#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2rkv s PHE 3 N 0.00 -0.52 -0.38 0.00 -0.12 -1.26 -5.07 117.98 110.63 2rkv s PHE 3 Ca 0.00 0.83 0.03 0.00 -0.05 0.00 0.00 56.93 57.75 2rkv s PHE 3 Cb 0.00 0.44 0.16 0.00 -0.63 0.00 0.00 43.02 42.99 2rkv s PHE 3 CO 0.00 -0.52 0.38 0.21 -0.05 0.00 0.00 175.22 175.24 2rkv s LYS 4 N -1.44 0.67 -0.37 1.99 2.20 -1.25 -4.08 119.74 117.45 2rkv s LYS 4 Ca -0.06 -0.95 -0.11 0.00 -0.36 0.00 0.00 55.97 54.49 2rkv s LYS 4 Cb -0.00 -0.75 0.03 0.00 -1.51 0.00 0.00 37.83 35.59 2rkv s LYS 4 CO 0.04 -1.21 0.21 0.42 -0.36 0.00 0.00 175.35 174.45 2rkv s ILE 5 N 1.33 4.63 0.30 5.43 1.01 -0.19 -4.89 121.20 128.81 2rkv s ILE 5 Ca 0.18 -0.83 -0.30 0.00 0.00 0.00 0.00 60.65 59.70 2rkv s ILE 5 Cb -0.15 -3.58 -0.11 0.00 0.01 0.00 0.00 42.46 38.63 2rkv s ILE 5 CO -0.03 -0.23 1.60 -1.58 0.00 0.00 0.00 174.94 174.70 2rkv s GLN 6 N 1.56 4.11 0.81 2.79 0.74 -1.26 0.32 119.66 128.73 2rkv s GLN 6 Ca 0.02 2.60 -0.13 0.00 0.05 0.00 0.00 55.36 57.91 2rkv s GLN 6 Cb -0.19 -3.01 0.09 0.00 1.10 0.00 0.00 33.01 30.99 2rkv s GLN 6 CO 0.07 -0.65 1.18 -0.51 -0.55 0.00 0.00 175.29 174.83 2rkv s LEU 7 N -0.61 3.10 0.35 3.68 1.43 -0.64 -4.29 118.68 121.71 2rkv s LEU 7 Ca 0.63 2.26 -0.25 0.00 -1.03 0.00 0.00 54.13 55.74 2rkv s LEU 7 Cb -0.48 -4.58 -0.13 0.00 0.03 0.00 0.00 46.19 41.03 2rkv s LEU 7 CO 0.49 -2.61 0.74 0.47 0.23 0.00 0.00 176.35 175.68 2rkv n ASP 8 N -3.41 0.01 -0.36 2.29 8.00 -1.26 -4.43 116.55 117.38 2rkv n ASP 8 Ca 0.13 1.04 0.04 0.00 0.71 0.00 0.00 54.79 56.70 2rkv n ASP 8 Cb 0.51 -1.18 0.19 0.00 -0.02 0.00 0.00 41.12 40.63 2rkv n ASP 8 CO 0.00 0.00 0.00 0.74 -0.39 0.00 0.00 177.20 177.55 2rkv h THR 9 N 1.28 1.05 0.00 -3.53 2.02 -1.87 0.35 112.91 112.21 2rkv h THR 9 Ca -0.39 -0.39 -0.03 0.00 0.77 0.00 0.00 66.41 66.38 2rkv h THR 9 Cb 1.38 -0.18 -0.00 0.00 -1.74 0.00 0.00 68.15 67.61 2rkv h THR 9 CO 0.56 0.21 -0.12 -0.07 0.37 0.00 0.00 175.52 176.46 2rkv h LEU 10 N 1.13 0.00 0.00 2.58 3.38 -1.89 -1.55 115.31 118.96 2rkv h LEU 10 Ca 0.44 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.41 2rkv h LEU 10 Cb 0.23 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.98 2rkv h LEU 10 CO -0.19 0.12 0.00 0.61 0.09 0.00 0.00 178.44 179.07 2rkv n GLY 11 N -1.05 -1.11 0.21 0.83 0.00 0.10 -2.64 105.19 101.53 2rkv n GLY 11 Ca -0.02 -0.15 0.15 0.00 0.00 0.00 0.00 46.02 46.00 2rkv n GLY 11 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2rkv n GLN 12 N -1.19 1.22 -1.67 1.61 1.13 -0.58 -4.51 117.38 113.39 2rkv n GLN 12 Ca 0.16 -0.43 -0.47 0.00 -1.94 0.00 0.00 57.00 54.32 2rkv n GLN 12 Cb 0.18 -1.49 -0.04 0.00 0.11 0.00 0.00 30.24 29.00 2rkv n GLN 12 CO 0.00 0.00 0.00 1.28 -1.44 0.00 0.00 177.06 176.90 2rkv n LEU 13 N -0.52 3.23 -0.32 1.08 4.77 -1.08 -4.89 117.00 119.27 2rkv n LEU 13 Ca 0.20 1.03 0.11 0.00 -0.03 0.00 0.00 56.01 57.33 2rkv n LEU 13 Cb 0.24 -1.40 0.33 0.00 -2.33 0.00 0.00 43.42 40.26 2rkv n LEU 13 CO 0.18 -0.20 1.22 -0.65 -1.33 0.00 0.00 177.39 176.62 2rkv h PRO 14 N 7.37 0.77 -0.52 3.23 0.11 -1.81 -2.12 132.00 139.03 2rkv h PRO 14 Ca -0.47 -0.05 -0.03 0.00 0.11 0.00 0.00 66.00 65.56 2rkv h PRO 14 Cb 1.26 -0.17 -0.02 0.00 0.11 0.00 0.00 31.00 32.18 2rkv h PRO 14 CO 0.91 0.51 0.20 0.78 -0.21 0.00 0.00 178.00 180.19 2rkv h GLY 15 N 0.79 0.85 1.73 -0.55 0.00 -1.90 -3.09 103.07 100.91 2rkv h GLY 15 Ca 0.50 -0.48 -0.13 0.00 0.00 0.00 0.00 47.33 47.22 2rkv h GLY 15 CO -0.26 0.45 -0.50 1.41 0.00 0.00 0.00 176.54 177.64 2rkv h LEU 16 N 0.71 0.31 -0.66 3.11 3.38 -1.74 -3.08 115.31 117.34 2rkv h LEU 16 Ca 0.17 -0.15 0.00 0.00 0.09 0.00 0.00 57.88 57.99 2rkv h LEU 16 Cb 0.22 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 40.88 2rkv h LEU 16 CO -0.01 0.76 0.00 0.18 0.09 0.00 0.00 178.44 179.46 2rkv n LEU 17 N -3.96 0.50 -0.54 1.67 4.77 -0.94 -2.23 117.00 116.27 2rkv n LEU 17 Ca -0.02 0.64 0.07 0.00 -0.03 0.00 0.00 56.01 56.67 2rkv n LEU 17 Cb 0.55 -0.60 0.06 0.00 -2.33 0.00 0.00 43.42 41.10 2rkv n LEU 17 CO 0.43 -0.57 0.47 -1.54 -1.33 0.00 0.00 177.39 174.86 2rkv n SER 18 N -2.07 2.17 -4.49 -1.43 3.41 -1.16 -4.84 113.62 105.20 2rkv n SER 18 Ca 0.02 -1.58 -0.31 0.00 -0.26 0.00 0.00 58.87 56.73 2rkv n SER 18 Cb 0.18 -0.02 -0.12 0.00 -0.26 0.00 0.00 64.21 63.99 2rkv n SER 18 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 2rkv s ILE 19 N -1.09 3.03 -0.14 -1.33 1.01 -1.13 -3.61 121.20 117.94 2rkv s ILE 19 Ca 0.16 -1.03 -0.01 0.00 0.00 0.00 0.00 60.65 59.77 2rkv s ILE 19 Cb 0.11 -2.28 -0.02 0.00 0.01 0.00 0.00 42.46 40.29 2rkv s ILE 19 CO 0.17 0.38 -0.11 -0.31 0.00 0.00 0.00 174.94 175.07 2rkv s TYR 20 N -0.92 2.87 -0.15 3.97 1.51 -0.38 -1.32 117.35 122.93 2rkv s TYR 20 Ca 0.15 -0.61 -0.25 0.00 -1.01 0.00 0.00 57.07 55.35 2rkv s TYR 20 Cb -0.11 -1.89 -0.02 0.00 -0.11 0.00 0.00 41.96 39.84 2rkv s TYR 20 CO 0.05 -0.21 0.82 0.99 -1.11 0.00 0.00 175.55 176.09 2rkv s THR 21 N 0.46 4.91 0.01 -0.71 2.01 -0.38 -4.41 115.64 117.52 2rkv s THR 21 Ca -0.08 1.62 0.03 0.00 0.31 0.00 0.00 61.69 63.57 2rkv s THR 21 Cb -0.15 -4.13 -0.03 0.00 0.01 0.00 0.00 72.50 68.19 2rkv s THR 21 CO 0.04 0.07 -0.06 -1.10 -0.69 0.00 0.00 174.62 172.88 2rkv s GLN 22 N 1.89 2.57 -0.06 4.92 -0.21 -1.26 -1.05 119.66 126.45 2rkv s GLN 22 Ca 0.39 -0.72 -0.07 0.00 0.02 0.00 0.00 55.36 54.97 2rkv s GLN 22 Cb -0.17 -2.52 0.02 0.00 1.00 0.00 0.00 33.01 31.34 2rkv s GLN 22 CO 0.14 0.60 0.19 -1.50 -2.12 0.00 0.00 175.29 172.59 2rkv s ILE 23 N -1.03 0.01 -0.04 1.08 1.10 -0.76 -4.48 121.20 117.08 2rkv s ILE 23 Ca 0.18 -0.09 0.07 0.00 -0.51 0.00 0.00 60.65 60.29 2rkv s ILE 23 Cb -0.11 -0.30 -0.02 0.00 0.15 0.00 0.00 42.46 42.18 2rkv s ILE 23 CO 0.09 -0.05 -0.23 -0.44 -2.11 0.00 0.00 174.94 172.19 2rkv s SER 24 N -0.10 3.27 -0.15 4.50 0.01 0.20 -0.91 113.70 120.52 2rkv s SER 24 Ca -0.02 -0.42 0.01 0.00 1.31 0.00 0.00 55.95 56.83 2rkv s SER 24 Cb -0.02 -0.57 -0.00 0.00 0.21 0.00 0.00 66.02 65.64 2rkv s SER 24 CO 0.00 0.31 -0.17 -0.76 0.41 0.00 0.00 173.24 173.03 2rkv s LEU 25 N -0.52 2.41 -0.18 2.44 1.02 0.78 -0.92 118.68 123.71 2rkv s LEU 25 Ca 0.07 -0.49 -0.07 0.00 0.02 0.00 0.00 54.13 53.66 2rkv s LEU 25 Cb -0.11 -1.54 -0.04 0.00 0.02 0.00 0.00 46.19 44.52 2rkv s LEU 25 CO 0.00 0.10 0.07 -0.22 0.02 0.00 0.00 176.35 176.32 2rkv s LEU 26 N 0.75 3.89 -0.00 1.79 2.96 -0.75 -0.30 118.68 127.02 2rkv s LEU 26 Ca -0.07 0.13 0.05 0.00 -0.22 0.00 0.00 54.13 54.02 2rkv s LEU 26 Cb -0.16 -1.98 -0.01 0.00 0.50 0.00 0.00 46.19 44.54 2rkv s LEU 26 CO 0.01 0.20 -0.17 -0.31 -1.32 0.00 0.00 176.35 174.75 2rkv s TYR 27 N 0.22 1.55 0.49 5.38 2.02 -0.00 0.22 117.35 127.22 2rkv s TYR 27 Ca 0.05 -0.30 -0.21 0.00 -0.37 0.00 0.00 57.07 56.24 2rkv s TYR 27 Cb -0.12 -0.99 -0.07 0.00 -0.40 0.00 0.00 41.96 40.38 2rkv s TYR 27 CO 0.00 -0.01 1.10 -1.25 -1.57 0.00 0.00 175.55 173.81 2rkv s PRO 28 N -0.52 3.69 -0.17 -1.71 0.04 -1.26 -0.30 135.00 134.77 2rkv s PRO 28 Ca 0.06 1.55 -0.01 0.00 0.04 0.00 0.00 61.00 62.64 2rkv s PRO 28 Cb -0.07 -2.18 0.05 0.00 0.04 0.00 0.00 34.50 32.33 2rkv s PRO 28 CO -0.00 -0.56 -0.04 0.08 0.04 0.00 0.00 177.00 176.52 2rkv s VAL 29 N -1.78 1.02 0.22 -0.36 1.01 -0.06 -4.77 120.40 115.67 2rkv s VAL 29 Ca 0.67 -0.64 -0.04 0.00 0.00 0.00 0.00 61.98 61.97 2rkv s VAL 29 Cb -0.22 -1.26 0.05 0.00 0.00 0.00 0.00 36.38 34.95 2rkv s VAL 29 CO 0.26 0.06 1.65 0.77 0.00 0.00 0.00 175.10 177.84 2rkv h SER 30 N 8.13 0.80 -3.56 3.32 4.64 -1.97 -3.36 113.55 121.56 2rkv h SER 30 Ca -0.22 -0.27 -0.26 0.00 -0.47 0.00 0.00 61.79 60.56 2rkv h SER 30 Cb 1.11 -0.22 -0.32 0.00 -0.31 0.00 0.00 62.40 62.66 2rkv h SER 30 CO 0.38 0.97 -0.68 -0.62 -0.87 0.00 0.00 176.83 176.01 2rkv s ASP 31 N -6.73 -0.00 0.63 4.97 -1.08 -1.26 -5.01 116.67 108.19 2rkv s ASP 31 Ca -0.09 0.12 0.37 0.00 -0.52 0.00 0.00 52.55 52.42 2rkv s ASP 31 Cb 0.13 0.03 2.00 0.00 -1.46 0.00 0.00 42.92 43.63 2rkv s ASP 31 CO 0.83 -0.10 2.13 0.28 0.52 0.00 0.00 175.17 178.82 2rkv h SER 32 N 6.96 0.00 0.00 -0.34 0.02 -2.00 -1.09 113.55 117.10 2rkv h SER 32 Ca -0.40 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.55 2rkv h SER 32 Cb 1.15 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.69 2rkv h SER 32 CO 0.47 0.00 0.07 0.77 -1.14 0.00 0.00 176.83 177.00 2rkv h SER 33 N 0.00 0.00 1.50 3.07 4.64 -1.99 -2.70 113.55 118.07 2rkv h SER 33 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2rkv h SER 33 Cb 0.26 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.35 2rkv h SER 33 CO 0.00 0.00 -0.36 1.56 -0.87 0.00 0.00 176.83 177.16 2rkv h GLN 34 N 0.00 0.00 -0.49 4.77 4.20 -1.63 -3.39 115.11 118.56 2rkv h GLN 34 Ca 0.00 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.70 2rkv h GLN 34 Cb 0.14 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 27.90 2rkv h GLN 34 CO 0.00 0.00 0.27 1.88 -0.67 0.00 0.00 178.83 180.31 2rkv h TYR 35 N 0.00 0.68 -0.85 2.96 0.05 -1.68 -2.01 116.97 116.11 2rkv h TYR 35 Ca 0.00 -0.02 0.10 0.00 0.05 0.00 0.00 58.73 58.86 2rkv h TYR 35 Cb 0.93 -0.22 -0.07 0.00 1.01 0.00 0.00 36.73 38.38 2rkv h TYR 35 CO 0.00 0.51 0.50 -1.35 -1.05 0.00 0.00 178.16 176.77 2rkv h PRO 36 N 0.65 0.81 -0.15 4.88 0.11 -1.82 -1.30 132.00 135.19 2rkv h PRO 36 Ca 0.17 -0.05 -0.16 0.00 0.11 0.00 0.00 66.00 66.08 2rkv h PRO 36 Cb 0.06 -0.18 -0.01 0.00 0.11 0.00 0.00 31.00 30.98 2rkv h PRO 36 CO -0.03 0.54 -0.57 1.15 -0.21 0.00 0.00 178.00 178.87 2rkv h THR 37 N 0.83 1.34 -0.34 -1.15 2.02 -1.81 -1.06 112.91 112.74 2rkv h THR 37 Ca 0.41 -1.86 0.07 0.00 0.77 0.00 0.00 66.41 65.81 2rkv h THR 37 Cb 0.37 1.85 -0.07 0.00 -1.74 0.00 0.00 68.15 68.55 2rkv h THR 37 CO -0.24 0.57 -0.10 0.40 0.37 0.00 0.00 175.52 176.51 2rkv h ILE 38 N 0.36 0.62 -0.20 3.11 2.04 -0.70 0.02 117.51 122.75 2rkv h ILE 38 Ca 0.00 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 65.82 2rkv h ILE 38 Cb 1.11 0.62 -0.01 0.00 -0.74 0.00 0.00 36.82 37.80 2rkv h ILE 38 CO 0.10 0.00 -0.02 0.58 0.00 0.00 0.00 178.15 178.81 2rkv h VAL 39 N -0.02 1.27 -0.55 1.67 2.07 -0.99 -1.50 116.25 118.19 2rkv h VAL 39 Ca 0.17 -0.94 -0.09 0.00 0.82 0.00 0.00 66.70 66.66 2rkv h VAL 39 Cb 0.28 1.48 -0.02 0.00 -1.52 0.00 0.00 31.29 31.51 2rkv h VAL 39 CO -0.37 0.29 -0.02 0.77 0.02 0.00 0.00 177.57 178.26 2rkv h SER 40 N 0.12 0.94 -0.47 0.57 4.64 -1.07 0.22 113.55 118.50 2rkv h SER 40 Ca 0.06 -0.26 0.00 0.00 -0.47 0.00 0.00 61.79 61.11 2rkv h SER 40 Cb 0.44 -0.25 -0.02 0.00 -0.31 0.00 0.00 62.40 62.25 2rkv h SER 40 CO 0.01 1.01 0.30 0.74 -0.87 0.00 0.00 176.83 178.02 2rkv h THR 41 N 0.88 1.14 -0.50 2.95 2.02 -0.93 -0.45 112.91 118.02 2rkv h THR 41 Ca 0.16 -0.28 -0.06 0.00 0.77 0.00 0.00 66.41 67.00 2rkv h THR 41 Cb 0.54 0.48 -0.02 0.00 -1.74 0.00 0.00 68.15 67.41 2rkv h THR 41 CO 0.03 0.13 0.09 0.15 0.37 0.00 0.00 175.52 176.30 2rkv h PHE 42 N 0.63 0.87 -0.60 3.16 3.04 -0.94 -1.02 116.94 122.08 2rkv h PHE 42 Ca 0.17 -0.12 -0.09 0.00 3.98 0.00 0.00 57.97 61.91 2rkv h PHE 42 Cb -0.04 -0.24 -0.02 0.00 2.56 0.00 0.00 35.95 38.21 2rkv h PHE 42 CO -0.04 0.79 0.02 0.93 -2.02 0.00 0.00 178.31 177.99 2rkv h GLU 43 N 0.70 1.04 -0.46 1.11 5.08 -0.79 -1.05 114.58 120.22 2rkv h GLU 43 Ca 0.15 -0.31 -0.08 0.00 -1.00 0.00 0.00 59.36 58.12 2rkv h GLU 43 Cb 0.38 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.50 2rkv h GLU 43 CO 0.01 1.00 -0.05 1.96 -1.00 0.00 0.00 179.01 180.93 2rkv h GLN 44 N 0.95 0.79 -0.30 2.33 4.20 -0.95 -1.46 115.11 120.66 2rkv h GLN 44 Ca 0.17 -0.23 -0.01 0.00 0.06 0.00 0.00 58.65 58.64 2rkv h GLN 44 Cb 0.53 -0.08 -0.01 0.00 0.30 0.00 0.00 27.48 28.21 2rkv h GLN 44 CO 0.03 0.83 0.15 0.78 -0.67 0.00 0.00 178.83 179.95 2rkv h GLY 45 N 0.97 0.47 1.01 3.46 0.00 -0.75 -1.07 103.07 107.16 2rkv h GLY 45 Ca 0.13 -0.22 0.01 0.00 0.00 0.00 0.00 47.33 47.25 2rkv h GLY 45 CO 0.03 0.21 0.57 1.41 0.00 0.00 0.00 176.54 178.76 2rkv h LEU 46 N 0.36 1.01 0.14 3.11 3.38 -0.92 -0.13 115.31 122.26 2rkv h LEU 46 Ca 0.11 -0.03 -0.01 0.00 0.09 0.00 0.00 57.88 58.04 2rkv h LEU 46 Cb 0.10 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 40.60 2rkv h LEU 46 CO -0.01 0.73 -0.07 0.50 0.09 0.00 0.00 178.44 179.68 2rkv h LYS 47 N 1.18 -0.18 -0.76 1.13 3.64 -1.08 -1.30 116.57 119.20 2rkv h LYS 47 Ca 0.32 0.01 0.04 0.00 -1.27 0.00 0.00 60.65 59.75 2rkv h LYS 47 Cb -0.13 0.04 -0.05 0.00 -0.41 0.00 0.00 32.23 31.68 2rkv h LYS 47 CO -0.07 -0.05 0.47 0.00 -2.27 0.00 0.00 179.45 177.53 2rkv h ARG 48 N -0.27 0.87 -0.32 1.90 3.08 -0.92 -1.05 114.38 117.67 2rkv h ARG 48 Ca -0.02 -0.05 -0.02 0.00 0.07 0.00 0.00 59.98 59.96 2rkv h ARG 48 Cb 0.21 -0.20 -0.01 0.00 0.08 0.00 0.00 29.97 30.05 2rkv h ARG 48 CO 0.03 0.57 0.13 0.35 -1.07 0.00 0.00 179.97 179.99 2rkv h PHE 49 N 0.89 0.48 -0.56 3.04 -0.00 -0.93 -1.64 116.94 118.22 2rkv h PHE 49 Ca 0.32 -0.03 -0.03 0.00 -0.00 0.00 0.00 57.97 58.22 2rkv h PHE 49 Cb 0.08 -0.14 -0.03 0.00 -0.00 0.00 0.00 35.95 35.86 2rkv h PHE 49 CO -0.04 0.45 0.22 0.77 -0.00 0.00 0.00 178.31 179.71 2rkv h SER 50 N 0.37 0.74 -0.50 0.41 0.02 -0.90 0.23 113.55 113.91 2rkv h SER 50 Ca 0.11 -0.09 -0.08 0.00 -0.84 0.00 0.00 61.79 60.88 2rkv h SER 50 Cb 0.17 -0.19 -0.02 0.00 0.14 0.00 0.00 62.40 62.51 2rkv h SER 50 CO -0.01 0.67 -0.01 -0.33 -1.14 0.00 0.00 176.83 176.01 2rkv h GLU 51 N 0.80 0.89 -0.22 3.45 5.08 -0.94 -1.84 114.58 121.79 2rkv h GLU 51 Ca 0.19 -0.29 -0.11 0.00 -1.00 0.00 0.00 59.36 58.15 2rkv h GLU 51 Cb 0.17 -0.08 -0.00 0.00 0.50 0.00 0.00 28.75 29.34 2rkv h GLU 51 CO -0.02 0.93 -0.30 0.00 -1.00 0.00 0.00 179.01 178.62 2rkv h ALA 52 N 0.93 0.34 -2.59 3.43 0.00 -0.73 -3.39 119.26 117.25 2rkv h ALA 52 Ca 0.14 -0.41 -0.60 0.00 0.00 0.00 0.00 54.91 54.04 2rkv h ALA 52 Cb 0.53 -0.07 -0.39 0.00 0.00 0.00 0.00 17.79 17.87 2rkv h ALA 52 CO 0.03 0.36 -0.85 0.08 0.00 0.00 0.00 179.25 178.87 2rkv s VAL 53 N -4.21 1.08 0.45 0.00 1.01 0.76 -5.01 120.40 114.46 2rkv s VAL 53 Ca -0.13 -3.08 0.24 0.00 0.00 0.00 0.00 61.98 59.01 2rkv s VAL 53 Cb 0.07 -1.73 0.43 0.00 0.00 0.00 0.00 36.38 35.16 2rkv s VAL 53 CO 0.81 -1.16 1.81 -0.65 0.00 0.00 0.00 175.10 175.92 2rkv h PRO 54 N 5.64 0.26 0.00 2.72 0.11 -1.55 -2.47 132.00 136.71 2rkv h PRO 54 Ca 0.22 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 66.31 2rkv h PRO 54 Cb 0.87 -0.06 -0.00 0.00 0.11 0.00 0.00 31.00 31.92 2rkv h PRO 54 CO 0.47 0.17 -0.01 0.11 -0.21 0.00 0.00 178.00 178.53 2rkv h TRP 55 N 0.27 0.00 0.00 0.65 5.08 -1.94 -2.15 115.95 117.86 2rkv h TRP 55 Ca 0.54 0.00 -0.01 0.00 1.08 0.00 0.00 58.89 60.51 2rkv h TRP 55 Cb 1.62 0.00 -0.00 0.00 -3.00 0.00 0.00 29.16 27.78 2rkv h TRP 55 CO -0.00 0.01 -0.04 -0.39 -1.28 0.00 0.00 178.44 176.73 2rkv h VAL 56 N 0.00 0.33 -0.24 0.12 -1.51 -1.80 -0.31 116.25 112.85 2rkv h VAL 56 Ca -0.00 -0.23 0.00 0.00 -1.23 0.00 0.00 66.70 65.24 2rkv h VAL 56 Cb 0.25 1.17 0.00 0.00 -2.13 0.00 0.00 31.29 30.58 2rkv h VAL 56 CO 0.00 0.04 0.00 0.00 -1.23 0.00 0.00 177.57 176.38 2rkv n ALA 57 N -2.21 2.49 -1.51 5.19 0.00 -0.81 -4.27 120.51 119.39 2rkv n ALA 57 Ca -0.02 -0.57 0.00 0.00 0.00 0.00 0.00 53.44 52.85 2rkv n ALA 57 Cb 0.15 -1.05 0.00 0.00 0.00 0.00 0.00 19.45 18.56 2rkv n ALA 57 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2rkv n GLY 58 N 1.12 -0.34 3.17 0.00 0.00 -0.13 -2.88 105.19 106.13 2rkv n GLY 58 Ca 0.15 -1.79 -0.13 0.00 0.00 0.00 0.00 46.02 44.25 2rkv n GLY 58 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2rkv s GLN 59 N -2.72 0.83 -0.24 1.61 -2.07 -0.02 -1.29 119.66 115.77 2rkv s GLN 59 Ca 0.00 -1.20 -0.18 0.00 -1.82 0.00 0.00 55.36 52.15 2rkv s GLN 59 Cb 0.00 -0.42 -0.03 0.00 -1.09 0.00 0.00 33.01 31.47 2rkv s GLN 59 CO 0.00 0.05 0.53 0.08 -1.32 0.00 0.00 175.29 174.63 2rkv s VAL 60 N -2.78 5.07 -0.09 3.63 1.01 0.68 -1.08 120.40 126.85 2rkv s VAL 60 Ca 0.07 0.94 0.01 0.00 0.00 0.00 0.00 61.98 62.99 2rkv s VAL 60 Cb -0.01 -3.85 0.02 0.00 0.00 0.00 0.00 36.38 32.55 2rkv s VAL 60 CO -0.01 0.11 -0.08 -0.75 0.00 0.00 0.00 175.10 174.37 2rkv s LYS 61 N 2.09 1.45 0.30 2.72 2.20 0.39 -4.28 119.74 124.62 2rkv s LYS 61 Ca 0.23 -0.27 -0.18 0.00 -0.36 0.00 0.00 55.97 55.39 2rkv s LYS 61 Cb -0.16 -1.41 -0.09 0.00 -1.51 0.00 0.00 37.83 34.67 2rkv s LYS 61 CO 0.09 -0.15 0.78 0.00 -0.36 0.00 0.00 175.35 175.70 2rkv s ALA 62 N 1.30 3.31 0.14 3.13 0.00 -1.26 -1.29 121.76 127.08 2rkv s ALA 62 Ca -0.03 0.16 -0.04 0.00 0.00 0.00 0.00 51.96 52.05 2rkv s ALA 62 Cb -0.14 -2.87 -0.03 0.00 0.00 0.00 0.00 23.12 20.09 2rkv s ALA 62 CO -0.03 0.29 0.15 -1.83 0.00 0.00 0.00 175.76 174.34 2rkv s GLU 63 N -2.61 1.02 -0.90 0.00 -1.05 -0.15 -4.93 118.70 110.08 2rkv s GLU 63 Ca 0.51 -1.32 0.00 0.00 -0.15 0.00 0.00 54.97 54.01 2rkv s GLU 63 Cb -0.13 0.30 0.00 0.00 -0.44 0.00 0.00 34.13 33.86 2rkv s GLU 63 CO 0.18 -0.33 0.00 0.41 0.95 0.00 0.00 175.26 176.48 2rkv n GLY 64 N -0.14 0.88 3.73 -3.83 0.00 -1.26 -0.83 105.19 103.73 2rkv n GLY 64 Ca -0.06 -0.62 -0.41 0.00 0.00 0.00 0.00 46.02 44.92 2rkv n GLY 64 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2rkv s ILE 65 N -2.34 4.13 0.18 -0.61 1.01 -1.26 -4.04 121.20 118.27 2rkv s ILE 65 Ca 0.00 1.78 -0.05 0.00 0.00 0.00 0.00 60.65 62.38 2rkv s ILE 65 Cb 0.00 -4.14 0.02 0.00 0.01 0.00 0.00 42.46 38.35 2rkv s ILE 65 CO 0.00 0.28 0.34 -1.54 0.00 0.00 0.00 174.94 174.02 2rkv n SER 66 N 2.65 -0.98 -4.69 3.58 3.41 -0.18 -4.98 113.62 112.42 2rkv n SER 66 Ca 0.03 -1.80 -0.42 0.00 -0.26 0.00 0.00 58.87 56.42 2rkv n SER 66 Cb 0.47 1.67 -0.03 0.00 -0.26 0.00 0.00 64.21 66.06 2rkv n SER 66 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 2rkv s GLU 67 N -2.13 4.14 -1.86 4.33 8.01 -1.26 -1.45 118.70 128.47 2rkv s GLU 67 Ca 0.09 2.58 0.00 0.00 0.01 0.00 0.00 54.97 57.65 2rkv s GLU 67 Cb -0.02 -3.56 0.00 0.00 -4.31 0.00 0.00 34.13 26.25 2rkv s GLU 67 CO 0.07 -0.83 0.00 0.41 0.01 0.00 0.00 175.26 174.92 2rkv n GLY 68 N 4.20 1.12 2.67 -1.39 0.00 -1.26 -4.97 105.19 105.56 2rkv n GLY 68 Ca 0.17 -0.12 -0.22 0.00 0.00 0.00 0.00 46.02 45.86 2rkv n GLY 68 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2rkv s ASN 69 N -2.60 1.99 0.00 1.61 3.84 -0.53 -3.63 114.94 115.62 2rkv s ASN 69 Ca 0.00 -0.52 0.31 0.00 0.21 0.00 0.00 52.86 52.87 2rkv s ASN 69 Cb 0.00 0.07 1.75 0.00 -0.55 0.00 0.00 41.25 42.52 2rkv s ASN 69 CO 0.00 -0.35 2.14 0.35 -2.79 0.00 0.00 177.10 176.45 2rkv n THR 70 N 5.30 0.00 -4.03 -5.21 -2.24 -0.34 -1.02 114.28 106.75 2rkv n THR 70 Ca -0.06 -0.04 0.00 0.00 -2.27 0.00 0.00 64.05 61.68 2rkv n THR 70 Cb 0.48 -0.34 -0.00 0.00 -2.10 0.00 0.00 70.33 68.38 2rkv n THR 70 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2rkv n GLY 71 N 1.04 -1.95 2.86 3.38 0.00 -1.26 -4.75 105.19 104.51 2rkv n GLY 71 Ca 0.23 -1.37 -0.17 0.00 0.00 0.00 0.00 46.02 44.71 2rkv n GLY 71 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2rkv s THR 72 N -0.03 0.26 0.05 2.61 2.01 -0.01 -4.94 115.64 115.58 2rkv s THR 72 Ca 0.00 -0.01 0.01 0.00 0.31 0.00 0.00 61.69 62.00 2rkv s THR 72 Cb 0.00 -0.31 -0.04 0.00 0.01 0.00 0.00 72.50 72.16 2rkv s THR 72 CO 0.00 0.14 0.15 -0.44 -0.69 0.00 0.00 174.62 173.79 2rkv s SER 73 N 0.73 6.04 0.04 3.53 0.01 -1.26 -0.97 113.70 121.80 2rkv s SER 73 Ca -0.08 0.18 0.02 0.00 1.31 0.00 0.00 55.95 57.38 2rkv s SER 73 Cb -0.11 -1.78 -0.02 0.00 0.21 0.00 0.00 66.02 64.32 2rkv s SER 73 CO -0.01 0.19 -0.07 -0.36 0.41 0.00 0.00 173.24 173.40 2rkv s PHE 74 N -1.43 0.59 -0.21 2.43 0.40 -0.41 -1.62 117.98 117.73 2rkv s PHE 74 Ca 0.31 -0.49 -0.25 0.00 -0.60 0.00 0.00 56.93 55.90 2rkv s PHE 74 Cb -0.13 -0.36 -0.01 0.00 0.51 0.00 0.00 43.02 43.04 2rkv s PHE 74 CO 0.24 -0.10 0.83 0.42 0.70 0.00 0.00 175.22 177.31 2rkv s ILE 75 N -1.36 4.86 0.17 0.64 1.01 0.15 -0.46 121.20 126.21 2rkv s ILE 75 Ca -0.11 1.60 0.02 0.00 0.00 0.00 0.00 60.65 62.16 2rkv s ILE 75 Cb -0.10 -4.13 -0.05 0.00 0.01 0.00 0.00 42.46 38.20 2rkv s ILE 75 CO 0.00 -0.03 -0.01 0.68 0.00 0.00 0.00 174.94 175.58 2rkv s VAL 76 N 2.53 0.78 0.68 2.92 -7.23 -0.24 -1.02 120.40 118.81 2rkv s VAL 76 Ca 0.36 -1.99 -0.17 0.00 -1.81 0.00 0.00 61.98 58.37 2rkv s VAL 76 Cb -0.16 -2.10 -0.01 0.00 0.56 0.00 0.00 36.38 34.67 2rkv s VAL 76 CO 0.09 -0.50 1.01 -2.65 -0.31 0.00 0.00 175.10 172.74 2rkv n PRO 77 N -0.25 0.70 0.00 4.82 -0.02 -1.26 -0.84 135.00 138.15 2rkv n PRO 77 Ca -0.07 0.29 0.00 0.00 -2.02 0.00 0.00 63.50 61.70 2rkv n PRO 77 Cb 0.63 -2.25 0.00 0.00 -0.02 0.00 0.00 33.50 31.86 2rkv n PRO 77 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 2rkv n PHE 78 N -2.20 -0.01 -4.46 6.00 -0.00 -1.26 -4.47 117.46 111.06 2rkv n PHE 78 Ca 0.14 0.00 -0.22 0.00 -0.00 0.00 0.00 57.45 57.37 2rkv n PHE 78 Cb 0.49 0.04 -0.11 0.00 -0.00 0.00 0.00 39.48 39.90 2rkv n PHE 78 CO 0.00 0.00 0.00 -1.21 -0.00 0.00 0.00 176.76 175.55 2rkv s GLU 79 N -0.07 1.67 0.25 -4.13 2.02 -1.14 -5.05 118.70 112.25 2rkv s GLU 79 Ca 0.00 -1.93 -0.05 0.00 0.02 0.00 0.00 54.97 53.01 2rkv s GLU 79 Cb 0.00 -0.91 0.29 0.00 0.10 0.00 0.00 34.13 33.61 2rkv s GLU 79 CO 0.00 -0.18 1.87 -0.44 0.02 0.00 0.00 175.26 176.53 2rkv h ASP 80 N 2.09 1.04 -4.32 -0.19 3.32 -1.99 -3.43 116.42 112.94 2rkv h ASP 80 Ca -0.41 -0.09 -0.28 0.00 0.02 0.00 0.00 57.03 56.27 2rkv h ASP 80 Cb 1.24 -0.26 -0.15 0.00 0.22 0.00 0.00 39.33 40.38 2rkv h ASP 80 CO 0.70 0.84 -0.71 0.68 -1.72 0.00 0.00 179.24 179.03 2rkv s VAL 81 N -5.75 0.92 0.44 -1.35 -7.23 -1.26 -4.86 120.40 101.30 2rkv s VAL 81 Ca -0.12 -1.92 -0.25 0.00 -1.81 0.00 0.00 61.98 57.88 2rkv s VAL 81 Cb 0.17 -1.67 -0.08 0.00 0.56 0.00 0.00 36.38 35.35 2rkv s VAL 81 CO 0.82 -0.76 1.38 -2.84 -0.31 0.00 0.00 175.10 173.39 2rkv s PRO 82 N -3.59 3.73 0.03 4.82 0.02 -1.26 -4.87 135.00 133.89 2rkv s PRO 82 Ca 0.12 2.32 -0.30 0.00 0.02 0.00 0.00 61.00 63.16 2rkv s PRO 82 Cb 0.03 -2.66 -0.06 0.00 0.02 0.00 0.00 34.50 31.83 2rkv s PRO 82 CO -0.02 -0.74 1.31 1.03 -0.33 0.00 0.00 177.00 178.25 2rkv s ARG 83 N -2.42 4.34 -0.08 5.54 0.52 -1.26 -4.94 118.95 120.64 2rkv s ARG 83 Ca 0.60 1.89 0.03 0.00 -0.52 0.00 0.00 55.73 57.74 2rkv s ARG 83 Cb -0.42 -3.44 -0.02 0.00 0.52 0.00 0.00 34.95 31.60 2rkv s ARG 83 CO 0.53 -0.44 -0.17 0.54 0.02 0.00 0.00 175.30 175.78 2rkv s VAL 84 N 1.71 2.75 -0.14 3.52 0.11 -1.26 -1.15 120.40 125.95 2rkv s VAL 84 Ca 0.61 -0.81 -0.05 0.00 -2.93 0.00 0.00 61.98 58.81 2rkv s VAL 84 Cb -0.31 -2.09 -0.04 0.00 -1.53 0.00 0.00 36.38 32.42 2rkv s VAL 84 CO 0.27 0.56 0.03 -0.69 -3.33 0.00 0.00 175.10 171.94 2rkv s VAL 85 N -0.17 4.51 -0.20 2.04 1.01 -0.33 -4.99 120.40 122.28 2rkv s VAL 85 Ca -0.01 -0.15 -0.05 0.00 0.00 0.00 0.00 61.98 61.77 2rkv s VAL 85 Cb -0.14 -2.97 -0.02 0.00 0.00 0.00 0.00 36.38 33.25 2rkv s VAL 85 CO 0.03 0.53 0.00 -0.69 0.00 0.00 0.00 175.10 174.98 2rkv s VAL 86 N -0.20 3.97 -0.12 2.92 1.01 -1.26 -0.59 120.40 126.13 2rkv s VAL 86 Ca 0.06 -0.31 0.02 0.00 0.00 0.00 0.00 61.98 61.75 2rkv s VAL 86 Cb -0.12 -2.79 0.01 0.00 0.00 0.00 0.00 36.38 33.48 2rkv s VAL 86 CO 0.02 0.43 -0.16 -0.54 0.00 0.00 0.00 175.10 174.84 2rkv s LYS 87 N 1.01 2.35 -0.48 2.72 -0.14 -0.04 -4.98 119.74 120.19 2rkv s LYS 87 Ca 0.02 -0.61 -0.17 0.00 -1.36 0.00 0.00 55.97 53.85 2rkv s LYS 87 Cb -0.14 -1.99 0.05 0.00 -1.68 0.00 0.00 37.83 34.08 2rkv s LYS 87 CO 0.02 -0.06 0.50 0.34 -0.76 0.00 0.00 175.35 175.39 2rkv s ASP 88 N 0.98 6.19 -0.00 2.83 2.15 -1.26 -0.54 116.67 127.03 2rkv s ASP 88 Ca -0.06 -1.00 0.13 0.00 0.43 0.00 0.00 52.55 52.05 2rkv s ASP 88 Cb -0.15 -2.24 0.38 0.00 -0.30 0.00 0.00 42.92 40.62 2rkv s ASP 88 CO -0.02 -0.74 1.32 0.18 -0.17 0.00 0.00 175.17 175.74 2rkv n LEU 89 N 5.71 3.17 -0.10 -1.34 4.77 0.93 -4.64 117.00 125.50 2rkv n LEU 89 Ca -0.09 -2.01 0.09 0.00 -0.03 0.00 0.00 56.01 53.97 2rkv n LEU 89 Cb 0.45 -0.29 0.44 0.00 -2.33 0.00 0.00 43.42 41.69 2rkv n LEU 89 CO 0.50 0.79 1.19 0.03 -1.33 0.00 0.00 177.39 178.57 2rkv h ARG 90 N 2.53 0.53 -0.32 3.23 3.08 -1.81 -2.47 114.38 119.16 2rkv h ARG 90 Ca 0.00 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.02 2rkv h ARG 90 Cb 0.79 -0.12 0.00 0.00 0.08 0.00 0.00 29.97 30.72 2rkv h ARG 90 CO 0.00 0.35 0.00 -0.25 -1.07 0.00 0.00 179.97 179.00 2rkv n ASP 91 N -4.48 3.47 -4.53 7.04 8.00 -1.26 -4.51 116.55 120.29 2rkv n ASP 91 Ca 0.09 -2.51 -0.42 0.00 0.71 0.00 0.00 54.79 52.66 2rkv n ASP 91 Cb 0.26 -0.40 -0.08 0.00 -0.02 0.00 0.00 41.12 40.88 2rkv n ASP 91 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2rkv s ASP 92 N -1.44 6.26 0.35 -2.24 -1.08 -0.93 -4.95 116.67 112.64 2rkv s ASP 92 Ca 0.33 -0.28 0.26 0.00 -0.52 0.00 0.00 52.55 52.34 2rkv s ASP 92 Cb 0.24 -2.25 1.20 0.00 -1.46 0.00 0.00 42.92 40.64 2rkv s ASP 92 CO 0.13 -0.53 1.78 1.55 0.52 0.00 0.00 175.17 178.62 2rkv h PRO 93 N 8.60 0.00 -0.00 4.34 0.13 -1.92 -1.71 132.00 141.44 2rkv h PRO 93 Ca -0.27 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.86 2rkv h PRO 93 Cb 1.12 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.25 2rkv h PRO 93 CO 0.78 0.00 -0.46 -1.13 -0.23 0.00 0.00 178.00 176.96 2rkv n SER 94 N -2.42 0.59 -4.88 1.44 3.41 -1.26 -4.94 113.62 105.56 2rkv n SER 94 Ca 0.00 -0.36 -0.30 0.00 -0.26 0.00 0.00 58.87 57.96 2rkv n SER 94 Cb 0.17 0.23 -0.02 0.00 -0.26 0.00 0.00 64.21 64.33 2rkv n SER 94 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2rkv s ALA 95 N -2.92 3.33 0.84 7.33 0.00 -0.64 -5.07 121.76 124.63 2rkv s ALA 95 Ca 0.13 -0.25 -0.11 0.00 0.00 0.00 0.00 51.96 51.73 2rkv s ALA 95 Cb 0.18 -2.73 0.10 0.00 0.00 0.00 0.00 23.12 20.67 2rkv s ALA 95 CO 0.67 -0.16 1.09 -1.25 0.00 0.00 0.00 175.76 176.12 2rkv s PRO 96 N -4.18 1.70 0.21 0.00 0.04 -1.26 -5.00 135.00 126.51 2rkv s PRO 96 Ca 0.51 0.84 0.07 0.00 0.04 0.00 0.00 61.00 62.47 2rkv s PRO 96 Cb -0.10 -1.86 -0.05 0.00 0.04 0.00 0.00 34.50 32.53 2rkv s PRO 96 CO 0.36 -1.94 -0.13 0.95 0.04 0.00 0.00 177.00 176.28 2rkv s THR 97 N -2.99 1.66 0.23 1.26 -4.23 -1.26 -4.32 115.64 105.99 2rkv s THR 97 Ca 0.62 -2.19 -0.08 0.00 -1.18 0.00 0.00 61.69 58.87 2rkv s THR 97 Cb -0.17 -2.07 0.20 0.00 1.34 0.00 0.00 72.50 71.80 2rkv s THR 97 CO 0.56 -0.58 1.89 -0.29 -0.54 0.00 0.00 174.62 175.66 2rkv h ILE 98 N 2.55 1.18 -0.21 2.99 6.09 -1.37 -0.36 117.51 128.38 2rkv h ILE 98 Ca -0.38 -0.38 -0.17 0.00 -1.37 0.00 0.00 64.86 62.57 2rkv h ILE 98 Cb 1.22 -0.02 -0.00 0.00 0.47 0.00 0.00 36.82 38.48 2rkv h ILE 98 CO 0.63 0.20 -0.55 -0.33 -3.07 0.00 0.00 178.15 175.03 2rkv h GLU 99 N 1.10 0.63 -0.52 2.19 4.39 -1.95 -1.24 114.58 119.19 2rkv h GLU 99 Ca 0.32 -0.40 -0.01 0.00 0.34 0.00 0.00 59.36 59.62 2rkv h GLU 99 Cb -0.06 0.05 -0.02 0.00 -0.10 0.00 0.00 28.75 28.61 2rkv h GLU 99 CO -0.09 1.01 0.30 0.78 -1.16 0.00 0.00 179.01 179.85 2rkv h GLY 100 N 0.98 0.76 0.92 -3.84 0.00 -1.88 -0.63 103.07 99.39 2rkv h GLY 100 Ca 0.01 -0.33 -0.02 0.00 0.00 0.00 0.00 47.33 46.99 2rkv h GLY 100 CO 0.11 0.32 0.13 -0.33 0.00 0.00 0.00 176.54 176.76 2rkv h MET 101 N 0.69 0.51 -0.35 4.80 2.86 -0.97 -2.21 114.93 120.26 2rkv h MET 101 Ca 0.18 -0.09 -0.01 0.00 -2.06 0.00 0.00 59.70 57.72 2rkv h MET 101 Cb 0.01 -0.08 -0.02 0.00 0.06 0.00 0.00 31.60 31.57 2rkv h MET 101 CO -0.03 0.51 0.19 0.00 1.06 0.00 0.00 176.91 178.63 2rkv h ARG 102 N 0.39 0.48 -0.91 1.72 3.08 -1.04 0.81 114.38 118.92 2rkv h ARG 102 Ca 0.11 -0.06 -0.00 0.00 0.07 0.00 0.00 59.98 60.10 2rkv h ARG 102 Cb 0.20 -0.09 -0.04 0.00 0.08 0.00 0.00 29.97 30.11 2rkv h ARG 102 CO -0.01 0.41 0.55 -0.22 -1.07 0.00 0.00 179.97 179.63 2rkv h LYS 103 N 0.43 1.23 -0.01 0.04 1.63 -1.06 -2.71 116.57 116.11 2rkv h LYS 103 Ca 0.12 -0.11 0.00 0.00 -0.85 0.00 0.00 60.65 59.81 2rkv h LYS 103 Cb 0.07 -0.26 0.00 0.00 -0.60 0.00 0.00 32.23 31.44 2rkv h LYS 103 CO -0.02 0.86 -0.14 0.00 -3.45 0.00 0.00 179.45 176.69 2rkv n ALA 104 N -2.40 2.85 -2.51 5.00 0.00 -0.84 -4.95 120.51 117.66 2rkv n ALA 104 Ca 0.10 -0.41 -0.09 0.00 0.00 0.00 0.00 53.44 53.05 2rkv n ALA 104 Cb 0.06 -1.17 0.01 0.00 0.00 0.00 0.00 19.45 18.35 2rkv n ALA 104 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2rkv n GLY 105 N 1.27 0.18 3.36 0.00 0.00 -0.39 -4.14 105.19 105.46 2rkv n GLY 105 Ca 0.15 -0.43 -0.18 0.00 0.00 0.00 0.00 46.02 45.55 2rkv n GLY 105 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2rkv n TYR 106 N -3.78 -2.32 -2.09 1.61 4.02 0.14 -4.97 117.16 109.76 2rkv n TYR 106 Ca -0.05 0.79 -0.34 0.00 -0.01 0.00 0.00 57.90 58.29 2rkv n TYR 106 Cb 0.55 -4.09 0.01 0.00 -0.02 0.00 0.00 39.34 35.80 2rkv n TYR 106 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 176.86 174.60 2rkv s PRO 107 N -4.82 3.24 0.38 -0.72 0.04 -1.26 -4.93 135.00 126.93 2rkv s PRO 107 Ca 0.41 1.41 0.08 0.00 0.04 0.00 0.00 61.00 62.94 2rkv s PRO 107 Cb -0.07 -2.01 0.83 0.00 0.04 0.00 0.00 34.50 33.29 2rkv s PRO 107 CO 0.76 -0.90 1.96 1.98 0.04 0.00 0.00 177.00 180.84 2rkv h MET 108 N 0.71 0.63 0.00 4.56 4.05 -1.19 -1.77 114.93 121.91 2rkv h MET 108 Ca -0.48 -0.04 -0.00 0.00 -0.28 0.00 0.00 59.70 58.90 2rkv h MET 108 Cb 1.24 -0.14 -0.00 0.00 -0.80 0.00 0.00 31.60 31.90 2rkv h MET 108 CO 0.56 0.42 -0.02 0.00 0.23 0.00 0.00 176.91 178.10 2rkv h ALA 109 N 1.63 1.38 -0.01 0.39 0.00 -1.92 -0.78 119.26 119.95 2rkv h ALA 109 Ca 0.32 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.21 2rkv h ALA 109 Cb 0.39 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.18 2rkv h ALA 109 CO -0.11 0.02 -0.04 -1.33 0.00 0.00 0.00 179.25 177.80 2rkv n MET 110 N -3.65 1.28 -3.20 0.00 2.00 -0.67 -4.10 117.12 108.78 2rkv n MET 110 Ca -0.03 -0.56 -0.31 0.00 0.00 0.00 0.00 57.70 56.79 2rkv n MET 110 Cb 0.11 -1.49 -0.05 0.00 0.00 0.00 0.00 33.22 31.79 2rkv n MET 110 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 175.97 177.16 2rkv n PHE 111 N -0.37 3.35 -2.46 2.03 3.72 -0.30 -4.68 117.46 118.75 2rkv n PHE 111 Ca 0.19 -3.67 -0.43 0.00 -0.05 0.00 0.00 57.45 53.49 2rkv n PHE 111 Cb 0.28 -0.75 -0.02 0.00 -0.94 0.00 0.00 39.48 38.05 2rkv n PHE 111 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 2rkv s ASP 112 N -2.42 6.84 0.54 4.37 -1.08 -1.26 -0.85 116.67 122.82 2rkv s ASP 112 Ca 0.39 1.40 0.23 0.00 -0.52 0.00 0.00 52.55 54.06 2rkv s ASP 112 Cb 0.15 -2.54 1.43 0.00 -1.46 0.00 0.00 42.92 40.50 2rkv s ASP 112 CO -0.01 -0.90 2.09 1.05 0.52 0.00 0.00 175.17 177.92 2rkv h GLU 113 N 8.60 0.00 0.00 4.34 4.11 -1.85 0.77 114.58 130.55 2rkv h GLU 113 Ca -0.25 0.00 -0.02 0.00 0.07 0.00 0.00 59.36 59.16 2rkv h GLU 113 Cb 1.09 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.34 2rkv h GLU 113 CO 1.00 0.00 -0.08 -0.91 0.07 0.00 0.00 179.01 179.09 2rkv h ASN 114 N 0.00 0.00 0.00 3.06 -0.26 -1.86 -2.36 115.58 114.16 2rkv h ASN 114 Ca 0.11 0.00 -0.34 0.00 -0.56 0.00 0.00 56.30 55.51 2rkv h ASN 114 Cb 0.47 0.00 -0.06 0.00 -1.06 0.00 0.00 38.32 37.67 2rkv h ASN 114 CO -0.00 0.08 -2.27 -0.38 -1.06 0.00 0.00 177.43 173.80 2rkv n ILE 115 N -3.21 1.27 0.31 2.81 5.41 0.08 -4.76 119.36 121.27 2rkv n ILE 115 Ca 0.00 -0.46 0.04 0.00 1.00 0.00 0.00 62.75 63.33 2rkv n ILE 115 Cb 0.36 -1.36 0.03 0.00 -0.71 0.00 0.00 39.64 37.95 2rkv n ILE 115 CO 0.00 0.00 0.00 2.30 0.00 0.00 0.00 176.55 178.85 2rkv n ILE 116 N -3.28 0.00 -4.29 1.39 -6.64 -0.15 -5.00 119.36 101.39 2rkv n ILE 116 Ca -0.40 -0.49 -0.30 0.00 -1.77 0.00 0.00 62.75 59.78 2rkv n ILE 116 Cb 0.90 1.15 -0.10 0.00 -1.44 0.00 0.00 39.64 40.15 2rkv n ILE 116 CO 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 176.55 174.78 2rkv s ALA 117 N -0.67 3.02 -0.74 -1.28 0.00 -0.89 -4.53 121.76 116.68 2rkv s ALA 117 Ca 0.08 -1.16 0.26 0.00 0.00 0.00 0.00 51.96 51.15 2rkv s ALA 117 Cb 0.06 -1.01 0.89 0.00 0.00 0.00 0.00 23.12 23.06 2rkv s ALA 117 CO 0.10 0.64 1.78 -0.35 0.00 0.00 0.00 175.76 177.93 2rkv n PRO 118 N 0.94 0.21 -3.55 0.00 -0.04 -1.26 -4.76 135.00 126.54 2rkv n PRO 118 Ca -0.14 0.22 -0.17 0.00 -0.04 0.00 0.00 63.50 63.37 2rkv n PRO 118 Cb 0.52 -1.77 -0.06 0.00 -0.04 0.00 0.00 33.50 32.15 2rkv n PRO 118 CO 0.00 0.00 0.00 0.50 -0.04 0.00 0.00 175.50 175.96 2rkv s ARG 119 N -3.12 1.01 0.66 0.54 3.52 -1.26 -5.07 118.95 115.22 2rkv s ARG 119 Ca 0.10 0.31 -0.15 0.00 -0.13 0.00 0.00 55.73 55.86 2rkv s ARG 119 Cb 0.13 0.48 -0.00 0.00 -1.56 0.00 0.00 34.95 33.99 2rkv s ARG 119 CO 0.55 -0.29 1.11 0.15 -0.81 0.00 0.00 175.30 176.01 2rkv s LYS 120 N -1.02 2.79 0.12 5.12 1.02 -1.26 -4.97 119.74 121.54 2rkv s LYS 120 Ca -0.10 1.41 -0.18 0.00 0.02 0.00 0.00 55.97 57.12 2rkv s LYS 120 Cb -0.01 -1.95 -0.05 0.00 -0.52 0.00 0.00 37.83 35.31 2rkv s LYS 120 CO 0.09 -1.26 1.71 1.15 -0.92 0.00 0.00 175.35 176.11 2rkv h THR 121 N 0.05 1.14 -2.45 2.17 2.02 -1.97 -3.40 112.91 110.47 2rkv h THR 121 Ca -0.47 -0.38 -0.51 0.00 0.77 0.00 0.00 66.41 65.82 2rkv h THR 121 Cb 1.25 0.88 -0.02 0.00 -1.74 0.00 0.00 68.15 68.52 2rkv h THR 121 CO 0.54 0.14 -0.44 -0.76 0.37 0.00 0.00 175.52 175.37 2rkv s LEU 122 N -9.95 4.32 -1.10 2.58 1.43 -1.26 -1.25 118.68 113.45 2rkv s LEU 122 Ca -0.13 0.15 -0.14 0.00 -1.03 0.00 0.00 54.13 52.98 2rkv s LEU 122 Cb 0.09 -2.92 -0.07 0.00 0.03 0.00 0.00 46.19 43.32 2rkv s LEU 122 CO 0.72 -0.00 2.20 -0.81 0.23 0.00 0.00 176.35 178.69 2rkv n PRO 123 N -0.87 2.30 -4.85 1.29 -0.04 -1.24 -4.84 135.00 126.76 2rkv n PRO 123 Ca -0.07 -1.97 -0.27 0.00 -0.04 0.00 0.00 63.50 61.15 2rkv n PRO 123 Cb 0.55 -2.86 -0.16 0.00 -0.04 0.00 0.00 33.50 30.99 2rkv n PRO 123 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 2rkv s ILE 124 N 3.73 1.48 0.00 0.52 1.01 -1.26 -4.94 121.20 121.74 2rkv s ILE 124 Ca 0.52 -0.71 0.00 0.00 0.00 0.00 0.00 60.65 60.46 2rkv s ILE 124 Cb 0.14 -1.30 0.00 0.00 0.01 0.00 0.00 42.46 41.31 2rkv s ILE 124 CO 0.00 0.43 0.00 0.61 0.00 0.00 0.00 174.94 175.98 2rkv n GLY 125 N 3.46 -2.08 3.76 6.18 0.00 -1.26 -4.84 105.19 110.41 2rkv n GLY 125 Ca -0.20 -1.79 -0.39 0.00 0.00 0.00 0.00 46.02 43.64 2rkv n GLY 125 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2rkv n PRO 126 N -0.06 1.95 -2.14 1.61 -0.02 -1.26 -3.39 135.00 131.70 2rkv n PRO 126 Ca 0.00 0.71 -0.14 0.00 -2.02 0.00 0.00 63.50 62.05 2rkv n PRO 126 Cb 0.00 -2.61 -0.01 0.00 -0.02 0.00 0.00 33.50 30.85 2rkv n PRO 126 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2rkv n GLY 127 N 0.67 0.04 0.10 -1.23 0.00 -1.26 -4.89 105.19 98.62 2rkv n GLY 127 Ca 0.08 -0.31 0.05 0.00 0.00 0.00 0.00 46.02 45.84 2rkv n GLY 127 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2rkv n THR 128 N -3.80 1.17 -1.89 2.61 -2.24 -1.22 -4.85 114.28 104.06 2rkv n THR 128 Ca -0.16 -1.34 -0.31 0.00 -2.27 0.00 0.00 64.05 59.96 2rkv n THR 128 Cb 0.60 0.21 0.01 0.00 -2.10 0.00 0.00 70.33 69.05 2rkv n THR 128 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2rkv s GLY 129 N -1.76 1.75 0.56 3.38 0.00 -1.26 -4.78 107.32 105.20 2rkv s GLY 129 Ca 0.15 0.02 0.27 0.00 0.00 0.00 0.00 44.72 45.15 2rkv s GLY 129 CO 0.01 0.30 2.01 -2.55 0.00 0.00 0.00 173.10 172.88 2rkv h PRO 130 N -0.18 0.00 0.00 2.90 0.11 -2.00 -1.31 132.00 131.53 2rkv h PRO 130 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 2rkv h PRO 130 Cb 1.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 2rkv h PRO 130 CO 0.60 0.00 -0.55 -0.40 -0.21 0.00 0.00 178.00 177.44 2rkv n ASP 131 N -4.07 0.64 -4.78 -2.05 5.75 -1.26 -4.87 116.55 105.91 2rkv n ASP 131 Ca 0.06 0.09 -0.37 0.00 -0.01 0.00 0.00 54.79 54.57 2rkv n ASP 131 Cb 0.51 0.11 -0.05 0.00 -1.03 0.00 0.00 41.12 40.65 2rkv n ASP 131 CO 0.00 0.00 0.00 -1.81 -0.11 0.00 0.00 177.20 175.28 2rkv s ASP 132 N -3.97 7.10 0.58 -1.12 1.01 -0.49 -5.00 116.67 114.77 2rkv s ASP 132 Ca 0.08 1.96 -0.20 0.00 0.71 0.00 0.00 52.55 55.09 2rkv s ASP 132 Cb 0.14 -2.59 -0.04 0.00 1.01 0.00 0.00 42.92 41.45 2rkv s ASP 132 CO 0.70 -0.25 1.34 -2.84 0.21 0.00 0.00 175.17 174.33 2rkv s PRO 133 N -2.18 2.94 -0.64 8.23 0.02 -1.26 -4.85 135.00 137.25 2rkv s PRO 133 Ca 0.53 2.18 0.05 0.00 0.02 0.00 0.00 61.00 63.77 2rkv s PRO 133 Cb -0.21 -2.11 0.16 0.00 0.02 0.00 0.00 34.50 32.35 2rkv s PRO 133 CO 0.27 -1.33 0.41 0.15 -0.33 0.00 0.00 177.00 176.17 2rkv s LYS 134 N -3.07 2.30 0.47 5.54 1.02 -1.26 -4.99 119.74 119.75 2rkv s LYS 134 Ca 0.75 -3.09 -0.24 0.00 0.02 0.00 0.00 55.97 53.42 2rkv s LYS 134 Cb -0.39 -3.39 -0.08 0.00 -0.52 0.00 0.00 37.83 33.44 2rkv s LYS 134 CO 0.45 -1.22 1.29 -2.30 -0.92 0.00 0.00 175.35 172.65 2rkv n PRO 135 N 2.38 1.84 -0.06 -1.68 -0.02 -1.26 -0.23 135.00 135.97 2rkv n PRO 135 Ca 0.14 0.66 -0.10 0.00 -2.02 0.00 0.00 63.50 62.19 2rkv n PRO 135 Cb 0.34 -2.45 -0.03 0.00 -0.02 0.00 0.00 33.50 31.34 2rkv n PRO 135 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 2rkv h VAL 136 N 1.82 1.06 -3.95 -1.45 2.07 -1.47 -3.39 116.25 110.95 2rkv h VAL 136 Ca -0.49 -0.12 -0.28 0.00 0.82 0.00 0.00 66.70 66.63 2rkv h VAL 136 Cb 1.30 0.70 -0.23 0.00 -1.52 0.00 0.00 31.29 31.53 2rkv h VAL 136 CO 0.59 0.06 -0.74 -0.51 0.02 0.00 0.00 177.57 176.99 2rkv s ILE 137 N -6.17 0.48 0.01 4.57 2.07 -1.26 -1.27 121.20 119.63 2rkv s ILE 137 Ca -0.13 -0.82 0.02 0.00 -1.41 0.00 0.00 60.65 58.31 2rkv s ILE 137 Cb 0.09 -0.52 -0.01 0.00 0.13 0.00 0.00 42.46 42.15 2rkv s ILE 137 CO 0.70 -0.24 -0.06 -0.76 -1.91 0.00 0.00 174.94 172.66 2rkv s LEU 138 N -1.15 2.10 0.10 8.50 1.43 -0.46 -4.31 118.68 124.90 2rkv s LEU 138 Ca -0.07 -0.26 0.07 0.00 -1.03 0.00 0.00 54.13 52.85 2rkv s LEU 138 Cb -0.08 -0.25 -0.03 0.00 0.03 0.00 0.00 46.19 45.86 2rkv s LEU 138 CO 0.00 -0.03 -0.19 -0.76 0.23 0.00 0.00 176.35 175.61 2rkv s LEU 139 N -0.65 2.32 -0.03 1.79 1.02 -0.30 -0.57 118.68 122.26 2rkv s LEU 139 Ca -0.02 -0.70 -0.00 0.00 0.02 0.00 0.00 54.13 53.43 2rkv s LEU 139 Cb -0.05 -0.78 0.03 0.00 0.02 0.00 0.00 46.19 45.41 2rkv s LEU 139 CO 0.00 0.01 0.03 -1.58 0.02 0.00 0.00 176.35 174.82 2rkv s GLN 140 N -2.01 0.06 -0.29 1.70 0.74 -0.36 -1.18 119.66 118.31 2rkv s GLN 140 Ca 0.06 0.19 -0.09 0.00 0.05 0.00 0.00 55.36 55.56 2rkv s GLN 140 Cb -0.09 -0.37 -0.02 0.00 1.10 0.00 0.00 33.01 33.63 2rkv s GLN 140 CO 0.04 -0.19 0.14 -0.51 -0.55 0.00 0.00 175.29 174.22 2rkv s LEU 141 N 1.25 3.91 -0.26 3.68 1.43 0.24 -0.82 118.68 128.12 2rkv s LEU 141 Ca -0.07 -0.31 -0.04 0.00 -1.03 0.00 0.00 54.13 52.67 2rkv s LEU 141 Cb -0.13 -2.01 0.01 0.00 0.03 0.00 0.00 46.19 44.09 2rkv s LEU 141 CO -0.03 -0.12 0.00 0.20 0.23 0.00 0.00 176.35 176.64 2rkv s ASN 142 N 1.65 4.64 -0.15 2.29 0.01 0.07 -0.86 114.94 122.60 2rkv s ASN 142 Ca 0.06 -0.62 -0.29 0.00 -0.71 0.00 0.00 52.86 51.30 2rkv s ASN 142 Cb -0.16 -1.78 -0.01 0.00 0.41 0.00 0.00 41.25 39.71 2rkv s ASN 142 CO 0.07 -0.11 0.99 -0.36 -1.51 0.00 0.00 177.10 176.17 2rkv s PHE 143 N 1.45 3.45 0.31 2.20 0.08 0.30 -0.91 117.98 124.87 2rkv s PHE 143 Ca 0.03 1.51 0.09 0.00 0.12 0.00 0.00 56.93 58.68 2rkv s PHE 143 Cb -0.16 -3.18 -0.06 0.00 -0.57 0.00 0.00 43.02 39.05 2rkv s PHE 143 CO -0.01 -0.29 -0.10 0.96 -0.10 0.00 0.00 175.22 175.68 2rkv s ILE 144 N 2.33 2.05 -0.12 0.64 -4.36 -0.83 -0.05 121.20 120.86 2rkv s ILE 144 Ca 0.46 -2.20 -0.34 0.00 -0.26 0.00 0.00 60.65 58.31 2rkv s ILE 144 Cb -0.17 -2.52 -0.11 0.00 1.25 0.00 0.00 42.46 40.91 2rkv s ILE 144 CO 0.14 -0.27 1.95 1.17 0.24 0.00 0.00 174.94 178.17 2rkv n LYS 145 N -0.69 2.08 -1.06 0.37 4.81 -1.26 -0.93 118.16 121.48 2rkv n LYS 145 Ca -0.05 0.74 -0.02 0.00 -0.87 0.00 0.00 58.31 58.10 2rkv n LYS 145 Cb 0.63 -2.70 -0.01 0.00 0.02 0.00 0.00 35.03 32.97 2rkv n LYS 145 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2rkv n GLY 146 N 4.75 0.51 3.08 3.14 0.00 -1.26 -0.99 105.19 114.42 2rkv n GLY 146 Ca 0.25 -0.23 -0.06 0.00 0.00 0.00 0.00 46.02 45.98 2rkv n GLY 146 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2rkv n GLY 147 N -1.84 1.09 2.86 -0.02 0.00 -0.11 -0.89 105.19 106.28 2rkv n GLY 147 Ca -0.02 -1.19 -0.14 0.00 0.00 0.00 0.00 46.02 44.67 2rkv n GLY 147 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2rkv s LEU 148 N 0.00 1.18 -0.24 0.99 2.96 0.59 -1.96 118.68 122.20 2rkv s LEU 148 Ca 0.14 0.14 -0.03 0.00 -0.22 0.00 0.00 54.13 54.15 2rkv s LEU 148 Cb -0.04 0.13 0.01 0.00 0.50 0.00 0.00 46.19 46.79 2rkv s LEU 148 CO 0.09 -0.10 -0.04 -0.63 -1.32 0.00 0.00 176.35 174.34 2rkv s ILE 149 N 0.80 3.20 -0.25 6.68 1.01 -0.09 -0.82 121.20 131.73 2rkv s ILE 149 Ca -0.06 -0.71 -0.12 0.00 0.00 0.00 0.00 60.65 59.76 2rkv s ILE 149 Cb -0.09 -2.53 -0.05 0.00 0.01 0.00 0.00 42.46 39.81 2rkv s ILE 149 CO -0.03 0.32 0.22 -0.22 0.00 0.00 0.00 174.94 175.23 2rkv s LEU 150 N 1.42 4.09 -0.08 2.97 2.96 0.60 -0.75 118.68 129.88 2rkv s LEU 150 Ca 0.04 0.16 0.04 0.00 -0.22 0.00 0.00 54.13 54.14 2rkv s LEU 150 Cb -0.15 -2.20 -0.01 0.00 0.50 0.00 0.00 46.19 44.32 2rkv s LEU 150 CO -0.04 -0.01 -0.20 -0.89 -1.32 0.00 0.00 176.35 173.90 2rkv s THR 151 N 1.38 2.50 -0.12 3.68 2.01 0.00 -0.16 115.64 124.93 2rkv s THR 151 Ca 0.10 -0.89 0.03 0.00 0.31 0.00 0.00 61.69 61.24 2rkv s THR 151 Cb -0.15 -1.97 0.01 0.00 0.01 0.00 0.00 72.50 70.40 2rkv s THR 151 CO 0.07 0.56 -0.23 -0.69 -0.69 0.00 0.00 174.62 173.65 2rkv s VAL 152 N -0.02 2.04 -0.15 3.82 1.01 -0.09 -1.23 120.40 125.78 2rkv s VAL 152 Ca -0.06 -0.98 -0.06 0.00 0.00 0.00 0.00 61.98 60.88 2rkv s VAL 152 Cb -0.15 -1.79 -0.04 0.00 0.00 0.00 0.00 36.38 34.40 2rkv s VAL 152 CO 0.05 0.55 0.05 0.20 0.00 0.00 0.00 175.10 175.95 2rkv s ASN 153 N 0.65 5.58 -0.07 3.32 -0.87 0.26 -1.82 114.94 121.99 2rkv s ASN 153 Ca -0.11 0.13 0.04 0.00 -1.57 0.00 0.00 52.86 51.35 2rkv s ASN 153 Cb -0.16 -1.86 -0.00 0.00 -0.02 0.00 0.00 41.25 39.20 2rkv s ASN 153 CO 0.02 0.25 -0.20 -0.83 -2.57 0.00 0.00 177.10 173.76 2rkv s GLY 154 N -0.08 1.12 -0.04 0.66 0.00 -0.22 -1.35 107.32 107.41 2rkv s GLY 154 Ca 0.06 -0.82 -0.30 0.00 0.00 0.00 0.00 44.72 43.66 2rkv s GLY 154 CO 0.01 -0.36 1.74 1.62 0.00 0.00 0.00 173.10 176.12 2rkv s GLN 155 N 0.16 4.14 0.47 2.90 -0.44 -0.40 -1.25 119.66 125.25 2rkv s GLN 155 Ca -0.10 2.28 0.25 0.00 -2.50 0.00 0.00 55.36 55.29 2rkv s GLN 155 Cb -0.15 -4.04 1.17 0.00 -1.64 0.00 0.00 33.01 28.36 2rkv s GLN 155 CO 0.05 -0.91 1.95 1.25 0.50 0.00 0.00 175.29 178.13 2rkv h HIS 156 N 9.93 0.00 -0.08 1.67 -0.00 -1.29 -0.31 115.15 125.06 2rkv h HIS 156 Ca -0.42 0.00 -0.06 0.00 -0.00 0.00 0.00 60.37 59.89 2rkv h HIS 156 Cb 1.19 0.00 -0.01 0.00 -0.00 0.00 0.00 27.41 28.59 2rkv h HIS 156 CO 0.91 0.19 -0.24 0.78 -0.00 0.00 0.00 177.93 179.57 2rkv h GLY 157 N 1.35 0.15 1.41 5.26 0.00 -1.69 -3.17 103.07 106.37 2rkv h GLY 157 Ca -0.00 -0.10 -0.03 0.00 0.00 0.00 0.00 47.33 47.20 2rkv h GLY 157 CO 0.02 0.09 -0.69 0.00 0.00 0.00 0.00 176.54 175.97 2rkv h ALA 158 N 1.64 0.69 -1.84 3.60 0.00 -1.39 -3.41 119.26 118.55 2rkv h ALA 158 Ca 0.02 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.79 2rkv h ALA 158 Cb 0.49 0.03 -0.23 0.00 0.00 0.00 0.00 17.79 18.08 2rkv h ALA 158 CO 0.03 0.17 0.26 0.00 0.00 0.00 0.00 179.25 179.71 2rkv s MET 159 N -3.23 0.70 0.70 0.00 0.23 -0.77 -3.98 119.30 112.96 2rkv s MET 159 Ca 0.02 0.84 -0.07 0.00 -1.03 0.00 0.00 55.69 55.46 2rkv s MET 159 Cb 0.08 0.34 0.15 0.00 -1.53 0.00 0.00 34.83 33.87 2rkv s MET 159 CO 0.75 -0.08 0.95 -0.40 -2.03 0.00 0.00 175.02 174.20 2rkv n ASP 160 N 2.53 0.59 0.20 -1.18 5.68 -0.84 -4.24 116.55 119.29 2rkv n ASP 160 Ca -0.13 -1.66 0.05 0.00 -0.50 0.00 0.00 54.79 52.55 2rkv n ASP 160 Cb 0.55 -0.68 0.42 0.00 -1.14 0.00 0.00 41.12 40.28 2rkv n ASP 160 CO 0.00 0.00 0.00 -0.03 -1.33 0.00 0.00 177.20 175.84 2rkv h MET 161 N 0.00 0.00 -0.31 0.11 1.85 -1.97 0.13 114.93 114.74 2rkv h MET 161 Ca -0.31 0.00 -0.04 0.00 -0.61 0.00 0.00 59.70 58.74 2rkv h MET 161 Cb 0.98 0.00 -0.01 0.00 0.43 0.00 0.00 31.60 33.00 2rkv h MET 161 CO 0.27 0.33 0.04 0.28 -0.40 0.00 0.00 176.91 177.43 2rkv h VAL 162 N 0.00 1.24 -0.56 -5.77 2.07 -1.94 0.11 116.25 111.39 2rkv h VAL 162 Ca -0.00 -0.83 -0.05 0.00 0.82 0.00 0.00 66.70 66.64 2rkv h VAL 162 Cb 0.68 1.18 -0.02 0.00 -1.52 0.00 0.00 31.29 31.61 2rkv h VAL 162 CO 0.04 0.27 0.16 1.23 0.02 0.00 0.00 177.57 179.29 2rkv h GLY 163 N 0.34 0.96 1.01 2.17 0.00 -1.61 -1.61 103.07 104.32 2rkv h GLY 163 Ca 0.09 -0.58 -0.01 0.00 0.00 0.00 0.00 47.33 46.83 2rkv h GLY 163 CO 0.01 0.54 0.41 -1.61 0.00 0.00 0.00 176.54 175.89 2rkv h GLN 164 N 0.80 1.01 -0.69 4.80 4.15 -0.58 -0.82 115.11 123.78 2rkv h GLN 164 Ca 0.18 -0.11 0.00 0.00 0.77 0.00 0.00 58.65 59.49 2rkv h GLN 164 Cb 0.31 -0.20 -0.03 0.00 0.21 0.00 0.00 27.48 27.76 2rkv h GLN 164 CO -0.00 0.74 0.44 0.22 -1.93 0.00 0.00 178.83 178.30 2rkv h ASP 165 N 1.00 0.81 -0.72 -0.69 3.58 -0.56 0.04 116.42 119.88 2rkv h ASP 165 Ca 0.26 -0.04 0.01 0.00 0.42 0.00 0.00 57.03 57.68 2rkv h ASP 165 Cb 0.01 -0.20 -0.04 0.00 1.72 0.00 0.00 39.33 40.82 2rkv h ASP 165 CO -0.04 0.61 0.48 0.00 -2.88 0.00 0.00 179.24 177.40 2rkv h ALA 166 N 1.24 0.91 -0.17 -0.78 0.00 -0.41 0.11 119.26 120.16 2rkv h ALA 166 Ca 0.25 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.10 2rkv h ALA 166 Cb -0.08 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.42 2rkv h ALA 166 CO -0.05 0.33 0.06 0.28 0.00 0.00 0.00 179.25 179.87 2rkv h VAL 167 N 0.97 1.18 -0.68 0.00 2.07 -0.80 -2.57 116.25 116.44 2rkv h VAL 167 Ca 0.26 -0.56 -0.03 0.00 0.82 0.00 0.00 66.70 67.20 2rkv h VAL 167 Cb -0.11 1.23 -0.03 0.00 -1.52 0.00 0.00 31.29 30.86 2rkv h VAL 167 CO -0.06 0.17 0.30 0.40 0.02 0.00 0.00 177.57 178.41 2rkv h ILE 168 N 0.10 1.23 -0.53 4.57 2.04 -0.67 0.10 117.51 124.36 2rkv h ILE 168 Ca 0.06 -0.69 0.06 0.00 1.00 0.00 0.00 64.86 65.29 2rkv h ILE 168 Cb 0.22 0.43 -0.05 0.00 -0.74 0.00 0.00 36.82 36.68 2rkv h ILE 168 CO -0.00 0.28 0.24 -0.09 0.00 0.00 0.00 178.15 178.58 2rkv h ARG 169 N 0.95 0.45 -0.14 2.37 2.43 -0.71 0.39 114.38 120.11 2rkv h ARG 169 Ca 0.23 -0.03 -0.14 0.00 -0.81 0.00 0.00 59.98 59.24 2rkv h ARG 169 Cb 0.16 -0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 29.60 2rkv h ARG 169 CO -0.02 0.30 -0.50 -0.07 -1.51 0.00 0.00 179.97 178.16 2rkv h LEU 170 N 0.46 0.41 -0.88 3.80 3.38 -1.08 -2.26 115.31 119.14 2rkv h LEU 170 Ca 0.24 -0.21 0.01 0.00 0.09 0.00 0.00 57.88 58.02 2rkv h LEU 170 Cb 0.20 -0.12 -0.04 0.00 0.09 0.00 0.00 40.66 40.79 2rkv h LEU 170 CO -0.20 0.85 0.58 0.25 0.09 0.00 0.00 178.44 180.01 2rkv h LEU 171 N 0.30 1.02 -0.48 1.67 5.85 -0.23 0.64 115.31 124.07 2rkv h LEU 171 Ca 0.01 -0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.71 2rkv h LEU 171 Cb 0.99 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.74 2rkv h LEU 171 CO 0.09 0.74 0.32 -1.28 -0.34 0.00 0.00 178.44 177.96 2rkv h SER 172 N 1.20 0.56 -0.39 1.25 0.87 -0.53 0.07 113.55 116.58 2rkv h SER 172 Ca 0.32 -0.02 0.05 0.00 -1.23 0.00 0.00 61.79 60.92 2rkv h SER 172 Cb -0.14 -0.14 -0.05 0.00 -0.44 0.00 0.00 62.40 61.64 2rkv h SER 172 CO -0.07 0.41 0.10 0.11 -0.53 0.00 0.00 176.83 176.85 2rkv h LYS 173 N 0.66 0.23 -0.79 2.24 1.57 -0.96 -2.10 116.57 117.42 2rkv h LYS 173 Ca 0.18 -0.01 -0.02 0.00 -1.87 0.00 0.00 60.65 58.93 2rkv h LYS 173 Cb -0.07 -0.05 -0.04 0.00 0.08 0.00 0.00 32.23 32.15 2rkv h LYS 173 CO -0.04 0.15 0.43 0.00 -0.57 0.00 0.00 179.45 179.42 2rkv h ALA 174 N 1.28 1.02 -0.82 3.86 0.00 -0.25 -0.13 119.26 124.21 2rkv h ALA 174 Ca 0.18 -0.12 0.04 0.00 0.00 0.00 0.00 54.91 55.00 2rkv h ALA 174 Cb 0.20 -0.32 -0.05 0.00 0.00 0.00 0.00 17.79 17.63 2rkv h ALA 174 CO -0.22 0.53 0.54 0.00 0.00 0.00 0.00 179.25 180.10 2rkv n ARG 176 N -4.45 0.10 -2.41 0.00 1.74 -0.66 -4.70 116.66 106.27 2rkv n ARG 176 Ca 0.11 0.08 -0.16 0.00 -0.77 0.00 0.00 57.85 57.11 2rkv n ARG 176 Cb 0.12 -1.61 0.00 0.00 -1.02 0.00 0.00 32.46 29.95 2rkv n ARG 176 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 2rkv n ASN 177 N -1.78 -4.76 -4.78 0.55 5.15 -0.25 -5.02 115.26 104.38 2rkv n ASN 177 Ca 0.06 -0.06 -0.39 0.00 -0.60 0.00 0.00 54.58 53.59 2rkv n ASN 177 Cb 0.37 -3.83 -0.06 0.00 -0.53 0.00 0.00 39.78 35.74 2rkv n ASN 177 CO 0.00 0.00 0.00 -1.81 1.40 0.00 0.00 177.26 176.85 2rkv s ASP 178 N -2.40 7.16 0.50 1.20 1.01 -0.23 -5.01 116.67 118.91 2rkv s ASP 178 Ca 0.05 1.38 -0.20 0.00 0.71 0.00 0.00 52.55 54.49 2rkv s ASP 178 Cb -0.02 -2.42 -0.07 0.00 1.01 0.00 0.00 42.92 41.42 2rkv s ASP 178 CO 0.06 0.17 1.09 -2.16 0.21 0.00 0.00 175.17 174.54 2rkv s PRO 179 N -0.71 3.62 0.31 8.23 0.04 -1.26 -4.38 135.00 140.85 2rkv s PRO 179 Ca 0.33 1.50 -0.24 0.00 0.04 0.00 0.00 61.00 62.63 2rkv s PRO 179 Cb -0.20 -2.10 -0.10 0.00 0.04 0.00 0.00 34.50 32.14 2rkv s PRO 179 CO 0.21 -0.60 0.90 -0.06 0.04 0.00 0.00 177.00 177.49 2rkv s PHE 180 N -1.85 3.64 0.68 0.56 0.08 -1.26 -5.06 117.98 114.78 2rkv s PHE 180 Ca 0.69 1.68 -0.11 0.00 0.12 0.00 0.00 56.93 59.31 2rkv s PHE 180 Cb -0.21 -2.85 -0.00 0.00 -0.57 0.00 0.00 43.02 39.39 2rkv s PHE 180 CO 0.24 0.20 1.06 0.95 -0.10 0.00 0.00 175.22 177.57 2rkv s THR 181 N -1.66 4.08 0.20 0.64 -4.23 -1.26 -4.90 115.64 108.51 2rkv s THR 181 Ca 0.50 0.68 -0.11 0.00 -1.18 0.00 0.00 61.69 61.58 2rkv s THR 181 Cb -0.17 -3.56 0.12 0.00 1.34 0.00 0.00 72.50 70.23 2rkv s THR 181 CO 0.22 -0.88 1.80 -0.08 -0.54 0.00 0.00 174.62 175.14 2rkv h GLU 182 N -0.60 0.59 -0.90 3.99 4.57 -1.99 -1.39 114.58 118.85 2rkv h GLU 182 Ca -0.44 -0.04 -0.00 0.00 -1.18 0.00 0.00 59.36 57.70 2rkv h GLU 182 Cb 1.22 -0.13 -0.04 0.00 -0.16 0.00 0.00 28.75 29.63 2rkv h GLU 182 CO 0.60 0.39 0.55 1.49 -1.18 0.00 0.00 179.01 180.86 2rkv h GLU 183 N 0.61 1.22 -0.20 1.92 4.22 -1.99 0.35 114.58 120.72 2rkv h GLU 183 Ca 0.27 -0.11 -0.02 0.00 0.08 0.00 0.00 59.36 59.58 2rkv h GLU 183 Cb 0.16 -0.26 -0.01 0.00 0.50 0.00 0.00 28.75 29.14 2rkv h GLU 183 CO -0.17 0.85 0.06 0.93 -2.18 0.00 0.00 179.01 178.51 2rkv h GLU 184 N 1.25 0.30 -0.71 1.92 5.08 -1.80 -0.24 114.58 120.39 2rkv h GLU 184 Ca 0.33 -0.06 -0.02 0.00 -1.00 0.00 0.00 59.36 58.60 2rkv h GLU 184 Cb -0.06 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.11 2rkv h GLU 184 CO -0.06 0.40 0.34 0.52 -1.00 0.00 0.00 179.01 179.21 2rkv h MET 185 N 0.14 1.01 -0.01 2.33 2.86 -0.96 -0.89 114.93 119.40 2rkv h MET 185 Ca 0.06 -0.13 -0.00 0.00 -2.06 0.00 0.00 59.70 57.57 2rkv h MET 185 Cb 0.22 -0.19 -0.00 0.00 0.06 0.00 0.00 31.60 31.69 2rkv h MET 185 CO -0.00 0.77 0.00 1.15 1.06 0.00 0.00 176.91 179.89 2rkv h THR 186 N 1.00 1.19 -0.99 2.22 2.02 -0.76 -3.06 112.91 114.53 2rkv h THR 186 Ca 0.25 -0.56 0.04 0.00 0.77 0.00 0.00 66.41 66.91 2rkv h THR 186 Cb 0.10 1.54 -0.06 0.00 -1.74 0.00 0.00 68.15 67.99 2rkv h THR 186 CO -0.03 0.15 0.65 0.00 0.37 0.00 0.00 175.52 176.65 2rkv h ALA 187 N 0.77 1.32 0.00 6.16 0.00 -0.75 -1.23 119.26 125.53 2rkv h ALA 187 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2rkv h ALA 187 Cb 0.24 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 17.68 2rkv h ALA 187 CO 0.00 0.53 0.00 -1.33 0.00 0.00 0.00 179.25 178.45 2rkv n MET 188 N -4.46 0.01 0.00 0.00 2.81 -0.36 -3.15 117.12 111.97 2rkv n MET 188 Ca 0.13 0.33 0.00 0.00 -1.81 0.00 0.00 57.70 56.35 2rkv n MET 188 Cb 0.10 -1.53 0.00 0.00 -0.71 0.00 0.00 33.22 31.08 2rkv n MET 188 CO 0.00 0.00 0.00 0.09 1.51 0.00 0.00 175.97 177.57 2rkv n ASN 189 N -1.55 1.05 -4.73 7.83 4.13 -0.53 -4.93 115.26 116.52 2rkv n ASN 189 Ca 0.02 -1.49 -0.42 0.00 1.68 0.00 0.00 54.58 54.37 2rkv n ASN 189 Cb 0.13 0.00 -0.01 0.00 -1.54 0.00 0.00 39.78 38.36 2rkv n ASN 189 CO 0.00 0.00 0.00 0.18 0.28 0.00 0.00 177.26 177.72 2rkv n LEU 190 N -0.25 4.14 -4.74 3.41 4.77 -0.78 -4.93 117.00 118.62 2rkv n LEU 190 Ca 0.00 1.20 -0.42 0.00 -0.03 0.00 0.00 56.01 56.77 2rkv n LEU 190 Cb 0.33 -1.55 -0.02 0.00 -2.33 0.00 0.00 43.42 39.85 2rkv n LEU 190 CO 0.00 -0.12 1.17 -0.62 -1.33 0.00 0.00 177.39 176.49 2rkv s ASP 191 N -0.05 6.56 -0.10 -1.43 2.15 -1.26 -4.93 116.67 117.60 2rkv s ASP 191 Ca 0.57 2.74 -0.05 0.00 0.43 0.00 0.00 52.55 56.25 2rkv s ASP 191 Cb -0.53 -2.62 -0.26 0.00 -0.30 0.00 0.00 42.92 39.21 2rkv s ASP 191 CO 0.59 -0.79 0.45 0.03 -0.17 0.00 0.00 175.17 175.29 2rkv h ARG 192 N 5.35 0.24 0.00 4.34 3.08 -1.92 -3.35 114.38 122.13 2rkv h ARG 192 Ca -0.46 -0.42 0.00 0.00 0.07 0.00 0.00 59.98 59.18 2rkv h ARG 192 Cb 1.22 0.16 0.00 0.00 0.08 0.00 0.00 29.97 31.42 2rkv h ARG 192 CO 0.81 1.13 0.00 0.36 -1.07 0.00 0.00 179.97 181.20 2rkv n LYS 193 N -3.44 0.16 -0.03 0.04 2.85 -1.26 -2.07 118.16 114.40 2rkv n LYS 193 Ca -0.29 0.44 0.03 0.00 -1.05 0.00 0.00 58.31 57.45 2rkv n LYS 193 Cb 1.05 -1.83 0.05 0.00 -0.65 0.00 0.00 35.03 33.65 2rkv n LYS 193 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 177.40 177.60 2rkv n THR 194 N -2.13 0.33 0.26 0.58 -2.24 -1.26 -4.74 114.28 105.08 2rkv n THR 194 Ca 0.02 -0.67 0.15 0.00 -2.27 0.00 0.00 64.05 61.28 2rkv n THR 194 Cb 0.18 0.93 0.59 0.00 -2.10 0.00 0.00 70.33 69.92 2rkv n THR 194 CO 0.00 0.00 0.00 -0.29 -0.57 0.00 0.00 175.07 174.21 2rkv h ILE 195 N 1.27 0.19 -3.60 2.28 2.10 -1.55 -3.35 117.51 114.86 2rkv h ILE 195 Ca 0.00 -0.74 -0.70 0.00 1.08 0.00 0.00 64.86 64.51 2rkv h ILE 195 Cb 0.40 1.62 -0.32 0.00 -1.09 0.00 0.00 36.82 37.43 2rkv h ILE 195 CO 0.00 0.07 -0.59 -0.69 -1.08 0.00 0.00 178.15 175.86 2rkv s VAL 196 N -3.65 3.47 0.23 2.19 1.01 -1.26 -5.05 120.40 117.34 2rkv s VAL 196 Ca 0.01 -1.56 -0.31 0.00 0.00 0.00 0.00 61.98 60.12 2rkv s VAL 196 Cb 0.09 -3.14 -0.11 0.00 0.00 0.00 0.00 36.38 33.22 2rkv s VAL 196 CO 0.58 -0.39 1.58 -2.84 0.00 0.00 0.00 175.10 174.03 2rkv s PRO 197 N 1.28 4.18 0.61 2.72 0.02 -1.26 -4.97 135.00 137.58 2rkv s PRO 197 Ca 0.01 2.45 -0.13 0.00 0.02 0.00 0.00 61.00 63.36 2rkv s PRO 197 Cb -0.21 -3.09 -0.04 0.00 0.02 0.00 0.00 34.50 31.18 2rkv s PRO 197 CO -0.01 -0.60 1.03 0.71 -0.33 0.00 0.00 177.00 177.80 2rkv s TYR 198 N 0.57 3.38 0.22 6.54 4.12 -1.26 -4.80 117.35 126.11 2rkv s TYR 198 Ca 0.67 1.40 -0.25 0.00 0.02 0.00 0.00 57.07 58.90 2rkv s TYR 198 Cb -0.46 -2.82 -0.08 0.00 -1.52 0.00 0.00 41.96 37.08 2rkv s TYR 198 CO 0.39 -0.79 0.82 -0.51 0.02 0.00 0.00 175.55 175.47 2rkv s LEU 199 N -4.89 4.51 0.17 -1.29 1.43 -1.26 -5.05 118.68 112.30 2rkv s LEU 199 Ca 0.58 1.67 -0.27 0.00 -1.03 0.00 0.00 54.13 55.08 2rkv s LEU 199 Cb -0.12 -3.52 -0.08 0.00 0.03 0.00 0.00 46.19 42.50 2rkv s LEU 199 CO 0.46 0.12 0.83 -1.83 0.23 0.00 0.00 176.35 176.16 2rkv s GLU 200 N -1.49 4.65 -1.49 1.70 4.04 -1.26 -4.13 118.70 120.73 2rkv s GLU 200 Ca 0.40 1.26 -0.09 0.00 0.04 0.00 0.00 54.97 56.59 2rkv s GLU 200 Cb -0.21 -3.29 0.06 0.00 0.02 0.00 0.00 34.13 30.71 2rkv s GLU 200 CO 0.25 0.50 0.75 0.09 -1.84 0.00 0.00 175.26 175.01 2rkv n ASN 201 N 1.80 -2.68 -4.77 0.83 3.02 -1.26 -4.94 115.26 107.27 2rkv n ASN 201 Ca -0.04 -0.88 -0.36 0.00 -0.03 0.00 0.00 54.58 53.27 2rkv n ASN 201 Cb 0.48 -3.52 -0.07 0.00 -0.61 0.00 0.00 39.78 36.06 2rkv n ASN 201 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 2rkv s TYR 202 N -3.53 3.47 0.00 3.10 5.04 -1.26 -4.99 117.35 119.17 2rkv s TYR 202 Ca 0.38 0.43 0.00 0.00 -2.44 0.00 0.00 57.07 55.44 2rkv s TYR 202 Cb -0.20 -2.14 0.00 0.00 0.35 0.00 0.00 41.96 39.97 2rkv s TYR 202 CO 0.86 0.39 0.00 0.25 -1.34 0.00 0.00 175.55 175.71 2rkv n THR 203 N 3.14 0.00 -3.71 4.34 -2.24 -1.26 -4.95 114.28 109.60 2rkv n THR 203 Ca -0.16 0.16 -0.13 0.00 -2.27 0.00 0.00 64.05 61.66 2rkv n THR 203 Cb 0.53 -1.07 -0.10 0.00 -2.10 0.00 0.00 70.33 67.58 2rkv n THR 203 CO 0.00 0.00 0.00 -0.51 -0.57 0.00 0.00 175.07 173.99 2rkv s ILE 204 N -0.64 -0.00 0.18 2.28 2.07 -1.26 -4.83 121.20 119.00 2rkv s ILE 204 Ca 0.00 0.02 -0.00 0.00 -1.41 0.00 0.00 60.65 59.25 2rkv s ILE 204 Cb 0.00 -0.64 0.00 0.00 0.13 0.00 0.00 42.46 41.95 2rkv s ILE 204 CO 0.00 0.01 0.24 0.61 -1.91 0.00 0.00 174.94 173.88 2rkv n GLY 205 N 3.15 2.71 0.25 1.50 0.00 -1.26 -5.02 105.19 106.52 2rkv n GLY 205 Ca -0.15 -1.53 0.17 0.00 0.00 0.00 0.00 46.02 44.50 2rkv n GLY 205 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2rkv h PRO 206 N 0.00 0.00 -0.70 1.61 0.13 -2.02 -2.83 132.00 128.19 2rkv h PRO 206 Ca -0.14 0.00 0.15 0.00 -0.87 0.00 0.00 66.00 65.14 2rkv h PRO 206 Cb 0.61 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 31.69 2rkv h PRO 206 CO 0.19 0.00 0.48 0.93 -0.23 0.00 0.00 178.00 179.36 2rkv h GLU 207 N 0.00 0.30 -0.43 0.86 3.07 -1.93 -1.84 114.58 114.62 2rkv h GLU 207 Ca 0.00 -0.02 0.00 0.00 -0.50 0.00 0.00 59.36 58.84 2rkv h GLU 207 Cb 0.06 -0.07 0.00 0.00 -0.84 0.00 0.00 28.75 27.91 2rkv h GLU 207 CO 0.00 0.20 0.00 1.33 -1.40 0.00 0.00 179.01 179.14 2rkv n VAL 208 N -4.45 2.23 -1.65 3.13 0.24 -1.07 -4.60 118.33 112.17 2rkv n VAL 208 Ca 0.13 -1.55 -0.44 0.00 -2.04 0.00 0.00 64.34 60.45 2rkv n VAL 208 Cb 0.55 -0.12 -0.02 0.00 -1.47 0.00 0.00 33.84 32.78 2rkv n VAL 208 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 2rkv n ASP 209 N 0.19 2.14 -0.07 -1.34 8.00 -0.69 -1.56 116.55 123.21 2rkv n ASP 209 Ca 0.23 1.18 -0.01 0.00 0.71 0.00 0.00 54.79 56.90 2rkv n ASP 209 Cb 0.94 -1.38 -0.00 0.00 -0.02 0.00 0.00 41.12 40.65 2rkv n ASP 209 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 2rkv n HIS 210 N 0.66 0.00 -0.15 1.24 8.25 -1.26 -4.83 115.22 119.14 2rkv n HIS 210 Ca 0.08 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.54 2rkv n HIS 210 Cb 0.33 -1.14 0.00 0.00 1.12 0.00 0.00 29.99 30.30 2rkv n HIS 210 CO 0.00 0.00 0.00 1.04 0.64 0.00 0.00 176.34 178.02 2rkv n GLN 211 N -1.04 0.34 -4.27 -0.41 6.02 -0.60 -3.08 117.38 114.33 2rkv n GLN 211 Ca -0.01 -0.34 -0.32 0.00 -0.01 0.00 0.00 57.00 56.32 2rkv n GLN 211 Cb 0.27 -0.82 -0.16 0.00 1.02 0.00 0.00 30.24 30.55 2rkv n GLN 211 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 2rkv s ILE 212 N -0.15 1.96 0.23 5.09 1.01 -1.25 -0.83 121.20 127.26 2rkv s ILE 212 Ca 0.00 -0.89 -0.30 0.00 0.00 0.00 0.00 60.65 59.46 2rkv s ILE 212 Cb 0.00 -1.77 -0.10 0.00 0.01 0.00 0.00 42.46 40.61 2rkv s ILE 212 CO 0.00 0.53 1.42 -0.69 0.00 0.00 0.00 174.94 176.20 2rkv s VAL 213 N 1.18 2.79 0.06 2.92 1.01 0.89 -4.87 120.40 124.38 2rkv s VAL 213 Ca 0.01 0.65 0.06 0.00 0.00 0.00 0.00 61.98 62.70 2rkv s VAL 213 Cb -0.14 -3.41 -0.03 0.00 0.00 0.00 0.00 36.38 32.80 2rkv s VAL 213 CO -0.09 0.10 -0.18 -0.54 0.00 0.00 0.00 175.10 174.39 2rkv s LYS 214 N -0.12 1.10 0.57 2.72 1.02 -1.26 -4.97 119.74 118.80 2rkv s LYS 214 Ca 0.60 -0.94 0.34 0.00 0.02 0.00 0.00 55.97 55.99 2rkv s LYS 214 Cb -0.41 -1.20 1.68 0.00 -0.52 0.00 0.00 37.83 37.38 2rkv s LYS 214 CO 0.41 0.29 2.12 0.00 -0.92 0.00 0.00 175.35 177.25 2rkv h ALA 215 N 4.62 1.10 -0.61 5.17 0.00 -2.01 -2.38 119.26 125.15 2rkv h ALA 215 Ca -0.42 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.45 2rkv h ALA 215 Cb 1.18 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.96 2rkv h ALA 215 CO 0.42 0.06 0.00 -0.40 0.00 0.00 0.00 179.25 179.34 2rkv n ASP 216 N -3.29 4.08 -3.91 0.00 5.75 -1.26 -4.88 116.55 113.04 2rkv n ASP 216 Ca -0.01 -2.23 -0.27 0.00 -0.01 0.00 0.00 54.79 52.27 2rkv n ASP 216 Cb 0.22 -0.48 -0.17 0.00 -1.03 0.00 0.00 41.12 39.66 2rkv n ASP 216 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 2rkv s VAL 217 N -1.42 1.07 0.41 2.12 1.01 -0.90 -5.12 120.40 117.57 2rkv s VAL 217 Ca 0.45 -0.34 -0.27 0.00 0.00 0.00 0.00 61.98 61.82 2rkv s VAL 217 Cb 0.26 -1.09 -0.10 0.00 0.00 0.00 0.00 36.38 35.45 2rkv s VAL 217 CO 0.26 0.35 1.47 0.00 0.00 0.00 0.00 175.10 177.18 2rkv s ALA 218 N 1.69 3.44 0.00 5.51 0.00 -1.26 -4.50 121.76 126.64 2rkv s ALA 218 Ca 0.05 1.54 0.00 0.00 0.00 0.00 0.00 51.96 53.54 2rkv s ALA 218 Cb -0.13 -3.60 0.00 0.00 0.00 0.00 0.00 23.12 19.39 2rkv s ALA 218 CO -0.08 -1.12 0.00 0.41 0.00 0.00 0.00 175.76 174.97 2rkv n GLY 219 N 0.50 0.15 0.00 0.00 0.00 -1.25 -4.28 105.19 100.31 2rkv n GLY 219 Ca 0.03 0.25 0.00 0.00 0.00 0.00 0.00 46.02 46.30 2rkv n GLY 219 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2rkv n VAL 227 N 0.00 0.00 -2.45 1.61 0.24 -1.26 -4.77 118.33 111.70 2rkv n VAL 227 Ca 0.00 0.00 -0.43 0.00 -2.04 0.00 0.00 64.34 61.87 2rkv n VAL 227 Cb 0.00 0.00 -0.02 0.00 -1.47 0.00 0.00 33.84 32.35 2rkv n VAL 227 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 2rkv s SER 228 N 0.00 6.94 0.22 -1.34 0.15 -1.26 -5.00 113.70 113.41 2rkv s SER 228 Ca 0.00 1.60 -0.00 0.00 0.70 0.00 0.00 55.95 58.25 2rkv s SER 228 Cb 0.00 -2.54 -0.04 0.00 -1.71 0.00 0.00 66.02 61.73 2rkv s SER 228 CO 0.00 -0.78 0.12 0.00 1.20 0.00 0.00 173.24 173.78 2rkv s ALA 229 N 3.54 1.36 0.25 5.45 0.00 -1.26 -0.49 121.76 130.60 2rkv s ALA 229 Ca 0.53 -1.75 -0.10 0.00 0.00 0.00 0.00 51.96 50.64 2rkv s ALA 229 Cb -0.20 1.25 -0.01 0.00 0.00 0.00 0.00 23.12 24.16 2rkv s ALA 229 CO 0.14 -0.54 0.42 -1.54 0.00 0.00 0.00 175.76 174.24 2rkv s SER 230 N -3.21 0.01 0.02 0.00 1.04 -0.73 -4.83 113.70 106.00 2rkv s SER 230 Ca 0.38 -1.04 0.03 0.00 0.48 0.00 0.00 55.95 55.80 2rkv s SER 230 Cb 0.07 0.56 -0.04 0.00 0.10 0.00 0.00 66.02 66.72 2rkv s SER 230 CO 0.12 -1.10 -0.03 0.26 0.98 0.00 0.00 173.24 173.47 2rkv s TRP 231 N -3.97 2.98 -0.11 5.02 0.52 -1.26 -2.08 118.94 120.04 2rkv s TRP 231 Ca 0.26 0.01 -0.18 0.00 0.02 0.00 0.00 56.10 56.20 2rkv s TRP 231 Cb 0.01 -1.62 0.04 0.00 -1.15 0.00 0.00 33.47 30.75 2rkv s TRP 231 CO 0.10 0.43 0.47 0.00 0.02 0.00 0.00 176.95 177.97 2rkv s ALA 232 N -1.10 -1.17 0.16 0.98 0.00 -0.52 -4.92 121.76 115.19 2rkv s ALA 232 Ca 0.20 1.07 -0.15 0.00 0.00 0.00 0.00 51.96 53.07 2rkv s ALA 232 Cb -0.11 -0.43 -0.07 0.00 0.00 0.00 0.00 23.12 22.51 2rkv s ALA 232 CO 0.11 -0.26 0.58 -0.06 0.00 0.00 0.00 175.76 176.13 2rkv s PHE 233 N -0.40 3.62 -0.04 0.00 2.99 -0.25 -1.00 117.98 122.90 2rkv s PHE 233 Ca -0.05 1.12 0.03 0.00 0.00 0.00 0.00 56.93 58.03 2rkv s PHE 233 Cb -0.03 -2.41 0.00 0.00 0.00 0.00 0.00 43.02 40.57 2rkv s PHE 233 CO 0.03 0.42 -0.14 -0.06 -0.00 0.00 0.00 175.22 175.47 2rkv s PHE 234 N -1.46 1.46 0.05 0.36 0.40 -0.05 -0.74 117.98 118.00 2rkv s PHE 234 Ca 0.38 -0.43 0.01 0.00 -0.60 0.00 0.00 56.93 56.29 2rkv s PHE 234 Cb -0.15 -1.01 -0.04 0.00 0.51 0.00 0.00 43.02 42.32 2rkv s PHE 234 CO 0.19 -0.17 0.12 0.95 0.70 0.00 0.00 175.22 177.01 2rkv s THR 235 N 0.20 4.86 -0.15 0.64 -4.23 -0.00 -1.13 115.64 115.83 2rkv s THR 235 Ca -0.06 -0.55 -0.00 0.00 -1.18 0.00 0.00 61.69 59.90 2rkv s THR 235 Cb -0.12 -3.32 0.03 0.00 1.34 0.00 0.00 72.50 70.44 2rkv s THR 235 CO 0.02 0.19 -0.09 -0.36 -0.54 0.00 0.00 174.62 173.84 2rkv s PHE 236 N -1.37 1.86 0.83 3.99 0.40 -0.10 -1.08 117.98 122.51 2rkv s PHE 236 Ca 0.29 -1.08 -0.10 0.00 -0.60 0.00 0.00 56.93 55.44 2rkv s PHE 236 Cb -0.12 -1.41 0.10 0.00 0.51 0.00 0.00 43.02 42.09 2rkv s PHE 236 CO 0.22 -0.62 1.12 -1.54 0.70 0.00 0.00 175.22 175.10 2rkv s SER 237 N 1.59 3.79 0.32 1.36 1.04 -1.26 -1.45 113.70 119.08 2rkv s SER 237 Ca 0.03 1.99 0.06 0.00 0.48 0.00 0.00 55.95 58.52 2rkv s SER 237 Cb -0.14 -2.54 0.74 0.00 0.10 0.00 0.00 66.02 64.18 2rkv s SER 237 CO -0.09 -2.52 1.82 -0.65 0.98 0.00 0.00 173.24 172.79 2rkv h PRO 238 N -1.45 0.76 -0.30 4.02 0.11 -1.85 -0.08 132.00 133.20 2rkv h PRO 238 Ca -0.43 -0.05 -0.07 0.00 0.11 0.00 0.00 66.00 65.56 2rkv h PRO 238 Cb 1.25 -0.17 -0.01 0.00 0.11 0.00 0.00 31.00 32.18 2rkv h PRO 238 CO 0.47 0.50 -0.08 -0.22 -0.21 0.00 0.00 178.00 178.46 2rkv h LYS 239 N 0.78 0.59 -0.59 1.05 3.64 -1.93 -1.64 116.57 118.47 2rkv h LYS 239 Ca 0.51 -0.23 0.06 0.00 -1.27 0.00 0.00 60.65 59.72 2rkv h LYS 239 Cb 0.76 -0.03 -0.05 0.00 -0.41 0.00 0.00 32.23 32.50 2rkv h LYS 239 CO -0.28 0.79 0.30 0.00 -2.27 0.00 0.00 179.45 177.98 2rkv h ALA 240 N 0.79 0.77 -0.25 5.00 0.00 -1.72 -0.39 119.26 123.46 2rkv h ALA 240 Ca 0.08 0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.01 2rkv h ALA 240 Cb 0.57 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 2rkv h ALA 240 CO 0.03 -0.05 0.16 0.52 0.00 0.00 0.00 179.25 179.92 2rkv h MET 241 N 0.56 0.34 -0.28 0.00 2.86 -0.86 -0.99 114.93 116.57 2rkv h MET 241 Ca 0.26 -0.03 -0.09 0.00 -2.06 0.00 0.00 59.70 57.79 2rkv h MET 241 Cb 0.19 -0.07 -0.01 0.00 0.06 0.00 0.00 31.60 31.76 2rkv h MET 241 CO -0.19 0.25 -0.20 0.66 1.06 0.00 0.00 176.91 178.49 2rkv h SER 242 N 0.33 0.51 -0.11 1.22 4.64 -0.99 -1.55 113.55 117.60 2rkv h SER 242 Ca 0.09 -0.16 -0.13 0.00 -0.47 0.00 0.00 61.79 61.12 2rkv h SER 242 Cb -0.01 -0.14 -0.01 0.00 -0.31 0.00 0.00 62.40 61.93 2rkv h SER 242 CO -0.02 0.72 -0.37 -0.33 -0.87 0.00 0.00 176.83 175.96 2rkv h GLU 243 N 0.46 0.62 -0.37 4.77 5.08 -0.84 -0.24 114.58 124.07 2rkv h GLU 243 Ca 0.08 -0.31 -0.02 0.00 -1.00 0.00 0.00 59.36 58.11 2rkv h GLU 243 Cb 0.61 -0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.84 2rkv h GLU 243 CO 0.04 0.90 0.14 -0.07 -1.00 0.00 0.00 179.01 179.02 2rkv h LEU 244 N 0.52 0.52 -0.64 1.33 3.38 -0.94 -1.26 115.31 118.22 2rkv h LEU 244 Ca 0.05 -0.17 -0.06 0.00 0.09 0.00 0.00 57.88 57.79 2rkv h LEU 244 Cb 0.88 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 41.47 2rkv h LEU 244 CO 0.08 0.55 0.17 0.50 0.09 0.00 0.00 178.44 179.83 2rkv h LYS 245 N 0.45 1.01 -0.29 1.13 3.64 -1.13 -1.48 116.57 119.91 2rkv h LYS 245 Ca 0.12 -0.23 0.05 0.00 -1.27 0.00 0.00 60.65 59.32 2rkv h LYS 245 Cb 0.20 -0.14 -0.04 0.00 -0.41 0.00 0.00 32.23 31.84 2rkv h LYS 245 CO -0.01 0.90 0.03 0.22 -2.27 0.00 0.00 179.45 178.32 2rkv h ASP 246 N 0.93 -0.06 -0.73 4.20 3.58 -0.97 0.60 116.42 123.97 2rkv h ASP 246 Ca 0.20 0.06 0.01 0.00 0.42 0.00 0.00 57.03 57.72 2rkv h ASP 246 Cb 0.33 0.09 -0.04 0.00 1.72 0.00 0.00 39.33 41.44 2rkv h ASP 246 CO -0.00 0.00 0.48 0.00 -2.88 0.00 0.00 179.24 176.84 2rkv h ALA 247 N 1.23 0.93 -0.23 -0.78 0.00 -0.91 -1.59 119.26 117.91 2rkv h ALA 247 Ca 0.14 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.96 2rkv h ALA 247 Cb 0.17 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 2rkv h ALA 247 CO -0.21 0.32 -0.01 0.00 0.00 0.00 0.00 179.25 179.35 2rkv h ALA 248 N 1.28 0.31 -0.59 0.00 0.00 -1.08 -3.25 119.26 115.93 2rkv h ALA 248 Ca 0.27 -0.22 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 2rkv h ALA 248 Cb -0.08 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.60 2rkv h ALA 248 CO -0.07 0.05 0.34 1.15 0.00 0.00 0.00 179.25 180.72 2rkv h THR 249 N 0.17 1.17 0.00 0.00 2.02 -0.53 -1.12 112.91 114.63 2rkv h THR 249 Ca 0.06 -0.40 0.00 0.00 0.77 0.00 0.00 66.41 66.84 2rkv h THR 249 Cb 0.43 0.36 0.00 0.00 -1.74 0.00 0.00 68.15 67.19 2rkv h THR 249 CO 0.01 0.18 0.00 0.29 0.37 0.00 0.00 175.52 176.38 2rkv n LYS 250 N -4.41 0.20 -1.14 6.66 5.02 -0.63 -3.74 118.16 120.13 2rkv n LYS 250 Ca 0.06 0.44 0.03 0.00 -2.02 0.00 0.00 58.31 56.81 2rkv n LYS 250 Cb 0.08 -1.89 0.12 0.00 -0.02 0.00 0.00 35.03 33.32 2rkv n LYS 250 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 2rkv n THR 251 N -2.28 1.39 -2.44 -0.18 -2.24 -0.43 -5.07 114.28 103.03 2rkv n THR 251 Ca 0.02 -2.49 -0.35 0.00 -2.27 0.00 0.00 64.05 58.97 2rkv n THR 251 Cb 0.23 0.22 -0.02 0.00 -2.10 0.00 0.00 70.33 68.66 2rkv n THR 251 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2rkv s LEU 252 N -2.12 3.83 0.72 3.22 1.43 -1.15 -2.70 118.68 121.91 2rkv s LEU 252 Ca 0.37 2.03 -0.16 0.00 -1.03 0.00 0.00 54.13 55.34 2rkv s LEU 252 Cb 0.38 -4.55 0.03 0.00 0.03 0.00 0.00 46.19 42.08 2rkv s LEU 252 CO -0.10 -0.93 1.23 0.47 0.23 0.00 0.00 176.35 177.26 2rkv n ASP 253 N -1.04 1.51 0.16 2.29 9.92 -1.26 -4.91 116.55 123.21 2rkv n ASP 253 Ca 0.10 0.71 0.12 0.00 -0.53 0.00 0.00 54.79 55.19 2rkv n ASP 253 Cb 0.52 -1.52 0.64 0.00 -0.64 0.00 0.00 41.12 40.11 2rkv n ASP 253 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2rkv h ALA 254 N -0.14 2.14 0.00 2.24 0.00 -2.00 -1.83 119.26 119.67 2rkv h ALA 254 Ca -0.49 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.42 2rkv h ALA 254 Cb 1.32 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.12 2rkv h ALA 254 CO 0.49 -0.19 0.00 -1.13 0.00 0.00 0.00 179.25 178.43 2rkv n SER 255 N -4.49 0.00 -4.18 0.00 3.41 -1.26 -4.75 113.62 102.35 2rkv n SER 255 Ca 0.01 0.12 -0.35 0.00 -0.26 0.00 0.00 58.87 58.40 2rkv n SER 255 Cb 0.25 -0.37 -0.14 0.00 -0.26 0.00 0.00 64.21 63.69 2rkv n SER 255 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 2rkv s THR 256 N -2.74 2.93 0.15 6.66 2.01 -0.69 -4.99 115.64 118.97 2rkv s THR 256 Ca 0.22 -1.29 -0.10 0.00 0.31 0.00 0.00 61.69 60.83 2rkv s THR 256 Cb 0.19 -2.63 -0.02 0.00 0.01 0.00 0.00 72.50 70.06 2rkv s THR 256 CO 0.48 -0.02 1.52 0.11 -0.69 0.00 0.00 174.62 176.02 2rkv h LYS 257 N 7.99 0.97 -2.96 4.92 1.79 -1.85 -3.43 116.57 124.00 2rkv h LYS 257 Ca -0.24 -0.46 -0.03 0.00 -2.18 0.00 0.00 60.65 57.74 2rkv h LYS 257 Cb 1.07 -0.01 -0.13 0.00 -1.58 0.00 0.00 32.23 31.58 2rkv h LYS 257 CO 0.54 1.12 0.15 -0.59 -1.08 0.00 0.00 179.45 179.59 2rkv s PHE 258 N -4.54 -0.48 0.33 -1.35 -0.12 -1.26 -5.13 117.98 105.42 2rkv s PHE 258 Ca -0.11 0.34 0.05 0.00 -0.05 0.00 0.00 56.93 57.15 2rkv s PHE 258 Cb 0.12 0.48 -0.06 0.00 -0.63 0.00 0.00 43.02 42.92 2rkv s PHE 258 CO 0.88 -0.79 0.03 0.14 -0.05 0.00 0.00 175.22 175.43 2rkv s VAL 259 N -3.42 1.36 0.37 -2.49 -7.23 -1.26 -5.00 120.40 102.73 2rkv s VAL 259 Ca -0.00 -2.02 0.07 0.00 -1.81 0.00 0.00 61.98 58.22 2rkv s VAL 259 Cb -0.00 -2.76 -0.00 0.00 0.56 0.00 0.00 36.38 34.17 2rkv s VAL 259 CO -0.10 -0.05 0.49 -0.94 -0.31 0.00 0.00 175.10 174.19 2rkv s SER 260 N -3.51 5.74 0.18 4.85 1.04 -1.26 -4.99 113.70 115.75 2rkv s SER 260 Ca 0.35 -0.34 -0.14 0.00 0.48 0.00 0.00 55.95 56.30 2rkv s SER 260 Cb 0.08 -0.95 0.15 0.00 0.10 0.00 0.00 66.02 65.41 2rkv s SER 260 CO 0.15 -0.57 1.70 0.74 0.98 0.00 0.00 173.24 176.25 2rkv h THR 261 N 0.83 0.68 -0.57 2.02 2.02 -1.96 -0.81 112.91 115.13 2rkv h THR 261 Ca -0.43 -0.05 0.01 0.00 0.77 0.00 0.00 66.41 66.71 2rkv h THR 261 Cb 1.27 0.52 -0.03 0.00 -1.74 0.00 0.00 68.15 68.17 2rkv h THR 261 CO 0.50 0.03 0.37 -0.78 0.37 0.00 0.00 175.52 176.01 2rkv h ASP 262 N 0.15 0.62 -0.49 4.18 1.82 -1.97 -1.64 116.42 119.08 2rkv h ASP 262 Ca 0.23 -0.01 0.08 0.00 -0.39 0.00 0.00 57.03 56.93 2rkv h ASP 262 Cb 0.32 -0.15 -0.06 0.00 0.68 0.00 0.00 39.33 40.12 2rkv h ASP 262 CO -0.35 0.44 0.13 0.44 -1.61 0.00 0.00 179.24 178.30 2rkv h ASP 263 N 0.74 0.08 -0.28 2.28 3.32 -1.82 -0.99 116.42 119.74 2rkv h ASP 263 Ca 0.22 0.08 -0.02 0.00 0.02 0.00 0.00 57.03 57.32 2rkv h ASP 263 Cb -0.05 0.09 -0.01 0.00 0.22 0.00 0.00 39.33 39.58 2rkv h ASP 263 CO -0.06 0.07 0.08 0.00 -1.72 0.00 0.00 179.24 177.61 2rkv h ALA 264 N 1.36 0.37 -0.43 3.45 0.00 -0.56 0.67 119.26 124.13 2rkv h ALA 264 Ca 0.24 -0.16 -0.06 0.00 0.00 0.00 0.00 54.91 54.93 2rkv h ALA 264 Cb 0.30 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 2rkv h ALA 264 CO -0.29 0.02 0.02 1.25 0.00 0.00 0.00 179.25 180.25 2rkv h LEU 265 N 0.29 0.72 -0.52 0.00 5.85 -1.23 -0.36 115.31 120.08 2rkv h LEU 265 Ca 0.09 -0.29 0.05 0.00 0.84 0.00 0.00 57.88 58.57 2rkv h LEU 265 Cb 0.26 -0.19 -0.05 0.00 0.37 0.00 0.00 40.66 41.05 2rkv h LEU 265 CO -0.00 0.84 0.24 0.28 -0.34 0.00 0.00 178.44 179.46 2rkv h SER 266 N 0.59 0.32 -0.63 1.25 0.02 -0.99 -1.23 113.55 112.89 2rkv h SER 266 Ca 0.12 0.04 -0.04 0.00 -0.84 0.00 0.00 61.79 61.07 2rkv h SER 266 Cb 0.45 -0.02 -0.03 0.00 0.14 0.00 0.00 62.40 62.95 2rkv h SER 266 CO 0.02 0.22 0.22 0.00 -1.14 0.00 0.00 176.83 176.15 2rkv h ALA 267 N 1.30 0.82 -0.73 3.77 0.00 -0.63 -1.92 119.26 121.86 2rkv h ALA 267 Ca 0.23 -0.19 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 2rkv h ALA 267 Cb 0.18 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.69 2rkv h ALA 267 CO -0.19 0.46 0.33 0.35 0.00 0.00 0.00 179.25 180.21 2rkv h PHE 268 N 0.89 1.06 -0.26 0.00 3.57 -0.69 -0.15 116.94 121.36 2rkv h PHE 268 Ca 0.20 -0.05 -0.08 0.00 3.53 0.00 0.00 57.97 61.57 2rkv h PHE 268 Cb 0.25 -0.33 -0.01 0.00 2.79 0.00 0.00 35.95 38.66 2rkv h PHE 268 CO 0.02 0.79 -0.15 0.82 -2.23 0.00 0.00 178.31 177.55 2rkv h ILE 269 N 1.05 1.30 -0.56 1.41 2.04 -0.98 0.06 117.51 121.84 2rkv h ILE 269 Ca 0.25 -1.25 0.01 0.00 1.00 0.00 0.00 64.86 64.86 2rkv h ILE 269 Cb 0.14 1.57 -0.03 0.00 -0.74 0.00 0.00 36.82 37.76 2rkv h ILE 269 CO -0.03 0.39 0.37 -0.25 0.00 0.00 0.00 178.15 178.63 2rkv h TRP 270 N 0.28 0.70 -0.28 1.37 7.01 -1.06 0.11 115.95 124.08 2rkv h TRP 270 Ca 0.05 0.02 -0.03 0.00 2.11 0.00 0.00 58.89 61.04 2rkv h TRP 270 Cb 0.67 -0.24 -0.01 0.00 -2.10 0.00 0.00 29.16 27.48 2rkv h TRP 270 CO 0.07 0.44 0.08 -0.22 -2.79 0.00 0.00 178.44 176.01 2rkv h LYS 271 N 0.75 0.45 -0.32 2.65 3.64 -0.97 -0.90 116.57 121.87 2rkv h LYS 271 Ca 0.20 -0.10 -0.05 0.00 -1.27 0.00 0.00 60.65 59.42 2rkv h LYS 271 Cb -0.08 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 31.66 2rkv h LYS 271 CO -0.04 0.52 -0.01 0.77 -2.27 0.00 0.00 179.45 178.42 2rkv h SER 272 N 0.29 0.57 -0.57 4.20 0.02 -0.73 0.12 113.55 117.45 2rkv h SER 272 Ca 0.09 -0.32 0.03 0.00 -0.84 0.00 0.00 61.79 60.75 2rkv h SER 272 Cb 0.27 -0.15 -0.04 0.00 0.14 0.00 0.00 62.40 62.62 2rkv h SER 272 CO -0.00 0.75 0.34 0.00 -1.14 0.00 0.00 176.83 176.78 2rkv h ALA 273 N 0.84 0.74 -0.40 3.77 0.00 -0.78 -1.89 119.26 121.54 2rkv h ALA 273 Ca 0.09 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.95 2rkv h ALA 273 Cb 0.46 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 2rkv h ALA 273 CO 0.02 0.06 0.10 0.77 0.00 0.00 0.00 179.25 180.20 2rkv h SER 274 N 0.67 0.61 0.00 0.00 0.02 -0.89 -1.15 113.55 112.83 2rkv h SER 274 Ca 0.23 -0.23 0.03 0.00 -0.84 0.00 0.00 61.79 60.98 2rkv h SER 274 Cb 0.03 -0.16 -0.04 0.00 0.14 0.00 0.00 62.40 62.37 2rkv h SER 274 CO -0.10 0.68 -0.25 -0.09 -1.14 0.00 0.00 176.83 175.93 2rkv h ARG 275 N 0.51 -0.37 -0.06 3.45 2.43 -0.62 -2.17 114.38 117.56 2rkv h ARG 275 Ca 0.13 0.03 -0.07 0.00 -0.81 0.00 0.00 59.98 59.25 2rkv h ARG 275 Cb 0.31 0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 29.93 2rkv h ARG 275 CO 0.00 -0.25 -0.29 -0.39 -1.51 0.00 0.00 179.97 177.53 2rkv h VAL 276 N -0.39 1.23 0.00 0.20 -1.51 -1.22 -2.48 116.25 112.08 2rkv h VAL 276 Ca 0.06 -1.11 -0.03 0.00 -1.23 0.00 0.00 66.70 64.40 2rkv h VAL 276 Cb 0.47 1.52 -0.00 0.00 -2.13 0.00 0.00 31.29 31.14 2rkv h VAL 276 CO -0.22 0.33 -0.12 0.03 -1.23 0.00 0.00 177.57 176.36 2rkv h ARG 277 N 0.09 0.00 -0.07 5.19 3.08 -0.80 -2.25 114.38 119.63 2rkv h ARG 277 Ca 0.01 0.00 0.02 0.00 0.07 0.00 0.00 59.98 60.08 2rkv h ARG 277 Cb 0.57 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.62 2rkv h ARG 277 CO 0.04 0.12 0.12 -0.07 -1.07 0.00 0.00 179.97 179.11 2rkv h LEU 278 N 0.00 0.00 -0.28 3.04 3.38 -0.91 -0.35 115.31 120.18 2rkv h LEU 278 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2rkv h LEU 278 Cb 0.49 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.24 2rkv h LEU 278 CO 0.02 0.00 0.00 -0.62 0.09 0.00 0.00 178.44 177.93 2rkv n GLU 279 N -3.52 0.14 0.00 1.13 -0.58 -0.84 -3.94 120.64 113.02 2rkv n GLU 279 Ca -0.01 0.28 0.00 0.00 -0.42 0.00 0.00 57.16 57.01 2rkv n GLU 279 Cb 0.21 -1.72 0.00 0.00 -0.57 0.00 0.00 31.44 29.36 2rkv n GLU 279 CO 0.00 0.00 0.00 2.89 -0.48 0.00 0.00 177.13 179.54 2rkv n ARG 280 N -1.96 3.02 -4.18 3.49 1.85 -0.31 -5.10 116.66 113.46 2rkv n ARG 280 Ca 0.04 0.00 -0.11 0.00 -1.00 0.00 0.00 57.85 56.78 2rkv n ARG 280 Cb 0.27 -0.63 -0.10 0.00 -1.05 0.00 0.00 32.46 30.95 2rkv n ARG 280 CO 0.00 0.00 0.00 0.96 -0.01 0.00 0.00 177.63 178.58 2rkv s ILE 281 N -1.02 0.44 0.47 8.89 -4.36 -0.30 -5.15 121.20 120.18 2rkv s ILE 281 Ca 0.00 -1.93 -0.22 0.00 -0.26 0.00 0.00 60.65 58.24 2rkv s ILE 281 Cb 0.00 -1.96 -0.08 0.00 1.25 0.00 0.00 42.46 41.67 2rkv s ILE 281 CO 0.00 -0.59 1.10 -0.62 0.24 0.00 0.00 174.94 175.07 2rkv s ASP 282 N -3.08 6.24 0.65 4.36 2.15 -1.26 -4.33 116.67 121.40 2rkv s ASP 282 Ca 0.20 2.13 0.37 0.00 0.43 0.00 0.00 52.55 55.69 2rkv s ASP 282 Cb 0.07 -2.58 2.08 0.00 -0.30 0.00 0.00 42.92 42.18 2rkv s ASP 282 CO 0.00 -0.86 2.23 1.23 -0.17 0.00 0.00 175.17 177.60 2rkv h GLY 283 N 1.85 0.00 2.00 2.66 0.00 -1.94 -1.59 103.07 106.05 2rkv h GLY 283 Ca -0.49 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.84 2rkv h GLY 283 CO 0.60 0.00 0.00 -1.14 0.00 0.00 0.00 176.54 176.00 2rkv n SER 284 N -3.25 0.06 -4.71 0.19 3.41 -1.26 -0.46 113.62 107.60 2rkv n SER 284 Ca -0.02 0.51 -0.43 0.00 -0.26 0.00 0.00 58.87 58.67 2rkv n SER 284 Cb 0.18 -0.52 -0.03 0.00 -0.26 0.00 0.00 64.21 63.57 2rkv n SER 284 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2rkv n ALA 285 N -1.52 2.47 -1.74 7.33 0.00 -0.60 -4.78 120.51 121.66 2rkv n ALA 285 Ca 0.07 0.40 -0.37 0.00 0.00 0.00 0.00 53.44 53.53 2rkv n ALA 285 Cb 0.33 -2.50 0.05 0.00 0.00 0.00 0.00 19.45 17.33 2rkv n ALA 285 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 2rkv s PRO 286 N 1.33 2.91 -0.02 0.00 0.02 -1.26 -0.74 135.00 137.25 2rkv s PRO 286 Ca 0.77 2.11 0.00 0.00 0.02 0.00 0.00 61.00 63.90 2rkv s PRO 286 Cb -0.54 -2.06 0.02 0.00 0.02 0.00 0.00 34.50 31.94 2rkv s PRO 286 CO 0.34 -1.33 0.00 -0.08 -0.33 0.00 0.00 177.00 175.60 2rkv s THR 287 N -1.38 0.08 -0.13 0.99 -1.32 -0.23 -4.66 115.64 108.99 2rkv s THR 287 Ca 0.76 0.07 0.03 0.00 -1.21 0.00 0.00 61.69 61.34 2rkv s THR 287 Cb -0.38 -0.15 0.00 0.00 -1.51 0.00 0.00 72.50 70.47 2rkv s THR 287 CO 0.42 0.08 -0.21 -0.70 -2.21 0.00 0.00 174.62 172.01 2rkv s GLU 288 N 0.64 3.07 -0.19 7.08 2.12 -1.26 -1.12 118.70 129.05 2rkv s GLU 288 Ca -0.06 -0.84 -0.16 0.00 0.36 0.00 0.00 54.97 54.28 2rkv s GLU 288 Cb -0.09 -2.43 -0.04 0.00 0.26 0.00 0.00 34.13 31.84 2rkv s GLU 288 CO -0.01 0.06 0.38 0.12 -0.54 0.00 0.00 175.26 175.27 2rkv s PHE 289 N 0.64 3.40 -0.25 5.30 5.36 0.25 -1.57 117.98 131.11 2rkv s PHE 289 Ca -0.11 0.62 -0.03 0.00 -0.96 0.00 0.00 56.93 56.46 2rkv s PHE 289 Cb -0.16 -2.49 0.02 0.00 -0.34 0.00 0.00 43.02 40.05 2rkv s PHE 289 CO 0.02 0.05 -0.04 0.00 -1.46 0.00 0.00 175.22 173.79 2rkv s ARG 291 N 1.37 3.31 0.21 0.00 3.52 -0.06 -1.12 118.95 126.19 2rkv s ARG 291 Ca 0.02 -0.68 -0.30 0.00 -0.13 0.00 0.00 55.73 54.64 2rkv s ARG 291 Cb -0.16 -2.81 -0.09 0.00 -1.56 0.00 0.00 34.95 30.33 2rkv s ARG 291 CO -0.04 -0.06 1.31 0.00 -0.81 0.00 0.00 175.30 175.70 2rkv s ALA 292 N 1.07 3.53 -0.05 6.12 0.00 -0.19 -0.59 121.76 131.64 2rkv s ALA 292 Ca 0.00 1.12 -0.00 0.00 0.00 0.00 0.00 51.96 53.08 2rkv s ALA 292 Cb -0.15 -3.48 0.03 0.00 0.00 0.00 0.00 23.12 19.52 2rkv s ALA 292 CO -0.02 -0.54 -0.01 0.08 0.00 0.00 0.00 175.76 175.27 2rkv s VAL 293 N -0.01 0.36 0.05 0.00 1.01 0.35 -4.62 120.40 117.54 2rkv s VAL 293 Ca 0.56 0.06 -0.30 0.00 0.00 0.00 0.00 61.98 62.30 2rkv s VAL 293 Cb -0.37 -0.48 -0.08 0.00 0.00 0.00 0.00 36.38 35.45 2rkv s VAL 293 CO 0.39 0.23 1.76 -0.62 0.00 0.00 0.00 175.10 176.86 2rkv s ASP 294 N 1.51 6.54 0.00 3.32 2.15 -1.26 -0.92 116.67 128.01 2rkv s ASP 294 Ca -0.02 2.54 0.26 0.00 0.43 0.00 0.00 52.55 55.76 2rkv s ASP 294 Cb -0.13 -2.55 0.70 0.00 -0.30 0.00 0.00 42.92 40.64 2rkv s ASP 294 CO -0.03 -0.96 1.54 0.00 -0.17 0.00 0.00 175.17 175.55 2rkv n ALA 295 N 6.32 2.72 -0.01 3.66 0.00 -0.39 -4.44 120.51 128.38 2rkv n ALA 295 Ca 0.17 -0.51 -0.09 0.00 0.00 0.00 0.00 53.44 53.01 2rkv n ALA 295 Cb 0.41 -1.04 -0.03 0.00 0.00 0.00 0.00 19.45 18.78 2rkv n ALA 295 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2rkv h ARG 296 N 2.72 -0.09 -0.40 0.00 3.08 -1.88 -1.69 114.38 116.12 2rkv h ARG 296 Ca 0.00 0.01 0.03 0.00 0.07 0.00 0.00 59.98 60.09 2rkv h ARG 296 Cb 0.64 0.02 -0.03 0.00 0.08 0.00 0.00 29.97 30.68 2rkv h ARG 296 CO 0.00 -0.06 0.19 -1.35 -1.07 0.00 0.00 179.97 177.68 2rkv h PRO 297 N -0.10 0.39 -0.10 0.04 0.11 -1.78 0.35 132.00 130.91 2rkv h PRO 297 Ca 0.08 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 66.16 2rkv h PRO 297 Cb 0.22 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 31.23 2rkv h PRO 297 CO -0.19 0.25 -0.00 0.00 -0.21 0.00 0.00 178.00 177.85 2rkv h ALA 298 N 1.21 1.82 -0.01 -0.75 0.00 -1.81 -2.02 119.26 117.71 2rkv h ALA 298 Ca 0.17 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.02 2rkv h ALA 298 Cb 0.08 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.82 2rkv h ALA 298 CO -0.12 0.14 -0.24 -0.12 0.00 0.00 0.00 179.25 178.91 2rkv n MET 299 N -4.45 0.80 -2.24 0.00 0.00 -0.65 -4.71 117.12 105.87 2rkv n MET 299 Ca -0.01 -0.45 -0.10 0.00 0.00 0.00 0.00 57.70 57.14 2rkv n MET 299 Cb 0.14 -1.49 -0.00 0.00 0.00 0.00 0.00 33.22 31.86 2rkv n MET 299 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 2rkv n GLY 300 N 1.34 -0.03 3.83 -5.12 0.00 -0.34 -5.03 105.19 99.83 2rkv n GLY 300 Ca 0.12 -0.45 -0.34 0.00 0.00 0.00 0.00 46.02 45.35 2rkv n GLY 300 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2rkv s VAL 301 N -2.54 5.09 0.37 1.61 1.01 -0.03 -5.02 120.40 120.88 2rkv s VAL 301 Ca 0.02 -0.15 -0.27 0.00 0.00 0.00 0.00 61.98 61.57 2rkv s VAL 301 Cb -0.01 -3.29 -0.11 0.00 0.00 0.00 0.00 36.38 32.97 2rkv s VAL 301 CO 0.02 0.45 1.30 -0.24 0.00 0.00 0.00 175.10 176.63 2rkv n SER 302 N 1.45 2.77 0.33 3.32 2.88 -1.26 -4.33 113.62 118.79 2rkv n SER 302 Ca -0.15 1.18 0.20 0.00 -1.33 0.00 0.00 58.87 58.77 2rkv n SER 302 Cb 0.53 -1.50 1.08 0.00 -0.75 0.00 0.00 64.21 63.58 2rkv n SER 302 CO 0.00 0.00 0.00 -1.13 -1.23 0.00 0.00 175.04 172.68 2rkv h ASN 303 N 2.42 0.00 0.00 -3.46 -1.24 -1.97 -1.50 115.58 109.83 2rkv h ASN 303 Ca -0.47 0.00 0.00 0.00 0.71 0.00 0.00 56.30 56.54 2rkv h ASN 303 Cb 1.28 0.00 0.00 0.00 0.73 0.00 0.00 38.32 40.33 2rkv h ASN 303 CO 0.62 0.00 -0.01 0.59 -1.29 0.00 0.00 177.43 177.34 2rkv n ASN 304 N -3.06 1.03 -4.66 1.15 3.02 -1.26 -4.82 115.26 106.65 2rkv n ASN 304 Ca -0.03 -1.32 -0.42 0.00 -0.03 0.00 0.00 54.58 52.78 2rkv n ASN 304 Cb 0.17 0.00 -0.03 0.00 -0.61 0.00 0.00 39.78 39.32 2rkv n ASN 304 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 2rkv s TYR 305 N -2.02 1.96 -2.15 3.10 5.04 -0.57 -4.40 117.35 118.32 2rkv s TYR 305 Ca 0.40 0.15 0.19 0.00 -2.44 0.00 0.00 57.07 55.38 2rkv s TYR 305 Cb 0.21 -3.94 0.86 0.00 0.35 0.00 0.00 41.96 39.43 2rkv s TYR 305 CO 0.35 -3.98 1.59 -0.35 -1.34 0.00 0.00 175.55 171.82 2rkv n PRO 306 N 7.01 1.42 0.00 4.97 -0.04 -1.26 -4.21 135.00 142.89 2rkv n PRO 306 Ca 0.17 -0.64 0.00 0.00 -0.04 0.00 0.00 63.50 62.99 2rkv n PRO 306 Cb 0.42 -1.34 0.00 0.00 -0.04 0.00 0.00 33.50 32.55 2rkv n PRO 306 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2rkv n GLY 307 N 0.98 1.12 3.15 0.55 0.00 -1.26 -4.35 105.19 105.37 2rkv n GLY 307 Ca 0.15 -1.65 -0.35 0.00 0.00 0.00 0.00 46.02 44.17 2rkv n GLY 307 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2rkv s LEU 308 N 0.00 4.20 -0.43 0.99 1.98 -1.26 -1.99 118.68 122.18 2rkv s LEU 308 Ca 0.00 -1.47 0.05 0.00 -2.89 0.00 0.00 54.13 49.82 2rkv s LEU 308 Cb 0.00 -1.73 0.17 0.00 0.66 0.00 0.00 46.19 45.29 2rkv s LEU 308 CO 0.00 -0.32 0.42 -0.22 -1.89 0.00 0.00 176.35 174.34 2rkv s LEU 309 N 1.21 0.74 0.01 -0.68 2.96 -1.26 -4.58 118.68 117.09 2rkv s LEU 309 Ca -0.02 -2.74 -0.06 0.00 -0.22 0.00 0.00 54.13 51.09 2rkv s LEU 309 Cb -0.20 0.10 -0.00 0.00 0.50 0.00 0.00 46.19 46.58 2rkv s LEU 309 CO -0.02 -0.15 0.11 -1.58 -1.32 0.00 0.00 176.35 173.40 2rkv s GLN 310 N 0.28 0.50 0.10 1.98 0.74 -1.26 -1.26 119.66 120.74 2rkv s GLN 310 Ca 0.32 -0.52 0.02 0.00 0.05 0.00 0.00 55.36 55.23 2rkv s GLN 310 Cb 0.02 0.20 -0.01 0.00 1.10 0.00 0.00 33.01 34.33 2rkv s GLN 310 CO -0.16 -0.12 0.06 -1.71 -0.55 0.00 0.00 175.29 172.81 2rkv n ASN 311 N 1.26 0.31 -4.39 6.67 2.85 -0.10 -4.85 115.26 117.01 2rkv n ASN 311 Ca -0.22 -1.58 -0.20 0.00 -0.11 0.00 0.00 54.58 52.46 2rkv n ASN 311 Cb 0.56 0.37 -0.10 0.00 1.24 0.00 0.00 39.78 41.86 2rkv n ASN 311 CO 0.00 0.00 0.00 -0.04 -2.11 0.00 0.00 177.26 175.11 2rkv s MET 312 N -2.38 1.45 0.05 1.20 -1.94 -1.26 -0.50 119.30 115.92 2rkv s MET 312 Ca 0.08 -1.65 0.04 0.00 -1.71 0.00 0.00 55.69 52.46 2rkv s MET 312 Cb 0.00 -1.36 -0.04 0.00 2.01 0.00 0.00 34.83 35.45 2rkv s MET 312 CO 0.06 0.24 -0.02 0.95 -0.01 0.00 0.00 175.02 176.23 2rkv s THR 313 N -2.78 3.90 -0.03 2.05 -4.23 0.24 -4.90 115.64 109.89 2rkv s THR 313 Ca 0.25 -0.88 0.07 0.00 -1.18 0.00 0.00 61.69 59.95 2rkv s THR 313 Cb -0.02 -2.79 -0.02 0.00 1.34 0.00 0.00 72.50 71.01 2rkv s THR 313 CO 0.10 0.24 -0.24 -0.31 -0.54 0.00 0.00 174.62 173.87 2rkv s TYR 314 N -1.18 2.17 -0.14 3.99 1.51 -1.26 -0.88 117.35 121.56 2rkv s TYR 314 Ca 0.22 -0.48 -0.04 0.00 -1.01 0.00 0.00 57.07 55.76 2rkv s TYR 314 Cb -0.11 -1.41 0.05 0.00 -0.11 0.00 0.00 41.96 40.38 2rkv s TYR 314 CO 0.14 -0.09 0.06 -1.01 -1.11 0.00 0.00 175.55 173.54 2rkv s HIS 315 N -0.43 0.37 -0.13 2.71 3.76 -0.43 -4.98 115.29 116.16 2rkv s HIS 315 Ca 0.05 -0.28 -0.01 0.00 -0.15 0.00 0.00 55.06 54.67 2rkv s HIS 315 Cb -0.10 -0.72 -0.02 0.00 1.11 0.00 0.00 32.58 32.84 2rkv s HIS 315 CO 0.00 -0.44 -0.08 -0.80 -0.85 0.00 0.00 174.74 172.57 2rkv s ASN 316 N 2.07 4.45 0.00 1.40 0.01 -1.26 -0.58 114.94 121.03 2rkv s ASN 316 Ca 0.02 -0.19 0.00 0.00 -0.71 0.00 0.00 52.86 51.99 2rkv s ASN 316 Cb -0.15 -1.57 0.00 0.00 0.41 0.00 0.00 41.25 39.94 2rkv s ASN 316 CO -0.07 0.21 0.00 -0.24 -1.51 0.00 0.00 177.10 175.49 2rkv n SER 317 N 3.25 0.00 -4.34 -1.22 2.88 -0.28 -5.01 113.62 108.91 2rkv n SER 317 Ca -0.18 0.00 -0.23 0.00 -1.33 0.00 0.00 58.87 57.13 2rkv n SER 317 Cb 0.53 0.00 -0.12 0.00 -0.75 0.00 0.00 64.21 63.87 2rkv n SER 317 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 2rkv s THR 318 N -1.68 1.90 0.21 2.46 -4.23 -1.26 -1.07 115.64 111.97 2rkv s THR 318 Ca 0.00 -1.84 -0.10 0.00 -1.18 0.00 0.00 61.69 58.57 2rkv s THR 318 Cb 0.00 -1.83 0.19 0.00 1.34 0.00 0.00 72.50 72.20 2rkv s THR 318 CO 0.00 -0.20 1.67 0.40 -0.54 0.00 0.00 174.62 175.95 2rkv h ILE 319 N 3.48 0.53 -0.47 2.99 1.08 -0.87 -0.97 117.51 123.28 2rkv h ILE 319 Ca -0.44 -0.05 -0.04 0.00 -0.39 0.00 0.00 64.86 63.94 2rkv h ILE 319 Cb 1.20 0.36 -0.02 0.00 -3.07 0.00 0.00 36.82 35.29 2rkv h ILE 319 CO 0.47 0.03 0.14 1.23 -0.69 0.00 0.00 178.15 179.33 2rkv h GLY 320 N 0.15 0.79 0.91 5.37 0.00 -1.04 -1.38 103.07 107.87 2rkv h GLY 320 Ca 0.33 -0.47 -0.03 0.00 0.00 0.00 0.00 47.33 47.16 2rkv h GLY 320 CO -0.50 0.44 0.09 -2.09 0.00 0.00 0.00 176.54 174.48 2rkv h GLU 321 N 0.62 0.50 -0.54 4.80 4.22 -1.63 -1.15 114.58 121.41 2rkv h GLU 321 Ca 0.15 -0.11 -0.04 0.00 0.08 0.00 0.00 59.36 59.44 2rkv h GLU 321 Cb 0.27 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.43 2rkv h GLU 321 CO -0.00 0.55 0.20 0.82 -2.18 0.00 0.00 179.01 178.39 2rkv h ILE 322 N 0.36 1.23 -0.80 2.32 1.08 -1.15 -1.44 117.51 119.11 2rkv h ILE 322 Ca 0.10 -0.74 -0.04 0.00 -0.39 0.00 0.00 64.86 63.80 2rkv h ILE 322 Cb 0.26 0.69 -0.04 0.00 -3.07 0.00 0.00 36.82 34.66 2rkv h ILE 322 CO -0.00 0.28 0.35 0.00 -0.69 0.00 0.00 178.15 178.09 2rkv h ALA 323 N 1.05 1.04 0.00 1.87 0.00 -1.13 -3.32 119.26 118.77 2rkv h ALA 323 Ca 0.18 -0.18 -0.12 0.00 0.00 0.00 0.00 54.91 54.79 2rkv h ALA 323 Cb 0.24 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 2rkv h ALA 323 CO -0.01 0.64 -1.43 0.09 0.00 0.00 0.00 179.25 178.54 2rkv n ASN 324 N -4.31 0.73 -4.77 0.00 3.02 -0.44 -4.90 115.26 104.58 2rkv n ASN 324 Ca 0.07 0.31 -0.29 0.00 -0.03 0.00 0.00 54.58 54.64 2rkv n ASN 324 Cb 0.17 0.45 0.12 0.00 -0.61 0.00 0.00 39.78 39.91 2rkv n ASN 324 CO 0.00 0.00 0.00 -1.83 -2.62 0.00 0.00 177.26 172.81 2rkv s GLU 325 N -3.06 1.50 0.89 3.52 -1.05 -0.56 -5.02 118.70 114.92 2rkv s GLU 325 Ca -0.03 0.57 -0.11 0.00 -0.15 0.00 0.00 54.97 55.25 2rkv s GLU 325 Cb 0.09 -1.86 0.13 0.00 -0.44 0.00 0.00 34.13 32.05 2rkv s GLU 325 CO 0.82 -2.01 1.10 -1.54 0.95 0.00 0.00 175.26 174.58 2rkv s SER 326 N -3.79 3.35 0.20 0.83 1.04 -1.26 -4.89 113.70 109.17 2rkv s SER 326 Ca 0.63 1.84 -0.10 0.00 0.48 0.00 0.00 55.95 58.79 2rkv s SER 326 Cb -0.16 -2.43 0.14 0.00 0.10 0.00 0.00 66.02 63.67 2rkv s SER 326 CO 0.55 -2.77 1.80 0.25 0.98 0.00 0.00 173.24 174.05 2rkv h LEU 327 N -1.64 0.94 -1.08 2.42 5.85 -1.89 -2.67 115.31 117.24 2rkv h LEU 327 Ca -0.47 -0.12 -0.02 0.00 0.84 0.00 0.00 57.88 58.11 2rkv h LEU 327 Cb 1.27 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 42.02 2rkv h LEU 327 CO 0.49 0.79 0.36 1.23 -0.34 0.00 0.00 178.44 180.97 2rkv h GLY 328 N 1.02 1.08 0.95 3.75 0.00 -1.70 0.35 103.07 108.52 2rkv h GLY 328 Ca 0.25 -0.50 0.02 0.00 0.00 0.00 0.00 47.33 47.10 2rkv h GLY 328 CO -0.04 0.48 0.43 0.00 0.00 0.00 0.00 176.54 177.42 2rkv h ALA 329 N 1.39 0.86 -0.22 3.60 0.00 -1.28 0.60 119.26 124.21 2rkv h ALA 329 Ca 0.25 -0.04 -0.14 0.00 0.00 0.00 0.00 54.91 54.98 2rkv h ALA 329 Cb 0.07 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.62 2rkv h ALA 329 CO -0.04 0.24 -0.42 1.15 0.00 0.00 0.00 179.25 180.18 2rkv h THR 330 N 0.87 1.31 -0.49 0.00 2.02 -1.11 -2.80 112.91 112.72 2rkv h THR 330 Ca 0.26 -1.64 -0.06 0.00 0.77 0.00 0.00 66.41 65.74 2rkv h THR 330 Cb -0.05 1.79 -0.02 0.00 -1.74 0.00 0.00 68.15 68.13 2rkv h THR 330 CO -0.08 0.51 0.05 0.00 0.37 0.00 0.00 175.52 176.38 2rkv h ALA 331 N 0.62 1.18 -0.98 6.16 0.00 -0.81 -2.29 119.26 123.15 2rkv h ALA 331 Ca 0.01 -0.23 0.04 0.00 0.00 0.00 0.00 54.91 54.72 2rkv h ALA 331 Cb 1.02 -0.20 -0.06 0.00 0.00 0.00 0.00 17.79 18.56 2rkv h ALA 331 CO 0.09 0.54 0.64 0.77 0.00 0.00 0.00 179.25 181.30 2rkv h SER 332 N 0.74 1.07 -0.54 0.00 0.02 -0.78 -1.30 113.55 112.75 2rkv h SER 332 Ca 0.15 -0.01 0.08 0.00 -0.84 0.00 0.00 61.79 61.17 2rkv h SER 332 Cb 0.37 -0.24 -0.06 0.00 0.14 0.00 0.00 62.40 62.61 2rkv h SER 332 CO 0.01 0.73 0.20 0.03 -1.14 0.00 0.00 176.83 176.66 2rkv h ARG 333 N 1.24 0.38 0.09 3.45 3.08 -1.14 -1.29 114.38 120.18 2rkv h ARG 333 Ca 0.39 -0.02 -0.00 0.00 0.07 0.00 0.00 59.98 60.41 2rkv h ARG 333 Cb 0.00 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 29.97 2rkv h ARG 333 CO -0.12 0.25 -0.05 -0.07 -1.07 0.00 0.00 179.97 178.91 2rkv h LEU 334 N 0.39 -0.11 -1.81 3.04 3.38 -1.26 -3.18 115.31 115.77 2rkv h LEU 334 Ca 0.26 -0.31 -0.01 0.00 0.09 0.00 0.00 57.88 57.91 2rkv h LEU 334 Cb 0.29 0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.06 2rkv h LEU 334 CO -0.26 0.27 -0.01 -0.09 0.09 0.00 0.00 178.44 178.43 2rkv h ARG 335 N -0.49 0.10 0.00 1.13 9.65 -1.17 -2.78 114.38 120.81 2rkv h ARG 335 Ca -0.01 -0.01 0.00 0.00 -1.10 0.00 0.00 59.98 58.86 2rkv h ARG 335 Cb 0.41 -0.02 0.00 0.00 -1.39 0.00 0.00 29.97 28.97 2rkv h ARG 335 CO 0.02 0.13 0.00 0.66 2.80 0.00 0.00 179.97 183.58 2rkv h SER 336 N 0.10 0.00 -0.19 -3.80 4.64 -1.21 -2.19 113.55 110.91 2rkv h SER 336 Ca 0.03 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.35 2rkv h SER 336 Cb 0.09 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.18 2rkv h SER 336 CO 0.00 0.00 0.00 -0.62 -0.87 0.00 0.00 176.83 175.34 2rkv n GLU 337 N -2.78 2.32 -0.53 4.77 -0.58 -1.05 -4.48 120.64 118.31 2rkv n GLU 337 Ca -0.02 -1.96 0.10 0.00 -0.42 0.00 0.00 57.16 54.86 2rkv n GLU 337 Cb 0.11 -1.48 0.34 0.00 -0.57 0.00 0.00 31.44 29.84 2rkv n GLU 337 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 2rkv n LEU 338 N 1.27 4.41 -4.68 -4.62 4.77 -0.82 -4.67 117.00 112.65 2rkv n LEU 338 Ca 0.17 -2.22 -0.42 0.00 -0.03 0.00 0.00 56.01 53.51 2rkv n LEU 338 Cb 0.57 -0.55 -0.03 0.00 -2.33 0.00 0.00 43.42 41.08 2rkv n LEU 338 CO 0.15 0.85 1.52 -0.62 -1.33 0.00 0.00 177.39 177.96 2rkv s ASP 339 N -0.92 6.45 0.27 -1.43 2.15 -1.26 -4.88 116.67 117.04 2rkv s ASP 339 Ca 0.50 2.70 0.00 0.00 0.43 0.00 0.00 52.55 56.18 2rkv s ASP 339 Cb 0.30 -2.55 0.55 0.00 -0.30 0.00 0.00 42.92 40.92 2rkv s ASP 339 CO 0.27 -1.02 1.78 -0.65 -0.17 0.00 0.00 175.17 175.39 2rkv h PRO 340 N 9.39 0.71 -0.74 4.34 0.11 -1.98 0.02 132.00 143.85 2rkv h PRO 340 Ca -0.47 -0.04 -0.03 0.00 0.11 0.00 0.00 66.00 65.57 2rkv h PRO 340 Cb 1.22 -0.16 -0.03 0.00 0.11 0.00 0.00 31.00 32.14 2rkv h PRO 340 CO 0.94 0.47 0.34 0.00 -0.21 0.00 0.00 178.00 179.54 2rkv h ALA 341 N 1.56 1.21 -0.21 -0.75 0.00 -1.92 0.47 119.26 119.62 2rkv h ALA 341 Ca 0.48 -0.16 -0.06 0.00 0.00 0.00 0.00 54.91 55.17 2rkv h ALA 341 Cb 0.63 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 18.12 2rkv h ALA 341 CO -0.34 0.60 -0.12 0.77 0.00 0.00 0.00 179.25 180.16 2rkv h SER 342 N 1.05 0.46 -0.86 0.00 0.02 -1.63 -1.51 113.55 111.09 2rkv h SER 342 Ca 0.25 -0.43 0.01 0.00 -0.84 0.00 0.00 61.79 60.79 2rkv h SER 342 Cb 0.13 -0.13 -0.04 0.00 0.14 0.00 0.00 62.40 62.50 2rkv h SER 342 CO -0.03 0.79 0.57 0.24 -1.14 0.00 0.00 176.83 177.26 2rkv h MET 343 N 0.14 1.13 0.15 3.45 2.86 -0.78 -1.10 114.93 120.78 2rkv h MET 343 Ca 0.04 -0.07 -0.01 0.00 -2.06 0.00 0.00 59.70 57.61 2rkv h MET 343 Cb 0.62 -0.26 0.00 0.00 0.06 0.00 0.00 31.60 32.03 2rkv h MET 343 CO 0.03 0.75 -0.07 -0.09 1.06 0.00 0.00 176.91 178.59 2rkv h ARG 344 N 1.17 -0.19 -0.49 1.72 2.43 -0.85 -1.14 114.38 117.03 2rkv h ARG 344 Ca 0.32 0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 59.50 2rkv h ARG 344 Cb -0.13 0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 29.44 2rkv h ARG 344 CO -0.07 -0.03 0.30 0.37 -1.51 0.00 0.00 179.97 179.03 2rkv h GLN 345 N -0.31 0.66 -0.36 0.20 5.75 -1.09 -0.15 115.11 119.82 2rkv h GLN 345 Ca -0.02 -0.06 -0.03 0.00 -0.15 0.00 0.00 58.65 58.39 2rkv h GLN 345 Cb 0.25 -0.14 -0.01 0.00 1.07 0.00 0.00 27.48 28.64 2rkv h GLN 345 CO 0.03 0.48 0.10 0.00 -2.65 0.00 0.00 178.83 176.79 2rkv h ARG 346 N 0.66 0.56 -0.62 1.69 3.08 -1.17 -0.78 114.38 117.80 2rkv h ARG 346 Ca 0.18 -0.13 -0.09 0.00 0.07 0.00 0.00 59.98 60.00 2rkv h ARG 346 Cb -0.02 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 29.93 2rkv h ARG 346 CO -0.03 0.60 0.02 1.15 -1.07 0.00 0.00 179.97 180.63 2rkv h THR 347 N 0.42 1.27 -0.66 2.04 2.02 -1.01 -0.56 112.91 116.43 2rkv h THR 347 Ca 0.11 -1.14 -0.03 0.00 0.77 0.00 0.00 66.41 66.12 2rkv h THR 347 Cb 0.28 0.77 -0.03 0.00 -1.74 0.00 0.00 68.15 67.43 2rkv h THR 347 CO -0.00 0.42 0.28 0.03 0.37 0.00 0.00 175.52 176.61 2rkv h ARG 348 N 0.98 0.96 -0.03 6.66 3.08 -0.85 -1.14 114.38 124.04 2rkv h ARG 348 Ca 0.18 -0.15 -0.00 0.00 0.07 0.00 0.00 59.98 60.08 2rkv h ARG 348 Cb 0.54 -0.17 -0.00 0.00 0.08 0.00 0.00 29.97 30.42 2rkv h ARG 348 CO 0.03 0.77 0.01 0.78 -1.07 0.00 0.00 179.97 180.49 2rkv h GLY 349 N 1.03 0.05 0.85 0.04 0.00 -0.44 -0.26 103.07 104.34 2rkv h GLY 349 Ca 0.23 -0.03 0.02 0.00 0.00 0.00 0.00 47.33 47.55 2rkv h GLY 349 CO -0.02 0.03 0.09 -2.00 0.00 0.00 0.00 176.54 174.64 2rkv h LEU 350 N -0.12 0.12 -0.82 3.11 5.85 -1.00 -0.06 115.31 122.39 2rkv h LEU 350 Ca 0.01 0.02 0.03 0.00 0.84 0.00 0.00 57.88 58.77 2rkv h LEU 350 Cb 0.18 -0.00 -0.05 0.00 0.37 0.00 0.00 40.66 41.16 2rkv h LEU 350 CO -0.00 0.10 0.53 0.00 -0.34 0.00 0.00 178.44 178.73 2rkv h ALA 351 N 1.13 1.07 -0.31 1.25 0.00 -1.16 -1.43 119.26 119.81 2rkv h ALA 351 Ca 0.10 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.92 2rkv h ALA 351 Cb 0.05 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.53 2rkv h ALA 351 CO -0.09 0.38 0.01 1.15 0.00 0.00 0.00 179.25 180.71 2rkv h THR 352 N 1.05 1.25 -0.42 0.00 2.02 -0.63 0.56 112.91 116.75 2rkv h THR 352 Ca 0.32 -0.91 0.03 0.00 0.77 0.00 0.00 66.41 66.62 2rkv h THR 352 Cb -0.03 1.24 -0.03 0.00 -1.74 0.00 0.00 68.15 67.58 2rkv h THR 352 CO -0.10 0.30 0.22 0.22 0.37 0.00 0.00 175.52 176.53 2rkv h TYR 353 N 0.34 0.41 -0.06 3.16 3.20 -0.80 0.27 116.97 123.50 2rkv h TYR 353 Ca 0.09 0.02 0.01 0.00 3.14 0.00 0.00 58.73 61.98 2rkv h TYR 353 Cb 0.41 -0.12 -0.01 0.00 1.54 0.00 0.00 36.73 38.55 2rkv h TYR 353 CO 0.03 0.22 0.01 -0.07 -1.64 0.00 0.00 178.16 176.72 2rkv h LEU 354 N 0.45 0.01 -0.89 2.82 3.38 -1.08 -2.54 115.31 117.46 2rkv h LEU 354 Ca 0.18 0.01 0.08 0.00 0.09 0.00 0.00 57.88 58.24 2rkv h LEU 354 Cb 0.07 0.01 -0.07 0.00 0.09 0.00 0.00 40.66 40.76 2rkv h LEU 354 CO -0.11 0.01 0.54 -0.74 0.09 0.00 0.00 178.44 178.24 2rkv h HIS 355 N 0.04 1.00 0.00 1.13 2.76 -0.44 -2.21 115.15 117.43 2rkv h HIS 355 Ca 0.03 0.03 0.00 0.00 -2.20 0.00 0.00 60.37 58.23 2rkv h HIS 355 Cb 0.02 -0.32 0.00 0.00 1.55 0.00 0.00 27.41 28.66 2rkv h HIS 355 CO -0.10 0.46 0.00 0.09 -1.30 0.00 0.00 177.93 177.08 2rkv n ASN 356 N -4.65 0.00 -4.07 3.26 3.02 0.05 -4.68 115.26 108.19 2rkv n ASN 356 Ca 0.14 0.46 -0.32 0.00 -0.03 0.00 0.00 54.58 54.83 2rkv n ASN 356 Cb 0.24 -0.48 -0.15 0.00 -0.61 0.00 0.00 39.78 38.78 2rkv n ASN 356 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 2rkv s ASN 357 N -2.97 4.51 0.47 6.41 0.01 -0.83 -4.98 114.94 117.57 2rkv s ASN 357 Ca 0.13 -1.49 0.13 0.00 -0.71 0.00 0.00 52.86 50.92 2rkv s ASN 357 Cb 0.16 -1.57 1.10 0.00 0.41 0.00 0.00 41.25 41.35 2rkv s ASN 357 CO 0.44 -0.22 2.09 -0.65 -1.51 0.00 0.00 177.10 177.26 2rkv h PRO 358 N 7.76 0.17 -4.46 -0.60 0.11 -1.83 -3.35 132.00 129.80 2rkv h PRO 358 Ca -0.17 -0.01 -0.72 0.00 0.11 0.00 0.00 66.00 65.20 2rkv h PRO 358 Cb 1.04 -0.04 -0.21 0.00 0.11 0.00 0.00 31.00 31.90 2rkv h PRO 358 CO 0.47 0.14 -0.01 0.34 -0.21 0.00 0.00 178.00 178.73 2rkv s ASP 359 N -6.94 6.19 0.00 -2.05 -1.08 -1.24 -1.20 116.67 110.35 2rkv s ASP 359 Ca -0.06 -1.56 0.18 0.00 -0.52 0.00 0.00 52.55 50.59 2rkv s ASP 359 Cb 0.17 -2.27 0.53 0.00 -1.46 0.00 0.00 42.92 39.89 2rkv s ASP 359 CO 0.69 -1.02 1.43 0.29 0.52 0.00 0.00 175.17 177.09 2rkv n LYS 360 N 5.92 2.08 0.29 4.34 5.02 -1.26 -4.51 118.16 130.04 2rkv n LYS 360 Ca -0.11 -1.65 0.19 0.00 -2.02 0.00 0.00 58.31 54.72 2rkv n LYS 360 Cb 0.42 -1.41 0.89 0.00 -0.02 0.00 0.00 35.03 34.90 2rkv n LYS 360 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 2rkv h SER 361 N 2.97 0.00 0.36 4.39 4.64 -1.94 -2.27 113.55 121.69 2rkv h SER 361 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2rkv h SER 361 Cb 0.67 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.76 2rkv h SER 361 CO 0.00 0.00 -0.34 0.59 -0.87 0.00 0.00 176.83 176.21 2rkv n ASN 362 N -2.98 0.76 -4.72 4.97 3.02 -1.26 -4.89 115.26 110.16 2rkv n ASN 362 Ca -0.01 -0.59 -0.38 0.00 -0.03 0.00 0.00 54.58 53.57 2rkv n ASN 362 Cb 0.19 0.15 -0.06 0.00 -0.61 0.00 0.00 39.78 39.45 2rkv n ASN 362 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2rkv s VAL 363 N -2.70 5.16 -0.17 2.41 1.01 -0.86 -0.07 120.40 125.18 2rkv s VAL 363 Ca 0.19 1.01 -0.12 0.00 0.00 0.00 0.00 61.98 63.06 2rkv s VAL 363 Cb 0.19 -3.85 0.05 0.00 0.00 0.00 0.00 36.38 32.77 2rkv s VAL 363 CO 0.59 0.30 0.43 -0.55 0.00 0.00 0.00 175.10 175.87 2rkv s SER 364 N 0.70 -0.51 0.40 3.32 0.15 -0.01 -4.54 113.70 113.21 2rkv s SER 364 Ca 0.27 0.91 0.28 0.00 0.70 0.00 0.00 55.95 58.12 2rkv s SER 364 Cb -0.15 0.85 1.43 0.00 -1.71 0.00 0.00 66.02 66.43 2rkv s SER 364 CO 0.11 -0.18 1.86 -0.07 1.20 0.00 0.00 173.24 176.16 2rkv h LEU 365 N 6.35 0.00 -3.76 3.45 3.38 -1.87 -2.58 115.31 120.29 2rkv h LEU 365 Ca -0.32 0.00 -0.33 0.00 0.09 0.00 0.00 57.88 57.32 2rkv h LEU 365 Cb 1.18 0.00 -0.31 0.00 0.09 0.00 0.00 40.66 41.62 2rkv h LEU 365 CO 0.26 0.00 -0.80 0.35 0.09 0.00 0.00 178.44 178.34 2rkv n THR 366 N -2.51 2.03 -0.14 0.22 -2.24 -1.26 -4.88 114.28 105.50 2rkv n THR 366 Ca -0.01 -3.49 0.17 0.00 -2.27 0.00 0.00 64.05 58.45 2rkv n THR 366 Cb 0.11 -0.33 0.55 0.00 -2.10 0.00 0.00 70.33 68.55 2rkv n THR 366 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2rkv h ALA 367 N 1.85 2.21 0.00 6.98 0.00 -1.39 -2.40 119.26 126.51 2rkv h ALA 367 Ca 0.14 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.05 2rkv h ALA 367 Cb 1.39 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 19.14 2rkv h ALA 367 CO 0.42 -0.41 -0.09 -0.40 0.00 0.00 0.00 179.25 178.77 2rkv n ASP 368 N -4.45 2.00 -4.67 0.00 5.68 -1.25 -3.85 116.55 110.00 2rkv n ASP 368 Ca 0.14 -2.96 -0.42 0.00 -0.50 0.00 0.00 54.79 51.05 2rkv n ASP 368 Cb 0.56 -0.40 -0.03 0.00 -1.14 0.00 0.00 41.12 40.11 2rkv n ASP 368 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2rkv s ALA 369 N -2.48 3.54 -0.31 2.12 0.00 -0.91 -4.71 121.76 119.01 2rkv s ALA 369 Ca 0.28 0.21 -0.21 0.00 0.00 0.00 0.00 51.96 52.24 2rkv s ALA 369 Cb 0.24 -3.42 -0.00 0.00 0.00 0.00 0.00 23.12 19.94 2rkv s ALA 369 CO 0.02 -0.78 0.67 0.34 0.00 0.00 0.00 175.76 176.01 2rkv s ASP 370 N 1.16 6.53 0.58 0.00 -1.08 -1.26 -4.34 116.67 118.26 2rkv s ASP 370 Ca 0.44 0.45 0.28 0.00 -0.52 0.00 0.00 52.55 53.21 2rkv s ASP 370 Cb -0.17 -2.35 1.69 0.00 -1.46 0.00 0.00 42.92 40.63 2rkv s ASP 370 CO 0.12 -0.53 2.15 1.55 0.52 0.00 0.00 175.17 178.99 2rkv h PRO 371 N 8.21 0.00 -0.21 4.34 0.13 -1.92 0.28 132.00 142.82 2rkv h PRO 371 Ca -0.26 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 64.77 2rkv h PRO 371 Cb 1.11 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.23 2rkv h PRO 371 CO 0.83 0.00 -0.31 1.03 -0.23 0.00 0.00 178.00 179.32 2rkv h SER 372 N 0.00 0.44 0.00 1.44 0.87 -1.93 -3.38 113.55 111.00 2rkv h SER 372 Ca 0.06 -0.16 0.00 0.00 -1.23 0.00 0.00 61.79 60.45 2rkv h SER 372 Cb 0.31 -0.12 0.00 0.00 -0.44 0.00 0.00 62.40 62.14 2rkv h SER 372 CO -0.00 0.73 0.00 0.35 -0.53 0.00 0.00 176.83 177.38 2rkv n THR 373 N -4.09 0.00 -2.15 2.23 -2.24 -0.67 -5.08 114.28 102.29 2rkv n THR 373 Ca -0.01 -0.40 -0.27 0.00 -2.27 0.00 0.00 64.05 61.11 2rkv n THR 373 Cb 0.44 1.01 0.08 0.00 -2.10 0.00 0.00 70.33 69.76 2rkv n THR 373 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 2rkv s SER 374 N -0.76 4.58 -0.06 3.42 0.01 0.91 -4.14 113.70 117.65 2rkv s SER 374 Ca 0.00 0.44 0.01 0.00 1.31 0.00 0.00 55.95 57.72 2rkv s SER 374 Cb 0.00 -1.00 0.02 0.00 0.21 0.00 0.00 66.02 65.25 2rkv s SER 374 CO 0.00 -1.77 -0.07 -0.69 0.41 0.00 0.00 173.24 171.12 2rkv s VAL 375 N -3.35 0.80 -0.34 3.43 1.01 -0.61 -4.79 120.40 116.54 2rkv s VAL 375 Ca 0.62 -0.25 0.03 0.00 0.00 0.00 0.00 61.98 62.37 2rkv s VAL 375 Cb -0.10 -0.79 0.09 0.00 0.00 0.00 0.00 36.38 35.59 2rkv s VAL 375 CO 0.46 0.29 0.05 -0.04 0.00 0.00 0.00 175.10 175.86 2rkv s MET 376 N 0.98 1.69 -0.08 2.72 -1.94 0.19 -0.07 119.30 122.78 2rkv s MET 376 Ca -0.10 -1.78 0.04 0.00 -1.71 0.00 0.00 55.69 52.14 2rkv s MET 376 Cb -0.15 -3.22 -0.01 0.00 2.01 0.00 0.00 34.83 33.46 2rkv s MET 376 CO 0.00 -0.90 -0.20 -1.17 -0.01 0.00 0.00 175.02 172.74 2rkv s LEU 377 N 0.97 2.36 -0.17 -0.03 2.96 -0.27 -0.34 118.68 124.16 2rkv s LEU 377 Ca 0.07 -0.42 0.01 0.00 -0.22 0.00 0.00 54.13 53.58 2rkv s LEU 377 Cb -0.20 -1.47 0.03 0.00 0.50 0.00 0.00 46.19 45.05 2rkv s LEU 377 CO -0.07 0.23 -0.15 -0.55 -1.32 0.00 0.00 176.35 174.49 2rkv s SER 378 N -0.06 3.01 -0.25 3.68 0.15 -0.38 -1.02 113.70 118.83 2rkv s SER 378 Ca -0.05 -0.64 -0.19 0.00 0.70 0.00 0.00 55.95 55.77 2rkv s SER 378 Cb -0.14 -1.29 -0.02 0.00 -1.71 0.00 0.00 66.02 62.85 2rkv s SER 378 CO 0.04 -0.06 0.56 -0.55 1.20 0.00 0.00 173.24 174.44 2rkv s SER 379 N 1.40 6.52 -0.14 5.45 0.15 -1.26 -1.95 113.70 123.85 2rkv s SER 379 Ca 0.03 0.63 0.17 0.00 0.70 0.00 0.00 55.95 57.48 2rkv s SER 379 Cb -0.14 -2.31 0.74 0.00 -1.71 0.00 0.00 66.02 62.61 2rkv s SER 379 CO -0.11 -0.31 1.66 0.79 1.20 0.00 0.00 173.24 176.47 2rkv n TRP 380 N 5.50 1.61 -0.24 3.44 8.01 0.27 -4.71 117.44 131.32 2rkv n TRP 380 Ca -0.03 -0.65 0.13 0.00 -1.31 0.00 0.00 57.50 55.64 2rkv n TRP 380 Cb 0.49 -0.31 0.41 0.00 -2.01 0.00 0.00 31.31 29.90 2rkv n TRP 380 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 2rkv h ALA 381 N 4.00 1.90 -0.06 6.99 0.00 -1.64 -2.34 119.26 128.11 2rkv h ALA 381 Ca 0.00 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.92 2rkv h ALA 381 Cb 1.58 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 19.26 2rkv h ALA 381 CO 0.29 -0.13 0.00 0.36 0.00 0.00 0.00 179.25 179.78 2rkv n LYS 382 N -4.53 2.01 -1.66 0.00 2.85 -1.26 -1.05 118.16 114.52 2rkv n LYS 382 Ca 0.16 -1.48 -0.31 0.00 -1.05 0.00 0.00 58.31 55.64 2rkv n LYS 382 Cb 0.47 -1.47 0.05 0.00 -0.65 0.00 0.00 35.03 33.43 2rkv n LYS 382 CO 0.00 0.00 0.00 0.14 -0.05 0.00 0.00 177.40 177.49 2rkv s VAL 383 N -1.94 4.02 -1.34 0.58 -7.23 -0.89 -4.98 120.40 108.62 2rkv s VAL 383 Ca 0.33 0.66 0.17 0.00 -1.81 0.00 0.00 61.98 61.33 2rkv s VAL 383 Cb 0.20 -3.47 0.63 0.00 0.56 0.00 0.00 36.38 34.30 2rkv s VAL 383 CO 0.31 -0.86 1.52 0.61 -0.31 0.00 0.00 175.10 176.37 2rkv n GLY 384 N -2.25 2.32 0.30 2.32 0.00 -1.26 -4.65 105.19 101.96 2rkv n GLY 384 Ca 0.07 -0.74 0.11 0.00 0.00 0.00 0.00 46.02 45.46 2rkv n GLY 384 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2rkv h LEU 385 N 3.64 0.05 -0.65 0.99 3.38 -1.94 -1.66 115.31 119.13 2rkv h LEU 385 Ca 0.00 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2rkv h LEU 385 Cb 1.23 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.97 2rkv h LEU 385 CO 0.17 0.04 0.00 0.79 0.09 0.00 0.00 178.44 179.53 2rkv n TRP 386 N -4.49 0.43 1.03 1.13 7.02 -1.26 -2.88 117.44 118.41 2rkv n TRP 386 Ca 0.01 0.20 0.11 0.00 -1.02 0.00 0.00 57.50 56.81 2rkv n TRP 386 Cb 0.23 -0.82 0.09 0.00 -2.42 0.00 0.00 31.31 28.39 2rkv n TRP 386 CO 0.00 0.00 0.00 -0.25 -2.02 0.00 0.00 177.69 175.42 2rkv n ASP 387 N -1.92 0.91 -4.76 -0.99 8.00 -0.62 -4.24 116.55 112.92 2rkv n ASP 387 Ca 0.01 -0.74 -0.37 0.00 0.71 0.00 0.00 54.79 54.40 2rkv n ASP 387 Cb 0.09 0.56 -0.07 0.00 -0.02 0.00 0.00 41.12 41.68 2rkv n ASP 387 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 2rkv s TYR 388 N -2.89 3.52 -0.20 1.24 2.02 -1.14 -4.95 117.35 114.95 2rkv s TYR 388 Ca 0.12 0.68 0.06 0.00 -0.37 0.00 0.00 57.07 57.57 2rkv s TYR 388 Cb 0.17 -2.32 -0.08 0.00 -0.40 0.00 0.00 41.96 39.33 2rkv s TYR 388 CO 0.73 0.34 0.22 -0.40 -1.57 0.00 0.00 175.55 174.87 2rkv n ASP 389 N 3.18 1.41 -1.87 2.29 5.68 -1.26 -4.29 116.55 121.69 2rkv n ASP 389 Ca -0.12 -0.42 -0.17 0.00 -0.50 0.00 0.00 54.79 53.58 2rkv n ASP 389 Cb 0.52 1.10 -0.05 0.00 -1.14 0.00 0.00 41.12 41.56 2rkv n ASP 389 CO 0.00 0.00 0.00 0.49 -1.33 0.00 0.00 177.20 176.36 2rkv n PHE 390 N -1.35 -0.62 -1.73 2.11 3.01 -1.26 -1.77 117.46 115.86 2rkv n PHE 390 Ca 0.00 0.00 -0.21 0.00 1.01 0.00 0.00 57.45 58.26 2rkv n PHE 390 Cb 0.12 -3.14 -0.08 0.00 -0.01 0.00 0.00 39.48 36.37 2rkv n PHE 390 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2rkv n GLY 391 N -0.56 1.57 0.05 1.37 0.00 -1.26 -4.46 105.19 101.90 2rkv n GLY 391 Ca -0.18 -0.02 0.13 0.00 0.00 0.00 0.00 46.02 45.95 2rkv n GLY 391 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2rkv n LEU 392 N -2.44 0.51 -0.67 0.99 4.77 -0.73 -4.93 117.00 114.50 2rkv n LEU 392 Ca -0.21 0.34 -0.08 0.00 -0.03 0.00 0.00 56.01 56.03 2rkv n LEU 392 Cb 0.68 -0.31 -0.03 0.00 -2.33 0.00 0.00 43.42 41.42 2rkv n LEU 392 CO 0.31 -0.04 -0.08 0.61 -1.33 0.00 0.00 177.39 176.86 2rkv n GLY 393 N 1.40 0.87 0.38 -0.72 0.00 -1.26 -4.87 105.19 100.99 2rkv n GLY 393 Ca 0.05 -0.65 0.09 0.00 0.00 0.00 0.00 46.02 45.51 2rkv n GLY 393 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2rkv n LEU 394 N -0.96 1.70 0.00 0.99 4.77 -1.26 -5.09 117.00 117.14 2rkv n LEU 394 Ca -0.08 -0.74 0.00 0.00 -0.03 0.00 0.00 56.01 55.16 2rkv n LEU 394 Cb 0.31 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.40 2rkv n LEU 394 CO 0.12 0.33 0.00 0.61 -1.33 0.00 0.00 177.39 177.12 2rkv n GLY 395 N 1.28 -1.82 3.90 -0.72 0.00 -1.26 -4.70 105.19 101.86 2rkv n GLY 395 Ca 0.07 -1.66 -0.29 0.00 0.00 0.00 0.00 46.02 44.15 2rkv n GLY 395 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2rkv s LYS 396 N 0.00 2.99 0.32 1.61 -0.14 -1.26 -4.61 119.74 118.65 2rkv s LYS 396 Ca 0.00 0.29 -0.28 0.00 -1.36 0.00 0.00 55.97 54.62 2rkv s LYS 396 Cb 0.00 -2.14 -0.13 0.00 -1.68 0.00 0.00 37.83 33.88 2rkv s LYS 396 CO 0.00 -0.82 1.18 -2.30 -0.76 0.00 0.00 175.35 172.65 2rkv n PRO 397 N -2.78 1.81 0.08 -1.68 -0.02 -1.26 -4.88 135.00 126.28 2rkv n PRO 397 Ca 0.06 0.64 -0.11 0.00 -2.02 0.00 0.00 63.50 62.06 2rkv n PRO 397 Cb 0.57 -2.14 -0.05 0.00 -0.02 0.00 0.00 33.50 31.87 2rkv n PRO 397 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 2rkv h GLU 398 N 2.39 0.23 -3.47 -0.52 4.81 -0.62 -3.47 114.58 113.93 2rkv h GLU 398 Ca -0.43 -0.28 -0.05 0.00 -0.13 0.00 0.00 59.36 58.46 2rkv h GLU 398 Cb 1.31 0.09 -0.12 0.00 0.63 0.00 0.00 28.75 30.65 2rkv h GLU 398 CO 0.62 1.03 -0.10 -0.08 -0.73 0.00 0.00 179.01 179.76 2rkv s THR 399 N -3.08 0.06 -0.20 0.32 -1.32 -1.22 -5.03 115.64 105.16 2rkv s THR 399 Ca -0.03 -0.82 -0.03 0.00 -1.21 0.00 0.00 61.69 59.60 2rkv s THR 399 Cb 0.09 -1.43 0.06 0.00 -1.51 0.00 0.00 72.50 69.71 2rkv s THR 399 CO 0.84 -0.26 0.04 -0.69 -2.21 0.00 0.00 174.62 172.34 2rkv s VAL 400 N -3.86 0.53 0.02 5.08 1.01 -1.26 -1.80 120.40 120.12 2rkv s VAL 400 Ca 0.08 -0.62 0.03 0.00 0.00 0.00 0.00 61.98 61.47 2rkv s VAL 400 Cb 0.01 -1.07 -0.01 0.00 0.00 0.00 0.00 36.38 35.31 2rkv s VAL 400 CO -0.07 -0.25 -0.09 -0.13 0.00 0.00 0.00 175.10 174.57 2rkv s ARG 401 N 1.85 0.62 0.03 2.72 1.81 -0.10 -4.66 118.95 121.22 2rkv s ARG 401 Ca -0.00 -0.51 -0.30 0.00 -1.72 0.00 0.00 55.73 53.20 2rkv s ARG 401 Cb -0.17 -0.54 -0.04 0.00 -0.45 0.00 0.00 34.95 33.75 2rkv s ARG 401 CO -0.10 0.13 1.02 0.50 -0.68 0.00 0.00 175.30 176.18 2rkv s ARG 402 N -0.81 4.56 0.49 3.54 3.52 -1.26 -0.62 118.95 128.36 2rkv s ARG 402 Ca -0.02 1.50 -0.23 0.00 -0.13 0.00 0.00 55.73 56.86 2rkv s ARG 402 Cb -0.06 -3.42 -0.08 0.00 -1.56 0.00 0.00 34.95 29.83 2rkv s ARG 402 CO 0.00 -0.05 1.15 -2.30 -0.81 0.00 0.00 175.30 173.30 2rkv n PRO 403 N 3.69 1.51 -2.31 5.12 -0.02 -1.26 -4.85 135.00 136.88 2rkv n PRO 403 Ca 0.06 0.55 -0.39 0.00 -2.02 0.00 0.00 63.50 61.70 2rkv n PRO 403 Cb 0.50 -2.29 -0.02 0.00 -0.02 0.00 0.00 33.50 31.66 2rkv n PRO 403 CO 0.00 0.00 0.00 -1.50 1.98 0.00 0.00 175.50 175.98 2rkv s ILE 404 N -1.31 3.18 0.00 4.25 2.07 -0.03 -4.87 121.20 124.49 2rkv s ILE 404 Ca 0.67 1.03 0.00 0.00 -1.41 0.00 0.00 60.65 60.94 2rkv s ILE 404 Cb -0.48 -3.60 0.00 0.00 0.13 0.00 0.00 42.46 38.51 2rkv s ILE 404 CO 0.54 0.13 0.00 2.22 -1.91 0.00 0.00 174.94 175.92 2rkv n PHE 405 N 0.31 -0.03 -1.72 3.50 1.16 -1.26 -2.70 117.46 116.73 2rkv n PHE 405 Ca 0.03 0.00 -0.42 0.00 -1.87 0.00 0.00 57.45 55.19 2rkv n PHE 405 Cb 0.46 0.00 -0.00 0.00 -1.61 0.00 0.00 39.48 38.32 2rkv n PHE 405 CO 0.00 0.00 0.00 0.39 -1.87 0.00 0.00 176.76 175.28 2rkv n GLU 406 N 0.00 2.27 -1.75 3.97 4.71 -1.26 -4.91 120.64 123.67 2rkv n GLU 406 Ca 0.00 0.80 -0.42 0.00 -0.01 0.00 0.00 57.16 57.53 2rkv n GLU 406 Cb 0.00 -2.43 -0.00 0.00 -1.01 0.00 0.00 31.44 28.00 2rkv n GLU 406 CO 0.00 0.00 0.00 -2.30 0.09 0.00 0.00 177.13 174.92 2rkv n PRO 407 N 0.50 2.56 -3.75 3.49 -0.02 -1.26 -4.99 135.00 131.53 2rkv n PRO 407 Ca 0.04 0.90 -0.29 0.00 -2.02 0.00 0.00 63.50 62.12 2rkv n PRO 407 Cb 0.37 -2.61 -0.15 0.00 -0.02 0.00 0.00 33.50 31.09 2rkv n PRO 407 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2rkv s VAL 408 N -0.91 0.85 0.09 -1.45 1.01 -1.26 -5.02 120.40 113.71 2rkv s VAL 408 Ca 0.56 -1.22 -0.35 0.00 0.00 0.00 0.00 61.98 60.97 2rkv s VAL 408 Cb -0.50 -1.55 -0.14 0.00 0.00 0.00 0.00 36.38 34.19 2rkv s VAL 408 CO 0.61 -0.55 1.58 1.21 0.00 0.00 0.00 175.10 177.95 2rkv n GLU 409 N 4.88 1.92 -0.81 2.72 2.13 -1.26 -1.57 120.64 128.64 2rkv n GLU 409 Ca -0.04 0.69 0.00 0.00 0.66 0.00 0.00 57.16 58.47 2rkv n GLU 409 Cb 0.43 -2.45 0.00 0.00 0.27 0.00 0.00 31.44 29.69 2rkv n GLU 409 CO 0.00 0.00 0.00 0.43 -0.41 0.00 0.00 177.13 177.15 2rkv n SER 410 N 3.81 0.00 -4.74 4.31 7.64 0.80 -4.79 113.62 120.65 2rkv n SER 410 Ca 0.18 0.00 -0.41 0.00 1.01 0.00 0.00 58.87 59.66 2rkv n SER 410 Cb 0.26 -0.08 -0.04 0.00 -1.01 0.00 0.00 64.21 63.35 2rkv n SER 410 CO 0.00 0.00 0.00 -0.22 -3.01 0.00 0.00 175.04 171.81 2rkv s LEU 411 N 0.00 4.51 0.00 -3.43 2.96 -0.61 -0.64 118.68 121.47 2rkv s LEU 411 Ca 0.00 2.13 -0.10 0.00 -0.22 0.00 0.00 54.13 55.95 2rkv s LEU 411 Cb 0.00 -3.61 0.01 0.00 0.50 0.00 0.00 46.19 43.09 2rkv s LEU 411 CO 0.00 -0.20 0.19 -0.04 -1.32 0.00 0.00 176.35 174.98 2rkv s MET 412 N -0.64 0.55 0.06 1.98 -1.94 0.54 -1.62 119.30 118.23 2rkv s MET 412 Ca 0.48 -0.36 0.04 0.00 -1.71 0.00 0.00 55.69 54.15 2rkv s MET 412 Cb -0.30 0.23 -0.03 0.00 2.01 0.00 0.00 34.83 36.74 2rkv s MET 412 CO 0.36 -0.14 -0.13 0.71 -0.01 0.00 0.00 175.02 175.82 2rkv s TYR 413 N -1.43 1.08 -0.17 -0.03 1.51 -0.27 -1.25 117.35 116.78 2rkv s TYR 413 Ca -0.14 -0.47 -0.07 0.00 -1.01 0.00 0.00 57.07 55.38 2rkv s TYR 413 Cb -0.07 -0.61 -0.04 0.00 -0.11 0.00 0.00 41.96 41.13 2rkv s TYR 413 CO 0.02 0.02 0.08 -0.06 -1.11 0.00 0.00 175.55 174.50 2rkv s PHE 414 N -1.30 3.32 0.82 2.71 0.08 -0.82 -0.10 117.98 122.68 2rkv s PHE 414 Ca -0.04 0.19 -0.11 0.00 0.12 0.00 0.00 56.93 57.09 2rkv s PHE 414 Cb -0.10 -2.05 0.08 0.00 -0.57 0.00 0.00 43.02 40.38 2rkv s PHE 414 CO 0.02 0.28 1.09 -1.64 -0.10 0.00 0.00 175.22 174.87 2rkv s MET 415 N 0.08 1.88 0.18 0.44 -1.94 0.15 -0.56 119.30 119.53 2rkv s MET 415 Ca 0.06 0.96 -0.33 0.00 -1.71 0.00 0.00 55.69 54.67 2rkv s MET 415 Cb -0.12 -1.87 -0.14 0.00 2.01 0.00 0.00 34.83 34.71 2rkv s MET 415 CO 0.00 -1.85 1.46 -2.30 -0.01 0.00 0.00 175.02 172.32 2rkv n PRO 416 N -3.64 1.93 -1.71 2.03 -0.02 -1.18 -3.27 135.00 129.13 2rkv n PRO 416 Ca 0.08 0.69 -0.43 0.00 -2.02 0.00 0.00 63.50 61.82 2rkv n PRO 416 Cb 0.54 -2.39 -0.03 0.00 -0.02 0.00 0.00 33.50 31.61 2rkv n PRO 416 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 2rkv n LYS 417 N 2.66 2.63 -1.91 -0.52 4.81 -0.21 -4.84 118.16 120.78 2rkv n LYS 417 Ca 0.15 0.94 -0.40 0.00 -0.87 0.00 0.00 58.31 58.13 2rkv n LYS 417 Cb 0.28 -2.75 0.00 0.00 0.02 0.00 0.00 35.03 32.58 2rkv n LYS 417 CO 0.00 0.00 0.00 0.21 1.17 0.00 0.00 177.40 178.78 2rkv s LYS 418 N 0.65 3.94 0.44 1.64 2.20 -0.49 -4.88 119.74 123.24 2rkv s LYS 418 Ca 0.73 2.36 0.23 0.00 -0.36 0.00 0.00 55.97 58.93 2rkv s LYS 418 Cb -0.54 -2.81 1.22 0.00 -1.51 0.00 0.00 37.83 34.20 2rkv s LYS 418 CO 0.38 -0.59 1.81 -1.35 -0.36 0.00 0.00 175.35 175.24 2rkv h PRO 419 N 2.70 0.27 0.00 4.03 0.11 -1.92 0.29 132.00 137.48 2rkv h PRO 419 Ca -0.50 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.59 2rkv h PRO 419 Cb 1.25 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.30 2rkv h PRO 419 CO 0.63 0.18 0.00 -0.40 -0.21 0.00 0.00 178.00 178.20 2rkv n ASP 420 N -4.48 0.00 0.00 -2.05 5.75 -1.26 -4.88 116.55 109.63 2rkv n ASP 420 Ca 0.23 0.34 0.00 0.00 -0.01 0.00 0.00 54.79 55.35 2rkv n ASP 420 Cb 0.91 -0.43 0.00 0.00 -1.03 0.00 0.00 41.12 40.58 2rkv n ASP 420 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2rkv n GLY 421 N 0.20 0.57 3.72 6.12 0.00 0.10 -4.74 105.19 111.16 2rkv n GLY 421 Ca 0.05 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.65 2rkv n GLY 421 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2rkv s GLU 422 N -0.70 4.22 0.05 1.61 2.12 -1.24 -4.31 118.70 120.46 2rkv s GLU 422 Ca 0.00 2.35 -0.00 0.00 0.36 0.00 0.00 54.97 57.68 2rkv s GLU 422 Cb 0.00 -3.15 -0.04 0.00 0.26 0.00 0.00 34.13 31.20 2rkv s GLU 422 CO 0.00 -0.58 0.20 -0.06 -0.54 0.00 0.00 175.26 174.28 2rkv s PHE 423 N 0.97 3.50 -0.13 5.30 0.40 -0.53 -1.40 117.98 126.09 2rkv s PHE 423 Ca 0.68 0.25 -0.01 0.00 -0.60 0.00 0.00 56.93 57.26 2rkv s PHE 423 Cb -0.43 -1.76 0.03 0.00 0.51 0.00 0.00 43.02 41.37 2rkv s PHE 423 CO 0.33 0.59 -0.05 0.00 0.70 0.00 0.00 175.22 176.79 2rkv s ALA 425 N 1.72 3.38 -0.27 0.00 0.00 -0.28 -0.67 121.76 125.63 2rkv s ALA 425 Ca 0.03 -0.81 -0.15 0.00 0.00 0.00 0.00 51.96 51.02 2rkv s ALA 425 Cb -0.14 -1.97 -0.03 0.00 0.00 0.00 0.00 23.12 20.98 2rkv s ALA 425 CO -0.08 0.06 0.40 0.00 0.00 0.00 0.00 175.76 176.14 2rkv s ALA 426 N 0.59 3.57 -0.09 0.00 0.00 0.85 -0.88 121.76 125.81 2rkv s ALA 426 Ca 0.03 -0.79 0.03 0.00 0.00 0.00 0.00 51.96 51.23 2rkv s ALA 426 Cb -0.13 -2.75 -0.01 0.00 0.00 0.00 0.00 23.12 20.23 2rkv s ALA 426 CO 0.01 -0.69 -0.19 -0.51 0.00 0.00 0.00 175.76 174.39 2rkv s LEU 427 N 2.11 2.43 -0.21 0.00 1.02 -0.17 -1.11 118.68 122.75 2rkv s LEU 427 Ca 0.16 -0.40 -0.03 0.00 0.02 0.00 0.00 54.13 53.88 2rkv s LEU 427 Cb -0.16 -1.50 -0.01 0.00 0.02 0.00 0.00 46.19 44.55 2rkv s LEU 427 CO 0.10 0.22 -0.06 -0.55 0.02 0.00 0.00 176.35 176.07 2rkv s SER 428 N 0.02 4.16 0.03 2.29 0.15 -0.64 -1.44 113.70 118.27 2rkv s SER 428 Ca -0.07 -0.42 -0.04 0.00 0.70 0.00 0.00 55.95 56.12 2rkv s SER 428 Cb -0.15 -1.71 -0.01 0.00 -1.71 0.00 0.00 66.02 62.44 2rkv s SER 428 CO 0.05 -0.01 0.07 -0.76 1.20 0.00 0.00 173.24 173.79 2rkv s LEU 429 N 1.42 1.91 0.60 3.45 1.43 -0.88 -0.14 118.68 126.46 2rkv s LEU 429 Ca 0.05 -0.54 -0.19 0.00 -1.03 0.00 0.00 54.13 52.42 2rkv s LEU 429 Cb -0.14 0.49 -0.03 0.00 0.03 0.00 0.00 46.19 46.54 2rkv s LEU 429 CO -0.04 -0.47 1.24 0.00 0.23 0.00 0.00 176.35 177.30 2rkv s ARG 430 N -2.44 2.90 0.26 1.70 1.70 -1.26 -1.78 118.95 120.03 2rkv s ARG 430 Ca -0.06 1.90 -0.02 0.00 -0.47 0.00 0.00 55.73 57.08 2rkv s ARG 430 Cb -0.02 -1.94 0.54 0.00 -0.57 0.00 0.00 34.95 32.96 2rkv s ARG 430 CO -0.04 -1.28 1.71 -0.44 -1.08 0.00 0.00 175.30 174.17 2rkv h ASP 431 N 0.87 0.23 -0.03 -2.89 3.32 -1.12 -0.40 116.42 116.40 2rkv h ASP 431 Ca -0.51 0.13 -0.10 0.00 0.02 0.00 0.00 57.03 56.58 2rkv h ASP 431 Cb 1.31 0.13 -0.01 0.00 0.22 0.00 0.00 39.33 40.97 2rkv h ASP 431 CO 0.55 0.04 -0.27 1.05 -1.72 0.00 0.00 179.24 178.89 2rkv h GLU 432 N 0.39 0.46 -0.07 3.56 4.11 -1.91 0.83 114.58 121.96 2rkv h GLU 432 Ca 0.46 -0.18 -0.02 0.00 0.07 0.00 0.00 59.36 59.70 2rkv h GLU 432 Cb 0.78 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 30.00 2rkv h GLU 432 CO -0.47 0.70 -0.02 -0.44 0.07 0.00 0.00 179.01 178.85 2rkv h ASP 433 N 0.41 0.13 -0.51 3.06 3.32 -1.62 -2.60 116.42 118.61 2rkv h ASP 433 Ca 0.06 -0.38 0.02 0.00 0.02 0.00 0.00 57.03 56.75 2rkv h ASP 433 Cb 0.69 -0.04 -0.03 0.00 0.22 0.00 0.00 39.33 40.17 2rkv h ASP 433 CO 0.05 0.47 0.31 -0.03 -1.72 0.00 0.00 179.24 178.32 2rkv h MET 434 N -0.22 0.60 -0.42 3.56 4.05 -0.81 0.36 114.93 122.05 2rkv h MET 434 Ca 0.02 -0.04 -0.03 0.00 -0.28 0.00 0.00 59.70 59.37 2rkv h MET 434 Cb 0.42 -0.13 -0.02 0.00 -0.80 0.00 0.00 31.60 31.07 2rkv h MET 434 CO 0.01 0.39 0.16 -0.44 0.23 0.00 0.00 176.91 177.26 2rkv h ASP 435 N 0.61 0.59 -0.57 1.39 3.32 -0.90 -1.41 116.42 119.45 2rkv h ASP 435 Ca 0.20 -0.18 -0.10 0.00 0.02 0.00 0.00 57.03 56.98 2rkv h ASP 435 Cb 0.01 -0.15 -0.02 0.00 0.22 0.00 0.00 39.33 39.39 2rkv h ASP 435 CO -0.09 0.61 -0.02 0.03 -1.72 0.00 0.00 179.24 178.06 2rkv h ARG 436 N 0.54 1.04 -0.32 3.56 3.08 -1.30 -2.82 114.38 118.16 2rkv h ARG 436 Ca 0.14 -0.33 -0.00 0.00 0.07 0.00 0.00 59.98 59.86 2rkv h ARG 436 Cb 0.21 -0.09 -0.02 0.00 0.08 0.00 0.00 29.97 30.15 2rkv h ARG 436 CO -0.01 1.02 0.20 1.25 -1.07 0.00 0.00 179.97 181.36 2rkv h LEU 437 N 0.94 0.38 -2.08 3.04 5.85 -0.70 -0.79 115.31 121.95 2rkv h LEU 437 Ca 0.17 -0.04 -0.02 0.00 0.84 0.00 0.00 57.88 58.83 2rkv h LEU 437 Cb 0.57 -0.10 -0.00 0.00 0.37 0.00 0.00 40.66 41.50 2rkv h LEU 437 CO 0.03 0.31 -0.08 0.11 -0.34 0.00 0.00 178.44 178.47 2rkv h LYS 438 N 0.41 0.00 -0.02 1.25 1.57 -1.14 -1.98 116.57 116.67 2rkv h LYS 438 Ca 0.11 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.89 2rkv h LYS 438 Cb -0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 2rkv h LYS 438 CO -0.02 0.08 -0.44 0.00 -0.57 0.00 0.00 179.45 178.50 2rkv n ALA 439 N -2.28 3.48 -2.55 3.86 0.00 -1.00 -4.87 120.51 117.15 2rkv n ALA 439 Ca -0.02 -0.64 -0.43 0.00 0.00 0.00 0.00 53.44 52.35 2rkv n ALA 439 Cb 0.19 -0.77 -0.02 0.00 0.00 0.00 0.00 19.45 18.85 2rkv n ALA 439 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2rkv s ASP 440 N -2.40 7.00 0.39 0.00 -1.08 -0.34 -4.94 116.67 115.30 2rkv s ASP 440 Ca 0.18 1.47 0.13 0.00 -0.52 0.00 0.00 52.55 53.81 2rkv s ASP 440 Cb 0.18 -2.54 0.77 0.00 -1.46 0.00 0.00 42.92 39.87 2rkv s ASP 440 CO 0.54 -0.74 1.86 0.11 0.52 0.00 0.00 175.17 177.46 2rkv h LYS 441 N 7.90 0.01 -0.08 4.34 6.56 -1.91 0.06 116.57 133.45 2rkv h LYS 441 Ca -0.22 -0.00 -0.13 0.00 -1.06 0.00 0.00 60.65 59.23 2rkv h LYS 441 Cb 1.08 -0.00 -0.01 0.00 -0.57 0.00 0.00 32.23 32.73 2rkv h LYS 441 CO 0.98 0.34 -0.54 0.93 -2.06 0.00 0.00 179.45 179.10 2rkv h GLU 442 N 0.01 0.25 0.10 3.15 5.08 -1.96 -2.19 114.58 119.02 2rkv h GLU 442 Ca -0.00 -0.15 -0.00 0.00 -1.00 0.00 0.00 59.36 58.20 2rkv h GLU 442 Cb 0.59 0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.85 2rkv h GLU 442 CO 0.04 0.73 -0.05 2.35 -1.00 0.00 0.00 179.01 181.08 2rkv h TRP 443 N 0.19 -0.12 0.00 4.33 2.91 -1.73 -3.33 115.95 118.20 2rkv h TRP 443 Ca 0.00 -0.00 0.00 0.00 1.13 0.00 0.00 58.89 60.02 2rkv h TRP 443 Cb 1.02 0.04 0.00 0.00 -0.51 0.00 0.00 29.16 29.71 2rkv h TRP 443 CO 0.02 0.40 0.00 1.79 -1.03 0.00 0.00 178.44 179.62 2rkv h THR 444 N -0.84 0.00 -0.63 2.65 1.35 -1.04 0.92 112.91 115.32 2rkv h THR 444 Ca -0.01 -0.24 0.12 0.00 -0.55 0.00 0.00 66.41 65.73 2rkv h THR 444 Cb 0.58 1.01 -0.04 0.00 -1.73 0.00 0.00 68.15 67.97 2rkv h THR 444 CO 0.02 0.00 0.43 0.50 -0.25 0.00 0.00 175.52 176.22 2rkv h LYS 445 N 0.00 0.33 0.00 4.72 3.64 -1.50 -3.30 116.57 120.45 2rkv h LYS 445 Ca 0.00 -0.02 -0.10 0.00 -1.27 0.00 0.00 60.65 59.27 2rkv h LYS 445 Cb 0.30 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 32.03 2rkv h LYS 445 CO 0.00 0.22 -1.36 0.66 -2.27 0.00 0.00 179.45 176.70 2rkv n TYR 446 N -4.46 0.00 -3.67 1.91 4.02 -0.58 -5.03 117.16 109.35 2rkv n TYR 446 Ca 0.11 0.00 -0.36 0.00 -0.01 0.00 0.00 57.90 57.64 2rkv n TYR 446 Cb 0.46 -0.25 -0.09 0.00 -0.02 0.00 0.00 39.34 39.44 2rkv n TYR 446 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2rkv s ALA 447 N -2.13 3.62 -0.33 -0.72 0.00 0.22 -4.52 121.76 117.91 2rkv s ALA 447 Ca -0.06 -0.86 -0.12 0.00 0.00 0.00 0.00 51.96 50.92 2rkv s ALA 447 Cb 0.02 -2.31 -0.02 0.00 0.00 0.00 0.00 23.12 20.82 2rkv s ALA 447 CO 0.18 -0.15 0.21 -0.65 0.00 0.00 0.00 175.76 175.35 2rkv s GLN 448 N 0.97 3.47 0.17 0.00 -0.21 -0.24 -4.36 119.66 119.45 2rkv s GLN 448 Ca 0.08 -0.65 -0.31 0.00 0.02 0.00 0.00 55.36 54.49 2rkv s GLN 448 Cb -0.13 -3.73 -0.10 0.00 1.00 0.00 0.00 33.01 30.05 2rkv s GLN 448 CO 0.04 -0.42 1.52 -0.47 -2.12 0.00 0.00 175.29 173.83 2rkv s TYR 449 N 1.69 3.09 -0.07 0.91 5.04 -1.26 -0.82 117.35 125.93 2rkv s TYR 449 Ca 0.06 0.75 -0.03 0.00 -2.44 0.00 0.00 57.07 55.40 2rkv s TYR 449 Cb -0.17 -3.87 -0.03 0.00 0.35 0.00 0.00 41.96 38.24 2rkv s TYR 449 CO 0.09 -3.12 -0.08 0.28 -1.34 0.00 0.00 175.55 171.38 2rkv n VAL 450 N 3.71 0.36 0.00 3.14 0.31 0.08 -4.92 118.33 121.02 2rkv n VAL 450 Ca 0.12 -0.10 0.00 0.00 -0.01 0.00 0.00 64.34 64.36 2rkv n VAL 450 Cb 0.39 -1.51 0.00 0.00 -0.91 0.00 0.00 33.84 31.81 2rkv n VAL 450 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12