s GLY 361 N -3.21 -0.08 -1.28 -0.72 0.00 -1.25 -5.07 107.32 95.71 1pmo s GLY 361 Ca 0.06 -0.04 -0.19 0.00 0.00 0.00 0.00 44.72 44.55 1pmo s GLY 361 CO 0.86 1.32 1.76 2.56 0.00 0.00 0.00 173.10 179.61 1pmo s PRO 362 N -2.62 3.80 0.11 2.90 0.04 -1.26 -4.88 135.00 133.09 1pmo s PRO 362 Ca 0.18 -1.89 0.07 0.00 0.04 0.00 0.00 61.00 59.40 1pmo s PRO 362 Cb -0.01 -5.50 -0.04 0.00 0.04 0.00 0.00 34.50 28.99 1pmo s PRO 362 CO 0.03 -2.48 -0.09 0.71 0.04 0.00 0.00 177.00 175.21 1pmo s TYR 363 N 5.10 2.74 -0.19 0.56 2.02 -1.26 -0.81 117.35 125.51 1pmo s TYR 363 Ca 0.56 -0.16 -0.01 0.00 -0.37 0.00 0.00 57.07 57.09 1pmo s TYR 363 Cb 0.03 -1.42 0.01 0.00 -0.40 0.00 0.00 41.96 40.18 1pmo s TYR 363 CO 0.09 0.44 -0.14 -2.00 -1.57 0.00 0.00 175.55 172.36 1pmo s GLU 364 N -2.28 3.15 0.01 -0.62 2.12 0.23 -4.75 118.70 116.56 1pmo s GLU 364 Ca 0.22 -0.75 -0.18 0.00 0.36 0.00 0.00 54.97 54.62 1pmo s GLU 364 Cb -0.11 -2.74 -0.06 0.00 0.26 0.00 0.00 34.13 31.49 1pmo s GLU 364 CO 0.14 -0.19 0.52 -0.06 -0.54 0.00 0.00 175.26 175.13 1pmo s PHE 365 N 1.34 3.72 -0.18 5.30 0.40 -1.26 -1.36 117.98 125.93 1pmo s PHE 365 Ca 0.05 1.13 0.15 0.00 -0.60 0.00 0.00 56.93 57.66 1pmo s PHE 365 Cb -0.14 -2.48 -0.21 0.00 0.51 0.00 0.00 43.02 40.70 1pmo s PHE 365 CO -0.09 0.49 0.05 -0.89 0.70 0.00 0.00 175.22 175.48 1pmo n ILE 366 N 2.26 1.21 -3.72 0.64 5.41 0.64 -4.95 119.36 120.86 1pmo n ILE 366 Ca -0.10 -0.74 -0.13 0.00 1.00 0.00 0.00 62.75 62.78 1pmo n ILE 366 Cb 0.51 -0.57 -0.14 0.00 -0.71 0.00 0.00 39.64 38.74 1pmo n ILE 366 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1pmo n THR 368 N 4.48 2.01 -2.11 0.00 -2.24 -1.26 -1.20 114.28 113.96 1pmo n THR 368 Ca -0.21 -2.39 -0.09 0.00 -2.27 0.00 0.00 64.05 59.09 1pmo n THR 368 Cb 0.52 -0.24 -0.01 0.00 -2.10 0.00 0.00 70.33 68.50 1pmo n THR 368 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1pmo n GLY 369 N -1.27 0.08 3.72 3.38 0.00 -0.47 -4.04 105.19 106.58 1pmo n GLY 369 Ca 0.18 -0.53 -0.38 0.00 0.00 0.00 0.00 46.02 45.29 1pmo n GLY 369 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1pmo s ARG 370 N -4.32 4.37 0.36 1.61 0.52 -1.26 -4.27 118.95 115.95 1pmo s ARG 370 Ca 0.00 0.60 0.12 0.00 -0.52 0.00 0.00 55.73 55.93 1pmo s ARG 370 Cb 0.00 -3.43 0.90 0.00 0.52 0.00 0.00 34.95 32.94 1pmo s ARG 370 CO 0.00 0.14 1.82 -1.35 0.02 0.00 0.00 175.30 175.93 1pmo h PRO 371 N 6.67 0.58 0.00 3.54 0.11 -1.91 -0.99 132.00 140.00 1pmo h PRO 371 Ca -0.41 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1pmo h PRO 371 Cb 1.19 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.16 1pmo h PRO 371 CO 0.75 0.38 0.00 -0.40 -0.21 0.00 0.00 178.00 178.53 1pmo n ASP 372 N -4.63 0.72 -0.05 -2.05 5.75 -1.26 -3.90 116.55 111.13 1pmo n ASP 372 Ca 0.21 0.57 -0.00 0.00 -0.01 0.00 0.00 54.79 55.56 1pmo n ASP 372 Cb 0.63 -0.76 -0.13 0.00 -1.03 0.00 0.00 41.12 39.83 1pmo n ASP 372 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 1pmo n GLU 373 N -2.18 0.96 0.00 0.11 1.02 -0.45 -5.00 120.64 115.11 1pmo n GLU 373 Ca 0.06 -0.08 0.00 0.00 -0.02 0.00 0.00 57.16 57.12 1pmo n GLU 373 Cb 0.41 -1.42 0.00 0.00 -0.02 0.00 0.00 31.44 30.41 1pmo n GLU 373 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1pmo n GLY 374 N 1.77 -0.87 3.98 0.62 0.00 -0.74 -0.96 105.19 108.99 1pmo n GLY 374 Ca -0.16 -0.18 -0.22 0.00 0.00 0.00 0.00 46.02 45.46 1pmo n GLY 374 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1pmo s ILE 375 N -4.00 2.46 -1.18 -0.61 -4.36 -0.47 -4.47 121.20 108.57 1pmo s ILE 375 Ca 0.00 -0.62 -0.20 0.00 -0.26 0.00 0.00 60.65 59.57 1pmo s ILE 375 Cb 0.00 -2.84 -0.04 0.00 1.25 0.00 0.00 42.46 40.84 1pmo s ILE 375 CO 0.00 0.00 1.91 -2.65 0.24 0.00 0.00 174.94 174.44 1pmo n PRO 376 N -2.53 2.23 -4.00 0.37 -0.02 -1.26 -4.40 135.00 125.40 1pmo n PRO 376 Ca 0.10 -2.61 -0.08 0.00 -2.02 0.00 0.00 63.50 58.89 1pmo n PRO 376 Cb 0.60 -3.44 -0.10 0.00 -0.02 0.00 0.00 33.50 30.54 1pmo n PRO 376 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1pmo s ALA 377 N 6.77 0.18 -0.10 3.55 0.00 -1.26 -1.45 121.76 129.44 1pmo s ALA 377 Ca 0.59 -0.84 0.02 0.00 0.00 0.00 0.00 51.96 51.73 1pmo s ALA 377 Cb 0.06 0.27 0.01 0.00 0.00 0.00 0.00 23.12 23.46 1pmo s ALA 377 CO 0.09 -0.34 -0.17 0.08 0.00 0.00 0.00 175.76 175.42 1pmo s VAL 378 N -3.14 1.60 -0.05 0.00 1.01 -0.05 -1.37 120.40 118.40 1pmo s VAL 378 Ca -0.00 -0.72 0.00 0.00 0.00 0.00 0.00 61.98 61.26 1pmo s VAL 378 Cb 0.02 -1.44 0.02 0.00 0.00 0.00 0.00 36.38 34.99 1pmo s VAL 378 CO -0.07 0.46 -0.02 0.00 0.00 0.00 0.00 175.10 175.47 1pmo s PHE 380 N 1.29 0.27 0.17 0.00 -0.71 -0.86 -0.26 117.98 117.88 1pmo s PHE 380 Ca -0.05 -0.62 -0.00 0.00 -1.04 0.00 0.00 56.93 55.21 1pmo s PHE 380 Cb -0.13 0.10 -0.04 0.00 -1.21 0.00 0.00 43.02 41.73 1pmo s PHE 380 CO -0.02 -0.82 0.07 -1.59 -1.34 0.00 0.00 175.22 171.52 1pmo s LYS 381 N -3.95 1.08 0.28 1.99 -2.85 -0.46 -0.92 119.74 114.90 1pmo s LYS 381 Ca 0.16 -1.54 -0.29 0.00 -1.00 0.00 0.00 55.97 53.30 1pmo s LYS 381 Cb 0.02 0.11 -0.09 0.00 -2.06 0.00 0.00 37.83 35.80 1pmo s LYS 381 CO 0.01 -0.28 1.07 -0.51 0.10 0.00 0.00 175.35 175.74 1pmo s LEU 382 N -3.13 4.53 0.38 2.77 1.43 -1.26 -0.60 118.68 122.81 1pmo s LEU 382 Ca 0.29 2.19 -0.27 0.00 -1.03 0.00 0.00 54.13 55.32 1pmo s LEU 382 Cb 0.07 -3.67 -0.11 0.00 0.03 0.00 0.00 46.19 42.51 1pmo s LEU 382 CO 0.06 -0.12 1.36 0.29 0.23 0.00 0.00 176.35 178.17 1pmo n LYS 383 N 1.13 2.26 -1.68 1.70 5.02 0.01 -4.70 118.16 121.91 1pmo n LYS 383 Ca -0.01 0.80 -0.45 0.00 -2.02 0.00 0.00 58.31 56.63 1pmo n LYS 383 Cb 0.46 -2.48 -0.03 0.00 -0.02 0.00 0.00 35.03 32.96 1pmo n LYS 383 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 1pmo n ASP 384 N 0.43 2.87 -1.99 4.39 8.00 -1.26 -2.08 116.55 126.91 1pmo n ASP 384 Ca 0.04 1.14 -0.17 0.00 0.71 0.00 0.00 54.79 56.51 1pmo n ASP 384 Cb 0.38 -1.44 0.00 0.00 -0.02 0.00 0.00 41.12 40.04 1pmo n ASP 384 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1pmo n GLY 385 N 2.23 -0.30 3.15 0.44 0.00 -1.26 -5.01 105.19 104.45 1pmo n GLY 385 Ca 0.12 -0.17 -0.27 0.00 0.00 0.00 0.00 46.02 45.70 1pmo n GLY 385 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1pmo s GLU 386 N -4.96 1.95 -0.38 1.61 2.56 -0.88 -5.11 118.70 113.49 1pmo s GLU 386 Ca 0.06 -0.65 0.02 0.00 0.00 0.00 0.00 54.97 54.39 1pmo s GLU 386 Cb -0.02 -1.67 0.12 0.00 2.00 0.00 0.00 34.13 34.55 1pmo s GLU 386 CO 0.07 0.24 0.16 0.34 -0.56 0.00 0.00 175.26 175.51 1pmo s ASP 387 N 0.07 4.07 0.00 -1.70 2.15 -1.26 -4.81 116.67 115.20 1pmo s ASP 387 Ca -0.05 -2.24 0.24 0.00 0.43 0.00 0.00 52.55 50.92 1pmo s ASP 387 Cb -0.12 -1.16 1.05 0.00 -0.30 0.00 0.00 42.92 42.39 1pmo s ASP 387 CO 0.03 -0.34 1.77 -0.81 -0.17 0.00 0.00 175.17 175.66 1pmo n PRO 388 N 4.08 0.05 0.00 4.34 -0.04 -1.26 -4.86 135.00 137.30 1pmo n PRO 388 Ca 0.04 0.08 0.00 0.00 -0.04 0.00 0.00 63.50 63.58 1pmo n PRO 388 Cb 0.38 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.34 1pmo n PRO 388 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1pmo n GLY 389 N 0.95 1.37 3.60 0.55 0.00 -1.26 -5.00 105.19 105.39 1pmo n GLY 389 Ca 0.07 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.06 1pmo n GLY 389 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1pmo s TYR 390 N -2.00 -0.12 0.39 1.61 -0.85 -1.26 -4.56 117.35 110.56 1pmo s TYR 390 Ca 0.00 0.04 0.08 0.00 -0.52 0.00 0.00 57.07 56.67 1pmo s TYR 390 Cb 0.00 0.53 -0.04 0.00 0.38 0.00 0.00 41.96 42.83 1pmo s TYR 390 CO 0.00 -0.27 0.23 0.95 -1.52 0.00 0.00 175.55 174.94 1pmo s THR 391 N -2.50 2.68 0.32 -3.49 -4.23 -1.26 -4.99 115.64 102.18 1pmo s THR 391 Ca 0.10 -1.58 0.32 0.00 -1.18 0.00 0.00 61.69 59.36 1pmo s THR 391 Cb 0.01 -3.00 0.35 0.00 1.34 0.00 0.00 72.50 71.19 1pmo s THR 391 CO -0.04 -0.06 2.07 -0.07 -0.54 0.00 0.00 174.62 175.97 1pmo h LEU 392 N 1.34 0.00 -0.33 4.79 3.38 -1.96 -2.09 115.31 120.43 1pmo h LEU 392 Ca -0.43 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.46 1pmo h LEU 392 Cb 1.26 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.00 1pmo h LEU 392 CO 0.64 0.07 -0.11 1.88 0.09 0.00 0.00 178.44 181.00 1pmo h TYR 393 N 0.00 0.75 -0.55 1.13 0.05 -1.93 -1.04 116.97 115.38 1pmo h TYR 393 Ca -0.00 -0.17 -0.04 0.00 0.05 0.00 0.00 58.73 58.57 1pmo h TYR 393 Cb 0.38 -0.18 -0.02 0.00 1.01 0.00 0.00 36.73 37.92 1pmo h TYR 393 CO 0.00 0.85 0.19 -0.44 -1.05 0.00 0.00 178.16 177.71 1pmo h ASP 394 N 0.43 0.79 -0.70 3.88 3.32 -1.65 -1.94 116.42 120.55 1pmo h ASP 394 Ca 0.08 -0.19 -0.03 0.00 0.02 0.00 0.00 57.03 56.91 1pmo h ASP 394 Cb 0.63 -0.21 -0.03 0.00 0.22 0.00 0.00 39.33 39.94 1pmo h ASP 394 CO 0.04 0.77 0.33 0.25 -1.72 0.00 0.00 179.24 178.91 1pmo h LEU 395 N 0.76 0.93 -0.84 1.55 5.85 -1.36 -1.97 115.31 120.23 1pmo h LEU 395 Ca 0.18 -0.14 0.01 0.00 0.84 0.00 0.00 57.88 58.77 1pmo h LEU 395 Cb 0.25 -0.24 -0.04 0.00 0.37 0.00 0.00 40.66 41.00 1pmo h LEU 395 CO -0.01 0.80 0.56 -1.28 -0.34 0.00 0.00 178.44 178.17 1pmo h SER 396 N 0.98 0.96 -0.49 1.25 0.87 -0.86 -1.41 113.55 114.86 1pmo h SER 396 Ca 0.24 -0.02 -0.12 0.00 -1.23 0.00 0.00 61.79 60.66 1pmo h SER 396 Cb 0.13 -0.24 -0.01 0.00 -0.44 0.00 0.00 62.40 61.84 1pmo h SER 396 CO -0.03 0.70 -0.16 -0.08 -0.53 0.00 0.00 176.83 176.73 1pmo h GLU 397 N 1.14 0.97 -0.81 2.24 4.81 -0.97 -2.02 114.58 119.94 1pmo h GLU 397 Ca 0.31 -0.39 -0.02 0.00 -0.13 0.00 0.00 59.36 59.13 1pmo h GLU 397 Cb -0.13 -0.05 -0.04 0.00 0.63 0.00 0.00 28.75 29.17 1pmo h GLU 397 CO -0.07 1.06 0.43 0.00 -0.73 0.00 0.00 179.01 179.70 1pmo h ARG 398 N 0.83 1.13 -0.01 1.92 2.47 -0.97 -1.97 114.38 117.77 1pmo h ARG 398 Ca 0.12 -0.13 -0.08 0.00 -1.26 0.00 0.00 59.98 58.63 1pmo h ARG 398 Cb 0.72 -0.22 -0.01 0.00 -1.65 0.00 0.00 29.97 28.81 1pmo h ARG 398 CO 0.06 0.83 -0.37 -0.07 0.56 0.00 0.00 179.97 180.98 1pmo h LEU 399 N 1.13 0.02 -0.96 3.04 3.38 -1.02 -2.64 115.31 118.27 1pmo h LEU 399 Ca 0.28 -0.01 -0.09 0.00 0.09 0.00 0.00 57.88 58.16 1pmo h LEU 399 Cb 0.04 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 1pmo h LEU 399 CO -0.04 0.39 -0.22 0.03 0.09 0.00 0.00 178.44 178.68 1pmo h ARG 400 N 0.02 0.50 0.00 1.13 3.08 -0.62 -0.14 114.38 118.35 1pmo h ARG 400 Ca -0.00 -0.18 0.00 0.00 0.07 0.00 0.00 59.98 59.87 1pmo h ARG 400 Cb 0.66 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.68 1pmo h ARG 400 CO 0.05 0.69 0.00 1.28 -1.07 0.00 0.00 179.97 180.92 1pmo n LEU 401 N -4.14 0.49 -1.05 3.04 4.77 -1.00 -0.51 117.00 118.59 1pmo n LEU 401 Ca -0.00 0.64 0.09 0.00 -0.03 0.00 0.00 56.01 56.71 1pmo n LEU 401 Cb 0.39 -0.60 0.24 0.00 -2.33 0.00 0.00 43.42 41.12 1pmo n LEU 401 CO 0.42 -0.57 0.71 0.54 -1.33 0.00 0.00 177.39 177.16 1pmo n ARG 402 N -2.06 2.70 -0.27 3.23 1.74 -0.70 -4.95 116.66 116.35 1pmo n ARG 402 Ca 0.02 -2.37 0.00 0.00 -0.77 0.00 0.00 57.85 54.73 1pmo n ARG 402 Cb 0.17 -1.45 0.00 0.00 -1.02 0.00 0.00 32.46 30.17 1pmo n ARG 402 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1pmo n GLY 403 N 1.20 0.93 3.88 -0.13 0.00 0.33 -5.06 105.19 106.33 1pmo n GLY 403 Ca 0.19 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.87 1pmo n GLY 403 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1pmo s TRP 404 N -2.70 3.53 -0.41 1.61 0.52 -0.15 -4.71 118.94 116.63 1pmo s TRP 404 Ca 0.00 0.70 0.02 0.00 0.02 0.00 0.00 56.10 56.83 1pmo s TRP 404 Cb 0.00 -2.10 0.11 0.00 -1.15 0.00 0.00 33.47 30.33 1pmo s TRP 404 CO 0.00 0.48 0.16 -1.14 0.02 0.00 0.00 176.95 176.47 1pmo s GLN 405 N -2.21 1.79 -0.36 4.98 2.00 -0.69 -2.67 119.66 122.51 1pmo s GLN 405 Ca 0.36 -2.05 0.01 0.00 -2.00 0.00 0.00 55.36 51.68 1pmo s GLN 405 Cb -0.13 -3.37 0.10 0.00 0.80 0.00 0.00 33.01 30.41 1pmo s GLN 405 CO 0.20 -1.02 0.09 0.08 -0.50 0.00 0.00 175.29 174.14 1pmo s VAL 406 N 0.67 2.72 0.29 1.34 1.01 -1.26 -0.91 120.40 124.25 1pmo s VAL 406 Ca 0.12 -2.11 -0.30 0.00 0.00 0.00 0.00 61.98 59.69 1pmo s VAL 406 Cb -0.21 -2.88 -0.11 0.00 0.00 0.00 0.00 36.38 33.17 1pmo s VAL 406 CO -0.05 -0.56 1.58 -2.16 0.00 0.00 0.00 175.10 173.91 1pmo s PRO 407 N 1.03 4.14 -0.10 2.72 0.04 -1.26 -4.71 135.00 136.87 1pmo s PRO 407 Ca 0.07 2.55 0.03 0.00 0.04 0.00 0.00 61.00 63.69 1pmo s PRO 407 Cb -0.21 -3.03 0.01 0.00 0.04 0.00 0.00 34.50 31.31 1pmo s PRO 407 CO -0.06 -0.61 -0.19 0.00 0.04 0.00 0.00 177.00 176.18 1pmo s ALA 408 N 0.02 1.88 0.31 8.56 0.00 -1.26 -2.16 121.76 129.11 1pmo s ALA 408 Ca 0.63 -0.81 -0.17 0.00 0.00 0.00 0.00 51.96 51.62 1pmo s ALA 408 Cb -0.47 -0.77 0.03 0.00 0.00 0.00 0.00 23.12 21.90 1pmo s ALA 408 CO 0.47 0.15 0.68 -0.59 0.00 0.00 0.00 175.76 176.48 1pmo s PHE 409 N 0.58 0.09 0.11 0.00 -0.12 -0.39 -2.57 117.98 115.68 1pmo s PHE 409 Ca -0.15 -0.59 -0.00 0.00 -0.05 0.00 0.00 56.93 56.14 1pmo s PHE 409 Cb -0.17 0.61 -0.04 0.00 -0.63 0.00 0.00 43.02 42.79 1pmo s PHE 409 CO 0.05 -1.30 0.27 -0.08 -0.05 0.00 0.00 175.22 174.11 1pmo s THR 410 N -3.36 5.32 0.74 -4.49 -1.32 -1.26 -0.09 115.64 111.18 1pmo s THR 410 Ca 0.16 -0.37 -0.06 0.00 -1.21 0.00 0.00 61.69 60.20 1pmo s THR 410 Cb -0.04 -3.66 0.10 0.00 -1.51 0.00 0.00 72.50 67.38 1pmo s THR 410 CO 0.10 0.04 1.05 -0.76 -2.21 0.00 0.00 174.62 172.84 1pmo s LEU 411 N -2.77 2.87 0.00 9.08 1.43 -0.81 -4.94 118.68 123.54 1pmo s LEU 411 Ca 0.36 0.20 0.00 0.00 -1.03 0.00 0.00 54.13 53.66 1pmo s LEU 411 Cb -0.12 -2.69 0.00 0.00 0.03 0.00 0.00 46.19 43.41 1pmo s LEU 411 CO 0.28 -1.83 0.00 0.61 0.23 0.00 0.00 176.35 175.64 1pmo n GLY 412 N -3.01 1.75 7.00 -3.19 0.00 -1.26 -3.11 105.19 103.37 1pmo n GLY 412 Ca 0.11 -2.01 0.00 0.00 0.00 0.00 0.00 46.02 44.12 1pmo n GLY 412 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pmo n GLY 413 N 5.00 2.78 0.07 -0.02 0.00 -1.26 0.48 105.19 112.24 1pmo n GLY 413 Ca 0.00 -0.02 0.09 0.00 0.00 0.00 0.00 46.02 46.09 1pmo n GLY 413 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1pmo n GLU 414 N 14.00 1.09 -0.47 1.61 4.71 0.18 -2.56 120.64 139.20 1pmo n GLU 414 Ca 0.00 -0.13 0.08 0.00 -0.01 0.00 0.00 57.16 57.10 1pmo n GLU 414 Cb 0.00 -1.30 0.27 0.00 -1.01 0.00 0.00 31.44 29.41 1pmo n GLU 414 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1pmo n ALA 415 N -0.65 2.94 0.12 0.62 0.00 0.18 -4.53 120.51 119.18 1pmo n ALA 415 Ca 0.14 -1.87 0.02 0.00 0.00 0.00 0.00 53.44 51.73 1pmo n ALA 415 Cb 0.09 -0.76 0.07 0.00 0.00 0.00 0.00 19.45 18.86 1pmo n ALA 415 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 1pmo n THR 416 N 0.17 1.75 0.56 0.00 5.66 -0.71 -1.21 114.28 120.50 1pmo n THR 416 Ca 0.21 0.44 0.06 0.00 -3.05 0.00 0.00 64.05 61.71 1pmo n THR 416 Cb 0.83 -1.38 0.01 0.00 -1.55 0.00 0.00 70.33 68.24 1pmo n THR 416 CO 0.00 0.00 0.00 -0.90 -3.05 0.00 0.00 175.07 171.12 1pmo n ASP 417 N -1.49 1.55 -4.80 1.09 5.75 -1.26 -4.73 116.55 112.65 1pmo n ASP 417 Ca 0.01 -1.28 -0.38 0.00 -0.01 0.00 0.00 54.79 53.14 1pmo n ASP 417 Cb 0.04 0.37 -0.06 0.00 -1.03 0.00 0.00 41.12 40.43 1pmo n ASP 417 CO 0.00 0.00 0.00 -0.63 -0.11 0.00 0.00 177.20 176.46 1pmo s ILE 418 N -1.49 5.13 -0.16 2.12 1.01 -0.35 -5.02 121.20 122.44 1pmo s ILE 418 Ca 0.12 0.77 -0.01 0.00 0.00 0.00 0.00 60.65 61.53 1pmo s ILE 418 Cb 0.10 -3.70 -0.01 0.00 0.01 0.00 0.00 42.46 38.87 1pmo s ILE 418 CO 0.29 0.51 -0.10 -0.69 0.00 0.00 0.00 174.94 174.95 1pmo s VAL 419 N -0.57 3.16 0.33 2.92 1.01 -1.26 -1.93 120.40 124.07 1pmo s VAL 419 Ca 0.22 -0.60 0.10 0.00 0.00 0.00 0.00 61.98 61.70 1pmo s VAL 419 Cb -0.16 -2.37 -0.06 0.00 0.00 0.00 0.00 36.38 33.80 1pmo s VAL 419 CO 0.11 0.50 -0.11 0.68 0.00 0.00 0.00 175.10 176.28 1pmo s VAL 420 N 0.69 2.24 -0.10 2.92 -7.23 0.87 -4.35 120.40 115.44 1pmo s VAL 420 Ca -0.05 -2.23 0.03 0.00 -1.81 0.00 0.00 61.98 57.92 1pmo s VAL 420 Cb -0.15 -2.58 0.01 0.00 0.56 0.00 0.00 36.38 34.21 1pmo s VAL 420 CO 0.02 -0.24 -0.20 -0.32 -0.31 0.00 0.00 175.10 174.05 1pmo s MET 421 N -3.60 2.66 -0.08 4.82 1.75 -0.10 -1.26 119.30 123.49 1pmo s MET 421 Ca 0.32 -0.74 0.05 0.00 -1.25 0.00 0.00 55.69 54.07 1pmo s MET 421 Cb 0.01 -2.08 -0.00 0.00 2.84 0.00 0.00 34.83 35.60 1pmo s MET 421 CO 0.16 0.09 -0.24 0.50 -0.65 0.00 0.00 175.02 174.88 1pmo s ARG 422 N 0.57 2.75 -0.15 4.11 3.52 -0.92 -2.03 118.95 126.80 1pmo s ARG 422 Ca -0.15 -0.86 0.01 0.00 -0.13 0.00 0.00 55.73 54.61 1pmo s ARG 422 Cb -0.17 -2.18 0.00 0.00 -1.56 0.00 0.00 34.95 31.05 1pmo s ARG 422 CO 0.05 0.26 -0.18 0.42 -0.81 0.00 0.00 175.30 175.03 1pmo s ILE 423 N 0.14 2.40 -0.15 4.11 1.01 0.12 -4.07 121.20 124.76 1pmo s ILE 423 Ca -0.12 -0.87 -0.06 0.00 0.00 0.00 0.00 60.65 59.60 1pmo s ILE 423 Cb -0.16 -1.99 -0.04 0.00 0.01 0.00 0.00 42.46 40.29 1pmo s ILE 423 CO 0.06 0.53 0.05 -0.04 0.00 0.00 0.00 174.94 175.54 1pmo s MET 424 N 0.78 3.70 -0.39 2.79 -1.94 -0.45 -0.87 119.30 122.92 1pmo s MET 424 Ca -0.07 -0.36 -0.04 0.00 -1.71 0.00 0.00 55.69 53.52 1pmo s MET 424 Cb -0.16 -3.09 0.10 0.00 2.01 0.00 0.00 34.83 33.69 1pmo s MET 424 CO -0.00 0.40 0.18 0.00 -0.01 0.00 0.00 175.02 175.59 1pmo s ARG 426 N 1.20 2.28 0.13 0.00 1.70 -1.26 -4.75 118.95 118.26 1pmo s ARG 426 Ca 0.05 -1.76 -0.35 0.00 -0.47 0.00 0.00 55.73 53.20 1pmo s ARG 426 Cb -0.22 -2.06 -0.15 0.00 -0.57 0.00 0.00 34.95 31.94 1pmo s ARG 426 CO -0.03 -0.10 1.38 -2.13 -1.08 0.00 0.00 175.30 173.35 1pmo n ARG 427 N -1.27 1.51 0.00 3.89 0.63 -1.26 -1.85 116.66 118.31 1pmo n ARG 427 Ca -0.01 0.54 0.00 0.00 -0.92 0.00 0.00 57.85 57.47 1pmo n ARG 427 Cb 0.64 -2.20 0.00 0.00 0.45 0.00 0.00 32.46 31.35 1pmo n ARG 427 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1pmo n GLY 428 N 2.66 1.69 3.35 5.14 0.00 -1.26 -4.41 105.19 112.36 1pmo n GLY 428 Ca 0.17 -0.09 -0.43 0.00 0.00 0.00 0.00 46.02 45.66 1pmo n GLY 428 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1pmo n PHE 429 N 0.00 4.50 -1.79 1.61 7.35 -0.77 -4.98 117.46 123.38 1pmo n PHE 429 Ca 0.00 -3.15 -0.29 0.00 -0.76 0.00 0.00 57.45 53.25 1pmo n PHE 429 Cb 0.00 -2.25 0.08 0.00 0.35 0.00 0.00 39.48 37.66 1pmo n PHE 429 CO 0.00 0.00 0.00 -1.21 -0.76 0.00 0.00 176.76 174.79 1pmo s GLU 430 N 1.94 2.14 0.32 -4.13 0.41 -1.26 -4.81 118.70 113.32 1pmo s GLU 430 Ca 0.45 0.32 0.10 0.00 -0.41 0.00 0.00 54.97 55.43 1pmo s GLU 430 Cb 0.01 -1.95 0.92 0.00 -1.78 0.00 0.00 34.13 31.33 1pmo s GLU 430 CO 0.01 -1.51 1.72 1.98 -0.49 0.00 0.00 175.26 176.97 1pmo h MET 431 N -1.00 0.52 -0.96 1.61 4.05 -1.94 0.46 114.93 117.67 1pmo h MET 431 Ca -0.46 -0.03 0.01 0.00 -0.28 0.00 0.00 59.70 58.93 1pmo h MET 431 Cb 1.30 -0.12 -0.05 0.00 -0.80 0.00 0.00 31.60 31.93 1pmo h MET 431 CO 0.64 0.35 0.62 -0.44 0.23 0.00 0.00 176.91 178.31 1pmo h ASP 432 N 0.54 1.12 0.50 1.39 3.32 -1.99 -1.59 116.42 119.71 1pmo h ASP 432 Ca 0.66 -0.04 -0.15 0.00 0.02 0.00 0.00 57.03 57.52 1pmo h ASP 432 Cb 1.30 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 40.56 1pmo h ASP 432 CO -0.50 0.82 -0.66 -0.26 -1.72 0.00 0.00 179.24 176.92 1pmo h PHE 433 N 1.31 0.20 -0.43 4.55 -1.00 -1.28 -2.76 116.94 117.53 1pmo h PHE 433 Ca 0.35 -0.08 -0.07 0.00 2.81 0.00 0.00 57.97 60.97 1pmo h PHE 433 Cb -0.13 -0.03 -0.02 0.00 3.61 0.00 0.00 35.95 39.38 1pmo h PHE 433 CO 0.00 0.77 -0.04 0.00 -1.61 0.00 0.00 178.31 177.43 1pmo h ALA 434 N 1.21 1.13 -0.67 2.45 0.00 -0.82 -0.82 119.26 121.73 1pmo h ALA 434 Ca -0.01 -0.27 -0.05 0.00 0.00 0.00 0.00 54.91 54.58 1pmo h ALA 434 Cb 1.19 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.77 1pmo h ALA 434 CO 0.10 0.56 0.23 0.93 0.00 0.00 0.00 179.25 181.06 1pmo h GLU 435 N 0.67 1.03 -0.60 0.00 4.39 -1.15 -0.72 114.58 118.20 1pmo h GLU 435 Ca 0.13 -0.21 -0.09 0.00 0.34 0.00 0.00 59.36 59.53 1pmo h GLU 435 Cb 0.47 -0.15 -0.02 0.00 -0.10 0.00 0.00 28.75 28.94 1pmo h GLU 435 CO 0.02 0.88 0.04 1.25 -1.16 0.00 0.00 179.01 180.05 1pmo h LEU 436 N 0.97 0.99 -0.57 1.33 5.85 -1.16 -1.37 115.31 121.35 1pmo h LEU 436 Ca 0.22 -0.26 0.00 0.00 0.84 0.00 0.00 57.88 58.68 1pmo h LEU 436 Cb 0.27 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 41.01 1pmo h LEU 436 CO -0.01 1.02 0.36 0.25 -0.34 0.00 0.00 178.44 179.72 1pmo h LEU 437 N 0.95 0.68 -0.87 2.25 7.12 -0.68 -0.96 115.31 123.80 1pmo h LEU 437 Ca 0.18 -0.04 0.00 0.00 0.13 0.00 0.00 57.88 58.15 1pmo h LEU 437 Cb 0.49 -0.17 -0.04 0.00 -0.53 0.00 0.00 40.66 40.41 1pmo h LEU 437 CO 0.02 0.52 0.55 -0.07 -0.13 0.00 0.00 178.44 179.33 1pmo h LEU 438 N 0.77 1.02 -0.34 2.25 3.38 -0.76 0.25 115.31 121.89 1pmo h LEU 438 Ca 0.21 -0.05 -0.01 0.00 0.09 0.00 0.00 57.88 58.12 1pmo h LEU 438 Cb -0.04 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.43 1pmo h LEU 438 CO -0.04 0.77 0.17 -0.33 0.09 0.00 0.00 178.44 179.10 1pmo h GLU 439 N 1.19 0.49 -0.07 1.13 5.08 -0.64 -0.58 114.58 121.17 1pmo h GLU 439 Ca 0.31 -0.07 -0.09 0.00 -1.00 0.00 0.00 59.36 58.51 1pmo h GLU 439 Cb -0.09 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.06 1pmo h GLU 439 CO -0.06 0.44 -0.37 -0.44 -1.00 0.00 0.00 179.01 177.57 1pmo h ASP 440 N 0.41 0.15 -0.22 1.42 3.32 -0.77 -1.40 116.42 119.34 1pmo h ASP 440 Ca 0.12 -0.06 -0.02 0.00 0.02 0.00 0.00 57.03 57.09 1pmo h ASP 440 Cb 0.11 -0.04 -0.01 0.00 0.22 0.00 0.00 39.33 39.61 1pmo h ASP 440 CO -0.02 0.52 0.04 0.22 -1.72 0.00 0.00 179.24 178.29 1pmo h TYR 441 N 0.13 0.37 -0.49 4.55 5.03 -0.05 -0.38 116.97 126.12 1pmo h TYR 441 Ca 0.01 -0.05 -0.04 0.00 2.58 0.00 0.00 58.73 61.24 1pmo h TYR 441 Cb 0.72 -0.10 -0.02 0.00 1.55 0.00 0.00 36.73 38.88 1pmo h TYR 441 CO 0.01 0.47 0.16 0.87 -1.32 0.00 0.00 178.16 178.35 1pmo h LYS 442 N 0.16 0.76 -0.98 1.82 1.57 -0.90 -1.90 116.57 117.10 1pmo h LYS 442 Ca 0.07 -0.16 0.03 0.00 -1.87 0.00 0.00 60.65 58.71 1pmo h LYS 442 Cb 0.30 -0.11 -0.05 0.00 0.08 0.00 0.00 32.23 32.44 1pmo h LYS 442 CO 0.00 0.71 0.64 0.00 -0.57 0.00 0.00 179.45 180.24 1pmo h ALA 443 N 1.01 1.27 -0.58 3.86 0.00 -1.12 -1.51 119.26 122.20 1pmo h ALA 443 Ca 0.16 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 1pmo h ALA 443 Cb 0.27 -0.37 -0.03 0.00 0.00 0.00 0.00 17.79 17.66 1pmo h ALA 443 CO -0.01 0.57 0.27 0.77 0.00 0.00 0.00 179.25 180.85 1pmo h SER 444 N 1.27 0.77 -0.75 0.00 0.02 -0.68 -1.57 113.55 112.60 1pmo h SER 444 Ca 0.38 -0.14 -0.05 0.00 -0.84 0.00 0.00 61.79 61.14 1pmo h SER 444 Cb -0.06 -0.20 -0.03 0.00 0.14 0.00 0.00 62.40 62.25 1pmo h SER 444 CO -0.11 0.69 0.28 -0.07 -1.14 0.00 0.00 176.83 176.49 1pmo h LEU 445 N 0.79 1.06 -0.73 5.07 3.38 -0.70 -0.50 115.31 123.68 1pmo h LEU 445 Ca 0.20 -0.19 -0.09 0.00 0.09 0.00 0.00 57.88 57.89 1pmo h LEU 445 Cb 0.13 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.59 1pmo h LEU 445 CO -0.02 0.96 -0.01 0.50 0.09 0.00 0.00 178.44 179.96 1pmo h LYS 446 N 1.10 0.96 -0.41 1.13 3.64 -1.08 -0.60 116.57 121.31 1pmo h LYS 446 Ca 0.25 -0.29 -0.05 0.00 -1.27 0.00 0.00 60.65 59.29 1pmo h LYS 446 Cb 0.25 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 31.96 1pmo h LYS 446 CO -0.02 0.95 0.07 -0.92 -2.27 0.00 0.00 179.45 177.27 1pmo h TYR 447 N 0.89 0.72 -0.40 1.91 3.20 -0.88 -0.33 116.97 122.07 1pmo h TYR 447 Ca 0.16 -0.10 -0.05 0.00 3.14 0.00 0.00 58.73 61.88 1pmo h TYR 447 Cb 0.53 -0.20 -0.02 0.00 1.54 0.00 0.00 36.73 38.58 1pmo h TYR 447 CO 0.03 0.70 0.03 -0.07 -1.64 0.00 0.00 178.16 177.22 1pmo h LEU 448 N 0.54 0.58 -0.46 2.82 3.38 -0.88 -0.47 115.31 120.83 1pmo h LEU 448 Ca 0.13 -0.11 -0.09 0.00 0.09 0.00 0.00 57.88 57.90 1pmo h LEU 448 Cb 0.36 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.94 1pmo h LEU 448 CO 0.01 0.63 -0.07 -1.28 0.09 0.00 0.00 178.44 177.82 1pmo h SER 449 N 0.60 0.86 1.30 -0.43 0.87 -0.67 -2.97 113.55 113.09 1pmo h SER 449 Ca 0.13 -0.34 0.00 0.00 -1.23 0.00 0.00 61.79 60.35 1pmo h SER 449 Cb 0.33 -0.23 0.00 0.00 -0.44 0.00 0.00 62.40 62.05 1pmo h SER 449 CO 0.01 1.00 0.00 0.47 -0.53 0.00 0.00 176.83 177.77 1pmo n ASP 450 N -4.30 0.57 -3.21 6.23 8.00 -0.17 -4.19 116.55 119.48 1pmo n ASP 450 Ca -0.00 0.56 -0.24 0.00 0.71 0.00 0.00 54.79 55.82 1pmo n ASP 450 Cb 0.36 -0.71 -0.06 0.00 -0.02 0.00 0.00 41.12 40.69 1pmo n ASP 450 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 1pmo n HIS 451 N -2.04 1.54 -0.36 1.24 8.25 -0.22 -4.97 115.22 118.66 1pmo n HIS 451 Ca 0.06 -3.85 0.35 0.00 -0.26 0.00 0.00 57.72 54.03 1pmo n HIS 451 Cb 0.39 -0.44 0.72 0.00 1.12 0.00 0.00 29.99 31.78 1pmo n HIS 451 CO 0.00 0.00 0.00 -1.35 0.64 0.00 0.00 176.34 175.63 1pmo h PRO 452 N 3.65 0.05 0.00 -0.41 0.11 -1.71 -1.89 132.00 131.81 1pmo h PRO 452 Ca 0.12 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.23 1pmo h PRO 452 Cb 0.78 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 31.88 1pmo h PRO 452 CO 0.63 0.03 0.00 0.87 -0.21 0.00 0.00 178.00 179.32 1pmo h LYS 453 N 0.05 0.00 0.00 1.05 1.57 -1.93 -2.50 116.57 114.81 1pmo h LYS 453 Ca 0.61 0.00 -0.11 0.00 -1.87 0.00 0.00 60.65 59.28 1pmo h LYS 453 Cb 2.32 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 34.61 1pmo h LYS 453 CO -0.06 0.00 -0.52 -0.07 -0.57 0.00 0.00 179.45 178.23 1pmo h LEU 454 N 0.00 0.00 -9.37 2.94 3.38 -1.68 -3.45 115.31 107.12 1pmo h LEU 454 Ca 0.00 0.00 -0.63 0.00 0.09 0.00 0.00 57.88 57.34 1pmo h LEU 454 Cb 0.05 0.00 0.05 0.00 0.09 0.00 0.00 40.66 40.85 1pmo h LEU 454 CO 0.00 0.52 0.70 1.67 0.09 0.00 0.00 178.44 181.42 1pmo n GLN 455 N -3.89 1.71 -0.05 1.13 7.27 -0.94 -2.38 117.38 120.23 1pmo n GLN 455 Ca -0.01 0.62 0.00 0.00 0.07 0.00 0.00 57.00 57.67 1pmo n GLN 455 Cb 0.53 -2.34 0.00 0.00 2.41 0.00 0.00 30.24 30.84 1pmo n GLN 455 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1pmo n GLY 456 N 3.21 2.08 0.06 1.69 0.00 -1.26 -4.94 105.19 106.02 1pmo n GLY 456 Ca 0.19 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.08 1pmo n GLY 456 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1pmo h ILE 457 N 0.00 1.41 -3.28 -0.61 2.04 -1.78 -3.43 117.51 111.85 1pmo h ILE 457 Ca 0.00 -1.20 -0.53 0.00 1.00 0.00 0.00 64.86 64.13 1pmo h ILE 457 Cb 0.00 2.22 0.03 0.00 -0.74 0.00 0.00 36.82 38.33 1pmo h ILE 457 CO 0.00 0.31 0.66 0.00 0.00 0.00 0.00 178.15 179.12 1pmo s ALA 458 N -4.16 3.53 0.00 1.87 0.00 -1.26 -4.92 121.76 116.81 1pmo s ALA 458 Ca -0.16 1.08 0.07 0.00 0.00 0.00 0.00 51.96 52.95 1pmo s ALA 458 Cb 0.01 -3.49 0.12 0.00 0.00 0.00 0.00 23.12 19.76 1pmo s ALA 458 CO 0.68 -0.54 0.93 1.04 0.00 0.00 0.00 175.76 177.87 1pmo n GLN 459 N 3.03 0.00 -4.55 0.00 1.13 -1.26 -4.63 117.38 111.10 1pmo n GLN 459 Ca 0.07 -1.04 -0.33 0.00 -1.94 0.00 0.00 57.00 53.76 1pmo n GLN 459 Cb 0.43 0.06 -0.13 0.00 0.11 0.00 0.00 30.24 30.71 1pmo n GLN 459 CO 0.00 0.00 0.00 -1.14 -1.44 0.00 0.00 177.06 174.48 1pmo s GLN 460 N 0.00 3.50 0.46 -1.09 2.00 -1.26 -5.10 119.66 118.18 1pmo s GLN 460 Ca 0.09 -0.61 -0.23 0.00 -2.00 0.00 0.00 55.36 52.61 1pmo s GLN 460 Cb 0.10 -2.78 -0.07 0.00 0.80 0.00 0.00 33.01 31.06 1pmo s GLN 460 CO -0.05 0.19 1.17 -0.80 -0.50 0.00 0.00 175.29 175.31 1pmo s ASN 461 N 0.44 6.14 0.53 6.67 0.01 -1.26 -4.94 114.94 122.53 1pmo s ASN 461 Ca -0.07 2.33 -0.03 0.00 -0.71 0.00 0.00 52.86 54.38 1pmo s ASN 461 Cb -0.15 -2.60 0.00 0.00 0.41 0.00 0.00 41.25 38.91 1pmo s ASN 461 CO 0.04 -0.94 0.80 -0.44 -1.51 0.00 0.00 177.10 175.05 1pmo s SER 462 N -1.33 5.70 0.10 -1.22 0.01 -1.06 -5.00 113.70 110.90 1pmo s SER 462 Ca 0.64 0.52 -0.31 0.00 1.31 0.00 0.00 55.95 58.11 1pmo s SER 462 Cb -0.29 -1.62 -0.10 0.00 0.21 0.00 0.00 66.02 64.22 1pmo s SER 462 CO 0.35 -0.90 1.88 0.33 0.41 0.00 0.00 173.24 175.31 1pmo n PHE 463 N -2.36 2.60 0.01 2.43 7.35 -1.26 -4.86 117.46 121.37 1pmo n PHE 463 Ca 0.03 -0.22 0.01 0.00 -0.76 0.00 0.00 57.45 56.51 1pmo n PHE 463 Cb 0.58 -2.76 -0.02 0.00 0.35 0.00 0.00 39.48 37.63 1pmo n PHE 463 CO 0.00 0.00 0.00 0.36 -0.76 0.00 0.00 176.76 176.36 1pmo n LYS 464 N 6.21 0.66 0.04 -4.13 2.85 -1.26 -4.76 118.16 117.77 1pmo n LYS 464 Ca 0.19 -0.02 0.05 0.00 -1.05 0.00 0.00 58.31 57.47 1pmo n LYS 464 Cb 0.39 -1.02 0.23 0.00 -0.65 0.00 0.00 35.03 33.98 1pmo n LYS 464 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 177.40 178.07 1pmo n HIS 465 N -1.55 0.20 0.00 5.58 8.25 -1.26 -4.77 115.22 121.67 1pmo n HIS 465 Ca -0.00 0.09 0.00 0.00 -0.26 0.00 0.00 57.72 57.55 1pmo n HIS 465 Cb 0.07 -0.65 0.00 0.00 1.12 0.00 0.00 29.99 30.53 1pmo n HIS 465 CO 0.00 0.00 0.00 -2.37 0.64 0.00 0.00 176.34 174.61