#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1c4x s VAL 4 N 0.00 2.09 -0.10 12.58 1.01 -1.26 -5.14 120.40 129.59 1c4x s VAL 4 Ca 0.00 -2.30 0.04 0.00 0.00 0.00 0.00 61.98 59.72 1c4x s VAL 4 Cb 0.00 -2.20 -0.00 0.00 0.00 0.00 0.00 36.38 34.17 1c4x s VAL 4 CO 0.00 -0.48 -0.23 -1.83 0.00 0.00 0.00 175.10 172.56 1c4x s GLU 5 N -3.59 2.99 -0.35 2.72 -1.05 -1.26 -5.05 118.70 113.11 1c4x s GLU 5 Ca 0.27 -0.87 -0.12 0.00 -0.15 0.00 0.00 54.97 54.10 1c4x s GLU 5 Cb -0.02 -2.30 0.01 0.00 -0.44 0.00 0.00 34.13 31.37 1c4x s GLU 5 CO 0.11 0.22 0.22 0.42 0.95 0.00 0.00 175.26 177.18 1c4x s ILE 6 N 0.25 4.88 0.06 1.83 1.01 -1.26 -4.50 121.20 123.48 1c4x s ILE 6 Ca -0.16 -0.55 -0.29 0.00 0.00 0.00 0.00 60.65 59.66 1c4x s ILE 6 Cb -0.17 -3.60 -0.05 0.00 0.01 0.00 0.00 42.46 38.64 1c4x s ILE 6 CO 0.08 -0.11 0.91 -0.63 0.00 0.00 0.00 174.94 175.19 1c4x s ILE 7 N 1.63 4.66 -0.33 2.92 -1.09 0.13 -4.86 121.20 124.27 1c4x s ILE 7 Ca 0.04 1.94 -0.01 0.00 -2.23 0.00 0.00 60.65 60.39 1c4x s ILE 7 Cb -0.18 -4.26 0.11 0.00 -1.58 0.00 0.00 42.46 36.55 1c4x s ILE 7 CO 0.08 0.29 0.13 -0.70 -1.23 0.00 0.00 174.94 173.52 1c4x s GLU 8 N 0.24 0.67 0.36 2.79 2.12 -1.26 0.80 118.70 124.41 1c4x s GLU 8 Ca 0.46 -1.11 -0.02 0.00 0.36 0.00 0.00 54.97 54.66 1c4x s GLU 8 Cb -0.22 -1.80 0.00 0.00 0.26 0.00 0.00 34.13 32.37 1c4x s GLU 8 CO 0.27 -1.04 0.49 -1.59 -0.54 0.00 0.00 175.26 172.85 1c4x s LYS 9 N 1.50 1.97 0.23 4.30 -2.85 -1.05 -4.94 119.74 118.90 1c4x s LYS 9 Ca 0.11 -1.80 -0.21 0.00 -1.00 0.00 0.00 55.97 53.07 1c4x s LYS 9 Cb -0.18 0.45 -0.08 0.00 -2.06 0.00 0.00 37.83 35.95 1c4x s LYS 9 CO -0.22 -0.82 0.76 1.03 0.10 0.00 0.00 175.35 176.21 1c4x s ARG 10 N -2.94 4.32 0.04 1.78 0.52 -1.26 -1.33 118.95 120.09 1c4x s ARG 10 Ca 0.31 0.96 0.03 0.00 -0.52 0.00 0.00 55.73 56.51 1c4x s ARG 10 Cb -0.01 -2.89 -0.02 0.00 0.52 0.00 0.00 34.95 32.55 1c4x s ARG 10 CO 0.22 0.39 -0.09 -0.06 0.02 0.00 0.00 175.30 175.78 1c4x s PHE 11 N -1.52 0.73 -0.42 -0.53 0.40 0.08 -4.96 117.98 111.76 1c4x s PHE 11 Ca 0.44 -0.46 -0.29 0.00 -0.60 0.00 0.00 56.93 56.02 1c4x s PHE 11 Cb -0.17 -0.44 0.01 0.00 0.51 0.00 0.00 43.02 42.93 1c4x s PHE 11 CO 0.22 -0.06 1.35 -1.25 0.70 0.00 0.00 175.22 176.17 1c4x s PRO 12 N -1.49 3.62 -0.51 0.24 0.04 -1.26 -1.59 135.00 134.06 1c4x s PRO 12 Ca -0.08 0.87 0.06 0.00 0.04 0.00 0.00 61.00 61.89 1c4x s PRO 12 Cb -0.09 -3.99 0.38 0.00 0.04 0.00 0.00 34.50 30.83 1c4x s PRO 12 CO 0.01 -1.51 1.00 -1.13 0.04 0.00 0.00 177.00 175.41 1c4x n SER 13 N 8.55 4.34 0.00 6.66 3.41 -1.26 -4.52 113.62 130.80 1c4x n SER 13 Ca 0.15 -3.64 0.00 0.00 -0.26 0.00 0.00 58.87 55.12 1c4x n SER 13 Cb 0.48 -0.52 0.00 0.00 -0.26 0.00 0.00 64.21 63.91 1c4x n SER 13 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1c4x n GLY 14 N -0.31 -0.00 0.38 5.00 0.00 -1.26 -4.27 105.19 104.72 1c4x n GLY 14 Ca 0.33 -1.10 -0.09 0.00 0.00 0.00 0.00 46.02 45.16 1c4x n GLY 14 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1c4x h THR 15 N 0.00 0.14 -3.18 2.61 2.02 -1.97 -3.39 112.91 109.14 1c4x h THR 15 Ca 0.00 0.00 -0.65 0.00 0.77 0.00 0.00 66.41 66.53 1c4x h THR 15 Cb 0.00 0.14 -0.14 0.00 -1.74 0.00 0.00 68.15 66.41 1c4x h THR 15 CO 0.00 0.00 -0.58 -0.76 0.37 0.00 0.00 175.52 174.55 1c4x s LEU 16 N -10.54 3.79 0.44 2.58 1.02 -1.26 -5.09 118.68 109.61 1c4x s LEU 16 Ca -0.15 0.16 -0.13 0.00 0.02 0.00 0.00 54.13 54.03 1c4x s LEU 16 Cb 0.12 -1.92 -0.07 0.00 0.02 0.00 0.00 46.19 44.35 1c4x s LEU 16 CO 0.66 0.29 0.84 0.00 0.02 0.00 0.00 176.35 178.17 1c4x s ALA 17 N -0.36 3.24 -0.04 4.21 0.00 -1.26 -3.98 121.76 123.57 1c4x s ALA 17 Ca 0.08 -0.04 0.05 0.00 0.00 0.00 0.00 51.96 52.06 1c4x s ALA 17 Cb -0.12 -2.86 -0.01 0.00 0.00 0.00 0.00 23.12 20.13 1c4x s ALA 17 CO 0.02 -0.05 -0.19 -1.54 0.00 0.00 0.00 175.76 174.00 1c4x s SER 18 N -3.03 2.33 0.13 0.00 1.04 -0.62 -0.18 113.70 113.36 1c4x s SER 18 Ca 0.54 -0.38 -0.29 0.00 0.48 0.00 0.00 55.95 56.30 1c4x s SER 18 Cb -0.10 -0.57 -0.06 0.00 0.10 0.00 0.00 66.02 65.38 1c4x s SER 18 CO 0.30 0.18 0.93 -2.28 0.98 0.00 0.00 173.24 173.35 1c4x s HIS 19 N -0.09 3.84 -0.02 5.02 5.04 -1.26 -0.75 115.29 127.07 1c4x s HIS 19 Ca -0.02 1.78 -0.20 0.00 -1.54 0.00 0.00 55.06 55.08 1c4x s HIS 19 Cb -0.11 -3.01 0.04 0.00 0.04 0.00 0.00 32.58 29.54 1c4x s HIS 19 CO 0.02 0.27 0.42 0.00 -2.34 0.00 0.00 174.74 173.11 1c4x s ALA 20 N -0.24 -1.09 -0.22 1.58 0.00 -0.44 -0.76 121.76 120.60 1c4x s ALA 20 Ca 0.45 0.63 -0.15 0.00 0.00 0.00 0.00 51.96 52.88 1c4x s ALA 20 Cb -0.23 0.06 -0.04 0.00 0.00 0.00 0.00 23.12 22.90 1c4x s ALA 20 CO 0.29 -0.30 0.38 -0.51 0.00 0.00 0.00 175.76 175.63 1c4x s LEU 21 N -1.30 4.13 0.07 0.00 1.43 0.17 -2.53 118.68 120.66 1c4x s LEU 21 Ca -0.13 0.45 0.08 0.00 -1.03 0.00 0.00 54.13 53.50 1c4x s LEU 21 Cb -0.04 -2.47 -0.03 0.00 0.03 0.00 0.00 46.19 43.68 1c4x s LEU 21 CO 0.06 -0.09 -0.21 -0.69 0.23 0.00 0.00 176.35 175.65 1c4x s VAL 22 N 1.43 1.74 -0.04 -1.59 1.01 0.24 -0.87 120.40 122.31 1c4x s VAL 22 Ca 0.18 -1.35 -0.29 0.00 0.00 0.00 0.00 61.98 60.52 1c4x s VAL 22 Cb -0.15 -1.53 0.11 0.00 0.00 0.00 0.00 36.38 34.81 1c4x s VAL 22 CO 0.08 0.12 0.90 0.00 0.00 0.00 0.00 175.10 176.21 1c4x s ALA 23 N -0.93 -1.84 0.00 5.51 0.00 -0.95 0.22 121.76 123.77 1c4x s ALA 23 Ca 0.08 1.14 0.00 0.00 0.00 0.00 0.00 51.96 53.17 1c4x s ALA 23 Cb -0.09 0.19 0.00 0.00 0.00 0.00 0.00 23.12 23.22 1c4x s ALA 23 CO 0.03 -0.61 0.00 0.41 0.00 0.00 0.00 175.76 175.59 1c4x n GLY 24 N -0.02 0.79 3.64 0.00 0.00 -1.26 -0.61 105.19 107.73 1c4x n GLY 24 Ca -0.09 -2.04 -0.41 0.00 0.00 0.00 0.00 46.02 43.48 1c4x n GLY 24 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1c4x s ASP 25 N -0.15 6.67 0.00 1.61 2.15 -1.26 -4.88 116.67 120.81 1c4x s ASP 25 Ca 0.00 0.82 0.00 0.00 0.43 0.00 0.00 52.55 53.80 1c4x s ASP 25 Cb 0.00 -2.37 0.00 0.00 -0.30 0.00 0.00 42.92 40.25 1c4x s ASP 25 CO 0.00 -0.39 0.77 -2.65 -0.17 0.00 0.00 175.17 172.73 1c4x n PRO 26 N 5.64 0.00 0.10 4.34 -0.02 -1.26 -0.60 135.00 143.20 1c4x n PRO 26 Ca 0.01 0.30 0.02 0.00 -2.02 0.00 0.00 63.50 61.80 1c4x n PRO 26 Cb 0.49 -1.61 -0.02 0.00 -0.02 0.00 0.00 33.50 32.34 1c4x n PRO 26 CO 0.00 0.00 0.00 0.37 1.98 0.00 0.00 175.50 177.85 1c4x h GLN 27 N 0.00 0.00 -7.32 -0.52 5.75 -1.99 -3.47 115.11 107.57 1c4x h GLN 27 Ca 0.00 0.00 -0.50 0.00 -0.15 0.00 0.00 58.65 58.00 1c4x h GLN 27 Cb 0.22 0.00 0.06 0.00 1.07 0.00 0.00 27.48 28.83 1c4x h GLN 27 CO 0.00 0.39 0.40 -1.12 -2.65 0.00 0.00 178.83 175.85 1c4x s SER 28 N -6.15 6.05 0.61 -0.69 0.01 0.23 -5.00 113.70 108.76 1c4x s SER 28 Ca 0.01 1.52 -0.18 0.00 1.31 0.00 0.00 55.95 58.61 1c4x s SER 28 Cb 0.08 -2.49 -0.06 0.00 0.21 0.00 0.00 66.02 63.77 1c4x s SER 28 CO 0.77 -0.99 0.80 -2.65 0.41 0.00 0.00 173.24 171.58 1c4x n PRO 29 N -2.61 0.71 -3.43 12.44 -0.02 -1.26 -3.87 135.00 136.95 1c4x n PRO 29 Ca 0.07 0.28 -0.28 0.00 -2.02 0.00 0.00 63.50 61.55 1c4x n PRO 29 Cb 0.54 -2.00 -0.03 0.00 -0.02 0.00 0.00 33.50 31.99 1c4x n PRO 29 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1c4x s ALA 30 N -1.61 3.68 -0.07 3.55 0.00 -1.26 0.31 121.76 126.35 1c4x s ALA 30 Ca 0.74 -0.67 -0.03 0.00 0.00 0.00 0.00 51.96 52.00 1c4x s ALA 30 Cb -0.42 -2.20 0.04 0.00 0.00 0.00 0.00 23.12 20.54 1c4x s ALA 30 CO 0.49 0.26 0.14 0.08 0.00 0.00 0.00 175.76 176.74 1c4x s VAL 31 N -2.06 -0.17 -0.17 0.00 1.01 0.29 -0.43 120.40 118.87 1c4x s VAL 31 Ca 0.42 0.30 -0.08 0.00 0.00 0.00 0.00 61.98 62.63 1c4x s VAL 31 Cb -0.11 -0.25 -0.04 0.00 0.00 0.00 0.00 36.38 35.98 1c4x s VAL 31 CO 0.30 0.13 0.09 -0.69 0.00 0.00 0.00 175.10 174.93 1c4x s VAL 32 N 1.89 5.05 -0.20 2.92 1.01 0.06 -0.84 120.40 130.30 1c4x s VAL 32 Ca -0.01 0.06 -0.03 0.00 0.00 0.00 0.00 61.98 61.99 1c4x s VAL 32 Cb -0.12 -3.26 -0.01 0.00 0.00 0.00 0.00 36.38 32.99 1c4x s VAL 32 CO -0.05 0.50 -0.05 -0.76 0.00 0.00 0.00 175.10 174.73 1c4x s LEU 33 N 0.00 2.94 -0.33 3.92 1.02 -0.42 -0.93 118.68 124.88 1c4x s LEU 33 Ca 0.07 -0.33 -0.03 0.00 0.02 0.00 0.00 54.13 53.86 1c4x s LEU 33 Cb -0.12 -1.73 0.06 0.00 0.02 0.00 0.00 46.19 44.42 1c4x s LEU 33 CO 0.00 0.04 0.07 -0.76 0.02 0.00 0.00 176.35 175.72 1c4x s LEU 34 N 1.14 4.29 1.13 1.79 1.43 0.24 -4.03 118.68 124.67 1c4x s LEU 34 Ca 0.02 -1.39 -0.13 0.00 -1.03 0.00 0.00 54.13 51.60 1c4x s LEU 34 Cb -0.15 -1.78 0.26 0.00 0.03 0.00 0.00 46.19 44.56 1c4x s LEU 34 CO -0.01 -0.34 1.04 -1.38 0.23 0.00 0.00 176.35 175.90 1c4x s HIS 35 N 1.27 1.56 0.38 0.29 -3.43 -1.26 -1.49 115.29 112.60 1c4x s HIS 35 Ca -0.01 1.09 -0.02 0.00 -0.80 0.00 0.00 55.06 55.32 1c4x s HIS 35 Cb -0.20 -3.15 0.08 0.00 -1.43 0.00 0.00 32.58 27.88 1c4x s HIS 35 CO -0.01 -3.64 0.52 0.41 -2.00 0.00 0.00 174.74 170.02 1c4x n GLY 36 N 0.24 0.33 0.00 -1.38 0.00 -1.14 -2.41 105.19 100.83 1c4x n GLY 36 Ca 0.03 -1.94 0.00 0.00 0.00 0.00 0.00 46.02 44.12 1c4x n GLY 36 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1c4x n ALA 37 N -3.04 0.00 0.00 4.61 0.00 -1.26 -4.72 120.51 116.10 1c4x n ALA 37 Ca -0.09 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.35 1c4x n ALA 37 Cb 0.29 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.74 1c4x n ALA 37 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1c4x n GLY 38 N 5.00 2.92 3.67 0.00 0.00 -1.26 -4.73 105.19 110.79 1c4x n GLY 38 Ca 0.00 -1.85 -0.42 0.00 0.00 0.00 0.00 46.02 43.74 1c4x n GLY 38 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1c4x s PRO 39 N -3.47 4.16 0.00 1.61 0.02 -1.26 -1.63 135.00 134.43 1c4x s PRO 39 Ca 0.00 2.47 0.00 0.00 0.02 0.00 0.00 61.00 63.49 1c4x s PRO 39 Cb 0.00 -3.92 0.00 0.00 0.02 0.00 0.00 34.50 30.60 1c4x s PRO 39 CO 0.00 -0.87 0.00 0.41 -0.33 0.00 0.00 177.00 176.21 1c4x n GLY 40 N 4.30 0.70 3.76 0.52 0.00 -1.26 -4.85 105.19 108.35 1c4x n GLY 40 Ca 0.18 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.79 1c4x n GLY 40 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1c4x s ALA 41 N -2.59 3.53 -0.10 4.61 0.00 -0.65 -4.97 121.76 121.60 1c4x s ALA 41 Ca 0.00 1.25 -0.30 0.00 0.00 0.00 0.00 51.96 52.91 1c4x s ALA 41 Cb 0.00 -3.49 0.11 0.00 0.00 0.00 0.00 23.12 19.73 1c4x s ALA 41 CO 0.00 -0.64 0.89 -3.38 0.00 0.00 0.00 175.76 172.63 1c4x s HIS 42 N -0.68 -0.44 0.10 0.00 -3.43 -1.26 -3.93 115.29 105.65 1c4x s HIS 42 Ca 0.52 0.69 -0.20 0.00 -0.80 0.00 0.00 55.06 55.27 1c4x s HIS 42 Cb -0.40 0.46 -0.05 0.00 -1.43 0.00 0.00 32.58 31.16 1c4x s HIS 42 CO 0.48 -0.45 1.14 0.00 -2.00 0.00 0.00 174.74 173.91 1c4x n ALA 43 N 0.60 -0.42 -0.31 -1.38 0.00 -1.26 -1.73 120.51 116.01 1c4x n ALA 43 Ca -0.12 0.56 0.16 0.00 0.00 0.00 0.00 53.44 54.03 1c4x n ALA 43 Cb 0.58 -0.03 0.33 0.00 0.00 0.00 0.00 19.45 20.34 1c4x n ALA 43 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1c4x h ALA 44 N 0.20 1.39 -0.28 0.00 0.00 -1.92 -0.14 119.26 118.52 1c4x h ALA 44 Ca 0.10 0.24 -0.10 0.00 0.00 0.00 0.00 54.91 55.16 1c4x h ALA 44 Cb 0.27 0.34 -0.01 0.00 0.00 0.00 0.00 17.79 18.39 1c4x h ALA 44 CO -0.62 -0.53 -0.23 0.66 0.00 0.00 0.00 179.25 178.53 1c4x h SER 45 N 0.17 0.53 0.70 0.00 4.64 -1.72 -1.59 113.55 116.28 1c4x h SER 45 Ca 0.60 -0.18 -0.26 0.00 -0.47 0.00 0.00 61.79 61.48 1c4x h SER 45 Cb 1.27 -0.14 -0.02 0.00 -0.31 0.00 0.00 62.40 63.20 1c4x h SER 45 CO -0.70 0.76 -1.29 0.78 -0.87 0.00 0.00 176.83 175.51 1c4x h ASN 46 N 0.47 0.20 0.00 4.97 -0.26 -1.02 -3.43 115.58 116.51 1c4x h ASN 46 Ca 0.07 -0.25 0.00 0.00 -0.56 0.00 0.00 56.30 55.56 1c4x h ASN 46 Cb 0.66 -0.07 0.00 0.00 -1.06 0.00 0.00 38.32 37.85 1c4x h ASN 46 CO 0.05 1.20 -0.74 0.79 -1.06 0.00 0.00 177.43 177.68 1c4x n TRP 47 N -3.38 0.00 -0.32 1.19 7.02 -0.49 -4.83 117.44 116.63 1c4x n TRP 47 Ca -0.08 0.00 0.01 0.00 -1.02 0.00 0.00 57.50 56.40 1c4x n TRP 47 Cb 1.00 0.00 0.06 0.00 -2.42 0.00 0.00 31.31 29.95 1c4x n TRP 47 CO 0.00 0.00 0.00 -2.13 -2.02 0.00 0.00 177.69 173.54 1c4x n ARG 48 N -1.22 -0.17 -0.11 -0.99 3.00 -0.60 -0.89 116.66 115.68 1c4x n ARG 48 Ca 0.00 1.31 0.17 0.00 -0.00 0.00 0.00 57.85 59.33 1c4x n ARG 48 Cb 0.09 -1.95 0.57 0.00 0.00 0.00 0.00 32.46 31.17 1c4x n ARG 48 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.63 176.28 1c4x h PRO 49 N 0.00 0.27 -0.03 -0.14 0.11 -1.90 -2.60 132.00 127.71 1c4x h PRO 49 Ca 0.32 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.42 1c4x h PRO 49 Cb 0.54 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 31.59 1c4x h PRO 49 CO -0.85 0.18 -0.02 0.44 -0.21 0.00 0.00 178.00 177.54 1c4x n ILE 50 N -4.44 0.00 -0.12 4.15 -5.35 -0.07 -4.55 119.36 108.99 1c4x n ILE 50 Ca 0.13 -0.49 -0.10 0.00 -0.27 0.00 0.00 62.75 62.02 1c4x n ILE 50 Cb 0.55 1.44 -0.02 0.00 -1.74 0.00 0.00 39.64 39.87 1c4x n ILE 50 CO 0.00 0.00 0.00 0.40 -1.76 0.00 0.00 176.55 175.19 1c4x h ILE 51 N 4.13 1.21 -0.84 7.28 2.04 -1.12 -2.73 117.51 127.48 1c4x h ILE 51 Ca 0.00 -0.69 0.16 0.00 1.00 0.00 0.00 64.86 65.33 1c4x h ILE 51 Cb 0.89 1.01 -0.10 0.00 -0.74 0.00 0.00 36.82 37.87 1c4x h ILE 51 CO 0.00 0.24 0.40 -0.65 0.00 0.00 0.00 178.15 178.13 1c4x h PRO 52 N 0.41 0.52 -0.64 2.37 0.11 -1.80 0.32 132.00 133.29 1c4x h PRO 52 Ca 0.11 -0.03 -0.07 0.00 0.11 0.00 0.00 66.00 66.12 1c4x h PRO 52 Cb 0.26 -0.12 -0.03 0.00 0.11 0.00 0.00 31.00 31.23 1c4x h PRO 52 CO -0.00 0.34 0.12 -0.44 -0.21 0.00 0.00 178.00 177.81 1c4x h ASP 53 N 0.53 0.97 -0.15 -2.05 5.19 -1.82 -2.73 116.42 116.37 1c4x h ASP 53 Ca 0.48 -0.21 -0.21 0.00 -0.62 0.00 0.00 57.03 56.46 1c4x h ASP 53 Cb 0.75 -0.26 0.01 0.00 0.18 0.00 0.00 39.33 40.01 1c4x h ASP 53 CO -0.41 0.96 -0.73 -0.07 -3.12 0.00 0.00 179.24 175.87 1c4x h LEU 54 N 0.97 0.90 -2.35 1.55 -0.00 -0.76 -3.14 115.31 112.48 1c4x h LEU 54 Ca 0.20 -0.63 0.03 0.00 -0.00 0.00 0.00 57.88 57.48 1c4x h LEU 54 Cb 0.39 -0.27 -0.00 0.00 -0.00 0.00 0.00 40.66 40.78 1c4x h LEU 54 CO 0.01 1.38 0.17 0.00 -0.00 0.00 0.00 178.44 180.00 1c4x h ALA 55 N 0.54 1.58 -0.08 1.53 0.00 -0.28 0.47 119.26 123.03 1c4x h ALA 55 Ca -0.05 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.86 1c4x h ALA 55 Cb 1.36 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 19.15 1c4x h ALA 55 CO 0.15 -0.23 0.04 1.49 0.00 0.00 0.00 179.25 180.71 1c4x h GLU 56 N 0.00 0.11 0.00 0.00 4.81 -1.43 -3.28 114.58 114.78 1c4x h GLU 56 Ca 0.05 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.28 1c4x h GLU 56 Cb 0.39 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.75 1c4x h GLU 56 CO -0.00 0.08 -0.25 0.09 -0.73 0.00 0.00 179.01 178.20 1c4x n ASN 57 N -4.52 1.27 -4.30 1.04 3.02 -0.90 -5.00 115.26 105.88 1c4x n ASN 57 Ca -0.02 -0.18 -0.20 0.00 -0.03 0.00 0.00 54.58 54.15 1c4x n ASN 57 Cb 0.09 0.62 -0.11 0.00 -0.61 0.00 0.00 39.78 39.77 1c4x n ASN 57 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 1c4x s PHE 58 N -0.87 1.64 -0.40 3.10 0.40 0.11 -4.30 117.98 117.65 1c4x s PHE 58 Ca 0.00 -0.52 -0.24 0.00 -0.60 0.00 0.00 56.93 55.57 1c4x s PHE 58 Cb 0.00 -0.82 0.02 0.00 0.51 0.00 0.00 43.02 42.73 1c4x s PHE 58 CO 0.00 0.26 0.83 0.12 0.70 0.00 0.00 175.22 177.13 1c4x s PHE 59 N -2.27 3.05 -0.13 0.36 5.36 0.15 -4.00 117.98 120.49 1c4x s PHE 59 Ca 0.14 0.46 -0.10 0.00 -0.96 0.00 0.00 56.93 56.47 1c4x s PHE 59 Cb -0.04 -3.60 -0.05 0.00 -0.34 0.00 0.00 43.02 38.99 1c4x s PHE 59 CO 0.05 -0.87 0.22 0.08 -1.46 0.00 0.00 175.22 173.24 1c4x s VAL 60 N 3.31 5.36 -0.23 3.12 1.01 0.22 -0.55 120.40 132.65 1c4x s VAL 60 Ca 0.33 0.39 -0.02 0.00 0.00 0.00 0.00 61.98 62.67 1c4x s VAL 60 Cb -0.12 -3.52 0.07 0.00 0.00 0.00 0.00 36.38 32.81 1c4x s VAL 60 CO 0.20 0.52 0.06 -0.69 0.00 0.00 0.00 175.10 175.19 1c4x s VAL 61 N -0.40 0.57 -0.43 2.92 1.01 -0.02 -2.24 120.40 121.82 1c4x s VAL 61 Ca 0.15 -0.79 0.02 0.00 0.00 0.00 0.00 61.98 61.36 1c4x s VAL 61 Cb -0.13 -1.20 0.12 0.00 0.00 0.00 0.00 36.38 35.17 1c4x s VAL 61 CO 0.04 -0.37 0.17 0.00 0.00 0.00 0.00 175.10 174.94 1c4x s ALA 62 N 1.81 3.11 0.50 5.51 0.00 -0.05 -1.30 121.76 131.35 1c4x s ALA 62 Ca 0.02 -2.81 -0.05 0.00 0.00 0.00 0.00 51.96 49.12 1c4x s ALA 62 Cb -0.17 -2.15 -0.03 0.00 0.00 0.00 0.00 23.12 20.77 1c4x s ALA 62 CO -0.15 -1.84 0.81 -1.25 0.00 0.00 0.00 175.76 173.34 1c4x s PRO 63 N 0.51 3.44 -0.44 0.00 0.04 -1.26 -0.65 135.00 136.64 1c4x s PRO 63 Ca 0.13 0.18 -0.21 0.00 0.04 0.00 0.00 61.00 61.13 1c4x s PRO 63 Cb -0.22 -2.35 0.03 0.00 0.04 0.00 0.00 34.50 32.00 1c4x s PRO 63 CO -0.05 -0.30 0.66 -0.51 0.04 0.00 0.00 177.00 176.84 1c4x s ASP 64 N -4.14 6.33 0.38 6.66 1.01 0.06 -4.32 116.67 122.64 1c4x s ASP 64 Ca 0.49 -0.34 -0.27 0.00 0.71 0.00 0.00 52.55 53.13 1c4x s ASP 64 Cb -0.10 -2.33 -0.10 0.00 1.01 0.00 0.00 42.92 41.40 1c4x s ASP 64 CO 0.45 -0.80 1.38 -0.76 0.21 0.00 0.00 175.17 175.65 1c4x s LEU 65 N 2.87 4.31 0.10 1.23 1.43 -1.26 -4.57 118.68 122.79 1c4x s LEU 65 Ca 0.23 2.82 -0.34 0.00 -1.03 0.00 0.00 54.13 55.81 1c4x s LEU 65 Cb -0.14 -3.75 -0.18 0.00 0.03 0.00 0.00 46.19 42.15 1c4x s LEU 65 CO 0.19 -0.79 0.84 -0.38 0.23 0.00 0.00 176.35 176.44 1c4x n ILE 66 N 0.42 0.96 0.00 -0.59 2.08 -1.26 -0.39 119.36 120.58 1c4x n ILE 66 Ca 0.02 -0.24 0.00 0.00 0.56 0.00 0.00 62.75 63.09 1c4x n ILE 66 Cb 0.41 -0.08 0.00 0.00 -0.75 0.00 0.00 39.64 39.22 1c4x n ILE 66 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1c4x n GLY 67 N 1.76 2.56 3.33 7.39 0.00 -1.26 -4.94 105.19 114.03 1c4x n GLY 67 Ca 0.19 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 46.03 1c4x n GLY 67 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1c4x s PHE 68 N -2.69 1.58 0.00 1.61 0.40 0.48 -4.80 117.98 114.56 1c4x s PHE 68 Ca 0.00 -0.73 0.00 0.00 -0.60 0.00 0.00 56.93 55.60 1c4x s PHE 68 Cb 0.00 -0.83 0.00 0.00 0.51 0.00 0.00 43.02 42.70 1c4x s PHE 68 CO 0.00 0.17 0.00 0.41 0.70 0.00 0.00 175.22 176.50 1c4x n GLY 69 N -0.37 1.22 1.71 4.36 0.00 -1.25 -3.48 105.19 107.38 1c4x n GLY 69 Ca -0.08 -0.56 0.04 0.00 0.00 0.00 0.00 46.02 45.42 1c4x n GLY 69 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1c4x n GLN 70 N 1.95 4.13 -1.87 1.61 6.02 -1.26 -4.95 117.38 123.01 1c4x n GLN 70 Ca 0.00 -2.66 -0.29 0.00 -0.01 0.00 0.00 57.00 54.04 1c4x n GLN 70 Cb 0.00 -2.14 0.07 0.00 1.02 0.00 0.00 30.24 29.19 1c4x n GLN 70 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 177.06 174.93 1c4x s SER 71 N -0.68 4.86 0.19 1.08 0.01 -1.23 -4.25 113.70 113.69 1c4x s SER 71 Ca 0.46 0.95 -0.30 0.00 1.31 0.00 0.00 55.95 58.37 1c4x s SER 71 Cb 0.36 -1.58 -0.09 0.00 0.21 0.00 0.00 66.02 64.92 1c4x s SER 71 CO 0.13 -1.70 1.33 -0.70 0.41 0.00 0.00 173.24 172.72 1c4x s GLU 72 N -5.46 4.37 0.15 12.44 2.12 0.74 -4.88 118.70 128.17 1c4x s GLU 72 Ca 0.60 2.08 -0.09 0.00 0.36 0.00 0.00 54.97 57.93 1c4x s GLU 72 Cb -0.11 -3.20 -0.06 0.00 0.26 0.00 0.00 34.13 31.02 1c4x s GLU 72 CO 0.50 -0.30 0.45 0.71 -0.54 0.00 0.00 175.26 176.09 1c4x s TYR 73 N 0.25 3.50 0.63 5.30 1.51 -1.26 -4.62 117.35 122.66 1c4x s TYR 73 Ca 0.58 0.77 -0.13 0.00 -1.01 0.00 0.00 57.07 57.28 1c4x s TYR 73 Cb -0.37 -2.16 -0.02 0.00 -0.11 0.00 0.00 41.96 39.29 1c4x s TYR 73 CO 0.37 0.41 1.04 -1.25 -1.11 0.00 0.00 175.55 175.01 1c4x s PRO 74 N -2.43 3.29 0.07 -1.71 0.04 -1.26 -4.98 135.00 128.02 1c4x s PRO 74 Ca 0.40 0.99 -0.31 0.00 0.04 0.00 0.00 61.00 62.12 1c4x s PRO 74 Cb -0.13 -2.04 -0.18 0.00 0.04 0.00 0.00 34.50 32.20 1c4x s PRO 74 CO 0.21 -0.82 1.62 0.93 0.04 0.00 0.00 177.00 178.98 1c4x h GLU 75 N -0.12 -0.68 -6.10 4.56 5.08 -2.04 -3.43 114.58 111.85 1c4x h GLU 75 Ca -0.45 0.05 -0.56 0.00 -1.00 0.00 0.00 59.36 57.40 1c4x h GLU 75 Cb 1.21 0.16 -0.04 0.00 0.50 0.00 0.00 28.75 30.57 1c4x h GLU 75 CO 0.58 -0.45 -0.51 0.95 -1.00 0.00 0.00 179.01 178.59 1c4x s THR 76 N -5.99 5.01 -0.45 1.13 -4.23 -1.26 -5.09 115.64 104.76 1c4x s THR 76 Ca -0.17 -0.81 -0.10 0.00 -1.18 0.00 0.00 61.69 59.44 1c4x s THR 76 Cb 0.04 -3.56 0.10 0.00 1.34 0.00 0.00 72.50 70.42 1c4x s THR 76 CO 0.62 -0.07 0.32 -0.31 -0.54 0.00 0.00 174.62 174.64 1c4x s TYR 77 N -1.71 3.38 0.37 3.99 2.02 -1.26 -5.08 117.35 119.05 1c4x s TYR 77 Ca 0.33 -1.67 -0.24 0.00 -0.37 0.00 0.00 57.07 55.12 1c4x s TYR 77 Cb -0.11 -3.28 -0.14 0.00 -0.40 0.00 0.00 41.96 38.03 1c4x s TYR 77 CO 0.26 -0.93 0.52 -0.35 -1.57 0.00 0.00 175.55 173.48 1c4x n PRO 78 N 4.94 0.48 0.05 -1.71 -0.04 -1.26 -4.94 135.00 132.52 1c4x n PRO 78 Ca -0.09 0.17 0.11 0.00 -0.04 0.00 0.00 63.50 63.65 1c4x n PRO 78 Cb 0.42 -1.39 -0.08 0.00 -0.04 0.00 0.00 33.50 32.41 1c4x n PRO 78 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1c4x n GLY 79 N 1.84 -1.24 3.65 0.55 0.00 -1.26 -4.85 105.19 103.89 1c4x n GLY 79 Ca 0.12 -0.37 -0.35 0.00 0.00 0.00 0.00 46.02 45.42 1c4x n GLY 79 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1c4x s HIS 80 N -3.44 3.28 0.46 1.61 5.65 -1.26 -4.47 115.29 117.12 1c4x s HIS 80 Ca -0.04 0.12 0.22 0.00 0.25 0.00 0.00 55.06 55.61 1c4x s HIS 80 Cb 0.12 -2.11 1.22 0.00 -1.18 0.00 0.00 32.58 30.63 1c4x s HIS 80 CO 0.85 0.17 1.86 0.97 -0.65 0.00 0.00 174.74 177.94 1c4x h ILE 81 N 4.85 0.63 0.00 0.89 6.09 -1.84 -0.15 117.51 127.97 1c4x h ILE 81 Ca -0.38 -0.09 -0.01 0.00 -1.37 0.00 0.00 64.86 63.01 1c4x h ILE 81 Cb 1.16 0.33 -0.00 0.00 0.47 0.00 0.00 36.82 38.79 1c4x h ILE 81 CO 0.71 0.05 -0.07 -0.03 -3.07 0.00 0.00 178.15 175.74 1c4x h MET 82 N 0.27 0.00 -0.31 2.19 4.05 -1.94 -1.31 114.93 117.89 1c4x h MET 82 Ca 0.46 0.00 -0.09 0.00 -0.28 0.00 0.00 59.70 59.79 1c4x h MET 82 Cb 1.37 0.00 -0.01 0.00 -0.80 0.00 0.00 31.60 32.16 1c4x h MET 82 CO -0.13 0.07 -0.17 0.77 0.23 0.00 0.00 176.91 177.67 1c4x h SER 83 N 0.00 0.69 -0.77 1.39 0.02 -1.43 -0.84 113.55 112.61 1c4x h SER 83 Ca -0.00 -0.42 0.01 0.00 -0.84 0.00 0.00 61.79 60.54 1c4x h SER 83 Cb 0.14 -0.19 -0.04 0.00 0.14 0.00 0.00 62.40 62.45 1c4x h SER 83 CO 0.01 0.96 0.51 -0.50 -1.14 0.00 0.00 176.83 176.66 1c4x h TRP 84 N 0.42 0.97 -0.26 3.45 4.06 -1.31 -1.79 115.95 121.48 1c4x h TRP 84 Ca 0.07 0.02 -0.12 0.00 2.06 0.00 0.00 58.89 60.92 1c4x h TRP 84 Cb 0.71 -0.33 -0.00 0.00 -1.00 0.00 0.00 29.16 28.54 1c4x h TRP 84 CO 0.06 0.61 -0.29 0.28 -3.56 0.00 0.00 178.44 175.54 1c4x h VAL 85 N 1.04 1.31 -0.91 1.49 2.07 -1.00 -2.42 116.25 117.83 1c4x h VAL 85 Ca 0.28 -1.46 0.03 0.00 0.82 0.00 0.00 66.70 66.37 1c4x h VAL 85 Cb -0.12 1.65 -0.05 0.00 -1.52 0.00 0.00 31.29 31.24 1c4x h VAL 85 CO -0.06 0.46 0.60 1.23 0.02 0.00 0.00 177.57 179.82 1c4x h GLY 86 N 0.38 1.32 0.94 2.17 0.00 -0.73 0.57 103.07 107.73 1c4x h GLY 86 Ca 0.04 -0.46 -0.01 0.00 0.00 0.00 0.00 47.33 46.90 1c4x h GLY 86 CO 0.07 0.41 0.16 -0.33 0.00 0.00 0.00 176.54 176.85 1c4x h MET 87 N 1.17 0.50 0.00 4.80 2.07 -1.28 -0.61 114.93 121.59 1c4x h MET 87 Ca 0.36 -0.08 -0.08 0.00 -2.07 0.00 0.00 59.70 57.83 1c4x h MET 87 Cb -0.03 -0.09 -0.01 0.00 -1.87 0.00 0.00 31.60 29.60 1c4x h MET 87 CO -0.11 0.46 -0.39 0.00 1.07 0.00 0.00 176.91 177.94 1c4x h ARG 88 N 0.42 0.00 -0.35 1.72 3.08 -1.07 0.37 114.38 118.55 1c4x h ARG 88 Ca 0.12 0.00 -0.14 0.00 0.07 0.00 0.00 59.98 60.03 1c4x h ARG 88 Cb 0.13 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.17 1c4x h ARG 88 CO -0.01 0.39 -0.32 0.28 -1.07 0.00 0.00 179.97 179.24 1c4x h VAL 89 N 0.00 1.28 -0.35 2.04 2.07 -0.46 -1.70 116.25 119.13 1c4x h VAL 89 Ca -0.00 -1.49 -0.12 0.00 0.82 0.00 0.00 66.70 65.91 1c4x h VAL 89 Cb 0.75 1.44 -0.01 0.00 -1.52 0.00 0.00 31.29 31.95 1c4x h VAL 89 CO 0.05 0.49 -0.24 -0.33 0.02 0.00 0.00 177.57 177.56 1c4x h GLU 90 N 0.63 0.78 0.01 1.57 4.39 -0.67 -2.73 114.58 118.56 1c4x h GLU 90 Ca 0.06 -0.38 0.02 0.00 0.34 0.00 0.00 59.36 59.40 1c4x h GLU 90 Cb 0.90 -0.01 -0.03 0.00 -0.10 0.00 0.00 28.75 29.52 1c4x h GLU 90 CO 0.08 1.00 -0.13 0.37 -1.16 0.00 0.00 179.01 179.17 1c4x h GLN 91 N 0.57 -0.21 -0.32 2.33 4.15 -0.16 0.13 115.11 121.59 1c4x h GLN 91 Ca 0.07 0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.51 1c4x h GLN 91 Cb 0.81 0.05 -0.02 0.00 0.21 0.00 0.00 27.48 28.53 1c4x h GLN 91 CO 0.07 -0.14 0.21 0.82 -1.93 0.00 0.00 178.83 177.86 1c4x h ILE 92 N -0.22 1.08 -0.70 2.39 1.08 -1.34 0.11 117.51 119.91 1c4x h ILE 92 Ca 0.04 -0.15 -0.04 0.00 -0.39 0.00 0.00 64.86 64.32 1c4x h ILE 92 Cb 0.28 0.61 -0.03 0.00 -3.07 0.00 0.00 36.82 34.60 1c4x h ILE 92 CO -0.12 0.08 0.28 -0.07 -0.69 0.00 0.00 178.15 177.63 1c4x h LEU 93 N 0.43 0.97 -1.30 1.44 3.38 -1.29 -0.52 115.31 118.42 1c4x h LEU 93 Ca 0.12 -0.17 -0.07 0.00 0.09 0.00 0.00 57.88 57.85 1c4x h LEU 93 Cb -0.05 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.44 1c4x h LEU 93 CO -0.03 0.88 -0.35 1.23 0.09 0.00 0.00 178.44 180.26 1c4x h GLY 94 N 1.01 0.00 1.53 0.83 0.00 -0.36 -0.84 103.07 105.24 1c4x h GLY 94 Ca 0.24 0.00 -0.20 0.00 0.00 0.00 0.00 47.33 47.37 1c4x h GLY 94 CO -0.02 0.00 -0.78 -2.00 0.00 0.00 0.00 176.54 173.74 1c4x h LEU 95 N 0.00 0.55 -0.40 3.11 6.46 -0.15 -1.84 115.31 123.04 1c4x h LEU 95 Ca -0.00 -0.38 -0.16 0.00 -0.12 0.00 0.00 57.88 57.22 1c4x h LEU 95 Cb 0.62 -0.16 -0.01 0.00 -0.73 0.00 0.00 40.66 40.38 1c4x h LEU 95 CO 0.05 1.13 -0.39 0.24 -0.62 0.00 0.00 178.44 178.85 1c4x h MET 96 N 0.30 0.94 0.02 1.25 2.86 -0.69 -2.85 114.93 116.75 1c4x h MET 96 Ca -0.04 -0.49 0.01 0.00 -2.06 0.00 0.00 59.70 57.11 1c4x h MET 96 Cb 1.37 0.02 -0.01 0.00 0.06 0.00 0.00 31.60 33.04 1c4x h MET 96 CO 0.14 1.15 -0.05 -0.91 1.06 0.00 0.00 176.91 178.30 1c4x h ASN 97 N 0.76 -0.13 -0.71 1.22 2.35 -1.10 -1.11 115.58 116.87 1c4x h ASN 97 Ca 0.06 0.02 0.15 0.00 -0.55 0.00 0.00 56.30 55.98 1c4x h ASN 97 Cb 0.98 0.05 -0.11 0.00 0.05 0.00 0.00 38.32 39.30 1c4x h ASN 97 CO 0.10 -0.07 0.16 -0.74 -1.65 0.00 0.00 177.43 175.22 1c4x h HIS 98 N -0.09 0.24 -0.00 1.19 -0.00 -1.23 -0.28 115.15 114.97 1c4x h HIS 98 Ca 0.01 0.04 0.00 0.00 -0.00 0.00 0.00 60.37 60.42 1c4x h HIS 98 Cb 0.10 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 27.52 1c4x h HIS 98 CO -0.11 -0.08 -0.01 1.19 -0.00 0.00 0.00 177.93 178.91 1c4x n PHE 99 N -5.16 0.00 -1.21 5.26 3.01 -0.97 -4.91 117.46 113.48 1c4x n PHE 99 Ca 0.13 0.00 -0.07 0.00 1.01 0.00 0.00 57.45 58.52 1c4x n PHE 99 Cb 0.43 -0.15 -0.03 0.00 -0.01 0.00 0.00 39.48 39.72 1c4x n PHE 99 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1c4x n GLY 100 N 1.17 0.92 3.59 1.37 0.00 -0.12 -4.97 105.19 107.15 1c4x n GLY 100 Ca 0.18 -0.55 -0.43 0.00 0.00 0.00 0.00 46.02 45.22 1c4x n GLY 100 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1c4x s ILE 101 N -2.20 4.45 -0.13 -0.61 1.01 -0.53 -4.91 121.20 118.28 1c4x s ILE 101 Ca 0.00 1.12 -0.29 0.00 0.00 0.00 0.00 60.65 61.48 1c4x s ILE 101 Cb 0.00 -4.44 -0.26 0.00 0.01 0.00 0.00 42.46 37.77 1c4x s ILE 101 CO 0.00 -0.73 0.79 1.05 0.00 0.00 0.00 174.94 176.05 1c4x h GLU 102 N 8.80 0.01 -5.78 2.79 4.11 -1.92 -3.41 114.58 119.18 1c4x h GLU 102 Ca -0.23 -0.02 -0.58 0.00 0.07 0.00 0.00 59.36 58.60 1c4x h GLU 102 Cb 1.07 0.01 -0.30 0.00 0.50 0.00 0.00 28.75 30.03 1c4x h GLU 102 CO 1.03 0.99 -0.85 0.21 0.07 0.00 0.00 179.01 180.47 1c4x s LYS 103 N -2.28 1.61 0.04 1.06 2.47 -1.26 -4.50 119.74 116.88 1c4x s LYS 103 Ca -0.19 -0.68 -0.07 0.00 -1.56 0.00 0.00 55.97 53.47 1c4x s LYS 103 Cb -0.03 -1.53 -0.00 0.00 -1.46 0.00 0.00 37.83 34.81 1c4x s LYS 103 CO 0.69 0.39 0.14 0.45 0.16 0.00 0.00 175.35 177.18 1c4x s SER 104 N -0.37 0.11 0.34 1.43 0.15 -0.19 -4.54 113.70 110.63 1c4x s SER 104 Ca 0.05 -0.44 -0.17 0.00 0.70 0.00 0.00 55.95 56.09 1c4x s SER 104 Cb -0.08 0.25 -0.09 0.00 -1.71 0.00 0.00 66.02 64.39 1c4x s SER 104 CO -0.00 -0.52 0.80 -1.00 1.20 0.00 0.00 173.24 173.71 1c4x s HIS 105 N -2.52 3.39 0.02 3.44 3.76 0.43 -1.41 115.29 122.40 1c4x s HIS 105 Ca -0.06 1.36 0.03 0.00 -0.15 0.00 0.00 55.06 56.24 1c4x s HIS 105 Cb -0.01 -2.64 -0.01 0.00 1.11 0.00 0.00 32.58 31.02 1c4x s HIS 105 CO -0.04 0.07 -0.10 -1.50 -0.85 0.00 0.00 174.74 172.32 1c4x s ILE 106 N -1.98 0.77 -0.04 0.60 2.07 -0.61 -0.76 121.20 121.24 1c4x s ILE 106 Ca 0.55 -0.69 -0.01 0.00 -1.41 0.00 0.00 60.65 59.09 1c4x s ILE 106 Cb -0.11 -0.70 0.03 0.00 0.13 0.00 0.00 42.46 41.81 1c4x s ILE 106 CO 0.17 0.02 0.01 -0.69 -1.91 0.00 0.00 174.94 172.54 1c4x s VAL 107 N -0.62 0.19 0.09 4.00 1.01 -0.11 -2.08 120.40 122.88 1c4x s VAL 107 Ca 0.00 0.16 0.08 0.00 0.00 0.00 0.00 61.98 62.22 1c4x s VAL 107 Cb -0.06 -0.34 -0.03 0.00 0.00 0.00 0.00 36.38 35.95 1c4x s VAL 107 CO 0.00 0.19 -0.20 -0.83 0.00 0.00 0.00 175.10 174.26 1c4x s GLY 108 N 1.55 1.18 -0.12 4.51 0.00 -0.81 -0.59 107.32 113.04 1c4x s GLY 108 Ca -0.02 -1.18 0.02 0.00 0.00 0.00 0.00 44.72 43.54 1c4x s GLY 108 CO -0.03 -1.16 -0.17 0.21 0.00 0.00 0.00 173.10 171.95 1c4x s ASN 109 N -1.71 2.65 1.98 1.64 3.84 -0.56 -2.11 114.94 120.67 1c4x s ASN 109 Ca 0.06 -0.48 0.00 0.00 0.21 0.00 0.00 52.86 52.65 1c4x s ASN 109 Cb -0.10 -1.20 0.00 0.00 -0.55 0.00 0.00 41.25 39.41 1c4x s ASN 109 CO 0.03 0.03 0.00 -0.24 -2.79 0.00 0.00 177.10 174.13 1c4x n SER 110 N 4.21 0.00 0.11 -4.21 2.88 -0.69 -1.20 113.62 114.72 1c4x n SER 110 Ca -0.19 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.35 1c4x n SER 110 Cb 0.51 0.00 0.32 0.00 -0.75 0.00 0.00 64.21 64.29 1c4x n SER 110 CO 0.00 0.00 0.00 0.24 -1.23 0.00 0.00 175.04 174.05 1c4x h MET 111 N 0.00 0.23 0.00 -1.46 2.86 -1.85 -1.27 114.93 113.44 1c4x h MET 111 Ca 0.00 -0.08 0.00 0.00 -2.06 0.00 0.00 59.70 57.56 1c4x h MET 111 Cb 0.00 -0.02 0.00 0.00 0.06 0.00 0.00 31.60 31.64 1c4x h MET 111 CO 0.00 0.48 0.00 0.78 1.06 0.00 0.00 176.91 179.23 1c4x h GLY 112 N 0.97 0.00 1.23 8.32 0.00 -0.79 -1.47 103.07 111.32 1c4x h GLY 112 Ca 0.03 0.00 -0.27 0.00 0.00 0.00 0.00 47.33 47.10 1c4x h GLY 112 CO 0.04 0.00 -1.05 -1.33 0.00 0.00 0.00 176.54 174.20 1c4x h GLY 113 N 1.27 0.76 0.98 4.60 0.00 -1.32 0.87 103.07 110.23 1c4x h GLY 113 Ca 0.00 -1.36 -0.00 0.00 0.00 0.00 0.00 47.33 45.97 1c4x h GLY 113 CO 0.00 1.20 0.16 0.00 0.00 0.00 0.00 176.54 177.90 1c4x h ALA 114 N 0.42 0.33 -0.69 3.60 0.00 -1.20 0.34 119.26 122.06 1c4x h ALA 114 Ca -0.13 -0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.68 1c4x h ALA 114 Cb 1.71 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 19.36 1c4x h ALA 114 CO 0.21 -0.17 0.20 0.28 0.00 0.00 0.00 179.25 179.76 1c4x h VAL 115 N 0.34 1.25 -0.59 0.00 2.07 -1.40 -2.29 116.25 115.63 1c4x h VAL 115 Ca 0.09 -0.89 0.01 0.00 0.82 0.00 0.00 66.70 66.73 1c4x h VAL 115 Cb -0.00 0.51 -0.03 0.00 -1.52 0.00 0.00 31.29 30.25 1c4x h VAL 115 CO -0.02 0.34 0.39 0.74 0.02 0.00 0.00 177.57 179.05 1c4x h THR 116 N 1.02 1.15 -0.65 2.57 2.02 -0.18 -1.03 112.91 117.81 1c4x h THR 116 Ca 0.22 -0.28 -0.01 0.00 0.77 0.00 0.00 66.41 67.11 1c4x h THR 116 Cb 0.31 0.28 -0.03 0.00 -1.74 0.00 0.00 68.15 66.97 1c4x h THR 116 CO -0.01 0.15 0.35 -0.07 0.37 0.00 0.00 175.52 176.31 1c4x h LEU 117 N 0.80 0.82 -0.40 2.58 4.07 -0.61 -2.14 115.31 120.42 1c4x h LEU 117 Ca 0.22 -0.10 -0.02 0.00 0.08 0.00 0.00 57.88 58.06 1c4x h LEU 117 Cb -0.09 -0.21 -0.02 0.00 1.08 0.00 0.00 40.66 41.42 1c4x h LEU 117 CO -0.05 0.68 0.18 1.56 -1.08 0.00 0.00 178.44 179.73 1c4x h GLN 118 N 0.89 0.59 0.07 1.13 1.08 -1.13 -2.06 115.11 115.68 1c4x h GLN 118 Ca 0.23 -0.10 0.01 0.00 -1.45 0.00 0.00 58.65 57.34 1c4x h GLN 118 Cb 0.05 -0.10 -0.02 0.00 -0.05 0.00 0.00 27.48 27.36 1c4x h GLN 118 CO -0.04 0.54 -0.11 -0.07 -0.95 0.00 0.00 178.83 178.21 1c4x h LEU 119 N 0.51 -0.29 -1.54 1.46 3.38 -0.99 0.86 115.31 118.70 1c4x h LEU 119 Ca 0.14 0.04 -0.01 0.00 0.09 0.00 0.00 57.88 58.13 1c4x h LEU 119 Cb 0.16 0.11 -0.00 0.00 0.09 0.00 0.00 40.66 41.02 1c4x h LEU 119 CO -0.01 -0.16 -0.06 -0.37 0.09 0.00 0.00 178.44 177.93 1c4x h VAL 120 N -0.21 0.18 0.07 1.22 -1.51 -1.37 0.34 116.25 114.96 1c4x h VAL 120 Ca 0.02 -0.61 -0.18 0.00 -1.23 0.00 0.00 66.70 64.70 1c4x h VAL 120 Cb 0.23 1.52 0.02 0.00 -2.13 0.00 0.00 31.29 30.92 1c4x h VAL 120 CO -0.06 0.06 -0.73 0.58 -1.23 0.00 0.00 177.57 176.19 1c4x h VAL 121 N 0.00 1.46 0.02 7.19 2.07 -0.84 -2.76 116.25 123.39 1c4x h VAL 121 Ca -0.00 -2.31 -0.12 0.00 0.82 0.00 0.00 66.70 65.09 1c4x h VAL 121 Cb 0.51 2.88 0.01 0.00 -1.52 0.00 0.00 31.29 33.17 1c4x h VAL 121 CO 0.01 0.66 -0.50 -0.33 0.02 0.00 0.00 177.57 177.44 1c4x h GLU 122 N -0.20 0.30 -2.20 1.57 5.08 -0.57 -3.38 114.58 115.17 1c4x h GLU 122 Ca -0.11 -0.35 -0.59 0.00 -1.00 0.00 0.00 59.36 57.31 1c4x h GLU 122 Cb 1.50 0.11 -0.42 0.00 0.50 0.00 0.00 28.75 30.44 1c4x h GLU 122 CO 0.14 1.06 -0.66 0.00 -1.00 0.00 0.00 179.01 178.55 1c4x n ALA 123 N -2.58 4.08 -0.18 3.43 0.00 0.12 -4.93 120.51 120.44 1c4x n ALA 123 Ca -0.11 -4.61 -0.01 0.00 0.00 0.00 0.00 53.44 48.72 1c4x n ALA 123 Cb 0.63 -0.84 0.09 0.00 0.00 0.00 0.00 19.45 19.33 1c4x n ALA 123 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1c4x h PRO 124 N 3.74 0.27 0.00 0.00 0.13 -1.65 -1.50 132.00 132.99 1c4x h PRO 124 Ca 0.17 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 65.28 1c4x h PRO 124 Cb 0.64 -0.06 0.00 0.00 0.13 0.00 0.00 31.00 31.71 1c4x h PRO 124 CO 0.79 0.18 0.00 1.05 -0.23 0.00 0.00 178.00 179.79 1c4x h GLU 125 N 0.28 0.00 -0.00 0.86 9.09 -1.91 -2.57 114.58 120.33 1c4x h GLU 125 Ca 0.29 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.70 1c4x h GLU 125 Cb 0.40 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.50 1c4x h GLU 125 CO -0.35 0.00 -0.20 0.54 0.05 0.00 0.00 179.01 179.05 1c4x n ARG 126 N -2.54 0.13 -4.72 1.06 5.12 -0.56 -4.76 116.66 110.39 1c4x n ARG 126 Ca -0.01 -0.04 -0.25 0.00 -1.93 0.00 0.00 57.85 55.62 1c4x n ARG 126 Cb 0.12 -1.50 -0.15 0.00 -1.16 0.00 0.00 32.46 29.78 1c4x n ARG 126 CO 0.00 0.00 0.00 -0.06 -1.93 0.00 0.00 177.63 175.64 1c4x s PHE 127 N -2.90 1.63 0.00 -1.55 0.40 -0.97 -1.02 117.98 113.57 1c4x s PHE 127 Ca 0.16 -0.33 0.00 0.00 -0.60 0.00 0.00 56.93 56.15 1c4x s PHE 127 Cb 0.19 -1.01 0.00 0.00 0.51 0.00 0.00 43.02 42.70 1c4x s PHE 127 CO 0.58 0.02 0.00 -3.47 0.70 0.00 0.00 175.22 173.05 1c4x n ASP 128 N 2.26 0.00 -4.87 1.36 -0.08 -0.50 -4.87 116.55 109.85 1c4x n ASP 128 Ca -0.16 0.00 -0.37 0.00 -1.51 0.00 0.00 54.79 52.75 1c4x n ASP 128 Cb 0.54 0.00 -0.06 0.00 2.34 0.00 0.00 41.12 43.94 1c4x n ASP 128 CO 0.00 0.00 0.00 -0.54 0.12 0.00 0.00 177.20 176.78 1c4x s LYS 129 N 0.00 3.48 0.11 -0.67 -0.14 -1.26 -4.44 119.74 116.82 1c4x s LYS 129 Ca 0.00 -0.12 0.09 0.00 -1.36 0.00 0.00 55.97 54.58 1c4x s LYS 129 Cb 0.00 -3.20 -0.04 0.00 -1.68 0.00 0.00 37.83 32.91 1c4x s LYS 129 CO 0.00 0.76 -0.19 0.08 -0.76 0.00 0.00 175.35 175.24 1c4x s VAL 130 N -0.98 2.80 -0.09 3.17 1.01 -1.16 -1.58 120.40 123.57 1c4x s VAL 130 Ca 0.15 -1.50 -0.05 0.00 0.00 0.00 0.00 61.98 60.58 1c4x s VAL 130 Cb -0.12 -2.27 0.04 0.00 0.00 0.00 0.00 36.38 34.03 1c4x s VAL 130 CO 0.04 0.12 0.21 0.00 0.00 0.00 0.00 175.10 175.47 1c4x s ALA 131 N -1.12 -0.47 0.05 5.51 0.00 -0.88 -2.09 121.76 122.76 1c4x s ALA 131 Ca 0.17 0.83 0.06 0.00 0.00 0.00 0.00 51.96 53.03 1c4x s ALA 131 Cb -0.11 -0.53 -0.02 0.00 0.00 0.00 0.00 23.12 22.46 1c4x s ALA 131 CO 0.09 -0.17 -0.17 -0.51 0.00 0.00 0.00 175.76 175.01 1c4x s LEU 132 N 1.03 2.20 -0.05 0.00 1.43 -0.65 -1.92 118.68 120.73 1c4x s LEU 132 Ca -0.08 -0.52 0.01 0.00 -1.03 0.00 0.00 54.13 52.51 1c4x s LEU 132 Cb -0.09 -0.72 0.02 0.00 0.03 0.00 0.00 46.19 45.43 1c4x s LEU 132 CO -0.06 0.06 -0.03 0.00 0.23 0.00 0.00 176.35 176.54 1c4x s MET 133 N -1.31 0.73 -1.60 1.70 0.23 -0.90 0.26 119.30 118.41 1c4x s MET 133 Ca 0.03 -0.05 -0.18 0.00 -1.03 0.00 0.00 55.69 54.47 1c4x s MET 133 Cb -0.09 -0.82 0.16 0.00 -1.53 0.00 0.00 34.83 32.55 1c4x s MET 133 CO 0.02 -0.12 0.68 0.41 -2.03 0.00 0.00 175.02 173.98 1c4x n GLY 134 N 4.23 -0.45 3.73 3.16 0.00 -0.58 -1.70 105.19 113.58 1c4x n GLY 134 Ca -0.22 0.11 -0.32 0.00 0.00 0.00 0.00 46.02 45.59 1c4x n GLY 134 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1c4x s SER 135 N -3.13 3.89 -0.02 1.61 0.15 -1.26 -3.06 113.70 111.88 1c4x s SER 135 Ca 0.68 2.04 0.03 0.00 0.70 0.00 0.00 55.95 59.41 1c4x s SER 135 Cb -0.38 -2.55 0.05 0.00 -1.71 0.00 0.00 66.02 61.43 1c4x s SER 135 CO 0.84 -2.45 0.96 1.33 1.20 0.00 0.00 173.24 175.12 1c4x n VAL 136 N -3.62 0.99 0.68 4.45 0.24 -1.05 -4.64 118.33 115.38 1c4x n VAL 136 Ca 0.11 -1.05 0.00 0.00 -2.04 0.00 0.00 64.34 61.35 1c4x n VAL 136 Cb 0.52 0.44 0.00 0.00 -1.47 0.00 0.00 33.84 33.34 1c4x n VAL 136 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1c4x n GLY 137 N -0.57 1.31 3.24 7.63 0.00 -1.26 -4.79 105.19 110.75 1c4x n GLY 137 Ca 0.03 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.91 1c4x n GLY 137 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1c4x s ALA 138 N 0.10 1.36 0.39 4.61 0.00 -1.26 -2.18 121.76 124.77 1c4x s ALA 138 Ca 0.00 -1.60 -0.27 0.00 0.00 0.00 0.00 51.96 50.10 1c4x s ALA 138 Cb 0.00 0.56 -0.09 0.00 0.00 0.00 0.00 23.12 23.59 1c4x s ALA 138 CO 0.00 -0.32 1.29 -2.14 0.00 0.00 0.00 175.76 174.59 1c4x s PRO 139 N -3.92 4.08 -0.12 0.00 0.02 -1.26 -4.87 135.00 128.92 1c4x s PRO 139 Ca 0.24 2.14 -0.03 0.00 0.02 0.00 0.00 61.00 63.38 1c4x s PRO 139 Cb 0.06 -2.83 -0.03 0.00 0.02 0.00 0.00 34.50 31.72 1c4x s PRO 139 CO 0.04 -0.40 -0.01 1.41 -0.33 0.00 0.00 177.00 177.71 1c4x s MET 140 N -2.13 3.34 0.05 5.54 1.75 -1.26 -4.31 119.30 122.28 1c4x s MET 140 Ca 0.55 -0.45 -0.34 0.00 -1.25 0.00 0.00 55.69 54.20 1c4x s MET 140 Cb -0.38 -2.87 -0.19 0.00 2.84 0.00 0.00 34.83 34.24 1c4x s MET 140 CO 0.49 0.48 1.44 -0.97 -0.65 0.00 0.00 175.02 175.80 1c4x h ASN 141 N 5.92 -1.03 -3.56 1.11 -0.00 -1.95 -3.45 115.58 112.63 1c4x h ASN 141 Ca -0.42 0.04 -0.21 0.00 -0.00 0.00 0.00 56.30 55.70 1c4x h ASN 141 Cb 1.19 0.27 -0.29 0.00 -0.00 0.00 0.00 38.32 39.48 1c4x h ASN 141 CO 0.59 -0.70 -0.56 0.00 -0.00 0.00 0.00 177.43 176.76 1c4x s ALA 142 N -5.62 -0.36 -0.28 1.57 0.00 -1.26 -5.12 121.76 110.70 1c4x s ALA 142 Ca -0.18 0.63 -0.29 0.00 0.00 0.00 0.00 51.96 52.13 1c4x s ALA 142 Cb 0.02 -0.40 -0.02 0.00 0.00 0.00 0.00 23.12 22.72 1c4x s ALA 142 CO 0.53 -0.13 1.61 0.50 0.00 0.00 0.00 175.76 178.27 1c4x s ARG 143 N 0.75 3.66 0.64 0.00 3.52 -1.26 -4.93 118.95 121.32 1c4x s ARG 143 Ca -0.05 1.48 -0.18 0.00 -0.13 0.00 0.00 55.73 56.85 1c4x s ARG 143 Cb -0.07 -4.06 -0.03 0.00 -1.56 0.00 0.00 34.95 29.22 1c4x s ARG 143 CO -0.04 -1.46 0.97 -0.35 -0.81 0.00 0.00 175.30 173.61 1c4x n PRO 144 N 7.88 0.79 0.26 5.12 -0.04 -1.26 -4.80 135.00 142.96 1c4x n PRO 144 Ca 0.19 0.32 0.09 0.00 -0.04 0.00 0.00 63.50 64.06 1c4x n PRO 144 Cb 0.46 -2.19 0.67 0.00 -0.04 0.00 0.00 33.50 32.40 1c4x n PRO 144 CO 0.00 0.00 0.00 -1.00 -0.04 0.00 0.00 175.50 174.46 1c4x h PRO 145 N 0.28 0.00 -0.86 0.54 0.13 -1.93 -1.74 132.00 128.42 1c4x h PRO 145 Ca -0.48 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.61 1c4x h PRO 145 Cb 1.36 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.45 1c4x h PRO 145 CO 0.50 0.05 0.41 0.93 -0.23 0.00 0.00 178.00 179.66 1c4x h GLU 146 N 0.00 1.24 -0.03 0.86 3.07 -1.89 -0.42 114.58 117.40 1c4x h GLU 146 Ca -0.00 -0.18 -0.19 0.00 -0.50 0.00 0.00 59.36 58.49 1c4x h GLU 146 Cb 0.11 -0.22 -0.01 0.00 -0.84 0.00 0.00 28.75 27.79 1c4x h GLU 146 CO 0.01 0.95 -0.79 1.25 -1.40 0.00 0.00 179.01 179.03 1c4x h LEU 147 N 1.22 0.36 -0.34 1.33 5.85 -1.59 -2.68 115.31 119.47 1c4x h LEU 147 Ca 0.29 -0.25 -0.10 0.00 0.84 0.00 0.00 57.88 58.66 1c4x h LEU 147 Cb 0.12 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.03 1c4x h LEU 147 CO -0.04 1.01 -0.18 0.00 -0.34 0.00 0.00 178.44 178.89 1c4x h ALA 148 N 0.98 0.48 0.00 1.25 0.00 -1.08 -2.31 119.26 118.59 1c4x h ALA 148 Ca -0.04 -0.35 0.00 0.00 0.00 0.00 0.00 54.91 54.52 1c4x h ALA 148 Cb 1.37 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 19.05 1c4x h ALA 148 CO 0.13 0.41 0.00 0.00 0.00 0.00 0.00 179.25 179.79 1c4x h ARG 149 N 0.50 0.00 0.16 0.00 3.08 -1.08 -2.59 114.38 114.46 1c4x h ARG 149 Ca 0.08 0.00 -0.24 0.00 0.07 0.00 0.00 59.98 59.89 1c4x h ARG 149 Cb 0.72 0.00 0.03 0.00 0.08 0.00 0.00 29.97 30.79 1c4x h ARG 149 CO 0.05 0.00 -1.03 1.25 -1.07 0.00 0.00 179.97 179.17 1c4x h LEU 150 N 0.00 0.62 -1.23 3.04 5.85 -1.15 -3.16 115.31 119.27 1c4x h LEU 150 Ca 0.00 -0.92 -0.08 0.00 0.84 0.00 0.00 57.88 57.72 1c4x h LEU 150 Cb 0.48 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.30 1c4x h LEU 150 CO 0.00 1.49 -0.37 -0.07 -0.34 0.00 0.00 178.44 179.15 1c4x h LEU 151 N -0.15 0.00 -3.84 2.25 3.38 -1.27 -2.87 115.31 112.81 1c4x h LEU 151 Ca -0.17 0.00 -0.39 0.00 0.09 0.00 0.00 57.88 57.40 1c4x h LEU 151 Cb 1.80 0.00 -0.23 0.00 0.09 0.00 0.00 40.66 42.31 1c4x h LEU 151 CO 0.19 0.37 0.46 0.00 0.09 0.00 0.00 178.44 179.55 1c4x n ALA 152 N -2.43 5.14 -0.10 1.53 0.00 -0.99 -4.64 120.51 119.02 1c4x n ALA 152 Ca -0.02 -2.77 -0.03 0.00 0.00 0.00 0.00 53.44 50.62 1c4x n ALA 152 Cb 0.42 -1.30 0.20 0.00 0.00 0.00 0.00 19.45 18.78 1c4x n ALA 152 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 1c4x h PHE 153 N 1.46 0.79 0.00 0.00 3.57 -1.47 -2.74 116.94 118.55 1c4x h PHE 153 Ca 0.48 -0.08 0.00 0.00 3.53 0.00 0.00 57.97 61.90 1c4x h PHE 153 Cb 2.57 -0.23 0.00 0.00 2.79 0.00 0.00 35.95 41.08 1c4x h PHE 153 CO 1.43 0.69 0.00 0.66 -2.23 0.00 0.00 178.31 178.87 1c4x n TYR 154 N -4.26 0.00 0.28 0.41 4.02 -1.26 -1.87 117.16 114.48 1c4x n TYR 154 Ca 0.03 0.00 0.12 0.00 -0.01 0.00 0.00 57.90 58.04 1c4x n TYR 154 Cb 0.25 -0.10 0.20 0.00 -0.02 0.00 0.00 39.34 39.67 1c4x n TYR 154 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1c4x h ALA 155 N 3.06 0.99 -0.44 -0.72 0.00 -1.86 -3.37 119.26 116.92 1c4x h ALA 155 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 54.91 54.68 1c4x h ALA 155 Cb 0.06 0.00 -0.16 0.00 0.00 0.00 0.00 17.79 17.68 1c4x h ALA 155 CO 0.00 0.00 -0.53 -3.47 0.00 0.00 0.00 179.25 175.25 1c4x n ASP 156 N -2.95 -2.86 -1.91 0.00 4.64 -0.78 -5.05 116.55 107.64 1c4x n ASP 156 Ca 0.04 -3.15 -0.09 0.00 -1.38 0.00 0.00 54.79 50.22 1c4x n ASP 156 Cb 0.51 1.64 -0.12 0.00 -1.04 0.00 0.00 41.12 42.11 1c4x n ASP 156 CO 0.00 0.00 0.00 -0.81 -0.82 0.00 0.00 177.20 175.57 1c4x n PRO 157 N 2.03 1.67 -2.05 -0.67 -0.04 -0.93 -4.88 135.00 130.13 1c4x n PRO 157 Ca 0.13 -0.72 -0.29 0.00 -0.04 0.00 0.00 63.50 62.57 1c4x n PRO 157 Cb 0.60 -1.75 0.04 0.00 -0.04 0.00 0.00 33.50 32.35 1c4x n PRO 157 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 1c4x s ARG 158 N 0.88 2.84 0.10 0.54 0.52 -1.26 -4.98 118.95 117.59 1c4x s ARG 158 Ca 0.49 0.30 -0.14 0.00 -0.52 0.00 0.00 55.73 55.85 1c4x s ARG 158 Cb 0.23 -2.10 -0.10 0.00 0.52 0.00 0.00 34.95 33.50 1c4x s ARG 158 CO 0.00 -0.95 1.39 1.25 0.02 0.00 0.00 175.30 177.01 1c4x h LEU 159 N -0.52 0.82 0.23 2.53 5.85 -1.99 -2.89 115.31 119.33 1c4x h LEU 159 Ca -0.45 -0.52 -0.01 0.00 0.84 0.00 0.00 57.88 57.74 1c4x h LEU 159 Cb 1.26 -0.23 0.00 0.00 0.37 0.00 0.00 40.66 42.05 1c4x h LEU 159 CO 0.63 1.18 -0.11 0.71 -0.34 0.00 0.00 178.44 180.51 1c4x h THR 160 N 0.49 0.79 -0.72 1.05 1.35 -1.98 -0.08 112.91 113.81 1c4x h THR 160 Ca 0.02 -0.08 0.14 0.00 -0.55 0.00 0.00 66.41 65.95 1c4x h THR 160 Cb 1.01 0.84 -0.05 0.00 -1.73 0.00 0.00 68.15 68.23 1c4x h THR 160 CO 0.10 0.02 0.49 -0.65 -0.25 0.00 0.00 175.52 175.22 1c4x h PRO 161 N -0.35 0.38 -0.46 4.72 0.11 -1.90 -0.29 132.00 134.22 1c4x h PRO 161 Ca -0.03 -0.02 -0.14 0.00 0.11 0.00 0.00 66.00 65.92 1c4x h PRO 161 Cb 0.27 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 31.28 1c4x h PRO 161 CO 0.05 0.25 -0.26 -0.92 -0.21 0.00 0.00 178.00 176.91 1c4x h TYR 162 N 0.39 1.13 -0.76 0.65 3.20 -1.14 -1.00 116.97 119.43 1c4x h TYR 162 Ca 0.35 -0.29 -0.02 0.00 3.14 0.00 0.00 58.73 61.91 1c4x h TYR 162 Cb 0.82 -0.26 -0.04 0.00 1.54 0.00 0.00 36.73 38.80 1c4x h TYR 162 CO -0.00 1.11 0.38 -0.09 -1.64 0.00 0.00 178.16 177.92 1c4x h ARG 163 N 0.83 1.09 -0.35 1.82 2.43 0.68 -0.19 114.38 120.68 1c4x h ARG 163 Ca 0.10 -0.15 -0.03 0.00 -0.81 0.00 0.00 59.98 59.09 1c4x h ARG 163 Cb 0.84 -0.20 -0.01 0.00 -0.42 0.00 0.00 29.97 30.17 1c4x h ARG 163 CO 0.07 0.84 0.12 0.93 -1.51 0.00 0.00 179.97 180.42 1c4x h GLU 164 N 1.07 0.54 -0.34 0.20 4.39 -1.20 -0.00 114.58 119.23 1c4x h GLU 164 Ca 0.26 -0.11 0.07 0.00 0.34 0.00 0.00 59.36 59.92 1c4x h GLU 164 Cb 0.10 -0.08 -0.06 0.00 -0.10 0.00 0.00 28.75 28.60 1c4x h GLU 164 CO -0.04 0.55 -0.07 1.25 -1.16 0.00 0.00 179.01 179.55 1c4x h LEU 165 N 0.42 -0.28 -0.22 1.33 5.85 -0.60 -1.24 115.31 120.56 1c4x h LEU 165 Ca 0.11 0.10 -0.05 0.00 0.84 0.00 0.00 57.88 58.89 1c4x h LEU 165 Cb 0.23 0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.45 1c4x h LEU 165 CO -0.01 -0.10 -0.04 0.40 -0.34 0.00 0.00 178.44 178.36 1c4x h ILE 166 N 0.02 1.28 -0.82 4.05 1.08 -0.85 -2.92 117.51 119.34 1c4x h ILE 166 Ca 0.16 -1.01 0.18 0.00 -0.39 0.00 0.00 64.86 63.81 1c4x h ILE 166 Cb 0.24 1.49 -0.06 0.00 -3.07 0.00 0.00 36.82 35.43 1c4x h ILE 166 CO -0.34 0.31 0.55 0.45 -0.69 0.00 0.00 178.15 178.43 1c4x h HIS 167 N 0.16 0.46 0.00 1.37 3.86 -0.64 0.92 115.15 121.29 1c4x h HIS 167 Ca 0.06 0.01 0.00 0.00 -1.16 0.00 0.00 60.37 59.28 1c4x h HIS 167 Cb 0.48 -0.14 0.00 0.00 1.06 0.00 0.00 27.41 28.81 1c4x h HIS 167 CO 0.05 0.15 0.00 -1.13 0.86 0.00 0.00 177.93 177.86 1c4x n SER 168 N -4.48 0.00 0.08 2.45 3.41 -0.50 -2.90 113.62 111.68 1c4x n SER 168 Ca 0.17 -0.70 0.10 0.00 -0.26 0.00 0.00 58.87 58.18 1c4x n SER 168 Cb 0.63 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 64.54 1c4x n SER 168 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 1c4x n PHE 169 N -0.98 0.78 -4.47 7.33 3.01 0.32 -4.42 117.46 119.03 1c4x n PHE 169 Ca 0.16 0.23 -0.25 0.00 1.01 0.00 0.00 57.45 58.60 1c4x n PHE 169 Cb 0.07 -0.88 -0.10 0.00 -0.01 0.00 0.00 39.48 38.56 1c4x n PHE 169 CO 0.00 0.00 0.00 0.14 1.01 0.00 0.00 176.76 177.91 1c4x s VAL 170 N -3.36 2.48 -0.02 -4.37 -7.23 -1.14 0.04 120.40 106.80 1c4x s VAL 170 Ca -0.02 -2.23 -0.25 0.00 -1.81 0.00 0.00 61.98 57.67 1c4x s VAL 170 Cb 0.10 -2.55 -0.20 0.00 0.56 0.00 0.00 36.38 34.29 1c4x s VAL 170 CO 0.82 -0.29 1.26 0.22 -0.31 0.00 0.00 175.10 176.79 1c4x h TYR 171 N 2.07 0.04 -3.29 2.82 3.20 -1.86 -3.41 116.97 116.55 1c4x h TYR 171 Ca -0.42 -0.01 -0.62 0.00 3.14 0.00 0.00 58.73 60.82 1c4x h TYR 171 Cb 1.25 -0.01 -0.40 0.00 1.54 0.00 0.00 36.73 39.11 1c4x h TYR 171 CO 0.77 0.53 -0.72 0.34 -1.64 0.00 0.00 178.16 177.44 1c4x s ASP 172 N -5.76 4.17 0.11 -2.11 3.68 -1.26 -4.97 116.67 110.53 1c4x s ASP 172 Ca -0.16 -2.26 -0.20 0.00 2.13 0.00 0.00 52.55 52.07 1c4x s ASP 172 Cb 0.02 -1.23 -0.08 0.00 -1.45 0.00 0.00 42.92 40.17 1c4x s ASP 172 CO 0.68 -0.34 1.72 -0.65 0.13 0.00 0.00 175.17 176.71 1c4x h PRO 173 N 7.35 0.25 -0.98 4.34 0.11 -1.82 -2.99 132.00 138.26 1c4x h PRO 173 Ca -0.07 -0.03 0.30 0.00 0.11 0.00 0.00 66.00 66.31 1c4x h PRO 173 Cb 0.97 -0.05 -0.14 0.00 0.11 0.00 0.00 31.00 31.89 1c4x h PRO 173 CO 0.52 0.23 0.52 0.93 -0.21 0.00 0.00 178.00 179.99 1c4x h GLU 174 N 0.20 0.33 -0.40 1.05 3.07 -1.97 -0.66 114.58 116.21 1c4x h GLU 174 Ca 0.06 -0.02 0.00 0.00 -0.50 0.00 0.00 59.36 58.90 1c4x h GLU 174 Cb 0.05 -0.08 0.00 0.00 -0.84 0.00 0.00 28.75 27.88 1c4x h GLU 174 CO -0.01 0.22 0.00 0.09 -1.40 0.00 0.00 179.01 177.91 1c4x n ASN 175 N -5.06 3.28 -4.66 1.42 3.02 -1.20 -4.94 115.26 107.12 1c4x n ASN 175 Ca 0.29 -1.93 -0.43 0.00 -0.03 0.00 0.00 54.58 52.48 1c4x n ASN 175 Cb 0.90 -0.26 -0.02 0.00 -0.61 0.00 0.00 39.78 39.79 1c4x n ASN 175 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 1c4x s PHE 176 N -1.24 2.80 -0.16 3.10 5.36 -0.26 -4.96 117.98 122.62 1c4x s PHE 176 Ca 0.34 0.95 -0.29 0.00 -0.96 0.00 0.00 56.93 56.97 1c4x s PHE 176 Cb 0.20 -3.54 -0.03 0.00 -0.34 0.00 0.00 43.02 39.30 1c4x s PHE 176 CO 0.27 -1.87 1.60 -1.25 -1.46 0.00 0.00 175.22 172.51 1c4x s PRO 177 N 3.38 3.95 0.00 10.12 0.04 -1.26 -2.70 135.00 148.53 1c4x s PRO 177 Ca 0.57 1.83 0.00 0.00 0.04 0.00 0.00 61.00 63.44 1c4x s PRO 177 Cb -0.23 -4.00 0.00 0.00 0.04 0.00 0.00 34.50 30.31 1c4x s PRO 177 CO 0.17 -1.11 0.00 0.41 0.04 0.00 0.00 177.00 176.51 1c4x n GLY 178 N 4.41 0.94 0.00 0.56 0.00 -1.26 -5.04 105.19 104.81 1c4x n GLY 178 Ca 0.18 -0.03 0.00 0.00 0.00 0.00 0.00 46.02 46.17 1c4x n GLY 178 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1c4x n MET 179 N -2.11 0.00 -0.35 1.61 2.81 -1.10 -0.00 117.12 117.98 1c4x n MET 179 Ca 0.00 0.32 0.17 0.00 -1.81 0.00 0.00 57.70 56.37 1c4x n MET 179 Cb 0.00 -1.23 0.37 0.00 -0.71 0.00 0.00 33.22 31.65 1c4x n MET 179 CO 0.00 0.00 0.00 1.49 1.51 0.00 0.00 175.97 178.97 1c4x h GLU 180 N 0.00 0.59 -0.47 0.03 4.57 -1.95 0.41 114.58 117.77 1c4x h GLU 180 Ca 0.00 -0.04 -0.07 0.00 -1.18 0.00 0.00 59.36 58.07 1c4x h GLU 180 Cb 0.00 -0.13 -0.02 0.00 -0.16 0.00 0.00 28.75 28.44 1c4x h GLU 180 CO 0.00 0.39 0.02 0.93 -1.18 0.00 0.00 179.01 179.17 1c4x h GLU 181 N 0.61 0.81 -0.70 1.92 4.39 -1.98 0.50 114.58 120.14 1c4x h GLU 181 Ca 0.63 -0.25 -0.08 0.00 0.34 0.00 0.00 59.36 60.01 1c4x h GLU 181 Cb 1.17 -0.08 -0.03 0.00 -0.10 0.00 0.00 28.75 29.72 1c4x h GLU 181 CO -0.46 0.86 0.14 0.82 -1.16 0.00 0.00 179.01 179.21 1c4x h ILE 182 N 0.67 1.26 0.77 3.13 2.04 0.26 -2.00 117.51 123.64 1c4x h ILE 182 Ca 0.13 -1.01 -0.04 0.00 1.00 0.00 0.00 64.86 64.94 1c4x h ILE 182 Cb 0.48 0.58 0.01 0.00 -0.74 0.00 0.00 36.82 37.15 1c4x h ILE 182 CO 0.02 0.39 -0.37 0.58 0.00 0.00 0.00 178.15 178.77 1c4x h VAL 183 N 1.06 0.00 -0.00 1.67 2.07 0.04 -1.93 116.25 119.16 1c4x h VAL 183 Ca 0.21 -0.08 0.03 0.00 0.82 0.00 0.00 66.70 67.68 1c4x h VAL 183 Cb 0.41 0.00 -0.03 0.00 -1.52 0.00 0.00 31.29 30.15 1c4x h VAL 183 CO 0.01 0.00 -0.16 0.11 0.02 0.00 0.00 177.57 177.54 1c4x h LYS 184 N -1.11 -0.26 -0.69 1.57 1.57 -0.94 -0.67 116.57 116.05 1c4x h LYS 184 Ca -0.11 0.02 -0.08 0.00 -1.87 0.00 0.00 60.65 58.62 1c4x h LYS 184 Cb 0.79 0.06 -0.03 0.00 0.08 0.00 0.00 32.23 33.13 1c4x h LYS 184 CO 0.17 -0.17 0.13 0.66 -0.57 0.00 0.00 179.45 179.67 1c4x h SER 185 N -0.27 1.07 1.33 0.86 4.64 -1.46 -2.67 113.55 117.05 1c4x h SER 185 Ca 0.05 -0.25 -0.02 0.00 -0.47 0.00 0.00 61.79 61.10 1c4x h SER 185 Cb 0.34 -0.28 -0.00 0.00 -0.31 0.00 0.00 62.40 62.14 1c4x h SER 185 CO -0.16 1.05 -0.12 0.03 -0.87 0.00 0.00 176.83 176.76 1c4x h ARG 186 N 1.06 0.00 -0.07 4.77 2.47 -1.23 -2.96 114.38 118.42 1c4x h ARG 186 Ca 0.21 0.00 -0.15 0.00 -1.26 0.00 0.00 59.98 58.78 1c4x h ARG 186 Cb 0.42 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.72 1c4x h ARG 186 CO 0.01 0.12 -0.63 0.35 0.56 0.00 0.00 179.97 180.38 1c4x h PHE 187 N 0.00 0.33 0.31 3.04 3.04 -0.79 -0.36 116.94 122.52 1c4x h PHE 187 Ca -0.00 -0.13 -0.02 0.00 3.98 0.00 0.00 57.97 61.80 1c4x h PHE 187 Cb 0.81 -0.06 0.00 0.00 2.56 0.00 0.00 35.95 39.27 1c4x h PHE 187 CO 0.00 0.81 -0.15 1.49 -2.02 0.00 0.00 178.31 178.44 1c4x h GLU 188 N 0.18 -0.41 0.15 1.11 4.57 -1.33 -2.60 114.58 116.25 1c4x h GLU 188 Ca -0.01 0.03 -0.00 0.00 -1.18 0.00 0.00 59.36 58.19 1c4x h GLU 188 Cb 1.14 0.09 -0.00 0.00 -0.16 0.00 0.00 28.75 29.82 1c4x h GLU 188 CO 0.10 -0.14 -0.09 0.28 -1.18 0.00 0.00 179.01 177.98 1c4x h VAL 189 N -0.64 0.81 -0.54 0.32 2.07 -1.52 -2.55 116.25 114.20 1c4x h VAL 189 Ca -0.04 0.00 0.16 0.00 0.82 0.00 0.00 66.70 67.63 1c4x h VAL 189 Cb 0.45 0.81 -0.02 0.00 -1.52 0.00 0.00 31.29 31.02 1c4x h VAL 189 CO 0.07 0.00 0.48 0.00 0.02 0.00 0.00 177.57 178.14 1c4x h ALA 190 N 0.62 2.34 -0.00 1.67 0.00 -1.07 -0.13 119.26 122.68 1c4x h ALA 190 Ca -0.01 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1c4x h ALA 190 Cb 0.19 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.02 1c4x h ALA 190 CO 0.02 -0.76 -0.73 0.09 0.00 0.00 0.00 179.25 177.87 1c4x n ASN 191 N -3.93 0.80 -4.62 0.00 3.02 -0.98 -3.88 115.26 105.67 1c4x n ASN 191 Ca 0.10 -0.67 -0.52 0.00 -0.03 0.00 0.00 54.58 53.46 1c4x n ASN 191 Cb 0.70 0.61 -0.06 0.00 -0.61 0.00 0.00 39.78 40.42 1c4x n ASN 191 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1c4x n ASP 192 N -1.43 1.93 -0.33 6.41 4.64 -0.06 -4.62 116.55 123.09 1c4x n ASP 192 Ca 0.05 1.11 0.19 0.00 -1.38 0.00 0.00 54.79 54.76 1c4x n ASP 192 Cb 0.34 -1.21 0.40 0.00 -1.04 0.00 0.00 41.12 39.61 1c4x n ASP 192 CO 0.00 0.00 0.00 -0.65 -0.82 0.00 0.00 177.20 175.73 1c4x h PRO 193 N 5.16 0.35 -0.01 -0.67 0.11 -1.92 0.54 132.00 135.56 1c4x h PRO 193 Ca -0.47 -0.02 -0.22 0.00 0.11 0.00 0.00 66.00 65.40 1c4x h PRO 193 Cb 1.32 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.36 1c4x h PRO 193 CO 0.82 0.23 -0.90 0.93 -0.21 0.00 0.00 178.00 178.87 1c4x h GLU 194 N 0.36 0.41 0.06 1.05 5.08 -1.95 -2.56 114.58 117.02 1c4x h GLU 194 Ca 0.66 -0.42 -0.00 0.00 -1.00 0.00 0.00 59.36 58.59 1c4x h GLU 194 Cb 1.39 0.11 0.00 0.00 0.50 0.00 0.00 28.75 30.76 1c4x h GLU 194 CO -0.58 1.08 -0.03 0.28 -1.00 0.00 0.00 179.01 178.77 1c4x h VAL 195 N 0.24 1.27 -0.06 3.13 2.07 -1.23 -2.88 116.25 118.79 1c4x h VAL 195 Ca -0.07 -1.23 0.02 0.00 0.82 0.00 0.00 66.70 66.24 1c4x h VAL 195 Cb 1.53 2.06 -0.00 0.00 -1.52 0.00 0.00 31.29 33.36 1c4x h VAL 195 CO 0.16 0.30 0.10 -0.09 0.02 0.00 0.00 177.57 178.05 1c4x h ARG 196 N -0.64 0.00 0.48 1.57 9.65 -0.12 1.00 114.38 126.32 1c4x h ARG 196 Ca -0.01 0.00 -0.02 0.00 -1.10 0.00 0.00 59.98 58.85 1c4x h ARG 196 Cb 0.55 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.14 1c4x h ARG 196 CO 0.01 0.00 -0.23 -0.09 2.80 0.00 0.00 179.97 182.46 1c4x h ARG 197 N 0.00 -0.62 -0.54 0.20 9.65 -1.28 -2.24 114.38 119.55 1c4x h ARG 197 Ca 0.03 0.04 -0.07 0.00 -1.10 0.00 0.00 59.98 58.88 1c4x h ARG 197 Cb 0.22 0.14 -0.02 0.00 -1.39 0.00 0.00 29.97 28.92 1c4x h ARG 197 CO -0.00 -0.41 0.06 0.97 2.80 0.00 0.00 179.97 183.38 1c4x h ILE 198 N -1.13 1.26 -0.71 1.20 2.10 -1.26 -3.07 117.51 115.90 1c4x h ILE 198 Ca -0.07 -1.01 0.08 0.00 1.08 0.00 0.00 64.86 64.94 1c4x h ILE 198 Cb 0.49 0.86 -0.07 0.00 -1.09 0.00 0.00 36.82 37.02 1c4x h ILE 198 CO 0.11 0.36 0.38 -0.61 -1.08 0.00 0.00 178.15 177.31 1c4x h GLN 199 N 0.80 0.65 0.15 2.19 5.75 -0.92 -1.28 115.11 122.44 1c4x h GLN 199 Ca 0.16 -0.04 0.02 0.00 -0.15 0.00 0.00 58.65 58.64 1c4x h GLN 199 Cb 0.45 -0.15 -0.03 0.00 1.07 0.00 0.00 27.48 28.83 1c4x h GLN 199 CO 0.02 0.43 -0.29 0.93 -2.65 0.00 0.00 178.83 177.27 1c4x h GLU 200 N 0.67 -0.50 -0.36 1.69 5.08 -1.30 -0.72 114.58 119.12 1c4x h GLU 200 Ca 0.34 0.03 -0.05 0.00 -1.00 0.00 0.00 59.36 58.68 1c4x h GLU 200 Cb 0.30 0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.64 1c4x h GLU 200 CO -0.23 -0.34 0.00 0.28 -1.00 0.00 0.00 179.01 177.72 1c4x h VAL 201 N -0.52 1.20 0.00 3.13 2.07 -1.50 -0.98 116.25 119.65 1c4x h VAL 201 Ca 0.02 -0.82 -0.00 0.00 0.82 0.00 0.00 66.70 66.73 1c4x h VAL 201 Cb 0.54 0.93 0.00 0.00 -1.52 0.00 0.00 31.29 31.24 1c4x h VAL 201 CO -0.15 0.28 -0.00 0.24 0.02 0.00 0.00 177.57 177.96 1c4x h MET 202 N 0.54 -0.00 -0.32 1.57 2.86 -0.81 0.87 114.93 119.64 1c4x h MET 202 Ca 0.11 0.00 -0.07 0.00 -2.06 0.00 0.00 59.70 57.68 1c4x h MET 202 Cb 0.35 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.99 1c4x h MET 202 CO 0.01 0.03 -0.11 0.74 1.06 0.00 0.00 176.91 178.64 1c4x h PHE 203 N -0.03 0.58 -0.62 -0.22 -1.00 -0.96 0.89 116.94 115.58 1c4x h PHE 203 Ca -0.00 -0.09 -0.08 0.00 2.81 0.00 0.00 57.97 60.61 1c4x h PHE 203 Cb 0.03 -0.16 -0.02 0.00 3.61 0.00 0.00 35.95 39.41 1c4x h PHE 203 CO -0.07 0.63 0.07 1.49 -1.61 0.00 0.00 178.31 178.83 1c4x h GLU 204 N 0.50 1.03 -0.22 1.51 4.57 -0.69 -0.23 114.58 121.04 1c4x h GLU 204 Ca 0.09 -0.28 -0.18 0.00 -1.18 0.00 0.00 59.36 57.81 1c4x h GLU 204 Cb 0.49 -0.12 -0.00 0.00 -0.16 0.00 0.00 28.75 28.96 1c4x h GLU 204 CO 0.03 0.96 -0.59 0.66 -1.18 0.00 0.00 179.01 178.89 1c4x h SER 205 N 0.96 0.82 0.44 1.04 4.64 -0.25 -3.26 113.55 117.93 1c4x h SER 205 Ca 0.19 -0.46 -0.02 0.00 -0.47 0.00 0.00 61.79 61.03 1c4x h SER 205 Cb 0.45 -0.24 0.00 0.00 -0.31 0.00 0.00 62.40 62.31 1c4x h SER 205 CO 0.02 1.22 -0.21 0.24 -0.87 0.00 0.00 176.83 177.23 1c4x h MET 206 N 0.54 -0.57 -6.73 4.77 2.86 -0.48 -3.35 114.93 111.98 1c4x h MET 206 Ca 0.00 0.04 -0.52 0.00 -2.06 0.00 0.00 59.70 57.16 1c4x h MET 206 Cb 1.18 0.13 0.05 0.00 0.06 0.00 0.00 31.60 33.01 1c4x h MET 206 CO 0.12 -0.35 0.69 -1.59 1.06 0.00 0.00 176.91 176.84 1c4x s LYS 207 N -5.87 4.34 -0.42 1.72 -2.85 -0.13 -3.24 119.74 113.29 1c4x s LYS 207 Ca -0.16 2.17 -0.21 0.00 -1.00 0.00 0.00 55.97 56.77 1c4x s LYS 207 Cb 0.04 -3.15 0.03 0.00 -2.06 0.00 0.00 37.83 32.69 1c4x s LYS 207 CO 0.62 -0.31 0.57 0.00 0.10 0.00 0.00 175.35 176.34 1c4x n ALA 208 N 2.31 -2.84 0.00 0.59 0.00 -1.26 -4.81 120.51 114.49 1c4x n ALA 208 Ca 0.06 0.92 0.00 0.00 0.00 0.00 0.00 53.44 54.41 1c4x n ALA 208 Cb 0.42 -3.21 0.00 0.00 0.00 0.00 0.00 19.45 16.65 1c4x n ALA 208 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1c4x n GLY 209 N -0.19 -0.52 0.14 0.00 0.00 -1.24 -4.84 105.19 98.55 1c4x n GLY 209 Ca 0.06 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.15 1c4x n GLY 209 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 1c4x h MET 210 N 0.00 0.00 -0.76 1.61 4.05 -1.78 -3.36 114.93 114.69 1c4x h MET 210 Ca 0.00 0.00 0.16 0.00 -0.28 0.00 0.00 59.70 59.58 1c4x h MET 210 Cb 0.00 0.00 -0.10 0.00 -0.80 0.00 0.00 31.60 30.70 1c4x h MET 210 CO 0.00 0.19 0.27 1.49 0.23 0.00 0.00 176.91 179.10 1c4x h GLU 211 N 0.00 0.38 0.00 0.39 4.81 -1.96 0.33 114.58 118.52 1c4x h GLU 211 Ca -0.04 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.17 1c4x h GLU 211 Cb 1.24 -0.08 0.00 0.00 0.63 0.00 0.00 28.75 30.53 1c4x h GLU 211 CO 0.03 0.25 0.20 0.66 -0.73 0.00 0.00 179.01 179.42 1c4x h SER 212 N 0.39 0.00 1.01 1.04 4.64 -2.02 0.15 113.55 118.76 1c4x h SER 212 Ca 0.43 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.75 1c4x h SER 212 Cb 0.70 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.79 1c4x h SER 212 CO -0.45 0.00 0.00 0.18 -0.87 0.00 0.00 176.83 175.69 1c4x n LEU 213 N -2.77 0.42 -4.67 5.97 4.32 0.11 -4.83 117.00 115.55 1c4x n LEU 213 Ca -0.02 0.56 -0.42 0.00 -0.02 0.00 0.00 56.01 56.11 1c4x n LEU 213 Cb 0.25 -0.46 -0.03 0.00 -1.62 0.00 0.00 43.42 41.57 1c4x n LEU 213 CO 0.14 -0.23 1.11 -0.69 -1.22 0.00 0.00 177.39 176.50 1c4x s VAL 214 N -3.10 4.01 0.01 4.08 1.01 0.04 -4.57 120.40 121.87 1c4x s VAL 214 Ca 0.10 1.30 -0.30 0.00 0.00 0.00 0.00 61.98 63.07 1c4x s VAL 214 Cb 0.13 -3.83 -0.04 0.00 0.00 0.00 0.00 36.38 32.64 1c4x s VAL 214 CO 0.48 -0.06 1.08 -0.63 0.00 0.00 0.00 175.10 175.97 1c4x s ILE 215 N 3.02 4.49 0.39 2.22 -1.09 -0.93 -4.98 121.20 124.33 1c4x s ILE 215 Ca 0.60 1.79 -0.27 0.00 -2.23 0.00 0.00 60.65 60.54 1c4x s ILE 215 Cb -0.27 -4.15 -0.10 0.00 -1.58 0.00 0.00 42.46 36.36 1c4x s ILE 215 CO 0.22 0.12 1.47 -2.84 -1.23 0.00 0.00 174.94 172.67 1c4x s PRO 216 N 1.20 4.01 0.33 2.79 0.02 -1.26 -4.82 135.00 137.26 1c4x s PRO 216 Ca 0.55 2.53 0.06 0.00 0.02 0.00 0.00 61.00 64.16 1c4x s PRO 216 Cb -0.24 -2.89 0.74 0.00 0.02 0.00 0.00 34.50 32.12 1c4x s PRO 216 CO 0.27 -0.60 1.84 -1.35 -0.33 0.00 0.00 177.00 176.83 1c4x h PRO 217 N 2.84 0.76 0.00 5.54 0.11 -1.97 0.11 132.00 139.39 1c4x h PRO 217 Ca -0.51 -0.05 -0.02 0.00 0.11 0.00 0.00 66.00 65.53 1c4x h PRO 217 Cb 1.25 -0.17 -0.00 0.00 0.11 0.00 0.00 31.00 32.18 1c4x h PRO 217 CO 0.63 0.51 -0.10 0.00 -0.21 0.00 0.00 178.00 178.82 1c4x h ALA 218 N 1.59 1.76 0.10 -0.75 0.00 -1.94 -0.66 119.26 119.37 1c4x h ALA 218 Ca 0.49 -0.10 -0.17 0.00 0.00 0.00 0.00 54.91 55.14 1c4x h ALA 218 Cb 0.71 -0.02 0.01 0.00 0.00 0.00 0.00 17.79 18.50 1c4x h ALA 218 CO -0.26 0.13 -0.77 1.15 0.00 0.00 0.00 179.25 179.50 1c4x h THR 219 N 0.00 1.47 -0.98 0.00 2.02 -1.17 -3.26 112.91 110.98 1c4x h THR 219 Ca -0.00 -2.47 0.11 0.00 0.77 0.00 0.00 66.41 64.82 1c4x h THR 219 Cb 0.19 3.13 -0.08 0.00 -1.74 0.00 0.00 68.15 69.65 1c4x h THR 219 CO 0.01 0.68 0.63 -0.07 0.37 0.00 0.00 175.52 177.14 1c4x h LEU 220 N -0.51 0.92 0.00 2.58 3.38 -1.04 0.30 115.31 120.95 1c4x h LEU 220 Ca -0.15 0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.86 1c4x h LEU 220 Cb 1.53 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 42.12 1c4x h LEU 220 CO 0.09 0.52 0.00 0.61 0.09 0.00 0.00 178.44 179.75 1c4x n GLY 221 N -1.36 -0.85 0.02 0.83 0.00 -0.28 -2.55 105.19 101.00 1c4x n GLY 221 Ca 0.18 -0.05 0.07 0.00 0.00 0.00 0.00 46.02 46.21 1c4x n GLY 221 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1c4x n ARG 222 N -1.42 0.66 -1.68 1.61 3.00 0.07 -4.34 116.66 114.55 1c4x n ARG 222 Ca 0.04 -0.15 -0.46 0.00 -0.01 0.00 0.00 57.85 57.27 1c4x n ARG 222 Cb 0.13 -1.45 -0.04 0.00 0.00 0.00 0.00 32.46 31.10 1c4x n ARG 222 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.63 178.91 1c4x n LEU 223 N -2.23 3.38 0.11 0.55 4.77 -1.04 -4.86 117.00 117.67 1c4x n LEU 223 Ca -0.07 1.03 0.13 0.00 -0.03 0.00 0.00 56.01 57.06 1c4x n LEU 223 Cb 0.58 -1.43 0.37 0.00 -2.33 0.00 0.00 43.42 40.61 1c4x n LEU 223 CO 0.39 -0.13 0.83 1.55 -1.33 0.00 0.00 177.39 178.70 1c4x h PRO 224 N 7.53 0.00 -7.18 3.23 0.13 -1.93 -3.38 132.00 130.41 1c4x h PRO 224 Ca -0.46 0.00 -0.51 0.00 -0.87 0.00 0.00 66.00 64.16 1c4x h PRO 224 Cb 1.25 0.00 0.09 0.00 0.13 0.00 0.00 31.00 32.48 1c4x h PRO 224 CO 0.92 0.00 0.39 -1.01 -0.23 0.00 0.00 178.00 178.06 1c4x s HIS 225 N -3.11 2.65 -0.57 1.56 3.76 -1.26 -4.90 115.29 113.41 1c4x s HIS 225 Ca 0.10 1.55 -0.21 0.00 -0.15 0.00 0.00 55.06 56.35 1c4x s HIS 225 Cb 0.12 -3.18 0.07 0.00 1.11 0.00 0.00 32.58 30.70 1c4x s HIS 225 CO 0.61 -1.64 0.79 -0.51 -0.85 0.00 0.00 174.74 173.14 1c4x s ASP 226 N -2.44 6.22 -0.08 1.40 1.01 -1.26 -4.17 116.67 117.36 1c4x s ASP 226 Ca 0.68 -0.94 -0.14 0.00 0.71 0.00 0.00 52.55 52.86 1c4x s ASP 226 Cb -0.21 -2.35 -0.05 0.00 1.01 0.00 0.00 42.92 41.32 1c4x s ASP 226 CO 0.39 -1.14 0.36 -0.69 0.21 0.00 0.00 175.17 174.29 1c4x s VAL 227 N 3.26 5.18 -0.27 -1.27 1.01 -0.02 -2.98 120.40 125.31 1c4x s VAL 227 Ca 0.19 0.71 -0.01 0.00 0.00 0.00 0.00 61.98 62.87 1c4x s VAL 227 Cb -0.18 -3.67 0.04 0.00 0.00 0.00 0.00 36.38 32.57 1c4x s VAL 227 CO 0.12 0.49 -0.05 -0.22 0.00 0.00 0.00 175.10 175.44 1c4x s LEU 228 N -0.39 3.48 -0.18 3.92 0.20 -0.89 -2.07 118.68 122.75 1c4x s LEU 228 Ca 0.21 -1.11 -0.12 0.00 0.69 0.00 0.00 54.13 53.80 1c4x s LEU 228 Cb -0.15 -1.66 -0.05 0.00 -0.43 0.00 0.00 46.19 43.91 1c4x s LEU 228 CO 0.09 -0.19 0.21 -0.69 -0.29 0.00 0.00 176.35 175.48 1c4x s VAL 229 N 1.26 5.36 0.06 1.68 1.01 0.31 -1.63 120.40 128.45 1c4x s VAL 229 Ca -0.03 0.36 0.09 0.00 0.00 0.00 0.00 61.98 62.40 1c4x s VAL 229 Cb -0.18 -3.55 -0.03 0.00 0.00 0.00 0.00 36.38 32.62 1c4x s VAL 229 CO -0.03 0.42 -0.26 -0.36 0.00 0.00 0.00 175.10 174.87 1c4x s PHE 230 N 0.37 2.34 -0.22 5.22 0.40 0.14 -1.29 117.98 124.95 1c4x s PHE 230 Ca 0.12 -0.39 -0.15 0.00 -0.60 0.00 0.00 56.93 55.91 1c4x s PHE 230 Cb -0.12 -1.37 0.06 0.00 0.51 0.00 0.00 43.02 42.11 1c4x s PHE 230 CO 0.01 0.18 0.55 -1.58 0.70 0.00 0.00 175.22 175.08 1c4x s HIS 231 N -0.87 -0.76 0.19 0.36 2.46 -0.98 -1.53 115.29 114.16 1c4x s HIS 231 Ca 0.12 1.64 -0.30 0.00 0.47 0.00 0.00 55.06 56.99 1c4x s HIS 231 Cb -0.10 0.37 -0.08 0.00 -0.13 0.00 0.00 32.58 32.64 1c4x s HIS 231 CO 0.03 -0.39 0.99 0.20 -2.47 0.00 0.00 174.74 173.11 1c4x s GLY 232 N 1.09 3.03 0.56 1.59 0.00 -1.26 -1.83 107.32 110.49 1c4x s GLY 232 Ca -0.06 0.67 0.28 0.00 0.00 0.00 0.00 44.72 45.60 1c4x s GLY 232 CO -0.10 1.39 2.17 -0.09 0.00 0.00 0.00 173.10 176.47 1c4x h ARG 233 N 4.75 0.00 -0.30 2.90 2.43 -0.08 -2.56 114.38 121.53 1c4x h ARG 233 Ca -0.44 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.73 1c4x h ARG 233 Cb 1.21 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.76 1c4x h ARG 233 CO 0.70 0.05 0.00 1.04 -1.51 0.00 0.00 179.97 180.25 1c4x n GLN 234 N -3.83 3.05 -1.78 0.20 3.00 -0.13 -5.00 117.38 112.89 1c4x n GLN 234 Ca -0.03 -2.75 -0.43 0.00 -0.01 0.00 0.00 57.00 53.78 1c4x n GLN 234 Cb 0.14 -1.79 -0.03 0.00 0.00 0.00 0.00 30.24 28.56 1c4x n GLN 234 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.06 177.40 1c4x s ASP 235 N -1.72 5.99 0.00 1.08 -1.08 -0.97 -4.54 116.67 115.42 1c4x s ASP 235 Ca 0.40 1.99 0.25 0.00 -0.52 0.00 0.00 52.55 54.67 1c4x s ASP 235 Cb 0.32 -2.52 0.45 0.00 -1.46 0.00 0.00 42.92 39.71 1c4x s ASP 235 CO 0.10 -1.52 1.37 0.54 0.52 0.00 0.00 175.17 176.19 1c4x n ARG 236 N 8.13 0.22 -0.10 4.34 1.74 -1.26 -4.43 116.66 125.30 1c4x n ARG 236 Ca 0.24 -0.14 -0.17 0.00 -0.77 0.00 0.00 57.85 57.01 1c4x n ARG 236 Cb 0.44 -1.50 -0.09 0.00 -1.02 0.00 0.00 32.46 30.30 1c4x n ARG 236 CO 0.00 0.00 0.00 -0.89 -1.52 0.00 0.00 177.63 175.22 1c4x n ILE 237 N -1.27 1.50 -3.89 0.55 2.08 -1.26 -4.58 119.36 112.49 1c4x n ILE 237 Ca 0.07 0.04 -0.35 0.00 0.56 0.00 0.00 62.75 63.06 1c4x n ILE 237 Cb 0.34 -2.14 -0.14 0.00 -0.75 0.00 0.00 39.64 36.95 1c4x n ILE 237 CO 0.00 0.00 0.00 -0.69 0.56 0.00 0.00 176.55 176.42 1c4x s VAL 238 N -2.33 3.17 0.55 1.39 1.01 -1.26 -4.63 120.40 118.30 1c4x s VAL 238 Ca -0.25 -1.16 -0.21 0.00 0.00 0.00 0.00 61.98 60.36 1c4x s VAL 238 Cb 0.05 -2.73 -0.06 0.00 0.00 0.00 0.00 36.38 33.64 1c4x s VAL 238 CO 0.48 -0.00 1.11 -0.81 0.00 0.00 0.00 175.10 175.88 1c4x n PRO 239 N 4.69 1.25 0.33 2.72 -0.04 -1.26 -4.85 135.00 137.84 1c4x n PRO 239 Ca -0.14 0.47 0.18 0.00 -0.04 0.00 0.00 63.50 63.96 1c4x n PRO 239 Cb 0.45 -2.29 0.96 0.00 -0.04 0.00 0.00 33.50 32.58 1c4x n PRO 239 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 1c4x h LEU 240 N 1.00 0.00 -1.72 1.53 5.85 -1.92 -2.35 115.31 117.70 1c4x h LEU 240 Ca -0.49 0.00 0.12 0.00 0.84 0.00 0.00 57.88 58.35 1c4x h LEU 240 Cb 1.34 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 42.33 1c4x h LEU 240 CO 0.54 0.00 0.40 0.44 -0.34 0.00 0.00 178.44 179.48 1c4x h ASP 241 N 0.00 0.28 0.03 1.25 3.45 -1.92 -1.60 116.42 117.92 1c4x h ASP 241 Ca 0.00 0.01 -0.00 0.00 0.43 0.00 0.00 57.03 57.47 1c4x h ASP 241 Cb 0.44 -0.05 0.00 0.00 -0.56 0.00 0.00 39.33 39.16 1c4x h ASP 241 CO -0.00 0.16 -0.02 0.71 -1.57 0.00 0.00 179.24 178.53 1c4x h THR 242 N 0.31 1.12 -0.68 0.35 1.35 -1.61 -1.75 112.91 112.00 1c4x h THR 242 Ca 0.28 -0.48 -0.04 0.00 -0.55 0.00 0.00 66.41 65.62 1c4x h THR 242 Cb 0.68 1.44 -0.03 0.00 -1.73 0.00 0.00 68.15 68.51 1c4x h THR 242 CO -0.07 0.12 0.28 0.28 -0.25 0.00 0.00 175.52 175.89 1c4x h SER 243 N -0.26 0.91 -0.69 5.36 0.02 -1.60 -1.82 113.55 115.48 1c4x h SER 243 Ca -0.00 -0.12 -0.07 0.00 -0.84 0.00 0.00 61.79 60.75 1c4x h SER 243 Cb 0.24 -0.23 -0.03 0.00 0.14 0.00 0.00 62.40 62.51 1c4x h SER 243 CO 0.01 0.80 0.14 -0.07 -1.14 0.00 0.00 176.83 176.58 1c4x h LEU 244 N 0.98 1.07 -0.28 5.07 3.38 -1.24 0.27 115.31 124.55 1c4x h LEU 244 Ca 0.23 -0.24 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 1c4x h LEU 244 Cb 0.17 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.63 1c4x h LEU 244 CO -0.02 1.04 0.11 0.22 0.09 0.00 0.00 178.44 179.88 1c4x h TYR 245 N 1.06 0.42 -0.48 1.13 3.20 -0.93 0.12 116.97 121.49 1c4x h TYR 245 Ca 0.21 -0.03 -0.07 0.00 3.14 0.00 0.00 58.73 61.98 1c4x h TYR 245 Cb 0.40 -0.13 -0.02 0.00 1.54 0.00 0.00 36.73 38.53 1c4x h TYR 245 CO 0.03 0.42 0.01 -0.07 -1.64 0.00 0.00 178.16 176.91 1c4x h LEU 246 N 0.30 0.82 -1.40 2.82 3.38 -1.08 -2.28 115.31 117.88 1c4x h LEU 246 Ca 0.09 -0.30 -0.06 0.00 0.09 0.00 0.00 57.88 57.70 1c4x h LEU 246 Cb 0.17 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 1c4x h LEU 246 CO -0.01 0.92 -0.30 0.74 0.09 0.00 0.00 178.44 179.88 1c4x h THR 247 N 0.70 1.18 -0.15 0.22 2.02 -0.26 -1.86 112.91 114.76 1c4x h THR 247 Ca 0.14 -1.05 -0.15 0.00 0.77 0.00 0.00 66.41 66.11 1c4x h THR 247 Cb 0.50 1.57 0.00 0.00 -1.74 0.00 0.00 68.15 68.48 1c4x h THR 247 CO 0.02 0.30 -0.51 0.50 0.37 0.00 0.00 175.52 176.20 1c4x h LYS 248 N 0.00 0.61 0.00 6.66 3.64 -0.39 -3.38 116.57 123.72 1c4x h LYS 248 Ca -0.00 -0.45 -0.11 0.00 -1.27 0.00 0.00 60.65 58.81 1c4x h LYS 248 Cb 0.55 0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 32.43 1c4x h LYS 248 CO 0.04 1.08 -1.53 0.72 -2.27 0.00 0.00 179.45 177.48 1c4x n HIS 249 N -4.19 0.68 -1.84 1.91 8.25 -0.89 -4.97 115.22 114.17 1c4x n HIS 249 Ca -0.07 0.21 -0.39 0.00 -0.26 0.00 0.00 57.72 57.22 1c4x n HIS 249 Cb 0.60 -0.93 0.03 0.00 1.12 0.00 0.00 29.99 30.81 1c4x n HIS 249 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1c4x s LEU 250 N -5.39 3.93 0.13 2.41 1.43 -0.71 -2.59 118.68 117.89 1c4x s LEU 250 Ca -0.04 2.75 -0.17 0.00 -1.03 0.00 0.00 54.13 55.64 1c4x s LEU 250 Cb 0.10 -4.19 -0.02 0.00 0.03 0.00 0.00 46.19 42.11 1c4x s LEU 250 CO 0.83 -1.40 1.67 0.50 0.23 0.00 0.00 176.35 178.18 1c4x h LYS 251 N 1.74 0.54 -3.88 1.70 3.64 -1.66 -3.40 116.57 115.24 1c4x h LYS 251 Ca -0.51 -0.10 -0.57 0.00 -1.27 0.00 0.00 60.65 58.20 1c4x h LYS 251 Cb 1.29 -0.09 -0.39 0.00 -0.41 0.00 0.00 32.23 32.63 1c4x h LYS 251 CO 0.58 0.52 -0.77 -1.01 -2.27 0.00 0.00 179.45 176.51 1c4x s HIS 252 N -5.55 1.81 0.04 1.91 3.76 -1.26 -5.11 115.29 110.89 1c4x s HIS 252 Ca -0.13 -1.51 -0.15 0.00 -0.15 0.00 0.00 55.06 53.13 1c4x s HIS 252 Cb 0.10 -1.49 0.02 0.00 1.11 0.00 0.00 32.58 32.31 1c4x s HIS 252 CO 0.74 -0.75 0.32 0.00 -0.85 0.00 0.00 174.74 174.20 1c4x s ALA 253 N 1.59 -0.74 -0.06 -1.40 0.00 -1.26 -0.84 121.76 119.05 1c4x s ALA 253 Ca 0.01 0.07 -0.05 0.00 0.00 0.00 0.00 51.96 51.99 1c4x s ALA 253 Cb -0.18 0.31 0.02 0.00 0.00 0.00 0.00 23.12 23.28 1c4x s ALA 253 CO -0.12 -0.41 0.16 -1.21 0.00 0.00 0.00 175.76 174.18 1c4x s GLU 254 N -2.48 0.17 -0.10 0.00 2.02 -0.88 -4.98 118.70 112.46 1c4x s GLU 254 Ca -0.05 0.26 -0.00 0.00 0.02 0.00 0.00 54.97 55.20 1c4x s GLU 254 Cb -0.01 0.03 -0.03 0.00 0.10 0.00 0.00 34.13 34.22 1c4x s GLU 254 CO -0.03 -0.06 -0.07 -1.17 0.02 0.00 0.00 175.26 173.95 1c4x s LEU 255 N 0.35 3.10 -0.11 1.80 2.96 -1.26 -0.53 118.68 124.99 1c4x s LEU 255 Ca -0.02 -0.10 0.01 0.00 -0.22 0.00 0.00 54.13 53.80 1c4x s LEU 255 Cb -0.03 -1.69 0.02 0.00 0.50 0.00 0.00 46.19 44.98 1c4x s LEU 255 CO -0.01 0.29 -0.11 -0.69 -1.32 0.00 0.00 176.35 174.51 1c4x s VAL 256 N -0.37 1.21 -0.35 1.68 1.01 -0.41 -4.98 120.40 118.19 1c4x s VAL 256 Ca 0.05 -0.44 -0.05 0.00 0.00 0.00 0.00 61.98 61.54 1c4x s VAL 256 Cb -0.12 -1.16 0.06 0.00 0.00 0.00 0.00 36.38 35.16 1c4x s VAL 256 CO 0.02 0.39 0.12 -0.69 0.00 0.00 0.00 175.10 174.94 1c4x s VAL 257 N 1.31 3.49 0.37 2.92 1.01 -1.26 -2.33 120.40 125.91 1c4x s VAL 257 Ca -0.01 -1.45 -0.22 0.00 0.00 0.00 0.00 61.98 60.29 1c4x s VAL 257 Cb -0.14 -3.10 -0.10 0.00 0.00 0.00 0.00 36.38 33.04 1c4x s VAL 257 CO -0.05 -0.32 0.91 -0.76 0.00 0.00 0.00 175.10 174.89 1c4x s LEU 258 N 1.30 4.11 0.43 3.92 1.43 -0.76 -4.76 118.68 124.36 1c4x s LEU 258 Ca 0.00 1.68 0.01 0.00 -1.03 0.00 0.00 54.13 54.79 1c4x s LEU 258 Cb -0.21 -4.25 -0.01 0.00 0.03 0.00 0.00 46.19 41.75 1c4x s LEU 258 CO -0.00 -0.22 0.65 -0.62 0.23 0.00 0.00 176.35 176.39 1c4x s ASP 259 N -1.96 5.90 -1.45 2.29 3.68 -1.26 0.27 116.67 124.13 1c4x s ASP 259 Ca 0.56 0.28 -0.06 0.00 2.13 0.00 0.00 52.55 55.47 1c4x s ASP 259 Cb -0.13 -1.58 0.04 0.00 -1.45 0.00 0.00 42.92 39.81 1c4x s ASP 259 CO 0.18 -0.64 0.65 0.54 0.13 0.00 0.00 175.17 176.02 1c4x n ARG 260 N -2.02 -4.07 -3.70 4.34 1.74 -1.26 -4.88 116.66 106.81 1c4x n ARG 260 Ca 0.01 0.49 -0.14 0.00 -0.77 0.00 0.00 57.85 57.44 1c4x n ARG 260 Cb 0.57 -4.95 -0.14 0.00 -1.02 0.00 0.00 32.46 26.93 1c4x n ARG 260 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1c4x n GLY 262 N 4.75 1.44 0.16 0.00 0.00 -1.26 -0.95 105.19 109.32 1c4x n GLY 262 Ca -0.16 -1.26 0.04 0.00 0.00 0.00 0.00 46.02 44.64 1c4x n GLY 262 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 1c4x h HIS 263 N 0.00 0.00 -1.98 1.61 2.76 -0.67 -3.35 115.15 113.52 1c4x h HIS 263 Ca 0.00 0.00 -0.79 0.00 -2.20 0.00 0.00 60.37 57.38 1c4x h HIS 263 Cb 0.00 0.00 -0.24 0.00 1.55 0.00 0.00 27.41 28.72 1c4x h HIS 263 CO 0.00 0.45 1.32 0.91 -1.30 0.00 0.00 177.93 179.31 1c4x n TRP 264 N -3.34 2.72 -0.22 5.26 8.01 -0.99 -4.82 117.44 124.06 1c4x n TRP 264 Ca 0.01 -2.59 0.00 0.00 -1.31 0.00 0.00 57.50 53.62 1c4x n TRP 264 Cb 0.64 -1.34 0.08 0.00 -2.01 0.00 0.00 31.31 28.68 1c4x n TRP 264 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 1c4x h ALA 265 N 4.19 0.49 -0.17 6.99 0.00 -1.90 0.12 119.26 128.97 1c4x h ALA 265 Ca 0.57 0.24 0.05 0.00 0.00 0.00 0.00 54.91 55.77 1c4x h ALA 265 Cb 0.30 0.46 -0.01 0.00 0.00 0.00 0.00 17.79 18.55 1c4x h ALA 265 CO 1.25 -0.42 0.26 -0.56 0.00 0.00 0.00 179.25 179.78 1c4x h GLN 266 N 0.03 0.00 0.00 0.00 -0.00 -1.90 -0.88 115.11 112.35 1c4x h GLN 266 Ca 0.32 0.00 -0.38 0.00 -0.00 0.00 0.00 58.65 58.59 1c4x h GLN 266 Cb 0.50 0.00 -0.07 0.00 -0.00 0.00 0.00 27.48 27.91 1c4x h GLN 266 CO -0.64 0.00 -2.42 1.28 -0.00 0.00 0.00 178.83 177.05 1c4x n LEU 267 N -3.51 1.07 0.08 0.06 4.77 0.25 -4.01 117.00 115.71 1c4x n LEU 267 Ca 0.01 -0.05 -0.13 0.00 -0.03 0.00 0.00 56.01 55.81 1c4x n LEU 267 Cb 0.37 -0.01 -0.13 0.00 -2.33 0.00 0.00 43.42 41.32 1c4x n LEU 267 CO 0.24 0.66 -0.07 -0.33 -1.33 0.00 0.00 177.39 176.55 1c4x h GLU 268 N 0.00 0.18 -1.04 3.23 5.08 -0.55 -3.39 114.58 118.11 1c4x h GLU 268 Ca -0.56 -0.31 -0.41 0.00 -1.00 0.00 0.00 59.36 57.08 1c4x h GLU 268 Cb 2.12 0.12 -0.41 0.00 0.50 0.00 0.00 28.75 31.08 1c4x h GLU 268 CO -0.01 1.11 -1.06 0.54 -1.00 0.00 0.00 179.01 178.58 1c4x n ARG 269 N -3.45 1.86 0.27 2.33 5.12 -0.39 -4.81 116.66 117.59 1c4x n ARG 269 Ca -0.08 -3.62 0.15 0.00 -1.93 0.00 0.00 57.85 52.37 1c4x n ARG 269 Cb 1.01 -1.57 0.74 0.00 -1.16 0.00 0.00 32.46 31.47 1c4x n ARG 269 CO 0.00 0.00 0.00 2.35 -1.93 0.00 0.00 177.63 178.05 1c4x h TRP 270 N 2.82 0.00 -0.31 -1.55 2.91 -1.70 -0.77 115.95 117.34 1c4x h TRP 270 Ca 0.01 0.00 0.02 0.00 1.13 0.00 0.00 58.89 60.05 1c4x h TRP 270 Cb 1.15 0.00 -0.02 0.00 -0.51 0.00 0.00 29.16 29.78 1c4x h TRP 270 CO 0.59 0.09 0.21 0.38 -1.03 0.00 0.00 178.44 178.68 1c4x h ASP 271 N 0.00 0.31 0.00 2.65 2.03 -1.91 0.38 116.42 119.87 1c4x h ASP 271 Ca -0.00 -0.01 -0.40 0.00 -0.73 0.00 0.00 57.03 55.90 1c4x h ASP 271 Cb 0.41 -0.07 -0.07 0.00 -0.83 0.00 0.00 39.33 38.77 1c4x h ASP 271 CO 0.01 0.22 -2.48 0.00 -1.03 0.00 0.00 179.24 175.96 1c4x n ALA 272 N -2.50 1.41 -0.06 4.15 0.00 -0.85 -4.55 120.51 118.10 1c4x n ALA 272 Ca 0.02 -1.10 -0.12 0.00 0.00 0.00 0.00 53.44 52.25 1c4x n ALA 272 Cb 0.12 -0.06 -0.05 0.00 0.00 0.00 0.00 19.45 19.45 1c4x n ALA 272 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 177.50 179.48 1c4x h MET 273 N -0.14 0.34 -0.61 0.00 -1.53 -1.08 -3.10 114.93 108.80 1c4x h MET 273 Ca -0.59 -0.11 0.06 0.00 -3.44 0.00 0.00 59.70 55.62 1c4x h MET 273 Cb 1.85 -0.03 -0.09 0.00 -0.55 0.00 0.00 31.60 32.78 1c4x h MET 273 CO -0.14 0.56 -0.56 0.78 0.14 0.00 0.00 176.91 177.69 1c4x h GLY 274 N 0.09 -0.97 0.77 1.39 0.00 -0.47 0.18 103.07 104.05 1c4x h GLY 274 Ca 0.05 0.75 0.05 0.00 0.00 0.00 0.00 47.33 48.18 1c4x h GLY 274 CO 0.01 -0.07 0.41 -2.55 0.00 0.00 0.00 176.54 174.35 1c4x h PRO 275 N -0.25 0.76 -0.74 4.80 0.11 -1.75 -1.39 132.00 133.54 1c4x h PRO 275 Ca 0.10 -0.05 -0.06 0.00 0.11 0.00 0.00 66.00 66.10 1c4x h PRO 275 Cb 0.52 -0.17 -0.03 0.00 0.11 0.00 0.00 31.00 31.43 1c4x h PRO 275 CO -0.71 0.50 0.22 0.52 -0.21 0.00 0.00 178.00 178.32 1c4x h MET 276 N 0.78 1.16 0.04 1.05 2.86 -1.24 -1.80 114.93 117.79 1c4x h MET 276 Ca 0.30 -0.26 -0.00 0.00 -2.06 0.00 0.00 59.70 57.68 1c4x h MET 276 Cb 0.11 -0.16 0.00 0.00 0.06 0.00 0.00 31.60 31.61 1c4x h MET 276 CO -0.15 0.99 -0.02 1.25 1.06 0.00 0.00 176.91 180.05 1c4x h LEU 277 N 1.11 -0.05 -0.50 1.22 5.85 -0.35 -1.40 115.31 121.19 1c4x h LEU 277 Ca 0.24 -0.14 0.10 0.00 0.84 0.00 0.00 57.88 58.92 1c4x h LEU 277 Cb 0.33 0.01 -0.08 0.00 0.37 0.00 0.00 40.66 41.29 1c4x h LEU 277 CO -0.00 0.11 -0.02 0.24 -0.34 0.00 0.00 178.44 178.43 1c4x h MET 278 N -0.20 0.10 -0.50 1.25 2.86 -1.00 0.24 114.93 117.67 1c4x h MET 278 Ca -0.01 -0.01 -0.10 0.00 -2.06 0.00 0.00 59.70 57.53 1c4x h MET 278 Cb 0.18 -0.02 -0.02 0.00 0.06 0.00 0.00 31.60 31.80 1c4x h MET 278 CO 0.01 0.06 -0.07 1.49 1.06 0.00 0.00 176.91 179.47 1c4x h GLU 279 N 0.10 0.90 -0.70 1.72 4.57 -1.22 0.65 114.58 120.60 1c4x h GLU 279 Ca 0.25 -0.29 -0.05 0.00 -1.18 0.00 0.00 59.36 58.08 1c4x h GLU 279 Cb 0.38 -0.08 -0.03 0.00 -0.16 0.00 0.00 28.75 28.87 1c4x h GLU 279 CO -0.43 0.94 0.22 1.25 -1.18 0.00 0.00 179.01 179.80 1c4x h HIS 280 N 0.82 1.11 0.01 0.92 2.76 -0.48 -2.44 115.15 117.85 1c4x h HIS 280 Ca 0.14 -0.10 -0.00 0.00 -2.20 0.00 0.00 60.37 58.21 1c4x h HIS 280 Cb 0.58 -0.32 0.00 0.00 1.55 0.00 0.00 27.41 29.22 1c4x h HIS 280 CO 0.03 0.88 -0.00 0.74 -1.30 0.00 0.00 177.93 178.28 1c4x h PHE 281 N 1.04 -0.01 -0.64 5.26 0.05 -0.66 -3.37 116.94 118.61 1c4x h PHE 281 Ca 0.23 -0.00 0.10 0.00 3.82 0.00 0.00 57.97 62.11 1c4x h PHE 281 Cb 0.29 0.00 -0.11 0.00 2.00 0.00 0.00 35.95 38.13 1c4x h PHE 281 CO 0.02 0.76 -0.42 -0.09 -0.18 0.00 0.00 178.31 178.40 1c4x h ARG 282 N -0.98 -0.18 -0.00 1.51 9.65 0.29 -3.50 114.38 121.17 1c4x h ARG 282 Ca -0.00 0.01 0.00 0.00 -1.10 0.00 0.00 59.98 58.89 1c4x h ARG 282 Cb 0.77 0.04 0.00 0.00 -1.39 0.00 0.00 29.97 29.39 1c4x h ARG 282 CO 0.00 -0.12 0.00 0.00 2.80 0.00 0.00 179.97 182.65