#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2c1x s PRO 8 N 0.00 3.74 -0.21 3.52 0.02 -1.26 -4.92 135.00 135.88 2c1x s PRO 8 Ca 0.00 1.81 -0.03 0.00 0.02 0.00 0.00 61.00 62.80 2c1x s PRO 8 Cb 0.00 -2.41 0.07 0.00 0.02 0.00 0.00 34.50 32.17 2c1x s PRO 8 CO 0.00 -0.58 0.05 -1.58 -0.33 0.00 0.00 177.00 174.56 2c1x s HIS 9 N -1.52 1.10 -0.36 6.54 2.46 -1.26 -1.97 115.29 120.27 2c1x s HIS 9 Ca 0.64 -0.98 -0.16 0.00 0.47 0.00 0.00 55.06 55.02 2c1x s HIS 9 Cb -0.29 -1.11 -0.00 0.00 -0.13 0.00 0.00 32.58 31.04 2c1x s HIS 9 CO 0.36 -0.66 0.42 0.08 -2.47 0.00 0.00 174.74 172.47 2c1x s VAL 10 N 1.83 5.11 -0.01 0.89 1.01 0.21 -0.27 120.40 129.18 2c1x s VAL 10 Ca 0.01 0.07 -0.23 0.00 0.00 0.00 0.00 61.98 61.82 2c1x s VAL 10 Cb -0.17 -3.89 -0.05 0.00 0.00 0.00 0.00 36.38 32.27 2c1x s VAL 10 CO -0.11 -0.18 0.70 0.00 0.00 0.00 0.00 175.10 175.51 2c1x s ALA 11 N 2.14 3.38 -0.19 5.51 0.00 -0.40 -1.48 121.76 130.71 2c1x s ALA 11 Ca 0.14 0.17 0.01 0.00 0.00 0.00 0.00 51.96 52.27 2c1x s ALA 11 Cb -0.16 -2.92 0.04 0.00 0.00 0.00 0.00 23.12 20.07 2c1x s ALA 11 CO 0.12 0.02 -0.11 0.08 0.00 0.00 0.00 175.76 175.87 2c1x s VAL 12 N 0.26 1.65 -0.39 0.00 1.01 0.21 -0.53 120.40 122.61 2c1x s VAL 12 Ca 0.36 -0.95 -0.09 0.00 0.00 0.00 0.00 61.98 61.31 2c1x s VAL 12 Cb -0.19 -1.69 0.06 0.00 0.00 0.00 0.00 36.38 34.56 2c1x s VAL 12 CO 0.20 0.23 0.21 -0.76 0.00 0.00 0.00 175.10 174.97 2c1x s LEU 13 N 1.40 4.86 0.27 3.92 1.43 -0.15 0.11 118.68 130.52 2c1x s LEU 13 Ca -0.00 -1.32 -0.13 0.00 -1.03 0.00 0.00 54.13 51.65 2c1x s LEU 13 Cb -0.16 -1.96 -0.08 0.00 0.03 0.00 0.00 46.19 44.02 2c1x s LEU 13 CO -0.09 -0.45 0.66 0.00 0.23 0.00 0.00 176.35 176.70 2c1x s ALA 14 N 1.44 3.43 -0.33 4.21 0.00 -0.35 -1.24 121.76 128.93 2c1x s ALA 14 Ca 0.02 -0.07 -0.17 0.00 0.00 0.00 0.00 51.96 51.74 2c1x s ALA 14 Cb -0.21 -2.64 -0.01 0.00 0.00 0.00 0.00 23.12 20.25 2c1x s ALA 14 CO 0.03 0.40 0.46 0.12 0.00 0.00 0.00 175.76 176.77 2c1x s PHE 15 N -1.85 3.20 -0.81 0.00 5.36 -1.26 -4.80 117.98 117.82 2c1x s PHE 15 Ca 0.50 0.20 0.05 0.00 -0.96 0.00 0.00 56.93 56.72 2c1x s PHE 15 Cb -0.11 -2.81 0.28 0.00 -0.34 0.00 0.00 43.02 40.03 2c1x s PHE 15 CO 0.19 -0.46 0.94 -0.35 -1.46 0.00 0.00 175.22 174.08 2c1x n PRO 16 N 5.60 2.29 -4.45 10.12 -0.04 -1.26 -3.22 135.00 144.03 2c1x n PRO 16 Ca -0.06 -1.06 -0.24 0.00 -0.04 0.00 0.00 63.50 62.09 2c1x n PRO 16 Cb 0.49 -1.73 -0.10 0.00 -0.04 0.00 0.00 33.50 32.12 2c1x n PRO 16 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 2c1x s PHE 17 N -1.60 2.26 0.00 0.54 0.08 -1.26 -4.82 117.98 113.17 2c1x s PHE 17 Ca 0.18 -0.35 0.00 0.00 0.12 0.00 0.00 56.93 56.89 2c1x s PHE 17 Cb 0.14 -1.01 0.00 0.00 -0.57 0.00 0.00 43.02 41.58 2c1x s PHE 17 CO 0.06 0.65 0.00 0.43 -0.10 0.00 0.00 175.22 176.26 2c1x n SER 18 N -0.40 -1.07 -4.27 1.36 7.64 -1.26 -3.77 113.62 111.84 2c1x n SER 18 Ca -0.07 0.00 -0.44 0.00 1.01 0.00 0.00 58.87 59.37 2c1x n SER 18 Cb 0.59 0.00 -0.00 0.00 -1.01 0.00 0.00 64.21 63.79 2c1x n SER 18 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 2c1x n THR 19 N 0.00 4.65 0.00 0.44 -1.04 -1.26 -4.58 114.28 112.48 2c1x n THR 19 Ca 0.00 -5.47 0.00 0.00 -2.04 0.00 0.00 64.05 56.54 2c1x n THR 19 Cb 0.00 -2.49 0.00 0.00 -1.82 0.00 0.00 70.33 66.02 2c1x n THR 19 CO 0.00 0.00 0.00 1.41 -0.64 0.00 0.00 175.07 175.84 2c1x n HIS 20 N 2.41 0.00 -0.09 -1.42 -0.00 -1.25 -4.72 115.22 110.16 2c1x n HIS 20 Ca 0.24 0.00 -0.09 0.00 -0.00 0.00 0.00 57.72 57.87 2c1x n HIS 20 Cb 0.38 0.02 0.07 0.00 -0.00 0.00 0.00 29.99 30.45 2c1x n HIS 20 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 2c1x h ALA 21 N 0.00 0.81 0.67 -1.41 0.00 -1.80 -3.00 119.26 114.53 2c1x h ALA 21 Ca 0.00 -0.40 -0.03 0.00 0.00 0.00 0.00 54.91 54.48 2c1x h ALA 21 Cb 0.94 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.59 2c1x h ALA 21 CO 0.00 0.65 -0.38 0.00 0.00 0.00 0.00 179.25 179.52 2c1x h ALA 22 N 1.01 -0.99 -0.67 0.00 0.00 -1.90 -0.13 119.26 116.58 2c1x h ALA 22 Ca 0.08 -0.20 0.04 0.00 0.00 0.00 0.00 54.91 54.83 2c1x h ALA 22 Cb 0.80 0.45 -0.04 0.00 0.00 0.00 0.00 17.79 19.00 2c1x h ALA 22 CO 0.07 -1.06 0.44 -1.00 0.00 0.00 0.00 179.25 177.70 2c1x h PRO 23 N -0.97 0.77 -0.17 0.00 0.13 -1.85 0.85 132.00 130.76 2c1x h PRO 23 Ca -0.09 -0.05 -0.01 0.00 -0.87 0.00 0.00 66.00 64.98 2c1x h PRO 23 Cb 0.77 -0.17 -0.01 0.00 0.13 0.00 0.00 31.00 31.72 2c1x h PRO 23 CO 0.11 0.51 0.06 1.25 -0.23 0.00 0.00 178.00 179.70 2c1x h LEU 24 N 0.80 0.25 -0.83 1.56 5.85 -1.36 -1.77 115.31 119.81 2c1x h LEU 24 Ca 0.27 -0.20 0.07 0.00 0.84 0.00 0.00 57.88 58.86 2c1x h LEU 24 Cb 0.08 -0.06 -0.06 0.00 0.37 0.00 0.00 40.66 40.98 2c1x h LEU 24 CO -0.08 0.38 0.50 0.25 -0.34 0.00 0.00 178.44 179.15 2c1x h LEU 25 N 0.10 0.76 -0.49 2.25 5.85 -0.66 -0.54 115.31 122.58 2c1x h LEU 25 Ca 0.06 0.03 0.09 0.00 0.84 0.00 0.00 57.88 58.89 2c1x h LEU 25 Cb 0.22 -0.13 -0.07 0.00 0.37 0.00 0.00 40.66 41.05 2c1x h LEU 25 CO -0.00 0.47 0.06 0.00 -0.34 0.00 0.00 178.44 178.63 2c1x h ALA 26 N 1.41 0.52 -0.50 1.25 0.00 -0.44 0.31 119.26 121.81 2c1x h ALA 26 Ca 0.37 0.12 -0.11 0.00 0.00 0.00 0.00 54.91 55.29 2c1x h ALA 26 Cb 0.23 0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 2c1x h ALA 26 CO -0.20 -0.34 -0.11 0.28 0.00 0.00 0.00 179.25 178.89 2c1x h VAL 27 N 0.19 1.26 -0.49 0.00 2.07 -0.67 -2.94 116.25 115.68 2c1x h VAL 27 Ca 0.25 -1.23 -0.02 0.00 0.82 0.00 0.00 66.70 66.52 2c1x h VAL 27 Cb 0.34 1.00 -0.02 0.00 -1.52 0.00 0.00 31.29 31.09 2c1x h VAL 27 CO -0.35 0.43 0.23 0.58 0.02 0.00 0.00 177.57 178.48 2c1x h VAL 28 N 0.82 1.19 -0.61 2.57 2.07 -0.51 -0.07 116.25 121.71 2c1x h VAL 28 Ca 0.13 -0.54 0.11 0.00 0.82 0.00 0.00 66.70 67.22 2c1x h VAL 28 Cb 0.64 0.65 -0.09 0.00 -1.52 0.00 0.00 31.29 30.98 2c1x h VAL 28 CO 0.04 0.21 0.14 0.03 0.02 0.00 0.00 177.57 178.01 2c1x h ARG 29 N 0.64 0.26 -0.65 1.57 3.08 -0.90 0.24 114.38 118.63 2c1x h ARG 29 Ca 0.17 -0.02 -0.06 0.00 0.07 0.00 0.00 59.98 60.14 2c1x h ARG 29 Cb 0.12 -0.06 -0.03 0.00 0.08 0.00 0.00 29.97 30.08 2c1x h ARG 29 CO -0.02 0.17 0.18 0.00 -1.07 0.00 0.00 179.97 179.23 2c1x h ARG 30 N 0.27 1.01 -0.39 0.04 3.08 -1.19 -2.17 114.38 115.04 2c1x h ARG 30 Ca 0.32 -0.22 -0.08 0.00 0.07 0.00 0.00 59.98 60.07 2c1x h ARG 30 Cb 0.47 -0.15 -0.01 0.00 0.08 0.00 0.00 29.97 30.36 2c1x h ARG 30 CO -0.40 0.88 -0.09 -0.07 -1.07 0.00 0.00 179.97 179.23 2c1x h LEU 31 N 0.97 0.74 -1.01 3.04 3.38 -0.45 -1.41 115.31 120.58 2c1x h LEU 31 Ca 0.21 -0.36 -0.01 0.00 0.09 0.00 0.00 57.88 57.82 2c1x h LEU 31 Cb 0.31 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 40.82 2c1x h LEU 31 CO -0.00 0.93 0.53 0.00 0.09 0.00 0.00 178.44 179.99 2c1x h ALA 32 N 0.84 1.26 -0.37 1.53 0.00 -0.46 0.25 119.26 122.30 2c1x h ALA 32 Ca 0.10 -0.10 -0.13 0.00 0.00 0.00 0.00 54.91 54.78 2c1x h ALA 32 Cb 0.60 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 2c1x h ALA 32 CO 0.04 0.63 -0.29 0.00 0.00 0.00 0.00 179.25 179.63 2c1x h ALA 33 N 1.36 0.79 0.00 0.00 0.00 -1.31 -3.10 119.26 117.00 2c1x h ALA 33 Ca 0.32 -0.40 -0.07 0.00 0.00 0.00 0.00 54.91 54.76 2c1x h ALA 33 Cb -0.05 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 2c1x h ALA 33 CO -0.06 0.65 -0.31 0.00 0.00 0.00 0.00 179.25 179.53 2c1x h ALA 34 N 1.00 0.87 -2.17 0.00 0.00 -0.61 -3.36 119.26 114.98 2c1x h ALA 34 Ca 0.08 -0.28 -0.58 0.00 0.00 0.00 0.00 54.91 54.12 2c1x h ALA 34 Cb 0.82 -0.05 -0.40 0.00 0.00 0.00 0.00 17.79 18.16 2c1x h ALA 34 CO 0.07 0.39 -0.85 0.00 0.00 0.00 0.00 179.25 178.86 2c1x n ALA 35 N -2.21 3.22 0.33 0.00 0.00 0.80 -4.96 120.51 117.71 2c1x n ALA 35 Ca 0.01 -4.04 0.12 0.00 0.00 0.00 0.00 53.44 49.54 2c1x n ALA 35 Cb 0.58 -0.86 0.53 0.00 0.00 0.00 0.00 19.45 19.70 2c1x n ALA 35 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2c1x n PRO 36 N 1.30 0.19 0.01 0.00 -0.04 -1.17 -1.57 135.00 133.71 2c1x n PRO 36 Ca 0.25 0.49 0.13 0.00 -0.04 0.00 0.00 63.50 64.33 2c1x n PRO 36 Cb 0.46 -1.92 0.39 0.00 -0.04 0.00 0.00 33.50 32.40 2c1x n PRO 36 CO 0.00 0.00 0.00 -2.39 -0.04 0.00 0.00 175.50 173.07 2c1x n HIS 37 N -2.29 0.11 -3.51 0.54 1.44 -1.26 -4.85 115.22 105.39 2c1x n HIS 37 Ca 0.01 0.03 -0.34 0.00 -2.01 0.00 0.00 57.72 55.41 2c1x n HIS 37 Cb 0.18 -0.42 -0.05 0.00 0.12 0.00 0.00 29.99 29.81 2c1x n HIS 37 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2c1x s ALA 38 N -3.02 3.67 -0.03 1.59 0.00 -0.61 -4.51 121.76 118.85 2c1x s ALA 38 Ca 0.12 -0.33 -0.01 0.00 0.00 0.00 0.00 51.96 51.73 2c1x s ALA 38 Cb 0.17 -2.33 -0.04 0.00 0.00 0.00 0.00 23.12 20.92 2c1x s ALA 38 CO 0.63 0.55 0.07 0.14 0.00 0.00 0.00 175.76 177.15 2c1x s VAL 39 N -1.54 4.70 -0.09 0.00 -7.23 -0.83 -4.86 120.40 110.55 2c1x s VAL 39 Ca 0.38 -0.34 0.03 0.00 -1.81 0.00 0.00 61.98 60.24 2c1x s VAL 39 Cb -0.13 -3.11 0.01 0.00 0.56 0.00 0.00 36.38 33.70 2c1x s VAL 39 CO 0.20 0.41 -0.18 -0.36 -0.31 0.00 0.00 175.10 174.87 2c1x s PHE 40 N -1.13 2.02 -0.21 2.82 0.08 0.69 -0.62 117.98 121.63 2c1x s PHE 40 Ca 0.21 -0.84 -0.00 0.00 0.12 0.00 0.00 56.93 56.41 2c1x s PHE 40 Cb -0.12 -1.41 0.02 0.00 -0.57 0.00 0.00 43.02 40.94 2c1x s PHE 40 CO 0.11 -0.38 -0.13 -1.12 -0.10 0.00 0.00 175.22 173.60 2c1x s SER 41 N 0.62 3.76 -0.31 1.36 0.01 -0.55 -1.48 113.70 117.10 2c1x s SER 41 Ca -0.14 -0.71 -0.10 0.00 1.31 0.00 0.00 55.95 56.31 2c1x s SER 41 Cb -0.16 -1.58 -0.01 0.00 0.21 0.00 0.00 66.02 64.47 2c1x s SER 41 CO 0.04 -0.05 0.15 0.12 0.41 0.00 0.00 173.24 173.92 2c1x s PHE 42 N 1.32 3.18 -0.22 2.43 5.36 -0.49 -0.62 117.98 128.94 2c1x s PHE 42 Ca 0.03 -0.54 -0.07 0.00 -0.96 0.00 0.00 56.93 55.39 2c1x s PHE 42 Cb -0.15 -2.35 -0.03 0.00 -0.34 0.00 0.00 43.02 40.15 2c1x s PHE 42 CO -0.08 -0.44 0.04 -0.06 -1.46 0.00 0.00 175.22 173.22 2c1x s PHE 43 N 1.62 3.09 0.37 10.12 0.08 0.12 -0.32 117.98 133.06 2c1x s PHE 43 Ca 0.05 -0.35 -0.10 0.00 0.12 0.00 0.00 56.93 56.65 2c1x s PHE 43 Cb -0.17 -2.16 0.03 0.00 -0.57 0.00 0.00 43.02 40.16 2c1x s PHE 43 CO 0.06 -0.23 0.65 0.45 -0.10 0.00 0.00 175.22 176.06 2c1x s SER 44 N 1.19 0.43 0.89 1.36 0.15 -1.03 -1.21 113.70 115.49 2c1x s SER 44 Ca 0.04 -1.31 -0.11 0.00 0.70 0.00 0.00 55.95 55.27 2c1x s SER 44 Cb -0.14 0.77 0.13 0.00 -1.71 0.00 0.00 66.02 65.07 2c1x s SER 44 CO 0.03 -1.52 1.10 0.42 1.20 0.00 0.00 173.24 174.46 2c1x s THR 45 N -2.62 2.63 0.16 6.45 -4.23 -1.26 -0.48 115.64 116.30 2c1x s THR 45 Ca 0.22 0.21 -0.12 0.00 -1.18 0.00 0.00 61.69 60.82 2c1x s THR 45 Cb -0.03 -2.53 0.05 0.00 1.34 0.00 0.00 72.50 71.33 2c1x s THR 45 CO 0.16 -0.27 1.66 0.77 -0.54 0.00 0.00 174.62 176.40 2c1x h SER 46 N -1.63 0.84 -0.98 3.99 4.64 -1.92 -0.00 113.55 118.49 2c1x h SER 46 Ca -0.47 -0.24 0.01 0.00 -0.47 0.00 0.00 61.79 60.61 2c1x h SER 46 Cb 1.27 -0.22 -0.05 0.00 -0.31 0.00 0.00 62.40 63.09 2c1x h SER 46 CO 0.50 0.87 0.65 1.56 -0.87 0.00 0.00 176.83 179.53 2c1x h GLN 47 N 0.78 1.29 -0.00 4.77 7.50 -1.95 0.84 115.11 128.34 2c1x h GLN 47 Ca 0.17 -0.08 -0.00 0.00 0.50 0.00 0.00 58.65 59.24 2c1x h GLN 47 Cb 0.37 -0.29 -0.00 0.00 0.05 0.00 0.00 27.48 27.61 2c1x h GLN 47 CO 0.00 0.86 -0.00 1.03 -1.50 0.00 0.00 178.83 179.22 2c1x h SER 48 N 1.33 0.01 -0.43 1.46 0.87 -1.77 -2.29 113.55 112.73 2c1x h SER 48 Ca 0.36 -0.42 0.05 0.00 -1.23 0.00 0.00 61.79 60.55 2c1x h SER 48 Cb -0.15 -0.00 -0.05 0.00 -0.44 0.00 0.00 62.40 61.76 2c1x h SER 48 CO -0.08 0.43 0.16 0.78 -0.53 0.00 0.00 176.83 177.58 2c1x h ASN 49 N -0.41 0.17 -0.98 6.23 2.35 -0.84 -1.13 115.58 120.97 2c1x h ASN 49 Ca 0.00 0.05 0.07 0.00 -0.55 0.00 0.00 56.30 55.87 2c1x h ASN 49 Cb 0.42 0.03 -0.07 0.00 0.05 0.00 0.00 38.32 38.75 2c1x h ASN 49 CO 0.00 0.13 0.63 0.00 -1.65 0.00 0.00 177.43 176.54 2c1x h ALA 50 N 1.27 1.45 -0.19 -0.83 0.00 -0.84 -1.06 119.26 119.06 2c1x h ALA 50 Ca 0.20 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 55.02 2c1x h ALA 50 Cb 0.18 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 17.68 2c1x h ALA 50 CO -0.20 0.40 -0.13 1.03 0.00 0.00 0.00 179.25 180.36 2c1x h SER 51 N 1.12 0.43 1.12 0.00 0.87 -0.79 -3.34 113.55 112.96 2c1x h SER 51 Ca 0.42 -0.44 -0.11 0.00 -1.23 0.00 0.00 61.79 60.44 2c1x h SER 51 Cb 0.20 -0.12 -0.02 0.00 -0.44 0.00 0.00 62.40 62.02 2c1x h SER 51 CO -0.17 0.78 -0.93 0.16 -0.53 0.00 0.00 176.83 176.14 2c1x h ILE 52 N 0.09 0.51 -2.58 2.23 3.07 -1.03 -3.52 117.51 116.28 2c1x h ILE 52 Ca 0.04 -1.84 -0.51 0.00 1.55 0.00 0.00 64.86 64.10 2c1x h ILE 52 Cb 0.63 2.08 -0.01 0.00 -0.27 0.00 0.00 36.82 39.25 2c1x h ILE 52 CO 0.03 0.29 -0.37 -0.36 -1.05 0.00 0.00 178.15 176.70 2c1x s PHE 53 N -3.03 3.48 -0.11 0.16 0.40 -0.42 -5.04 117.98 113.42 2c1x s PHE 53 Ca 0.01 0.19 -0.08 0.00 -0.60 0.00 0.00 56.93 56.44 2c1x s PHE 53 Cb 0.08 -1.74 0.03 0.00 0.51 0.00 0.00 43.02 41.91 2c1x s PHE 53 CO 0.77 0.39 0.16 1.04 0.70 0.00 0.00 175.22 178.28 2c1x n GLN 61 N -1.03 -4.10 0.19 0.44 3.00 -1.26 -5.07 117.38 109.55 2c1x n GLN 61 Ca -0.06 3.09 0.14 0.00 -0.01 0.00 0.00 57.00 60.15 2c1x n GLN 61 Cb 0.55 -4.22 0.60 0.00 0.00 0.00 0.00 30.24 27.17 2c1x n GLN 61 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 2c1x n ASN 63 N -2.53 0.00 -4.61 0.00 6.94 -1.26 -4.74 115.26 109.06 2c1x n ASN 63 Ca 0.01 -1.16 -0.34 0.00 -0.02 0.00 0.00 54.58 53.06 2c1x n ASN 63 Cb 0.22 0.00 -0.10 0.00 -2.36 0.00 0.00 39.78 37.54 2c1x n ASN 63 CO 0.00 0.00 0.00 -0.63 -1.03 0.00 0.00 177.26 175.60 2c1x s ILE 64 N -2.00 4.27 -0.04 1.53 1.01 -0.83 -0.22 121.20 124.91 2c1x s ILE 64 Ca 0.34 -0.24 0.02 0.00 0.00 0.00 0.00 60.65 60.77 2c1x s ILE 64 Cb 0.15 -2.85 0.01 0.00 0.01 0.00 0.00 42.46 39.79 2c1x s ILE 64 CO 0.26 0.54 -0.09 -0.75 0.00 0.00 0.00 174.94 174.90 2c1x s LYS 65 N -0.20 1.16 0.39 2.79 2.20 -0.55 -4.98 119.74 120.55 2c1x s LYS 65 Ca 0.05 -0.28 -0.22 0.00 -0.36 0.00 0.00 55.97 55.16 2c1x s LYS 65 Cb -0.12 -1.05 -0.10 0.00 -1.51 0.00 0.00 37.83 35.04 2c1x s LYS 65 CO 0.02 0.03 0.93 -1.54 -0.36 0.00 0.00 175.35 174.43 2c1x s SER 66 N 0.56 7.06 -0.05 1.43 1.04 -1.26 -1.39 113.70 121.08 2c1x s SER 66 Ca -0.09 1.71 0.02 0.00 0.48 0.00 0.00 55.95 58.06 2c1x s SER 66 Cb -0.13 -2.54 0.01 0.00 0.10 0.00 0.00 66.02 63.47 2c1x s SER 66 CO 0.01 -0.25 -0.09 -0.31 0.98 0.00 0.00 173.24 173.58 2c1x s TYR 67 N -1.98 1.12 -0.11 5.02 2.02 0.56 -4.87 117.35 119.11 2c1x s TYR 67 Ca 0.58 -0.36 -0.24 0.00 -0.37 0.00 0.00 57.07 56.68 2c1x s TYR 67 Cb -0.12 -0.85 -0.03 0.00 -0.40 0.00 0.00 41.96 40.55 2c1x s TYR 67 CO 0.17 -0.21 0.73 -0.51 -1.57 0.00 0.00 175.55 174.16 2c1x s ASP 68 N 0.64 6.95 0.36 2.29 1.01 -1.26 -2.46 116.67 124.19 2c1x s ASP 68 Ca -0.11 1.15 0.09 0.00 0.71 0.00 0.00 52.55 54.38 2c1x s ASP 68 Cb -0.14 -2.42 -0.06 0.00 1.01 0.00 0.00 42.92 41.32 2c1x s ASP 68 CO 0.02 -0.21 0.02 0.27 0.21 0.00 0.00 175.17 175.48 2c1x s ILE 69 N 1.30 2.48 0.32 0.77 -5.25 0.37 -4.92 121.20 116.27 2c1x s ILE 69 Ca 0.37 -1.97 -0.29 0.00 -0.99 0.00 0.00 60.65 57.77 2c1x s ILE 69 Cb -0.17 -2.82 -0.10 0.00 2.95 0.00 0.00 42.46 42.32 2c1x s ILE 69 CO 0.16 -0.16 1.24 -0.55 -1.79 0.00 0.00 174.94 173.84 2c1x s SER 70 N -3.72 6.88 0.00 4.36 0.15 -1.26 -4.20 113.70 115.90 2c1x s SER 70 Ca 0.35 2.56 0.21 0.00 0.70 0.00 0.00 55.95 59.76 2c1x s SER 70 Cb 0.02 -2.64 1.23 0.00 -1.71 0.00 0.00 66.02 62.91 2c1x s SER 70 CO 0.19 -0.45 1.68 -0.90 1.20 0.00 0.00 173.24 174.97 2c1x n ASP 71 N 0.84 0.00 0.00 5.45 5.68 -1.26 -4.86 116.55 122.39 2c1x n ASP 71 Ca 0.00 -1.00 0.00 0.00 -0.50 0.00 0.00 54.79 53.29 2c1x n ASP 71 Cb 0.43 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.41 2c1x n ASP 71 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2c1x n GLY 72 N 0.58 0.61 3.61 6.12 0.00 -1.26 -3.06 105.19 111.79 2c1x n GLY 72 Ca 0.15 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.76 2c1x n GLY 72 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2c1x s VAL 73 N -2.56 4.86 0.78 1.61 1.01 -1.26 -4.63 120.40 120.22 2c1x s VAL 73 Ca 0.00 1.11 -0.14 0.00 0.00 0.00 0.00 61.98 62.96 2c1x s VAL 73 Cb 0.00 -4.07 0.07 0.00 0.00 0.00 0.00 36.38 32.38 2c1x s VAL 73 CO 0.00 -0.17 1.20 -2.84 0.00 0.00 0.00 175.10 173.30 2c1x s PRO 74 N 2.79 1.80 0.15 2.72 0.02 -1.26 -4.92 135.00 136.29 2c1x s PRO 74 Ca 0.30 1.75 -0.19 0.00 0.02 0.00 0.00 61.00 62.87 2c1x s PRO 74 Cb -0.15 -1.79 0.04 0.00 0.02 0.00 0.00 34.50 32.62 2c1x s PRO 74 CO 0.11 -2.09 1.67 1.49 -0.33 0.00 0.00 177.00 177.85 2c1x h GLU 75 N -0.73 -0.05 -0.93 5.54 4.57 -2.06 -2.86 114.58 118.06 2c1x h GLU 75 Ca -0.47 0.00 -0.50 0.00 -1.18 0.00 0.00 59.36 57.22 2c1x h GLU 75 Cb 1.29 0.01 -0.29 0.00 -0.16 0.00 0.00 28.75 29.61 2c1x h GLU 75 CO 0.47 -0.03 0.59 0.41 -1.18 0.00 0.00 179.01 179.27 2c1x n GLY 76 N -1.28 4.67 3.72 1.92 0.00 -1.26 -5.02 105.19 107.93 2c1x n GLY 76 Ca 0.00 -1.21 -0.42 0.00 0.00 0.00 0.00 46.02 44.39 2c1x n GLY 76 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2c1x s TYR 77 N -3.34 3.53 -0.24 1.61 6.14 -1.08 -5.00 117.35 118.96 2c1x s TYR 77 Ca 0.56 1.47 -0.08 0.00 0.64 0.00 0.00 57.07 59.66 2c1x s TYR 77 Cb 0.47 -3.30 -0.04 0.00 0.42 0.00 0.00 41.96 39.51 2c1x s TYR 77 CO 0.09 -0.78 0.09 0.08 0.64 0.00 0.00 175.55 175.66 2c1x s VAL 78 N 0.86 4.61 0.30 3.14 1.01 -1.26 -5.03 120.40 124.03 2c1x s VAL 78 Ca 0.55 -0.08 -0.29 0.00 0.00 0.00 0.00 61.98 62.17 2c1x s VAL 78 Cb -0.27 -3.15 -0.10 0.00 0.00 0.00 0.00 36.38 32.86 2c1x s VAL 78 CO 0.30 0.35 1.32 -0.36 0.00 0.00 0.00 175.10 176.71 2c1x s PHE 79 N 1.37 3.08 0.23 5.22 0.40 -1.26 -4.91 117.98 122.11 2c1x s PHE 79 Ca 0.06 1.34 0.02 0.00 -0.60 0.00 0.00 56.93 57.75 2c1x s PHE 79 Cb -0.15 -3.68 0.23 0.00 0.51 0.00 0.00 43.02 39.93 2c1x s PHE 79 CO 0.05 -1.96 1.56 0.00 0.70 0.00 0.00 175.22 175.57 2c1x h ALA 80 N 3.88 0.83 0.00 5.36 0.00 -2.01 -3.47 119.26 123.85 2c1x h ALA 80 Ca -0.48 -0.52 0.00 0.00 0.00 0.00 0.00 54.91 53.91 2c1x h ALA 80 Cb 1.22 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.93 2c1x h ALA 80 CO 0.69 0.70 0.00 0.41 0.00 0.00 0.00 179.25 181.05 2c1x n GLY 81 N 0.21 0.98 3.75 0.00 0.00 -1.26 -5.09 105.19 103.78 2c1x n GLY 81 Ca -0.03 -0.02 -0.34 0.00 0.00 0.00 0.00 46.02 45.63 2c1x n GLY 81 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2c1x s ARG 82 N -0.54 2.59 0.16 1.61 0.52 -1.26 -4.98 118.95 117.04 2c1x s ARG 82 Ca 0.00 1.65 -0.31 0.00 -0.52 0.00 0.00 55.73 56.56 2c1x s ARG 82 Cb 0.00 -1.90 -0.08 0.00 0.52 0.00 0.00 34.95 33.49 2c1x s ARG 82 CO 0.00 -1.46 1.33 -1.25 0.02 0.00 0.00 175.30 173.94 2c1x s PRO 83 N -3.80 4.36 -1.46 3.54 0.04 -1.26 -3.20 135.00 133.22 2c1x s PRO 83 Ca 0.73 2.04 -0.00 0.00 0.04 0.00 0.00 61.00 63.81 2c1x s PRO 83 Cb -0.26 -3.22 0.00 0.00 0.04 0.00 0.00 34.50 31.05 2c1x s PRO 83 CO 0.40 -0.32 0.06 1.04 0.04 0.00 0.00 177.00 178.22 2c1x n GLN 84 N 3.21 -1.73 -0.16 4.56 6.02 -1.26 -4.90 117.38 123.13 2c1x n GLN 84 Ca 0.08 0.83 -0.11 0.00 -0.01 0.00 0.00 57.00 57.79 2c1x n GLN 84 Cb 0.43 -5.31 -0.01 0.00 1.02 0.00 0.00 30.24 26.37 2c1x n GLN 84 CO 0.00 0.00 0.00 1.49 -1.01 0.00 0.00 177.06 177.54 2c1x h GLU 85 N -0.15 0.95 -0.96 -1.09 4.81 -1.94 -2.01 114.58 114.19 2c1x h GLU 85 Ca -0.42 -0.40 0.05 0.00 -0.13 0.00 0.00 59.36 58.46 2c1x h GLU 85 Cb 1.31 -0.04 -0.06 0.00 0.63 0.00 0.00 28.75 30.59 2c1x h GLU 85 CO 0.49 1.06 0.62 0.38 -0.73 0.00 0.00 179.01 180.83 2c1x h ASP 86 N 0.79 1.02 -0.60 1.04 3.04 -1.90 -1.52 116.42 118.29 2c1x h ASP 86 Ca 0.11 -0.00 -0.08 0.00 -3.24 0.00 0.00 57.03 53.82 2c1x h ASP 86 Cb 0.76 -0.22 -0.02 0.00 -1.04 0.00 0.00 39.33 38.80 2c1x h ASP 86 CO 0.06 0.68 0.06 0.40 -2.04 0.00 0.00 179.24 178.40 2c1x h ILE 87 N 1.17 1.26 -0.53 4.15 2.04 -1.91 -0.38 117.51 123.32 2c1x h ILE 87 Ca 0.39 -1.05 -0.03 0.00 1.00 0.00 0.00 64.86 65.17 2c1x h ILE 87 Cb 0.06 0.77 -0.02 0.00 -0.74 0.00 0.00 36.82 36.88 2c1x h ILE 87 CO -0.14 0.39 0.22 -0.33 0.00 0.00 0.00 178.15 178.29 2c1x h GLU 88 N 0.92 0.78 -0.35 2.37 5.08 -0.93 -0.75 114.58 121.70 2c1x h GLU 88 Ca 0.18 -0.13 -0.06 0.00 -1.00 0.00 0.00 59.36 58.35 2c1x h GLU 88 Cb 0.47 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.58 2c1x h GLU 88 CO 0.02 0.67 -0.01 -0.07 -1.00 0.00 0.00 179.01 178.62 2c1x h LEU 89 N 0.71 0.61 0.23 1.33 3.38 -1.01 -1.97 115.31 118.58 2c1x h LEU 89 Ca 0.18 -0.31 -0.01 0.00 0.09 0.00 0.00 57.88 57.83 2c1x h LEU 89 Cb 0.18 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 40.76 2c1x h LEU 89 CO -0.02 0.77 -0.14 0.15 0.09 0.00 0.00 178.44 179.30 2c1x h PHE 90 N 0.42 -0.37 -0.62 1.13 3.57 -0.99 -3.00 116.94 117.09 2c1x h PHE 90 Ca 0.10 -0.00 0.05 0.00 3.53 0.00 0.00 57.97 61.64 2c1x h PHE 90 Cb 0.47 0.13 -0.05 0.00 2.79 0.00 0.00 35.95 39.29 2c1x h PHE 90 CO 0.04 -0.22 0.34 1.15 -2.23 0.00 0.00 178.31 177.39 2c1x h THR 91 N -0.36 0.98 -0.77 4.41 2.02 -0.99 0.11 112.91 118.31 2c1x h THR 91 Ca -0.02 -0.22 -0.04 0.00 0.77 0.00 0.00 66.41 66.90 2c1x h THR 91 Cb 0.30 0.28 -0.03 0.00 -1.74 0.00 0.00 68.15 66.95 2c1x h THR 91 CO 0.02 0.12 0.33 0.03 0.37 0.00 0.00 175.52 176.39 2c1x h ARG 92 N 0.64 1.13 0.00 6.66 3.08 -1.36 -2.68 114.38 121.85 2c1x h ARG 92 Ca 0.27 -0.19 0.00 0.00 0.07 0.00 0.00 59.98 60.13 2c1x h ARG 92 Cb 0.15 -0.19 0.00 0.00 0.08 0.00 0.00 29.97 30.01 2c1x h ARG 92 CO -0.17 0.90 -0.32 0.00 -1.07 0.00 0.00 179.97 179.32 2c1x h ALA 93 N 1.17 0.81 -0.52 0.04 0.00 -1.34 -3.41 119.26 116.01 2c1x h ALA 93 Ca 0.26 0.00 0.08 0.00 0.00 0.00 0.00 54.91 55.25 2c1x h ALA 93 Cb 0.18 0.00 -0.07 0.00 0.00 0.00 0.00 17.79 17.90 2c1x h ALA 93 CO -0.03 0.00 0.15 0.00 0.00 0.00 0.00 179.25 179.37 2c1x h ALA 94 N 2.33 0.61 -0.58 0.00 0.00 -0.42 0.80 119.26 121.99 2c1x h ALA 94 Ca 0.00 0.09 0.12 0.00 0.00 0.00 0.00 54.91 55.12 2c1x h ALA 94 Cb 0.84 0.09 -0.10 0.00 0.00 0.00 0.00 17.79 18.62 2c1x h ALA 94 CO 0.00 -0.26 -0.00 -1.35 0.00 0.00 0.00 179.25 177.64 2c1x h PRO 95 N 0.30 0.11 -0.10 0.00 0.11 -1.80 0.23 132.00 130.85 2c1x h PRO 95 Ca 0.26 -0.01 -0.15 0.00 0.11 0.00 0.00 66.00 66.21 2c1x h PRO 95 Cb 0.32 -0.03 0.01 0.00 0.11 0.00 0.00 31.00 31.41 2c1x h PRO 95 CO -0.30 0.07 -0.51 1.49 -0.21 0.00 0.00 178.00 178.55 2c1x h GLU 96 N 0.11 0.52 -0.25 1.05 4.57 -1.70 -2.01 114.58 116.89 2c1x h GLU 96 Ca 0.30 -0.43 0.06 0.00 -1.18 0.00 0.00 59.36 58.11 2c1x h GLU 96 Cb 0.48 0.09 -0.06 0.00 -0.16 0.00 0.00 28.75 29.10 2c1x h GLU 96 CO -0.50 1.06 -0.15 0.77 -1.18 0.00 0.00 179.01 179.01 2c1x h SER 97 N 0.12 -0.49 -0.55 1.04 0.02 -0.45 -1.57 113.55 111.68 2c1x h SER 97 Ca -0.04 0.11 -0.05 0.00 -0.84 0.00 0.00 61.79 60.97 2c1x h SER 97 Cb 1.16 0.26 -0.02 0.00 0.14 0.00 0.00 62.40 63.93 2c1x h SER 97 CO 0.11 -0.19 0.14 -0.26 -1.14 0.00 0.00 176.83 175.49 2c1x h PHE 98 N -0.13 0.91 -0.40 3.45 0.04 -0.62 -1.82 116.94 118.37 2c1x h PHE 98 Ca 0.14 -0.11 0.08 0.00 2.80 0.00 0.00 57.97 60.88 2c1x h PHE 98 Cb 0.33 -0.26 -0.08 0.00 2.20 0.00 0.00 35.95 38.15 2c1x h PHE 98 CO -0.32 0.79 -0.09 -0.09 -0.60 0.00 0.00 178.31 177.99 2c1x h ARG 99 N 0.78 0.01 -0.50 1.51 2.43 -1.08 0.15 114.38 117.68 2c1x h ARG 99 Ca 0.17 -0.00 -0.05 0.00 -0.81 0.00 0.00 59.98 59.29 2c1x h ARG 99 Cb 0.33 -0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 29.86 2c1x h ARG 99 CO 0.00 0.01 0.12 1.96 -1.51 0.00 0.00 179.97 180.54 2c1x h GLN 100 N 0.01 0.80 -0.47 0.20 4.20 -1.21 -0.70 115.11 117.93 2c1x h GLN 100 Ca 0.19 -0.20 0.08 0.00 0.06 0.00 0.00 58.65 58.79 2c1x h GLN 100 Cb 0.30 -0.10 -0.06 0.00 0.30 0.00 0.00 27.48 27.91 2c1x h GLN 100 CO -0.41 0.78 0.10 0.78 -0.67 0.00 0.00 178.83 179.41 2c1x h GLY 101 N 0.69 0.57 1.45 3.46 0.00 -0.95 -2.42 103.07 105.87 2c1x h GLY 101 Ca 0.16 -0.03 -0.09 0.00 0.00 0.00 0.00 47.33 47.37 2c1x h GLY 101 CO 0.00 -0.05 -0.14 -0.33 0.00 0.00 0.00 176.54 176.02 2c1x h MET 102 N 0.24 0.66 -0.35 4.80 2.86 -0.17 -1.42 114.93 121.55 2c1x h MET 102 Ca 0.23 -0.21 0.06 0.00 -2.06 0.00 0.00 59.70 57.72 2c1x h MET 102 Cb 0.30 -0.06 -0.05 0.00 0.06 0.00 0.00 31.60 31.85 2c1x h MET 102 CO -0.30 0.77 0.03 0.28 1.06 0.00 0.00 176.91 178.75 2c1x h VAL 103 N 0.60 0.78 -0.28 -2.22 2.07 -0.93 0.00 116.25 116.26 2c1x h VAL 103 Ca 0.10 -0.05 0.02 0.00 0.82 0.00 0.00 66.70 67.59 2c1x h VAL 103 Cb 0.58 0.63 -0.02 0.00 -1.52 0.00 0.00 31.29 30.96 2c1x h VAL 103 CO 0.04 0.02 0.15 -0.03 0.02 0.00 0.00 177.57 177.77 2c1x h MET 104 N 0.13 0.31 -0.60 1.57 -1.53 -0.91 -1.31 114.93 112.59 2c1x h MET 104 Ca 0.17 -0.02 -0.08 0.00 -3.44 0.00 0.00 59.70 56.33 2c1x h MET 104 Cb 0.21 -0.07 -0.02 0.00 -0.55 0.00 0.00 31.60 31.17 2c1x h MET 104 CO -0.26 0.20 0.08 0.00 0.14 0.00 0.00 176.91 177.07 2c1x h ALA 105 N 1.14 0.80 -0.29 0.39 0.00 -0.86 -0.38 119.26 120.05 2c1x h ALA 105 Ca 0.11 -0.27 -0.00 0.00 0.00 0.00 0.00 54.91 54.76 2c1x h ALA 105 Cb 0.02 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 2c1x h ALA 105 CO -0.07 0.57 0.18 0.28 0.00 0.00 0.00 179.25 180.21 2c1x h VAL 106 N 0.91 1.10 -0.68 0.00 2.07 -0.85 -0.64 116.25 118.15 2c1x h VAL 106 Ca 0.18 -0.23 0.03 0.00 0.82 0.00 0.00 66.70 67.50 2c1x h VAL 106 Cb 0.45 0.73 -0.04 0.00 -1.52 0.00 0.00 31.29 30.91 2c1x h VAL 106 CO 0.02 0.10 0.43 0.00 0.02 0.00 0.00 177.57 178.13 2c1x h ALA 107 N 1.07 0.88 -0.34 1.67 0.00 -1.01 0.30 119.26 121.83 2c1x h ALA 107 Ca 0.10 -0.02 -0.10 0.00 0.00 0.00 0.00 54.91 54.89 2c1x h ALA 107 Cb 0.00 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 2c1x h ALA 107 CO -0.02 0.20 -0.17 0.93 0.00 0.00 0.00 179.25 180.19 2c1x h GLU 108 N 0.84 0.72 0.00 0.00 5.08 -0.77 -3.22 114.58 117.24 2c1x h GLU 108 Ca 0.27 -0.32 -0.04 0.00 -1.00 0.00 0.00 59.36 58.27 2c1x h GLU 108 Cb 0.00 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.23 2c1x h GLU 108 CO -0.10 0.92 -0.63 1.79 -1.00 0.00 0.00 179.01 179.99 2c1x h THR 109 N 0.49 0.20 -1.44 1.13 1.35 -1.00 -3.48 112.91 110.16 2c1x h THR 109 Ca 0.07 -1.32 -0.38 0.00 -0.55 0.00 0.00 66.41 64.23 2c1x h THR 109 Cb 0.71 1.89 -0.11 0.00 -1.73 0.00 0.00 68.15 68.91 2c1x h THR 109 CO 0.05 0.11 -0.39 0.61 -0.25 0.00 0.00 175.52 175.65 2c1x n GLY 110 N 1.19 1.15 3.13 5.82 0.00 0.11 -5.01 105.19 111.57 2c1x n GLY 110 Ca 0.00 -0.11 -0.32 0.00 0.00 0.00 0.00 46.02 45.60 2c1x n GLY 110 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2c1x s ARG 111 N -4.00 2.85 0.60 1.61 0.52 -1.20 -5.05 118.95 114.29 2c1x s ARG 111 Ca 0.00 -0.79 -0.20 0.00 -0.52 0.00 0.00 55.73 54.23 2c1x s ARG 111 Cb 0.00 -2.39 -0.03 0.00 0.52 0.00 0.00 34.95 33.05 2c1x s ARG 111 CO 0.00 -0.10 1.30 -2.30 0.02 0.00 0.00 175.30 174.22 2c1x n PRO 112 N 4.32 1.36 -1.97 3.54 -0.02 -1.26 -4.49 135.00 136.48 2c1x n PRO 112 Ca -0.20 0.51 -0.42 0.00 -2.02 0.00 0.00 63.50 61.38 2c1x n PRO 112 Cb 0.51 -2.53 -0.03 0.00 -0.02 0.00 0.00 33.50 31.43 2c1x n PRO 112 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2c1x s VAL 113 N -1.35 2.66 -0.60 -1.45 1.01 -1.26 -4.27 120.40 115.14 2c1x s VAL 113 Ca 0.77 0.50 0.14 0.00 0.00 0.00 0.00 61.98 63.39 2c1x s VAL 113 Cb -0.40 -3.32 -0.15 0.00 0.00 0.00 0.00 36.38 32.51 2c1x s VAL 113 CO 0.45 0.05 0.56 -1.54 0.00 0.00 0.00 175.10 174.62 2c1x n SER 114 N 3.48 0.72 -3.63 3.32 3.41 0.63 -4.90 113.62 116.64 2c1x n SER 114 Ca 0.12 -0.77 -0.11 0.00 -0.26 0.00 0.00 58.87 57.85 2c1x n SER 114 Cb 0.39 1.05 -0.07 0.00 -0.26 0.00 0.00 64.21 65.32 2c1x n SER 114 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2c1x s LEU 116 N 0.90 4.46 -0.09 0.00 2.96 -0.33 -1.28 118.68 125.30 2c1x s LEU 116 Ca -0.04 -1.58 -0.12 0.00 -0.22 0.00 0.00 54.13 52.18 2c1x s LEU 116 Cb -0.05 -1.76 -0.05 0.00 0.50 0.00 0.00 46.19 44.83 2c1x s LEU 116 CO -0.08 -0.37 0.28 -0.69 -1.32 0.00 0.00 176.35 174.16 2c1x s VAL 117 N 1.21 5.28 -0.01 1.68 1.01 0.31 -0.79 120.40 129.09 2c1x s VAL 117 Ca 0.01 0.53 -0.23 0.00 0.00 0.00 0.00 61.98 62.28 2c1x s VAL 117 Cb -0.21 -3.57 0.05 0.00 0.00 0.00 0.00 36.38 32.65 2c1x s VAL 117 CO -0.02 0.54 0.50 0.00 0.00 0.00 0.00 175.10 176.12 2c1x s ALA 118 N -0.62 -1.29 0.31 5.51 0.00 -1.04 -0.98 121.76 123.64 2c1x s ALA 118 Ca 0.18 0.75 -0.29 0.00 0.00 0.00 0.00 51.96 52.60 2c1x s ALA 118 Cb -0.14 0.14 -0.12 0.00 0.00 0.00 0.00 23.12 23.00 2c1x s ALA 118 CO 0.07 -0.38 1.43 -3.47 0.00 0.00 0.00 175.76 173.41 2c1x n ASP 119 N 0.87 3.21 0.26 0.00 -0.08 -0.37 -0.64 116.55 119.80 2c1x n ASP 119 Ca -0.20 1.18 0.17 0.00 -1.51 0.00 0.00 54.79 54.43 2c1x n ASP 119 Cb 0.58 -1.52 0.80 0.00 2.34 0.00 0.00 41.12 43.32 2c1x n ASP 119 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2c1x h ALA 120 N 3.56 1.57 -0.02 -1.67 0.00 -1.45 0.12 119.26 121.38 2c1x h ALA 120 Ca -0.47 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.44 2c1x h ALA 120 Cb 1.26 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.06 2c1x h ALA 120 CO 0.70 -0.42 0.00 1.19 0.00 0.00 0.00 179.25 180.72 2c1x n PHE 121 N -3.16 0.02 -2.78 0.00 3.72 -1.26 -4.66 117.46 109.35 2c1x n PHE 121 Ca 0.01 -0.01 -0.43 0.00 -0.05 0.00 0.00 57.45 56.97 2c1x n PHE 121 Cb 0.44 0.00 -0.04 0.00 -0.94 0.00 0.00 39.48 38.94 2c1x n PHE 121 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 2c1x s ILE 122 N -1.98 4.25 0.04 4.37 -1.09 0.42 -4.98 121.20 122.24 2c1x s ILE 122 Ca 0.39 0.19 -0.30 0.00 -2.23 0.00 0.00 60.65 58.70 2c1x s ILE 122 Cb 0.19 -4.65 -0.04 0.00 -1.58 0.00 0.00 42.46 36.38 2c1x s ILE 122 CO 0.31 -1.33 0.99 0.26 -1.23 0.00 0.00 174.94 173.95 2c1x s TRP 123 N 4.32 3.69 0.00 3.97 0.51 -1.26 -2.78 118.94 127.39 2c1x s TRP 123 Ca 0.30 1.71 0.00 0.00 -2.12 0.00 0.00 56.10 55.99 2c1x s TRP 123 Cb -0.13 -3.12 0.00 0.00 -0.81 0.00 0.00 33.47 29.41 2c1x s TRP 123 CO 0.17 -0.04 0.00 1.19 -0.51 0.00 0.00 176.95 177.76 2c1x n PHE 124 N 3.50 0.00 -0.22 -1.98 3.72 -1.26 -4.70 117.46 116.52 2c1x n PHE 124 Ca 0.05 0.00 0.04 0.00 -0.05 0.00 0.00 57.45 57.48 2c1x n PHE 124 Cb 0.50 0.00 0.28 0.00 -0.94 0.00 0.00 39.48 39.32 2c1x n PHE 124 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2c1x h ALA 125 N 0.00 1.56 -0.61 4.37 0.00 -1.91 -0.27 119.26 122.40 2c1x h ALA 125 Ca 0.00 -0.03 0.01 0.00 0.00 0.00 0.00 54.91 54.89 2c1x h ALA 125 Cb 0.00 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.50 2c1x h ALA 125 CO 0.00 0.35 0.40 0.00 0.00 0.00 0.00 179.25 180.00 2c1x h ALA 126 N 1.56 0.78 -0.40 0.00 0.00 -1.92 -0.04 119.26 119.24 2c1x h ALA 126 Ca 0.32 -0.04 -0.13 0.00 0.00 0.00 0.00 54.91 55.06 2c1x h ALA 126 Cb 0.10 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 2c1x h ALA 126 CO -0.10 0.19 -0.27 -0.44 0.00 0.00 0.00 179.25 178.63 2c1x h ASP 127 N 0.81 0.87 -0.42 0.00 3.32 -1.81 -1.94 116.42 117.25 2c1x h ASP 127 Ca 0.23 -0.34 -0.01 0.00 0.02 0.00 0.00 57.03 56.93 2c1x h ASP 127 Cb -0.06 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.22 2c1x h ASP 127 CO -0.06 1.09 0.23 0.24 -1.72 0.00 0.00 179.24 179.01 2c1x h MET 128 N 0.72 0.58 -0.41 3.56 2.86 -0.84 -0.23 114.93 121.17 2c1x h MET 128 Ca 0.09 -0.07 -0.02 0.00 -2.06 0.00 0.00 59.70 57.64 2c1x h MET 128 Cb 0.81 -0.11 -0.02 0.00 0.06 0.00 0.00 31.60 32.34 2c1x h MET 128 CO 0.07 0.47 0.17 0.00 1.06 0.00 0.00 176.91 178.68 2c1x h ALA 129 N 1.08 0.53 -0.48 6.32 0.00 -0.90 -1.76 119.26 124.06 2c1x h ALA 129 Ca 0.15 -0.14 0.06 0.00 0.00 0.00 0.00 54.91 54.98 2c1x h ALA 129 Cb 0.06 -0.16 -0.05 0.00 0.00 0.00 0.00 17.79 17.64 2c1x h ALA 129 CO -0.02 0.13 0.18 0.00 0.00 0.00 0.00 179.25 179.54 2c1x h ALA 130 N 1.01 0.58 -0.20 0.00 0.00 -1.19 -0.03 119.26 119.44 2c1x h ALA 130 Ca 0.14 0.06 -0.06 0.00 0.00 0.00 0.00 54.91 55.05 2c1x h ALA 130 Cb 0.19 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 2c1x h ALA 130 CO -0.01 -0.21 -0.13 1.49 0.00 0.00 0.00 179.25 180.39 2c1x h GLU 131 N 0.36 0.32 0.00 0.00 4.57 -0.89 -2.51 114.58 116.43 2c1x h GLU 131 Ca 0.23 -0.08 0.00 0.00 -1.18 0.00 0.00 59.36 58.33 2c1x h GLU 131 Cb 0.23 -0.04 0.00 0.00 -0.16 0.00 0.00 28.75 28.77 2c1x h GLU 131 CO -0.22 0.46 -0.34 -1.33 -1.18 0.00 0.00 179.01 176.39 2c1x n MET 132 N -4.25 0.13 -2.63 1.92 2.81 -0.67 -4.95 117.12 109.47 2c1x n MET 132 Ca -0.00 0.06 -0.08 0.00 -1.81 0.00 0.00 57.70 55.86 2c1x n MET 132 Cb 0.29 -1.60 0.02 0.00 -0.71 0.00 0.00 33.22 31.21 2c1x n MET 132 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2c1x n GLY 133 N 1.42 0.28 3.35 3.03 0.00 -0.13 -5.06 105.19 108.08 2c1x n GLY 133 Ca 0.05 -0.42 -0.18 0.00 0.00 0.00 0.00 46.02 45.47 2c1x n GLY 133 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2c1x s VAL 134 N -2.86 1.59 0.47 1.61 -7.23 -0.55 -4.62 120.40 108.80 2c1x s VAL 134 Ca 0.14 -2.16 -0.24 0.00 -1.81 0.00 0.00 61.98 57.92 2c1x s VAL 134 Cb -0.06 -2.15 -0.07 0.00 0.56 0.00 0.00 36.38 34.66 2c1x s VAL 134 CO 0.17 -0.52 1.28 0.00 -0.31 0.00 0.00 175.10 175.72 2c1x s ALA 135 N -3.06 3.03 -0.23 1.32 0.00 -1.26 -4.32 121.76 117.23 2c1x s ALA 135 Ca 0.24 1.17 -0.06 0.00 0.00 0.00 0.00 51.96 53.31 2c1x s ALA 135 Cb 0.01 -3.48 -0.02 0.00 0.00 0.00 0.00 23.12 19.63 2c1x s ALA 135 CO 0.07 -0.95 0.03 -0.46 0.00 0.00 0.00 175.76 174.45 2c1x s TRP 136 N -1.37 3.05 -0.63 0.00 -0.00 -1.26 -1.18 118.94 117.55 2c1x s TRP 136 Ca 0.64 -0.55 0.05 0.00 -0.00 0.00 0.00 56.10 56.23 2c1x s TRP 136 Cb -0.36 -2.17 0.16 0.00 -0.00 0.00 0.00 33.47 31.10 2c1x s TRP 136 CO 0.44 -0.38 0.42 -0.51 -0.00 0.00 0.00 176.95 176.92 2c1x s LEU 137 N 1.45 4.28 0.37 5.86 1.43 0.03 -2.10 118.68 130.00 2c1x s LEU 137 Ca 0.05 -3.55 -0.26 0.00 -1.03 0.00 0.00 54.13 49.35 2c1x s LEU 137 Cb -0.15 -1.49 -0.09 0.00 0.03 0.00 0.00 46.19 44.50 2c1x s LEU 137 CO 0.01 -0.13 1.11 -2.16 0.23 0.00 0.00 176.35 175.42 2c1x s PRO 138 N -0.98 4.22 -0.26 1.29 0.04 -1.21 -2.50 135.00 135.59 2c1x s PRO 138 Ca 0.24 1.72 -0.09 0.00 0.04 0.00 0.00 61.00 62.90 2c1x s PRO 138 Cb -0.09 -2.74 -0.04 0.00 0.04 0.00 0.00 34.50 31.67 2c1x s PRO 138 CO -0.13 -0.14 0.13 0.12 0.04 0.00 0.00 177.00 177.02 2c1x s PHE 139 N -1.45 3.18 -0.37 0.56 5.36 0.18 -1.47 117.98 123.97 2c1x s PHE 139 Ca 0.55 -0.09 -0.21 0.00 -0.96 0.00 0.00 56.93 56.22 2c1x s PHE 139 Cb -0.28 -2.29 0.01 0.00 -0.34 0.00 0.00 43.02 40.11 2c1x s PHE 139 CO 0.35 -0.20 0.65 -0.46 -1.46 0.00 0.00 175.22 174.10 2c1x s TRP 140 N 1.55 3.13 -1.35 10.12 -0.11 -0.04 -1.12 118.94 131.12 2c1x s TRP 140 Ca 0.06 0.29 0.29 0.00 1.22 0.00 0.00 56.10 57.97 2c1x s TRP 140 Cb -0.15 -3.20 1.26 0.00 -1.50 0.00 0.00 33.47 29.88 2c1x s TRP 140 CO 0.07 -0.68 1.90 0.25 -4.62 0.00 0.00 176.95 173.87 2c1x n THR 141 N 5.66 0.00 -2.03 5.86 -2.24 -1.26 -3.76 114.28 116.50 2c1x n THR 141 Ca -0.01 -0.02 0.00 0.00 -2.27 0.00 0.00 64.05 61.75 2c1x n THR 141 Cb 0.48 -0.30 0.00 0.00 -2.10 0.00 0.00 70.33 68.42 2c1x n THR 141 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2c1x n ALA 142 N -1.25 0.00 -2.36 6.98 0.00 -1.26 -4.80 120.51 117.82 2c1x n ALA 142 Ca 0.12 0.00 -0.24 0.00 0.00 0.00 0.00 53.44 53.32 2c1x n ALA 142 Cb 0.29 0.00 0.01 0.00 0.00 0.00 0.00 19.45 19.74 2c1x n ALA 142 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2c1x s GLY 143 N -0.12 1.52 0.54 0.00 0.00 -1.26 -4.56 107.32 103.44 2c1x s GLY 143 Ca 0.00 -0.94 0.32 0.00 0.00 0.00 0.00 44.72 44.11 2c1x s GLY 143 CO 0.00 -0.78 1.96 -0.56 0.00 0.00 0.00 173.10 173.73 2c1x h PRO 144 N 0.39 0.00 -0.12 2.90 0.13 -1.97 -2.26 132.00 131.07 2c1x h PRO 144 Ca -0.47 0.00 0.01 0.00 -0.87 0.00 0.00 66.00 64.67 2c1x h PRO 144 Cb 1.24 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.36 2c1x h PRO 144 CO 0.59 0.03 0.06 -2.95 -0.23 0.00 0.00 178.00 175.49 2c1x h ASN 145 N 0.00 0.09 0.29 1.44 7.08 -1.98 0.14 115.58 122.64 2c1x h ASN 145 Ca -0.00 0.00 -0.17 0.00 -3.08 0.00 0.00 56.30 53.05 2c1x h ASN 145 Cb 0.54 -0.01 -0.01 0.00 -2.08 0.00 0.00 38.32 36.76 2c1x h ASN 145 CO 0.00 0.07 -0.68 0.77 -2.08 0.00 0.00 177.43 175.51 2c1x h SER 146 N 0.13 0.41 -0.82 6.14 4.64 -1.87 -2.40 113.55 119.78 2c1x h SER 146 Ca 0.05 -0.26 0.02 0.00 -0.47 0.00 0.00 61.79 61.13 2c1x h SER 146 Cb 0.01 -0.12 -0.05 0.00 -0.31 0.00 0.00 62.40 61.93 2c1x h SER 146 CO -0.03 0.97 0.53 0.25 -0.87 0.00 0.00 176.83 177.68 2c1x h LEU 147 N 0.25 0.90 0.04 5.97 5.85 -1.30 -2.08 115.31 124.94 2c1x h LEU 147 Ca -0.02 -0.01 -0.00 0.00 0.84 0.00 0.00 57.88 58.69 2c1x h LEU 147 Cb 1.23 -0.21 0.00 0.00 0.37 0.00 0.00 40.66 42.05 2c1x h LEU 147 CO 0.11 0.64 -0.02 -1.28 -0.34 0.00 0.00 178.44 177.55 2c1x h SER 148 N 1.06 -0.04 -0.33 1.25 0.87 -0.54 -2.32 113.55 113.51 2c1x h SER 148 Ca 0.32 -0.14 -0.06 0.00 -1.23 0.00 0.00 61.79 60.67 2c1x h SER 148 Cb -0.05 0.01 -0.02 0.00 -0.44 0.00 0.00 62.40 61.90 2c1x h SER 148 CO -0.09 0.11 0.00 0.71 -0.53 0.00 0.00 176.83 177.03 2c1x h THR 149 N -0.20 1.23 -0.46 2.23 1.35 -1.36 -1.58 112.91 114.12 2c1x h THR 149 Ca -0.01 -0.91 -0.03 0.00 -0.55 0.00 0.00 66.41 64.91 2c1x h THR 149 Cb 0.18 0.90 -0.02 0.00 -1.73 0.00 0.00 68.15 67.48 2c1x h THR 149 CO 0.01 0.32 0.15 0.45 -0.25 0.00 0.00 175.52 176.20 2c1x h HIS 150 N 0.64 0.72 0.00 4.73 -0.00 -1.36 -2.06 115.15 117.83 2c1x h HIS 150 Ca 0.13 -0.07 -0.03 0.00 -0.00 0.00 0.00 60.37 60.40 2c1x h HIS 150 Cb 0.40 -0.21 -0.00 0.00 -0.00 0.00 0.00 27.41 27.59 2c1x h HIS 150 CO 0.02 0.64 -0.16 0.28 -0.00 0.00 0.00 177.93 178.71 2c1x h VAL 151 N 0.60 0.53 -0.55 2.45 2.07 -1.08 -2.55 116.25 117.72 2c1x h VAL 151 Ca 0.15 -0.75 0.00 0.00 0.82 0.00 0.00 66.70 66.92 2c1x h VAL 151 Cb 0.25 1.51 0.00 0.00 -1.52 0.00 0.00 31.29 31.52 2c1x h VAL 151 CO -0.01 0.15 0.00 -1.22 0.02 0.00 0.00 177.57 176.52 2c1x n TYR 152 N -3.51 1.71 -0.21 1.57 4.02 -0.62 -4.76 117.16 115.36 2c1x n TYR 152 Ca -0.01 -0.71 0.00 0.00 -0.01 0.00 0.00 57.90 57.17 2c1x n TYR 152 Cb 0.31 -0.39 0.11 0.00 -0.02 0.00 0.00 39.34 39.35 2c1x n TYR 152 CO 0.00 0.00 0.00 0.97 -1.01 0.00 0.00 176.86 176.82 2c1x h ILE 153 N 3.68 0.79 -0.22 -0.72 2.10 -0.93 -0.27 117.51 121.95 2c1x h ILE 153 Ca 0.00 -0.15 -0.01 0.00 1.08 0.00 0.00 64.86 65.77 2c1x h ILE 153 Cb 1.72 0.30 -0.01 0.00 -1.09 0.00 0.00 36.82 37.74 2c1x h ILE 153 CO 0.37 0.08 0.10 0.44 -1.08 0.00 0.00 178.15 178.05 2c1x h ASP 154 N 0.45 0.30 -0.79 2.19 3.32 -1.86 -0.85 116.42 119.18 2c1x h ASP 154 Ca 0.31 -0.15 0.01 0.00 0.02 0.00 0.00 57.03 57.22 2c1x h ASP 154 Cb 0.37 -0.08 -0.04 0.00 0.22 0.00 0.00 39.33 39.81 2c1x h ASP 154 CO -0.29 0.36 0.52 -0.33 -1.72 0.00 0.00 179.24 177.78 2c1x h GLU 155 N 0.21 1.04 -0.21 3.56 3.07 -1.82 0.40 114.58 120.83 2c1x h GLU 155 Ca 0.07 -0.06 -0.03 0.00 -0.50 0.00 0.00 59.36 58.84 2c1x h GLU 155 Cb 0.15 -0.23 -0.01 0.00 -0.84 0.00 0.00 28.75 27.82 2c1x h GLU 155 CO -0.01 0.69 0.01 0.82 -1.40 0.00 0.00 179.01 179.12 2c1x h ILE 156 N 1.07 1.25 -0.34 3.13 2.04 -0.87 -1.18 117.51 122.61 2c1x h ILE 156 Ca 0.29 -0.84 0.01 0.00 1.00 0.00 0.00 64.86 65.32 2c1x h ILE 156 Cb -0.12 1.39 -0.02 0.00 -0.74 0.00 0.00 36.82 37.33 2c1x h ILE 156 CO -0.06 0.26 0.21 0.03 0.00 0.00 0.00 178.15 178.59 2c1x h ARG 157 N 0.13 0.43 -0.61 2.37 3.08 -1.00 -0.64 114.38 118.13 2c1x h ARG 157 Ca 0.06 -0.03 0.11 0.00 0.07 0.00 0.00 59.98 60.20 2c1x h ARG 157 Cb 0.38 -0.10 -0.08 0.00 0.08 0.00 0.00 29.97 30.25 2c1x h ARG 157 CO 0.01 0.28 0.16 0.93 -1.07 0.00 0.00 179.97 180.28 2c1x h GLU 158 N 0.44 0.29 -0.00 0.04 5.08 -0.09 0.17 114.58 120.50 2c1x h GLU 158 Ca 0.13 -0.02 -0.20 0.00 -1.00 0.00 0.00 59.36 58.27 2c1x h GLU 158 Cb -0.03 -0.07 0.02 0.00 0.50 0.00 0.00 28.75 29.17 2c1x h GLU 158 CO -0.04 0.19 -0.79 0.87 -1.00 0.00 0.00 179.01 178.24 2c1x h LYS 159 N 0.30 0.54 0.03 2.33 6.56 -0.98 -3.37 116.57 121.98 2c1x h LYS 159 Ca 0.32 -0.58 -0.33 0.00 -1.06 0.00 0.00 60.65 59.01 2c1x h LYS 159 Cb 0.47 0.16 -0.05 0.00 -0.57 0.00 0.00 32.23 32.24 2c1x h LYS 159 CO -0.38 1.20 -1.93 -0.89 -2.06 0.00 0.00 179.45 175.38 2c1x n ILE 160 N -4.06 1.60 0.00 1.86 5.41 -0.27 -5.10 119.36 118.79 2c1x n ILE 160 Ca -0.11 -0.77 0.00 0.00 1.00 0.00 0.00 62.75 62.88 2c1x n ILE 160 Cb 0.76 -1.10 0.00 0.00 -0.71 0.00 0.00 39.64 38.59 2c1x n ILE 160 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2c1x n GLY 161 N 1.72 -0.43 0.53 7.39 0.00 0.59 -4.86 105.19 110.13 2c1x n GLY 161 Ca -0.24 -1.71 0.07 0.00 0.00 0.00 0.00 46.02 44.14 2c1x n GLY 161 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2c1x n VAL 162 N -0.36 1.75 -0.77 1.61 0.24 -1.26 -4.58 118.33 114.95 2c1x n VAL 162 Ca 0.00 -1.67 0.08 0.00 -2.04 0.00 0.00 64.34 60.72 2c1x n VAL 162 Cb 0.00 0.01 0.35 0.00 -1.47 0.00 0.00 33.84 32.73 2c1x n VAL 162 CO 0.00 0.00 0.00 -1.54 -2.14 0.00 0.00 176.83 173.15 2c1x n SER 163 N -0.50 4.93 0.00 -1.34 3.41 -1.26 -4.96 113.62 113.89 2c1x n SER 163 Ca 0.15 -2.70 0.00 0.00 -0.26 0.00 0.00 58.87 56.06 2c1x n SER 163 Cb 0.65 -0.60 0.00 0.00 -0.26 0.00 0.00 64.21 64.00 2c1x n SER 163 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2c1x n GLY 164 N 0.65 2.21 0.06 5.00 0.00 -1.26 -4.91 105.19 106.94 2c1x n GLY 164 Ca 0.25 -2.00 0.06 0.00 0.00 0.00 0.00 46.02 44.33 2c1x n GLY 164 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2c1x n ILE 165 N 0.77 1.50 -1.64 -0.61 -5.35 -1.26 -4.96 119.36 107.80 2c1x n ILE 165 Ca 0.00 -1.73 -0.49 0.00 -0.27 0.00 0.00 62.75 60.26 2c1x n ILE 165 Cb 0.00 0.06 -0.05 0.00 -1.74 0.00 0.00 39.64 37.91 2c1x n ILE 165 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2c1x n GLN 166 N -1.05 1.71 -0.90 6.28 3.00 -1.26 -0.30 117.38 124.87 2c1x n GLN 166 Ca 0.10 0.62 0.00 0.00 -0.01 0.00 0.00 57.00 57.71 2c1x n GLN 166 Cb 0.50 -2.34 0.00 0.00 0.00 0.00 0.00 30.24 28.40 2c1x n GLN 166 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2c1x n GLY 167 N 3.18 0.76 0.10 1.08 0.00 -1.26 -4.83 105.19 104.23 2c1x n GLY 167 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.21 2c1x n GLY 167 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2c1x n ARG 168 N -2.42 0.44 -0.13 1.61 1.74 0.59 -4.88 116.66 113.62 2c1x n ARG 168 Ca 0.00 -0.80 0.24 0.00 -0.77 0.00 0.00 57.85 56.52 2c1x n ARG 168 Cb 0.00 -0.60 0.68 0.00 -1.02 0.00 0.00 32.46 31.51 2c1x n ARG 168 CO 0.00 0.00 0.00 0.93 -1.52 0.00 0.00 177.63 177.04 2c1x h GLU 169 N 0.00 0.07 -0.54 5.56 3.07 -1.84 -1.47 114.58 119.44 2c1x h GLU 169 Ca 0.00 -0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 2c1x h GLU 169 Cb 1.01 -0.02 0.00 0.00 -0.84 0.00 0.00 28.75 28.90 2c1x h GLU 169 CO 0.00 0.05 0.00 -0.25 -1.40 0.00 0.00 179.01 177.41 2c1x n ASP 170 N -4.35 3.55 -4.76 1.42 8.00 -1.26 -1.39 116.55 117.77 2c1x n ASP 170 Ca 0.16 -1.98 -0.35 0.00 0.71 0.00 0.00 54.79 53.33 2c1x n ASP 170 Cb 0.79 -0.36 0.03 0.00 -0.02 0.00 0.00 41.12 41.57 2c1x n ASP 170 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 2c1x s GLU 171 N -1.12 2.97 -0.02 -1.24 2.02 -0.55 -4.80 118.70 115.96 2c1x s GLU 171 Ca 0.40 1.70 -0.06 0.00 0.02 0.00 0.00 54.97 57.02 2c1x s GLU 171 Cb 0.21 -1.94 -0.04 0.00 0.10 0.00 0.00 34.13 32.46 2c1x s GLU 171 CO 0.29 -1.17 0.23 -0.51 0.02 0.00 0.00 175.26 174.11 2c1x s LEU 172 N -4.21 4.38 -0.17 1.80 1.43 -1.26 -0.74 118.68 119.90 2c1x s LEU 172 Ca 0.74 0.52 -0.00 0.00 -1.03 0.00 0.00 54.13 54.36 2c1x s LEU 172 Cb -0.27 -2.53 0.13 0.00 0.03 0.00 0.00 46.19 43.55 2c1x s LEU 172 CO 0.34 0.29 1.88 -0.11 0.23 0.00 0.00 176.35 178.98 2c1x n LEU 173 N 1.31 5.67 0.00 1.79 0.00 0.15 -4.63 117.00 121.29 2c1x n LEU 173 Ca -0.13 -2.78 0.09 0.00 0.00 0.00 0.00 56.01 53.19 2c1x n LEU 173 Cb 0.53 -1.01 0.49 0.00 0.00 0.00 0.00 43.42 43.43 2c1x n LEU 173 CO 0.39 1.05 0.79 -0.46 0.00 0.00 0.00 177.39 179.17 2c1x n ASN 174 N 0.70 0.00 -0.01 1.96 0.23 -1.26 -1.91 115.26 114.98 2c1x n ASN 174 Ca 0.17 -0.03 0.14 0.00 -0.53 0.00 0.00 54.58 54.34 2c1x n ASN 174 Cb 0.59 -0.27 0.64 0.00 -2.08 0.00 0.00 39.78 38.66 2c1x n ASN 174 CO 0.00 0.00 0.00 2.22 -0.93 0.00 0.00 177.26 178.55 2c1x n PHE 175 N -1.27 0.00 -3.77 -2.53 1.16 -1.26 -4.72 117.46 105.07 2c1x n PHE 175 Ca 0.09 0.00 -0.36 0.00 -1.87 0.00 0.00 57.45 55.31 2c1x n PHE 175 Cb 0.15 -0.41 -0.11 0.00 -1.61 0.00 0.00 39.48 37.50 2c1x n PHE 175 CO 0.00 0.00 0.00 0.42 -1.87 0.00 0.00 176.76 175.31 2c1x s ILE 176 N -2.85 4.77 0.18 1.97 -1.09 -0.80 -5.07 121.20 118.31 2c1x s ILE 176 Ca 0.19 -0.02 -0.33 0.00 -2.23 0.00 0.00 60.65 58.26 2c1x s ILE 176 Cb 0.19 -3.22 -0.15 0.00 -1.58 0.00 0.00 42.46 37.71 2c1x s ILE 176 CO 0.52 0.35 1.35 -2.65 -1.23 0.00 0.00 174.94 173.28 2c1x n PRO 177 N 4.56 1.66 -0.87 2.79 -0.02 -1.26 -1.04 135.00 140.82 2c1x n PRO 177 Ca -0.16 0.59 0.00 0.00 -2.02 0.00 0.00 63.50 61.92 2c1x n PRO 177 Cb 0.52 -2.22 0.00 0.00 -0.02 0.00 0.00 33.50 31.78 2c1x n PRO 177 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2c1x n GLY 178 N 2.40 1.01 0.82 -1.23 0.00 -1.26 -4.78 105.19 102.15 2c1x n GLY 178 Ca 0.15 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.22 2c1x n GLY 178 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2c1x n MET 179 N -2.00 2.40 0.28 1.61 2.81 -0.21 -4.77 117.12 117.24 2c1x n MET 179 Ca 0.00 -2.89 0.12 0.00 -1.81 0.00 0.00 57.70 53.12 2c1x n MET 179 Cb 0.00 -1.78 0.78 0.00 -0.71 0.00 0.00 33.22 31.50 2c1x n MET 179 CO 0.00 0.00 0.00 0.66 1.51 0.00 0.00 175.97 178.14 2c1x h SER 180 N 1.33 0.00 0.24 7.83 4.64 -1.77 -1.41 113.55 124.41 2c1x h SER 180 Ca 0.05 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.37 2c1x h SER 180 Cb 1.42 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.51 2c1x h SER 180 CO 0.23 0.02 -0.51 0.29 -0.87 0.00 0.00 176.83 175.98 2c1x n LYS 181 N -4.12 0.45 -2.43 4.77 5.02 -1.26 -4.58 118.16 116.01 2c1x n LYS 181 Ca -0.03 -0.31 -0.42 0.00 -2.02 0.00 0.00 58.31 55.53 2c1x n LYS 181 Cb 0.10 -1.49 -0.03 0.00 -0.02 0.00 0.00 35.03 33.59 2c1x n LYS 181 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2c1x s VAL 182 N -2.76 4.17 0.13 -0.18 1.01 -0.53 -4.95 120.40 117.29 2c1x s VAL 182 Ca 0.16 1.51 -0.02 0.00 0.00 0.00 0.00 61.98 63.63 2c1x s VAL 182 Cb 0.18 -3.97 -0.05 0.00 0.00 0.00 0.00 36.38 32.54 2c1x s VAL 182 CO 0.65 0.01 0.33 -0.13 0.00 0.00 0.00 175.10 175.96 2c1x s ARG 183 N 2.08 3.54 0.27 2.72 0.52 -1.26 0.29 118.95 127.11 2c1x s ARG 183 Ca 0.57 -0.26 -0.03 0.00 -0.52 0.00 0.00 55.73 55.50 2c1x s ARG 183 Cb -0.26 -2.91 0.58 0.00 0.52 0.00 0.00 34.95 32.88 2c1x s ARG 183 CO 0.23 0.50 1.62 0.74 0.02 0.00 0.00 175.30 178.41 2c1x h PHE 184 N 2.72 0.04 0.00 -0.53 -1.00 -0.91 0.40 116.94 117.67 2c1x h PHE 184 Ca -0.46 0.06 -0.00 0.00 2.81 0.00 0.00 57.97 60.38 2c1x h PHE 184 Cb 1.17 0.12 -0.00 0.00 3.61 0.00 0.00 35.95 40.85 2c1x h PHE 184 CO 0.60 -0.28 -0.01 0.07 -1.61 0.00 0.00 178.31 177.08 2c1x h ARG 185 N 0.10 0.00 0.00 1.51 0.11 -1.52 -2.57 114.38 112.02 2c1x h ARG 185 Ca 0.49 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.57 2c1x h ARG 185 Cb 0.94 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.02 2c1x h ARG 185 CO -0.73 0.01 0.00 -0.44 0.10 0.00 0.00 179.97 178.91 2c1x h ASP 186 N 0.00 0.00 -4.05 0.08 3.32 -0.46 -3.47 116.42 111.84 2c1x h ASP 186 Ca -0.00 0.00 -0.54 0.00 0.02 0.00 0.00 57.03 56.51 2c1x h ASP 186 Cb 0.09 0.00 0.13 0.00 0.22 0.00 0.00 39.33 39.77 2c1x h ASP 186 CO 0.00 0.00 0.57 -0.76 -1.72 0.00 0.00 179.24 177.34 2c1x s LEU 187 N -5.23 3.84 0.66 1.55 1.43 -0.97 -3.45 118.68 116.51 2c1x s LEU 187 Ca 0.07 2.66 -0.17 0.00 -1.03 0.00 0.00 54.13 55.66 2c1x s LEU 187 Cb 0.09 -4.32 0.00 0.00 0.03 0.00 0.00 46.19 42.00 2c1x s LEU 187 CO 0.56 -1.51 1.23 -1.10 0.23 0.00 0.00 176.35 175.76 2c1x s GLN 188 N -2.94 2.52 0.39 1.70 1.11 -1.26 -4.96 119.66 116.22 2c1x s GLN 188 Ca 0.72 1.86 -0.27 0.00 0.01 0.00 0.00 55.36 57.67 2c1x s GLN 188 Cb -0.38 -1.87 -0.10 0.00 -1.01 0.00 0.00 33.01 29.65 2c1x s GLN 188 CO 0.44 -1.56 1.45 0.39 0.01 0.00 0.00 175.29 176.02 2c1x n GLU 189 N -2.14 2.49 0.00 2.91 4.71 -1.26 -3.07 120.64 124.28 2c1x n GLU 189 Ca 0.14 0.88 0.00 0.00 -0.01 0.00 0.00 57.16 58.17 2c1x n GLU 189 Cb 0.49 -2.62 0.00 0.00 -1.01 0.00 0.00 31.44 28.31 2c1x n GLU 189 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 2c1x n GLY 190 N 0.52 0.11 0.05 0.62 0.00 -0.17 -4.95 105.19 101.39 2c1x n GLY 190 Ca 0.03 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.01 2c1x n GLY 190 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2c1x n ILE 191 N -1.91 1.06 -0.58 -0.61 2.08 -1.18 -4.84 119.36 113.39 2c1x n ILE 191 Ca 0.00 0.29 0.00 0.00 0.56 0.00 0.00 62.75 63.60 2c1x n ILE 191 Cb 0.00 -2.17 0.00 0.00 -0.75 0.00 0.00 39.64 36.72 2c1x n ILE 191 CO 0.00 0.00 0.00 1.33 0.56 0.00 0.00 176.55 178.44 2c1x n VAL 192 N -4.02 0.00 -3.78 1.39 0.24 -1.26 -4.74 118.33 106.16 2c1x n VAL 192 Ca -0.05 -0.12 -0.10 0.00 -2.04 0.00 0.00 64.34 62.03 2c1x n VAL 192 Cb 0.20 1.58 -0.05 0.00 -1.47 0.00 0.00 33.84 34.09 2c1x n VAL 192 CO 0.00 0.00 0.00 0.72 -2.14 0.00 0.00 176.83 175.41 2c1x s PHE 193 N -0.06 0.03 0.00 6.34 -0.12 -1.26 -4.28 117.98 118.63 2c1x s PHE 193 Ca 0.00 -0.38 0.00 0.00 -0.05 0.00 0.00 56.93 56.50 2c1x s PHE 193 Cb 0.00 0.17 0.00 0.00 -0.63 0.00 0.00 43.02 42.56 2c1x s PHE 193 CO 0.00 -0.74 0.00 0.41 -0.05 0.00 0.00 175.22 174.84 2c1x n GLY 194 N -0.23 -2.22 3.56 1.99 0.00 -1.26 -0.99 105.19 106.04 2c1x n GLY 194 Ca -0.12 -1.97 -0.39 0.00 0.00 0.00 0.00 46.02 43.54 2c1x n GLY 194 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2c1x s ASN 195 N -3.25 6.23 0.11 1.61 3.84 -1.26 -4.81 114.94 117.41 2c1x s ASN 195 Ca 0.00 -1.14 0.18 0.00 0.21 0.00 0.00 52.86 52.10 2c1x s ASN 195 Cb 0.00 -2.57 0.76 0.00 -0.55 0.00 0.00 41.25 38.89 2c1x s ASN 195 CO 0.00 -1.75 1.55 0.18 -2.79 0.00 0.00 177.10 174.29 2c1x n LEU 196 N 9.76 0.28 -0.41 3.21 4.32 -1.26 -2.43 117.00 130.48 2c1x n LEU 196 Ca 0.29 0.57 0.10 0.00 -0.02 0.00 0.00 56.01 56.95 2c1x n LEU 196 Cb 0.50 -0.54 -0.01 0.00 -1.62 0.00 0.00 43.42 41.75 2c1x n LEU 196 CO 0.66 -0.40 0.26 -3.20 -1.22 0.00 0.00 177.39 173.49 2c1x n ASN 197 N -1.81 1.78 -4.65 -1.43 5.15 -1.26 -4.54 115.26 108.49 2c1x n ASN 197 Ca 0.03 -1.39 -0.30 0.00 -0.60 0.00 0.00 54.58 52.31 2c1x n ASN 197 Cb 0.18 0.51 0.17 0.00 -0.53 0.00 0.00 39.78 40.12 2c1x n ASN 197 CO 0.00 0.00 0.00 -0.94 1.40 0.00 0.00 177.26 177.72 2c1x s SER 198 N -2.26 2.73 0.15 1.20 1.04 -1.02 -4.79 113.70 110.76 2c1x s SER 198 Ca 0.15 1.99 -0.16 0.00 0.48 0.00 0.00 55.95 58.41 2c1x s SER 198 Cb 0.16 -2.49 0.02 0.00 0.10 0.00 0.00 66.02 63.80 2c1x s SER 198 CO 0.52 -3.19 1.79 0.25 0.98 0.00 0.00 173.24 173.59 2c1x h LEU 199 N -1.93 0.36 -0.57 2.42 5.85 -1.95 -2.04 115.31 117.45 2c1x h LEU 199 Ca -0.47 0.00 0.02 0.00 0.84 0.00 0.00 57.88 58.27 2c1x h LEU 199 Cb 1.28 -0.07 -0.04 0.00 0.37 0.00 0.00 40.66 42.20 2c1x h LEU 199 CO 0.45 0.26 0.35 0.15 -0.34 0.00 0.00 178.44 179.31 2c1x h PHE 200 N 0.45 0.66 -0.26 1.25 3.57 -1.94 -2.02 116.94 118.65 2c1x h PHE 200 Ca 0.15 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.66 2c1x h PHE 200 Cb 0.00 -0.22 -0.01 0.00 2.79 0.00 0.00 35.95 38.51 2c1x h PHE 200 CO -0.07 0.39 0.12 0.77 -2.23 0.00 0.00 178.31 177.29 2c1x h SER 201 N 0.70 0.34 -0.23 0.41 0.02 -1.78 -1.59 113.55 111.44 2c1x h SER 201 Ca 0.22 -0.13 -0.08 0.00 -0.84 0.00 0.00 61.79 60.97 2c1x h SER 201 Cb -0.00 -0.09 -0.02 0.00 0.14 0.00 0.00 62.40 62.43 2c1x h SER 201 CO -0.09 0.37 -0.10 0.03 -1.14 0.00 0.00 176.83 175.91 2c1x h ARG 202 N 0.29 0.61 -0.18 3.45 3.08 -1.24 -0.19 114.38 120.20 2c1x h ARG 202 Ca 0.09 -0.18 -0.14 0.00 0.07 0.00 0.00 59.98 59.83 2c1x h ARG 202 Cb 0.12 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.11 2c1x h ARG 202 CO -0.01 0.70 -0.42 0.52 -1.07 0.00 0.00 179.97 179.68 2c1x h MET 203 N 0.56 0.61 -0.93 0.04 2.86 -1.22 -1.71 114.93 115.14 2c1x h MET 203 Ca 0.10 -0.41 0.02 0.00 -2.06 0.00 0.00 59.70 57.36 2c1x h MET 203 Cb 0.50 0.06 -0.05 0.00 0.06 0.00 0.00 31.60 32.17 2c1x h MET 203 CO 0.03 1.03 0.61 -0.07 1.06 0.00 0.00 176.91 179.56 2c1x h LEU 204 N 0.27 1.03 0.14 1.22 4.07 -1.21 0.59 115.31 121.41 2c1x h LEU 204 Ca -0.00 -0.02 -0.00 0.00 0.08 0.00 0.00 57.88 57.94 2c1x h LEU 204 Cb 1.03 -0.24 -0.01 0.00 1.08 0.00 0.00 40.66 42.52 2c1x h LEU 204 CO 0.09 0.72 -0.10 -0.74 -1.08 0.00 0.00 178.44 177.33 2c1x h HIS 205 N 1.20 -0.27 -0.75 1.13 2.76 -0.82 -1.95 115.15 116.45 2c1x h HIS 205 Ca 0.36 -0.00 0.01 0.00 -2.20 0.00 0.00 60.37 58.53 2c1x h HIS 205 Cb -0.06 0.10 -0.04 0.00 1.55 0.00 0.00 27.41 28.97 2c1x h HIS 205 CO -0.01 -0.16 0.49 -0.09 -1.30 0.00 0.00 177.93 176.86 2c1x h ARG 206 N -0.25 0.99 -0.30 5.26 2.43 -1.07 -2.75 114.38 118.69 2c1x h ARG 206 Ca -0.01 -0.06 0.07 0.00 -0.81 0.00 0.00 59.98 59.17 2c1x h ARG 206 Cb 0.22 -0.22 -0.07 0.00 -0.42 0.00 0.00 29.97 29.48 2c1x h ARG 206 CO -0.00 0.66 -0.21 1.98 -1.51 0.00 0.00 179.97 180.88 2c1x h MET 207 N 1.01 -0.18 -0.88 0.20 4.05 -0.66 -0.60 114.93 117.88 2c1x h MET 207 Ca 0.27 0.01 0.13 0.00 -0.28 0.00 0.00 59.70 59.84 2c1x h MET 207 Cb -0.11 0.04 -0.07 0.00 -0.80 0.00 0.00 31.60 30.66 2c1x h MET 207 CO -0.06 -0.12 0.57 0.78 0.23 0.00 0.00 176.91 178.31 2c1x h GLY 208 N -0.18 1.21 1.84 1.39 0.00 -1.08 0.23 103.07 106.48 2c1x h GLY 208 Ca 0.16 -0.31 -0.16 0.00 0.00 0.00 0.00 47.33 47.02 2c1x h GLY 208 CO -0.41 0.12 -0.69 1.46 0.00 0.00 0.00 176.54 177.02 2c1x h GLN 209 N 0.73 0.15 0.00 4.80 4.20 -1.04 -3.34 115.11 120.62 2c1x h GLN 209 Ca 0.43 -0.12 -0.15 0.00 0.06 0.00 0.00 58.65 58.87 2c1x h GLN 209 Cb 0.63 0.03 -0.03 0.00 0.30 0.00 0.00 27.48 28.41 2c1x h GLN 209 CO -0.19 0.78 -1.65 0.28 -0.67 0.00 0.00 178.83 177.37 2c1x n VAL 210 N -3.78 0.94 -0.33 -0.54 0.31 -0.33 -4.26 118.33 110.35 2c1x n VAL 210 Ca -0.02 -0.67 0.16 0.00 -0.01 0.00 0.00 64.34 63.80 2c1x n VAL 210 Cb 0.68 -0.51 0.35 0.00 -0.91 0.00 0.00 33.84 33.45 2c1x n VAL 210 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 2c1x h LEU 211 N 0.00 0.50 -1.67 7.52 3.38 -1.11 0.56 115.31 124.49 2c1x h LEU 211 Ca -0.18 0.15 0.00 0.00 0.09 0.00 0.00 57.88 57.93 2c1x h LEU 211 Cb 1.53 0.09 0.00 0.00 0.09 0.00 0.00 40.66 42.36 2c1x h LEU 211 CO 0.03 0.04 0.09 -0.65 0.09 0.00 0.00 178.44 178.04 2c1x h PRO 212 N 0.48 0.00 -0.00 1.13 0.11 -1.78 -1.80 132.00 130.13 2c1x h PRO 212 Ca 0.61 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.72 2c1x h PRO 212 Cb 1.17 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.28 2c1x h PRO 212 CO -0.51 0.00 -0.37 1.63 -0.21 0.00 0.00 178.00 178.54 2c1x n LYS 213 N -2.43 0.45 -1.72 1.05 5.02 0.20 -3.91 118.16 116.82 2c1x n LYS 213 Ca -0.02 -0.26 -0.39 0.00 -2.02 0.00 0.00 58.31 55.62 2c1x n LYS 213 Cb 0.13 -1.49 0.04 0.00 -0.02 0.00 0.00 35.03 33.69 2c1x n LYS 213 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2c1x n ALA 214 N -1.04 1.29 -0.24 7.82 0.00 -0.68 -4.92 120.51 122.74 2c1x n ALA 214 Ca 0.09 0.12 0.03 0.00 0.00 0.00 0.00 53.44 53.69 2c1x n ALA 214 Cb 0.34 -2.30 0.16 0.00 0.00 0.00 0.00 19.45 17.65 2c1x n ALA 214 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 2c1x h THR 215 N 1.34 0.65 -1.93 0.00 2.02 -1.77 -3.40 112.91 109.82 2c1x h THR 215 Ca -0.50 -0.13 -0.03 0.00 0.77 0.00 0.00 66.41 66.52 2c1x h THR 215 Cb 1.31 0.24 -0.21 0.00 -1.74 0.00 0.00 68.15 67.75 2c1x h THR 215 CO 0.56 0.07 0.20 0.00 0.37 0.00 0.00 175.52 176.73 2c1x s ALA 216 N -6.05 -1.81 -0.19 6.16 0.00 -1.24 -3.82 121.76 114.81 2c1x s ALA 216 Ca -0.13 1.78 -0.06 0.00 0.00 0.00 0.00 51.96 53.56 2c1x s ALA 216 Cb 0.20 -0.84 -0.03 0.00 0.00 0.00 0.00 23.12 22.44 2c1x s ALA 216 CO 0.75 -0.34 0.03 0.08 0.00 0.00 0.00 175.76 176.29 2c1x s VAL 217 N -0.17 4.34 0.24 0.00 1.01 0.14 -3.32 120.40 122.63 2c1x s VAL 217 Ca -0.03 -0.19 0.10 0.00 0.00 0.00 0.00 61.98 61.87 2c1x s VAL 217 Cb -0.03 -2.96 -0.04 0.00 0.00 0.00 0.00 36.38 33.34 2c1x s VAL 217 CO 0.03 0.44 -0.09 0.72 0.00 0.00 0.00 175.10 176.19 2c1x s PHE 218 N 0.70 2.55 -0.08 5.22 -0.12 -0.54 -1.10 117.98 124.61 2c1x s PHE 218 Ca 0.01 -0.26 -0.15 0.00 -0.05 0.00 0.00 56.93 56.49 2c1x s PHE 218 Cb -0.14 -1.17 0.03 0.00 -0.63 0.00 0.00 43.02 41.12 2c1x s PHE 218 CO 0.02 0.60 0.36 -1.50 -0.05 0.00 0.00 175.22 174.65 2c1x s ILE 219 N -2.14 0.02 -1.34 -4.49 2.07 -0.68 -0.86 121.20 113.80 2c1x s ILE 219 Ca 0.28 -0.20 -0.15 0.00 -1.41 0.00 0.00 60.65 59.18 2c1x s ILE 219 Cb -0.07 -0.58 0.09 0.00 0.13 0.00 0.00 42.46 42.03 2c1x s ILE 219 CO 0.17 -0.11 1.88 -3.20 -1.91 0.00 0.00 174.94 171.77 2c1x n ASN 220 N 2.12 4.65 -2.88 4.50 5.15 -1.25 -0.96 115.26 126.59 2c1x n ASN 220 Ca -0.17 -2.93 -0.10 0.00 -0.60 0.00 0.00 54.58 50.78 2c1x n ASN 220 Cb 0.57 -1.65 0.02 0.00 -0.53 0.00 0.00 39.78 38.18 2c1x n ASN 220 CO 0.00 0.00 0.00 -0.55 1.40 0.00 0.00 177.26 178.11 2c1x s SER 221 N 3.13 0.25 -0.01 1.20 0.15 -1.26 -4.74 113.70 112.43 2c1x s SER 221 Ca 0.48 -1.28 0.07 0.00 0.70 0.00 0.00 55.95 55.91 2c1x s SER 221 Cb 0.07 0.83 -0.02 0.00 -1.71 0.00 0.00 66.02 65.19 2c1x s SER 221 CO -0.00 -1.65 -0.21 0.72 1.20 0.00 0.00 173.24 173.30 2c1x s PHE 222 N -2.28 1.85 0.32 3.44 -0.12 -1.25 -0.37 117.98 119.56 2c1x s PHE 222 Ca 0.19 -0.35 0.08 0.00 -0.05 0.00 0.00 56.93 56.80 2c1x s PHE 222 Cb -0.04 -1.18 0.83 0.00 -0.63 0.00 0.00 43.02 42.00 2c1x s PHE 222 CO 0.14 -0.01 1.76 0.93 -0.05 0.00 0.00 175.22 177.99 2c1x h GLU 223 N 5.50 0.65 0.00 1.99 5.08 -1.89 -1.52 114.58 124.39 2c1x h GLU 223 Ca -0.40 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 57.92 2c1x h GLU 223 Cb 1.14 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 30.25 2c1x h GLU 223 CO 0.47 0.43 0.00 0.39 -1.00 0.00 0.00 179.01 179.30 2c1x n GLU 224 N -4.78 0.73 -0.33 2.33 4.71 -1.26 -2.77 120.64 119.27 2c1x n GLU 224 Ca 0.25 0.00 0.05 0.00 -0.01 0.00 0.00 57.16 57.45 2c1x n GLU 224 Cb 0.66 -1.50 0.21 0.00 -1.01 0.00 0.00 31.44 29.79 2c1x n GLU 224 CO 0.00 0.00 0.00 1.25 0.09 0.00 0.00 177.13 178.47 2c1x h LEU 225 N 0.00 0.81 -6.04 -4.62 5.85 -1.70 -3.39 115.31 106.22 2c1x h LEU 225 Ca 0.00 0.05 0.01 0.00 0.84 0.00 0.00 57.88 58.78 2c1x h LEU 225 Cb 0.11 -0.11 -0.22 0.00 0.37 0.00 0.00 40.66 40.81 2c1x h LEU 225 CO 0.00 0.44 -0.39 -0.62 -0.34 0.00 0.00 178.44 177.53 2c1x s ASP 226 N -5.65 -1.36 0.33 1.25 -1.08 -1.11 -5.05 116.67 104.00 2c1x s ASP 226 Ca -0.12 0.20 0.01 0.00 -0.52 0.00 0.00 52.55 52.11 2c1x s ASP 226 Cb 0.21 1.94 0.57 0.00 -1.46 0.00 0.00 42.92 44.18 2c1x s ASP 226 CO 0.80 -0.30 2.00 0.44 0.52 0.00 0.00 175.17 178.62 2c1x h ASP 227 N 8.02 0.79 -0.36 -0.34 3.32 -1.77 -0.95 116.42 125.14 2c1x h ASP 227 Ca -0.04 -0.02 -0.10 0.00 0.02 0.00 0.00 57.03 56.89 2c1x h ASP 227 Cb 1.18 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 40.52 2c1x h ASP 227 CO 0.18 0.58 -0.15 0.28 -1.72 0.00 0.00 179.24 178.41 2c1x h SER 228 N 0.93 0.75 -0.21 6.45 0.02 -1.97 0.27 113.55 119.80 2c1x h SER 228 Ca 0.25 -0.40 -0.00 0.00 -0.84 0.00 0.00 61.79 60.80 2c1x h SER 228 Cb -0.10 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 62.22 2c1x h SER 228 CO -0.05 0.98 0.12 0.25 -1.14 0.00 0.00 176.83 176.98 2c1x h LEU 229 N 0.52 0.25 -0.28 5.07 5.85 -1.79 0.78 115.31 125.70 2c1x h LEU 229 Ca 0.08 -0.07 0.07 0.00 0.84 0.00 0.00 57.88 58.80 2c1x h LEU 229 Cb 0.68 -0.06 -0.07 0.00 0.37 0.00 0.00 40.66 41.58 2c1x h LEU 229 CO 0.05 0.24 -0.18 0.74 -0.34 0.00 0.00 178.44 178.95 2c1x h THR 230 N 0.24 0.49 -0.82 1.05 2.02 -1.07 0.01 112.91 114.83 2c1x h THR 230 Ca 0.07 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.23 2c1x h THR 230 Cb 0.04 0.49 -0.04 0.00 -1.74 0.00 0.00 68.15 66.90 2c1x h THR 230 CO -0.01 0.00 0.43 0.78 0.37 0.00 0.00 175.52 177.09 2c1x h ASN 231 N -0.16 1.04 -0.42 4.18 2.35 -0.61 -0.67 115.58 121.30 2c1x h ASN 231 Ca 0.15 -0.11 -0.03 0.00 -0.55 0.00 0.00 56.30 55.76 2c1x h ASN 231 Cb 0.39 -0.26 -0.02 0.00 0.05 0.00 0.00 38.32 38.47 2c1x h ASN 231 CO -0.38 0.85 0.14 -0.78 -1.65 0.00 0.00 177.43 175.61 2c1x h ASP 232 N 1.14 0.61 -0.30 5.81 3.58 -0.49 -2.13 116.42 124.64 2c1x h ASP 232 Ca 0.29 -0.20 -0.08 0.00 0.42 0.00 0.00 57.03 57.46 2c1x h ASP 232 Cb 0.06 -0.16 -0.02 0.00 1.72 0.00 0.00 39.33 40.93 2c1x h ASP 232 CO -0.04 0.64 -0.08 -0.07 -2.88 0.00 0.00 179.24 176.81 2c1x h LEU 233 N 0.54 0.69 -2.23 2.28 3.38 -0.68 -1.12 115.31 118.17 2c1x h LEU 233 Ca 0.14 -0.19 -0.01 0.00 0.09 0.00 0.00 57.88 57.91 2c1x h LEU 233 Cb 0.25 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 40.81 2c1x h LEU 233 CO -0.01 0.81 -0.06 0.11 0.09 0.00 0.00 178.44 179.39 2c1x h LYS 234 N 0.65 0.00 0.00 1.13 1.57 -0.83 -0.91 116.57 118.19 2c1x h LYS 234 Ca 0.12 0.00 -0.08 0.00 -1.87 0.00 0.00 60.65 58.82 2c1x h LYS 234 Cb 0.53 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.82 2c1x h LYS 234 CO 0.03 0.06 -0.46 0.66 -0.57 0.00 0.00 179.45 179.17 2c1x h SER 235 N 0.00 0.00 0.38 0.86 4.64 -0.55 -3.33 113.55 115.55 2c1x h SER 235 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2c1x h SER 235 Cb 0.20 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.29 2c1x h SER 235 CO 0.01 0.36 -1.59 0.29 -0.87 0.00 0.00 176.83 175.03 2c1x n LYS 236 N -3.15 0.62 -4.40 4.77 4.76 -0.71 -4.97 118.16 115.08 2c1x n LYS 236 Ca 0.02 -0.07 -0.27 0.00 -2.87 0.00 0.00 58.31 55.11 2c1x n LYS 236 Cb 0.68 -1.64 -0.12 0.00 -1.84 0.00 0.00 35.03 32.11 2c1x n LYS 236 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 2c1x s LEU 237 N -4.80 2.37 0.06 -0.35 1.43 -0.43 -4.50 118.68 112.46 2c1x s LEU 237 Ca -0.05 -0.80 -0.24 0.00 -1.03 0.00 0.00 54.13 52.01 2c1x s LEU 237 Cb 0.12 -1.16 -0.16 0.00 0.03 0.00 0.00 46.19 45.02 2c1x s LEU 237 CO 0.86 0.14 1.62 0.11 0.23 0.00 0.00 176.35 179.31 2c1x h LYS 238 N 3.58 -0.08 -3.25 1.70 1.57 -1.77 -3.43 116.57 114.88 2c1x h LYS 238 Ca -0.48 0.01 -0.23 0.00 -1.87 0.00 0.00 60.65 58.07 2c1x h LYS 238 Cb 1.19 0.02 -0.31 0.00 0.08 0.00 0.00 32.23 33.21 2c1x h LYS 238 CO 0.43 0.05 -0.58 0.99 -0.57 0.00 0.00 179.45 179.78 2c1x s THR 239 N -5.73 -0.04 -0.12 -0.16 2.01 -1.25 -5.03 115.64 105.32 2c1x s THR 239 Ca -0.14 0.15 -0.01 0.00 0.31 0.00 0.00 61.69 62.00 2c1x s THR 239 Cb 0.05 -0.25 0.03 0.00 0.01 0.00 0.00 72.50 72.33 2c1x s THR 239 CO 0.65 0.06 -0.06 -0.47 -0.69 0.00 0.00 174.62 174.12 2c1x s TYR 240 N 1.02 1.40 -0.33 4.92 5.04 -1.26 -0.68 117.35 127.45 2c1x s TYR 240 Ca -0.08 -0.73 0.02 0.00 -2.44 0.00 0.00 57.07 53.85 2c1x s TYR 240 Cb -0.10 -1.18 0.10 0.00 0.35 0.00 0.00 41.96 41.13 2c1x s TYR 240 CO -0.05 -0.51 0.06 -0.51 -1.34 0.00 0.00 175.55 173.20 2c1x s LEU 241 N 1.74 3.89 -0.10 6.97 1.43 -0.26 -4.97 118.68 127.37 2c1x s LEU 241 Ca 0.04 -1.97 -0.30 0.00 -1.03 0.00 0.00 54.13 50.87 2c1x s LEU 241 Cb -0.13 -1.37 -0.02 0.00 0.03 0.00 0.00 46.19 44.70 2c1x s LEU 241 CO -0.08 -0.39 1.19 0.20 0.23 0.00 0.00 176.35 177.50 2c1x s ASN 242 N 1.15 7.05 -0.08 2.29 0.01 -1.26 -1.68 114.94 122.41 2c1x s ASN 242 Ca 0.10 1.73 0.12 0.00 -0.71 0.00 0.00 52.86 54.10 2c1x s ASN 242 Cb -0.18 -2.55 0.20 0.00 0.41 0.00 0.00 41.25 39.12 2c1x s ASN 242 CO -0.14 -0.62 1.10 2.30 -1.51 0.00 0.00 177.10 178.23 2c1x n ILE 243 N 4.83 1.12 -3.42 0.60 -5.35 -0.14 -4.24 119.36 112.76 2c1x n ILE 243 Ca 0.11 -1.43 0.00 0.00 -0.27 0.00 0.00 62.75 61.17 2c1x n ILE 243 Cb 0.46 0.09 0.00 0.00 -1.74 0.00 0.00 39.64 38.45 2c1x n ILE 243 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2c1x n GLY 244 N -0.80 5.84 3.72 3.28 0.00 0.50 -4.57 105.19 113.16 2c1x n GLY 244 Ca 0.10 -1.94 -0.42 0.00 0.00 0.00 0.00 46.02 43.76 2c1x n GLY 244 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2c1x s PRO 245 N -0.27 4.32 0.32 1.61 0.02 -1.26 -3.77 135.00 135.96 2c1x s PRO 245 Ca 0.00 2.11 0.06 0.00 0.02 0.00 0.00 61.00 63.19 2c1x s PRO 245 Cb 0.00 -3.22 0.73 0.00 0.02 0.00 0.00 34.50 32.03 2c1x s PRO 245 CO 0.00 -0.41 1.82 0.74 -0.33 0.00 0.00 177.00 178.82 2c1x h PHE 246 N 6.37 1.00 0.00 6.54 0.04 -1.87 -2.31 116.94 126.71 2c1x h PHE 246 Ca -0.43 0.03 0.00 0.00 2.80 0.00 0.00 57.97 60.37 2c1x h PHE 246 Cb 1.21 -0.31 0.00 0.00 2.20 0.00 0.00 35.95 39.05 2c1x h PHE 246 CO 0.65 0.31 0.00 0.27 -0.60 0.00 0.00 178.31 178.94 2c1x n ASN 247 N -4.65 0.60 0.01 2.17 2.04 -1.26 -1.19 115.26 112.98 2c1x n ASN 247 Ca 0.20 0.59 0.12 0.00 -0.44 0.00 0.00 54.58 55.05 2c1x n ASN 247 Cb 0.49 -0.74 0.24 0.00 -2.53 0.00 0.00 39.78 37.24 2c1x n ASN 247 CO 0.00 0.00 0.00 0.18 -0.44 0.00 0.00 177.26 177.00 2c1x n LEU 248 N -2.10 0.52 -0.02 -4.53 4.77 -0.87 -3.94 117.00 110.83 2c1x n LEU 248 Ca 0.04 0.06 -0.19 0.00 -0.03 0.00 0.00 56.01 55.90 2c1x n LEU 248 Cb 0.33 -0.24 -0.14 0.00 -2.33 0.00 0.00 43.42 41.05 2c1x n LEU 248 CO 0.25 0.08 -0.87 -0.38 -1.33 0.00 0.00 177.39 175.14 2c1x n ILE 249 N -1.64 1.71 -2.80 -0.08 5.41 -0.53 -5.05 119.36 116.37 2c1x n ILE 249 Ca 0.05 -0.67 0.00 0.00 1.00 0.00 0.00 62.75 63.13 2c1x n ILE 249 Cb 0.36 -1.57 0.00 0.00 -0.71 0.00 0.00 39.64 37.72 2c1x n ILE 249 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 176.55 176.96 2c1x n THR 250 N -3.38 0.00 0.00 1.39 -1.04 -0.33 -5.13 114.28 105.79 2c1x n THR 250 Ca -0.32 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.69 2c1x n THR 250 Cb 1.04 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.55 2c1x n THR 250 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2c1x n GLY 260 N 3.60 0.00 0.11 3.41 0.00 -1.26 -4.62 105.19 106.42 2c1x n GLY 260 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.92 2c1x n GLY 260 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2c1x h LEU 262 N 0.25 0.53 -0.36 0.00 3.38 -1.97 -0.99 115.31 116.14 2c1x h LEU 262 Ca 0.08 -0.16 -0.08 0.00 0.09 0.00 0.00 57.88 57.80 2c1x h LEU 262 Cb -0.01 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.58 2c1x h LEU 262 CO -0.03 0.73 -0.08 1.56 0.09 0.00 0.00 178.44 180.71 2c1x h GLN 263 N 0.48 0.68 -0.38 1.13 7.50 -1.97 -1.71 115.11 120.83 2c1x h GLN 263 Ca 0.08 -0.26 -0.01 0.00 0.50 0.00 0.00 58.65 58.96 2c1x h GLN 263 Cb 0.61 -0.04 -0.02 0.00 0.05 0.00 0.00 27.48 28.08 2c1x h GLN 263 CO 0.04 0.84 0.22 2.35 -1.50 0.00 0.00 178.83 180.78 2c1x h TRP 264 N 0.48 0.52 -0.24 2.96 7.01 -1.19 -3.02 115.95 122.46 2c1x h TRP 264 Ca 0.09 -0.01 -0.03 0.00 2.11 0.00 0.00 58.89 61.05 2c1x h TRP 264 Cb 0.59 -0.17 -0.01 0.00 -2.10 0.00 0.00 29.16 27.47 2c1x h TRP 264 CO 0.05 0.39 0.00 -0.07 -2.79 0.00 0.00 178.44 176.02 2c1x h LEU 265 N 0.50 0.32 -1.18 0.65 4.07 -1.02 -2.76 115.31 115.88 2c1x h LEU 265 Ca 0.14 -0.05 0.31 0.00 0.08 0.00 0.00 57.88 58.37 2c1x h LEU 265 Cb 0.04 -0.08 -0.13 0.00 1.08 0.00 0.00 40.66 41.57 2c1x h LEU 265 CO -0.02 0.38 0.66 0.50 -1.08 0.00 0.00 178.44 178.87 2c1x h LYS 266 N 0.34 0.33 -0.07 1.13 3.64 -1.18 -1.47 116.57 119.30 2c1x h LYS 266 Ca 0.08 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.44 2c1x h LYS 266 Cb 0.23 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 31.97 2c1x h LYS 266 CO 0.00 0.22 0.00 0.39 -2.27 0.00 0.00 179.45 177.79 2c1x n GLU 267 N -4.83 1.65 -3.92 1.90 -0.58 -1.04 -4.94 120.64 108.88 2c1x n GLU 267 Ca 0.30 -0.96 -0.26 0.00 -0.42 0.00 0.00 57.16 55.82 2c1x n GLU 267 Cb 1.00 -1.45 -0.03 0.00 -0.57 0.00 0.00 31.44 30.39 2c1x n GLU 267 CO 0.00 0.00 0.00 1.03 -0.48 0.00 0.00 177.13 177.68 2c1x s ARG 268 N -1.92 3.45 0.65 3.49 3.00 -0.55 -5.08 118.95 121.98 2c1x s ARG 268 Ca 0.36 -0.58 -0.16 0.00 0.00 0.00 0.00 55.73 55.35 2c1x s ARG 268 Cb 0.20 -2.96 -0.01 0.00 0.00 0.00 0.00 34.95 32.19 2c1x s ARG 268 CO 0.31 0.51 1.16 0.15 0.00 0.00 0.00 175.30 177.43 2c1x s LYS 269 N -3.25 2.74 0.33 3.54 -0.14 -1.26 -4.77 119.74 116.93 2c1x s LYS 269 Ca 0.35 1.61 -0.28 0.00 -1.36 0.00 0.00 55.97 56.28 2c1x s LYS 269 Cb -0.11 -1.92 -0.12 0.00 -1.68 0.00 0.00 37.83 33.99 2c1x s LYS 269 CO 0.29 -1.34 1.32 -2.30 -0.76 0.00 0.00 175.35 172.56 2c1x n PRO 270 N -2.17 2.17 -2.83 -1.68 -0.02 -1.26 -3.13 135.00 126.08 2c1x n PRO 270 Ca 0.12 0.76 -0.21 0.00 -2.02 0.00 0.00 63.50 62.15 2c1x n PRO 270 Cb 0.51 -2.37 0.01 0.00 -0.02 0.00 0.00 33.50 31.63 2c1x n PRO 270 CO 0.00 0.00 0.00 2.41 1.98 0.00 0.00 175.50 179.89 2c1x n THR 271 N 0.54 -1.41 0.12 3.45 -1.04 0.28 -4.84 114.28 111.38 2c1x n THR 271 Ca 0.05 0.00 0.03 0.00 -2.04 0.00 0.00 64.05 62.09 2c1x n THR 271 Cb 0.36 -2.88 -0.05 0.00 -1.82 0.00 0.00 70.33 65.94 2c1x n THR 271 CO 0.00 0.00 0.00 -1.54 -0.64 0.00 0.00 175.07 172.89 2c1x n SER 272 N -2.26 2.20 -4.82 8.00 3.41 0.03 -4.26 113.62 115.92 2c1x n SER 272 Ca -0.14 -0.26 -0.36 0.00 -0.26 0.00 0.00 58.87 57.85 2c1x n SER 272 Cb 0.63 1.18 -0.07 0.00 -0.26 0.00 0.00 64.21 65.69 2c1x n SER 272 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 2c1x s VAL 273 N -2.12 5.46 -0.24 -3.33 1.01 0.19 -4.26 120.40 117.11 2c1x s VAL 273 Ca -0.00 0.23 -0.13 0.00 0.00 0.00 0.00 61.98 62.08 2c1x s VAL 273 Cb 0.04 -3.44 -0.05 0.00 0.00 0.00 0.00 36.38 32.94 2c1x s VAL 273 CO 0.27 0.55 0.26 -0.69 0.00 0.00 0.00 175.10 175.49 2c1x s VAL 274 N -0.48 5.28 -0.16 2.92 1.01 -0.20 0.27 120.40 129.04 2c1x s VAL 274 Ca 0.13 0.38 -0.08 0.00 0.00 0.00 0.00 61.98 62.40 2c1x s VAL 274 Cb -0.12 -3.59 -0.04 0.00 0.00 0.00 0.00 36.38 32.62 2c1x s VAL 274 CO 0.02 0.28 0.12 -0.47 0.00 0.00 0.00 175.10 175.06 2c1x s TYR 275 N 1.34 3.45 -0.12 5.22 5.04 0.12 -1.47 117.35 130.93 2c1x s TYR 275 Ca 0.12 0.37 0.02 0.00 -2.44 0.00 0.00 57.07 55.14 2c1x s TYR 275 Cb -0.14 -2.06 0.01 0.00 0.35 0.00 0.00 41.96 40.12 2c1x s TYR 275 CO 0.07 0.44 -0.18 0.42 -1.34 0.00 0.00 175.55 174.96 2c1x s ILE 276 N -0.19 1.73 -0.05 3.14 1.09 0.23 -0.68 121.20 126.47 2c1x s ILE 276 Ca 0.10 -0.79 -0.26 0.00 -1.10 0.00 0.00 60.65 58.61 2c1x s ILE 276 Cb -0.12 -1.55 0.06 0.00 -1.06 0.00 0.00 42.46 39.79 2c1x s ILE 276 CO 0.01 0.49 0.57 -0.55 -0.10 0.00 0.00 174.94 175.35 2c1x s SER 277 N 0.85 -0.53 -0.26 3.58 0.15 -0.51 -0.53 113.70 116.46 2c1x s SER 277 Ca -0.08 0.58 0.09 0.00 0.70 0.00 0.00 55.95 57.25 2c1x s SER 277 Cb -0.15 0.54 0.46 0.00 -1.71 0.00 0.00 66.02 65.15 2c1x s SER 277 CO -0.01 -0.53 1.32 0.49 1.20 0.00 0.00 173.24 175.71 2c1x n PHE 278 N 1.17 0.81 -4.25 3.44 3.72 -1.26 -3.51 117.46 117.58 2c1x n PHE 278 Ca -0.19 -1.67 0.00 0.00 -0.05 0.00 0.00 57.45 55.54 2c1x n PHE 278 Cb 0.57 -0.37 0.00 0.00 -0.94 0.00 0.00 39.48 38.73 2c1x n PHE 278 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2c1x n GLY 279 N -1.07 -0.31 0.06 1.37 0.00 -1.26 -3.81 105.19 100.17 2c1x n GLY 279 Ca 0.28 -1.05 0.11 0.00 0.00 0.00 0.00 46.02 45.37 2c1x n GLY 279 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2c1x n THR 280 N 0.00 0.31 -0.91 2.61 -2.24 -1.26 -4.53 114.28 108.27 2c1x n THR 280 Ca 0.00 -0.35 0.00 0.00 -2.27 0.00 0.00 64.05 61.43 2c1x n THR 280 Cb 0.00 -0.02 0.00 0.00 -2.10 0.00 0.00 70.33 68.21 2c1x n THR 280 CO 0.00 0.00 0.00 1.33 -0.57 0.00 0.00 175.07 175.83 2c1x n VAL 281 N -2.20 0.09 -4.69 2.28 0.24 -1.26 -5.00 118.33 107.78 2c1x n VAL 281 Ca 0.01 -0.09 -0.24 0.00 -2.04 0.00 0.00 64.34 61.98 2c1x n VAL 281 Cb 0.48 1.04 -0.16 0.00 -1.47 0.00 0.00 33.84 33.73 2c1x n VAL 281 CO 0.00 0.00 0.00 -0.89 -2.14 0.00 0.00 176.83 173.80 2c1x s THR 282 N -0.09 1.21 0.01 3.34 2.01 -1.25 -5.13 115.64 115.74 2c1x s THR 282 Ca 0.00 -0.60 0.03 0.00 0.31 0.00 0.00 61.69 61.43 2c1x s THR 282 Cb 0.00 -1.05 -0.01 0.00 0.01 0.00 0.00 72.50 71.45 2c1x s THR 282 CO 0.00 0.36 -0.11 -0.89 -0.69 0.00 0.00 174.62 173.29 2c1x s THR 283 N 0.05 0.86 0.86 -0.82 2.01 -1.26 -4.60 115.64 112.74 2c1x s THR 283 Ca -0.03 -0.62 -0.11 0.00 0.31 0.00 0.00 61.69 61.24 2c1x s THR 283 Cb -0.10 -0.75 0.11 0.00 0.01 0.00 0.00 72.50 71.76 2c1x s THR 283 CO 0.01 0.13 1.09 -2.84 -0.69 0.00 0.00 174.62 172.32 2c1x s PRO 284 N -0.56 1.57 0.73 4.92 0.02 -1.26 -4.99 135.00 135.42 2c1x s PRO 284 Ca 0.02 1.04 -0.13 0.00 0.02 0.00 0.00 61.00 61.95 2c1x s PRO 284 Cb -0.05 -1.83 0.04 0.00 0.02 0.00 0.00 34.50 32.67 2c1x s PRO 284 CO 0.00 -2.09 1.13 -1.25 -0.33 0.00 0.00 177.00 174.46 2c1x s PRO 285 N -4.88 2.36 0.31 5.54 0.04 -1.26 -4.63 135.00 132.48 2c1x s PRO 285 Ca 0.63 1.43 0.07 0.00 0.04 0.00 0.00 61.00 63.18 2c1x s PRO 285 Cb -0.18 -1.89 0.85 0.00 0.04 0.00 0.00 34.50 33.31 2c1x s PRO 285 CO 0.57 -1.60 1.69 -1.35 0.04 0.00 0.00 177.00 176.35 2c1x h PRO 286 N -0.49 0.38 -0.10 0.56 0.11 -1.95 0.16 132.00 130.67 2c1x h PRO 286 Ca -0.46 -0.02 -0.04 0.00 0.11 0.00 0.00 66.00 65.59 2c1x h PRO 286 Cb 1.26 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 32.27 2c1x h PRO 286 CO 0.51 0.25 -0.12 0.00 -0.21 0.00 0.00 178.00 178.44 2c1x h ALA 287 N 1.76 1.62 0.06 -0.75 0.00 -1.94 -0.45 119.26 119.55 2c1x h ALA 287 Ca 0.62 -0.17 -0.24 0.00 0.00 0.00 0.00 54.91 55.12 2c1x h ALA 287 Cb 1.26 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.97 2c1x h ALA 287 CO -0.55 0.28 -1.11 0.93 0.00 0.00 0.00 179.25 178.80 2c1x h GLU 288 N 0.15 0.14 -0.80 0.00 5.08 -1.30 -1.66 114.58 116.18 2c1x h GLU 288 Ca 0.03 -0.23 0.05 0.00 -1.00 0.00 0.00 59.36 58.21 2c1x h GLU 288 Cb 0.31 0.08 -0.05 0.00 0.50 0.00 0.00 28.75 29.59 2c1x h GLU 288 CO 0.02 1.10 0.50 0.28 -1.00 0.00 0.00 179.01 179.91 2c1x h VAL 289 N 0.04 1.07 -0.06 3.13 2.07 -0.80 -0.69 116.25 121.01 2c1x h VAL 289 Ca -0.07 -0.32 -0.01 0.00 0.82 0.00 0.00 66.70 67.12 2c1x h VAL 289 Cb 1.85 0.04 -0.00 0.00 -1.52 0.00 0.00 31.29 31.66 2c1x h VAL 289 CO 0.16 0.17 0.02 0.58 0.02 0.00 0.00 177.57 178.52 2c1x h VAL 290 N 0.94 1.18 -0.28 2.57 2.07 -1.00 -1.35 116.25 120.37 2c1x h VAL 290 Ca 0.34 -0.53 0.03 0.00 0.82 0.00 0.00 66.70 67.36 2c1x h VAL 290 Cb 0.10 1.42 -0.03 0.00 -1.52 0.00 0.00 31.29 31.25 2c1x h VAL 290 CO -0.15 0.15 0.09 0.00 0.02 0.00 0.00 177.57 177.68 2c1x h ALA 291 N 0.82 0.31 -0.44 1.67 0.00 -1.11 -0.03 119.26 120.48 2c1x h ALA 291 Ca 0.02 0.03 0.04 0.00 0.00 0.00 0.00 54.91 55.01 2c1x h ALA 291 Cb 0.22 0.02 -0.04 0.00 0.00 0.00 0.00 17.79 17.99 2c1x h ALA 291 CO -0.00 -0.32 0.20 1.25 0.00 0.00 0.00 179.25 180.38 2c1x h LEU 292 N 0.21 0.27 -1.20 0.00 5.85 -1.11 -1.00 115.31 118.33 2c1x h LEU 292 Ca 0.12 0.03 0.01 0.00 0.84 0.00 0.00 57.88 58.88 2c1x h LEU 292 Cb 0.10 -0.01 -0.04 0.00 0.37 0.00 0.00 40.66 41.07 2c1x h LEU 292 CO -0.13 0.19 0.54 0.77 -0.34 0.00 0.00 178.44 179.47 2c1x h SER 293 N 0.40 0.93 -0.40 1.25 4.64 -0.42 -1.31 113.55 118.65 2c1x h SER 293 Ca 0.20 -0.02 -0.15 0.00 -0.47 0.00 0.00 61.79 61.34 2c1x h SER 293 Cb 0.14 -0.23 -0.01 0.00 -0.31 0.00 0.00 62.40 61.99 2c1x h SER 293 CO -0.16 0.67 -0.36 -0.33 -0.87 0.00 0.00 176.83 175.79 2c1x h GLU 294 N 1.10 0.94 -0.38 4.77 5.08 -0.60 -0.99 114.58 124.49 2c1x h GLU 294 Ca 0.30 -0.48 -0.05 0.00 -1.00 0.00 0.00 59.36 58.12 2c1x h GLU 294 Cb -0.13 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.12 2c1x h GLU 294 CO -0.06 1.14 0.04 0.00 -1.00 0.00 0.00 179.01 179.13 2c1x h ALA 295 N 0.78 0.51 -0.23 3.43 0.00 -0.96 -0.43 119.26 122.36 2c1x h ALA 295 Ca 0.07 -0.23 -0.00 0.00 0.00 0.00 0.00 54.91 54.75 2c1x h ALA 295 Cb 0.95 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.59 2c1x h ALA 295 CO 0.09 0.24 0.13 -0.07 0.00 0.00 0.00 179.25 179.64 2c1x h LEU 296 N 0.48 0.28 0.11 0.00 3.38 -1.06 -1.57 115.31 116.94 2c1x h LEU 296 Ca 0.11 -0.07 0.01 0.00 0.09 0.00 0.00 57.88 58.02 2c1x h LEU 296 Cb 0.40 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 41.06 2c1x h LEU 296 CO 0.01 0.27 -0.15 -0.08 0.09 0.00 0.00 178.44 178.58 2c1x h GLU 297 N 0.27 -0.29 -0.58 1.13 4.81 -1.08 -0.97 114.58 117.86 2c1x h GLU 297 Ca 0.08 0.02 -0.08 0.00 -0.13 0.00 0.00 59.36 59.26 2c1x h GLU 297 Cb 0.04 0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.47 2c1x h GLU 297 CO -0.01 -0.20 0.06 0.00 -0.73 0.00 0.00 179.01 178.13 2c1x h ALA 298 N 0.54 1.00 0.00 2.92 0.00 -1.03 -2.85 119.26 119.84 2c1x h ALA 298 Ca 0.01 -0.27 -0.06 0.00 0.00 0.00 0.00 54.91 54.59 2c1x h ALA 298 Cb 0.31 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 2c1x h ALA 298 CO -0.06 0.62 -0.29 0.66 0.00 0.00 0.00 179.25 180.18 2c1x h SER 299 N 0.90 0.00 -6.16 0.00 4.64 -1.29 -3.47 113.55 108.17 2c1x h SER 299 Ca 0.18 0.00 -0.45 0.00 -0.47 0.00 0.00 61.79 61.05 2c1x h SER 299 Cb 0.45 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.56 2c1x h SER 299 CO 0.02 0.29 -0.75 0.54 -0.87 0.00 0.00 176.83 176.06 2c1x n ARG 300 N -3.20 -6.10 -2.99 4.77 1.74 -0.37 -4.96 116.66 105.56 2c1x n ARG 300 Ca 0.02 0.66 -0.40 0.00 -0.77 0.00 0.00 57.85 57.37 2c1x n ARG 300 Cb 0.62 -5.57 -0.05 0.00 -1.02 0.00 0.00 32.46 26.45 2c1x n ARG 300 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 2c1x s VAL 301 N -3.34 4.85 0.44 1.55 0.11 -1.22 -5.02 120.40 117.76 2c1x s VAL 301 Ca 0.57 1.60 -0.26 0.00 -2.93 0.00 0.00 61.98 60.95 2c1x s VAL 301 Cb -0.27 -4.10 -0.09 0.00 -1.53 0.00 0.00 36.38 30.38 2c1x s VAL 301 CO 0.80 0.31 1.43 -2.65 -3.33 0.00 0.00 175.10 171.67 2c1x n PRO 302 N 3.19 2.31 -3.71 1.54 -0.02 -1.26 -4.82 135.00 132.23 2c1x n PRO 302 Ca -0.01 0.82 -0.14 0.00 -2.02 0.00 0.00 63.50 62.14 2c1x n PRO 302 Cb 0.51 -2.62 -0.08 0.00 -0.02 0.00 0.00 33.50 31.29 2c1x n PRO 302 CO 0.00 0.00 0.00 -0.59 1.98 0.00 0.00 175.50 176.89 2c1x s PHE 303 N -1.18 -0.27 -0.16 6.00 -0.12 -1.05 -1.03 117.98 120.17 2c1x s PHE 303 Ca 0.60 0.42 0.01 0.00 -0.05 0.00 0.00 56.93 57.90 2c1x s PHE 303 Cb -0.46 0.16 0.03 0.00 -0.63 0.00 0.00 43.02 42.12 2c1x s PHE 303 CO 0.59 -0.45 -0.15 0.42 -0.05 0.00 0.00 175.22 175.58 2c1x s ILE 304 N -1.40 1.69 -0.27 -4.49 1.01 -0.54 -1.12 121.20 116.07 2c1x s ILE 304 Ca -0.12 -0.76 -0.02 0.00 0.00 0.00 0.00 60.65 59.75 2c1x s ILE 304 Cb -0.04 -1.60 0.03 0.00 0.01 0.00 0.00 42.46 40.87 2c1x s ILE 304 CO 0.05 0.43 -0.03 0.86 0.00 0.00 0.00 174.94 176.24 2c1x s TRP 305 N 1.43 3.13 -0.45 3.97 -0.11 0.52 -0.60 118.94 126.84 2c1x s TRP 305 Ca 0.04 -1.62 -0.28 0.00 1.22 0.00 0.00 56.10 55.46 2c1x s TRP 305 Cb -0.13 -2.09 0.03 0.00 -1.50 0.00 0.00 33.47 29.78 2c1x s TRP 305 CO -0.11 -0.74 1.04 0.45 -4.62 0.00 0.00 176.95 172.97 2c1x s SER 306 N 1.31 6.62 -0.05 5.86 0.15 0.31 -1.18 113.70 126.73 2c1x s SER 306 Ca -0.01 0.42 -0.00 0.00 0.70 0.00 0.00 55.95 57.06 2c1x s SER 306 Cb -0.18 -2.51 0.03 0.00 -1.71 0.00 0.00 66.02 61.65 2c1x s SER 306 CO -0.03 -1.11 -0.01 -0.22 1.20 0.00 0.00 173.24 173.07 2c1x s LEU 307 N 4.06 0.95 0.12 3.45 2.96 0.35 -4.57 118.68 126.00 2c1x s LEU 307 Ca 0.43 -0.07 -0.35 0.00 -0.22 0.00 0.00 54.13 53.93 2c1x s LEU 307 Cb -0.09 -0.35 -0.16 0.00 0.50 0.00 0.00 46.19 46.09 2c1x s LEU 307 CO 0.27 -0.13 1.29 0.54 -1.32 0.00 0.00 176.35 177.00 2c1x n ARG 308 N 4.52 1.22 -0.27 1.98 5.12 -1.26 -3.89 116.66 124.07 2c1x n ARG 308 Ca -0.18 0.44 0.07 0.00 -1.93 0.00 0.00 57.85 56.24 2c1x n ARG 308 Cb 0.50 -2.03 0.21 0.00 -1.16 0.00 0.00 32.46 29.98 2c1x n ARG 308 CO 0.00 0.00 0.00 -0.44 -1.93 0.00 0.00 177.63 175.26 2c1x h ASP 309 N 4.16 0.36 -0.55 0.55 3.32 -1.90 0.12 116.42 122.48 2c1x h ASP 309 Ca -0.46 0.11 0.13 0.00 0.02 0.00 0.00 57.03 56.83 2c1x h ASP 309 Cb 1.33 0.07 -0.03 0.00 0.22 0.00 0.00 39.33 40.92 2c1x h ASP 309 CO 0.75 0.13 0.38 0.11 -1.72 0.00 0.00 179.24 178.90 2c1x h LYS 310 N 0.49 0.14 0.00 3.56 1.79 -2.02 -1.49 116.57 119.04 2c1x h LYS 310 Ca 0.44 -0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.90 2c1x h LYS 310 Cb 0.68 -0.03 0.00 0.00 -1.58 0.00 0.00 32.23 31.30 2c1x h LYS 310 CO -0.40 0.09 0.00 0.00 -1.08 0.00 0.00 179.45 178.06 2c1x n ALA 311 N -2.60 2.34 0.31 3.86 0.00 0.41 -3.66 120.51 121.17 2c1x n ALA 311 Ca 0.10 -0.11 0.18 0.00 0.00 0.00 0.00 53.44 53.61 2c1x n ALA 311 Cb 0.53 -1.46 1.01 0.00 0.00 0.00 0.00 19.45 19.52 2c1x n ALA 311 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2c1x h ARG 312 N 0.00 0.00 0.00 0.00 3.08 -1.18 -1.17 114.38 115.11 2c1x h ARG 312 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2c1x h ARG 312 Cb 0.44 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.49 2c1x h ARG 312 CO 0.00 0.01 0.00 -0.39 -1.07 0.00 0.00 179.97 178.52 2c1x h VAL 313 N 0.00 0.00 -0.00 2.04 -1.51 -1.77 -1.96 116.25 113.05 2c1x h VAL 313 Ca -0.00 -0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.47 2c1x h VAL 313 Cb 0.03 0.91 0.00 0.00 -2.13 0.00 0.00 31.29 30.10 2c1x h VAL 313 CO 0.00 0.00 -0.45 1.41 -1.23 0.00 0.00 177.57 177.30 2c1x n HIS 314 N -2.93 0.00 -2.30 5.19 8.25 -0.44 -4.89 115.22 118.10 2c1x n HIS 314 Ca -0.03 0.00 -0.41 0.00 -0.26 0.00 0.00 57.72 57.02 2c1x n HIS 314 Cb 0.07 -0.14 -0.03 0.00 1.12 0.00 0.00 29.99 31.00 2c1x n HIS 314 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 2c1x s LEU 315 N -2.73 4.46 0.46 2.41 1.43 -0.74 -4.51 118.68 119.46 2c1x s LEU 315 Ca 0.17 2.40 -0.24 0.00 -1.03 0.00 0.00 54.13 55.42 2c1x s LEU 315 Cb 0.18 -3.62 -0.07 0.00 0.03 0.00 0.00 46.19 42.70 2c1x s LEU 315 CO 0.63 -0.39 1.34 -2.84 0.23 0.00 0.00 176.35 175.32 2c1x s PRO 316 N -0.88 3.65 0.18 1.29 0.02 -1.26 -4.91 135.00 133.09 2c1x s PRO 316 Ca 0.51 2.22 -0.33 0.00 0.02 0.00 0.00 61.00 63.42 2c1x s PRO 316 Cb -0.35 -2.57 -0.15 0.00 0.02 0.00 0.00 34.50 31.46 2c1x s PRO 316 CO 0.42 -0.77 1.31 -1.91 -0.33 0.00 0.00 177.00 175.72 2c1x n GLU 317 N -0.32 1.57 0.00 5.54 2.13 -1.26 -1.61 120.64 126.69 2c1x n GLU 317 Ca 0.06 0.56 0.00 0.00 0.66 0.00 0.00 57.16 58.44 2c1x n GLU 317 Cb 0.44 -2.16 0.00 0.00 0.27 0.00 0.00 31.44 29.99 2c1x n GLU 317 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2c1x n GLY 318 N 2.27 2.79 0.07 8.31 0.00 -1.26 -4.92 105.19 112.46 2c1x n GLY 318 Ca 0.14 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.05 2c1x n GLY 318 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2c1x h PHE 319 N 0.00 -0.07 -0.73 1.61 3.57 -1.67 -1.11 116.94 118.55 2c1x h PHE 319 Ca 0.00 0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.53 2c1x h PHE 319 Cb 0.00 0.04 -0.04 0.00 2.79 0.00 0.00 35.95 38.74 2c1x h PHE 319 CO 0.00 -0.05 0.46 -0.07 -2.23 0.00 0.00 178.31 176.42 2c1x h LEU 320 N -0.03 0.77 -0.50 0.59 3.38 -1.91 -1.71 115.31 115.89 2c1x h LEU 320 Ca 0.03 -0.01 -0.08 0.00 0.09 0.00 0.00 57.88 57.92 2c1x h LEU 320 Cb 0.08 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.63 2c1x h LEU 320 CO -0.07 0.54 0.00 -0.33 0.09 0.00 0.00 178.44 178.68 2c1x h GLU 321 N 0.91 0.87 0.00 1.13 3.07 -1.91 -1.82 114.58 116.83 2c1x h GLU 321 Ca 0.29 -0.28 0.00 0.00 -0.50 0.00 0.00 59.36 58.87 2c1x h GLU 321 Cb -0.01 -0.08 0.00 0.00 -0.84 0.00 0.00 28.75 27.82 2c1x h GLU 321 CO -0.10 0.91 0.00 0.87 -1.40 0.00 0.00 179.01 179.29 2c1x h LYS 322 N 0.73 0.00 -0.02 2.33 1.57 -1.00 -3.23 116.57 116.96 2c1x h LYS 322 Ca 0.14 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.92 2c1x h LYS 322 Cb 0.51 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.82 2c1x h LYS 322 CO 0.02 0.00 -0.23 0.25 -0.57 0.00 0.00 179.45 178.92 2c1x n THR 323 N -3.01 0.00 -0.21 -0.16 -2.24 -0.66 -4.59 114.28 103.40 2c1x n THR 323 Ca 0.03 -0.38 0.12 0.00 -2.27 0.00 0.00 64.05 61.54 2c1x n THR 323 Cb 0.42 1.29 0.42 0.00 -2.10 0.00 0.00 70.33 70.36 2c1x n THR 323 CO 0.00 0.00 0.00 -0.09 -0.57 0.00 0.00 175.07 174.41 2c1x h ARG 324 N 2.69 0.59 0.00 -0.78 2.43 -1.35 0.91 114.38 118.87 2c1x h ARG 324 Ca 0.00 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.13 2c1x h ARG 324 Cb 0.69 -0.13 0.00 0.00 -0.42 0.00 0.00 29.97 30.10 2c1x h ARG 324 CO 0.00 0.39 0.00 0.41 -1.51 0.00 0.00 179.97 179.26 2c1x n GLY 325 N -1.47 -1.30 0.00 2.80 0.00 -1.26 -4.19 105.19 99.77 2c1x n GLY 325 Ca 0.15 -0.08 0.00 0.00 0.00 0.00 0.00 46.02 46.08 2c1x n GLY 325 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 2c1x n TYR 326 N -1.48 0.00 -3.79 1.61 0.18 -0.13 -5.12 117.16 108.43 2c1x n TYR 326 Ca 0.06 0.00 -0.10 0.00 1.88 0.00 0.00 57.90 59.74 2c1x n TYR 326 Cb 0.27 0.01 -0.07 0.00 -0.38 0.00 0.00 39.34 39.17 2c1x n TYR 326 CO 0.00 0.00 0.00 0.20 -2.08 0.00 0.00 176.86 174.98 2c1x s GLY 327 N 0.00 -0.04 -0.00 -7.48 0.00 0.13 -2.52 107.32 97.41 2c1x s GLY 327 Ca 0.00 -0.30 0.04 0.00 0.00 0.00 0.00 44.72 44.46 2c1x s GLY 327 CO 0.00 -0.50 -0.13 1.06 0.00 0.00 0.00 173.10 173.53 2c1x s MET 328 N -3.30 1.01 -0.23 2.90 -1.94 -0.28 -4.44 119.30 113.02 2c1x s MET 328 Ca 0.00 -0.49 -0.01 0.00 -1.71 0.00 0.00 55.69 53.49 2c1x s MET 328 Cb 0.02 -0.98 0.02 0.00 2.01 0.00 0.00 34.83 35.90 2c1x s MET 328 CO -0.08 0.27 -0.09 0.08 -0.01 0.00 0.00 175.02 175.18 2c1x s VAL 329 N -0.36 2.72 0.06 -6.03 1.01 -1.26 -0.35 120.40 116.19 2c1x s VAL 329 Ca 0.04 -0.96 0.06 0.00 0.00 0.00 0.00 61.98 61.12 2c1x s VAL 329 Cb -0.05 -2.32 -0.03 0.00 0.00 0.00 0.00 36.38 33.98 2c1x s VAL 329 CO -0.00 0.30 -0.16 0.68 0.00 0.00 0.00 175.10 175.92 2c1x s VAL 330 N 1.33 1.27 -0.15 2.92 -7.23 -0.32 -4.97 120.40 113.25 2c1x s VAL 330 Ca 0.02 -1.24 0.29 0.00 -1.81 0.00 0.00 61.98 59.24 2c1x s VAL 330 Cb -0.16 -1.17 0.37 0.00 0.56 0.00 0.00 36.38 35.98 2c1x s VAL 330 CO -0.06 -0.08 1.82 1.55 -0.31 0.00 0.00 175.10 178.02 2c1x h PRO 331 N 4.52 0.00 -2.31 4.82 0.13 -1.87 0.10 132.00 137.40 2c1x h PRO 331 Ca -0.41 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.67 2c1x h PRO 331 Cb 1.18 0.00 -0.23 0.00 0.13 0.00 0.00 31.00 32.08 2c1x h PRO 331 CO 0.42 0.00 -0.10 -0.46 -0.23 0.00 0.00 178.00 177.63 2c1x s TRP 332 N -3.46 -0.79 0.19 1.56 -0.11 -1.26 -4.50 118.94 110.57 2c1x s TRP 332 Ca 0.04 1.69 0.09 0.00 1.22 0.00 0.00 56.10 59.14 2c1x s TRP 332 Cb 0.07 0.39 -0.04 0.00 -1.50 0.00 0.00 33.47 32.39 2c1x s TRP 332 CO 0.59 -0.40 -0.10 0.00 -4.62 0.00 0.00 176.95 172.43 2c1x s ALA 333 N 1.14 2.94 -1.27 5.86 0.00 -1.26 -5.02 121.76 124.15 2c1x s ALA 333 Ca -0.07 -1.51 -0.19 0.00 0.00 0.00 0.00 51.96 50.19 2c1x s ALA 333 Cb -0.06 -0.71 0.03 0.00 0.00 0.00 0.00 23.12 22.38 2c1x s ALA 333 CO -0.11 0.44 1.80 -0.35 0.00 0.00 0.00 175.76 177.54 2c1x n PRO 334 N -0.07 2.78 -0.14 0.00 -0.04 -1.26 -4.83 135.00 131.44 2c1x n PRO 334 Ca -0.10 -3.05 -0.09 0.00 -0.04 0.00 0.00 63.50 60.22 2c1x n PRO 334 Cb 0.56 -3.55 -0.00 0.00 -0.04 0.00 0.00 33.50 30.47 2c1x n PRO 334 CO 0.00 0.00 0.00 0.37 -0.04 0.00 0.00 175.50 175.83 2c1x h GLN 335 N 8.06 0.58 -0.74 0.54 4.15 -1.99 -0.68 115.11 125.03 2c1x h GLN 335 Ca 0.40 -0.08 -0.04 0.00 0.77 0.00 0.00 58.65 59.70 2c1x h GLN 335 Cb 0.88 -0.11 -0.03 0.00 0.21 0.00 0.00 27.48 28.43 2c1x h GLN 335 CO 1.42 0.49 0.31 0.00 -1.93 0.00 0.00 178.83 179.12 2c1x h ALA 336 N 1.06 1.15 -0.34 3.38 0.00 -1.95 -0.03 119.26 122.52 2c1x h ALA 336 Ca 0.14 -0.18 -0.12 0.00 0.00 0.00 0.00 54.91 54.75 2c1x h ALA 336 Cb 0.10 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 2c1x h ALA 336 CO -0.02 0.62 -0.29 0.93 0.00 0.00 0.00 179.25 180.49 2c1x h GLU 337 N 1.07 0.72 -0.43 0.00 5.08 -1.79 -2.15 114.58 117.08 2c1x h GLU 337 Ca 0.25 -0.32 -0.03 0.00 -1.00 0.00 0.00 59.36 58.26 2c1x h GLU 337 Cb 0.18 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.39 2c1x h GLU 337 CO -0.02 0.92 0.14 0.28 -1.00 0.00 0.00 179.01 179.33 2c1x h VAL 338 N 0.62 1.22 0.00 3.13 2.07 -0.62 -2.71 116.25 119.95 2c1x h VAL 338 Ca 0.07 -0.70 -0.04 0.00 0.82 0.00 0.00 66.70 66.85 2c1x h VAL 338 Cb 0.80 0.86 -0.01 0.00 -1.52 0.00 0.00 31.29 31.43 2c1x h VAL 338 CO 0.07 0.25 -0.21 -0.07 0.02 0.00 0.00 177.57 177.63 2c1x h LEU 339 N 0.55 0.00 -0.08 2.57 3.38 -0.82 -1.34 115.31 119.57 2c1x h LEU 339 Ca 0.14 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.11 2c1x h LEU 339 Cb 0.25 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.00 2c1x h LEU 339 CO -0.01 0.21 -0.12 0.00 0.09 0.00 0.00 178.44 178.61 2c1x n ALA 340 N -2.33 2.70 -2.43 1.53 0.00 -0.83 -4.33 120.51 114.82 2c1x n ALA 340 Ca -0.02 -0.21 -0.41 0.00 0.00 0.00 0.00 53.44 52.81 2c1x n ALA 340 Cb 0.31 -1.37 -0.04 0.00 0.00 0.00 0.00 19.45 18.35 2c1x n ALA 340 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 2c1x s HIS 341 N -2.74 3.74 0.58 0.00 5.04 -0.51 -4.95 115.29 116.46 2c1x s HIS 341 Ca 0.21 1.67 0.28 0.00 -1.54 0.00 0.00 55.06 55.68 2c1x s HIS 341 Cb 0.19 -3.00 1.57 0.00 0.04 0.00 0.00 32.58 31.39 2c1x s HIS 341 CO 0.53 0.16 2.04 1.05 -2.34 0.00 0.00 174.74 176.18 2c1x h GLU 342 N 5.95 0.00 0.00 2.88 9.09 -1.89 -1.73 114.58 128.89 2c1x h GLU 342 Ca -0.43 0.00 0.00 0.00 0.05 0.00 0.00 59.36 58.98 2c1x h GLU 342 Cb 1.21 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.31 2c1x h GLU 342 CO 0.73 0.00 0.00 0.00 0.05 0.00 0.00 179.01 179.79 2c1x h ALA 343 N 1.70 1.00 -2.46 1.06 0.00 -1.85 0.83 119.26 119.53 2c1x h ALA 343 Ca 0.13 0.00 -0.55 0.00 0.00 0.00 0.00 54.91 54.49 2c1x h ALA 343 Cb 0.69 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.44 2c1x h ALA 343 CO -0.00 0.00 0.32 0.08 0.00 0.00 0.00 179.25 179.65 2c1x s VAL 344 N -3.54 4.91 -0.10 0.00 1.01 -0.65 -0.64 120.40 121.39 2c1x s VAL 344 Ca 0.03 1.81 0.07 0.00 0.00 0.00 0.00 61.98 63.89 2c1x s VAL 344 Cb 0.09 -4.21 -0.10 0.00 0.00 0.00 0.00 36.38 32.15 2c1x s VAL 344 CO 0.54 0.14 0.20 0.61 0.00 0.00 0.00 175.10 176.59 2c1x n GLY 345 N 3.08 -0.13 3.41 4.51 0.00 0.14 -4.33 105.19 111.86 2c1x n GLY 345 Ca 0.04 -0.18 -0.15 0.00 0.00 0.00 0.00 46.02 45.73 2c1x n GLY 345 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2c1x s ALA 346 N -2.25 -1.39 -0.23 4.61 0.00 -1.08 -4.29 121.76 117.13 2c1x s ALA 346 Ca -0.01 0.74 0.00 0.00 0.00 0.00 0.00 51.96 52.69 2c1x s ALA 346 Cb 0.05 0.28 0.06 0.00 0.00 0.00 0.00 23.12 23.51 2c1x s ALA 346 CO 0.30 -0.46 -0.04 0.12 0.00 0.00 0.00 175.76 175.68 2c1x s PHE 347 N -2.09 2.27 -0.37 0.00 5.36 -0.36 -0.70 117.98 122.08 2c1x s PHE 347 Ca -0.07 -1.68 -0.29 0.00 -0.96 0.00 0.00 56.93 53.93 2c1x s PHE 347 Cb -0.01 -1.54 0.02 0.00 -0.34 0.00 0.00 43.02 41.15 2c1x s PHE 347 CO 0.01 -0.76 1.08 0.08 -1.46 0.00 0.00 175.22 174.17 2c1x s VAL 348 N 1.44 4.43 0.09 3.12 1.01 0.15 -0.01 120.40 130.63 2c1x s VAL 348 Ca -0.05 1.54 0.04 0.00 0.00 0.00 0.00 61.98 63.52 2c1x s VAL 348 Cb -0.19 -4.46 -0.03 0.00 0.00 0.00 0.00 36.38 31.70 2c1x s VAL 348 CO -0.07 -0.63 -0.11 0.28 0.00 0.00 0.00 175.10 174.57 2c1x s THR 349 N 3.85 1.00 -1.84 3.92 -1.32 -0.68 -1.43 115.64 119.14 2c1x s THR 349 Ca 0.45 -1.53 0.31 0.00 -1.21 0.00 0.00 61.69 59.71 2c1x s THR 349 Cb -0.11 -1.25 0.69 0.00 -1.51 0.00 0.00 72.50 70.32 2c1x s THR 349 CO 0.20 -0.45 2.07 0.00 -2.21 0.00 0.00 174.62 174.23 2c1x n HIS 350 N 0.79 0.00 -2.34 9.09 1.44 -1.23 -1.14 115.22 121.83 2c1x n HIS 350 Ca -0.18 0.00 -0.09 0.00 -2.01 0.00 0.00 57.72 55.44 2c1x n HIS 350 Cb 0.57 -0.10 0.00 0.00 0.12 0.00 0.00 29.99 30.58 2c1x n HIS 350 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2c1x s GLY 352 N -2.72 2.80 0.20 0.00 0.00 -1.26 -4.66 107.32 101.68 2c1x s GLY 352 Ca 0.06 1.01 -0.10 0.00 0.00 0.00 0.00 44.72 45.68 2c1x s GLY 352 CO 0.07 1.48 1.78 -0.25 0.00 0.00 0.00 173.10 176.18 2c1x h TRP 353 N 1.97 0.54 -0.37 1.90 2.91 -1.95 -1.33 115.95 119.62 2c1x h TRP 353 Ca -0.50 0.03 -0.11 0.00 1.13 0.00 0.00 58.89 59.44 2c1x h TRP 353 Cb 1.26 -0.15 -0.01 0.00 -0.51 0.00 0.00 29.16 29.75 2c1x h TRP 353 CO 0.52 0.23 -0.18 -0.91 -1.03 0.00 0.00 178.44 177.06 2c1x h ASN 354 N 0.55 0.81 -0.62 2.65 4.21 -1.92 -2.73 115.58 118.52 2c1x h ASN 354 Ca 0.28 -0.41 0.02 0.00 1.21 0.00 0.00 56.30 57.40 2c1x h ASN 354 Cb 0.24 -0.22 -0.04 0.00 -1.12 0.00 0.00 38.32 37.18 2c1x h ASN 354 CO -0.21 1.03 0.40 0.28 -1.29 0.00 0.00 177.43 177.64 2c1x h SER 355 N 0.58 0.66 -0.06 5.81 0.02 -1.89 -2.41 113.55 116.25 2c1x h SER 355 Ca 0.08 -0.01 0.03 0.00 -0.84 0.00 0.00 61.79 61.05 2c1x h SER 355 Cb 0.73 -0.15 -0.03 0.00 0.14 0.00 0.00 62.40 63.09 2c1x h SER 355 CO 0.06 0.47 -0.10 0.25 -1.14 0.00 0.00 176.83 176.36 2c1x h LEU 356 N 0.79 -0.30 -1.50 5.07 6.46 -1.08 -1.08 115.31 123.67 2c1x h LEU 356 Ca 0.24 0.06 -0.05 0.00 -0.12 0.00 0.00 57.88 58.01 2c1x h LEU 356 Cb -0.03 0.14 -0.01 0.00 -0.73 0.00 0.00 40.66 40.04 2c1x h LEU 356 CO -0.08 -0.14 -0.23 -0.50 -0.62 0.00 0.00 178.44 176.87 2c1x h TRP 357 N -0.14 0.03 -0.28 1.25 4.06 -1.34 -0.56 115.95 118.96 2c1x h TRP 357 Ca 0.06 -0.00 -0.13 0.00 2.06 0.00 0.00 58.89 60.88 2c1x h TRP 357 Cb 0.23 -0.01 -0.01 0.00 -1.00 0.00 0.00 29.16 28.37 2c1x h TRP 357 CO -0.19 0.26 -0.35 0.93 -3.56 0.00 0.00 178.44 175.53 2c1x h GLU 358 N 0.03 0.61 -0.33 0.49 5.08 -1.09 -0.15 114.58 119.22 2c1x h GLU 358 Ca 0.00 -0.29 -0.15 0.00 -1.00 0.00 0.00 59.36 57.93 2c1x h GLU 358 Cb 0.43 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.66 2c1x h GLU 358 CO 0.03 0.87 -0.39 1.03 -1.00 0.00 0.00 179.01 179.56 2c1x h SER 359 N 0.52 0.85 -0.67 1.42 0.87 -0.35 -1.68 113.55 114.51 2c1x h SER 359 Ca 0.05 -0.38 -0.02 0.00 -1.23 0.00 0.00 61.79 60.21 2c1x h SER 359 Cb 0.85 -0.24 -0.03 0.00 -0.44 0.00 0.00 62.40 62.54 2c1x h SER 359 CO 0.07 1.14 0.34 0.58 -0.53 0.00 0.00 176.83 178.43 2c1x h VAL 360 N 0.66 1.22 -0.69 2.23 2.07 -0.99 -0.26 116.25 120.49 2c1x h VAL 360 Ca 0.05 -0.58 -0.00 0.00 0.82 0.00 0.00 66.70 66.99 2c1x h VAL 360 Cb 0.95 0.37 -0.03 0.00 -1.52 0.00 0.00 31.29 31.06 2c1x h VAL 360 CO 0.09 0.25 0.42 0.00 0.02 0.00 0.00 177.57 178.34 2c1x h ALA 361 N 1.16 1.44 -0.00 1.67 0.00 -0.75 -1.86 119.26 120.93 2c1x h ALA 361 Ca 0.23 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.07 2c1x h ALA 361 Cb 0.08 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.59 2c1x h ALA 361 CO -0.03 0.49 -0.14 0.41 0.00 0.00 0.00 179.25 179.98 2c1x n GLY 362 N -1.33 -1.42 2.22 0.00 0.00 -0.66 -4.94 105.19 99.07 2c1x n GLY 362 Ca 0.07 -0.17 -0.12 0.00 0.00 0.00 0.00 46.02 45.80 2c1x n GLY 362 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2c1x n GLY 363 N 1.49 -0.06 3.57 -0.02 0.00 -0.26 -4.75 105.19 105.15 2c1x n GLY 363 Ca 0.07 -0.40 -0.36 0.00 0.00 0.00 0.00 46.02 45.33 2c1x n GLY 363 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2c1x s VAL 364 N -2.57 4.80 0.47 1.61 1.01 -0.29 -4.85 120.40 120.57 2c1x s VAL 364 Ca 0.00 -0.02 -0.24 0.00 0.00 0.00 0.00 61.98 61.72 2c1x s VAL 364 Cb 0.00 -3.22 -0.07 0.00 0.00 0.00 0.00 36.38 33.09 2c1x s VAL 364 CO 0.00 0.37 1.31 -2.84 0.00 0.00 0.00 175.10 173.93 2c1x s PRO 365 N 1.13 3.63 0.15 2.72 0.02 -1.26 -4.59 135.00 136.81 2c1x s PRO 365 Ca 0.05 2.13 -0.11 0.00 0.02 0.00 0.00 61.00 63.09 2c1x s PRO 365 Cb -0.14 -2.52 -0.07 0.00 0.02 0.00 0.00 34.50 31.80 2c1x s PRO 365 CO 0.04 -0.76 0.50 -0.51 -0.33 0.00 0.00 177.00 175.94 2c1x s LEU 366 N -2.93 4.29 -0.33 -5.54 2.01 -0.88 -1.23 118.68 114.07 2c1x s LEU 366 Ca 0.63 0.94 -0.02 0.00 0.01 0.00 0.00 54.13 55.69 2c1x s LEU 366 Cb -0.37 -3.32 0.06 0.00 0.01 0.00 0.00 46.19 42.57 2c1x s LEU 366 CO 0.46 0.07 0.06 -0.63 1.01 0.00 0.00 176.35 177.31 2c1x s ILE 367 N -1.56 3.10 -0.11 -0.59 1.01 0.99 -0.39 121.20 123.64 2c1x s ILE 367 Ca 0.40 -1.54 -0.19 0.00 0.00 0.00 0.00 60.65 59.32 2c1x s ILE 367 Cb -0.13 -2.87 -0.04 0.00 0.01 0.00 0.00 42.46 39.42 2c1x s ILE 367 CO 0.20 -0.26 0.51 0.00 0.00 0.00 0.00 174.94 175.39 2c1x n ARG 369 N 3.75 0.75 -2.17 0.00 3.00 -0.29 -3.46 116.66 118.23 2c1x n ARG 369 Ca -0.06 -3.25 -0.36 0.00 -0.00 0.00 0.00 57.85 54.19 2c1x n ARG 369 Cb 0.51 -1.25 0.01 0.00 0.00 0.00 0.00 32.46 31.74 2c1x n ARG 369 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.63 176.38 2c1x s PRO 370 N -1.26 3.29 -0.06 -0.14 0.04 -1.26 -4.31 135.00 131.30 2c1x s PRO 370 Ca 0.35 1.72 -0.09 0.00 0.04 0.00 0.00 61.00 63.02 2c1x s PRO 370 Cb 0.18 -2.05 -0.04 0.00 0.04 0.00 0.00 34.50 32.64 2c1x s PRO 370 CO -0.11 -0.92 -0.18 1.19 0.04 0.00 0.00 177.00 177.02 2c1x n PHE 371 N -1.26 0.00 -3.68 0.56 3.72 -1.26 -4.88 117.46 110.66 2c1x n PHE 371 Ca 0.12 0.00 -0.08 0.00 -0.05 0.00 0.00 57.45 57.44 2c1x n PHE 371 Cb 0.50 -0.30 0.01 0.00 -0.94 0.00 0.00 39.48 38.75 2c1x n PHE 371 CO 0.00 0.00 0.00 1.97 -0.05 0.00 0.00 176.76 178.68 2c1x n PHE 372 N -3.94 -1.81 -2.32 1.38 1.16 -1.26 -4.96 117.46 105.71 2c1x n PHE 372 Ca -0.11 -1.49 0.00 0.00 -1.87 0.00 0.00 57.45 53.98 2c1x n PHE 372 Cb 0.34 0.62 0.00 0.00 -1.61 0.00 0.00 39.48 38.83 2c1x n PHE 372 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 2c1x n GLY 373 N -0.41 3.20 0.06 4.97 0.00 -1.26 -2.14 105.19 109.61 2c1x n GLY 373 Ca -0.05 -0.25 0.11 0.00 0.00 0.00 0.00 46.02 45.84 2c1x n GLY 373 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2c1x n ASP 374 N 3.24 0.19 -0.02 1.61 5.75 -1.26 -4.11 116.55 121.96 2c1x n ASP 374 Ca 0.00 -1.34 -0.07 0.00 -0.01 0.00 0.00 54.79 53.36 2c1x n ASP 374 Cb 0.00 -0.01 0.10 0.00 -1.03 0.00 0.00 41.12 40.18 2c1x n ASP 374 CO 0.00 0.00 0.00 1.56 -0.11 0.00 0.00 177.20 178.65 2c1x h GLN 375 N 0.27 0.59 -0.57 0.11 4.20 -1.70 -0.76 115.11 117.25 2c1x h GLN 375 Ca 0.00 -0.30 -0.06 0.00 0.06 0.00 0.00 58.65 58.35 2c1x h GLN 375 Cb 0.06 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 27.82 2c1x h GLN 375 CO 0.00 0.89 0.12 0.00 -0.67 0.00 0.00 178.83 179.16 2c1x h ARG 376 N 0.49 0.90 -0.41 1.46 3.08 -1.80 0.12 114.38 118.22 2c1x h ARG 376 Ca 0.04 -0.20 -0.07 0.00 0.07 0.00 0.00 59.98 59.82 2c1x h ARG 376 Cb 0.90 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 30.81 2c1x h ARG 376 CO 0.08 0.82 -0.01 -0.07 -1.07 0.00 0.00 179.97 179.72 2c1x h LEU 377 N 0.86 0.72 -0.74 3.04 3.38 -1.41 -0.89 115.31 120.27 2c1x h LEU 377 Ca 0.18 -0.31 -0.05 0.00 0.09 0.00 0.00 57.88 57.79 2c1x h LEU 377 Cb 0.34 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.87 2c1x h LEU 377 CO 0.00 0.86 0.26 0.78 0.09 0.00 0.00 178.44 180.44 2c1x h ASN 378 N 0.57 1.06 -0.29 -0.43 2.35 -0.95 -1.04 115.58 116.86 2c1x h ASN 378 Ca 0.12 -0.19 0.05 0.00 -0.55 0.00 0.00 56.30 55.72 2c1x h ASN 378 Cb 0.50 -0.28 -0.04 0.00 0.05 0.00 0.00 38.32 38.55 2c1x h ASN 378 CO 0.02 0.97 0.03 1.23 -1.65 0.00 0.00 177.43 178.03 2c1x h GLY 379 N 1.09 0.30 0.81 2.83 0.00 -0.51 -0.91 103.07 106.68 2c1x h GLY 379 Ca 0.24 0.01 0.03 0.00 0.00 0.00 0.00 47.33 47.61 2c1x h GLY 379 CO -0.01 -0.04 0.21 -0.09 0.00 0.00 0.00 176.54 176.61 2c1x h ARG 380 N 0.12 0.41 -0.19 4.80 9.65 -0.91 0.27 114.38 128.53 2c1x h ARG 380 Ca 0.13 -0.02 0.04 0.00 -1.10 0.00 0.00 59.98 59.03 2c1x h ARG 380 Cb 0.16 -0.09 -0.04 0.00 -1.39 0.00 0.00 29.97 28.61 2c1x h ARG 380 CO -0.20 0.27 -0.07 1.98 2.80 0.00 0.00 179.97 184.75 2c1x h MET 381 N 0.42 -0.04 -0.22 0.20 4.05 -0.93 0.24 114.93 118.66 2c1x h MET 381 Ca 0.17 0.00 -0.00 0.00 -0.28 0.00 0.00 59.70 59.59 2c1x h MET 381 Cb 0.07 0.01 -0.01 0.00 -0.80 0.00 0.00 31.60 30.87 2c1x h MET 381 CO -0.12 -0.02 0.12 0.28 0.23 0.00 0.00 176.91 177.40 2c1x h VAL 382 N -0.04 1.11 0.01 -5.77 2.07 -0.80 0.27 116.25 113.10 2c1x h VAL 382 Ca 0.10 -0.28 -0.02 0.00 0.82 0.00 0.00 66.70 67.32 2c1x h VAL 382 Cb 0.19 0.90 0.00 0.00 -1.52 0.00 0.00 31.29 30.86 2c1x h VAL 382 CO -0.22 0.10 -0.08 -0.33 0.02 0.00 0.00 177.57 177.06 2c1x h GLU 383 N 0.25 0.03 0.00 1.57 5.08 -0.80 0.22 114.58 120.92 2c1x h GLU 383 Ca 0.08 -0.05 -0.03 0.00 -1.00 0.00 0.00 59.36 58.36 2c1x h GLU 383 Cb 0.06 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.32 2c1x h GLU 383 CO -0.01 1.01 -1.97 -0.25 -1.00 0.00 0.00 179.01 176.79 2c1x n ASP 384 N -4.57 0.31 -0.06 1.42 8.00 0.83 -3.93 116.55 118.56 2c1x n ASP 384 Ca -0.10 0.00 -0.08 0.00 0.71 0.00 0.00 54.79 55.31 2c1x n ASP 384 Cb 0.51 1.86 -0.03 0.00 -0.02 0.00 0.00 41.12 43.44 2c1x n ASP 384 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 2c1x n VAL 385 N -2.25 1.41 0.09 2.53 0.31 -0.80 -4.70 118.33 114.92 2c1x n VAL 385 Ca -0.06 0.16 0.01 0.00 -0.01 0.00 0.00 64.34 64.44 2c1x n VAL 385 Cb 0.58 -2.13 -0.03 0.00 -0.91 0.00 0.00 33.84 31.35 2c1x n VAL 385 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 2c1x h LEU 386 N -0.75 0.00 -2.30 7.52 3.38 -0.67 -3.49 115.31 119.00 2c1x h LEU 386 Ca -0.05 0.00 -0.39 0.00 0.09 0.00 0.00 57.88 57.53 2c1x h LEU 386 Cb 0.82 0.00 0.09 0.00 0.09 0.00 0.00 40.66 41.66 2c1x h LEU 386 CO -0.03 0.58 -0.87 -0.62 0.09 0.00 0.00 178.44 177.59 2c1x n GLU 387 N -3.11 -3.40 -0.07 1.13 1.02 -0.52 -4.92 120.64 110.78 2c1x n GLU 387 Ca -0.03 0.63 0.03 0.00 -0.02 0.00 0.00 57.16 57.77 2c1x n GLU 387 Cb 0.79 -5.02 0.06 0.00 -0.02 0.00 0.00 31.44 27.25 2c1x n GLU 387 CO 0.00 0.00 0.00 0.44 1.18 0.00 0.00 177.13 178.75 2c1x n ILE 388 N -4.04 1.15 -3.83 -3.67 -5.35 -0.05 -4.62 119.36 98.94 2c1x n ILE 388 Ca -0.20 -1.17 -0.06 0.00 -0.27 0.00 0.00 62.75 61.05 2c1x n ILE 388 Cb 0.64 0.39 -0.00 0.00 -1.74 0.00 0.00 39.64 38.93 2c1x n ILE 388 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 2c1x s GLY 389 N -1.24 0.06 0.21 3.28 0.00 -1.18 -2.07 107.32 106.38 2c1x s GLY 389 Ca 0.10 -0.38 0.11 0.00 0.00 0.00 0.00 44.72 44.56 2c1x s GLY 389 CO 0.04 0.15 -0.19 -1.34 0.00 0.00 0.00 173.10 171.77 2c1x s VAL 390 N -3.08 2.64 0.25 1.40 -7.23 0.48 -4.30 120.40 110.56 2c1x s VAL 390 Ca 0.14 -2.01 -0.06 0.00 -1.81 0.00 0.00 61.98 58.24 2c1x s VAL 390 Cb -0.04 -2.31 -0.06 0.00 0.56 0.00 0.00 36.38 34.53 2c1x s VAL 390 CO 0.07 -0.18 0.53 0.00 -0.31 0.00 0.00 175.10 175.21 2c1x s ARG 391 N -2.92 3.68 -0.31 4.82 1.70 -1.26 -0.88 118.95 123.78 2c1x s ARG 391 Ca 0.24 0.08 -0.19 0.00 -0.47 0.00 0.00 55.73 55.38 2c1x s ARG 391 Cb -0.07 -2.67 -0.01 0.00 -0.57 0.00 0.00 34.95 31.62 2c1x s ARG 391 CO 0.13 0.27 0.57 0.96 -1.08 0.00 0.00 175.30 176.15 2c1x s ILE 392 N -1.96 4.99 -0.18 4.99 -4.36 -1.22 -4.85 121.20 118.60 2c1x s ILE 392 Ca 0.45 0.72 -0.39 0.00 -0.26 0.00 0.00 60.65 61.17 2c1x s ILE 392 Cb -0.11 -3.95 -0.16 0.00 1.25 0.00 0.00 42.46 39.49 2c1x s ILE 392 CO 0.27 -0.11 1.66 -0.62 0.24 0.00 0.00 174.94 176.38 2c1x n GLU 393 N 5.77 1.23 0.00 0.37 -0.58 -1.26 -0.47 120.64 125.70 2c1x n GLU 393 Ca -0.03 0.45 0.00 0.00 -0.42 0.00 0.00 57.16 57.16 2c1x n GLU 393 Cb 0.49 -2.14 0.00 0.00 -0.57 0.00 0.00 31.44 29.23 2c1x n GLU 393 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2c1x n GLY 394 N 3.83 1.52 2.61 0.62 0.00 -1.26 -4.24 105.19 108.28 2c1x n GLY 394 Ca 0.24 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.26 2c1x n GLY 394 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2c1x n GLY 395 N -2.00 0.38 3.10 -0.02 0.00 0.38 -4.99 105.19 102.04 2c1x n GLY 395 Ca 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.82 2c1x n GLY 395 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2c1x s VAL 396 N -1.90 0.98 0.02 1.61 -7.23 -1.26 -4.82 120.40 107.80 2c1x s VAL 396 Ca 0.00 -0.80 -0.33 0.00 -1.81 0.00 0.00 61.98 59.05 2c1x s VAL 396 Cb 0.00 -0.88 -0.11 0.00 0.56 0.00 0.00 36.38 35.95 2c1x s VAL 396 CO 0.00 0.08 1.85 0.49 -0.31 0.00 0.00 175.10 177.21 2c1x n PHE 397 N 2.23 2.43 -4.37 2.82 3.72 -1.26 -4.80 117.46 118.22 2c1x n PHE 397 Ca -0.17 -0.09 -0.25 0.00 -0.05 0.00 0.00 57.45 56.90 2c1x n PHE 397 Cb 0.55 -2.70 -0.12 0.00 -0.94 0.00 0.00 39.48 36.28 2c1x n PHE 397 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 176.76 177.66 2c1x s THR 398 N 3.44 2.08 0.11 4.37 -4.23 -1.26 -4.75 115.64 115.39 2c1x s THR 398 Ca 0.88 -1.92 -0.31 0.00 -1.18 0.00 0.00 61.69 59.16 2c1x s THR 398 Cb -0.59 -1.95 -0.11 0.00 1.34 0.00 0.00 72.50 71.20 2c1x s THR 398 CO 0.44 -0.17 1.60 0.50 -0.54 0.00 0.00 174.62 176.45 2c1x h LYS 399 N 3.35 -0.64 -0.22 3.99 3.64 -1.95 -1.22 116.57 123.52 2c1x h LYS 399 Ca -0.45 0.04 -0.10 0.00 -1.27 0.00 0.00 60.65 58.88 2c1x h LYS 399 Cb 1.20 0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 33.15 2c1x h LYS 399 CO 0.48 -0.43 -0.28 0.66 -2.27 0.00 0.00 179.45 177.61 2c1x h SER 400 N -0.66 0.44 -0.45 4.20 4.64 -1.98 -2.16 113.55 117.58 2c1x h SER 400 Ca 0.01 -0.16 -0.04 0.00 -0.47 0.00 0.00 61.79 61.13 2c1x h SER 400 Cb 0.66 -0.12 -0.02 0.00 -0.31 0.00 0.00 62.40 62.61 2c1x h SER 400 CO -0.18 0.72 0.13 1.23 -0.87 0.00 0.00 176.83 177.86 2c1x h GLY 401 N 1.04 0.77 0.93 -0.77 0.00 -1.92 -1.98 103.07 101.13 2c1x h GLY 401 Ca 0.05 -0.46 -0.04 0.00 0.00 0.00 0.00 47.33 46.88 2c1x h GLY 401 CO 0.05 0.43 0.09 1.41 0.00 0.00 0.00 176.54 178.53 2c1x h LEU 402 N 0.60 0.56 -1.16 3.11 3.38 -1.05 -2.41 115.31 118.35 2c1x h LEU 402 Ca 0.14 -0.23 0.04 0.00 0.09 0.00 0.00 57.88 57.92 2c1x h LEU 402 Cb 0.29 -0.15 -0.05 0.00 0.09 0.00 0.00 40.66 40.84 2c1x h LEU 402 CO -0.00 0.64 0.58 0.24 0.09 0.00 0.00 178.44 179.99 2c1x h MET 403 N 0.46 1.06 -0.41 1.13 2.86 -1.32 0.07 114.93 118.78 2c1x h MET 403 Ca 0.12 -0.06 -0.01 0.00 -2.06 0.00 0.00 59.70 57.69 2c1x h MET 403 Cb 0.30 -0.24 -0.02 0.00 0.06 0.00 0.00 31.60 31.70 2c1x h MET 403 CO 0.00 0.70 0.23 1.03 1.06 0.00 0.00 176.91 179.94 2c1x h SER 404 N 1.09 0.51 -0.71 1.22 0.87 -1.25 -1.59 113.55 113.68 2c1x h SER 404 Ca 0.35 -0.08 0.00 0.00 -1.23 0.00 0.00 61.79 60.84 2c1x h SER 404 Cb 0.03 -0.13 -0.03 0.00 -0.44 0.00 0.00 62.40 61.83 2c1x h SER 404 CO -0.11 0.43 0.45 0.00 -0.53 0.00 0.00 176.83 177.08 2c1x h PHE 406 N 0.97 0.11 0.05 0.00 0.04 -0.87 -2.08 116.94 115.15 2c1x h PHE 406 Ca 0.26 0.00 0.01 0.00 2.80 0.00 0.00 57.97 61.04 2c1x h PHE 406 Cb -0.07 -0.04 -0.02 0.00 2.20 0.00 0.00 35.95 38.03 2c1x h PHE 406 CO -0.02 0.10 -0.12 0.22 -0.60 0.00 0.00 178.31 177.90 2c1x h ASP 407 N 0.08 -0.33 -0.44 2.17 3.58 -1.03 0.12 116.42 120.57 2c1x h ASP 407 Ca 0.03 0.04 0.09 0.00 0.42 0.00 0.00 57.03 57.61 2c1x h ASP 407 Cb 0.03 0.13 -0.08 0.00 1.72 0.00 0.00 39.33 41.13 2c1x h ASP 407 CO -0.01 -0.17 -0.08 1.56 -2.88 0.00 0.00 179.24 177.66 2c1x h GLN 408 N -0.22 0.02 0.09 0.28 4.20 -0.97 0.88 115.11 119.39 2c1x h GLN 408 Ca 0.03 -0.00 -0.14 0.00 0.06 0.00 0.00 58.65 58.60 2c1x h GLN 408 Cb 0.25 -0.01 0.02 0.00 0.30 0.00 0.00 27.48 28.04 2c1x h GLN 408 CO -0.08 0.02 -0.60 0.82 -0.67 0.00 0.00 178.83 178.32 2c1x h ILE 409 N 0.03 1.55 0.02 2.54 2.04 -1.27 -2.38 117.51 120.04 2c1x h ILE 409 Ca 0.21 -2.39 -0.23 0.00 1.00 0.00 0.00 64.86 63.45 2c1x h ILE 409 Cb 0.33 3.12 -0.03 0.00 -0.74 0.00 0.00 36.82 39.49 2c1x h ILE 409 CO -0.43 0.67 -1.17 -0.07 0.00 0.00 0.00 178.15 177.14 2c1x h LEU 410 N -0.45 0.05 0.00 1.44 3.38 -0.68 -3.36 115.31 115.69 2c1x h LEU 410 Ca -0.10 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.81 2c1x h LEU 410 Cb 1.43 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 42.16 2c1x h LEU 410 CO 0.11 1.05 -0.49 -1.20 0.09 0.00 0.00 178.44 178.00 2c1x n SER 411 N -3.32 2.42 -4.79 -0.43 7.64 0.26 -5.00 113.62 110.41 2c1x n SER 411 Ca -0.04 -0.26 -0.27 0.00 1.01 0.00 0.00 58.87 59.31 2c1x n SER 411 Cb 0.97 1.00 -0.06 0.00 -1.01 0.00 0.00 64.21 65.12 2c1x n SER 411 CO 0.00 0.00 0.00 -1.10 -3.01 0.00 0.00 175.04 170.93 2c1x s GLN 412 N -1.50 2.22 0.27 1.43 -1.52 -0.95 -5.01 119.66 114.60 2c1x s GLN 412 Ca 0.00 -2.00 -0.00 0.00 -1.95 0.00 0.00 55.36 51.40 2c1x s GLN 412 Cb 0.00 -1.92 0.50 0.00 -0.22 0.00 0.00 33.01 31.37 2c1x s GLN 412 CO 0.01 -0.30 1.84 1.49 -0.25 0.00 0.00 175.29 178.08 2c1x h GLU 413 N 1.23 0.97 -0.79 2.91 4.57 -1.93 -2.74 114.58 118.81 2c1x h GLU 413 Ca -0.41 -0.06 0.19 0.00 -1.18 0.00 0.00 59.36 57.89 2c1x h GLU 413 Cb 1.28 -0.22 -0.13 0.00 -0.16 0.00 0.00 28.75 29.52 2c1x h GLU 413 CO 0.68 0.64 0.15 -0.22 -1.18 0.00 0.00 179.01 179.08 2c1x h LYS 414 N 1.00 0.20 -0.47 1.92 1.63 -1.94 -0.89 116.57 118.02 2c1x h LYS 414 Ca 0.47 -0.01 -0.07 0.00 -0.85 0.00 0.00 60.65 60.19 2c1x h LYS 414 Cb 0.41 -0.05 -0.02 0.00 -0.60 0.00 0.00 32.23 31.97 2c1x h LYS 414 CO -0.25 0.14 0.01 0.78 -3.45 0.00 0.00 179.45 176.68 2c1x h GLY 415 N 0.21 0.83 1.01 5.01 0.00 -1.10 -0.24 103.07 108.79 2c1x h GLY 415 Ca 0.46 -0.54 -0.01 0.00 0.00 0.00 0.00 47.33 47.23 2c1x h GLY 415 CO -0.60 0.50 0.44 0.50 0.00 0.00 0.00 176.54 177.39 2c1x h LYS 416 N 0.72 1.08 -0.32 4.80 1.57 -1.23 -0.18 116.57 123.03 2c1x h LYS 416 Ca 0.14 -0.12 -0.10 0.00 -1.87 0.00 0.00 60.65 58.70 2c1x h LYS 416 Cb 0.43 -0.22 -0.01 0.00 0.08 0.00 0.00 32.23 32.51 2c1x h LYS 416 CO 0.02 0.79 -0.20 0.87 -0.57 0.00 0.00 179.45 180.36 2c1x h LYS 417 N 1.08 0.69 -0.71 3.15 1.57 -0.90 -1.84 116.57 119.61 2c1x h LYS 417 Ca 0.28 -0.32 -0.01 0.00 -1.87 0.00 0.00 60.65 58.72 2c1x h LYS 417 Cb 0.01 -0.01 -0.03 0.00 0.08 0.00 0.00 32.23 32.28 2c1x h LYS 417 CO -0.05 0.93 0.39 -0.07 -0.57 0.00 0.00 179.45 180.08 2c1x h LEU 418 N 0.46 0.88 -0.98 2.94 3.38 -0.86 -0.01 115.31 121.12 2c1x h LEU 418 Ca 0.07 -0.09 -0.03 0.00 0.09 0.00 0.00 57.88 57.92 2c1x h LEU 418 Cb 0.74 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 41.23 2c1x h LEU 418 CO 0.06 0.72 0.39 0.03 0.09 0.00 0.00 178.44 179.73 2c1x h ARG 419 N 0.97 1.11 -0.29 1.13 3.08 -0.99 -0.07 114.38 119.32 2c1x h ARG 419 Ca 0.25 -0.15 -0.01 0.00 0.07 0.00 0.00 59.98 60.14 2c1x h ARG 419 Cb 0.03 -0.21 -0.01 0.00 0.08 0.00 0.00 29.97 29.86 2c1x h ARG 419 CO -0.04 0.84 0.13 0.93 -1.07 0.00 0.00 179.97 180.76 2c1x h GLU 420 N 1.11 0.43 -0.66 0.04 5.08 -0.70 -1.50 114.58 118.37 2c1x h GLU 420 Ca 0.27 -0.07 0.04 0.00 -1.00 0.00 0.00 59.36 58.60 2c1x h GLU 420 Cb 0.09 -0.07 -0.05 0.00 0.50 0.00 0.00 28.75 29.22 2c1x h GLU 420 CO -0.04 0.43 0.40 -0.91 -1.00 0.00 0.00 179.01 177.89 2c1x h ASN 421 N 0.33 0.63 -0.88 1.42 2.35 -0.70 -2.26 115.58 116.46 2c1x h ASN 421 Ca 0.10 0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.86 2c1x h ASN 421 Cb 0.16 -0.12 -0.04 0.00 0.05 0.00 0.00 38.32 38.36 2c1x h ASN 421 CO -0.01 0.43 0.56 -0.07 -1.65 0.00 0.00 177.43 176.69 2c1x h LEU 422 N 0.76 1.03 -0.60 1.61 3.38 -0.87 -1.25 115.31 119.38 2c1x h LEU 422 Ca 0.28 -0.04 -0.04 0.00 0.09 0.00 0.00 57.88 58.16 2c1x h LEU 422 Cb 0.08 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.55 2c1x h LEU 422 CO -0.13 0.77 0.21 0.03 0.09 0.00 0.00 178.44 179.40 2c1x h ARG 423 N 1.20 0.92 -0.36 1.13 3.08 -0.72 -1.10 114.38 118.53 2c1x h ARG 423 Ca 0.32 -0.19 -0.16 0.00 0.07 0.00 0.00 59.98 60.02 2c1x h ARG 423 Cb -0.10 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 29.80 2c1x h ARG 423 CO -0.07 0.81 -0.41 0.00 -1.07 0.00 0.00 179.97 179.23 2c1x h ALA 424 N 1.07 0.58 -0.26 0.04 0.00 -1.24 -2.44 119.26 117.01 2c1x h ALA 424 Ca 0.20 -0.46 -0.01 0.00 0.00 0.00 0.00 54.91 54.63 2c1x h ALA 424 Cb 0.26 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 2c1x h ALA 424 CO -0.01 0.68 0.13 1.25 0.00 0.00 0.00 179.25 181.30 2c1x h LEU 425 N 0.73 0.34 -0.99 0.00 5.85 -1.10 -2.54 115.31 117.59 2c1x h LEU 425 Ca 0.05 -0.12 0.00 0.00 0.84 0.00 0.00 57.88 58.66 2c1x h LEU 425 Cb 1.00 -0.09 -0.05 0.00 0.37 0.00 0.00 40.66 41.90 2c1x h LEU 425 CO 0.10 0.36 0.60 -0.09 -0.34 0.00 0.00 178.44 179.06 2c1x h ARG 426 N 0.29 1.28 -0.45 1.25 2.43 -1.16 -1.65 114.38 116.38 2c1x h ARG 426 Ca 0.09 -0.10 -0.01 0.00 -0.81 0.00 0.00 59.98 59.15 2c1x h ARG 426 Cb 0.11 -0.28 -0.02 0.00 -0.42 0.00 0.00 29.97 29.36 2c1x h ARG 426 CO -0.01 0.88 0.24 1.49 -1.51 0.00 0.00 179.97 181.06 2c1x h GLU 427 N 1.31 0.62 -0.28 0.20 4.57 -1.33 0.25 114.58 119.92 2c1x h GLU 427 Ca 0.35 -0.07 0.04 0.00 -1.18 0.00 0.00 59.36 58.49 2c1x h GLU 427 Cb -0.09 -0.12 -0.03 0.00 -0.16 0.00 0.00 28.75 28.34 2c1x h GLU 427 CO -0.07 0.50 0.07 1.15 -1.18 0.00 0.00 179.01 179.48 2c1x h THR 428 N 0.58 0.88 -0.48 0.32 2.02 -1.00 -1.10 112.91 114.14 2c1x h THR 428 Ca 0.16 -0.06 0.00 0.00 0.77 0.00 0.00 66.41 67.28 2c1x h THR 428 Cb 0.06 0.69 -0.02 0.00 -1.74 0.00 0.00 68.15 67.14 2c1x h THR 428 CO -0.02 0.03 0.30 0.00 0.37 0.00 0.00 175.52 176.20 2c1x h ALA 429 N 1.20 0.60 -0.79 6.16 0.00 -0.97 -1.17 119.26 124.30 2c1x h ALA 429 Ca 0.13 -0.05 0.02 0.00 0.00 0.00 0.00 54.91 55.01 2c1x h ALA 429 Cb 0.12 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.68 2c1x h ALA 429 CO -0.16 0.08 0.51 -0.44 0.00 0.00 0.00 179.25 179.24 2c1x h ASP 430 N 0.64 0.87 -0.54 0.00 3.32 -0.21 -1.82 116.42 118.68 2c1x h ASP 430 Ca 0.17 -0.01 -0.05 0.00 0.02 0.00 0.00 57.03 57.16 2c1x h ASP 430 Cb -0.03 -0.20 -0.03 0.00 0.22 0.00 0.00 39.33 39.29 2c1x h ASP 430 CO -0.03 0.61 0.15 0.03 -1.72 0.00 0.00 179.24 178.28 2c1x h ARG 431 N 1.02 0.89 -0.30 3.56 3.08 -0.57 -0.85 114.38 121.22 2c1x h ARG 431 Ca 0.30 -0.18 -0.02 0.00 0.07 0.00 0.00 59.98 60.15 2c1x h ARG 431 Cb -0.05 -0.13 -0.02 0.00 0.08 0.00 0.00 29.97 29.85 2c1x h ARG 431 CO -0.09 0.79 0.12 0.00 -1.07 0.00 0.00 179.97 179.72 2c1x h ALA 432 N 1.30 1.64 -0.39 0.04 0.00 -0.38 -2.38 119.26 119.09 2c1x h ALA 432 Ca 0.19 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.01 2c1x h ALA 432 Cb 0.30 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.96 2c1x h ALA 432 CO -0.00 0.29 0.00 1.33 0.00 0.00 0.00 179.25 180.86 2c1x n VAL 433 N -4.41 0.50 -1.81 0.00 0.24 -0.99 -0.89 118.33 110.97 2c1x n VAL 433 Ca 0.01 -0.74 -0.25 0.00 -2.04 0.00 0.00 64.34 61.32 2c1x n VAL 433 Cb 0.13 0.95 0.18 0.00 -1.47 0.00 0.00 33.84 33.63 2c1x n VAL 433 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2c1x n GLY 434 N 1.50 -1.44 3.78 7.63 0.00 -0.35 -4.76 105.19 111.55 2c1x n GLY 434 Ca 0.19 -1.71 -0.41 0.00 0.00 0.00 0.00 46.02 44.10 2c1x n GLY 434 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2c1x s PRO 435 N -5.52 4.06 0.00 1.61 0.02 -1.26 -0.70 135.00 133.20 2c1x s PRO 435 Ca 0.65 2.50 0.00 0.00 0.02 0.00 0.00 61.00 64.18 2c1x s PRO 435 Cb -0.02 -2.92 0.00 0.00 0.02 0.00 0.00 34.50 31.58 2c1x s PRO 435 CO 0.46 -0.55 0.00 1.17 -0.33 0.00 0.00 177.00 177.75 2c1x n LYS 436 N 0.37 -0.58 -1.99 5.54 3.00 -1.26 -4.98 118.16 118.25 2c1x n LYS 436 Ca 0.02 0.14 -0.34 0.00 -0.00 0.00 0.00 58.31 58.13 2c1x n LYS 436 Cb 0.40 -4.17 0.03 0.00 0.00 0.00 0.00 35.03 31.29 2c1x n LYS 436 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.40 177.60 2c1x s GLY 437 N -2.00 2.37 0.24 3.14 0.00 0.12 -4.87 107.32 106.32 2c1x s GLY 437 Ca 0.00 0.66 -0.05 0.00 0.00 0.00 0.00 44.72 45.33 2c1x s GLY 437 CO 0.00 1.02 1.77 1.48 0.00 0.00 0.00 173.10 177.36 2c1x h SER 438 N 0.57 0.45 -0.23 1.64 4.64 -1.75 -1.35 113.55 117.50 2c1x h SER 438 Ca -0.48 0.07 -0.14 0.00 -0.47 0.00 0.00 61.79 60.77 2c1x h SER 438 Cb 1.25 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.34 2c1x h SER 438 CO 0.55 0.23 -0.37 0.28 -0.87 0.00 0.00 176.83 176.65 2c1x h SER 439 N 0.58 0.81 -0.41 4.97 0.02 -1.19 -0.55 113.55 117.79 2c1x h SER 439 Ca 0.38 -0.36 0.00 0.00 -0.84 0.00 0.00 61.79 60.98 2c1x h SER 439 Cb 0.46 -0.23 -0.02 0.00 0.14 0.00 0.00 62.40 62.75 2c1x h SER 439 CO -0.31 1.10 0.27 0.74 -1.14 0.00 0.00 176.83 177.49 2c1x h THR 440 N 0.64 1.11 -0.45 -2.27 2.02 -1.18 0.19 112.91 112.96 2c1x h THR 440 Ca 0.06 -0.20 -0.10 0.00 0.77 0.00 0.00 66.41 66.94 2c1x h THR 440 Cb 0.92 0.51 -0.01 0.00 -1.74 0.00 0.00 68.15 67.82 2c1x h THR 440 CO 0.08 0.10 -0.10 -0.33 0.37 0.00 0.00 175.52 175.65 2c1x h GLU 441 N 0.55 0.86 -0.68 6.66 4.39 -1.09 -2.34 114.58 122.92 2c1x h GLU 441 Ca 0.15 -0.32 -0.01 0.00 0.34 0.00 0.00 59.36 59.52 2c1x h GLU 441 Cb -0.06 -0.05 -0.03 0.00 -0.10 0.00 0.00 28.75 28.50 2c1x h GLU 441 CO -0.03 0.96 0.39 -0.91 -1.16 0.00 0.00 179.01 178.26 2c1x h ASN 442 N 0.69 0.83 -0.22 1.42 2.35 -0.97 -2.37 115.58 117.31 2c1x h ASN 442 Ca 0.11 -0.05 -0.10 0.00 -0.55 0.00 0.00 56.30 55.71 2c1x h ASN 442 Cb 0.64 -0.21 -0.01 0.00 0.05 0.00 0.00 38.32 38.78 2c1x h ASN 442 CO 0.04 0.65 -0.21 0.15 -1.65 0.00 0.00 177.43 176.42 2c1x h PHE 443 N 0.94 0.75 -0.62 1.19 3.57 -0.67 -1.48 116.94 120.62 2c1x h PHE 443 Ca 0.24 -0.16 0.03 0.00 3.53 0.00 0.00 57.97 61.62 2c1x h PHE 443 Cb -0.01 -0.18 -0.04 0.00 2.79 0.00 0.00 35.95 38.51 2c1x h PHE 443 CO 0.00 0.83 0.37 0.82 -2.23 0.00 0.00 178.31 178.10 2c1x h ILE 444 N 0.59 1.05 -0.76 1.41 2.04 -1.07 0.42 117.51 121.19 2c1x h ILE 444 Ca 0.09 -0.25 0.05 0.00 1.00 0.00 0.00 64.86 65.75 2c1x h ILE 444 Cb 0.68 0.27 -0.05 0.00 -0.74 0.00 0.00 36.82 36.97 2c1x h ILE 444 CO 0.05 0.13 0.47 0.74 0.00 0.00 0.00 178.15 179.54 2c1x h THR 445 N 0.72 1.05 -0.30 -0.27 2.02 -0.91 -1.51 112.91 113.72 2c1x h THR 445 Ca 0.25 -0.30 -0.12 0.00 0.77 0.00 0.00 66.41 67.02 2c1x h THR 445 Cb 0.05 0.09 -0.01 0.00 -1.74 0.00 0.00 68.15 66.55 2c1x h THR 445 CO -0.12 0.16 -0.26 0.25 0.37 0.00 0.00 175.52 175.92 2c1x h LEU 446 N 0.88 0.75 -0.81 2.58 5.85 -0.74 -1.08 115.31 122.74 2c1x h LEU 446 Ca 0.32 -0.46 0.10 0.00 0.84 0.00 0.00 57.88 58.68 2c1x h LEU 446 Cb 0.11 -0.21 -0.07 0.00 0.37 0.00 0.00 40.66 40.85 2c1x h LEU 446 CO -0.15 1.05 0.45 0.58 -0.34 0.00 0.00 178.44 180.04 2c1x h VAL 447 N 0.46 0.88 -0.49 1.05 2.07 -0.70 -0.09 116.25 119.42 2c1x h VAL 447 Ca 0.05 -0.26 -0.00 0.00 0.82 0.00 0.00 66.70 67.31 2c1x h VAL 447 Cb 0.83 0.07 -0.02 0.00 -1.52 0.00 0.00 31.29 30.64 2c1x h VAL 447 CO 0.07 0.14 0.30 0.44 0.02 0.00 0.00 177.57 178.53 2c1x h ASP 448 N 0.75 0.59 -0.32 0.57 3.32 -0.93 0.24 116.42 120.64 2c1x h ASP 448 Ca 0.40 -0.06 -0.01 0.00 0.02 0.00 0.00 57.03 57.38 2c1x h ASP 448 Cb 0.40 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 39.78 2c1x h ASP 448 CO -0.26 0.47 0.15 -0.07 -1.72 0.00 0.00 179.24 177.81 2c1x h LEU 449 N 0.66 0.42 -0.87 1.55 3.38 -0.21 -2.99 115.31 117.25 2c1x h LEU 449 Ca 0.18 -0.13 0.00 0.00 0.09 0.00 0.00 57.88 58.02 2c1x h LEU 449 Cb -0.01 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.63 2c1x h LEU 449 CO -0.03 0.43 0.00 -0.37 0.09 0.00 0.00 178.44 178.56 2c1x h VAL 450 N 0.38 0.00 0.00 1.22 -1.51 -0.84 -2.94 116.25 112.56 2c1x h VAL 450 Ca 0.11 -0.68 0.00 0.00 -1.23 0.00 0.00 66.70 64.90 2c1x h VAL 450 Cb 0.13 1.67 0.00 0.00 -2.13 0.00 0.00 31.29 30.96 2c1x h VAL 450 CO -0.01 0.00 0.00 -1.20 -1.23 0.00 0.00 177.57 175.13 2c1x n SER 451 N -3.05 0.61 -4.70 4.19 7.64 0.05 -4.86 113.62 113.49 2c1x n SER 451 Ca 0.02 0.57 -0.42 0.00 1.01 0.00 0.00 58.87 60.05 2c1x n SER 451 Cb 0.39 -0.73 -0.03 0.00 -1.01 0.00 0.00 64.21 62.83 2c1x n SER 451 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 2c1x s LYS 452 N -3.11 4.36 0.97 1.43 1.02 -1.11 -4.69 119.74 118.61 2c1x s LYS 452 Ca 0.10 1.87 -0.12 0.00 0.02 0.00 0.00 55.97 57.84 2c1x s LYS 452 Cb 0.13 -3.40 0.17 0.00 -0.52 0.00 0.00 37.83 34.21 2c1x s LYS 452 CO 0.54 -0.39 1.09 -1.25 -0.92 0.00 0.00 175.35 174.42 2c1x s PRO 453 N 1.51 0.67 0.35 -1.68 0.04 -1.26 -4.82 135.00 129.81 2c1x s PRO 453 Ca 0.61 0.89 -0.29 0.00 0.04 0.00 0.00 61.00 62.25 2c1x s PRO 453 Cb -0.31 -1.74 -0.11 0.00 0.04 0.00 0.00 34.50 32.39 2c1x s PRO 453 CO 0.28 -2.66 1.41 0.21 0.04 0.00 0.00 177.00 176.27 2c1x s LYS 454 N -4.80 4.23 0.47 4.56 2.20 -1.26 -4.97 119.74 120.17 2c1x s LYS 454 Ca 0.65 2.39 -0.24 0.00 -0.36 0.00 0.00 55.97 58.41 2c1x s LYS 454 Cb -0.20 -3.03 -0.08 0.00 -1.51 0.00 0.00 37.83 33.02 2c1x s LYS 454 CO 0.59 -0.37 1.40 -0.25 -0.36 0.00 0.00 175.35 176.36 2c1x n ASP 455 N 0.79 3.11 0.00 1.43 8.00 -1.26 -5.07 116.55 123.55 2c1x n ASP 455 Ca 0.01 1.09 0.08 0.00 0.71 0.00 0.00 54.79 56.67 2c1x n ASP 455 Cb 0.40 -1.59 0.45 0.00 -0.02 0.00 0.00 41.12 40.36 2c1x n ASP 455 CO 0.00 0.00 0.00 1.33 -0.39 0.00 0.00 177.20 178.14