#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1jmi h LEU 2 N 0.00 0.49 -2.73 4.03 6.46 -1.94 -1.89 115.31 119.73 1jmi h LEU 2 Ca 0.00 0.12 -0.07 0.00 -0.12 0.00 0.00 57.88 57.80 1jmi h LEU 2 Cb 0.00 0.05 -0.04 0.00 -0.73 0.00 0.00 40.66 39.93 1jmi h LEU 2 CO 0.00 0.14 0.09 -1.84 -0.62 0.00 0.00 178.44 176.22 1jmi n GLU 3 N -4.92 3.05 0.03 1.25 -0.00 -1.26 -4.41 120.64 114.38 1jmi n GLU 3 Ca 0.20 -1.93 -0.04 0.00 -0.00 0.00 0.00 57.16 55.39 1jmi n GLU 3 Cb 0.54 -1.92 0.19 0.00 -0.00 0.00 0.00 31.44 30.24 1jmi n GLU 3 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.13 177.50 1jmi h GLN 4 N 2.05 0.43 -0.05 3.44 5.75 -1.78 -2.63 115.11 122.32 1jmi h GLN 4 Ca 0.09 -0.19 0.02 0.00 -0.15 0.00 0.00 58.65 58.42 1jmi h GLN 4 Cb 1.59 -0.01 -0.00 0.00 1.07 0.00 0.00 27.48 30.12 1jmi h GLN 4 CO 0.39 0.71 0.04 -1.35 -2.65 0.00 0.00 178.83 175.98 1jmi h PRO 5 N 0.37 0.00 0.78 -2.39 0.11 -1.83 -0.96 132.00 128.08 1jmi h PRO 5 Ca 0.04 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 66.12 1jmi h PRO 5 Cb 0.76 0.00 0.01 0.00 0.11 0.00 0.00 31.00 31.88 1jmi h PRO 5 CO 0.06 0.00 -0.38 -0.92 -0.21 0.00 0.00 178.00 176.55 1jmi h TYR 6 N 0.00 -0.98 -0.76 0.65 3.20 -1.81 -1.03 116.97 116.25 1jmi h TYR 6 Ca 0.03 -0.02 0.15 0.00 3.14 0.00 0.00 58.73 62.02 1jmi h TYR 6 Cb 0.11 0.32 -0.10 0.00 1.54 0.00 0.00 36.73 38.60 1jmi h TYR 6 CO 0.00 -0.61 0.29 -0.07 -1.64 0.00 0.00 178.16 176.13 1jmi h LEU 7 N -1.28 0.24 -0.96 2.82 3.38 -1.48 0.17 115.31 118.20 1jmi h LEU 7 Ca -0.11 0.12 -0.04 0.00 0.09 0.00 0.00 57.88 57.94 1jmi h LEU 7 Cb 0.81 0.11 -0.03 0.00 0.09 0.00 0.00 40.66 41.63 1jmi h LEU 7 CO 0.18 0.08 0.27 0.44 0.09 0.00 0.00 178.44 179.49 1jmi h ASP 8 N 0.41 0.94 -0.04 -0.43 3.32 -1.18 -1.21 116.42 118.23 1jmi h ASP 8 Ca 0.42 -0.14 0.03 0.00 0.02 0.00 0.00 57.03 57.37 1jmi h ASP 8 Cb 0.67 -0.24 -0.04 0.00 0.22 0.00 0.00 39.33 39.94 1jmi h ASP 8 CO -0.43 0.84 -0.18 0.25 -1.72 0.00 0.00 179.24 178.01 1jmi h LEU 9 N 1.00 -0.53 -0.24 1.55 6.46 0.42 -0.88 115.31 123.08 1jmi h LEU 9 Ca 0.23 0.08 0.04 0.00 -0.12 0.00 0.00 57.88 58.11 1jmi h LEU 9 Cb 0.20 0.23 -0.04 0.00 -0.73 0.00 0.00 40.66 40.32 1jmi h LEU 9 CO -0.02 -0.24 0.02 0.00 -0.62 0.00 0.00 178.44 177.59 1jmi h ALA 10 N 0.69 0.23 -0.43 1.25 0.00 -1.04 -2.16 119.26 117.80 1jmi h ALA 10 Ca 0.07 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 1jmi h ALA 10 Cb 0.36 0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.22 1jmi h ALA 10 CO -0.20 -0.40 0.23 0.87 0.00 0.00 0.00 179.25 179.75 1jmi h LYS 11 N 0.10 0.58 -0.08 0.00 1.57 -1.00 -0.33 116.57 117.41 1jmi h LYS 11 Ca 0.11 -0.05 -0.13 0.00 -1.87 0.00 0.00 60.65 58.71 1jmi h LYS 11 Cb 0.13 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.31 1jmi h LYS 11 CO -0.17 0.43 -0.51 -0.22 -0.57 0.00 0.00 179.45 178.41 1jmi h LYS 12 N 0.59 0.23 0.00 3.15 3.64 -0.53 -0.30 116.57 123.35 1jmi h LYS 12 Ca 0.15 -0.13 -0.09 0.00 -1.27 0.00 0.00 60.65 59.31 1jmi h LYS 12 Cb 0.02 0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 31.84 1jmi h LYS 12 CO -0.02 0.68 -0.75 -0.24 -2.27 0.00 0.00 179.45 176.85 1jmi h VAL 13 N 0.18 0.50 -0.22 2.00 3.04 -1.06 0.36 116.25 121.04 1jmi h VAL 13 Ca 0.01 -1.78 -0.09 0.00 -1.01 0.00 0.00 66.70 63.82 1jmi h VAL 13 Cb 0.96 2.11 -0.00 0.00 -2.01 0.00 0.00 31.29 32.35 1jmi h VAL 13 CO 0.08 0.28 -0.22 -0.07 -1.01 0.00 0.00 177.57 176.63 1jmi h LEU 14 N 0.00 0.58 0.08 3.16 3.38 -0.72 -1.45 115.31 120.34 1jmi h LEU 14 Ca -0.05 -0.48 -0.33 0.00 0.09 0.00 0.00 57.88 57.12 1jmi h LEU 14 Cb 1.32 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.88 1jmi h LEU 14 CO 0.04 0.94 -1.81 0.47 0.09 0.00 0.00 178.44 178.16 1jmi n ASP 15 N -4.40 2.04 0.01 -0.43 8.00 -0.16 -4.60 116.55 117.02 1jmi n ASP 15 Ca -0.05 0.26 0.11 0.00 0.71 0.00 0.00 54.79 55.83 1jmi n ASP 15 Cb 0.42 -0.88 -0.13 0.00 -0.02 0.00 0.00 41.12 40.51 1jmi n ASP 15 CO 0.00 0.00 0.00 1.21 -0.39 0.00 0.00 177.20 178.02 1jmi n GLU 16 N -3.77 0.57 -1.64 -1.24 2.13 0.12 -5.00 120.64 111.81 1jmi n GLU 16 Ca -0.33 -0.12 -0.36 0.00 0.66 0.00 0.00 57.16 57.00 1jmi n GLU 16 Cb 0.94 -1.57 0.08 0.00 0.27 0.00 0.00 31.44 31.16 1jmi n GLU 16 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1jmi n GLY 17 N 1.28 0.46 3.66 8.31 0.00 -0.55 -4.96 105.19 113.40 1jmi n GLY 17 Ca -0.02 -0.20 -0.30 0.00 0.00 0.00 0.00 46.02 45.50 1jmi n GLY 17 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1jmi s HIS 18 N -1.49 2.92 0.07 1.61 3.76 -1.04 -4.77 115.29 116.35 1jmi s HIS 18 Ca 0.81 -0.07 -0.31 0.00 -0.15 0.00 0.00 55.06 55.35 1jmi s HIS 18 Cb -0.37 -1.49 -0.06 0.00 1.11 0.00 0.00 32.58 31.77 1jmi s HIS 18 CO 0.42 0.47 1.19 0.12 -0.85 0.00 0.00 174.74 176.09 1jmi s PHE 19 N -1.35 3.45 -0.10 1.40 2.19 -1.26 -0.57 117.98 121.74 1jmi s PHE 19 Ca 0.25 1.32 -0.06 0.00 0.33 0.00 0.00 56.93 58.77 1jmi s PHE 19 Cb -0.11 -3.41 0.04 0.00 -1.31 0.00 0.00 43.02 38.22 1jmi s PHE 19 CO 0.17 -1.23 0.24 0.21 1.83 0.00 0.00 175.22 176.44 1jmi s LYS 20 N 0.95 0.23 0.48 10.12 2.20 0.27 -4.94 119.74 129.04 1jmi s LYS 20 Ca 0.58 0.44 -0.16 0.00 -0.36 0.00 0.00 55.97 56.47 1jmi s LYS 20 Cb -0.29 -0.02 -0.08 0.00 -1.51 0.00 0.00 37.83 35.92 1jmi s LYS 20 CO 0.30 -0.11 0.94 -1.25 -0.36 0.00 0.00 175.35 174.86 1jmi s PRO 21 N 0.81 3.95 0.19 4.03 0.04 -1.26 -1.80 135.00 140.96 1jmi s PRO 21 Ca -0.06 0.88 0.02 0.00 0.04 0.00 0.00 61.00 61.89 1jmi s PRO 21 Cb -0.07 -2.19 -0.01 0.00 0.04 0.00 0.00 34.50 32.27 1jmi s PRO 21 CO -0.05 -0.19 0.08 -0.40 0.04 0.00 0.00 177.00 176.48 1jmi n ASP 22 N -1.38 0.79 0.00 6.66 5.75 -1.25 -4.95 116.55 122.18 1jmi n ASP 22 Ca 0.06 -2.03 0.00 0.00 -0.01 0.00 0.00 54.79 52.81 1jmi n ASP 22 Cb 0.54 0.55 0.00 0.00 -1.03 0.00 0.00 41.12 41.18 1jmi n ASP 22 CO 0.00 0.00 0.00 -1.14 -0.11 0.00 0.00 177.20 175.95 1jmi n ARG 23 N -0.41 0.00 -1.74 0.11 0.63 -1.26 -4.37 116.66 109.62 1jmi n ARG 23 Ca -0.01 0.30 -0.42 0.00 -0.92 0.00 0.00 57.85 56.80 1jmi n ARG 23 Cb 0.29 -1.09 -0.01 0.00 0.45 0.00 0.00 32.46 32.10 1jmi n ARG 23 CO 0.00 0.00 0.00 0.25 -2.51 0.00 0.00 177.63 175.37 1jmi n THR 24 N -1.03 1.81 -0.58 5.15 -2.24 -1.26 -4.84 114.28 111.29 1jmi n THR 24 Ca 0.00 -0.45 -0.04 0.00 -2.27 0.00 0.00 64.05 61.29 1jmi n THR 24 Cb 0.00 -1.83 0.01 0.00 -2.10 0.00 0.00 70.33 66.41 1jmi n THR 24 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 1jmi n HIS 25 N 0.71 0.33 -3.18 4.78 8.25 -1.14 -4.82 115.22 120.15 1jmi n HIS 25 Ca 0.04 -1.20 -0.21 0.00 -0.26 0.00 0.00 57.72 56.09 1jmi n HIS 25 Cb 0.37 -0.60 0.05 0.00 1.12 0.00 0.00 29.99 30.94 1jmi n HIS 25 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 1jmi s THR 26 N -0.49 2.08 0.37 1.59 2.01 -1.26 -5.00 115.64 114.94 1jmi s THR 26 Ca 0.07 -1.09 0.07 0.00 0.31 0.00 0.00 61.69 61.05 1jmi s THR 26 Cb 0.05 -2.16 -0.02 0.00 0.01 0.00 0.00 72.50 70.38 1jmi s THR 26 CO -0.00 0.00 0.39 -0.83 -0.69 0.00 0.00 174.62 173.49 1jmi s GLY 27 N -4.59 1.88 -0.01 4.40 0.00 -1.26 -3.91 107.32 103.83 1jmi s GLY 27 Ca 0.57 -1.69 -0.08 0.00 0.00 0.00 0.00 44.72 43.51 1jmi s GLY 27 CO 0.36 -1.57 0.17 -0.51 0.00 0.00 0.00 173.10 171.55 1jmi s THR 28 N -2.34 0.07 -0.32 0.90 -4.23 -0.74 -1.33 115.64 107.64 1jmi s THR 28 Ca 0.46 -0.58 -0.11 0.00 -1.18 0.00 0.00 61.69 60.28 1jmi s THR 28 Cb -0.06 -0.44 -0.01 0.00 1.34 0.00 0.00 72.50 73.32 1jmi s THR 28 CO 0.29 -0.32 0.19 -0.31 -0.54 0.00 0.00 174.62 173.93 1jmi s TYR 29 N -1.20 3.20 0.04 3.99 2.02 -0.26 -0.56 117.35 124.57 1jmi s TYR 29 Ca -0.13 -0.39 0.05 0.00 -0.37 0.00 0.00 57.07 56.23 1jmi s TYR 29 Cb -0.07 -2.41 -0.02 0.00 -0.40 0.00 0.00 41.96 39.07 1jmi s TYR 29 CO 0.02 -0.40 -0.14 0.45 -1.57 0.00 0.00 175.55 173.91 1jmi s SER 30 N 1.67 1.63 0.44 2.29 0.15 0.27 -0.96 113.70 119.19 1jmi s SER 30 Ca 0.05 -0.44 0.05 0.00 0.70 0.00 0.00 55.95 56.31 1jmi s SER 30 Cb -0.17 -0.11 -0.06 0.00 -1.71 0.00 0.00 66.02 63.97 1jmi s SER 30 CO 0.08 0.04 0.01 0.27 1.20 0.00 0.00 173.24 174.84 1jmi s ILE 31 N -0.82 1.70 -0.06 6.45 -4.36 -0.63 -2.50 121.20 120.99 1jmi s ILE 31 Ca 0.02 -2.00 -0.01 0.00 -0.26 0.00 0.00 60.65 58.39 1jmi s ILE 31 Cb -0.08 -2.71 0.03 0.00 1.25 0.00 0.00 42.46 40.96 1jmi s ILE 31 CO 0.01 0.00 0.01 0.12 0.24 0.00 0.00 174.94 175.32 1jmi s PHE 32 N -2.77 0.49 0.00 1.37 5.36 -1.26 -2.31 117.98 118.86 1jmi s PHE 32 Ca 0.25 -0.05 0.00 0.00 -0.96 0.00 0.00 56.93 56.17 1jmi s PHE 32 Cb 0.07 -0.67 0.00 0.00 -0.34 0.00 0.00 43.02 42.08 1jmi s PHE 32 CO 0.13 -0.26 0.00 0.41 -1.46 0.00 0.00 175.22 174.03 1jmi n GLY 33 N 4.99 -1.82 3.64 13.12 0.00 0.14 -5.01 105.19 120.24 1jmi n GLY 33 Ca -0.10 -0.84 -0.08 0.00 0.00 0.00 0.00 46.02 45.01 1jmi n GLY 33 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1jmi s HIS 34 N 0.00 -0.39 0.01 1.61 5.04 -1.21 -4.96 115.29 115.39 1jmi s HIS 34 Ca 0.00 0.92 0.03 0.00 -1.54 0.00 0.00 55.06 54.47 1jmi s HIS 34 Cb 0.00 0.39 -0.01 0.00 0.04 0.00 0.00 32.58 33.00 1jmi s HIS 34 CO 0.00 -0.20 -0.08 -1.14 -2.34 0.00 0.00 174.74 170.98 1jmi s GLN 35 N 0.08 0.64 -0.03 2.88 0.74 -1.26 -0.42 119.66 122.29 1jmi s GLN 35 Ca 0.04 -0.39 -0.07 0.00 0.05 0.00 0.00 55.36 54.98 1jmi s GLN 35 Cb -0.05 -0.60 0.01 0.00 1.10 0.00 0.00 33.01 33.47 1jmi s GLN 35 CO -0.07 0.16 0.16 0.00 -0.55 0.00 0.00 175.29 174.98 1jmi s MET 36 N -0.48 0.36 0.00 1.67 0.23 -0.37 -4.98 119.30 115.73 1jmi s MET 36 Ca 0.01 -0.10 0.05 0.00 -1.03 0.00 0.00 55.69 54.62 1jmi s MET 36 Cb -0.04 0.16 -0.02 0.00 -1.53 0.00 0.00 34.83 33.40 1jmi s MET 36 CO -0.00 -0.07 -0.17 -0.98 -2.03 0.00 0.00 175.02 171.77 1jmi s ARG 37 N -0.71 1.28 -0.19 3.16 1.70 -1.26 -0.17 118.95 122.76 1jmi s ARG 37 Ca -0.08 -0.65 0.01 0.00 -0.47 0.00 0.00 55.73 54.54 1jmi s ARG 37 Cb -0.05 -1.26 0.02 0.00 -0.57 0.00 0.00 34.95 33.10 1jmi s ARG 37 CO 0.01 0.34 -0.17 -0.06 -1.08 0.00 0.00 175.30 174.33 1jmi s PHE 38 N -0.50 2.85 -0.56 5.89 0.40 0.49 -4.95 117.98 121.61 1jmi s PHE 38 Ca 0.06 -1.67 -0.28 0.00 -0.60 0.00 0.00 56.93 54.44 1jmi s PHE 38 Cb -0.07 -1.94 0.03 0.00 0.51 0.00 0.00 43.02 41.55 1jmi s PHE 38 CO -0.00 -0.80 1.15 0.34 0.70 0.00 0.00 175.22 176.62 1jmi s ASP 39 N 1.28 6.47 0.00 1.36 2.15 -1.26 -0.19 116.67 126.48 1jmi s ASP 39 Ca 0.03 0.12 0.09 0.00 0.43 0.00 0.00 52.55 53.23 1jmi s ASP 39 Cb -0.14 -2.54 0.54 0.00 -0.30 0.00 0.00 42.92 40.49 1jmi s ASP 39 CO -0.11 -1.41 0.97 0.18 -0.17 0.00 0.00 175.17 174.63 1jmi n LEU 40 N 8.22 0.00 0.02 -1.34 4.77 0.27 -1.92 117.00 127.02 1jmi n LEU 40 Ca 0.08 0.00 0.11 0.00 -0.03 0.00 0.00 56.01 56.18 1jmi n LEU 40 Cb 0.49 0.00 0.07 0.00 -2.33 0.00 0.00 43.42 41.64 1jmi n LEU 40 CO 0.71 0.00 0.12 -1.54 -1.33 0.00 0.00 177.39 175.34 1jmi n SER 41 N -0.83 0.64 0.02 -1.43 3.41 -1.26 -3.90 113.62 110.27 1jmi n SER 41 Ca 0.07 -0.30 0.12 0.00 -0.26 0.00 0.00 58.87 58.51 1jmi n SER 41 Cb 0.03 0.66 0.28 0.00 -0.26 0.00 0.00 64.21 64.92 1jmi n SER 41 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1jmi n LYS 42 N -1.81 0.10 0.00 4.33 4.76 -0.81 -5.03 118.16 119.71 1jmi n LYS 42 Ca 0.03 0.03 0.00 0.00 -2.87 0.00 0.00 58.31 55.50 1jmi n LYS 42 Cb 0.40 -1.57 0.00 0.00 -1.84 0.00 0.00 35.03 32.02 1jmi n LYS 42 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1jmi n GLY 43 N 1.44 2.08 3.72 0.72 0.00 -1.25 -4.88 105.19 107.01 1jmi n GLY 43 Ca 0.05 -1.63 -0.38 0.00 0.00 0.00 0.00 46.02 44.06 1jmi n GLY 43 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1jmi s PHE 44 N -1.75 3.51 -0.26 1.61 5.36 -0.35 -4.52 117.98 121.57 1jmi s PHE 44 Ca 0.00 0.91 -0.05 0.00 -0.96 0.00 0.00 56.93 56.83 1jmi s PHE 44 Cb 0.00 -2.58 -0.15 0.00 -0.34 0.00 0.00 43.02 39.95 1jmi s PHE 44 CO 0.00 0.14 2.48 -0.35 -1.46 0.00 0.00 175.22 176.04 1jmi n PRO 45 N 3.75 1.58 -3.34 10.12 -0.04 -1.26 -4.00 135.00 141.81 1jmi n PRO 45 Ca -0.06 -0.89 -0.42 0.00 -0.04 0.00 0.00 63.50 62.09 1jmi n PRO 45 Cb 0.51 -2.00 -0.09 0.00 -0.04 0.00 0.00 33.50 31.89 1jmi n PRO 45 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 1jmi s LEU 46 N 0.03 4.64 0.10 1.53 2.96 -1.26 -4.27 118.68 122.41 1jmi s LEU 46 Ca 0.44 -0.43 -0.34 0.00 -0.22 0.00 0.00 54.13 53.58 1jmi s LEU 46 Cb 0.19 -2.40 -0.18 0.00 0.50 0.00 0.00 46.19 44.29 1jmi s LEU 46 CO -0.01 -0.48 0.83 0.18 -1.32 0.00 0.00 176.35 175.55 1jmi n LEU 47 N 5.55 -0.46 -0.08 -0.68 4.77 -1.26 -4.79 117.00 120.05 1jmi n LEU 47 Ca -0.08 1.15 -0.06 0.00 -0.03 0.00 0.00 56.01 56.99 1jmi n LEU 47 Cb 0.48 -0.95 -0.16 0.00 -2.33 0.00 0.00 43.42 40.46 1jmi n LEU 47 CO 0.44 -2.35 -1.07 0.35 -1.33 0.00 0.00 177.39 173.43 1jmi n THR 48 N 0.84 1.09 1.08 -5.08 -2.24 -1.26 -4.35 114.28 104.36 1jmi n THR 48 Ca 0.19 -0.77 0.00 0.00 -2.27 0.00 0.00 64.05 61.19 1jmi n THR 48 Cb 0.17 -0.37 0.00 0.00 -2.10 0.00 0.00 70.33 68.02 1jmi n THR 48 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1jmi n THR 49 N -2.64 0.00 -3.65 4.28 -2.24 -1.26 -0.57 114.28 108.20 1jmi n THR 49 Ca -0.27 0.00 -0.02 0.00 -2.27 0.00 0.00 64.05 61.50 1jmi n THR 49 Cb 1.03 -0.23 -0.07 0.00 -2.10 0.00 0.00 70.33 68.96 1jmi n THR 49 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 1jmi s LYS 50 N -2.00 0.11 -0.16 -0.78 2.20 -1.26 -4.77 119.74 113.09 1jmi s LYS 50 Ca 0.00 0.16 -0.29 0.00 -0.36 0.00 0.00 55.97 55.47 1jmi s LYS 50 Cb 0.00 0.04 -0.02 0.00 -1.51 0.00 0.00 37.83 36.35 1jmi s LYS 50 CO 0.00 -0.02 1.30 0.21 -0.36 0.00 0.00 175.35 176.48 1jmi s LYS 51 N 0.46 4.22 -0.15 4.03 2.20 -0.96 -4.69 119.74 124.84 1jmi s LYS 51 Ca 0.01 1.71 0.01 0.00 -0.36 0.00 0.00 55.97 57.34 1jmi s LYS 51 Cb -0.04 -3.79 0.02 0.00 -1.51 0.00 0.00 37.83 32.51 1jmi s LYS 51 CO -0.13 -0.73 -0.17 0.08 -0.36 0.00 0.00 175.35 174.04 1jmi s VAL 52 N 3.56 1.81 -0.73 4.02 1.01 -1.26 -4.72 120.40 124.09 1jmi s VAL 52 Ca 0.57 -0.79 -0.24 0.00 0.00 0.00 0.00 61.98 61.51 1jmi s VAL 52 Cb -0.23 -1.65 -0.15 0.00 0.00 0.00 0.00 36.38 34.35 1jmi s VAL 52 CO 0.16 0.50 2.42 -2.65 0.00 0.00 0.00 175.10 175.53 1jmi n PRO 53 N 4.56 0.60 0.07 2.72 -0.02 -1.26 -4.83 135.00 136.83 1jmi n PRO 53 Ca -0.19 -0.33 -0.01 0.00 -2.02 0.00 0.00 63.50 60.95 1jmi n PRO 53 Cb 0.50 -3.00 0.27 0.00 -0.02 0.00 0.00 33.50 31.26 1jmi n PRO 53 CO 0.00 0.00 0.00 0.35 1.98 0.00 0.00 175.50 177.83 1jmi h PHE 54 N 15.00 0.37 -0.96 6.00 3.57 -1.99 -2.84 116.94 136.10 1jmi h PHE 54 Ca -0.09 -0.07 0.06 0.00 3.53 0.00 0.00 57.97 61.40 1jmi h PHE 54 Cb 1.16 -0.09 -0.06 0.00 2.79 0.00 0.00 35.95 39.74 1jmi h PHE 54 CO 1.11 0.56 0.61 0.78 -2.23 0.00 0.00 178.31 179.14 1jmi h GLY 55 N 1.00 1.44 1.94 2.40 0.00 -1.98 0.49 103.07 108.35 1jmi h GLY 55 Ca 0.05 -0.45 -0.09 0.00 0.00 0.00 0.00 47.33 46.83 1jmi h GLY 55 CO 0.04 0.34 -0.39 1.41 0.00 0.00 0.00 176.54 177.94 1jmi h LEU 56 N 1.14 0.07 0.04 3.11 3.38 -1.90 0.78 115.31 121.93 1jmi h LEU 56 Ca 0.40 -0.03 -0.00 0.00 0.09 0.00 0.00 57.88 58.35 1jmi h LEU 56 Cb 0.12 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 40.85 1jmi h LEU 56 CO -0.16 0.46 -0.02 0.40 0.09 0.00 0.00 178.44 179.21 1jmi h ILE 57 N 0.06 1.31 0.34 1.22 2.04 -1.10 -2.57 117.51 118.81 1jmi h ILE 57 Ca 0.00 -1.62 -0.00 0.00 1.00 0.00 0.00 64.86 64.25 1jmi h ILE 57 Cb 0.72 2.31 -0.02 0.00 -0.74 0.00 0.00 36.82 39.09 1jmi h ILE 57 CO 0.05 0.38 -0.34 0.50 0.00 0.00 0.00 178.15 178.74 1jmi h LYS 58 N -0.83 -0.68 -0.07 2.37 3.64 0.05 0.91 116.57 121.95 1jmi h LYS 58 Ca -0.01 0.05 -0.02 0.00 -1.27 0.00 0.00 60.65 59.40 1jmi h LYS 58 Cb 0.67 0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 32.64 1jmi h LYS 58 CO 0.01 -0.46 -0.07 0.66 -2.27 0.00 0.00 179.45 177.33 1jmi h SER 59 N -0.71 0.09 0.13 4.20 4.64 -0.98 -0.76 113.55 120.17 1jmi h SER 59 Ca -0.02 -0.01 -0.19 0.00 -0.47 0.00 0.00 61.79 61.10 1jmi h SER 59 Cb 0.64 -0.02 -0.00 0.00 -0.31 0.00 0.00 62.40 62.71 1jmi h SER 59 CO -0.06 0.17 -0.72 -0.08 -0.87 0.00 0.00 176.83 175.27 1jmi h GLU 60 N 0.10 0.52 -0.20 4.77 4.81 -0.98 -2.51 114.58 121.08 1jmi h GLU 60 Ca 0.02 -0.41 -0.06 0.00 -0.13 0.00 0.00 59.36 58.78 1jmi h GLU 60 Cb 0.19 0.08 -0.00 0.00 0.63 0.00 0.00 28.75 29.64 1jmi h GLU 60 CO 0.01 1.04 -0.12 1.25 -0.73 0.00 0.00 179.01 180.46 1jmi h LEU 61 N 0.36 0.46 -1.20 1.64 5.85 0.21 -2.06 115.31 120.57 1jmi h LEU 61 Ca -0.03 -0.43 0.01 0.00 0.84 0.00 0.00 57.88 58.27 1jmi h LEU 61 Cb 1.31 -0.13 -0.04 0.00 0.37 0.00 0.00 40.66 42.17 1jmi h LEU 61 CO 0.13 0.79 0.52 -0.07 -0.34 0.00 0.00 178.44 179.47 1jmi h LEU 62 N 0.13 0.92 -0.34 2.25 3.38 -1.21 -0.20 115.31 120.25 1jmi h LEU 62 Ca 0.04 -0.03 -0.01 0.00 0.09 0.00 0.00 57.88 57.97 1jmi h LEU 62 Cb 0.62 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.13 1jmi h LEU 62 CO 0.03 0.68 0.16 -0.25 0.09 0.00 0.00 178.44 179.15 1jmi h TRP 63 N 1.08 0.49 0.44 1.13 7.01 -1.36 -2.33 115.95 122.42 1jmi h TRP 63 Ca 0.29 -0.03 -0.01 0.00 2.11 0.00 0.00 58.89 61.25 1jmi h TRP 63 Cb -0.11 -0.15 -0.02 0.00 -2.10 0.00 0.00 29.16 26.78 1jmi h TRP 63 CO 0.00 0.44 -0.37 0.74 -2.79 0.00 0.00 178.44 176.46 1jmi h PHE 64 N 0.41 -0.99 -0.02 2.65 0.04 -0.55 -2.11 116.94 116.37 1jmi h PHE 64 Ca 0.12 0.00 0.01 0.00 2.80 0.00 0.00 57.97 60.89 1jmi h PHE 64 Cb 0.14 0.37 -0.00 0.00 2.20 0.00 0.00 35.95 38.66 1jmi h PHE 64 CO -0.01 -0.53 0.32 -0.07 -0.60 0.00 0.00 178.31 177.42 1jmi h LEU 65 N -0.81 0.00 -1.02 1.54 3.38 -0.94 0.22 115.31 117.68 1jmi h LEU 65 Ca -0.04 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.93 1jmi h LEU 65 Cb 0.70 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.45 1jmi h LEU 65 CO -0.02 0.00 -0.02 1.41 0.09 0.00 0.00 178.44 179.90 1jmi n HIS 66 N -2.94 0.00 -1.23 1.13 8.25 -0.81 -4.78 115.22 114.85 1jmi n HIS 66 Ca -0.02 0.00 -0.08 0.00 -0.26 0.00 0.00 57.72 57.37 1jmi n HIS 66 Cb 0.38 -0.01 -0.03 0.00 1.12 0.00 0.00 29.99 31.45 1jmi n HIS 66 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1jmi n GLY 67 N 1.20 0.86 3.76 -1.41 0.00 0.76 -4.94 105.19 105.42 1jmi n GLY 67 Ca 0.18 -0.17 -0.40 0.00 0.00 0.00 0.00 46.02 45.63 1jmi n GLY 67 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1jmi s ASP 68 N -2.44 7.22 -0.01 1.61 -1.08 -1.12 -4.38 116.67 116.48 1jmi s ASP 68 Ca 0.00 2.28 0.01 0.00 -0.52 0.00 0.00 52.55 54.32 1jmi s ASP 68 Cb 0.00 -2.62 0.02 0.00 -1.46 0.00 0.00 42.92 38.85 1jmi s ASP 68 CO 0.00 -0.19 0.79 0.35 0.52 0.00 0.00 175.17 176.64 1jmi n THR 69 N 1.37 0.54 -3.76 1.71 -2.24 -1.26 -4.50 114.28 106.14 1jmi n THR 69 Ca -0.00 -0.57 -0.36 0.00 -2.27 0.00 0.00 64.05 60.85 1jmi n THR 69 Cb 0.45 0.67 -0.11 0.00 -2.10 0.00 0.00 70.33 69.24 1jmi n THR 69 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1jmi s ASN 70 N -0.68 5.62 0.64 3.42 3.84 -1.26 -0.61 114.94 125.91 1jmi s ASN 70 Ca 0.02 -0.04 0.28 0.00 0.21 0.00 0.00 52.86 53.33 1jmi s ASN 70 Cb 0.02 -2.01 1.51 0.00 -0.55 0.00 0.00 41.25 40.22 1jmi s ASN 70 CO 0.00 0.03 1.87 0.40 -2.79 0.00 0.00 177.10 176.61 1jmi h ILE 71 N 5.26 0.12 -0.90 -5.21 2.04 -0.43 -2.52 117.51 115.87 1jmi h ILE 71 Ca -0.37 0.00 0.08 0.00 1.00 0.00 0.00 64.86 65.57 1jmi h ILE 71 Cb 1.18 0.62 -0.07 0.00 -0.74 0.00 0.00 36.82 37.81 1jmi h ILE 71 CO 0.61 0.00 0.55 -0.09 0.00 0.00 0.00 178.15 179.22 1jmi h ARG 72 N 0.00 0.94 -0.82 2.37 2.43 -1.90 -1.24 114.38 116.16 1jmi h ARG 72 Ca 0.07 -0.06 0.03 0.00 -0.81 0.00 0.00 59.98 59.21 1jmi h ARG 72 Cb 0.89 -0.21 -0.05 0.00 -0.42 0.00 0.00 29.97 30.18 1jmi h ARG 72 CO -0.00 0.62 0.53 0.35 -1.51 0.00 0.00 179.97 179.96 1jmi h PHE 73 N 0.97 1.00 0.40 2.20 3.57 -1.85 -1.07 116.94 122.15 1jmi h PHE 73 Ca 0.41 0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.91 1jmi h PHE 73 Cb 0.26 -0.33 0.00 0.00 2.79 0.00 0.00 35.95 38.67 1jmi h PHE 73 CO -0.03 0.59 -0.19 -0.07 -2.23 0.00 0.00 178.31 176.38 1jmi h LEU 74 N 1.05 -0.45 -1.46 0.59 3.38 -1.45 -2.89 115.31 114.07 1jmi h LEU 74 Ca 0.32 -0.10 0.17 0.00 0.09 0.00 0.00 57.88 58.36 1jmi h LEU 74 Cb -0.03 0.12 -0.06 0.00 0.09 0.00 0.00 40.66 40.77 1jmi h LEU 74 CO -0.10 -0.14 0.57 -0.07 0.09 0.00 0.00 178.44 178.78 1jmi h LEU 75 N -0.77 0.47 -1.80 1.67 3.38 -1.09 0.42 115.31 117.58 1jmi h LEU 75 Ca -0.05 0.04 0.04 0.00 0.09 0.00 0.00 57.88 58.00 1jmi h LEU 75 Cb 0.53 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 41.21 1jmi h LEU 75 CO 0.09 0.21 0.22 1.56 0.09 0.00 0.00 178.44 180.61 1jmi h GLN 76 N 0.48 0.25 -0.53 1.13 4.20 -0.99 -0.84 115.11 118.82 1jmi h GLN 76 Ca 0.44 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 59.13 1jmi h GLN 76 Cb 0.97 -0.06 0.00 0.00 0.30 0.00 0.00 27.48 28.69 1jmi h GLN 76 CO -0.17 0.17 0.00 0.72 -0.67 0.00 0.00 178.83 178.87 1jmi n HIS 77 N -4.49 1.48 -2.01 2.96 8.25 0.14 -4.94 115.22 116.61 1jmi n HIS 77 Ca 0.03 -0.69 -0.15 0.00 -0.26 0.00 0.00 57.72 56.65 1jmi n HIS 77 Cb 0.21 -0.32 -0.02 0.00 1.12 0.00 0.00 29.99 30.97 1jmi n HIS 77 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 1jmi n ARG 78 N 0.60 -1.12 -3.56 -0.41 1.74 -0.32 -4.98 116.66 108.61 1jmi n ARG 78 Ca 0.24 0.80 -0.40 0.00 -0.77 0.00 0.00 57.85 57.73 1jmi n ARG 78 Cb 0.95 -5.06 -0.11 0.00 -1.02 0.00 0.00 32.46 27.22 1jmi n ARG 78 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 1jmi s ASN 79 N -2.50 5.96 -0.12 0.55 3.84 -0.65 -4.92 114.94 117.11 1jmi s ASN 79 Ca 0.00 -0.42 0.15 0.00 0.21 0.00 0.00 52.86 52.80 1jmi s ASN 79 Cb 0.00 -2.11 0.50 0.00 -0.55 0.00 0.00 41.25 39.09 1jmi s ASN 79 CO 0.00 -0.22 1.41 1.41 -2.79 0.00 0.00 177.10 176.91 1jmi n HIS 80 N 5.08 0.92 0.24 0.43 8.25 -1.26 -3.49 115.22 125.39 1jmi n HIS 80 Ca -0.13 -0.73 0.18 0.00 -0.26 0.00 0.00 57.72 56.78 1jmi n HIS 80 Cb 0.50 -0.23 0.88 0.00 1.12 0.00 0.00 29.99 32.25 1jmi n HIS 80 CO 0.00 0.00 0.00 0.82 0.64 0.00 0.00 176.34 177.80 1jmi h ILE 81 N 2.21 0.35 -0.01 1.59 2.04 -1.98 -2.93 117.51 118.79 1jmi h ILE 81 Ca 0.00 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.86 1jmi h ILE 81 Cb 1.26 0.84 0.00 0.00 -0.74 0.00 0.00 36.82 38.18 1jmi h ILE 81 CO 0.17 0.00 0.00 0.79 0.00 0.00 0.00 178.15 179.11 1jmi n TRP 82 N -3.60 0.01 -0.01 1.37 7.02 -1.26 -4.82 117.44 116.15 1jmi n TRP 82 Ca 0.01 -0.02 -0.13 0.00 -1.02 0.00 0.00 57.50 56.34 1jmi n TRP 82 Cb 0.30 -0.00 -0.07 0.00 -2.42 0.00 0.00 31.31 29.12 1jmi n TRP 82 CO 0.00 0.00 0.00 -0.44 -2.02 0.00 0.00 177.69 175.23 1jmi h ASP 83 N 1.28 -1.42 -0.05 -0.99 3.32 -1.85 -2.78 116.42 113.93 1jmi h ASP 83 Ca 0.00 0.18 0.02 0.00 0.02 0.00 0.00 57.03 57.25 1jmi h ASP 83 Cb 0.28 0.57 -0.00 0.00 0.22 0.00 0.00 39.33 40.41 1jmi h ASP 83 CO 0.00 -0.44 0.63 1.05 -1.72 0.00 0.00 179.24 178.76 1jmi h GLU 84 N -0.51 0.00 0.05 3.56 4.11 -1.87 0.19 114.58 120.11 1jmi h GLU 84 Ca 0.07 0.00 -0.21 0.00 0.07 0.00 0.00 59.36 59.29 1jmi h GLU 84 Cb 0.64 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.91 1jmi h GLU 84 CO -0.42 0.00 -0.86 -1.49 0.07 0.00 0.00 179.01 176.31 1jmi h TRP 85 N 0.00 0.78 -0.13 2.06 4.06 -1.87 -1.85 115.95 119.00 1jmi h TRP 85 Ca 0.03 -0.46 -0.18 0.00 2.06 0.00 0.00 58.89 60.34 1jmi h TRP 85 Cb 1.28 -0.08 -0.00 0.00 -1.00 0.00 0.00 29.16 29.36 1jmi h TRP 85 CO 0.00 1.30 -0.66 0.00 -3.56 0.00 0.00 178.44 175.52 1jmi h ALA 86 N 0.30 0.61 -0.26 1.49 0.00 -0.79 -3.16 119.26 117.45 1jmi h ALA 86 Ca -0.12 -0.56 -0.03 0.00 0.00 0.00 0.00 54.91 54.20 1jmi h ALA 86 Cb 1.57 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 19.29 1jmi h ALA 86 CO 0.17 0.72 0.06 0.35 0.00 0.00 0.00 179.25 180.55 1jmi h PHE 87 N 0.37 0.44 -0.82 0.00 3.04 -1.32 -1.31 116.94 117.34 1jmi h PHE 87 Ca -0.02 -0.05 0.19 0.00 3.98 0.00 0.00 57.97 62.07 1jmi h PHE 87 Cb 1.22 -0.12 -0.12 0.00 2.56 0.00 0.00 35.95 39.49 1jmi h PHE 87 CO 0.05 0.50 0.27 1.49 -2.02 0.00 0.00 178.31 178.60 1jmi h GLU 88 N 0.24 0.32 -0.16 1.11 4.81 -1.30 -0.07 114.58 119.53 1jmi h GLU 88 Ca 0.08 -0.02 -0.18 0.00 -0.13 0.00 0.00 59.36 59.11 1jmi h GLU 88 Cb 0.28 -0.07 -0.00 0.00 0.63 0.00 0.00 28.75 29.59 1jmi h GLU 88 CO 0.00 0.21 -0.64 0.87 -0.73 0.00 0.00 179.01 178.72 1jmi h LYS 89 N 0.33 0.57 0.13 1.92 1.79 -1.47 -2.90 116.57 116.93 1jmi h LYS 89 Ca 0.49 -0.40 0.00 0.00 -2.18 0.00 0.00 60.65 58.55 1jmi h LYS 89 Cb 0.88 0.06 -0.01 0.00 -1.58 0.00 0.00 32.23 31.58 1jmi h LYS 89 CO -0.53 1.02 -0.11 2.35 -1.08 0.00 0.00 179.45 181.10 1jmi h TRP 90 N 0.42 -0.30 -0.95 -1.35 -0.00 0.12 -2.65 115.95 111.23 1jmi h TRP 90 Ca -0.01 0.00 0.09 0.00 -0.00 0.00 0.00 58.89 58.97 1jmi h TRP 90 Cb 1.21 0.11 -0.07 0.00 -0.00 0.00 0.00 29.16 30.41 1jmi h TRP 90 CO 0.05 -0.18 0.59 0.28 -0.00 0.00 0.00 178.44 179.19 1jmi h VAL 91 N -0.26 0.99 -0.11 2.65 2.07 -1.17 -1.45 116.25 118.97 1jmi h VAL 91 Ca 0.00 -0.35 -0.01 0.00 0.82 0.00 0.00 66.70 67.16 1jmi h VAL 91 Cb 0.24 -0.11 -0.01 0.00 -1.52 0.00 0.00 31.29 29.90 1jmi h VAL 91 CO -0.02 0.18 0.02 2.29 0.02 0.00 0.00 177.57 180.06 1jmi n LYS 92 N -4.61 1.59 -4.27 1.57 2.85 -1.01 -4.84 118.16 109.44 1jmi n LYS 92 Ca 0.16 -0.52 -0.29 0.00 -1.05 0.00 0.00 58.31 56.61 1jmi n LYS 92 Cb 0.26 -1.57 -0.10 0.00 -0.65 0.00 0.00 35.03 32.97 1jmi n LYS 92 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 177.40 175.81 1jmi s SER 93 N -0.02 4.21 0.37 -5.58 1.04 -0.55 -5.02 113.70 108.14 1jmi s SER 93 Ca 0.09 -0.50 0.12 0.00 0.48 0.00 0.00 55.95 56.15 1jmi s SER 93 Cb 0.07 -0.72 0.93 0.00 0.10 0.00 0.00 66.02 66.40 1jmi s SER 93 CO 0.03 0.15 1.81 0.44 0.98 0.00 0.00 173.24 176.65 1jmi h ASP 94 N 3.42 0.58 0.78 7.02 5.19 -1.90 -1.80 116.42 129.72 1jmi h ASP 94 Ca -0.48 0.07 -0.08 0.00 -0.62 0.00 0.00 57.03 55.91 1jmi h ASP 94 Cb 1.18 -0.04 -0.01 0.00 0.18 0.00 0.00 39.33 40.64 1jmi h ASP 94 CO 0.51 0.21 -0.38 -0.33 -3.12 0.00 0.00 179.24 176.14 1jmi h GLU 95 N 0.57 0.00 -6.23 3.56 4.39 -1.95 -3.44 114.58 111.48 1jmi h GLU 95 Ca 0.53 0.00 -0.56 0.00 0.34 0.00 0.00 59.36 59.67 1jmi h GLU 95 Cb 1.07 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.71 1jmi h GLU 95 CO -0.27 0.38 1.23 -0.47 -1.16 0.00 0.00 179.01 178.71 1jmi s TYR 96 N -3.67 1.73 -0.61 4.33 5.04 -0.68 -4.90 117.35 118.59 1jmi s TYR 96 Ca -0.00 0.33 0.05 0.00 -2.44 0.00 0.00 57.07 55.01 1jmi s TYR 96 Cb 0.11 -4.03 0.20 0.00 0.35 0.00 0.00 41.96 38.60 1jmi s TYR 96 CO 0.69 -3.75 0.56 0.72 -1.34 0.00 0.00 175.55 172.43 1jmi n HIS 97 N 8.94 2.38 -3.68 4.97 8.25 -1.26 -4.95 115.22 129.87 1jmi n HIS 97 Ca 0.21 -4.04 -0.08 0.00 -0.26 0.00 0.00 57.72 53.56 1jmi n HIS 97 Cb 0.44 -0.44 0.00 0.00 1.12 0.00 0.00 29.99 31.11 1jmi n HIS 97 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1jmi n GLY 98 N 1.68 1.80 3.50 -1.41 0.00 -1.26 -5.09 105.19 104.41 1jmi n GLY 98 Ca 0.25 -1.33 -0.42 0.00 0.00 0.00 0.00 46.02 44.52 1jmi n GLY 98 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1jmi n PRO 99 N -0.37 0.65 -1.34 1.61 -0.02 -1.26 -4.76 135.00 129.51 1jmi n PRO 99 Ca -0.03 0.06 -0.54 0.00 -2.02 0.00 0.00 63.50 60.98 1jmi n PRO 99 Cb 0.39 -2.48 -0.12 0.00 -0.02 0.00 0.00 33.50 31.27 1jmi n PRO 99 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 1jmi n ASP 100 N 12.42 0.77 -3.56 2.55 2.03 -1.26 -4.85 116.55 124.65 1jmi n ASP 100 Ca 0.49 0.50 -0.40 0.00 0.52 0.00 0.00 54.79 55.89 1jmi n ASP 100 Cb 0.28 -0.95 0.00 0.00 -0.72 0.00 0.00 41.12 39.73 1jmi n ASP 100 CO 0.00 0.00 0.00 0.23 -1.92 0.00 0.00 177.20 175.51 1jmi n MET 101 N 7.86 4.81 -2.52 -0.67 2.81 -1.26 -4.99 117.12 123.16 1jmi n MET 101 Ca 0.56 -3.85 -0.41 0.00 -1.81 0.00 0.00 57.70 52.20 1jmi n MET 101 Cb 0.01 -2.59 -0.04 0.00 -0.71 0.00 0.00 33.22 29.89 1jmi n MET 101 CO 0.00 0.00 0.00 0.99 1.51 0.00 0.00 175.97 178.47 1jmi s THR 102 N -2.06 3.75 -0.65 2.03 2.01 -1.26 -3.60 115.64 115.85 1jmi s THR 102 Ca 0.48 1.60 -0.08 0.00 0.31 0.00 0.00 61.69 64.00 1jmi s THR 102 Cb 0.18 -4.02 0.08 0.00 0.01 0.00 0.00 72.50 68.75 1jmi s THR 102 CO -0.10 0.32 0.21 -0.67 -0.69 0.00 0.00 174.62 173.69 1jmi n ASP 103 N 1.92 -1.25 -0.46 3.53 2.03 -1.26 -4.73 116.55 116.32 1jmi n ASP 103 Ca 0.01 -0.12 0.38 0.00 0.52 0.00 0.00 54.79 55.58 1jmi n ASP 103 Cb 0.46 -1.17 0.69 0.00 -0.72 0.00 0.00 41.12 40.37 1jmi n ASP 103 CO 0.00 0.00 0.00 2.19 -1.92 0.00 0.00 177.20 177.47 1jmi h PHE 104 N -0.30 0.34 0.11 -0.67 -0.00 -1.92 -1.44 116.94 113.05 1jmi h PHE 104 Ca -0.21 0.01 0.01 0.00 -0.00 0.00 0.00 57.97 57.79 1jmi h PHE 104 Cb 1.10 -0.09 -0.05 0.00 -0.00 0.00 0.00 35.95 36.92 1jmi h PHE 104 CO 0.80 -0.09 -0.52 0.78 -0.00 0.00 0.00 178.31 179.28 1jmi h GLY 105 N 0.09 -1.12 0.86 6.09 0.00 -1.91 -1.46 103.07 105.62 1jmi h GLY 105 Ca 0.77 0.63 -0.05 0.00 0.00 0.00 0.00 47.33 48.68 1jmi h GLY 105 CO -0.24 -0.26 -0.04 0.45 0.00 0.00 0.00 176.54 176.44 1jmi h HIS 106 N -0.74 0.55 0.00 5.60 3.86 -1.64 -3.16 115.15 119.62 1jmi h HIS 106 Ca 0.00 -0.11 0.00 0.00 -1.16 0.00 0.00 60.37 59.10 1jmi h HIS 106 Cb 0.75 -0.14 0.00 0.00 1.06 0.00 0.00 27.41 29.08 1jmi h HIS 106 CO -0.45 0.69 0.00 0.54 0.86 0.00 0.00 177.93 179.56 1jmi n ARG 107 N -4.56 0.40 0.00 2.45 1.74 -0.83 -1.57 116.66 114.29 1jmi n ARG 107 Ca -0.03 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.05 1jmi n ARG 107 Cb 0.28 -1.12 0.00 0.00 -1.02 0.00 0.00 32.46 30.61 1jmi n ARG 107 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 1jmi n SER 108 N -0.03 2.82 0.24 0.55 7.64 -0.59 -4.29 113.62 119.96 1jmi n SER 108 Ca 0.00 0.00 0.12 0.00 1.01 0.00 0.00 58.87 60.00 1jmi n SER 108 Cb 0.06 0.00 0.57 0.00 -1.01 0.00 0.00 64.21 63.83 1jmi n SER 108 CO 0.00 0.00 0.00 1.56 -3.01 0.00 0.00 175.04 173.59 1jmi h GLN 109 N 0.00 0.00 -7.57 1.43 1.08 -1.49 -3.44 115.11 105.11 1jmi h GLN 109 Ca 0.00 0.00 -0.46 0.00 -1.45 0.00 0.00 58.65 56.74 1jmi h GLN 109 Cb 0.85 0.00 0.13 0.00 -0.05 0.00 0.00 27.48 28.42 1jmi h GLN 109 CO 0.00 0.16 0.34 0.21 -0.95 0.00 0.00 178.83 178.59 1jmi s LYS 110 N -3.77 1.14 0.31 1.46 2.20 -0.61 -5.00 119.74 115.46 1jmi s LYS 110 Ca -0.00 0.11 0.01 0.00 -0.36 0.00 0.00 55.97 55.72 1jmi s LYS 110 Cb 0.11 -1.86 0.53 0.00 -1.51 0.00 0.00 37.83 35.10 1jmi s LYS 110 CO 0.60 -2.16 1.93 0.38 -0.36 0.00 0.00 175.35 175.74 1jmi h ASP 111 N -1.47 0.89 -3.83 1.43 3.04 -1.90 -3.45 116.42 111.13 1jmi h ASP 111 Ca -0.48 -0.00 -0.56 0.00 -3.24 0.00 0.00 57.03 52.75 1jmi h ASP 111 Cb 1.31 -0.20 0.13 0.00 -1.04 0.00 0.00 39.33 39.54 1jmi h ASP 111 CO 0.58 0.59 0.55 -2.65 -2.04 0.00 0.00 179.24 176.27 1jmi n PRO 112 N -4.47 1.80 -1.68 4.15 -0.02 -1.26 -4.84 135.00 128.69 1jmi n PRO 112 Ca 0.12 0.65 -0.36 0.00 -2.02 0.00 0.00 63.50 61.90 1jmi n PRO 112 Cb 0.16 -2.50 -0.03 0.00 -0.02 0.00 0.00 33.50 31.11 1jmi n PRO 112 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 1jmi n GLU 113 N -0.54 3.89 0.01 -0.52 2.13 -1.26 -4.23 120.64 120.11 1jmi n GLU 113 Ca 0.09 -2.81 -0.18 0.00 0.66 0.00 0.00 57.16 54.91 1jmi n GLU 113 Cb 0.43 -2.56 -0.08 0.00 0.27 0.00 0.00 31.44 29.49 1jmi n GLU 113 CO 0.00 0.00 0.00 0.35 -0.41 0.00 0.00 177.13 177.07 1jmi h PHE 114 N 4.36 1.04 -0.44 4.31 3.57 -1.89 -3.11 116.94 124.78 1jmi h PHE 114 Ca 0.67 -0.51 0.13 0.00 3.53 0.00 0.00 57.97 61.79 1jmi h PHE 114 Cb 0.44 -0.14 -0.02 0.00 2.79 0.00 0.00 35.95 39.02 1jmi h PHE 114 CO 1.67 1.34 0.50 0.00 -2.23 0.00 0.00 178.31 179.60 1jmi h ALA 115 N 0.50 2.15 0.34 2.41 0.00 -1.75 0.15 119.26 123.06 1jmi h ALA 115 Ca -0.09 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.79 1jmi h ALA 115 Cb 1.54 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.36 1jmi h ALA 115 CO 0.18 -0.73 -0.16 0.00 0.00 0.00 0.00 179.25 178.53 1jmi h ALA 116 N 1.41 -0.46 0.00 0.00 0.00 -1.89 -1.53 119.26 116.80 1jmi h ALA 116 Ca 0.21 -0.18 -0.08 0.00 0.00 0.00 0.00 54.91 54.87 1jmi h ALA 116 Cb 1.22 0.18 -0.01 0.00 0.00 0.00 0.00 17.79 19.17 1jmi h ALA 116 CO -0.00 -0.62 -0.37 -0.24 0.00 0.00 0.00 179.25 178.02 1jmi h VAL 117 N -0.74 0.78 0.84 0.00 3.04 -1.36 -3.21 116.25 115.60 1jmi h VAL 117 Ca -0.05 -1.60 -0.04 0.00 -1.01 0.00 0.00 66.70 64.00 1jmi h VAL 117 Cb 0.50 2.02 0.01 0.00 -2.01 0.00 0.00 31.29 31.81 1jmi h VAL 117 CO 0.08 0.36 -0.40 0.22 -1.01 0.00 0.00 177.57 176.82 1jmi h TYR 118 N 0.00 -1.04 -0.04 3.17 3.20 -0.66 -1.84 116.97 119.76 1jmi h TYR 118 Ca -0.00 -0.02 0.01 0.00 3.14 0.00 0.00 58.73 61.85 1jmi h TYR 118 Cb 0.99 0.34 -0.00 0.00 1.54 0.00 0.00 36.73 39.61 1jmi h TYR 118 CO 0.00 -0.64 0.03 0.45 -1.64 0.00 0.00 178.16 176.36 1jmi h HIS 119 N -1.17 0.00 0.08 -3.82 3.86 -1.32 0.10 115.15 112.88 1jmi h HIS 119 Ca -0.11 0.00 -0.25 0.00 -1.16 0.00 0.00 60.37 58.84 1jmi h HIS 119 Cb 0.87 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 29.33 1jmi h HIS 119 CO -0.01 0.00 -1.14 1.49 0.86 0.00 0.00 177.93 179.13 1jmi h GLU 120 N 0.00 0.21 -0.31 2.45 4.81 -1.55 -1.35 114.58 118.85 1jmi h GLU 120 Ca 0.02 -0.34 -0.15 0.00 -0.13 0.00 0.00 59.36 58.76 1jmi h GLU 120 Cb 0.08 0.12 -0.01 0.00 0.63 0.00 0.00 28.75 29.57 1jmi h GLU 120 CO -0.00 1.14 -0.42 0.93 -0.73 0.00 0.00 179.01 179.93 1jmi h GLU 121 N 0.07 0.78 -0.51 1.92 4.39 -0.48 -1.82 114.58 118.93 1jmi h GLU 121 Ca -0.10 -0.42 -0.05 0.00 0.34 0.00 0.00 59.36 59.13 1jmi h GLU 121 Cb 1.87 0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 30.52 1jmi h GLU 121 CO 0.18 1.05 0.12 1.98 -1.16 0.00 0.00 179.01 181.18 1jmi h MET 122 N 0.63 0.82 -0.70 2.33 4.05 -0.84 -1.03 114.93 120.20 1jmi h MET 122 Ca 0.05 -0.20 0.04 0.00 -0.28 0.00 0.00 59.70 59.30 1jmi h MET 122 Cb 0.99 -0.11 -0.04 0.00 -0.80 0.00 0.00 31.60 31.64 1jmi h MET 122 CO 0.09 0.79 0.46 0.00 0.23 0.00 0.00 176.91 178.49 1jmi h ALA 123 N 0.99 1.62 0.05 0.39 0.00 -1.00 0.13 119.26 121.44 1jmi h ALA 123 Ca 0.16 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 1jmi h ALA 123 Cb 0.34 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.90 1jmi h ALA 123 CO 0.00 0.30 -0.02 0.87 0.00 0.00 0.00 179.25 180.40 1jmi h LYS 124 N 0.83 -0.07 -0.07 0.00 1.57 -0.71 -2.10 116.57 116.03 1jmi h LYS 124 Ca 0.28 0.00 0.04 0.00 -1.87 0.00 0.00 60.65 59.11 1jmi h LYS 124 Cb 0.09 0.01 -0.06 0.00 0.08 0.00 0.00 32.23 32.36 1jmi h LYS 124 CO -0.08 0.30 -0.30 0.35 -0.57 0.00 0.00 179.45 179.15 1jmi h PHE 125 N -0.44 -0.82 -0.92 -1.35 3.57 -0.51 0.31 116.94 116.77 1jmi h PHE 125 Ca -0.01 0.03 0.14 0.00 3.53 0.00 0.00 57.97 61.67 1jmi h PHE 125 Cb 0.40 0.37 -0.08 0.00 2.79 0.00 0.00 35.95 39.44 1jmi h PHE 125 CO 0.05 -0.39 0.59 -0.44 -2.23 0.00 0.00 178.31 175.90 1jmi h ASP 126 N -0.41 0.71 0.17 0.41 5.19 -0.78 -0.02 116.42 121.68 1jmi h ASP 126 Ca 0.08 0.05 -0.19 0.00 -0.62 0.00 0.00 57.03 56.35 1jmi h ASP 126 Cb 0.53 -0.09 -0.00 0.00 0.18 0.00 0.00 39.33 39.94 1jmi h ASP 126 CO -0.30 0.35 -0.71 -0.78 -3.12 0.00 0.00 179.24 174.68 1jmi h ASP 127 N 0.75 0.57 -0.10 6.45 1.82 -0.51 -1.09 116.42 124.30 1jmi h ASP 127 Ca 0.47 -0.36 -0.01 0.00 -0.39 0.00 0.00 57.03 56.74 1jmi h ASP 127 Cb 0.70 -0.17 -0.00 0.00 0.68 0.00 0.00 39.33 40.54 1jmi h ASP 127 CO -0.23 1.10 0.04 0.03 -1.61 0.00 0.00 179.24 178.57 1jmi h ARG 128 N 0.33 0.15 -0.85 0.28 2.47 0.49 -1.01 114.38 116.25 1jmi h ARG 128 Ca -0.03 -0.03 0.02 0.00 -1.26 0.00 0.00 59.98 58.68 1jmi h ARG 128 Cb 1.29 -0.02 -0.05 0.00 -1.65 0.00 0.00 29.97 29.54 1jmi h ARG 128 CO 0.13 0.27 0.55 0.28 0.56 0.00 0.00 179.97 181.76 1jmi h VAL 129 N 0.00 1.18 0.00 2.04 2.07 -1.01 0.32 116.25 120.86 1jmi h VAL 129 Ca 0.03 -0.38 -0.05 0.00 0.82 0.00 0.00 66.70 67.12 1jmi h VAL 129 Cb 0.18 -0.02 -0.01 0.00 -1.52 0.00 0.00 31.29 29.92 1jmi h VAL 129 CO -0.00 0.20 -0.23 -0.07 0.02 0.00 0.00 177.57 177.49 1jmi h LEU 130 N 1.11 0.00 0.00 2.57 3.38 -0.92 -3.38 115.31 118.07 1jmi h LEU 130 Ca 0.32 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.28 1jmi h LEU 130 Cb -0.08 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.67 1jmi h LEU 130 CO -0.09 0.23 -1.08 1.41 0.09 0.00 0.00 178.44 179.00 1jmi n HIS 131 N -3.48 0.00 -3.65 1.13 8.25 -0.41 -4.97 115.22 112.10 1jmi n HIS 131 Ca -0.00 0.00 -0.39 0.00 -0.26 0.00 0.00 57.72 57.06 1jmi n HIS 131 Cb 0.40 -0.05 -0.10 0.00 1.12 0.00 0.00 29.99 31.35 1jmi n HIS 131 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1jmi s ASP 132 N -2.75 5.53 0.24 0.41 2.15 0.11 -4.99 116.67 117.36 1jmi s ASP 132 Ca -0.01 -1.63 -0.06 0.00 0.43 0.00 0.00 52.55 51.29 1jmi s ASP 132 Cb 0.01 -1.95 0.42 0.00 -0.30 0.00 0.00 42.92 41.10 1jmi s ASP 132 CO 0.06 -0.54 1.69 0.44 -0.17 0.00 0.00 175.17 176.65 1jmi h ASP 133 N 8.33 -0.00 -0.89 -0.34 3.32 -1.86 0.54 116.42 125.52 1jmi h ASP 133 Ca -0.21 0.14 -0.00 0.00 0.02 0.00 0.00 57.03 56.98 1jmi h ASP 133 Cb 1.07 0.19 -0.04 0.00 0.22 0.00 0.00 39.33 40.77 1jmi h ASP 133 CO 0.75 -0.03 0.55 0.00 -1.72 0.00 0.00 179.24 178.78 1jmi h ALA 134 N 1.58 1.29 -0.05 3.45 0.00 -1.95 0.27 119.26 123.85 1jmi h ALA 134 Ca 0.39 -0.09 -0.03 0.00 0.00 0.00 0.00 54.91 55.18 1jmi h ALA 134 Cb 0.65 -0.36 -0.00 0.00 0.00 0.00 0.00 17.79 18.08 1jmi h ALA 134 CO -0.49 0.62 -0.08 0.35 0.00 0.00 0.00 179.25 179.65 1jmi h PHE 135 N 1.22 0.18 -0.48 0.00 3.57 -1.50 -2.04 116.94 117.90 1jmi h PHE 135 Ca 0.32 -0.06 0.09 0.00 3.53 0.00 0.00 57.97 61.85 1jmi h PHE 135 Cb -0.07 -0.04 -0.07 0.00 2.79 0.00 0.00 35.95 38.56 1jmi h PHE 135 CO 0.00 0.64 0.03 0.00 -2.23 0.00 0.00 178.31 176.75 1jmi h ALA 136 N 0.51 0.48 0.00 2.41 0.00 -0.74 0.73 119.26 122.65 1jmi h ALA 136 Ca 0.01 0.13 -0.05 0.00 0.00 0.00 0.00 54.91 55.00 1jmi h ALA 136 Cb 0.62 0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.61 1jmi h ALA 136 CO 0.02 -0.36 -0.23 0.00 0.00 0.00 0.00 179.25 178.68 1jmi h ALA 137 N 1.41 1.49 0.00 0.00 0.00 -0.93 0.51 119.26 121.74 1jmi h ALA 137 Ca 0.24 -0.21 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 1jmi h ALA 137 Cb 0.35 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.10 1jmi h ALA 137 CO -0.37 0.28 -0.15 -0.22 0.00 0.00 0.00 179.25 178.79 1jmi h LYS 138 N 0.00 0.00 0.00 0.00 3.64 -0.20 -3.40 116.57 116.61 1jmi h LYS 138 Ca -0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1jmi h LYS 138 Cb 0.44 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.26 1jmi h LYS 138 CO 0.03 0.73 -1.16 0.66 -2.27 0.00 0.00 179.45 177.44 1jmi n TYR 139 N -4.63 0.00 0.31 1.91 4.01 0.04 -4.61 117.16 114.19 1jmi n TYR 139 Ca -0.10 0.00 0.15 0.00 -0.16 0.00 0.00 57.90 57.80 1jmi n TYR 139 Cb 0.38 -0.13 0.58 0.00 -0.31 0.00 0.00 39.34 39.87 1jmi n TYR 139 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 1jmi h GLY 140 N 1.21 0.00 -7.28 2.72 0.00 0.04 -3.43 103.07 96.33 1jmi h GLY 140 Ca 0.00 0.00 -0.63 0.00 0.00 0.00 0.00 47.33 46.70 1jmi h GLY 140 CO 0.00 0.00 -0.32 -0.35 0.00 0.00 0.00 176.54 175.87 1jmi s ASP 141 N -5.40 6.21 0.08 0.19 2.15 -1.01 0.40 116.67 119.28 1jmi s ASP 141 Ca 0.03 0.23 0.03 0.00 0.43 0.00 0.00 52.55 53.27 1jmi s ASP 141 Cb 0.09 -2.18 -0.24 0.00 -0.30 0.00 0.00 42.92 40.28 1jmi s ASP 141 CO 0.53 -0.11 1.12 -0.07 -0.17 0.00 0.00 175.17 176.47 1jmi h LEU 142 N 8.29 0.17 0.00 -1.34 3.38 -1.12 -3.49 115.31 121.21 1jmi h LEU 142 Ca -0.34 -0.20 0.00 0.00 0.09 0.00 0.00 57.88 57.43 1jmi h LEU 142 Cb 1.17 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.86 1jmi h LEU 142 CO 0.63 1.16 0.00 0.61 0.09 0.00 0.00 178.44 180.94 1jmi n GLY 143 N 1.47 1.85 2.96 0.83 0.00 -1.26 -4.73 105.19 106.31 1jmi n GLY 143 Ca -0.06 -0.27 -0.43 0.00 0.00 0.00 0.00 46.02 45.26 1jmi n GLY 143 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1jmi n LEU 144 N 0.00 6.43 -4.71 0.99 4.77 -1.26 -4.62 117.00 118.59 1jmi n LEU 144 Ca 0.00 -4.58 -0.30 0.00 -0.03 0.00 0.00 56.01 51.10 1jmi n LEU 144 Cb 0.00 -1.51 -0.09 0.00 -2.33 0.00 0.00 43.42 39.49 1jmi n LEU 144 CO 0.00 1.25 -0.25 -0.69 -1.33 0.00 0.00 177.39 176.37 1jmi s VAL 145 N 0.77 1.57 0.14 4.08 1.01 -1.26 -4.98 120.40 121.73 1jmi s VAL 145 Ca 0.41 -1.96 -0.30 0.00 0.00 0.00 0.00 61.98 60.12 1jmi s VAL 145 Cb 0.08 -2.54 -0.06 0.00 0.00 0.00 0.00 36.38 33.86 1jmi s VAL 145 CO -0.00 0.00 1.56 1.88 0.00 0.00 0.00 175.10 178.54 1jmi h TYR 146 N 1.49 -1.46 -0.99 5.22 0.05 -1.93 -0.93 116.97 118.42 1jmi h TYR 146 Ca -0.44 0.07 0.28 0.00 0.05 0.00 0.00 58.73 58.69 1jmi h TYR 146 Cb 1.28 0.69 -0.05 0.00 1.01 0.00 0.00 36.73 39.66 1jmi h TYR 146 CO 1.14 -0.48 0.70 0.78 -1.05 0.00 0.00 178.16 179.25 1jmi h GLY 147 N -0.41 0.15 0.24 3.88 0.00 -1.79 0.84 103.07 105.98 1jmi h GLY 147 Ca 0.09 -0.03 -0.00 0.00 0.00 0.00 0.00 47.33 47.39 1jmi h GLY 147 CO -0.55 -0.01 -0.02 0.23 0.00 0.00 0.00 176.54 176.19 1jmi h SER 148 N 0.06 -0.05 0.02 0.19 0.87 -1.51 -1.46 113.55 111.66 1jmi h SER 148 Ca 0.48 -0.62 -0.02 0.00 -1.23 0.00 0.00 61.79 60.40 1jmi h SER 148 Cb 1.81 0.01 -0.01 0.00 -0.44 0.00 0.00 62.40 63.78 1jmi h SER 148 CO -0.04 0.65 -0.05 1.56 -0.53 0.00 0.00 176.83 178.43 1jmi h GLN 149 N -0.82 0.08 0.11 2.24 4.20 0.96 0.74 115.11 122.63 1jmi h GLN 149 Ca -0.01 -0.01 -0.26 0.00 0.06 0.00 0.00 58.65 58.43 1jmi h GLN 149 Cb 0.67 -0.02 -0.00 0.00 0.30 0.00 0.00 27.48 28.43 1jmi h GLN 149 CO 0.01 0.14 -1.33 -1.49 -0.67 0.00 0.00 178.83 175.48 1jmi h TRP 150 N 0.08 0.44 -0.36 2.96 4.06 0.39 -3.38 115.95 120.14 1jmi h TRP 150 Ca 0.02 -0.32 0.00 0.00 2.06 0.00 0.00 58.89 60.65 1jmi h TRP 150 Cb 0.14 -0.02 0.00 0.00 -1.00 0.00 0.00 29.16 28.28 1jmi h TRP 150 CO 0.00 1.52 0.00 0.54 -3.56 0.00 0.00 178.44 176.94 1jmi n ARG 151 N -3.96 2.80 -2.71 0.49 1.74 -0.55 -1.36 116.66 113.11 1jmi n ARG 151 Ca -0.24 -2.06 -0.08 0.00 -0.77 0.00 0.00 57.85 54.70 1jmi n ARG 151 Cb 0.88 -1.29 0.09 0.00 -1.02 0.00 0.00 32.46 31.13 1jmi n ARG 151 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1jmi n ALA 152 N 0.59 -0.92 -2.27 7.54 0.00 0.26 -4.47 120.51 121.24 1jmi n ALA 152 Ca 0.12 -1.25 -0.43 0.00 0.00 0.00 0.00 53.44 51.89 1jmi n ALA 152 Cb 0.43 -1.43 -0.02 0.00 0.00 0.00 0.00 19.45 18.43 1jmi n ALA 152 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 177.50 177.04 1jmi s TRP 153 N 0.22 2.57 -0.24 0.00 -0.11 0.48 -4.61 118.94 117.25 1jmi s TRP 153 Ca 0.21 0.73 -0.29 0.00 1.22 0.00 0.00 56.10 57.97 1jmi s TRP 153 Cb 0.30 -3.65 0.01 0.00 -1.50 0.00 0.00 33.47 28.62 1jmi s TRP 153 CO -0.08 -2.48 1.02 -1.01 -4.62 0.00 0.00 176.95 169.79 1jmi s HIS 154 N 3.51 3.31 0.42 5.86 3.76 -1.26 -0.00 115.29 130.88 1jmi s HIS 154 Ca 0.62 1.39 -0.05 0.00 -0.15 0.00 0.00 55.06 56.88 1jmi s HIS 154 Cb -0.27 -3.31 0.09 0.00 1.11 0.00 0.00 32.58 30.20 1jmi s HIS 154 CO 0.21 -0.52 0.57 0.25 -0.85 0.00 0.00 174.74 174.41 1jmi n THR 155 N 5.40 0.00 0.03 1.30 -2.24 -0.76 -4.99 114.28 113.01 1jmi n THR 155 Ca 0.11 -0.59 -0.19 0.00 -2.27 0.00 0.00 64.05 61.11 1jmi n THR 155 Cb 0.46 -1.50 -0.11 0.00 -2.10 0.00 0.00 70.33 67.08 1jmi n THR 155 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 1jmi h SER 156 N -0.61 0.72 0.00 3.42 0.02 -1.96 -3.16 113.55 111.98 1jmi h SER 156 Ca -0.19 -0.76 0.00 0.00 -0.84 0.00 0.00 61.79 60.00 1jmi h SER 156 Cb 0.58 -0.22 0.00 0.00 0.14 0.00 0.00 62.40 62.90 1jmi h SER 156 CO 0.16 1.39 0.00 1.17 -1.14 0.00 0.00 176.83 178.41 1jmi n LYS 157 N -4.03 0.58 0.00 3.45 4.81 -1.26 -4.81 118.16 116.90 1jmi n LYS 157 Ca -0.11 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.33 1jmi n LYS 157 Cb 0.79 -1.06 0.00 0.00 0.02 0.00 0.00 35.03 34.78 1jmi n LYS 157 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1jmi n GLY 158 N 0.11 3.17 2.50 3.14 0.00 -1.20 -5.04 105.19 107.87 1jmi n GLY 158 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.80 1jmi n GLY 158 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1jmi n ASP 159 N 0.05 -2.34 -4.14 1.61 2.03 -1.26 -4.65 116.55 107.85 1jmi n ASP 159 Ca 0.00 -0.89 -0.29 0.00 0.52 0.00 0.00 54.79 54.13 1jmi n ASP 159 Cb 0.00 -0.73 -0.17 0.00 -0.72 0.00 0.00 41.12 39.50 1jmi n ASP 159 CO 0.00 0.00 0.00 -0.89 -1.92 0.00 0.00 177.20 174.39 1jmi s THR 160 N -2.26 1.67 -0.21 5.18 2.01 -1.26 -1.83 115.64 118.94 1jmi s THR 160 Ca 0.51 -0.79 -0.07 0.00 0.31 0.00 0.00 61.69 61.65 1jmi s THR 160 Cb -0.06 -1.47 -0.03 0.00 0.01 0.00 0.00 72.50 70.94 1jmi s THR 160 CO 0.40 0.47 0.05 -0.63 -0.69 0.00 0.00 174.62 174.23 1jmi s ILE 161 N 0.49 4.44 -1.18 1.82 -1.09 1.00 -4.85 121.20 121.83 1jmi s ILE 161 Ca -0.17 -0.14 -0.10 0.00 -2.23 0.00 0.00 60.65 58.01 1jmi s ILE 161 Cb -0.17 -3.03 0.22 0.00 -1.58 0.00 0.00 42.46 37.90 1jmi s ILE 161 CO 0.07 0.40 1.43 -0.67 -1.23 0.00 0.00 174.94 174.94 1jmi n ASP 162 N 4.20 5.47 -0.17 3.58 2.03 -1.26 -0.39 116.55 130.02 1jmi n ASP 162 Ca -0.16 -3.09 -0.12 0.00 0.52 0.00 0.00 54.79 51.94 1jmi n ASP 162 Cb 0.52 -1.45 -0.09 0.00 -0.72 0.00 0.00 41.12 39.38 1jmi n ASP 162 CO 0.00 0.00 0.00 1.56 -1.92 0.00 0.00 177.20 176.84 1jmi h GLN 163 N 6.48 -0.27 0.04 -0.67 4.20 -1.73 0.08 115.11 123.23 1jmi h GLN 163 Ca 0.27 0.02 0.02 0.00 0.06 0.00 0.00 58.65 59.02 1jmi h GLN 163 Cb 0.79 0.06 -0.03 0.00 0.30 0.00 0.00 27.48 28.60 1jmi h GLN 163 CO 1.26 -0.18 -0.16 1.25 -0.67 0.00 0.00 178.83 180.33 1jmi h LEU 164 N -0.28 -0.45 -0.89 1.46 5.85 -1.56 0.68 115.31 120.13 1jmi h LEU 164 Ca 0.08 0.06 0.12 0.00 0.84 0.00 0.00 57.88 58.98 1jmi h LEU 164 Cb 0.49 0.18 -0.08 0.00 0.37 0.00 0.00 40.66 41.62 1jmi h LEU 164 CO -0.59 -0.22 0.51 1.23 -0.34 0.00 0.00 178.44 179.03 1jmi h GLY 165 N -0.28 1.44 0.71 3.75 0.00 -1.70 -0.05 103.07 106.93 1jmi h GLY 165 Ca 0.04 -0.32 -0.03 0.00 0.00 0.00 0.00 47.33 47.02 1jmi h GLY 165 CO -0.12 0.07 -0.03 -0.55 0.00 0.00 0.00 176.54 175.90 1jmi h ASP 166 N 0.78 0.21 -0.92 0.19 5.19 -0.60 -2.87 116.42 118.41 1jmi h ASP 166 Ca 0.46 -0.38 0.12 0.00 -0.62 0.00 0.00 57.03 56.60 1jmi h ASP 166 Cb 0.53 -0.06 -0.07 0.00 0.18 0.00 0.00 39.33 39.91 1jmi h ASP 166 CO -0.30 0.55 0.59 0.58 -3.12 0.00 0.00 179.24 177.54 1jmi h VAL 167 N -0.12 0.92 -0.28 -1.35 2.07 0.05 -0.65 116.25 116.88 1jmi h VAL 167 Ca 0.03 -0.29 -0.05 0.00 0.82 0.00 0.00 66.70 67.20 1jmi h VAL 167 Cb 0.46 -0.01 -0.01 0.00 -1.52 0.00 0.00 31.29 30.21 1jmi h VAL 167 CO 0.01 0.16 -0.03 0.40 0.02 0.00 0.00 177.57 178.12 1jmi h ILE 168 N 0.85 1.27 -0.82 4.57 2.04 -0.91 -1.15 117.51 123.36 1jmi h ILE 168 Ca 0.44 -1.02 0.02 0.00 1.00 0.00 0.00 64.86 65.31 1jmi h ILE 168 Cb 0.52 1.36 -0.04 0.00 -0.74 0.00 0.00 36.82 37.92 1jmi h ILE 168 CO -0.21 0.32 0.55 -0.08 0.00 0.00 0.00 178.15 178.73 1jmi h GLU 169 N 0.30 1.05 -0.84 2.37 4.57 -1.14 -1.10 114.58 119.79 1jmi h GLU 169 Ca 0.08 -0.06 -0.02 0.00 -1.18 0.00 0.00 59.36 58.18 1jmi h GLU 169 Cb 0.49 -0.24 -0.04 0.00 -0.16 0.00 0.00 28.75 28.80 1jmi h GLU 169 CO 0.02 0.69 0.46 1.96 -1.18 0.00 0.00 179.01 180.97 1jmi h GLN 170 N 1.08 1.17 -0.43 1.92 1.08 -0.68 0.85 115.11 120.10 1jmi h GLN 170 Ca 0.31 -0.13 -0.06 0.00 -1.45 0.00 0.00 58.65 57.32 1jmi h GLN 170 Cb -0.06 -0.23 -0.02 0.00 -0.05 0.00 0.00 27.48 27.12 1jmi h GLN 170 CO -0.08 0.85 0.03 0.82 -0.95 0.00 0.00 178.83 179.51 1jmi h ILE 171 N 1.16 1.22 -0.10 2.54 2.04 0.03 1.13 117.51 125.53 1jmi h ILE 171 Ca 0.30 -0.85 -0.23 0.00 1.00 0.00 0.00 64.86 65.07 1jmi h ILE 171 Cb 0.02 0.86 0.01 0.00 -0.74 0.00 0.00 36.82 36.98 1jmi h ILE 171 CO -0.05 0.30 -0.84 0.11 0.00 0.00 0.00 178.15 177.67 1jmi h LYS 172 N 0.64 0.74 0.00 2.37 1.57 -0.81 -2.83 116.57 118.25 1jmi h LYS 172 Ca 0.14 -0.67 0.00 0.00 -1.87 0.00 0.00 60.65 58.25 1jmi h LYS 172 Cb 0.35 0.16 0.00 0.00 0.08 0.00 0.00 32.23 32.82 1jmi h LYS 172 CO 0.01 1.27 -0.72 1.15 -0.57 0.00 0.00 179.45 180.59 1jmi h THR 173 N 0.45 0.00 -1.04 -0.16 2.02 -0.62 -3.41 112.91 110.15 1jmi h THR 173 Ca -0.08 -0.69 -0.34 0.00 0.77 0.00 0.00 66.41 66.07 1jmi h THR 173 Cb 1.48 1.27 -0.24 0.00 -1.74 0.00 0.00 68.15 68.92 1jmi h THR 173 CO 0.17 0.00 -0.70 1.41 0.37 0.00 0.00 175.52 176.77 1jmi n HIS 174 N -2.36 -2.43 -0.30 3.16 8.25 0.39 -5.02 115.22 116.90 1jmi n HIS 174 Ca 0.02 -2.30 0.02 0.00 -0.26 0.00 0.00 57.72 55.20 1jmi n HIS 174 Cb 0.48 0.92 0.16 0.00 1.12 0.00 0.00 29.99 32.67 1jmi n HIS 174 CO 0.00 0.00 0.00 -1.35 0.64 0.00 0.00 176.34 175.63 1jmi h PRO 175 N 4.46 0.81 -1.65 -0.41 0.11 -1.64 -2.76 132.00 130.93 1jmi h PRO 175 Ca 0.01 -0.05 -0.15 0.00 0.11 0.00 0.00 66.00 65.92 1jmi h PRO 175 Cb 1.00 -0.18 -0.07 0.00 0.11 0.00 0.00 31.00 31.86 1jmi h PRO 175 CO 0.29 0.54 0.19 0.66 -0.21 0.00 0.00 178.00 179.47 1jmi n TYR 176 N -4.71 0.73 -3.35 0.65 4.01 -1.26 -3.83 117.16 109.39 1jmi n TYR 176 Ca 0.13 -1.36 -0.39 0.00 -0.16 0.00 0.00 57.90 56.13 1jmi n TYR 176 Cb 0.25 -0.67 -0.08 0.00 -0.31 0.00 0.00 39.34 38.54 1jmi n TYR 176 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 1jmi s SER 177 N 1.03 6.41 -0.12 7.72 0.15 -1.04 -4.95 113.70 122.90 1jmi s SER 177 Ca 0.14 0.49 0.01 0.00 0.70 0.00 0.00 55.95 57.29 1jmi s SER 177 Cb 0.11 -2.24 0.18 0.00 -1.71 0.00 0.00 66.02 62.37 1jmi s SER 177 CO 0.00 -0.14 1.23 0.54 1.20 0.00 0.00 173.24 176.08 1jmi n ARG 178 N 4.81 1.37 -0.16 5.44 1.74 -1.26 -3.48 116.66 125.12 1jmi n ARG 178 Ca -0.07 -0.82 0.01 0.00 -0.77 0.00 0.00 57.85 56.20 1jmi n ARG 178 Cb 0.51 -1.33 0.02 0.00 -1.02 0.00 0.00 32.46 30.63 1jmi n ARG 178 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1jmi n ARG 179 N 0.06 0.72 -2.38 5.56 1.74 -1.26 -4.96 116.66 116.14 1jmi n ARG 179 Ca 0.16 -1.13 -0.37 0.00 -0.77 0.00 0.00 57.85 55.74 1jmi n ARG 179 Cb 0.81 -0.73 -0.02 0.00 -1.02 0.00 0.00 32.46 31.49 1jmi n ARG 179 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1jmi s LEU 180 N -0.59 3.52 0.03 0.55 1.43 -1.23 -4.91 118.68 117.48 1jmi s LEU 180 Ca 0.05 -2.13 0.07 0.00 -1.03 0.00 0.00 54.13 51.09 1jmi s LEU 180 Cb 0.04 -2.58 -0.02 0.00 0.03 0.00 0.00 46.19 43.65 1jmi s LEU 180 CO 0.00 -1.94 -0.20 -0.63 0.23 0.00 0.00 176.35 173.82 1jmi s ILE 181 N 6.96 1.60 -0.14 -0.59 1.01 -1.26 -0.73 121.20 128.05 1jmi s ILE 181 Ca 0.60 -1.11 -0.00 0.00 0.00 0.00 0.00 60.65 60.13 1jmi s ILE 181 Cb 0.02 -1.38 0.03 0.00 0.01 0.00 0.00 42.46 41.14 1jmi s ILE 181 CO 0.10 0.23 -0.08 -0.69 0.00 0.00 0.00 174.94 174.50 1jmi s VAL 182 N -0.74 1.16 0.10 2.92 1.01 -0.85 -4.94 120.40 119.06 1jmi s VAL 182 Ca 0.07 -0.48 0.05 0.00 0.00 0.00 0.00 61.98 61.62 1jmi s VAL 182 Cb -0.08 -1.22 -0.04 0.00 0.00 0.00 0.00 36.38 35.04 1jmi s VAL 182 CO 0.01 0.30 0.00 -0.55 0.00 0.00 0.00 175.10 174.87 1jmi s SER 183 N 1.64 5.01 0.00 3.32 0.15 -1.26 -2.04 113.70 120.52 1jmi s SER 183 Ca 0.03 -0.20 0.00 0.00 0.70 0.00 0.00 55.95 56.48 1jmi s SER 183 Cb -0.14 -1.18 0.00 0.00 -1.71 0.00 0.00 66.02 62.99 1jmi s SER 183 CO -0.08 0.16 0.48 0.00 1.20 0.00 0.00 173.24 175.00 1jmi n ALA 184 N 0.47 2.46 -3.15 5.45 0.00 0.21 -4.76 120.51 121.19 1jmi n ALA 184 Ca -0.11 -0.48 -0.45 0.00 0.00 0.00 0.00 53.44 52.40 1jmi n ALA 184 Cb 0.52 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.94 1jmi n ALA 184 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 177.50 177.04 1jmi s TRP 185 N -0.03 3.36 -0.26 0.00 -0.11 -1.20 -4.70 118.94 116.02 1jmi s TRP 185 Ca 0.00 -1.54 -0.17 0.00 1.22 0.00 0.00 56.10 55.61 1jmi s TRP 185 Cb 0.00 -4.01 -0.03 0.00 -1.50 0.00 0.00 33.47 27.93 1jmi s TRP 185 CO 0.00 -1.22 0.49 1.21 -4.62 0.00 0.00 176.95 172.81 1jmi s ASN 186 N 3.02 6.41 0.47 5.86 3.84 -1.26 -4.95 114.94 128.33 1jmi s ASN 186 Ca 0.21 0.49 0.21 0.00 0.21 0.00 0.00 52.86 53.98 1jmi s ASN 186 Cb -0.12 -2.27 1.18 0.00 -0.55 0.00 0.00 41.25 39.49 1jmi s ASN 186 CO -0.05 -0.26 2.01 -0.65 -2.79 0.00 0.00 177.10 175.36 1jmi h PRO 187 N 7.99 0.00 -0.00 0.43 0.11 -2.02 -2.69 132.00 135.82 1jmi h PRO 187 Ca -0.30 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.81 1jmi h PRO 187 Cb 1.15 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.26 1jmi h PRO 187 CO 0.70 0.18 0.00 -0.85 -0.21 0.00 0.00 178.00 177.82 1jmi n GLU 188 N -3.94 1.13 -0.01 1.05 0.28 -1.26 -4.06 120.64 113.83 1jmi n GLU 188 Ca -0.02 -0.18 -0.01 0.00 -0.16 0.00 0.00 57.16 56.79 1jmi n GLU 188 Cb 0.27 -1.49 -0.01 0.00 1.43 0.00 0.00 31.44 31.63 1jmi n GLU 188 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 1jmi n ASP 189 N -0.78 4.19 -0.34 -1.84 8.00 -1.03 -4.80 116.55 119.95 1jmi n ASP 189 Ca 0.23 -0.01 0.08 0.00 0.71 0.00 0.00 54.79 55.81 1jmi n ASP 189 Cb 0.16 0.21 0.19 0.00 -0.02 0.00 0.00 41.12 41.65 1jmi n ASP 189 CO 0.00 0.00 0.00 0.58 -0.39 0.00 0.00 177.20 177.39 1jmi h VAL 190 N 0.00 0.05 -0.07 2.53 2.07 -1.65 0.09 116.25 119.26 1jmi h VAL 190 Ca -0.04 -0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.50 1jmi h VAL 190 Cb 1.07 0.04 -0.00 0.00 -1.52 0.00 0.00 31.29 30.88 1jmi h VAL 190 CO -0.00 0.00 0.21 1.55 0.02 0.00 0.00 177.57 179.34 1jmi h PRO 191 N 0.01 0.00 -0.09 1.57 0.13 -1.87 -2.21 132.00 129.54 1jmi h PRO 191 Ca 0.51 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.64 1jmi h PRO 191 Cb 0.88 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.01 1jmi h PRO 191 CO -0.95 0.00 0.00 0.25 -0.23 0.00 0.00 178.00 177.07 1jmi n THR 192 N -3.26 0.54 -3.06 1.56 -2.24 -0.01 -5.03 114.28 102.78 1jmi n THR 192 Ca -0.01 -0.77 -0.35 0.00 -2.27 0.00 0.00 64.05 60.66 1jmi n THR 192 Cb 0.29 0.78 -0.06 0.00 -2.10 0.00 0.00 70.33 69.24 1jmi n THR 192 CO 0.00 0.00 0.00 -0.04 -0.57 0.00 0.00 175.07 174.46 1jmi s MET 193 N -0.74 4.21 0.12 -0.78 -1.94 -0.83 -4.97 119.30 114.37 1jmi s MET 193 Ca 0.09 0.87 -0.09 0.00 -1.71 0.00 0.00 55.69 54.85 1jmi s MET 193 Cb 0.05 -2.69 -0.10 0.00 2.01 0.00 0.00 34.83 34.10 1jmi s MET 193 CO 0.07 0.28 1.33 0.00 -0.01 0.00 0.00 175.02 176.69 1jmi h ALA 194 N 2.93 0.37 -2.53 3.03 0.00 -1.94 -3.40 119.26 117.72 1jmi h ALA 194 Ca -0.48 -0.62 -0.57 0.00 0.00 0.00 0.00 54.91 53.24 1jmi h ALA 194 Cb 1.19 -0.02 -0.38 0.00 0.00 0.00 0.00 17.79 18.57 1jmi h ALA 194 CO 0.65 0.71 -0.85 -1.17 0.00 0.00 0.00 179.25 178.60 1jmi s LEU 195 N -8.22 0.91 0.53 0.00 1.98 -1.26 -5.12 118.68 107.50 1jmi s LEU 195 Ca -0.09 -2.19 -0.21 0.00 -2.89 0.00 0.00 54.13 48.75 1jmi s LEU 195 Cb 0.09 -0.33 -0.06 0.00 0.66 0.00 0.00 46.19 46.55 1jmi s LEU 195 CO 0.89 -0.30 1.17 -2.65 -1.89 0.00 0.00 176.35 173.57 1jmi n PRO 196 N 4.00 1.40 -1.54 0.98 -0.02 -1.26 -4.82 135.00 133.73 1jmi n PRO 196 Ca 0.13 0.52 -0.53 0.00 -2.02 0.00 0.00 63.50 61.60 1jmi n PRO 196 Cb 0.38 -2.34 -0.06 0.00 -0.02 0.00 0.00 33.50 31.46 1jmi n PRO 196 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1jmi n PRO 197 N -0.75 0.69 0.04 0.52 -0.02 -1.26 -4.88 135.00 129.34 1jmi n PRO 197 Ca 0.11 0.25 -0.13 0.00 -2.02 0.00 0.00 63.50 61.71 1jmi n PRO 197 Cb 0.44 -1.73 -0.14 0.00 -0.02 0.00 0.00 33.50 32.05 1jmi n PRO 197 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1jmi n HIS 199 N -3.35 2.39 -0.30 0.00 8.25 -1.26 -2.03 115.22 118.92 1jmi n HIS 199 Ca -0.13 -2.62 0.11 0.00 -0.26 0.00 0.00 57.72 54.82 1jmi n HIS 199 Cb 1.02 -1.40 0.24 0.00 1.12 0.00 0.00 29.99 30.97 1jmi n HIS 199 CO 0.00 0.00 0.00 1.15 0.64 0.00 0.00 176.34 178.13 1jmi h THR 200 N 3.49 0.22 -1.96 1.59 2.02 -1.63 -3.42 112.91 113.23 1jmi h THR 200 Ca 0.24 -0.04 0.19 0.00 0.77 0.00 0.00 66.41 67.58 1jmi h THR 200 Cb 0.62 0.11 -0.14 0.00 -1.74 0.00 0.00 68.15 67.00 1jmi h THR 200 CO 1.40 0.02 0.62 -1.48 0.37 0.00 0.00 175.52 176.45 1jmi s LEU 201 N -10.82 -0.22 0.04 2.58 0.05 -1.22 -0.62 118.68 108.47 1jmi s LEU 201 Ca -0.13 -0.10 -0.05 0.00 0.05 0.00 0.00 54.13 53.90 1jmi s LEU 201 Cb 0.26 1.79 -0.01 0.00 -2.05 0.00 0.00 46.19 46.17 1jmi s LEU 201 CO 0.77 -0.53 0.08 -0.72 -0.55 0.00 0.00 176.35 175.40 1jmi s TYR 202 N -2.87 0.23 -0.02 3.48 1.13 -0.86 -0.73 117.35 117.72 1jmi s TYR 202 Ca 0.09 -0.57 0.03 0.00 -1.41 0.00 0.00 57.07 55.21 1jmi s TYR 202 Cb -0.00 -0.17 -0.00 0.00 -1.10 0.00 0.00 41.96 40.69 1jmi s TYR 202 CO -0.05 -0.37 -0.09 -1.14 -2.51 0.00 0.00 175.55 171.39 1jmi s GLN 203 N -2.76 0.86 0.27 -3.49 0.74 -0.02 -2.01 119.66 113.25 1jmi s GLN 203 Ca -0.04 -0.31 0.03 0.00 0.05 0.00 0.00 55.36 55.09 1jmi s GLN 203 Cb -0.00 -0.81 -0.03 0.00 1.10 0.00 0.00 33.01 33.26 1jmi s GLN 203 CO -0.05 0.15 0.41 -0.06 -0.55 0.00 0.00 175.29 175.19 1jmi s PHE 204 N 0.01 3.47 -0.17 1.67 0.08 0.09 -0.98 117.98 122.14 1jmi s PHE 204 Ca 0.00 0.11 -0.09 0.00 0.12 0.00 0.00 56.93 57.07 1jmi s PHE 204 Cb -0.06 -1.68 0.06 0.00 -0.57 0.00 0.00 43.02 40.77 1jmi s PHE 204 CO 0.00 0.35 0.41 -0.47 -0.10 0.00 0.00 175.22 175.41 1jmi s TYR 205 N -2.06 -0.61 -0.03 0.36 5.04 -0.70 -4.57 117.35 114.78 1jmi s TYR 205 Ca 0.36 1.30 0.07 0.00 -2.44 0.00 0.00 57.07 56.36 1jmi s TYR 205 Cb -0.09 0.27 -0.02 0.00 0.35 0.00 0.00 41.96 42.46 1jmi s TYR 205 CO 0.31 -0.35 -0.24 0.08 -1.34 0.00 0.00 175.55 174.01 1jmi s VAL 206 N 1.45 2.24 -0.29 3.14 1.01 -1.25 -0.32 120.40 126.38 1jmi s VAL 206 Ca -0.09 -1.04 -0.23 0.00 0.00 0.00 0.00 61.98 60.62 1jmi s VAL 206 Cb -0.09 -1.80 0.14 0.00 0.00 0.00 0.00 36.38 34.64 1jmi s VAL 206 CO -0.13 0.58 1.11 0.21 0.00 0.00 0.00 175.10 176.88 1jmi s ASN 207 N -0.61 -0.37 -1.45 3.32 3.84 -0.80 -4.59 114.94 114.28 1jmi s ASN 207 Ca 0.10 0.68 -0.04 0.00 0.21 0.00 0.00 52.86 53.81 1jmi s ASN 207 Cb -0.10 0.80 0.02 0.00 -0.55 0.00 0.00 41.25 41.41 1jmi s ASN 207 CO -0.01 -0.11 0.33 0.47 -2.79 0.00 0.00 177.10 174.99 1jmi n ASP 208 N 2.41 -5.13 -0.59 -4.21 8.00 -1.26 -0.77 116.55 115.00 1jmi n ASP 208 Ca -0.13 -0.15 -0.08 0.00 0.71 0.00 0.00 54.79 55.14 1jmi n ASP 208 Cb 0.56 -4.23 -0.03 0.00 -0.02 0.00 0.00 41.12 37.40 1jmi n ASP 208 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1jmi n GLY 209 N -1.20 0.86 3.56 0.44 0.00 -1.26 -4.97 105.19 102.62 1jmi n GLY 209 Ca -0.13 -0.16 -0.34 0.00 0.00 0.00 0.00 46.02 45.40 1jmi n GLY 209 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1jmi s LYS 210 N -2.38 2.90 -0.28 1.61 -0.14 0.05 -1.15 119.74 120.35 1jmi s LYS 210 Ca 0.00 -0.55 -0.06 0.00 -1.36 0.00 0.00 55.97 54.00 1jmi s LYS 210 Cb 0.00 -2.64 0.01 0.00 -1.68 0.00 0.00 37.83 33.52 1jmi s LYS 210 CO 0.00 0.59 0.04 -1.17 -0.76 0.00 0.00 175.35 174.06 1jmi s LEU 211 N -0.61 3.60 0.37 3.17 2.96 -0.38 -1.90 118.68 125.89 1jmi s LEU 211 Ca 0.09 -0.65 0.07 0.00 -0.22 0.00 0.00 54.13 53.42 1jmi s LEU 211 Cb -0.12 -1.84 -0.02 0.00 0.50 0.00 0.00 46.19 44.72 1jmi s LEU 211 CO 0.02 -0.15 0.38 -0.44 -1.32 0.00 0.00 176.35 174.84 1jmi s SER 212 N 1.48 5.38 -0.12 3.68 0.01 0.56 -1.20 113.70 123.49 1jmi s SER 212 Ca 0.03 -0.50 -0.11 0.00 1.31 0.00 0.00 55.95 56.67 1jmi s SER 212 Cb -0.17 -0.86 0.03 0.00 0.21 0.00 0.00 66.02 65.23 1jmi s SER 212 CO 0.01 -0.50 0.32 -0.22 0.41 0.00 0.00 173.24 173.26 1jmi s LEU 213 N -4.11 0.76 -0.07 2.44 0.20 -0.93 -1.72 118.68 115.26 1jmi s LEU 213 Ca 0.45 0.65 0.03 0.00 0.69 0.00 0.00 54.13 55.96 1jmi s LEU 213 Cb -0.06 1.11 0.01 0.00 -0.43 0.00 0.00 46.19 46.81 1jmi s LEU 213 CO 0.28 -0.11 -0.17 -1.58 -0.29 0.00 0.00 176.35 174.48 1jmi s GLN 214 N 0.17 2.08 -0.11 1.98 0.74 -0.15 -0.65 119.66 123.72 1jmi s GLN 214 Ca -0.00 -0.59 0.01 0.00 0.05 0.00 0.00 55.36 54.83 1jmi s GLN 214 Cb -0.02 -1.68 -0.02 0.00 1.10 0.00 0.00 33.01 32.39 1jmi s GLN 214 CO 0.00 0.13 -0.15 -1.17 -0.55 0.00 0.00 175.29 173.55 1jmi s LEU 215 N 0.40 2.64 -0.36 3.68 0.20 -0.58 -0.84 118.68 123.83 1jmi s LEU 215 Ca -0.13 -0.32 -0.09 0.00 0.69 0.00 0.00 54.13 54.28 1jmi s LEU 215 Cb -0.15 -1.57 0.03 0.00 -0.43 0.00 0.00 46.19 44.07 1jmi s LEU 215 CO 0.05 0.21 0.16 -0.47 -0.29 0.00 0.00 176.35 176.01 1jmi s TYR 216 N 0.08 3.25 -0.45 5.38 6.14 0.09 -0.59 117.35 131.25 1jmi s TYR 216 Ca -0.06 -1.14 -0.10 0.00 0.64 0.00 0.00 57.07 56.40 1jmi s TYR 216 Cb -0.15 -2.37 0.10 0.00 0.42 0.00 0.00 41.96 39.96 1jmi s TYR 216 CO 0.05 -0.68 0.32 -1.14 0.64 0.00 0.00 175.55 174.74 1jmi s GLN 217 N 1.49 2.60 0.42 4.97 0.74 -0.57 -2.38 119.66 126.94 1jmi s GLN 217 Ca 0.01 -1.60 0.16 0.00 0.05 0.00 0.00 55.36 53.98 1jmi s GLN 217 Cb -0.19 -3.90 1.05 0.00 1.10 0.00 0.00 33.01 31.07 1jmi s GLN 217 CO 0.05 -1.08 1.90 0.07 -0.55 0.00 0.00 175.29 175.67 1jmi h ARG 218 N 8.48 0.42 -3.38 1.67 0.11 -1.71 -0.19 114.38 119.78 1jmi h ARG 218 Ca -0.23 -0.03 -0.19 0.00 0.10 0.00 0.00 59.98 59.64 1jmi h ARG 218 Cb 1.08 -0.09 -0.26 0.00 1.11 0.00 0.00 29.97 31.80 1jmi h ARG 218 CO 0.83 0.28 -0.54 0.45 0.10 0.00 0.00 179.97 181.08 1jmi s SER 219 N -5.84 -0.15 -0.02 0.08 0.15 -1.26 -0.88 113.70 105.79 1jmi s SER 219 Ca -0.08 0.28 -0.02 0.00 0.70 0.00 0.00 55.95 56.82 1jmi s SER 219 Cb 0.22 0.30 0.01 0.00 -1.71 0.00 0.00 66.02 64.83 1jmi s SER 219 CO 0.77 -0.06 0.07 0.00 1.20 0.00 0.00 173.24 175.22 1jmi s ALA 220 N 0.02 -0.16 -0.52 5.45 0.00 0.01 -4.92 121.76 121.64 1jmi s ALA 220 Ca -0.01 0.16 -0.14 0.00 0.00 0.00 0.00 51.96 51.98 1jmi s ALA 220 Cb -0.01 -0.10 0.13 0.00 0.00 0.00 0.00 23.12 23.13 1jmi s ALA 220 CO 0.00 -0.04 0.45 0.34 0.00 0.00 0.00 175.76 176.51 1jmi s ASP 221 N -0.03 6.03 0.16 0.00 -1.08 -1.26 -0.90 116.67 119.59 1jmi s ASP 221 Ca -0.01 -1.84 -0.23 0.00 -0.52 0.00 0.00 52.55 49.96 1jmi s ASP 221 Cb -0.01 -2.14 0.06 0.00 -1.46 0.00 0.00 42.92 39.37 1jmi s ASP 221 CO 0.00 -0.80 1.60 0.40 0.52 0.00 0.00 175.17 176.89 1jmi h ILE 222 N 5.97 0.25 0.11 4.11 1.08 -1.38 0.66 117.51 128.31 1jmi h ILE 222 Ca -0.27 0.00 -0.01 0.00 -0.39 0.00 0.00 64.86 64.20 1jmi h ILE 222 Cb 1.09 0.25 0.00 0.00 -3.07 0.00 0.00 36.82 35.09 1jmi h ILE 222 CO 0.98 0.00 -0.05 0.15 -0.69 0.00 0.00 178.15 178.53 1jmi h PHE 223 N -0.24 -0.14 0.01 1.37 3.57 -1.94 -3.31 116.94 116.26 1jmi h PHE 223 Ca 0.17 -0.00 -0.32 0.00 3.53 0.00 0.00 57.97 61.35 1jmi h PHE 223 Cb 0.53 0.05 -0.05 0.00 2.79 0.00 0.00 35.95 39.26 1jmi h PHE 223 CO -0.52 0.28 -1.94 1.28 -2.23 0.00 0.00 178.31 175.19 1jmi n LEU 224 N -4.95 0.94 0.00 0.59 4.77 -1.22 -4.60 117.00 112.53 1jmi n LEU 224 Ca -0.09 0.27 0.00 0.00 -0.03 0.00 0.00 56.01 56.16 1jmi n LEU 224 Cb 0.25 0.07 0.00 0.00 -2.33 0.00 0.00 43.42 41.41 1jmi n LEU 224 CO 0.31 0.49 0.00 0.61 -1.33 0.00 0.00 177.39 177.47 1jmi n GLY 225 N 1.68 -0.43 0.31 -0.72 0.00 0.21 -4.58 105.19 101.66 1jmi n GLY 225 Ca -0.24 0.00 0.31 0.00 0.00 0.00 0.00 46.02 46.10 1jmi n GLY 225 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1jmi n VAL 226 N -2.02 -0.41 -0.30 1.61 0.31 -0.01 -1.17 118.33 116.35 1jmi n VAL 226 Ca 0.00 1.97 0.02 0.00 -0.01 0.00 0.00 64.34 66.32 1jmi n VAL 226 Cb 0.00 -3.21 0.15 0.00 -0.91 0.00 0.00 33.84 29.88 1jmi n VAL 226 CO 0.00 0.00 0.00 -0.65 -1.32 0.00 0.00 176.83 174.86 1jmi h PRO 227 N 0.00 0.87 0.27 5.55 0.11 -1.81 -2.15 132.00 134.84 1jmi h PRO 227 Ca 0.83 -0.05 -0.01 0.00 0.11 0.00 0.00 66.00 66.87 1jmi h PRO 227 Cb 2.19 -0.20 0.00 0.00 0.11 0.00 0.00 31.00 33.11 1jmi h PRO 227 CO -0.75 0.58 -0.13 0.74 -0.21 0.00 0.00 178.00 178.23 1jmi h PHE 228 N 0.90 -0.34 -0.84 0.65 -1.00 -1.39 -3.13 116.94 111.78 1jmi h PHE 228 Ca 0.39 -0.01 0.20 0.00 2.81 0.00 0.00 57.97 61.36 1jmi h PHE 228 Cb 0.26 0.11 -0.15 0.00 3.61 0.00 0.00 35.95 39.78 1jmi h PHE 228 CO -0.04 0.01 0.01 0.77 -1.61 0.00 0.00 178.31 177.45 1jmi h SER 229 N -0.78 -0.40 0.61 2.17 0.02 -1.43 0.17 113.55 113.91 1jmi h SER 229 Ca -0.04 0.22 -0.02 0.00 -0.84 0.00 0.00 61.79 61.11 1jmi h SER 229 Cb 0.50 0.40 -0.01 0.00 0.14 0.00 0.00 62.40 63.43 1jmi h SER 229 CO 0.06 -0.23 -0.39 0.40 -1.14 0.00 0.00 176.83 175.53 1jmi h ILE 230 N 0.08 0.20 -0.12 3.27 2.04 -1.44 -0.88 117.51 120.66 1jmi h ILE 230 Ca 0.47 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 66.29 1jmi h ILE 230 Cb 0.88 0.20 -0.01 0.00 -0.74 0.00 0.00 36.82 37.15 1jmi h ILE 230 CO -0.76 0.00 -0.11 0.00 0.00 0.00 0.00 178.15 177.28 1jmi h ALA 231 N -0.67 1.59 0.18 1.87 0.00 -1.19 -0.67 119.26 120.37 1jmi h ALA 231 Ca -0.07 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.65 1jmi h ALA 231 Cb 0.78 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.50 1jmi h ALA 231 CO 0.07 0.30 -0.09 1.03 0.00 0.00 0.00 179.25 180.56 1jmi h SER 232 N 0.18 -0.21 1.16 0.00 0.87 -0.39 -1.62 113.55 113.54 1jmi h SER 232 Ca 0.04 -0.26 -0.02 0.00 -1.23 0.00 0.00 61.79 60.32 1jmi h SER 232 Cb 0.32 0.05 -0.00 0.00 -0.44 0.00 0.00 62.40 62.33 1jmi h SER 232 CO 0.02 0.17 -0.07 1.88 -0.53 0.00 0.00 176.83 178.29 1jmi h TYR 233 N -0.62 0.00 0.02 2.24 -1.99 -1.06 -0.45 116.97 115.12 1jmi h TYR 233 Ca -0.03 0.00 -0.24 0.00 2.00 0.00 0.00 58.73 60.46 1jmi h TYR 233 Cb 0.45 0.00 0.01 0.00 2.00 0.00 0.00 36.73 39.19 1jmi h TYR 233 CO 0.04 0.07 -1.01 0.00 -0.00 0.00 0.00 178.16 177.26 1jmi h ALA 234 N 1.93 0.28 -0.24 3.88 0.00 -1.12 -1.85 119.26 122.14 1jmi h ALA 234 Ca -0.00 -0.73 -0.05 0.00 0.00 0.00 0.00 54.91 54.13 1jmi h ALA 234 Cb 0.68 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 1jmi h ALA 234 CO 0.01 0.81 -0.05 1.25 0.00 0.00 0.00 179.25 181.27 1jmi h LEU 235 N 0.23 0.45 -0.28 0.00 6.46 -0.86 -1.68 115.31 119.64 1jmi h LEU 235 Ca -0.10 -0.36 0.06 0.00 -0.12 0.00 0.00 57.88 57.36 1jmi h LEU 235 Cb 1.66 -0.12 -0.06 0.00 -0.73 0.00 0.00 40.66 41.41 1jmi h LEU 235 CO 0.18 0.71 -0.11 0.25 -0.62 0.00 0.00 178.44 178.85 1jmi h LEU 236 N 0.19 -0.38 -0.67 2.25 5.85 -1.08 -0.33 115.31 121.15 1jmi h LEU 236 Ca 0.06 0.10 0.09 0.00 0.84 0.00 0.00 57.88 58.97 1jmi h LEU 236 Cb 0.51 0.22 -0.07 0.00 0.37 0.00 0.00 40.66 41.69 1jmi h LEU 236 CO 0.02 -0.14 0.30 0.74 -0.34 0.00 0.00 178.44 179.03 1jmi h THR 237 N -0.06 0.81 -0.54 1.05 2.02 -1.19 -0.20 112.91 114.80 1jmi h THR 237 Ca 0.14 -0.18 -0.05 0.00 0.77 0.00 0.00 66.41 67.10 1jmi h THR 237 Cb 0.27 0.25 -0.02 0.00 -1.74 0.00 0.00 68.15 66.91 1jmi h THR 237 CO -0.32 0.10 0.16 0.45 0.37 0.00 0.00 175.52 176.27 1jmi h HIS 238 N 0.52 0.88 0.26 3.16 3.86 -0.55 -2.49 115.15 120.79 1jmi h HIS 238 Ca 0.33 -0.09 -0.01 0.00 -1.16 0.00 0.00 60.37 59.44 1jmi h HIS 238 Cb 0.38 -0.25 0.00 0.00 1.06 0.00 0.00 27.41 28.60 1jmi h HIS 238 CO -0.13 0.76 -0.13 -0.07 0.86 0.00 0.00 177.93 179.22 1jmi h LEU 239 N 0.75 -0.30 -1.22 2.43 3.38 -0.07 -1.14 115.31 119.14 1jmi h LEU 239 Ca 0.17 -0.17 0.13 0.00 0.09 0.00 0.00 57.88 58.11 1jmi h LEU 239 Cb 0.30 0.08 -0.07 0.00 0.09 0.00 0.00 40.66 41.05 1jmi h LEU 239 CO -0.00 0.01 0.58 0.58 0.09 0.00 0.00 178.44 179.70 1jmi h VAL 240 N -0.62 0.87 0.02 1.22 2.07 -1.11 -1.78 116.25 116.92 1jmi h VAL 240 Ca -0.04 -0.27 -0.00 0.00 0.82 0.00 0.00 66.70 67.22 1jmi h VAL 240 Cb 0.45 0.03 0.00 0.00 -1.52 0.00 0.00 31.29 30.24 1jmi h VAL 240 CO 0.06 0.14 -0.01 0.00 0.02 0.00 0.00 177.57 177.78 1jmi h ALA 241 N 1.58 -0.03 -1.19 1.67 0.00 -1.33 -1.05 119.26 118.92 1jmi h ALA 241 Ca 0.45 -0.18 0.34 0.00 0.00 0.00 0.00 54.91 55.52 1jmi h ALA 241 Cb 0.62 0.01 -0.08 0.00 0.00 0.00 0.00 17.79 18.34 1jmi h ALA 241 CO -0.21 -0.34 0.80 1.25 0.00 0.00 0.00 179.25 180.75 1jmi h HIS 242 N -0.38 0.37 0.00 0.00 6.17 -0.37 -0.55 115.15 120.40 1jmi h HIS 242 Ca -0.00 0.01 -0.01 0.00 0.71 0.00 0.00 60.37 61.08 1jmi h HIS 242 Cb 0.36 -0.10 -0.00 0.00 2.52 0.00 0.00 27.41 30.19 1jmi h HIS 242 CO 0.05 -0.01 -0.05 1.49 0.71 0.00 0.00 177.93 180.11 1jmi h GLU 243 N 0.18 0.00 -0.24 5.26 4.81 -1.11 -3.33 114.58 120.16 1jmi h GLU 243 Ca 0.64 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.87 1jmi h GLU 243 Cb 2.07 0.00 0.00 0.00 0.63 0.00 0.00 28.75 31.45 1jmi h GLU 243 CO -0.20 0.52 0.00 0.00 -0.73 0.00 0.00 179.01 178.60 1jmi n GLY 245 N 0.12 0.00 3.92 0.00 0.00 -0.55 -4.93 105.19 103.74 1jmi n GLY 245 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 1jmi n GLY 245 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1jmi s LEU 246 N 0.00 2.63 0.23 0.99 1.43 -1.06 -5.00 118.68 117.89 1jmi s LEU 246 Ca 0.00 0.48 0.05 0.00 -1.03 0.00 0.00 54.13 53.63 1jmi s LEU 246 Cb 0.00 -2.72 -0.03 0.00 0.03 0.00 0.00 46.19 43.47 1jmi s LEU 246 CO 0.00 -2.37 0.29 -0.70 0.23 0.00 0.00 176.35 173.79 1jmi s GLU 247 N -5.75 3.26 0.11 1.70 2.56 -0.30 -4.49 118.70 115.79 1jmi s GLU 247 Ca 0.69 -0.83 -0.23 0.00 0.00 0.00 0.00 54.97 54.60 1jmi s GLU 247 Cb -0.07 -2.79 -0.07 0.00 2.00 0.00 0.00 34.13 33.20 1jmi s GLU 247 CO 0.51 0.44 0.70 0.54 -0.56 0.00 0.00 175.26 176.89 1jmi s VAL 248 N -1.98 4.56 0.00 3.70 0.11 -1.26 -1.25 120.40 124.29 1jmi s VAL 248 Ca 0.34 1.52 0.00 0.00 -2.93 0.00 0.00 61.98 60.91 1jmi s VAL 248 Cb -0.09 -4.05 0.00 0.00 -1.53 0.00 0.00 36.38 30.71 1jmi s VAL 248 CO 0.27 0.51 0.00 0.61 -3.33 0.00 0.00 175.10 173.16 1jmi n GLY 249 N 1.79 0.96 3.67 6.54 0.00 -0.34 -4.64 105.19 113.17 1jmi n GLY 249 Ca -0.07 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.70 1jmi n GLY 249 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1jmi s GLU 250 N 2.38 2.12 -0.25 1.61 2.02 -1.26 -0.56 118.70 124.77 1jmi s GLU 250 Ca 0.00 -1.83 0.01 0.00 0.02 0.00 0.00 54.97 53.17 1jmi s GLU 250 Cb 0.00 -1.91 0.06 0.00 0.10 0.00 0.00 34.13 32.38 1jmi s GLU 250 CO 0.00 0.01 -0.06 0.12 0.02 0.00 0.00 175.26 175.36 1jmi s PHE 251 N -2.57 2.59 -0.13 1.61 5.36 0.74 -2.18 117.98 123.40 1jmi s PHE 251 Ca 0.37 -1.91 -0.10 0.00 -0.96 0.00 0.00 56.93 54.33 1jmi s PHE 251 Cb 0.03 -1.70 -0.05 0.00 -0.34 0.00 0.00 43.02 40.96 1jmi s PHE 251 CO 0.20 -0.80 0.21 0.42 -1.46 0.00 0.00 175.22 173.79 1jmi s ILE 252 N 1.33 5.37 -0.17 3.12 1.01 0.17 -0.38 121.20 131.64 1jmi s ILE 252 Ca -0.05 0.38 0.01 0.00 0.00 0.00 0.00 60.65 60.98 1jmi s ILE 252 Cb -0.19 -3.51 0.03 0.00 0.01 0.00 0.00 42.46 38.79 1jmi s ILE 252 CO -0.07 0.53 -0.15 -2.28 0.00 0.00 0.00 174.94 172.98 1jmi s HIS 253 N -0.43 2.45 -0.01 3.97 2.46 0.76 -1.53 115.29 122.96 1jmi s HIS 253 Ca 0.15 -1.48 0.02 0.00 0.47 0.00 0.00 55.06 54.23 1jmi s HIS 253 Cb -0.13 -1.71 -0.03 0.00 -0.13 0.00 0.00 32.58 30.58 1jmi s HIS 253 CO 0.04 -0.74 -0.05 0.99 -2.47 0.00 0.00 174.74 172.52 1jmi s THR 254 N 1.39 3.79 0.14 0.89 2.01 0.25 -1.24 115.64 122.87 1jmi s THR 254 Ca 0.03 -0.67 0.10 0.00 0.31 0.00 0.00 61.69 61.46 1jmi s THR 254 Cb -0.14 -2.64 -0.04 0.00 0.01 0.00 0.00 72.50 69.69 1jmi s THR 254 CO -0.10 0.43 -0.24 -0.36 -0.69 0.00 0.00 174.62 173.66 1jmi s PHE 255 N -0.98 2.12 0.00 4.92 0.08 0.44 -1.51 117.98 123.05 1jmi s PHE 255 Ca 0.17 -0.39 0.00 0.00 0.12 0.00 0.00 56.93 56.82 1jmi s PHE 255 Cb -0.11 -1.12 0.00 0.00 -0.57 0.00 0.00 43.02 41.22 1jmi s PHE 255 CO 0.07 0.34 0.00 0.41 -0.10 0.00 0.00 175.22 175.93 1jmi n GLY 256 N 0.76 0.38 3.44 4.36 0.00 -0.08 -3.33 105.19 110.71 1jmi n GLY 256 Ca -0.17 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.41 1jmi n GLY 256 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1jmi s ASP 257 N -1.00 6.22 -0.30 1.61 -1.08 -0.05 -0.68 116.67 121.39 1jmi s ASP 257 Ca 0.00 -0.95 -0.15 0.00 -0.52 0.00 0.00 52.55 50.93 1jmi s ASP 257 Cb 0.00 -2.31 -0.03 0.00 -1.46 0.00 0.00 42.92 39.13 1jmi s ASP 257 CO 0.00 -0.97 0.38 0.00 0.52 0.00 0.00 175.17 175.09 1jmi s ALA 258 N 2.79 3.53 0.09 3.66 0.00 -0.98 -0.81 121.76 130.05 1jmi s ALA 258 Ca 0.16 -0.96 0.03 0.00 0.00 0.00 0.00 51.96 51.19 1jmi s ALA 258 Cb -0.19 -2.76 -0.04 0.00 0.00 0.00 0.00 23.12 20.13 1jmi s ALA 258 CO 0.12 -0.83 -0.10 -3.38 0.00 0.00 0.00 175.76 171.57 1jmi s HIS 259 N 2.07 1.01 -0.18 0.00 -3.43 -0.08 -1.60 115.29 113.09 1jmi s HIS 259 Ca 0.14 -0.67 0.01 0.00 -0.80 0.00 0.00 55.06 53.74 1jmi s HIS 259 Cb -0.16 -0.56 0.01 0.00 -1.43 0.00 0.00 32.58 30.45 1jmi s HIS 259 CO 0.11 -0.02 -0.18 -1.17 -2.00 0.00 0.00 174.74 171.47 1jmi s LEU 260 N -2.41 2.25 0.18 5.38 2.96 -0.14 -0.86 118.68 126.05 1jmi s LEU 260 Ca 0.04 -0.59 -0.30 0.00 -0.22 0.00 0.00 54.13 53.06 1jmi s LEU 260 Cb -0.03 -1.51 -0.08 0.00 0.50 0.00 0.00 46.19 45.07 1jmi s LEU 260 CO -0.00 0.02 1.27 -0.31 -1.32 0.00 0.00 176.35 176.00 1jmi s TYR 261 N 1.18 3.32 0.58 5.38 2.02 -1.26 -1.10 117.35 127.47 1jmi s TYR 261 Ca 0.02 1.28 0.29 0.00 -0.37 0.00 0.00 57.07 58.29 1jmi s TYR 261 Cb -0.14 -3.54 1.46 0.00 -0.40 0.00 0.00 41.96 39.35 1jmi s TYR 261 CO -0.09 -1.64 1.89 0.28 -1.57 0.00 0.00 175.55 174.42 1jmi h VAL 262 N 3.82 0.41 -0.21 0.71 2.07 -1.56 0.20 116.25 121.68 1jmi h VAL 262 Ca -0.44 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.08 1jmi h VAL 262 Cb 1.21 0.59 0.00 0.00 -1.52 0.00 0.00 31.29 31.58 1jmi h VAL 262 CO 0.77 0.00 0.00 -0.46 0.02 0.00 0.00 177.57 177.90 1jmi n ASN 263 N -3.85 2.46 0.00 0.57 6.94 -1.26 -3.37 115.26 116.75 1jmi n ASN 263 Ca 0.11 -2.28 0.00 0.00 -0.02 0.00 0.00 54.58 52.39 1jmi n ASN 263 Cb 0.75 -0.51 0.00 0.00 -2.36 0.00 0.00 39.78 37.66 1jmi n ASN 263 CO 0.00 0.00 0.00 1.41 -1.03 0.00 0.00 177.26 177.64 1jmi n HIS 264 N 0.22 0.00 0.08 -2.53 8.25 0.69 -4.64 115.22 117.29 1jmi n HIS 264 Ca 0.09 -0.30 -0.13 0.00 -0.26 0.00 0.00 57.72 57.12 1jmi n HIS 264 Cb 0.53 -0.03 -0.07 0.00 1.12 0.00 0.00 29.99 31.53 1jmi n HIS 264 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 1jmi h LEU 265 N 0.00 -0.11 -0.62 2.41 3.38 -1.66 -0.22 115.31 118.50 1jmi h LEU 265 Ca 0.00 -0.03 -0.00 0.00 0.09 0.00 0.00 57.88 57.94 1jmi h LEU 265 Cb 0.50 0.03 -0.03 0.00 0.09 0.00 0.00 40.66 41.25 1jmi h LEU 265 CO 0.00 -0.05 0.38 0.44 0.09 0.00 0.00 178.44 179.30 1jmi h ASP 266 N -0.17 0.74 0.31 -0.43 3.32 -1.88 0.04 116.42 118.36 1jmi h ASP 266 Ca -0.01 -0.06 -0.01 0.00 0.02 0.00 0.00 57.03 56.97 1jmi h ASP 266 Cb 0.13 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 39.49 1jmi h ASP 266 CO 0.02 0.58 -0.21 1.56 -1.72 0.00 0.00 179.24 179.47 1jmi h GLN 267 N 0.84 -0.49 -0.62 3.56 7.50 -1.86 0.06 115.11 124.10 1jmi h GLN 267 Ca 0.22 0.03 -0.05 0.00 0.50 0.00 0.00 58.65 59.36 1jmi h GLN 267 Cb -0.03 0.11 -0.03 0.00 0.05 0.00 0.00 27.48 27.59 1jmi h GLN 267 CO -0.04 -0.33 0.20 0.97 -1.50 0.00 0.00 178.83 178.13 1jmi h ILE 268 N -0.51 1.23 -0.88 2.54 6.09 -0.91 -1.84 117.51 123.23 1jmi h ILE 268 Ca -0.03 -0.78 -0.00 0.00 -1.37 0.00 0.00 64.86 62.68 1jmi h ILE 268 Cb 0.44 0.54 -0.04 0.00 0.47 0.00 0.00 36.82 38.22 1jmi h ILE 268 CO 0.01 0.30 0.54 0.11 -3.07 0.00 0.00 178.15 176.05 1jmi h LYS 269 N 0.91 1.19 -0.34 2.19 1.57 -0.60 -1.43 116.57 120.05 1jmi h LYS 269 Ca 0.21 -0.10 -0.07 0.00 -1.87 0.00 0.00 60.65 58.82 1jmi h LYS 269 Cb 0.25 -0.25 -0.01 0.00 0.08 0.00 0.00 32.23 32.29 1jmi h LYS 269 CO -0.01 0.82 -0.05 1.49 -0.57 0.00 0.00 179.45 181.13 1jmi h GLU 270 N 1.21 0.63 -0.84 3.15 4.57 -0.42 -3.07 114.58 119.81 1jmi h GLU 270 Ca 0.32 -0.23 0.00 0.00 -1.18 0.00 0.00 59.36 58.28 1jmi h GLU 270 Cb -0.07 -0.04 -0.04 0.00 -0.16 0.00 0.00 28.75 28.44 1jmi h GLU 270 CO -0.06 0.78 0.54 0.37 -1.18 0.00 0.00 179.01 179.46 1jmi h GLN 271 N 0.42 1.12 0.00 1.92 4.15 -0.64 -1.30 115.11 120.78 1jmi h GLN 271 Ca 0.09 -0.08 0.00 0.00 0.77 0.00 0.00 58.65 59.43 1jmi h GLN 271 Cb 0.53 -0.25 0.00 0.00 0.21 0.00 0.00 27.48 27.97 1jmi h GLN 271 CO 0.03 0.75 0.00 1.28 -1.93 0.00 0.00 178.83 178.96 1jmi n LEU 272 N -4.39 0.43 -0.14 -2.39 4.77 -0.61 -1.57 117.00 113.10 1jmi n LEU 272 Ca 0.09 0.64 0.14 0.00 -0.03 0.00 0.00 56.01 56.86 1jmi n LEU 272 Cb 0.04 -0.62 0.64 0.00 -2.33 0.00 0.00 43.42 41.15 1jmi n LEU 272 CO 0.37 -0.60 0.90 -1.54 -1.33 0.00 0.00 177.39 175.19 1jmi n SER 273 N -2.01 0.52 -4.89 -1.43 3.41 -0.49 -4.88 113.62 103.86 1jmi n SER 273 Ca 0.01 -0.73 -0.30 0.00 -0.26 0.00 0.00 58.87 57.59 1jmi n SER 273 Cb 0.14 -0.06 -0.04 0.00 -0.26 0.00 0.00 64.21 63.99 1jmi n SER 273 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 1jmi s ARG 274 N -2.36 3.70 -0.33 4.33 0.52 -0.61 -5.07 118.95 119.13 1jmi s ARG 274 Ca 0.32 0.13 -0.09 0.00 -0.52 0.00 0.00 55.73 55.57 1jmi s ARG 274 Cb 0.20 -2.63 0.01 0.00 0.52 0.00 0.00 34.95 33.06 1jmi s ARG 274 CO 0.45 0.23 0.15 0.99 0.02 0.00 0.00 175.30 177.14 1jmi s THR 275 N -2.02 4.40 0.67 0.02 2.01 -1.26 -5.05 115.64 114.41 1jmi s THR 275 Ca 0.46 -0.68 -0.17 0.00 0.31 0.00 0.00 61.69 61.60 1jmi s THR 275 Cb -0.11 -3.34 -0.11 0.00 0.01 0.00 0.00 72.50 68.95 1jmi s THR 275 CO 0.27 -0.05 0.04 -2.65 -0.69 0.00 0.00 174.62 171.54 1jmi n PRO 276 N 4.95 0.15 -4.55 4.92 -0.02 -1.26 -4.94 135.00 134.25 1jmi n PRO 276 Ca -0.13 0.07 -0.29 0.00 -2.02 0.00 0.00 63.50 61.13 1jmi n PRO 276 Cb 0.47 -1.35 -0.09 0.00 -0.02 0.00 0.00 33.50 32.51 1jmi n PRO 276 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 1jmi s ARG 277 N -1.89 2.08 0.13 -0.52 0.52 -1.26 -5.03 118.95 112.98 1jmi s ARG 277 Ca 0.58 -2.14 -0.31 0.00 -0.52 0.00 0.00 55.73 53.33 1jmi s ARG 277 Cb -0.39 -1.68 -0.10 0.00 0.52 0.00 0.00 34.95 33.30 1jmi s ARG 277 CO 0.65 -0.17 1.72 -2.14 0.02 0.00 0.00 175.30 175.39 1jmi s PRO 278 N -3.81 4.16 0.87 3.54 0.02 -1.26 -4.87 135.00 133.65 1jmi s PRO 278 Ca 0.28 2.49 -0.11 0.00 0.02 0.00 0.00 61.00 63.67 1jmi s PRO 278 Cb 0.06 -3.45 0.12 0.00 0.02 0.00 0.00 34.50 31.25 1jmi s PRO 278 CO 0.15 -0.76 1.17 0.00 -0.33 0.00 0.00 177.00 177.22 1jmi s ALA 279 N 2.24 1.65 0.72 -1.55 0.00 -1.26 -4.71 121.76 118.85 1jmi s ALA 279 Ca 0.76 0.68 -0.11 0.00 0.00 0.00 0.00 51.96 53.30 1jmi s ALA 279 Cb -0.44 -3.46 0.04 0.00 0.00 0.00 0.00 23.12 19.25 1jmi s ALA 279 CO 0.34 -2.54 1.09 -1.25 0.00 0.00 0.00 175.76 173.40 1jmi s PRO 280 N -4.46 2.54 -0.13 0.00 0.04 -1.25 -4.81 135.00 126.94 1jmi s PRO 280 Ca 0.69 0.24 -0.00 0.00 0.04 0.00 0.00 61.00 61.97 1jmi s PRO 280 Cb -0.25 -2.04 -0.02 0.00 0.04 0.00 0.00 34.50 32.23 1jmi s PRO 280 CO 0.55 -1.18 -0.12 0.99 0.04 0.00 0.00 177.00 177.27 1jmi s THR 281 N -3.37 3.14 0.00 1.26 2.01 0.87 -1.21 115.64 118.34 1jmi s THR 281 Ca 0.59 -0.63 -0.19 0.00 0.31 0.00 0.00 61.69 61.77 1jmi s THR 281 Cb -0.11 -2.32 -0.06 0.00 0.01 0.00 0.00 72.50 70.02 1jmi s THR 281 CO 0.50 0.53 0.53 -0.22 -0.69 0.00 0.00 174.62 175.26 1jmi s LEU 282 N 0.28 4.44 -0.21 4.42 2.96 -1.26 0.14 118.68 129.46 1jmi s LEU 282 Ca -0.09 1.10 -0.03 0.00 -0.22 0.00 0.00 54.13 54.90 1jmi s LEU 282 Cb -0.15 -2.82 0.07 0.00 0.50 0.00 0.00 46.19 43.79 1jmi s LEU 282 CO 0.05 0.19 0.05 -1.58 -1.32 0.00 0.00 176.35 173.74 1jmi s GLN 283 N -0.53 0.59 0.36 1.98 0.74 0.20 -4.97 119.66 118.04 1jmi s GLN 283 Ca 0.28 -0.47 -0.04 0.00 0.05 0.00 0.00 55.36 55.18 1jmi s GLN 283 Cb -0.18 -2.03 -0.04 0.00 1.10 0.00 0.00 33.01 31.85 1jmi s GLN 283 CO 0.16 -0.70 0.63 -0.51 -0.55 0.00 0.00 175.29 174.33 1jmi s LEU 284 N 1.87 3.91 -0.20 3.68 1.43 -1.26 -0.29 118.68 127.83 1jmi s LEU 284 Ca 0.01 0.74 -0.29 0.00 -1.03 0.00 0.00 54.13 53.56 1jmi s LEU 284 Cb -0.17 -3.61 -0.02 0.00 0.03 0.00 0.00 46.19 42.42 1jmi s LEU 284 CO -0.11 -0.34 1.46 0.21 0.23 0.00 0.00 176.35 177.79 1jmi s ASN 285 N -3.63 6.65 0.09 2.29 3.84 -0.56 -4.91 114.94 118.71 1jmi s ASN 285 Ca 0.44 1.65 -0.19 0.00 0.21 0.00 0.00 52.86 54.98 1jmi s ASN 285 Cb -0.10 -2.54 -0.07 0.00 -0.55 0.00 0.00 41.25 37.99 1jmi s ASN 285 CO 0.35 -1.03 1.58 -0.65 -2.79 0.00 0.00 177.10 174.57 1jmi h PRO 286 N 9.53 0.42 -0.71 0.43 0.11 -1.96 -3.20 132.00 136.62 1jmi h PRO 286 Ca -0.31 -0.11 -0.05 0.00 0.11 0.00 0.00 66.00 65.65 1jmi h PRO 286 Cb 1.13 -0.05 -0.03 0.00 0.11 0.00 0.00 31.00 32.16 1jmi h PRO 286 CO 0.99 0.53 0.25 -0.44 -0.21 0.00 0.00 178.00 179.12 1jmi h ASP 287 N 0.24 1.00 -3.56 -2.05 5.19 -2.02 -3.41 116.42 111.82 1jmi h ASP 287 Ca 0.08 -0.17 -0.52 0.00 -0.62 0.00 0.00 57.03 55.80 1jmi h ASP 287 Cb 0.30 -0.26 -0.03 0.00 0.18 0.00 0.00 39.33 39.52 1jmi h ASP 287 CO 0.00 0.92 0.21 -0.75 -3.12 0.00 0.00 179.24 176.50 1jmi s LYS 288 N -5.42 4.61 0.00 3.56 2.47 -1.21 -4.94 119.74 118.81 1jmi s LYS 288 Ca -0.12 1.21 0.00 0.00 -1.56 0.00 0.00 55.97 55.50 1jmi s LYS 288 Cb 0.16 -3.27 0.00 0.00 -1.46 0.00 0.00 37.83 33.26 1jmi s LYS 288 CO 0.83 0.56 0.00 0.72 0.16 0.00 0.00 175.35 177.62 1jmi n HIS 289 N 1.60 0.00 -2.34 4.03 8.25 -1.26 -4.76 115.22 120.73 1jmi n HIS 289 Ca -0.05 0.00 -0.38 0.00 -0.26 0.00 0.00 57.72 57.03 1jmi n HIS 289 Cb 0.48 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.56 1jmi n HIS 289 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1jmi s ASP 290 N -1.37 5.85 0.62 0.41 2.15 -1.26 -4.43 116.67 118.64 1jmi s ASP 290 Ca 0.00 -0.49 0.41 0.00 0.43 0.00 0.00 52.55 52.91 1jmi s ASP 290 Cb 0.00 -2.55 2.23 0.00 -0.30 0.00 0.00 42.92 42.30 1jmi s ASP 290 CO 0.00 -2.04 2.26 0.16 -0.17 0.00 0.00 175.17 175.37 1jmi h ILE 291 N 6.60 0.00 0.00 4.11 3.07 -1.94 -0.50 117.51 128.85 1jmi h ILE 291 Ca -0.12 0.00 0.00 0.00 1.55 0.00 0.00 64.86 66.29 1jmi h ILE 291 Cb 1.06 0.91 0.00 0.00 -0.27 0.00 0.00 36.82 38.53 1jmi h ILE 291 CO 1.29 0.00 0.00 0.49 -1.05 0.00 0.00 178.15 178.88 1jmi n PHE 292 N -2.96 0.62 -1.12 0.16 3.72 -1.26 -3.20 117.46 113.43 1jmi n PHE 292 Ca -0.03 0.19 0.08 0.00 -0.05 0.00 0.00 57.45 57.64 1jmi n PHE 292 Cb 0.08 -0.81 0.19 0.00 -0.94 0.00 0.00 39.48 38.00 1jmi n PHE 292 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46 1jmi n ASP 293 N -2.02 2.83 -4.86 4.37 8.00 -0.20 -4.69 116.55 119.98 1jmi n ASP 293 Ca 0.06 -3.19 -0.30 0.00 0.71 0.00 0.00 54.79 52.06 1jmi n ASP 293 Cb 0.37 -0.50 0.04 0.00 -0.02 0.00 0.00 41.12 41.02 1jmi n ASP 293 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 1jmi s PHE 294 N -2.93 3.32 0.10 1.24 0.40 -1.19 -5.02 117.98 113.91 1jmi s PHE 294 Ca 0.37 1.17 -0.04 0.00 -0.60 0.00 0.00 56.93 57.83 1jmi s PHE 294 Cb 0.32 -2.96 -0.03 0.00 0.51 0.00 0.00 43.02 40.87 1jmi s PHE 294 CO 0.04 -1.13 0.10 0.34 0.70 0.00 0.00 175.22 175.27 1jmi s ASP 295 N -4.19 0.27 0.30 1.36 2.15 -1.26 -5.03 116.67 110.27 1jmi s ASP 295 Ca 0.58 -0.96 0.11 0.00 0.43 0.00 0.00 52.55 52.70 1jmi s ASP 295 Cb -0.12 0.30 0.94 0.00 -0.30 0.00 0.00 42.92 43.75 1jmi s ASP 295 CO 0.53 -0.72 1.38 0.23 -0.17 0.00 0.00 175.17 176.42 1jmi n MET 296 N -0.05 -0.06 0.32 4.34 2.81 -1.26 -0.57 117.12 122.64 1jmi n MET 296 Ca -0.10 1.26 0.19 0.00 -1.81 0.00 0.00 57.70 57.24 1jmi n MET 296 Cb 0.62 -2.13 1.07 0.00 -0.71 0.00 0.00 33.22 32.07 1jmi n MET 296 CO 0.00 0.00 0.00 1.57 1.51 0.00 0.00 175.97 179.05 1jmi h LYS 297 N 0.00 0.00 -0.01 0.03 2.10 -2.03 -2.82 116.57 113.84 1jmi h LYS 297 Ca 0.64 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.29 1jmi h LYS 297 Cb 1.56 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.89 1jmi h LYS 297 CO -0.75 0.00 -0.15 -0.25 -2.00 0.00 0.00 179.45 176.30 1jmi n ASP 298 N -3.38 1.13 -4.06 7.07 8.00 0.26 -4.76 116.55 120.80 1jmi n ASP 298 Ca -0.03 -1.08 -0.32 0.00 0.71 0.00 0.00 54.79 54.08 1jmi n ASP 298 Cb 0.11 0.07 -0.15 0.00 -0.02 0.00 0.00 41.12 41.13 1jmi n ASP 298 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1jmi s ILE 299 N -2.32 2.18 -0.20 0.53 1.01 -1.06 -1.50 121.20 119.85 1jmi s ILE 299 Ca 0.30 -1.73 -0.06 0.00 0.00 0.00 0.00 60.65 59.15 1jmi s ILE 299 Cb 0.20 -2.33 -0.03 0.00 0.01 0.00 0.00 42.46 40.30 1jmi s ILE 299 CO 0.45 -0.11 0.04 -0.75 0.00 0.00 0.00 174.94 174.57 1jmi s LYS 300 N 1.07 3.78 -0.12 2.79 2.47 0.61 -4.95 119.74 125.40 1jmi s LYS 300 Ca -0.06 -0.44 -0.13 0.00 -1.56 0.00 0.00 55.97 53.78 1jmi s LYS 300 Cb -0.20 -3.16 -0.05 0.00 -1.46 0.00 0.00 37.83 32.96 1jmi s LYS 300 CO -0.05 0.11 0.30 -1.17 0.16 0.00 0.00 175.35 174.70 1jmi s LEU 301 N 0.79 4.32 0.15 5.43 2.96 -1.26 0.62 118.68 131.68 1jmi s LEU 301 Ca 0.02 0.61 0.10 0.00 -0.22 0.00 0.00 54.13 54.64 1jmi s LEU 301 Cb -0.14 -2.39 -0.04 0.00 0.50 0.00 0.00 46.19 44.12 1jmi s LEU 301 CO 0.02 0.19 -0.23 -0.76 -1.32 0.00 0.00 176.35 174.25 1jmi s LEU 302 N -0.08 2.38 -1.21 -0.68 1.43 0.37 -4.85 118.68 116.05 1jmi s LEU 302 Ca 0.18 -0.80 -0.27 0.00 -1.03 0.00 0.00 54.13 52.21 1jmi s LEU 302 Cb -0.14 -1.05 0.02 0.00 0.03 0.00 0.00 46.19 45.05 1jmi s LEU 302 CO 0.06 0.09 0.69 0.59 0.23 0.00 0.00 176.35 178.01 1jmi n ASN 303 N 0.58 -4.25 -4.40 2.29 3.02 -1.26 -0.09 115.26 111.15 1jmi n ASN 303 Ca -0.15 -1.18 -0.41 0.00 -0.03 0.00 0.00 54.58 52.81 1jmi n ASN 303 Cb 0.55 -2.41 -0.11 0.00 -0.61 0.00 0.00 39.78 37.20 1jmi n ASN 303 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 1jmi s TYR 304 N -3.56 3.25 -0.65 3.10 5.04 -1.26 -3.76 117.35 119.51 1jmi s TYR 304 Ca 0.45 -0.87 0.05 0.00 -2.44 0.00 0.00 57.07 54.27 1jmi s TYR 304 Cb -0.21 -2.50 0.20 0.00 0.35 0.00 0.00 41.96 39.80 1jmi s TYR 304 CO 0.93 -0.64 0.57 -3.47 -1.34 0.00 0.00 175.55 171.60 1jmi n ASP 305 N 5.05 2.90 -4.89 4.32 2.03 -1.26 -5.09 116.55 119.60 1jmi n ASP 305 Ca -0.11 -3.21 -0.29 0.00 0.52 0.00 0.00 54.79 51.70 1jmi n ASP 305 Cb 0.46 -0.71 -0.02 0.00 -0.72 0.00 0.00 41.12 40.13 1jmi n ASP 305 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 1jmi s PRO 306 N -1.69 3.67 0.73 -0.67 0.04 -1.26 -4.90 135.00 130.92 1jmi s PRO 306 Ca 0.31 0.29 -0.11 0.00 0.04 0.00 0.00 61.00 61.54 1jmi s PRO 306 Cb 0.04 -2.42 0.03 0.00 0.04 0.00 0.00 34.50 32.19 1jmi s PRO 306 CO -0.12 -0.06 1.08 0.71 0.04 0.00 0.00 177.00 178.65 1jmi s TYR 307 N -2.47 2.82 1.17 0.56 1.51 0.26 -4.85 117.35 116.34 1jmi s TYR 307 Ca 0.49 1.50 -0.16 0.00 -1.01 0.00 0.00 57.07 57.88 1jmi s TYR 307 Cb -0.10 -2.98 0.20 0.00 -0.11 0.00 0.00 41.96 38.97 1jmi s TYR 307 CO 0.36 -1.54 0.46 -0.35 -1.11 0.00 0.00 175.55 173.37 1jmi n PRO 308 N -3.31 -2.20 -3.20 -1.71 -0.04 -1.26 -2.27 135.00 121.00 1jmi n PRO 308 Ca 0.08 -0.62 -0.39 0.00 -0.04 0.00 0.00 63.50 62.53 1jmi n PRO 308 Cb 0.53 -1.89 -0.06 0.00 -0.04 0.00 0.00 33.50 32.04 1jmi n PRO 308 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1jmi s ALA 309 N -2.29 3.54 -0.41 0.55 0.00 -1.26 -3.51 121.76 118.38 1jmi s ALA 309 Ca 0.61 0.09 -0.20 0.00 0.00 0.00 0.00 51.96 52.47 1jmi s ALA 309 Cb -0.18 -2.72 0.02 0.00 0.00 0.00 0.00 23.12 20.24 1jmi s ALA 309 CO 0.65 0.32 0.61 0.42 0.00 0.00 0.00 175.76 177.77 1jmi s ILE 310 N -0.89 4.88 0.40 0.00 1.01 -1.26 -4.98 121.20 120.36 1jmi s ILE 310 Ca 0.31 0.19 -0.25 0.00 0.00 0.00 0.00 60.65 60.89 1jmi s ILE 310 Cb -0.20 -4.14 -0.08 0.00 0.01 0.00 0.00 42.46 38.04 1jmi s ILE 310 CO 0.20 -0.49 1.19 -0.54 0.00 0.00 0.00 174.94 175.30 1jmi s LYS 311 N 2.70 4.05 -0.09 2.79 1.02 -1.26 -5.04 119.74 123.92 1jmi s LYS 311 Ca 0.22 1.90 -0.06 0.00 0.02 0.00 0.00 55.97 58.05 1jmi s LYS 311 Cb -0.15 -2.70 0.04 0.00 -0.52 0.00 0.00 37.83 34.50 1jmi s LYS 311 CO 0.17 -0.34 0.22 0.00 -0.92 0.00 0.00 175.35 174.48 1jmi s ALA 312 N -1.38 -0.50 -0.18 5.17 0.00 -1.26 -4.98 121.76 118.63 1jmi s ALA 312 Ca 0.57 0.79 -0.29 0.00 0.00 0.00 0.00 51.96 53.03 1jmi s ALA 312 Cb -0.32 -0.49 -0.04 0.00 0.00 0.00 0.00 23.12 22.27 1jmi s ALA 312 CO 0.40 -0.15 1.76 -1.25 0.00 0.00 0.00 175.76 176.52 1jmi s PRO 313 N 0.80 3.75 0.40 0.00 0.04 -1.26 -4.95 135.00 133.78 1jmi s PRO 313 Ca -0.06 1.87 -0.25 0.00 0.04 0.00 0.00 61.00 62.61 1jmi s PRO 313 Cb -0.07 -4.11 -0.08 0.00 0.04 0.00 0.00 34.50 30.28 1jmi s PRO 313 CO -0.05 -1.36 1.18 0.08 0.04 0.00 0.00 177.00 176.89 1jmi s VAL 314 N 5.54 3.13 0.64 -0.36 1.01 -1.26 -4.91 120.40 124.19 1jmi s VAL 314 Ca 0.78 0.94 -0.07 0.00 0.00 0.00 0.00 61.98 63.64 1jmi s VAL 314 Cb -0.29 -3.53 0.14 0.00 0.00 0.00 0.00 36.38 32.70 1jmi s VAL 314 CO 0.32 0.08 0.87 0.00 0.00 0.00 0.00 175.10 176.37 1jmi n ALA 315 N 0.05 -0.55 0.00 5.51 0.00 -1.26 -5.02 120.51 119.24 1jmi n ALA 315 Ca 0.04 -1.35 0.00 0.00 0.00 0.00 0.00 53.44 52.13 1jmi n ALA 315 Cb 0.46 0.07 0.00 0.00 0.00 0.00 0.00 19.45 19.99 1jmi n ALA 315 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78