#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ip3 s LEU 2 N 0.00 2.73 -0.14 2.46 1.43 0.11 -5.00 118.68 120.27 3ip3 s LEU 2 Ca 0.00 -0.35 -0.17 0.00 -1.03 0.00 0.00 54.13 52.58 3ip3 s LEU 2 Cb 0.00 -1.63 -0.04 0.00 0.03 0.00 0.00 46.19 44.55 3ip3 s LEU 2 CO 0.00 0.12 0.43 -0.54 0.23 0.00 0.00 176.35 176.59 3ip3 s LYS 3 N 0.59 4.30 -0.06 1.70 1.02 -1.26 -1.39 119.74 124.65 3ip3 s LYS 3 Ca -0.07 0.34 0.05 0.00 0.02 0.00 0.00 55.97 56.31 3ip3 s LYS 3 Cb -0.15 -3.45 -0.01 0.00 -0.52 0.00 0.00 37.83 33.70 3ip3 s LYS 3 CO 0.03 0.15 -0.22 0.42 -0.92 0.00 0.00 175.35 174.81 3ip3 s ILE 4 N 0.68 1.83 0.27 2.17 1.01 0.24 -0.97 121.20 126.43 3ip3 s ILE 4 Ca 0.23 -0.93 0.11 0.00 0.00 0.00 0.00 60.65 60.05 3ip3 s ILE 4 Cb -0.15 -1.56 -0.05 0.00 0.01 0.00 0.00 42.46 40.72 3ip3 s ILE 4 CO 0.08 0.51 -0.09 0.00 0.00 0.00 0.00 174.94 175.45 3ip3 s VAL 6 N -2.38 1.30 -0.25 0.00 1.01 -0.66 -0.69 120.40 118.74 3ip3 s VAL 6 Ca 0.31 -0.51 -0.07 0.00 0.00 0.00 0.00 61.98 61.71 3ip3 s VAL 6 Cb -0.06 -1.22 -0.02 0.00 0.00 0.00 0.00 36.38 35.08 3ip3 s VAL 6 CO 0.18 0.40 0.05 -0.63 0.00 0.00 0.00 175.10 175.10 3ip3 s ILE 7 N 1.14 4.06 0.00 2.22 1.01 0.45 -1.76 121.20 128.32 3ip3 s ILE 7 Ca -0.04 -0.32 0.00 0.00 0.00 0.00 0.00 60.65 60.29 3ip3 s ILE 7 Cb -0.14 -2.92 0.00 0.00 0.01 0.00 0.00 42.46 39.41 3ip3 s ILE 7 CO -0.03 0.32 0.00 0.61 0.00 0.00 0.00 174.94 175.84 3ip3 n GLY 8 N 4.89 1.12 0.48 6.18 0.00 -0.12 -0.35 105.19 117.38 3ip3 n GLY 8 Ca -0.16 -1.91 0.00 0.00 0.00 0.00 0.00 46.02 43.95 3ip3 n GLY 8 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 3ip3 n SER 9 N -0.30 0.00 -1.05 1.61 2.88 -0.99 -4.72 113.62 111.05 3ip3 n SER 9 Ca 0.00 -1.84 0.08 0.00 -1.33 0.00 0.00 58.87 55.78 3ip3 n SER 9 Cb 0.00 -0.17 0.25 0.00 -0.75 0.00 0.00 64.21 63.55 3ip3 n SER 9 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 3ip3 n SER 10 N 0.00 3.79 0.00 -3.46 7.64 -0.24 -4.71 113.62 116.63 3ip3 n SER 10 Ca 0.00 -2.35 0.00 0.00 1.01 0.00 0.00 58.87 57.53 3ip3 n SER 10 Cb 0.67 -0.43 0.00 0.00 -1.01 0.00 0.00 64.21 63.44 3ip3 n SER 10 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3ip3 n GLY 11 N 0.58 5.39 2.50 0.23 0.00 -1.21 -4.82 105.19 107.86 3ip3 n GLY 11 Ca 0.19 -1.46 -0.39 0.00 0.00 0.00 0.00 46.02 44.35 3ip3 n GLY 11 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3ip3 n HIS 12 N 0.00 2.56 0.23 1.61 8.25 -1.26 -4.66 115.22 121.95 3ip3 n HIS 12 Ca 0.00 -2.75 0.17 0.00 -0.26 0.00 0.00 57.72 54.88 3ip3 n HIS 12 Cb 0.00 -1.75 0.86 0.00 1.12 0.00 0.00 29.99 30.22 3ip3 n HIS 12 CO 0.00 0.00 0.00 0.27 0.64 0.00 0.00 176.34 177.25 3ip3 h PHE 13 N 4.46 0.00 -0.30 4.41 -5.15 -1.94 -1.66 116.94 116.76 3ip3 h PHE 13 Ca 0.67 0.00 0.09 0.00 -0.20 0.00 0.00 57.97 58.53 3ip3 h PHE 13 Cb 0.33 0.00 -0.01 0.00 0.22 0.00 0.00 35.95 36.48 3ip3 h PHE 13 CO 1.57 0.00 0.26 0.00 -2.00 0.00 0.00 178.31 178.14 3ip3 h ARG 14 N 0.00 0.00 -0.99 6.09 3.08 -2.00 -0.60 114.38 119.97 3ip3 h ARG 14 Ca 0.07 0.00 0.07 0.00 0.07 0.00 0.00 59.98 60.19 3ip3 h ARG 14 Cb 0.39 0.00 -0.07 0.00 0.08 0.00 0.00 29.97 30.38 3ip3 h ARG 14 CO -0.00 0.00 0.64 1.88 -1.07 0.00 0.00 179.97 181.42 3ip3 h TYR 15 N 0.00 1.16 -0.09 3.04 0.05 -1.70 -0.96 116.97 118.47 3ip3 h TYR 15 Ca 0.14 0.03 -0.10 0.00 0.05 0.00 0.00 58.73 58.85 3ip3 h TYR 15 Cb 0.65 -0.38 0.00 0.00 1.01 0.00 0.00 36.73 38.02 3ip3 h TYR 15 CO 0.00 0.59 -0.34 0.00 -1.05 0.00 0.00 178.16 177.36 3ip3 h ALA 16 N 1.48 0.16 -0.95 3.88 0.00 -1.32 -3.21 119.26 119.30 3ip3 h ALA 16 Ca 0.43 -0.44 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3ip3 h ALA 16 Cb 0.22 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 17.95 3ip3 h ALA 16 CO -0.18 0.22 0.61 -0.07 0.00 0.00 0.00 179.25 179.83 3ip3 h LEU 17 N -0.08 1.11 0.00 0.00 3.38 -1.30 -2.07 115.31 116.35 3ip3 h LEU 17 Ca -0.02 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.91 3ip3 h LEU 17 Cb 0.97 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 41.44 3ip3 h LEU 17 CO 0.07 0.82 0.00 -0.62 0.09 0.00 0.00 178.44 178.80 3ip3 n GLU 18 N -4.37 0.77 -0.06 1.13 1.02 -0.38 -3.12 120.64 115.61 3ip3 n GLU 18 Ca 0.11 0.00 0.05 0.00 -0.02 0.00 0.00 57.16 57.30 3ip3 n GLU 18 Cb 0.03 -1.50 0.08 0.00 -0.02 0.00 0.00 31.44 30.03 3ip3 n GLU 18 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3ip3 n GLY 19 N 1.09 0.83 3.74 0.62 0.00 -0.79 -4.95 105.19 105.73 3ip3 n GLY 19 Ca 0.20 -0.29 -0.34 0.00 0.00 0.00 0.00 46.02 45.59 3ip3 n GLY 19 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3ip3 s LEU 20 N -0.88 3.35 0.34 0.99 1.43 -1.13 -4.25 118.68 118.54 3ip3 s LEU 20 Ca 0.15 2.22 0.04 0.00 -1.03 0.00 0.00 54.13 55.51 3ip3 s LEU 20 Cb 0.09 -4.57 -0.03 0.00 0.03 0.00 0.00 46.19 41.70 3ip3 s LEU 20 CO 0.13 -2.01 0.18 1.51 0.23 0.00 0.00 176.35 176.38 3ip3 s ASP 21 N -2.23 1.98 0.50 2.29 1.47 -1.26 -5.04 116.67 114.38 3ip3 s ASP 21 Ca 0.72 -1.65 0.32 0.00 1.18 0.00 0.00 52.55 53.12 3ip3 s ASP 21 Cb -0.26 0.47 1.44 0.00 -0.34 0.00 0.00 42.92 44.23 3ip3 s ASP 21 CO 0.43 -0.95 1.76 -0.08 0.68 0.00 0.00 175.17 177.01 3ip3 h GLU 22 N 2.06 0.11 -0.64 2.11 4.57 -2.03 0.15 114.58 120.90 3ip3 h GLU 22 Ca -0.32 -0.01 0.00 0.00 -1.18 0.00 0.00 59.36 57.86 3ip3 h GLU 22 Cb 1.25 -0.02 0.00 0.00 -0.16 0.00 0.00 28.75 29.82 3ip3 h GLU 22 CO 0.49 0.07 0.00 0.39 -1.18 0.00 0.00 179.01 178.78 3ip3 n GLU 23 N -4.33 4.19 -4.85 1.92 -0.58 -1.26 -4.88 120.64 110.85 3ip3 n GLU 23 Ca 0.28 -2.68 -0.29 0.00 -0.42 0.00 0.00 57.16 54.05 3ip3 n GLU 23 Cb 1.23 -2.10 -0.15 0.00 -0.57 0.00 0.00 31.44 29.85 3ip3 n GLU 23 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3ip3 s SER 25 N -1.24 -0.08 -0.49 0.00 1.04 -0.48 -4.74 113.70 107.69 3ip3 s SER 25 Ca 0.11 0.13 -0.24 0.00 0.48 0.00 0.00 55.95 56.43 3ip3 s SER 25 Cb -0.10 0.24 0.03 0.00 0.10 0.00 0.00 66.02 66.29 3ip3 s SER 25 CO 0.02 -0.11 0.90 -0.63 0.98 0.00 0.00 173.24 174.40 3ip3 s ILE 26 N -0.26 4.48 -0.43 -1.02 1.01 -1.26 -0.60 121.20 123.12 3ip3 s ILE 26 Ca -0.03 0.49 0.23 0.00 0.00 0.00 0.00 60.65 61.33 3ip3 s ILE 26 Cb -0.03 -4.45 -0.15 0.00 0.01 0.00 0.00 42.46 37.84 3ip3 s ILE 26 CO 0.00 -0.92 0.90 0.35 0.00 0.00 0.00 174.94 175.27 3ip3 n THR 27 N 6.27 0.21 -3.62 2.92 -2.24 0.14 -4.24 114.28 113.72 3ip3 n THR 27 Ca 0.04 -0.35 -0.14 0.00 -2.27 0.00 0.00 64.05 61.33 3ip3 n THR 27 Cb 0.48 0.10 -0.06 0.00 -2.10 0.00 0.00 70.33 68.75 3ip3 n THR 27 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 3ip3 s GLY 28 N -3.95 -0.37 0.03 3.38 0.00 -1.23 -1.90 107.32 103.27 3ip3 s GLY 28 Ca 0.00 0.58 0.00 0.00 0.00 0.00 0.00 44.72 45.30 3ip3 s GLY 28 CO 0.83 0.30 -0.04 -0.26 0.00 0.00 0.00 173.10 173.93 3ip3 s ILE 29 N -2.12 0.18 0.03 0.90 -4.36 -0.65 -1.65 121.20 113.53 3ip3 s ILE 29 Ca -0.07 -1.11 -0.22 0.00 -0.26 0.00 0.00 60.65 58.99 3ip3 s ILE 29 Cb -0.01 -0.55 0.05 0.00 1.25 0.00 0.00 42.46 43.20 3ip3 s ILE 29 CO 0.01 -0.59 0.51 0.00 0.24 0.00 0.00 174.94 175.11 3ip3 s ALA 30 N -1.93 -1.30 0.65 2.27 0.00 -0.72 -1.24 121.76 119.48 3ip3 s ALA 30 Ca -0.11 0.63 -0.11 0.00 0.00 0.00 0.00 51.96 52.37 3ip3 s ALA 30 Cb -0.06 0.31 -0.02 0.00 0.00 0.00 0.00 23.12 23.34 3ip3 s ALA 30 CO -0.03 -0.47 1.05 -1.25 0.00 0.00 0.00 175.76 175.07 3ip3 s PRO 31 N -2.22 3.36 0.04 0.00 0.04 -1.26 -0.94 135.00 134.02 3ip3 s PRO 31 Ca -0.07 0.69 0.05 0.00 0.04 0.00 0.00 61.00 61.71 3ip3 s PRO 31 Cb -0.01 -2.06 -0.24 0.00 0.04 0.00 0.00 34.50 32.23 3ip3 s PRO 31 CO 0.00 -0.73 0.99 0.78 0.04 0.00 0.00 177.00 178.08 3ip3 h GLY 32 N -0.44 0.10 -4.16 0.56 0.00 -1.93 -3.37 103.07 93.83 3ip3 h GLY 32 Ca -0.44 -0.26 -0.49 0.00 0.00 0.00 0.00 47.33 46.13 3ip3 h GLY 32 CO 0.62 0.23 -0.80 -1.34 0.00 0.00 0.00 176.54 175.25 3ip3 s VAL 33 N -2.65 1.49 0.45 4.60 -7.23 -1.26 -4.94 120.40 110.86 3ip3 s VAL 33 Ca -0.04 -1.51 0.17 0.00 -1.81 0.00 0.00 61.98 58.80 3ip3 s VAL 33 Cb 0.08 -1.42 0.36 0.00 0.56 0.00 0.00 36.38 35.97 3ip3 s VAL 33 CO 0.83 -0.16 1.95 -0.65 -0.31 0.00 0.00 175.10 176.76 3ip3 h PRO 34 N 4.04 0.32 -0.01 4.82 0.11 -1.89 -1.93 132.00 137.45 3ip3 h PRO 34 Ca -0.44 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.66 3ip3 h PRO 34 Cb 1.19 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.23 3ip3 h PRO 34 CO 0.42 0.21 -0.25 -0.85 -0.21 0.00 0.00 178.00 177.32 3ip3 n GLU 35 N -4.45 0.94 -1.71 1.05 0.00 -1.26 -4.94 120.64 110.27 3ip3 n GLU 35 Ca 0.12 -0.57 -0.43 0.00 0.00 0.00 0.00 57.16 56.29 3ip3 n GLU 35 Cb 0.52 -1.49 -0.03 0.00 0.00 0.00 0.00 31.44 30.44 3ip3 n GLU 35 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.13 175.22 3ip3 n GLU 36 N -0.54 2.67 -2.31 3.44 2.13 -0.73 -4.91 120.64 120.40 3ip3 n GLU 36 Ca 0.13 0.97 -0.43 0.00 0.66 0.00 0.00 57.16 58.48 3ip3 n GLU 36 Cb 0.36 -2.80 -0.02 0.00 0.27 0.00 0.00 31.44 29.24 3ip3 n GLU 36 CO 0.00 0.00 0.00 0.34 -0.41 0.00 0.00 177.13 177.06 3ip3 s ASP 37 N 1.27 6.86 0.00 4.31 2.15 -1.26 -4.92 116.67 125.07 3ip3 s ASP 37 Ca 0.76 1.83 0.22 0.00 0.43 0.00 0.00 52.55 55.79 3ip3 s ASP 37 Cb -0.53 -2.54 0.25 0.00 -0.30 0.00 0.00 42.92 39.80 3ip3 s ASP 37 CO 0.34 -0.82 1.25 0.18 -0.17 0.00 0.00 175.17 175.95 3ip3 n LEU 38 N 6.80 3.01 -0.26 -1.34 4.77 -1.26 -4.56 117.00 124.16 3ip3 n LEU 38 Ca 0.15 -1.17 -0.06 0.00 -0.03 0.00 0.00 56.01 54.91 3ip3 n LEU 38 Cb 0.44 -0.08 -0.01 0.00 -2.33 0.00 0.00 43.42 41.45 3ip3 n LEU 38 CO 0.58 0.56 0.59 0.28 -1.33 0.00 0.00 177.39 178.07 3ip3 h SER 39 N 4.29 -1.41 -0.15 -1.43 0.02 -1.94 -2.03 113.55 110.90 3ip3 h SER 39 Ca 0.00 0.26 0.04 0.00 -0.84 0.00 0.00 61.79 61.25 3ip3 h SER 39 Cb 0.93 0.68 -0.04 0.00 0.14 0.00 0.00 62.40 64.11 3ip3 h SER 39 CO 0.00 -0.31 -0.10 0.11 -1.14 0.00 0.00 176.83 175.40 3ip3 h LYS 40 N -0.14 -0.09 -0.27 3.45 1.57 -1.88 0.49 116.57 119.70 3ip3 h LYS 40 Ca 0.23 0.01 0.02 0.00 -1.87 0.00 0.00 60.65 59.04 3ip3 h LYS 40 Cb 0.56 0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.86 3ip3 h LYS 40 CO -0.77 -0.06 0.11 1.25 -0.57 0.00 0.00 179.45 179.42 3ip3 h LEU 41 N -0.09 0.16 -0.61 2.94 5.85 -1.75 -1.77 115.31 120.04 3ip3 h LEU 41 Ca 0.09 0.02 -0.04 0.00 0.84 0.00 0.00 57.88 58.79 3ip3 h LEU 41 Cb 0.23 -0.01 -0.03 0.00 0.37 0.00 0.00 40.66 41.22 3ip3 h LEU 41 CO -0.21 0.12 0.24 -0.33 -0.34 0.00 0.00 178.44 177.92 3ip3 h GLU 42 N 0.25 0.91 -0.48 1.25 5.08 -0.86 -1.47 114.58 119.26 3ip3 h GLU 42 Ca 0.11 -0.17 0.10 0.00 -1.00 0.00 0.00 59.36 58.40 3ip3 h GLU 42 Cb 0.06 -0.15 -0.09 0.00 0.50 0.00 0.00 28.75 29.07 3ip3 h GLU 42 CO -0.10 0.78 -0.14 0.87 -1.00 0.00 0.00 179.01 179.42 3ip3 h LYS 43 N 0.84 -0.02 -0.23 2.33 1.57 0.24 -2.48 116.57 118.82 3ip3 h LYS 43 Ca 0.20 0.00 -0.19 0.00 -1.87 0.00 0.00 60.65 58.80 3ip3 h LYS 43 Cb 0.21 0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.53 3ip3 h LYS 43 CO -0.02 -0.02 -0.60 0.00 -0.57 0.00 0.00 179.45 178.25 3ip3 h ALA 44 N 1.43 0.51 -0.43 3.86 0.00 -0.89 -2.76 119.26 120.98 3ip3 h ALA 44 Ca 0.23 -0.53 -0.07 0.00 0.00 0.00 0.00 54.91 54.54 3ip3 h ALA 44 Cb 0.37 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 3ip3 h ALA 44 CO -0.50 0.69 -0.00 -0.84 0.00 0.00 0.00 179.25 178.60 3ip3 h ILE 45 N 0.56 1.26 -0.11 0.00 3.07 -1.15 -3.18 117.51 117.96 3ip3 h ILE 45 Ca -0.00 -1.03 -0.01 0.00 1.55 0.00 0.00 64.86 65.37 3ip3 h ILE 45 Cb 1.19 1.08 -0.00 0.00 -0.27 0.00 0.00 36.82 38.82 3ip3 h ILE 45 CO 0.12 0.35 0.03 0.77 -1.05 0.00 0.00 178.15 178.38 3ip3 h SER 46 N 0.59 0.17 0.00 2.16 4.64 -1.45 -2.28 113.55 117.38 3ip3 h SER 46 Ca 0.12 -0.21 0.00 0.00 -0.47 0.00 0.00 61.79 61.23 3ip3 h SER 46 Cb 0.49 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 62.54 3ip3 h SER 46 CO 0.02 0.33 0.00 -0.62 -0.87 0.00 0.00 176.83 175.70 3ip3 n GLU 47 N -4.88 0.00 -0.40 4.77 1.02 -1.04 -4.48 120.64 115.63 3ip3 n GLU 47 Ca -0.06 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.08 3ip3 n GLU 47 Cb 0.14 -1.13 0.00 0.00 -0.02 0.00 0.00 31.44 30.43 3ip3 n GLU 47 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 3ip3 n ASN 49 N 1.22 0.00 -4.84 1.62 4.13 -0.89 -5.09 115.26 111.40 3ip3 n ASN 49 Ca 0.00 -1.06 -0.38 0.00 1.68 0.00 0.00 54.58 54.83 3ip3 n ASN 49 Cb 0.00 -0.01 -0.06 0.00 -1.54 0.00 0.00 39.78 38.17 3ip3 n ASN 49 CO 0.00 0.00 0.00 0.27 0.28 0.00 0.00 177.26 177.81 3ip3 s ILE 50 N 0.00 5.09 -0.60 2.41 -0.00 -1.01 -5.05 121.20 122.04 3ip3 s ILE 50 Ca 0.00 0.73 0.04 0.00 -0.00 0.00 0.00 60.65 61.42 3ip3 s ILE 50 Cb 0.00 -3.67 0.17 0.00 -0.00 0.00 0.00 42.46 38.96 3ip3 s ILE 50 CO 0.00 0.56 0.43 -0.75 -0.00 0.00 0.00 174.94 175.18 3ip3 s LYS 51 N -1.14 1.96 0.57 0.37 2.20 -1.26 -4.31 119.74 118.14 3ip3 s LYS 51 Ca 0.23 -2.91 -0.09 0.00 -0.36 0.00 0.00 55.97 52.85 3ip3 s LYS 51 Cb -0.16 -2.82 -0.03 0.00 -1.51 0.00 0.00 37.83 33.31 3ip3 s LYS 51 CO 0.13 -1.30 0.94 -1.25 -0.36 0.00 0.00 175.35 173.51 3ip3 s PRO 52 N -0.90 3.51 0.15 4.03 0.04 -1.26 -5.02 135.00 135.55 3ip3 s PRO 52 Ca 0.26 0.50 -0.30 0.00 0.04 0.00 0.00 61.00 61.50 3ip3 s PRO 52 Cb -0.04 -2.19 -0.07 0.00 0.04 0.00 0.00 34.50 32.23 3ip3 s PRO 52 CO -0.16 -0.47 1.18 0.21 0.04 0.00 0.00 177.00 177.80 3ip3 s LYS 53 N -5.02 4.50 -0.22 4.56 2.20 -0.80 -4.83 119.74 120.12 3ip3 s LYS 53 Ca 0.52 1.82 -0.13 0.00 -0.36 0.00 0.00 55.97 57.81 3ip3 s LYS 53 Cb -0.11 -3.28 -0.04 0.00 -1.51 0.00 0.00 37.83 32.89 3ip3 s LYS 53 CO 0.50 -0.10 0.29 0.21 -0.36 0.00 0.00 175.35 175.89 3ip3 s LYS 54 N 0.10 4.12 0.07 4.03 2.20 -1.26 -1.63 119.74 127.37 3ip3 s LYS 54 Ca 0.54 -0.02 0.04 0.00 -0.36 0.00 0.00 55.97 56.17 3ip3 s LYS 54 Cb -0.31 -3.54 -0.04 0.00 -1.51 0.00 0.00 37.83 32.43 3ip3 s LYS 54 CO 0.34 0.00 0.01 0.71 -0.36 0.00 0.00 175.35 176.06 3ip3 s TYR 55 N 1.21 3.04 0.17 4.03 1.51 -0.37 -4.99 117.35 121.95 3ip3 s TYR 55 Ca 0.14 0.02 0.02 0.00 -1.01 0.00 0.00 57.07 56.23 3ip3 s TYR 55 Cb -0.14 -1.58 0.01 0.00 -0.11 0.00 0.00 41.96 40.13 3ip3 s TYR 55 CO 0.06 0.48 1.38 -0.91 -1.11 0.00 0.00 175.55 175.46 3ip3 h ASN 56 N 3.62 0.30 -3.36 2.29 2.35 -1.96 -3.38 115.58 115.44 3ip3 h ASN 56 Ca -0.48 -0.23 -0.67 0.00 -0.55 0.00 0.00 56.30 54.37 3ip3 h ASN 56 Cb 1.17 -0.09 -0.31 0.00 0.05 0.00 0.00 38.32 39.13 3ip3 h ASN 56 CO 0.60 1.02 -0.77 0.20 -1.65 0.00 0.00 177.43 176.84 3ip3 s ASN 57 N -6.95 4.01 0.30 5.81 0.01 -1.26 -4.59 114.94 112.27 3ip3 s ASN 57 Ca -0.03 -0.66 0.01 0.00 -0.71 0.00 0.00 52.86 51.47 3ip3 s ASN 57 Cb 0.10 -1.64 0.54 0.00 0.41 0.00 0.00 41.25 40.66 3ip3 s ASN 57 CO 0.83 -0.06 1.91 4.11 -1.51 0.00 0.00 177.10 182.38 3ip3 h TRP 58 N 8.03 1.04 -0.64 2.20 5.08 -1.87 -2.13 115.95 127.66 3ip3 h TRP 58 Ca -0.39 0.03 -0.02 0.00 1.08 0.00 0.00 58.89 59.58 3ip3 h TRP 58 Cb 1.13 -0.34 -0.03 0.00 -3.00 0.00 0.00 29.16 26.92 3ip3 h TRP 58 CO 0.55 0.54 0.30 0.11 -1.28 0.00 0.00 178.44 178.66 3ip3 h TRP 59 N 1.02 0.90 0.00 0.12 0.09 -1.94 -2.03 115.95 114.11 3ip3 h TRP 59 Ca 0.40 -0.03 0.00 0.00 0.09 0.00 0.00 58.89 59.34 3ip3 h TRP 59 Cb 0.23 -0.28 0.00 0.00 0.08 0.00 0.00 29.16 29.18 3ip3 h TRP 59 CO -0.00 0.67 0.00 0.39 0.09 0.00 0.00 178.44 179.59 3ip3 n GLU 60 N -4.34 0.44 0.00 0.12 1.02 -0.80 -2.57 120.64 114.50 3ip3 n GLU 60 Ca 0.06 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.20 3ip3 n GLU 60 Cb 0.14 -1.28 0.00 0.00 -0.02 0.00 0.00 31.44 30.28 3ip3 n GLU 60 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 3ip3 n LEU 62 N 1.00 0.00 -0.28 -4.62 4.32 -0.77 -0.93 117.00 115.72 3ip3 n LEU 62 Ca 0.00 0.00 -0.06 0.00 -0.02 0.00 0.00 56.01 55.93 3ip3 n LEU 62 Cb 0.22 0.00 0.06 0.00 -1.62 0.00 0.00 43.42 42.08 3ip3 n LEU 62 CO 0.00 0.00 1.07 -0.08 -1.22 0.00 0.00 177.39 177.16 3ip3 h GLU 63 N 0.00 1.13 0.14 3.23 4.81 -1.78 -0.02 114.58 122.09 3ip3 h GLU 63 Ca 0.00 -0.18 -0.32 0.00 -0.13 0.00 0.00 59.36 58.73 3ip3 h GLU 63 Cb 0.00 -0.20 0.00 0.00 0.63 0.00 0.00 28.75 29.19 3ip3 h GLU 63 CO 0.00 0.90 -1.55 0.87 -0.73 0.00 0.00 179.01 178.50 3ip3 h LYS 64 N 1.10 0.31 0.00 1.92 1.57 -1.32 -3.37 116.57 116.77 3ip3 h LYS 64 Ca 0.26 -0.52 -0.18 0.00 -1.87 0.00 0.00 60.65 58.34 3ip3 h LYS 64 Cb 0.16 0.19 -0.03 0.00 0.08 0.00 0.00 32.23 32.63 3ip3 h LYS 64 CO -0.03 1.19 -1.49 0.39 -0.57 0.00 0.00 179.45 178.94 3ip3 n GLU 65 N -3.51 0.63 -3.82 3.15 -0.58 -1.23 -5.00 120.64 110.28 3ip3 n GLU 65 Ca -0.17 0.20 -0.37 0.00 -0.42 0.00 0.00 57.16 56.40 3ip3 n GLU 65 Cb 1.05 -1.78 0.03 0.00 -0.57 0.00 0.00 31.44 30.17 3ip3 n GLU 65 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 3ip3 n LYS 66 N -2.87 -0.86 -1.61 3.49 4.76 -0.02 -4.90 118.16 116.16 3ip3 n LYS 66 Ca -0.11 0.35 -0.33 0.00 -2.87 0.00 0.00 58.31 55.34 3ip3 n LYS 66 Cb 0.85 -3.47 0.07 0.00 -1.84 0.00 0.00 35.03 30.64 3ip3 n LYS 66 CO 0.00 0.00 0.00 -1.25 -1.37 0.00 0.00 177.40 174.78 3ip3 s PRO 67 N -6.42 2.54 0.23 1.97 0.04 -1.26 -4.92 135.00 127.17 3ip3 s PRO 67 Ca 0.46 1.47 0.13 0.00 0.04 0.00 0.00 61.00 63.10 3ip3 s PRO 67 Cb -0.20 -1.91 -0.01 0.00 0.04 0.00 0.00 34.50 32.42 3ip3 s PRO 67 CO 0.90 -1.47 1.40 -0.44 0.04 0.00 0.00 177.00 177.43 3ip3 h ASP 68 N -0.19 0.00 -3.66 6.66 3.32 -1.40 -3.46 116.42 117.70 3ip3 h ASP 68 Ca -0.47 0.00 -0.25 0.00 0.02 0.00 0.00 57.03 56.33 3ip3 h ASP 68 Cb 1.26 0.00 -0.30 0.00 0.22 0.00 0.00 39.33 40.51 3ip3 h ASP 68 CO 0.52 0.65 -0.71 -0.63 -1.72 0.00 0.00 179.24 177.35 3ip3 s ILE 69 N -2.89 -0.02 -0.14 0.35 1.01 -0.92 -2.28 121.20 116.30 3ip3 s ILE 69 Ca 0.03 0.07 0.02 0.00 0.00 0.00 0.00 60.65 60.77 3ip3 s ILE 69 Cb 0.08 -0.05 0.01 0.00 0.01 0.00 0.00 42.46 42.50 3ip3 s ILE 69 CO 0.77 0.03 -0.20 -0.22 0.00 0.00 0.00 174.94 175.31 3ip3 s LEU 70 N 0.38 2.21 -0.30 2.97 2.96 0.58 -1.62 118.68 125.86 3ip3 s LEU 70 Ca -0.03 -0.57 -0.15 0.00 -0.22 0.00 0.00 54.13 53.17 3ip3 s LEU 70 Cb -0.04 -1.48 -0.03 0.00 0.50 0.00 0.00 46.19 45.14 3ip3 s LEU 70 CO -0.01 0.08 0.35 -0.69 -1.32 0.00 0.00 176.35 174.76 3ip3 s VAL 71 N 0.80 5.18 -0.27 1.68 1.01 0.13 -0.74 120.40 128.19 3ip3 s VAL 71 Ca -0.07 0.31 -0.02 0.00 0.00 0.00 0.00 61.98 62.20 3ip3 s VAL 71 Cb -0.16 -3.73 0.03 0.00 0.00 0.00 0.00 36.38 32.52 3ip3 s VAL 71 CO -0.01 0.06 -0.02 -0.63 0.00 0.00 0.00 175.10 174.50 3ip3 s ILE 72 N 2.02 3.05 -0.48 2.22 1.01 0.09 -0.42 121.20 128.71 3ip3 s ILE 72 Ca 0.13 -1.12 0.06 0.00 0.00 0.00 0.00 60.65 59.72 3ip3 s ILE 72 Cb -0.16 -2.63 0.19 0.00 0.01 0.00 0.00 42.46 39.87 3ip3 s ILE 72 CO 0.11 0.07 0.62 -0.46 0.00 0.00 0.00 174.94 175.27 3ip3 n ASN 73 N 4.68 -2.28 0.00 3.58 2.04 0.52 -0.75 115.26 123.04 3ip3 n ASN 73 Ca -0.15 -2.79 0.00 0.00 -0.44 0.00 0.00 54.58 51.20 3ip3 n ASN 73 Cb 0.46 0.93 0.00 0.00 -2.53 0.00 0.00 39.78 38.63 3ip3 n ASN 73 CO 0.00 0.00 0.00 1.07 -0.44 0.00 0.00 177.26 177.89 3ip3 n THR 74 N 2.66 0.00 -1.62 5.53 5.66 -1.25 -1.08 114.28 124.18 3ip3 n THR 74 Ca 0.21 0.00 -0.50 0.00 -3.05 0.00 0.00 64.05 60.71 3ip3 n THR 74 Cb 0.54 0.00 -0.05 0.00 -1.55 0.00 0.00 70.33 69.27 3ip3 n THR 74 CO 0.00 0.00 0.00 0.52 -3.05 0.00 0.00 175.07 172.54 3ip3 n VAL 75 N 0.00 0.10 -0.10 1.08 0.31 -1.26 -4.70 118.33 113.76 3ip3 n VAL 75 Ca 0.00 -0.02 -0.06 0.00 -0.01 0.00 0.00 64.34 64.24 3ip3 n VAL 75 Cb 0.00 -1.06 0.01 0.00 -0.91 0.00 0.00 33.84 31.89 3ip3 n VAL 75 CO 0.00 0.00 0.00 -0.26 -1.32 0.00 0.00 176.83 175.25 3ip3 h PHE 76 N 4.86 0.17 -0.09 3.52 0.04 -1.86 0.15 116.94 123.74 3ip3 h PHE 76 Ca -0.46 0.02 0.03 0.00 2.80 0.00 0.00 57.97 60.35 3ip3 h PHE 76 Cb 1.31 -0.02 -0.00 0.00 2.20 0.00 0.00 35.95 39.43 3ip3 h PHE 76 CO 0.60 0.06 0.10 0.66 -0.60 0.00 0.00 178.31 179.13 3ip3 h SER 77 N 0.23 0.00 1.17 2.17 4.64 -1.60 -1.75 113.55 118.41 3ip3 h SER 77 Ca 0.16 0.00 -0.17 0.00 -0.47 0.00 0.00 61.79 61.31 3ip3 h SER 77 Cb 0.15 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.22 3ip3 h SER 77 CO -0.18 0.00 -0.84 0.25 -0.87 0.00 0.00 176.83 175.19 3ip3 h LEU 78 N 0.00 0.00 -0.54 5.97 5.85 -1.00 -3.35 115.31 122.23 3ip3 h LEU 78 Ca 0.04 0.00 0.11 0.00 0.84 0.00 0.00 57.88 58.87 3ip3 h LEU 78 Cb 0.24 0.00 -0.10 0.00 0.37 0.00 0.00 40.66 41.17 3ip3 h LEU 78 CO -0.00 0.80 -0.12 0.78 -0.34 0.00 0.00 178.44 179.56 3ip3 h ASN 79 N 0.00 -0.47 -0.49 1.25 2.35 -0.83 -1.33 115.58 116.05 3ip3 h ASN 79 Ca -0.02 0.16 -0.01 0.00 -0.55 0.00 0.00 56.30 55.88 3ip3 h ASN 79 Cb 1.63 0.32 -0.03 0.00 0.05 0.00 0.00 38.32 40.30 3ip3 h ASN 79 CO 0.10 -0.17 0.27 1.23 -1.65 0.00 0.00 177.43 177.21 3ip3 h GLY 80 N 0.01 0.76 0.98 2.83 0.00 -1.67 0.23 103.07 106.22 3ip3 h GLY 80 Ca 0.26 -0.33 -0.16 0.00 0.00 0.00 0.00 47.33 47.11 3ip3 h GLY 80 CO -0.55 0.32 -0.50 0.50 0.00 0.00 0.00 176.54 176.31 3ip3 h LYS 81 N 0.72 0.65 -0.44 4.80 1.57 -1.45 -0.39 116.57 122.03 3ip3 h LYS 81 Ca 0.18 -0.46 -0.13 0.00 -1.87 0.00 0.00 60.65 58.37 3ip3 h LYS 81 Cb 0.04 0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.41 3ip3 h LYS 81 CO -0.03 1.08 -0.23 0.82 -0.57 0.00 0.00 179.45 180.53 3ip3 h ILE 82 N 0.32 1.27 -0.30 1.86 2.04 -1.20 -2.08 117.51 119.43 3ip3 h ILE 82 Ca -0.01 -1.38 0.04 0.00 1.00 0.00 0.00 64.86 64.51 3ip3 h ILE 82 Cb 1.12 1.18 -0.04 0.00 -0.74 0.00 0.00 36.82 38.34 3ip3 h ILE 82 CO 0.11 0.47 0.07 0.25 0.00 0.00 0.00 178.15 179.04 3ip3 h LEU 83 N 0.77 0.04 -0.57 1.44 5.85 -0.87 0.43 115.31 122.40 3ip3 h LEU 83 Ca 0.10 0.04 0.11 0.00 0.84 0.00 0.00 57.88 58.98 3ip3 h LEU 83 Cb 0.78 0.05 -0.11 0.00 0.37 0.00 0.00 40.66 41.76 3ip3 h LEU 83 CO 0.06 0.06 -0.14 0.25 -0.34 0.00 0.00 178.44 178.33 3ip3 h LEU 84 N 0.18 -0.52 -0.67 2.25 5.85 -0.94 -0.79 115.31 120.66 3ip3 h LEU 84 Ca 0.14 0.17 0.08 0.00 0.84 0.00 0.00 57.88 59.10 3ip3 h LEU 84 Cb 0.14 0.35 -0.06 0.00 0.37 0.00 0.00 40.66 41.45 3ip3 h LEU 84 CO -0.17 -0.19 0.34 -0.33 -0.34 0.00 0.00 178.44 177.75 3ip3 h GLU 85 N 0.00 0.59 -0.40 1.25 4.39 -0.80 -1.81 114.58 117.80 3ip3 h GLU 85 Ca 0.27 -0.04 -0.04 0.00 0.34 0.00 0.00 59.36 59.90 3ip3 h GLU 85 Cb 0.41 -0.13 -0.02 0.00 -0.10 0.00 0.00 28.75 28.91 3ip3 h GLU 85 CO -0.58 0.39 0.11 0.00 -1.16 0.00 0.00 179.01 177.77 3ip3 h ALA 86 N 1.39 0.53 -0.15 3.43 0.00 0.10 -1.57 119.26 122.98 3ip3 h ALA 86 Ca 0.32 -0.18 0.01 0.00 0.00 0.00 0.00 54.91 55.05 3ip3 h ALA 86 Cb 0.28 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 3ip3 h ALA 86 CO -0.23 0.19 0.08 -0.07 0.00 0.00 0.00 179.25 179.22 3ip3 h LEU 87 N 0.51 0.13 -1.00 0.00 3.38 -0.96 0.30 115.31 117.67 3ip3 h LEU 87 Ca 0.13 0.00 0.09 0.00 0.09 0.00 0.00 57.88 58.19 3ip3 h LEU 87 Cb 0.29 -0.03 -0.08 0.00 0.09 0.00 0.00 40.66 40.94 3ip3 h LEU 87 CO -0.00 0.10 0.64 -0.33 0.09 0.00 0.00 178.44 178.94 3ip3 h GLU 88 N 0.18 1.05 -0.14 1.13 5.08 -1.30 -0.30 114.58 120.28 3ip3 h GLU 88 Ca 0.06 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3ip3 h GLU 88 Cb -0.00 -0.24 0.00 0.00 0.50 0.00 0.00 28.75 29.01 3ip3 h GLU 88 CO -0.03 0.69 0.00 0.54 -1.00 0.00 0.00 179.01 179.21 3ip3 n ARG 89 N -4.57 1.48 -3.47 2.33 1.74 -0.59 -4.91 116.66 108.67 3ip3 n ARG 89 Ca 0.17 -0.73 -0.21 0.00 -0.77 0.00 0.00 57.85 56.31 3ip3 n ARG 89 Cb 0.27 -1.31 0.07 0.00 -1.02 0.00 0.00 32.46 30.47 3ip3 n ARG 89 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 3ip3 n LYS 90 N -0.02 -7.10 -4.30 5.56 4.01 -0.12 -4.99 118.16 111.21 3ip3 n LYS 90 Ca 0.13 0.74 -0.34 0.00 -0.51 0.00 0.00 58.31 58.34 3ip3 n LYS 90 Cb 0.22 -5.52 -0.12 0.00 -0.51 0.00 0.00 35.03 29.10 3ip3 n LYS 90 CO 0.00 0.00 0.00 0.42 -1.11 0.00 0.00 177.40 176.71 3ip3 s ILE 91 N -3.28 3.95 0.42 -0.18 1.01 0.91 -4.93 121.20 119.10 3ip3 s ILE 91 Ca 0.52 -0.33 -0.26 0.00 0.00 0.00 0.00 60.65 60.58 3ip3 s ILE 91 Cb -0.23 -2.75 -0.09 0.00 0.01 0.00 0.00 42.46 39.40 3ip3 s ILE 91 CO 0.65 0.48 1.44 -1.00 0.00 0.00 0.00 174.94 176.50 3ip3 s HIS 92 N 0.52 2.53 -0.02 3.97 3.76 -0.97 -4.20 115.29 120.89 3ip3 s HIS 92 Ca -0.02 1.24 0.02 0.00 -0.15 0.00 0.00 55.06 56.15 3ip3 s HIS 92 Cb -0.14 -3.94 0.01 0.00 1.11 0.00 0.00 32.58 29.62 3ip3 s HIS 92 CO 0.02 -2.90 -0.06 0.00 -0.85 0.00 0.00 174.74 170.96 3ip3 s ALA 93 N -1.18 0.59 -0.29 -1.40 0.00 -0.83 -0.31 121.76 118.35 3ip3 s ALA 93 Ca 0.58 -0.18 0.02 0.00 0.00 0.00 0.00 51.96 52.38 3ip3 s ALA 93 Cb -0.44 -0.25 0.07 0.00 0.00 0.00 0.00 23.12 22.49 3ip3 s ALA 93 CO 0.58 0.08 -0.04 0.12 0.00 0.00 0.00 175.76 176.50 3ip3 s PHE 94 N 0.29 3.39 -0.06 0.00 5.36 0.08 -2.22 117.98 124.82 3ip3 s PHE 94 Ca -0.04 -2.37 0.05 0.00 -0.96 0.00 0.00 56.93 53.61 3ip3 s PHE 94 Cb -0.08 -2.24 -0.00 0.00 -0.34 0.00 0.00 43.02 40.36 3ip3 s PHE 94 CO -0.00 -0.88 -0.21 0.54 -1.46 0.00 0.00 175.22 173.20 3ip3 s VAL 95 N 1.09 1.77 0.55 3.12 0.11 -0.69 -0.73 120.40 125.63 3ip3 s VAL 95 Ca -0.03 -0.90 -0.20 0.00 -2.93 0.00 0.00 61.98 57.92 3ip3 s VAL 95 Cb -0.20 -1.52 -0.06 0.00 -1.53 0.00 0.00 36.38 33.07 3ip3 s VAL 95 CO -0.05 0.50 1.06 1.21 -3.33 0.00 0.00 175.10 174.49 3ip3 n GLU 96 N 3.17 1.17 -2.88 1.54 4.07 0.07 -4.17 120.64 123.60 3ip3 n GLU 96 Ca -0.18 0.44 -0.29 0.00 -0.06 0.00 0.00 57.16 57.07 3ip3 n GLU 96 Cb 0.52 -2.23 -0.02 0.00 -0.06 0.00 0.00 31.44 29.66 3ip3 n GLU 96 CO 0.00 0.00 0.00 -1.59 -0.06 0.00 0.00 177.13 175.48 3ip3 s LYS 97 N -2.61 3.65 0.66 5.31 0.00 -1.26 -4.13 119.74 121.35 3ip3 s LYS 97 Ca 0.72 0.24 -0.16 0.00 0.00 0.00 0.00 55.97 56.77 3ip3 s LYS 97 Cb -0.45 -2.44 -0.00 0.00 0.00 0.00 0.00 37.83 34.94 3ip3 s LYS 97 CO 0.50 -0.05 1.16 -1.25 0.00 0.00 0.00 175.35 175.71 3ip3 s PRO 98 N -4.16 2.68 0.00 1.78 0.04 -1.26 -4.90 135.00 129.18 3ip3 s PRO 98 Ca 0.48 1.61 0.30 0.00 0.04 0.00 0.00 61.00 63.43 3ip3 s PRO 98 Cb -0.10 -1.92 1.54 0.00 0.04 0.00 0.00 34.50 34.06 3ip3 s PRO 98 CO 0.36 -1.39 2.05 0.44 0.04 0.00 0.00 177.00 178.51 3ip3 n ILE 99 N -2.24 0.02 -3.65 0.56 -5.35 -1.26 -4.72 119.36 102.72 3ip3 n ILE 99 Ca 0.12 0.00 -0.15 0.00 -0.27 0.00 0.00 62.75 62.46 3ip3 n ILE 99 Cb 0.51 -0.51 -0.08 0.00 -1.74 0.00 0.00 39.64 37.82 3ip3 n ILE 99 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3ip3 s ALA 100 N -2.51 -1.39 -2.24 -1.28 0.00 -1.26 -2.99 121.76 110.09 3ip3 s ALA 100 Ca 0.30 1.26 0.19 0.00 0.00 0.00 0.00 51.96 53.71 3ip3 s ALA 100 Cb 0.20 -0.45 0.12 0.00 0.00 0.00 0.00 23.12 22.99 3ip3 s ALA 100 CO 0.44 -0.30 1.07 0.25 0.00 0.00 0.00 175.76 177.23 3ip3 n THR 101 N 1.92 0.00 -4.13 0.00 -2.24 -1.26 -4.94 114.28 103.63 3ip3 n THR 101 Ca -0.17 -0.46 -0.13 0.00 -2.27 0.00 0.00 64.05 61.03 3ip3 n THR 101 Cb 0.56 1.36 -0.11 0.00 -2.10 0.00 0.00 70.33 70.05 3ip3 n THR 101 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 3ip3 s THR 102 N -1.70 0.69 0.33 4.28 -4.23 -1.26 -4.93 115.64 108.83 3ip3 s THR 102 Ca 0.21 -1.52 0.01 0.00 -1.18 0.00 0.00 61.69 59.21 3ip3 s THR 102 Cb 0.16 -1.17 0.27 0.00 1.34 0.00 0.00 72.50 73.09 3ip3 s THR 102 CO 0.28 -0.59 1.99 -0.26 -0.54 0.00 0.00 174.62 175.50 3ip3 h PHE 103 N 3.74 0.88 -0.04 3.99 0.04 -1.98 -1.60 116.94 121.96 3ip3 h PHE 103 Ca -0.36 0.02 0.02 0.00 2.80 0.00 0.00 57.97 60.45 3ip3 h PHE 103 Cb 1.19 -0.30 -0.03 0.00 2.20 0.00 0.00 35.95 39.01 3ip3 h PHE 103 CO 0.62 0.55 -0.10 0.93 -0.60 0.00 0.00 178.31 179.71 3ip3 h GLU 104 N 0.94 -0.15 -0.74 1.51 5.08 -1.99 0.14 114.58 119.37 3ip3 h GLU 104 Ca 0.26 0.01 -0.04 0.00 -1.00 0.00 0.00 59.36 58.59 3ip3 h GLU 104 Cb -0.08 0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.17 3ip3 h GLU 104 CO -0.06 -0.10 0.31 -0.44 -1.00 0.00 0.00 179.01 177.72 3ip3 h ASP 105 N -0.15 1.01 -0.95 1.42 3.32 -1.93 -2.62 116.42 116.51 3ip3 h ASP 105 Ca 0.05 -0.17 0.00 0.00 0.02 0.00 0.00 57.03 56.94 3ip3 h ASP 105 Cb 0.22 -0.26 -0.05 0.00 0.22 0.00 0.00 39.33 39.46 3ip3 h ASP 105 CO -0.13 0.90 0.60 0.25 -1.72 0.00 0.00 179.24 179.14 3ip3 h LEU 106 N 1.06 1.12 -0.83 1.55 5.85 -0.80 -2.49 115.31 120.77 3ip3 h LEU 106 Ca 0.25 -0.05 -0.04 0.00 0.84 0.00 0.00 57.88 58.88 3ip3 h LEU 106 Cb 0.20 -0.28 -0.04 0.00 0.37 0.00 0.00 40.66 40.91 3ip3 h LEU 106 CO -0.02 0.84 0.38 -0.08 -0.34 0.00 0.00 178.44 179.21 3ip3 h GLU 107 N 1.30 1.21 -0.63 1.25 4.57 -0.55 -1.36 114.58 120.37 3ip3 h GLU 107 Ca 0.34 -0.19 -0.04 0.00 -1.18 0.00 0.00 59.36 58.29 3ip3 h GLU 107 Cb -0.10 -0.21 -0.03 0.00 -0.16 0.00 0.00 28.75 28.25 3ip3 h GLU 107 CO -0.07 0.94 0.21 0.87 -1.18 0.00 0.00 179.01 179.79 3ip3 h LYS 108 N 1.18 0.95 -0.42 1.92 1.57 -1.20 -1.25 116.57 119.32 3ip3 h LYS 108 Ca 0.28 -0.17 -0.05 0.00 -1.87 0.00 0.00 60.65 58.84 3ip3 h LYS 108 Cb 0.15 -0.15 -0.02 0.00 0.08 0.00 0.00 32.23 32.29 3ip3 h LYS 108 CO -0.03 0.80 0.06 0.82 -0.57 0.00 0.00 179.45 180.53 3ip3 h ILE 109 N 0.92 1.25 -0.63 1.86 2.04 -1.07 -1.18 117.51 120.70 3ip3 h ILE 109 Ca 0.21 -0.90 -0.06 0.00 1.00 0.00 0.00 64.86 65.11 3ip3 h ILE 109 Cb 0.24 1.02 -0.03 0.00 -0.74 0.00 0.00 36.82 37.31 3ip3 h ILE 109 CO -0.01 0.31 0.16 -0.09 0.00 0.00 0.00 178.15 178.52 3ip3 h ARG 110 N 0.55 0.99 0.03 2.37 2.43 -0.86 0.40 114.38 120.29 3ip3 h ARG 110 Ca 0.13 -0.22 -0.08 0.00 -0.81 0.00 0.00 59.98 59.00 3ip3 h ARG 110 Cb 0.39 -0.14 0.01 0.00 -0.42 0.00 0.00 29.97 29.80 3ip3 h ARG 110 CO 0.01 0.88 -0.32 1.03 -1.51 0.00 0.00 179.97 180.06 3ip3 h SER 111 N 0.95 0.23 -0.69 -3.80 0.87 -1.19 -2.67 113.55 107.25 3ip3 h SER 111 Ca 0.20 -0.87 -0.02 0.00 -1.23 0.00 0.00 61.79 59.87 3ip3 h SER 111 Cb 0.33 -0.07 -0.03 0.00 -0.44 0.00 0.00 62.40 62.19 3ip3 h SER 111 CO -0.00 1.08 0.33 0.58 -0.53 0.00 0.00 176.83 178.29 3ip3 h VAL 112 N -0.59 1.23 -0.71 2.23 2.07 -1.21 -3.00 116.25 116.28 3ip3 h VAL 112 Ca -0.05 -0.64 0.06 0.00 0.82 0.00 0.00 66.70 66.89 3ip3 h VAL 112 Cb 1.15 0.38 -0.06 0.00 -1.52 0.00 0.00 31.29 31.25 3ip3 h VAL 112 CO 0.06 0.27 0.41 0.22 0.02 0.00 0.00 177.57 178.55 3ip3 h TYR 113 N 0.96 0.75 -0.83 1.57 3.20 -0.97 -1.91 116.97 119.74 3ip3 h TYR 113 Ca 0.24 0.03 0.12 0.00 3.14 0.00 0.00 58.73 62.25 3ip3 h TYR 113 Cb 0.12 -0.23 -0.06 0.00 1.54 0.00 0.00 36.73 38.09 3ip3 h TYR 113 CO 0.00 0.37 0.54 -0.56 -1.64 0.00 0.00 178.16 176.87 3ip3 h GLN 114 N 0.75 0.68 0.00 1.82 3.07 -1.33 -0.07 115.11 120.03 3ip3 h GLN 114 Ca 0.31 -0.04 -0.19 0.00 0.09 0.00 0.00 58.65 58.82 3ip3 h GLN 114 Cb 0.18 -0.15 -0.03 0.00 0.08 0.00 0.00 27.48 27.56 3ip3 h GLN 114 CO -0.18 0.45 -0.89 0.87 0.09 0.00 0.00 178.83 179.17 3ip3 h LYS 115 N 0.70 0.00 -0.09 0.06 1.57 -1.32 -3.34 116.57 114.16 3ip3 h LYS 115 Ca 0.40 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.18 3ip3 h LYS 115 Cb 0.58 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.89 3ip3 h LYS 115 CO -0.16 0.89 0.00 1.33 -0.57 0.00 0.00 179.45 180.94 3ip3 n VAL 116 N -3.48 0.20 0.29 0.50 0.24 -0.87 -4.74 118.33 110.47 3ip3 n VAL 116 Ca -0.00 -0.60 0.12 0.00 -2.04 0.00 0.00 64.34 61.81 3ip3 n VAL 116 Cb 0.85 1.10 0.54 0.00 -1.47 0.00 0.00 33.84 34.87 3ip3 n VAL 116 CO 0.00 0.00 0.00 -2.11 -2.14 0.00 0.00 176.83 172.58 3ip3 n ARG 117 N 0.67 0.17 0.09 7.34 1.85 -0.09 -0.62 116.66 126.08 3ip3 n ARG 117 Ca 0.08 0.53 0.13 0.00 -1.00 0.00 0.00 57.85 57.59 3ip3 n ARG 117 Cb 0.33 -1.92 0.33 0.00 -1.05 0.00 0.00 32.46 30.15 3ip3 n ARG 117 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 177.63 177.71 3ip3 n ASN 118 N -2.27 0.80 -0.00 2.89 5.03 -1.26 -4.26 115.26 116.20 3ip3 n ASN 118 Ca 0.00 0.44 0.01 0.00 0.87 0.00 0.00 54.58 55.90 3ip3 n ASN 118 Cb 0.14 -0.51 -0.01 0.00 -1.02 0.00 0.00 39.78 38.38 3ip3 n ASN 118 CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 3ip3 n GLU 119 N -2.24 2.76 -3.81 3.52 1.02 0.21 -5.04 120.64 117.06 3ip3 n GLU 119 Ca 0.05 -0.01 -0.12 0.00 -0.02 0.00 0.00 57.16 57.05 3ip3 n GLU 119 Cb 0.44 -0.85 -0.11 0.00 -0.02 0.00 0.00 31.44 30.89 3ip3 n GLU 119 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 3ip3 s VAL 120 N -1.73 0.02 0.10 2.62 0.11 -0.71 -4.99 120.40 115.82 3ip3 s VAL 120 Ca -0.00 -0.15 0.08 0.00 -2.93 0.00 0.00 61.98 58.98 3ip3 s VAL 120 Cb 0.01 -0.34 -0.04 0.00 -1.53 0.00 0.00 36.38 34.48 3ip3 s VAL 120 CO 0.08 -0.08 -0.15 0.12 -3.33 0.00 0.00 175.10 171.73 3ip3 s PHE 121 N -0.24 2.61 0.08 1.54 5.36 -1.26 -4.46 117.98 121.61 3ip3 s PHE 121 Ca -0.03 -0.22 -0.08 0.00 -0.96 0.00 0.00 56.93 55.63 3ip3 s PHE 121 Cb -0.03 -1.39 -0.00 0.00 -0.34 0.00 0.00 43.02 41.26 3ip3 s PHE 121 CO 0.01 0.38 0.18 -0.59 -1.46 0.00 0.00 175.22 173.74 3ip3 s PHE 122 N -1.14 0.15 0.24 10.12 -0.71 -1.26 -1.96 117.98 123.42 3ip3 s PHE 122 Ca 0.19 -0.55 -0.20 0.00 -1.04 0.00 0.00 56.93 55.33 3ip3 s PHE 122 Cb -0.11 -0.07 0.03 0.00 -1.21 0.00 0.00 43.02 41.66 3ip3 s PHE 122 CO 0.11 -0.51 0.64 -0.08 -1.34 0.00 0.00 175.22 174.04 3ip3 s THR 123 N -3.58 0.01 0.00 -4.49 -1.32 -0.94 -3.65 115.64 101.67 3ip3 s THR 123 Ca 0.03 -0.81 0.00 0.00 -1.21 0.00 0.00 61.69 59.70 3ip3 s THR 123 Cb 0.04 -1.75 0.00 0.00 -1.51 0.00 0.00 72.50 69.28 3ip3 s THR 123 CO -0.09 -0.02 0.00 0.00 -2.21 0.00 0.00 174.62 172.29 3ip3 n ALA 124 N -0.41 0.00 0.00 11.08 0.00 -1.26 -1.70 120.51 128.22 3ip3 n ALA 124 Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.37 3ip3 n ALA 124 Cb 0.61 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.06 3ip3 n ALA 124 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 3ip3 n PHE 126 N 0.00 0.00 0.27 0.00 3.72 -1.26 -4.83 117.46 115.36 3ip3 n PHE 126 Ca 0.00 0.00 0.16 0.00 -0.05 0.00 0.00 57.45 57.56 3ip3 n PHE 126 Cb 0.00 0.00 0.70 0.00 -0.94 0.00 0.00 39.48 39.24 3ip3 n PHE 126 CO 0.00 0.00 0.00 0.78 -0.05 0.00 0.00 176.76 177.49 3ip3 h GLY 127 N 0.00 0.00 2.00 1.37 0.00 -2.00 -2.97 103.07 101.48 3ip3 h GLY 127 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.32 3ip3 h GLY 127 CO 0.00 0.00 -0.03 -2.22 0.00 0.00 0.00 176.54 174.29 3ip3 h ILE 128 N 0.00 0.76 -0.86 2.60 2.04 -1.99 -2.25 117.51 117.80 3ip3 h ILE 128 Ca -0.00 -0.11 0.19 0.00 1.00 0.00 0.00 64.86 65.93 3ip3 h ILE 128 Cb 0.50 1.07 -0.06 0.00 -0.74 0.00 0.00 36.82 37.58 3ip3 h ILE 128 CO 0.01 0.03 0.57 0.03 0.00 0.00 0.00 178.15 178.79 3ip3 h ARG 129 N 0.00 0.41 -0.00 2.37 3.08 -1.93 -2.71 114.38 115.59 3ip3 h ARG 129 Ca -0.00 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.02 3ip3 h ARG 129 Cb 0.06 -0.09 0.00 0.00 0.08 0.00 0.00 29.97 30.02 3ip3 h ARG 129 CO 0.00 0.27 -0.28 0.66 -1.07 0.00 0.00 179.97 179.55 3ip3 n TYR 130 N -4.50 0.00 -2.14 3.04 4.02 -0.85 -3.20 117.16 113.54 3ip3 n TYR 130 Ca 0.18 0.00 -0.40 0.00 -0.01 0.00 0.00 57.90 57.67 3ip3 n TYR 130 Cb 0.64 -0.19 -0.01 0.00 -0.02 0.00 0.00 39.34 39.76 3ip3 n TYR 130 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 176.86 176.88 3ip3 s ARG 131 N -2.67 4.13 0.26 -0.72 0.52 -1.02 -0.50 118.95 118.95 3ip3 s ARG 131 Ca 0.21 2.10 -0.03 0.00 -0.52 0.00 0.00 55.73 57.49 3ip3 s ARG 131 Cb 0.19 -2.86 0.55 0.00 0.52 0.00 0.00 34.95 33.35 3ip3 s ARG 131 CO 0.56 -0.33 1.65 -1.35 0.02 0.00 0.00 175.30 175.85 3ip3 h PRO 132 N 2.94 0.17 -0.50 3.54 0.11 -1.85 -1.19 132.00 135.21 3ip3 h PRO 132 Ca -0.49 -0.01 -0.04 0.00 0.11 0.00 0.00 66.00 65.57 3ip3 h PRO 132 Cb 1.24 -0.04 -0.02 0.00 0.11 0.00 0.00 31.00 32.28 3ip3 h PRO 132 CO 0.64 0.11 0.13 1.12 -0.21 0.00 0.00 178.00 179.79 3ip3 h HIS 133 N 0.17 0.76 0.10 0.65 2.07 -1.89 0.56 115.15 117.58 3ip3 h HIS 133 Ca 0.47 -0.06 -0.27 0.00 -2.85 0.00 0.00 60.37 57.66 3ip3 h HIS 133 Cb 0.87 -0.23 0.01 0.00 2.57 0.00 0.00 27.41 30.63 3ip3 h HIS 133 CO -0.34 0.64 -1.17 0.74 -3.07 0.00 0.00 177.93 174.73 3ip3 h PHE 134 N 0.73 0.63 -0.80 6.12 0.04 -1.60 -1.96 116.94 120.11 3ip3 h PHE 134 Ca 0.17 -0.42 0.01 0.00 2.80 0.00 0.00 57.97 60.53 3ip3 h PHE 134 Cb 0.25 -0.04 -0.04 0.00 2.20 0.00 0.00 35.95 38.32 3ip3 h PHE 134 CO 0.01 1.29 0.53 -0.07 -0.60 0.00 0.00 178.31 179.47 3ip3 h LEU 135 N 0.15 0.92 -0.39 1.54 3.38 -1.01 -1.44 115.31 118.46 3ip3 h LEU 135 Ca -0.13 -0.03 -0.03 0.00 0.09 0.00 0.00 57.88 57.78 3ip3 h LEU 135 Cb 1.86 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 42.37 3ip3 h LEU 135 CO 0.20 0.67 0.13 0.74 0.09 0.00 0.00 178.44 180.27 3ip3 h THR 136 N 1.08 1.21 -0.39 0.22 2.02 -0.86 -0.42 112.91 115.77 3ip3 h THR 136 Ca 0.29 -0.67 0.02 0.00 0.77 0.00 0.00 66.41 66.82 3ip3 h THR 136 Cb -0.12 0.92 -0.03 0.00 -1.74 0.00 0.00 68.15 67.18 3ip3 h THR 136 CO -0.06 0.24 0.23 0.00 0.37 0.00 0.00 175.52 176.29 3ip3 h ALA 137 N 0.98 0.49 -0.29 6.16 0.00 -1.22 -0.66 119.26 124.71 3ip3 h ALA 137 Ca 0.13 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.03 3ip3 h ALA 137 Cb 0.24 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 3ip3 h ALA 137 CO -0.01 -0.11 0.20 -0.22 0.00 0.00 0.00 179.25 179.11 3ip3 h LYS 138 N 0.46 0.39 0.38 0.00 1.63 -1.03 -1.38 116.57 117.01 3ip3 h LYS 138 Ca 0.15 -0.02 -0.01 0.00 -0.85 0.00 0.00 60.65 59.92 3ip3 h LYS 138 Cb 0.01 -0.09 -0.01 0.00 -0.60 0.00 0.00 32.23 31.54 3ip3 h LYS 138 CO -0.07 0.26 -0.30 -0.22 -3.45 0.00 0.00 179.45 175.66 3ip3 h LYS 139 N 0.40 -0.66 -0.18 1.90 3.64 -0.80 0.14 116.57 121.02 3ip3 h LYS 139 Ca 0.11 0.05 0.03 0.00 -1.27 0.00 0.00 60.65 59.56 3ip3 h LYS 139 Cb -0.05 0.15 -0.06 0.00 -0.41 0.00 0.00 32.23 31.87 3ip3 h LYS 139 CO -0.02 -0.44 -0.46 -0.07 -2.27 0.00 0.00 179.45 176.18 3ip3 h LEU 140 N -0.69 -1.50 -0.75 5.20 3.38 -1.05 -0.81 115.31 119.10 3ip3 h LEU 140 Ca -0.03 0.18 0.03 0.00 0.09 0.00 0.00 57.88 58.15 3ip3 h LEU 140 Cb 0.60 0.59 -0.05 0.00 0.09 0.00 0.00 40.66 41.89 3ip3 h LEU 140 CO -0.01 -0.39 0.47 0.58 0.09 0.00 0.00 178.44 179.18 3ip3 h VAL 141 N -0.45 1.10 -0.26 1.22 2.07 -1.18 -2.01 116.25 116.74 3ip3 h VAL 141 Ca 0.04 -0.31 -0.02 0.00 0.82 0.00 0.00 66.70 67.22 3ip3 h VAL 141 Cb 0.56 0.11 -0.01 0.00 -1.52 0.00 0.00 31.29 30.42 3ip3 h VAL 141 CO -0.41 0.17 0.08 -1.28 0.02 0.00 0.00 177.57 176.15 3ip3 h SER 142 N 0.92 0.33 -0.54 0.57 0.87 -0.28 -2.61 113.55 112.81 3ip3 h SER 142 Ca 0.30 -0.03 -0.03 0.00 -1.23 0.00 0.00 61.79 60.80 3ip3 h SER 142 Cb 0.02 -0.08 -0.02 0.00 -0.44 0.00 0.00 62.40 61.88 3ip3 h SER 142 CO -0.11 0.33 0.04 -0.62 -0.53 0.00 0.00 176.83 175.93 3ip3 n GLU 143 N -4.40 4.36 -0.58 2.24 1.02 -0.35 -4.93 120.64 118.00 3ip3 n GLU 143 Ca 0.01 -2.82 0.00 0.00 -0.02 0.00 0.00 57.16 54.33 3ip3 n GLU 143 Cb 0.15 -2.18 0.00 0.00 -0.02 0.00 0.00 31.44 29.38 3ip3 n GLU 143 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3ip3 n GLY 144 N 0.46 0.73 0.27 0.62 0.00 -0.98 -4.97 105.19 101.32 3ip3 n GLY 144 Ca 0.27 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.40 3ip3 n GLY 144 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ip3 h ALA 145 N 0.00 1.59 -0.20 4.61 0.00 -1.59 -1.26 119.26 122.41 3ip3 h ALA 145 Ca 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.85 3ip3 h ALA 145 Cb 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.78 3ip3 h ALA 145 CO 0.00 0.09 0.00 1.33 0.00 0.00 0.00 179.25 180.67 3ip3 n VAL 146 N -4.03 0.36 -4.06 0.00 0.24 -1.26 -3.98 118.33 105.59 3ip3 n VAL 146 Ca -0.03 -0.68 0.00 0.00 -2.04 0.00 0.00 64.34 61.59 3ip3 n VAL 146 Cb 0.16 1.05 0.00 0.00 -1.47 0.00 0.00 33.84 33.57 3ip3 n VAL 146 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3ip3 n GLY 147 N 0.98 1.80 3.71 7.63 0.00 -0.48 -1.13 105.19 117.69 3ip3 n GLY 147 Ca 0.13 -0.60 -0.42 0.00 0.00 0.00 0.00 46.02 45.12 3ip3 n GLY 147 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3ip3 s GLU 148 N 0.00 4.51 0.26 1.61 2.12 -1.26 -4.75 118.70 121.19 3ip3 s GLU 148 Ca 0.00 1.48 -0.30 0.00 0.36 0.00 0.00 54.97 56.51 3ip3 s GLU 148 Cb 0.00 -3.46 -0.10 0.00 0.26 0.00 0.00 34.13 30.83 3ip3 s GLU 148 CO 0.00 -0.15 1.35 0.42 -0.54 0.00 0.00 175.26 176.34 3ip3 s ILE 149 N 1.25 2.88 0.00 -3.70 1.01 -1.26 -0.89 121.20 120.49 3ip3 s ILE 149 Ca 0.53 0.77 0.00 0.00 0.00 0.00 0.00 60.65 61.95 3ip3 s ILE 149 Cb -0.22 -3.49 0.00 0.00 0.01 0.00 0.00 42.46 38.76 3ip3 s ILE 149 CO 0.26 0.14 0.00 0.54 0.00 0.00 0.00 174.94 175.88 3ip3 n ARG 150 N 1.96 2.48 -3.71 2.79 5.12 0.35 -4.87 116.66 120.77 3ip3 n ARG 150 Ca 0.04 0.00 -0.12 0.00 -1.93 0.00 0.00 57.85 55.84 3ip3 n ARG 150 Cb 0.42 -1.00 -0.10 0.00 -1.16 0.00 0.00 32.46 30.62 3ip3 n ARG 150 CO 0.00 0.00 0.00 -1.17 -1.93 0.00 0.00 177.63 174.53 3ip3 s LEU 151 N -4.37 0.18 -0.04 0.55 2.96 -0.64 -2.93 118.68 114.40 3ip3 s LEU 151 Ca 0.00 0.92 0.01 0.00 -0.22 0.00 0.00 54.13 54.84 3ip3 s LEU 151 Cb 0.00 1.52 0.02 0.00 0.50 0.00 0.00 46.19 48.23 3ip3 s LEU 151 CO 0.00 -0.17 -0.05 -0.69 -1.32 0.00 0.00 176.35 174.12 3ip3 s VAL 152 N 0.51 0.56 -0.09 1.68 1.01 -0.25 0.22 120.40 124.05 3ip3 s VAL 152 Ca -0.02 -0.15 0.02 0.00 0.00 0.00 0.00 61.98 61.83 3ip3 s VAL 152 Cb -0.04 -0.57 -0.02 0.00 0.00 0.00 0.00 36.38 35.74 3ip3 s VAL 152 CO -0.03 0.22 -0.15 0.20 0.00 0.00 0.00 175.10 175.35 3ip3 s ASN 153 N 0.81 3.94 0.10 3.32 0.02 0.16 -0.73 114.94 122.56 3ip3 s ASN 153 Ca -0.11 -0.29 0.05 0.00 -1.02 0.00 0.00 52.86 51.49 3ip3 s ASN 153 Cb -0.14 -1.21 -0.03 0.00 0.02 0.00 0.00 41.25 39.88 3ip3 s ASN 153 CO 0.00 0.25 -0.12 0.42 0.02 0.00 0.00 177.10 177.67 3ip3 s THR 154 N -0.17 1.09 -0.01 1.60 -4.23 -0.13 -0.21 115.64 113.58 3ip3 s THR 154 Ca -0.01 -1.57 0.00 0.00 -1.18 0.00 0.00 61.69 58.94 3ip3 s THR 154 Cb -0.13 -1.32 0.02 0.00 1.34 0.00 0.00 72.50 72.40 3ip3 s THR 154 CO 0.03 -0.43 0.02 -1.58 -0.54 0.00 0.00 174.62 172.12 3ip3 s GLN 155 N -2.47 -0.02 -0.07 3.99 0.74 0.16 -1.96 119.66 120.03 3ip3 s GLN 155 Ca 0.04 0.12 0.04 0.00 0.05 0.00 0.00 55.36 55.61 3ip3 s GLN 155 Cb -0.05 -0.16 -0.00 0.00 1.10 0.00 0.00 33.01 33.90 3ip3 s GLN 155 CO 0.02 -0.10 -0.20 0.15 -0.55 0.00 0.00 175.29 174.60 3ip3 s LYS 156 N 0.67 2.40 -0.22 1.67 -0.14 -0.10 -1.85 119.74 122.17 3ip3 s LYS 156 Ca -0.06 -0.74 -0.04 0.00 -1.36 0.00 0.00 55.97 53.78 3ip3 s LYS 156 Cb -0.08 -1.93 0.11 0.00 -1.68 0.00 0.00 37.83 34.25 3ip3 s LYS 156 CO -0.02 0.21 0.31 0.45 -0.76 0.00 0.00 175.35 175.55 3ip3 s SER 157 N 0.22 0.63 0.17 2.83 0.15 -1.23 -1.79 113.70 114.69 3ip3 s SER 157 Ca -0.11 0.13 0.10 0.00 0.70 0.00 0.00 55.95 56.77 3ip3 s SER 157 Cb -0.15 0.83 -0.04 0.00 -1.71 0.00 0.00 66.02 64.95 3ip3 s SER 157 CO 0.05 -0.30 -0.18 -0.31 1.20 0.00 0.00 173.24 173.70 3ip3 s TYR 158 N 2.46 2.46 0.11 3.44 2.02 -0.80 -1.80 117.35 125.25 3ip3 s TYR 158 Ca 0.09 -0.29 -0.31 0.00 -0.37 0.00 0.00 57.07 56.19 3ip3 s TYR 158 Cb -0.15 -1.24 -0.07 0.00 -0.40 0.00 0.00 41.96 40.10 3ip3 s TYR 158 CO -0.14 0.47 1.26 0.15 -1.57 0.00 0.00 175.55 175.72 3ip3 s LYS 159 N -2.58 4.41 0.00 -0.62 1.02 -0.80 -2.17 119.74 119.00 3ip3 s LYS 159 Ca 0.21 1.90 0.00 0.00 0.02 0.00 0.00 55.97 58.10 3ip3 s LYS 159 Cb -0.09 -3.29 0.00 0.00 -0.52 0.00 0.00 37.83 33.94 3ip3 s LYS 159 CO 0.11 -0.27 0.07 -0.11 -0.92 0.00 0.00 175.35 174.23 3ip3 n LEU 160 N 3.53 2.39 0.00 3.17 7.94 -1.26 -4.99 117.00 127.79 3ip3 n LEU 160 Ca 0.08 0.11 0.00 0.00 -1.11 0.00 0.00 56.01 55.09 3ip3 n LEU 160 Cb 0.45 -0.04 0.00 0.00 0.53 0.00 0.00 43.42 44.35 3ip3 n LEU 160 CO 0.57 -0.04 0.00 0.61 -1.11 0.00 0.00 177.39 177.41 3ip3 n GLY 161 N 2.08 -1.08 3.73 -3.96 0.00 -1.26 -4.73 105.19 99.97 3ip3 n GLY 161 Ca 0.00 -1.20 -0.41 0.00 0.00 0.00 0.00 46.02 44.41 3ip3 n GLY 161 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3ip3 s GLN 162 N 0.00 4.65 0.20 1.61 0.74 -1.26 -5.07 119.66 120.53 3ip3 s GLN 162 Ca 0.00 1.39 0.08 0.00 0.05 0.00 0.00 55.36 56.88 3ip3 s GLN 162 Cb 0.00 -3.39 -0.05 0.00 1.10 0.00 0.00 33.01 30.68 3ip3 s GLN 162 CO 0.00 0.18 -0.16 1.03 -0.55 0.00 0.00 175.29 175.79 3ip3 s ARG 163 N 0.17 1.33 0.64 1.67 1.81 -1.26 -5.13 118.95 118.18 3ip3 s ARG 163 Ca 0.47 -1.54 -0.17 0.00 -1.72 0.00 0.00 55.73 52.76 3ip3 s ARG 163 Cb -0.22 -1.23 -0.07 0.00 -0.45 0.00 0.00 34.95 32.98 3ip3 s ARG 163 CO 0.28 0.22 0.54 -2.30 -0.68 0.00 0.00 175.30 173.36 3ip3 n PRO 164 N -0.19 0.44 0.29 3.54 -0.02 -1.26 -4.86 135.00 132.94 3ip3 n PRO 164 Ca -0.09 0.18 0.14 0.00 -2.02 0.00 0.00 63.50 61.71 3ip3 n PRO 164 Cb 0.59 -1.77 0.85 0.00 -0.02 0.00 0.00 33.50 33.15 3ip3 n PRO 164 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 3ip3 h ASP 165 N -0.01 0.00 0.24 2.55 3.32 -2.01 -2.03 116.42 118.48 3ip3 h ASP 165 Ca -0.46 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.59 3ip3 h ASP 165 Cb 1.38 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.93 3ip3 h ASP 165 CO 0.45 0.05 0.00 2.19 -1.72 0.00 0.00 179.24 180.21 3ip3 h PHE 166 N 0.00 0.00 0.00 4.55 -5.15 -1.96 -0.28 116.94 114.10 3ip3 h PHE 166 Ca -0.00 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.77 3ip3 h PHE 166 Cb 0.13 0.00 0.00 0.00 0.22 0.00 0.00 35.95 36.30 3ip3 h PHE 166 CO 0.00 0.00 0.00 1.88 -2.00 0.00 0.00 178.31 178.19 3ip3 h TYR 167 N 0.00 0.00 0.00 6.09 -1.99 -1.71 -2.99 116.97 116.37 3ip3 h TYR 167 Ca 0.00 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.73 3ip3 h TYR 167 Cb 0.12 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.85 3ip3 h TYR 167 CO 0.00 0.00 -0.47 0.87 -0.00 0.00 0.00 178.16 178.56 3ip3 h LYS 168 N 0.00 0.00 -5.28 4.88 1.57 -1.21 -3.37 116.57 113.16 3ip3 h LYS 168 Ca 0.00 0.00 -0.66 0.00 -1.87 0.00 0.00 60.65 58.12 3ip3 h LYS 168 Cb 0.14 0.00 -0.27 0.00 0.08 0.00 0.00 32.23 32.18 3ip3 h LYS 168 CO 0.00 0.00 -0.76 0.15 -0.57 0.00 0.00 179.45 178.27 3ip3 s LYS 169 N -3.18 3.39 0.31 3.15 -0.14 -1.21 -0.64 119.74 121.42 3ip3 s LYS 169 Ca 0.06 -0.67 0.08 0.00 -1.36 0.00 0.00 55.97 54.08 3ip3 s LYS 169 Cb 0.12 -2.68 0.85 0.00 -1.68 0.00 0.00 37.83 34.44 3ip3 s LYS 169 CO 0.70 0.16 1.69 -0.09 -0.76 0.00 0.00 175.35 177.05 3ip3 h ARG 170 N 6.87 0.41 -0.77 1.68 9.65 -1.87 0.26 114.38 130.61 3ip3 h ARG 170 Ca -0.28 -0.02 0.11 0.00 -1.10 0.00 0.00 59.98 58.69 3ip3 h ARG 170 Cb 1.20 -0.09 -0.05 0.00 -1.39 0.00 0.00 29.97 29.64 3ip3 h ARG 170 CO 0.57 0.27 0.51 1.49 2.80 0.00 0.00 179.97 185.60 3ip3 h GLU 171 N 0.42 0.59 0.00 0.20 4.81 -1.95 0.21 114.58 118.86 3ip3 h GLU 171 Ca 0.62 -0.04 -0.24 0.00 -0.13 0.00 0.00 59.36 59.57 3ip3 h GLU 171 Cb 1.25 -0.13 -0.05 0.00 0.63 0.00 0.00 28.75 30.45 3ip3 h GLU 171 CO -0.54 0.39 -2.00 0.25 -0.73 0.00 0.00 179.01 176.38 3ip3 n THR 172 N -4.50 0.91 0.02 0.32 -2.24 -0.68 -4.67 114.28 103.44 3ip3 n THR 172 Ca 0.14 -0.61 -0.19 0.00 -2.27 0.00 0.00 64.05 61.12 3ip3 n THR 172 Cb 0.40 -0.51 -0.14 0.00 -2.10 0.00 0.00 70.33 67.97 3ip3 n THR 172 CO 0.00 0.00 0.00 0.22 -0.57 0.00 0.00 175.07 174.72 3ip3 h TYR 173 N 0.00 0.43 0.00 4.78 3.20 -0.37 -1.81 116.97 123.20 3ip3 h TYR 173 Ca -0.36 -0.32 0.00 0.00 3.14 0.00 0.00 58.73 61.19 3ip3 h TYR 173 Cb 1.79 -0.02 0.00 0.00 1.54 0.00 0.00 36.73 40.04 3ip3 h TYR 173 CO 0.00 1.27 0.00 0.41 -1.64 0.00 0.00 178.16 178.20 3ip3 n GLY 174 N 1.66 1.93 0.00 1.82 0.00 0.73 -4.69 105.19 106.64 3ip3 n GLY 174 Ca -0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.88 3ip3 n GLY 174 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ip3 n GLY 175 N -2.00 2.41 0.12 -0.02 0.00 -1.26 -4.58 105.19 99.85 3ip3 n GLY 175 Ca 0.00 -1.83 -0.09 0.00 0.00 0.00 0.00 46.02 44.09 3ip3 n GLY 175 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 3ip3 h THR 176 N 0.00 1.51 -0.39 2.61 2.02 -1.91 -1.83 112.91 114.93 3ip3 h THR 176 Ca 0.00 -2.73 0.03 0.00 0.77 0.00 0.00 66.41 64.48 3ip3 h THR 176 Cb 0.00 2.55 -0.03 0.00 -1.74 0.00 0.00 68.15 68.93 3ip3 h THR 176 CO 0.00 0.79 0.20 0.40 0.37 0.00 0.00 175.52 177.28 3ip3 h ILE 177 N 0.10 0.99 0.02 3.11 2.04 -1.92 0.26 117.51 122.10 3ip3 h ILE 177 Ca -0.05 -0.14 -0.21 0.00 1.00 0.00 0.00 64.86 65.46 3ip3 h ILE 177 Cb 1.58 0.55 -0.02 0.00 -0.74 0.00 0.00 36.82 38.18 3ip3 h ILE 177 CO 0.14 0.07 -1.00 -0.65 0.00 0.00 0.00 178.15 176.71 3ip3 h PRO 178 N 0.40 0.05 -0.02 2.37 0.11 -1.78 -1.72 132.00 131.42 3ip3 h PRO 178 Ca 0.16 -0.07 -0.04 0.00 0.11 0.00 0.00 66.00 66.17 3ip3 h PRO 178 Cb 0.06 0.03 0.00 0.00 0.11 0.00 0.00 31.00 31.20 3ip3 h PRO 178 CO -0.11 1.00 -0.13 2.35 -0.21 0.00 0.00 178.00 180.90 3ip3 h TRP 179 N 0.02 0.17 0.02 0.65 2.91 -1.28 -3.32 115.95 115.11 3ip3 h TRP 179 Ca -0.03 -0.08 -0.40 0.00 1.13 0.00 0.00 58.89 59.52 3ip3 h TRP 179 Cb 1.74 -0.02 -0.06 0.00 -0.51 0.00 0.00 29.16 30.30 3ip3 h TRP 179 CO 0.01 0.80 -2.35 0.28 -1.03 0.00 0.00 178.44 176.16 3ip3 n VAL 180 N -4.62 1.54 0.22 2.65 0.31 0.05 -4.50 118.33 113.99 3ip3 n VAL 180 Ca -0.09 -0.48 0.09 0.00 -0.01 0.00 0.00 64.34 63.84 3ip3 n VAL 180 Cb 0.41 -1.66 0.53 0.00 -0.91 0.00 0.00 33.84 32.22 3ip3 n VAL 180 CO 0.00 0.00 0.00 1.23 -1.32 0.00 0.00 176.83 176.74 3ip3 h GLY 181 N 0.70 0.00 2.00 2.92 0.00 -0.95 -3.15 103.07 104.59 3ip3 h GLY 181 Ca -0.58 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 46.74 3ip3 h GLY 181 CO -0.18 0.00 -0.05 1.19 0.00 0.00 0.00 176.54 177.50 3ip3 h ILE 182 N 0.00 0.67 -0.48 2.60 2.10 -1.55 -1.42 117.51 119.43 3ip3 h ILE 182 Ca -0.00 -0.20 0.04 0.00 1.08 0.00 0.00 64.86 65.77 3ip3 h ILE 182 Cb 0.58 1.12 -0.04 0.00 -1.09 0.00 0.00 36.82 37.39 3ip3 h ILE 182 CO 0.03 0.05 0.25 0.45 -1.08 0.00 0.00 178.15 177.85 3ip3 h HIS 183 N 0.00 0.46 -0.01 2.19 3.86 -1.83 -1.19 115.15 118.62 3ip3 h HIS 183 Ca -0.00 0.02 -0.21 0.00 -1.16 0.00 0.00 60.37 59.01 3ip3 h HIS 183 Cb 0.12 -0.14 -0.00 0.00 1.06 0.00 0.00 27.41 28.45 3ip3 h HIS 183 CO 0.00 0.23 -0.90 0.00 0.86 0.00 0.00 177.93 178.12 3ip3 h ALA 184 N 1.26 0.42 -0.76 2.45 0.00 -1.50 -1.74 119.26 119.39 3ip3 h ALA 184 Ca 0.21 -0.69 0.06 0.00 0.00 0.00 0.00 54.91 54.49 3ip3 h ALA 184 Cb 0.11 -0.03 -0.06 0.00 0.00 0.00 0.00 17.79 17.81 3ip3 h ALA 184 CO -0.14 0.82 0.45 0.82 0.00 0.00 0.00 179.25 181.20 3ip3 h ILE 185 N 0.22 1.00 -0.44 0.00 2.04 -1.25 0.68 117.51 119.77 3ip3 h ILE 185 Ca -0.07 -0.28 -0.06 0.00 1.00 0.00 0.00 64.86 65.45 3ip3 h ILE 185 Cb 1.52 0.10 -0.02 0.00 -0.74 0.00 0.00 36.82 37.69 3ip3 h ILE 185 CO 0.15 0.15 0.04 -0.78 0.00 0.00 0.00 178.15 177.71 3ip3 h ASP 186 N 0.83 0.73 -0.55 1.72 3.58 -1.01 -0.68 116.42 121.04 3ip3 h ASP 186 Ca 0.34 -0.28 0.07 0.00 0.42 0.00 0.00 57.03 57.58 3ip3 h ASP 186 Cb 0.18 -0.19 -0.06 0.00 1.72 0.00 0.00 39.33 40.98 3ip3 h ASP 186 CO -0.18 0.83 0.22 -0.50 -2.88 0.00 0.00 179.24 176.73 3ip3 h TRP 187 N 0.60 0.38 0.13 0.28 6.55 -0.51 0.16 115.95 123.55 3ip3 h TRP 187 Ca 0.13 0.03 -0.01 0.00 0.95 0.00 0.00 58.89 59.99 3ip3 h TRP 187 Cb 0.43 -0.09 0.00 0.00 -0.86 0.00 0.00 29.16 28.65 3ip3 h TRP 187 CO 0.03 0.13 -0.06 0.82 -1.05 0.00 0.00 178.44 178.31 3ip3 h ILE 188 N 0.41 0.95 0.12 1.49 2.04 -0.71 0.20 117.51 122.01 3ip3 h ILE 188 Ca 0.26 -0.32 0.02 0.00 1.00 0.00 0.00 64.86 65.82 3ip3 h ILE 188 Cb 0.28 1.15 -0.04 0.00 -0.74 0.00 0.00 36.82 37.47 3ip3 h ILE 188 CO -0.25 0.08 -0.38 -0.74 0.00 0.00 0.00 178.15 176.86 3ip3 h HIS 189 N -0.33 -1.04 -0.21 1.37 2.76 -0.91 -1.00 115.15 115.79 3ip3 h HIS 189 Ca -0.02 0.03 0.03 0.00 -2.20 0.00 0.00 60.37 58.21 3ip3 h HIS 189 Cb 0.27 0.44 -0.03 0.00 1.55 0.00 0.00 27.41 29.63 3ip3 h HIS 189 CO -0.02 -0.48 0.00 2.35 -1.30 0.00 0.00 177.93 178.48 3ip3 h TRP 190 N -0.61 -0.01 0.04 5.26 7.01 -0.64 -0.98 115.95 126.02 3ip3 h TRP 190 Ca 0.03 0.02 -0.25 0.00 2.11 0.00 0.00 58.89 60.79 3ip3 h TRP 190 Cb 0.64 0.03 0.01 0.00 -2.10 0.00 0.00 29.16 27.74 3ip3 h TRP 190 CO -0.33 -0.03 -1.04 0.82 -2.79 0.00 0.00 178.44 175.07 3ip3 h ILE 191 N 0.07 1.39 0.02 2.65 2.04 -0.57 -3.33 117.51 119.78 3ip3 h ILE 191 Ca 0.10 -2.52 -0.24 0.00 1.00 0.00 0.00 64.86 63.20 3ip3 h ILE 191 Cb 0.12 2.53 -0.03 0.00 -0.74 0.00 0.00 36.82 38.70 3ip3 h ILE 191 CO -0.16 0.75 -1.23 0.71 0.00 0.00 0.00 178.15 178.22 3ip3 h THR 192 N 0.23 1.45 -0.59 -0.27 1.35 -1.19 -3.46 112.91 110.42 3ip3 h THR 192 Ca -0.11 -3.18 -0.26 0.00 -0.55 0.00 0.00 66.41 62.31 3ip3 h THR 192 Cb 1.70 2.74 -0.10 0.00 -1.73 0.00 0.00 68.15 70.76 3ip3 h THR 192 CO 0.18 0.84 -0.23 0.61 -0.25 0.00 0.00 175.52 176.67 3ip3 n GLY 193 N 1.43 1.30 3.68 5.82 0.00 -0.38 -4.99 105.19 112.06 3ip3 n GLY 193 Ca -0.06 -0.24 -0.29 0.00 0.00 0.00 0.00 46.02 45.43 3ip3 n GLY 193 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ip3 s LYS 194 N -2.96 2.50 0.28 1.61 1.02 -1.26 -5.10 119.74 115.84 3ip3 s LYS 194 Ca 0.00 -0.91 -0.29 0.00 0.02 0.00 0.00 55.97 54.79 3ip3 s LYS 194 Cb 0.00 -2.49 -0.09 0.00 -0.52 0.00 0.00 37.83 34.73 3ip3 s LYS 194 CO 0.00 0.52 1.02 0.15 -0.92 0.00 0.00 175.35 176.12 3ip3 s LYS 195 N -2.47 4.68 -0.06 1.68 1.02 -1.26 -4.84 119.74 118.49 3ip3 s LYS 195 Ca 0.26 1.62 -0.27 0.00 0.02 0.00 0.00 55.97 57.61 3ip3 s LYS 195 Cb -0.11 -3.14 -0.03 0.00 -0.52 0.00 0.00 37.83 34.03 3ip3 s LYS 195 CO 0.18 0.31 0.84 -0.06 -0.92 0.00 0.00 175.35 175.70 3ip3 s PHE 196 N -1.25 3.57 -0.18 3.18 0.40 -1.26 -1.17 117.98 121.27 3ip3 s PHE 196 Ca 0.45 1.43 -0.04 0.00 -0.60 0.00 0.00 56.93 58.17 3ip3 s PHE 196 Cb -0.28 -2.98 -0.22 0.00 0.51 0.00 0.00 43.02 40.05 3ip3 s PHE 196 CO 0.35 -0.03 0.10 1.28 0.70 0.00 0.00 175.22 177.62 3ip3 n LEU 197 N 4.18 2.71 -3.62 -0.37 4.77 0.86 -3.50 117.00 122.03 3ip3 n LEU 197 Ca 0.03 0.09 -0.10 0.00 -0.03 0.00 0.00 56.01 56.00 3ip3 n LEU 197 Cb 0.51 -1.02 -0.03 0.00 -2.33 0.00 0.00 43.42 40.54 3ip3 n LEU 197 CO 0.49 0.85 0.31 -0.94 -1.33 0.00 0.00 177.39 176.77 3ip3 s SER 198 N -6.85 -0.36 -0.06 -1.43 1.04 -1.10 -0.58 113.70 104.36 3ip3 s SER 198 Ca -0.28 -0.30 -0.04 0.00 0.48 0.00 0.00 55.95 55.81 3ip3 s SER 198 Cb 0.08 0.58 0.02 0.00 0.10 0.00 0.00 66.02 66.80 3ip3 s SER 198 CO 0.69 -1.01 0.14 0.54 0.98 0.00 0.00 173.24 174.58 3ip3 s VAL 199 N -3.82 -0.01 -0.12 5.02 0.11 -0.28 -1.54 120.40 119.76 3ip3 s VAL 199 Ca 0.05 0.05 0.03 0.00 -2.93 0.00 0.00 61.98 59.19 3ip3 s VAL 199 Cb -0.01 -0.21 0.01 0.00 -1.53 0.00 0.00 36.38 34.63 3ip3 s VAL 199 CO -0.07 0.02 -0.21 -0.47 -3.33 0.00 0.00 175.10 171.03 3ip3 s TYR 200 N 0.42 2.51 0.03 1.54 5.04 -0.39 -0.49 117.35 126.01 3ip3 s TYR 200 Ca -0.03 -1.17 -0.01 0.00 -2.44 0.00 0.00 57.07 53.42 3ip3 s TYR 200 Cb -0.04 -1.71 -0.02 0.00 0.35 0.00 0.00 41.96 40.54 3ip3 s TYR 200 CO -0.02 -0.52 -0.00 0.00 -1.34 0.00 0.00 175.55 173.67 3ip3 s ALA 201 N 0.67 0.19 0.14 3.97 0.00 -1.26 0.51 121.76 125.98 3ip3 s ALA 201 Ca -0.11 -0.74 0.05 0.00 0.00 0.00 0.00 51.96 51.15 3ip3 s ALA 201 Cb -0.16 0.20 -0.04 0.00 0.00 0.00 0.00 23.12 23.11 3ip3 s ALA 201 CO 0.02 -0.25 -0.11 0.95 0.00 0.00 0.00 175.76 176.37 3ip3 s THR 202 N -2.35 1.20 0.10 0.00 -4.23 0.26 -3.04 115.64 107.58 3ip3 s THR 202 Ca -0.08 -1.93 -0.13 0.00 -1.18 0.00 0.00 61.69 58.38 3ip3 s THR 202 Cb -0.03 -1.71 0.02 0.00 1.34 0.00 0.00 72.50 72.11 3ip3 s THR 202 CO -0.04 -0.64 0.30 -1.38 -0.54 0.00 0.00 174.62 172.32 3ip3 s HIS 203 N -2.91 -0.04 -0.02 3.99 -3.43 -1.26 -1.58 115.29 110.04 3ip3 s HIS 203 Ca 0.13 -0.31 -0.00 0.00 -0.80 0.00 0.00 55.06 54.08 3ip3 s HIS 203 Cb -0.00 0.10 0.02 0.00 -1.43 0.00 0.00 32.58 31.28 3ip3 s HIS 203 CO 0.01 -0.61 0.03 0.45 -2.00 0.00 0.00 174.74 172.62 3ip3 s SER 204 N -2.76 0.04 -0.11 7.38 0.15 -0.45 -4.99 113.70 112.96 3ip3 s SER 204 Ca 0.03 0.05 0.16 0.00 0.70 0.00 0.00 55.95 56.89 3ip3 s SER 204 Cb 0.03 -0.04 0.66 0.00 -1.71 0.00 0.00 66.02 64.96 3ip3 s SER 204 CO -0.11 -0.10 1.55 -2.11 1.20 0.00 0.00 173.24 173.67 3ip3 n ARG 205 N 3.95 3.52 -2.18 5.44 1.85 -1.26 -1.20 116.66 126.79 3ip3 n ARG 205 Ca -0.25 -2.59 -0.41 0.00 -1.00 0.00 0.00 57.85 53.61 3ip3 n ARG 205 Cb 0.52 -1.86 -0.03 0.00 -1.05 0.00 0.00 32.46 30.05 3ip3 n ARG 205 CO 0.00 0.00 0.00 -0.51 -0.01 0.00 0.00 177.63 177.11 3ip3 s LEU 206 N -1.74 4.43 -1.19 2.89 1.43 -1.26 -3.63 118.68 119.62 3ip3 s LEU 206 Ca 0.46 2.55 -0.02 0.00 -1.03 0.00 0.00 54.13 56.09 3ip3 s LEU 206 Cb 0.30 -3.63 -0.01 0.00 0.03 0.00 0.00 46.19 42.88 3ip3 s LEU 206 CO 0.22 -0.51 0.92 1.41 0.23 0.00 0.00 176.35 178.62 3ip3 n HIS 207 N 1.62 -2.19 -0.99 0.29 8.25 -1.26 -4.73 115.22 116.20 3ip3 n HIS 207 Ca 0.03 0.89 -0.04 0.00 -0.26 0.00 0.00 57.72 58.33 3ip3 n HIS 207 Cb 0.42 -4.71 0.32 0.00 1.12 0.00 0.00 29.99 27.14 3ip3 n HIS 207 CO 0.00 0.00 0.00 0.27 0.64 0.00 0.00 176.34 177.25 3ip3 n ASN 208 N -3.12 4.98 -3.91 0.41 6.94 -1.24 -4.93 115.26 114.39 3ip3 n ASN 208 Ca -0.24 -3.16 -0.30 0.00 -0.02 0.00 0.00 54.58 50.85 3ip3 n ASN 208 Cb 0.66 -0.74 0.03 0.00 -2.36 0.00 0.00 39.78 37.37 3ip3 n ASN 208 CO 0.00 0.00 0.00 -1.20 -1.03 0.00 0.00 177.26 175.03 3ip3 n SER 209 N -0.02 -4.93 -0.90 0.53 7.64 -1.26 -1.55 113.62 113.14 3ip3 n SER 209 Ca 0.39 -0.77 -0.08 0.00 1.01 0.00 0.00 58.87 59.42 3ip3 n SER 209 Cb 1.36 -3.93 -0.01 0.00 -1.01 0.00 0.00 64.21 60.63 3ip3 n SER 209 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3ip3 n GLY 210 N -1.71 0.12 2.03 0.23 0.00 -1.26 -4.94 105.19 99.66 3ip3 n GLY 210 Ca 0.05 -0.56 -0.05 0.00 0.00 0.00 0.00 46.02 45.46 3ip3 n GLY 210 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3ip3 n HIS 211 N -3.89 2.47 0.00 1.61 8.25 -0.59 -5.03 115.22 118.04 3ip3 n HIS 211 Ca -0.10 -1.16 0.00 0.00 -0.26 0.00 0.00 57.72 56.21 3ip3 n HIS 211 Cb 0.55 -0.68 0.00 0.00 1.12 0.00 0.00 29.99 30.97 3ip3 n HIS 211 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3ip3 n GLY 212 N -0.06 2.55 0.40 -1.41 0.00 -1.26 -1.91 105.19 103.50 3ip3 n GLY 212 Ca 0.40 0.17 0.13 0.00 0.00 0.00 0.00 46.02 46.73 3ip3 n GLY 212 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3ip3 n GLU 213 N 6.08 1.55 -1.98 1.61 1.02 0.19 -4.90 120.64 124.21 3ip3 n GLU 213 Ca 0.00 -0.80 -0.42 0.00 -0.02 0.00 0.00 57.16 55.92 3ip3 n GLU 213 Cb 0.00 -1.46 -0.03 0.00 -0.02 0.00 0.00 31.44 29.93 3ip3 n GLU 213 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 3ip3 s LEU 214 N -1.90 4.37 -0.10 -4.62 0.20 -0.80 -4.80 118.68 111.03 3ip3 s LEU 214 Ca 0.38 2.58 -0.23 0.00 0.69 0.00 0.00 54.13 57.55 3ip3 s LEU 214 Cb 0.20 -3.60 -0.03 0.00 -0.43 0.00 0.00 46.19 42.33 3ip3 s LEU 214 CO 0.32 -0.78 0.70 -1.61 -0.29 0.00 0.00 176.35 174.69 3ip3 s GLU 215 N 0.93 4.38 0.05 1.98 8.01 -1.26 -4.53 118.70 128.26 3ip3 s GLU 215 Ca 0.68 0.84 0.13 0.00 0.01 0.00 0.00 54.97 56.63 3ip3 s GLU 215 Cb -0.42 -3.49 -0.17 0.00 -4.31 0.00 0.00 34.13 25.74 3ip3 s GLU 215 CO 0.33 -0.04 0.90 1.79 0.01 0.00 0.00 175.26 178.25 3ip3 h THR 216 N 4.89 0.88 -3.94 3.63 1.35 -1.45 -3.43 112.91 114.84 3ip3 h THR 216 Ca -0.38 -2.55 -0.30 0.00 -0.55 0.00 0.00 66.41 62.63 3ip3 h THR 216 Cb 1.18 2.37 -0.24 0.00 -1.73 0.00 0.00 68.15 69.72 3ip3 h THR 216 CO 0.77 0.50 -0.74 0.42 -0.25 0.00 0.00 175.52 176.22 3ip3 s THR 217 N -2.76 0.49 0.03 6.82 -4.23 -1.16 0.96 115.64 115.79 3ip3 s THR 217 Ca -0.02 -0.69 -0.17 0.00 -1.18 0.00 0.00 61.69 59.62 3ip3 s THR 217 Cb 0.08 -0.50 0.03 0.00 1.34 0.00 0.00 72.50 73.46 3ip3 s THR 217 CO 0.81 -0.15 0.38 0.00 -0.54 0.00 0.00 174.62 175.12 3ip3 s ALA 218 N -0.81 -0.92 -0.02 3.99 0.00 0.06 -1.34 121.76 122.72 3ip3 s ALA 218 Ca -0.04 0.27 0.01 0.00 0.00 0.00 0.00 51.96 52.19 3ip3 s ALA 218 Cb -0.06 0.29 0.02 0.00 0.00 0.00 0.00 23.12 23.36 3ip3 s ALA 218 CO 0.00 -0.42 -0.02 -1.17 0.00 0.00 0.00 175.76 174.16 3ip3 s LEU 219 N -1.90 1.49 -0.01 0.00 2.96 -0.61 -0.73 118.68 119.87 3ip3 s LEU 219 Ca -0.06 -0.05 0.05 0.00 -0.22 0.00 0.00 54.13 53.84 3ip3 s LEU 219 Cb -0.01 -0.24 -0.01 0.00 0.50 0.00 0.00 46.19 46.42 3ip3 s LEU 219 CO -0.01 -0.04 -0.16 0.00 -1.32 0.00 0.00 176.35 174.81 3ip3 s HIS 221 N -0.36 2.98 -0.12 0.00 2.46 0.18 -1.26 115.29 119.17 3ip3 s HIS 221 Ca 0.06 -1.82 -0.03 0.00 0.47 0.00 0.00 55.06 53.74 3ip3 s HIS 221 Cb -0.07 -1.95 -0.03 0.00 -0.13 0.00 0.00 32.58 30.40 3ip3 s HIS 221 CO -0.01 -0.81 -0.01 -0.06 -2.47 0.00 0.00 174.74 171.39 3ip3 s PHE 222 N 1.24 3.12 -0.24 3.88 0.08 0.02 -1.26 117.98 124.83 3ip3 s PHE 222 Ca 0.00 0.01 -0.11 0.00 0.12 0.00 0.00 56.93 56.96 3ip3 s PHE 222 Cb -0.16 -1.88 -0.05 0.00 -0.57 0.00 0.00 43.02 40.36 3ip3 s PHE 222 CO -0.09 0.26 0.16 0.99 -0.10 0.00 0.00 175.22 176.44 3ip3 s THR 223 N -0.30 5.36 0.50 0.64 2.01 -0.59 -1.29 115.64 121.97 3ip3 s THR 223 Ca 0.06 0.19 0.06 0.00 0.31 0.00 0.00 61.69 62.32 3ip3 s THR 223 Cb -0.12 -3.50 0.02 0.00 0.01 0.00 0.00 72.50 68.90 3ip3 s THR 223 CO 0.02 0.35 0.39 -0.76 -0.69 0.00 0.00 174.62 173.93 3ip3 s LEU 224 N 0.99 2.91 0.68 4.42 1.02 0.67 -0.10 118.68 129.28 3ip3 s LEU 224 Ca 0.08 -1.11 -0.17 0.00 0.02 0.00 0.00 54.13 52.95 3ip3 s LEU 224 Cb -0.13 -1.42 -0.05 0.00 0.02 0.00 0.00 46.19 44.61 3ip3 s LEU 224 CO 0.04 -0.95 0.54 -0.62 0.02 0.00 0.00 176.35 175.38 3ip3 n GLU 225 N -1.67 0.37 -2.41 1.70 1.02 -0.31 -3.14 120.64 116.19 3ip3 n GLU 225 Ca 0.00 0.16 -0.20 0.00 -0.02 0.00 0.00 57.16 57.11 3ip3 n GLU 225 Cb 0.64 -1.81 -0.01 0.00 -0.02 0.00 0.00 31.44 30.24 3ip3 n GLU 225 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 3ip3 n ASN 226 N -0.12 -5.67 -3.29 1.62 5.15 -1.26 -2.31 115.26 109.38 3ip3 n ASN 226 Ca 0.10 -0.03 -0.24 0.00 -0.60 0.00 0.00 54.58 53.81 3ip3 n ASN 226 Cb 0.49 -4.68 0.02 0.00 -0.53 0.00 0.00 39.78 35.08 3ip3 n ASN 226 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 3ip3 n GLU 227 N -2.95 -4.66 -2.88 1.20 1.02 -1.19 -4.95 120.64 106.23 3ip3 n GLU 227 Ca -0.23 0.71 -0.41 0.00 -0.02 0.00 0.00 57.16 57.21 3ip3 n GLU 227 Cb 0.67 -5.54 -0.04 0.00 -0.02 0.00 0.00 31.44 26.52 3ip3 n GLU 227 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 3ip3 s VAL 228 N -3.11 4.93 0.02 2.62 1.01 -0.98 -4.95 120.40 119.94 3ip3 s VAL 228 Ca 0.40 1.70 0.02 0.00 0.00 0.00 0.00 61.98 64.11 3ip3 s VAL 228 Cb -0.20 -4.16 -0.04 0.00 0.00 0.00 0.00 36.38 31.99 3ip3 s VAL 228 CO 0.50 0.13 -0.00 -0.36 0.00 0.00 0.00 175.10 175.36 3ip3 s PHE 229 N 1.42 3.04 -0.05 5.22 0.08 -1.15 -0.23 117.98 126.31 3ip3 s PHE 229 Ca 0.42 0.05 0.01 0.00 0.12 0.00 0.00 56.93 57.53 3ip3 s PHE 229 Cb -0.18 -1.63 0.02 0.00 -0.57 0.00 0.00 43.02 40.65 3ip3 s PHE 229 CO 0.18 0.46 -0.06 0.00 -0.10 0.00 0.00 175.22 175.70 3ip3 s ALA 230 N -1.13 0.80 0.01 5.36 0.00 -0.41 -1.09 121.76 125.30 3ip3 s ALA 230 Ca 0.21 -0.14 -0.00 0.00 0.00 0.00 0.00 51.96 52.03 3ip3 s ALA 230 Cb -0.12 -0.43 -0.04 0.00 0.00 0.00 0.00 23.12 22.53 3ip3 s ALA 230 CO 0.12 0.03 0.11 -1.54 0.00 0.00 0.00 175.76 174.48 3ip3 s SER 231 N 0.79 5.83 -0.20 0.00 1.04 0.09 -0.80 113.70 120.45 3ip3 s SER 231 Ca -0.12 0.16 -0.03 0.00 0.48 0.00 0.00 55.95 56.44 3ip3 s SER 231 Cb -0.14 -1.70 0.06 0.00 0.10 0.00 0.00 66.02 64.34 3ip3 s SER 231 CO 0.01 0.25 0.06 -0.22 0.98 0.00 0.00 173.24 174.31 3ip3 s LEU 232 N -1.95 0.98 -0.20 2.42 2.96 -0.39 -0.96 118.68 121.55 3ip3 s LEU 232 Ca 0.26 -0.83 -0.11 0.00 -0.22 0.00 0.00 54.13 53.22 3ip3 s LEU 232 Cb -0.12 -0.50 -0.05 0.00 0.50 0.00 0.00 46.19 46.02 3ip3 s LEU 232 CO 0.17 -0.33 0.20 -0.55 -1.32 0.00 0.00 176.35 174.52 3ip3 s SER 233 N 1.93 6.27 -0.06 3.68 0.15 -0.83 -1.25 113.70 123.59 3ip3 s SER 233 Ca 0.01 0.30 0.03 0.00 0.70 0.00 0.00 55.95 56.98 3ip3 s SER 233 Cb -0.17 -2.13 0.01 0.00 -1.71 0.00 0.00 66.02 62.03 3ip3 s SER 233 CO -0.10 0.12 -0.12 -0.63 1.20 0.00 0.00 173.24 173.71 3ip3 s ILE 234 N 0.58 1.10 0.02 6.45 1.01 0.09 -0.92 121.20 129.53 3ip3 s ILE 234 Ca 0.11 -0.48 -0.11 0.00 0.00 0.00 0.00 60.65 60.17 3ip3 s ILE 234 Cb -0.12 -1.00 0.01 0.00 0.01 0.00 0.00 42.46 41.36 3ip3 s ILE 234 CO 0.01 0.34 0.22 1.51 0.00 0.00 0.00 174.94 177.02 3ip3 s ASP 235 N 0.52 -0.03 -0.53 3.58 -4.77 -0.74 -0.76 116.67 113.94 3ip3 s ASP 235 Ca -0.11 -0.21 0.01 0.00 -3.30 0.00 0.00 52.55 48.94 3ip3 s ASP 235 Cb -0.14 0.28 0.48 0.00 -1.09 0.00 0.00 42.92 42.45 3ip3 s ASP 235 CO 0.03 -0.49 1.80 -1.22 0.70 0.00 0.00 175.17 175.99 3ip3 n TYR 236 N 0.99 2.94 -1.26 2.11 0.53 0.27 -1.90 117.16 120.84 3ip3 n TYR 236 Ca -0.20 -2.61 0.03 0.00 -1.02 0.00 0.00 57.90 54.09 3ip3 n TYR 236 Cb 0.57 -1.08 0.21 0.00 -1.03 0.00 0.00 39.34 38.01 3ip3 n TYR 236 CO 0.00 0.00 0.00 1.28 -1.02 0.00 0.00 176.86 177.12 3ip3 n LEU 237 N -0.92 3.73 -4.64 7.72 4.77 -1.19 -3.99 117.00 122.48 3ip3 n LEU 237 Ca 0.56 -3.44 -0.43 0.00 -0.03 0.00 0.00 56.01 52.68 3ip3 n LEU 237 Cb 0.88 -0.57 -0.03 0.00 -2.33 0.00 0.00 43.42 41.37 3ip3 n LEU 237 CO 0.64 1.00 1.34 -0.60 -1.33 0.00 0.00 177.39 178.44 3ip3 s ARG 238 N -3.06 3.96 0.43 3.23 3.52 -0.92 -4.93 118.95 121.18 3ip3 s ARG 238 Ca 0.42 1.82 -0.24 0.00 -0.13 0.00 0.00 55.73 57.60 3ip3 s ARG 238 Cb 0.37 -3.99 -0.10 0.00 -1.56 0.00 0.00 34.95 29.67 3ip3 s ARG 238 CO 0.03 -1.09 1.13 -2.30 -0.81 0.00 0.00 175.30 172.25 3ip3 n PRO 239 N 7.37 1.57 -0.19 5.12 -0.02 -1.26 -4.17 135.00 143.42 3ip3 n PRO 239 Ca 0.18 0.56 0.17 0.00 -2.02 0.00 0.00 63.50 62.39 3ip3 n PRO 239 Cb 0.44 -2.20 0.51 0.00 -0.02 0.00 0.00 33.50 32.23 3ip3 n PRO 239 CO 0.00 0.00 0.00 1.96 1.98 0.00 0.00 175.50 179.44 3ip3 h GLN 240 N 1.71 0.40 0.00 -0.52 1.08 -1.98 -1.61 115.11 114.18 3ip3 h GLN 240 Ca -0.46 -0.02 0.00 0.00 -1.45 0.00 0.00 58.65 56.71 3ip3 h GLN 240 Cb 1.32 -0.09 0.00 0.00 -0.05 0.00 0.00 27.48 28.66 3ip3 h GLN 240 CO 0.58 0.27 0.00 0.41 -0.95 0.00 0.00 178.83 179.13 3ip3 n GLY 241 N -1.52 -0.96 3.75 3.46 0.00 -1.26 -4.87 105.19 103.79 3ip3 n GLY 241 Ca 0.16 0.07 -0.37 0.00 0.00 0.00 0.00 46.02 45.88 3ip3 n GLY 241 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ip3 s ALA 242 N -3.25 2.61 0.20 4.61 0.00 -0.61 -4.93 121.76 120.40 3ip3 s ALA 242 Ca 0.02 1.09 0.33 0.00 0.00 0.00 0.00 51.96 53.40 3ip3 s ALA 242 Cb 0.07 -3.48 1.42 0.00 0.00 0.00 0.00 23.12 21.12 3ip3 s ALA 242 CO 0.24 -1.21 2.01 -1.00 0.00 0.00 0.00 175.76 175.80 3ip3 h PRO 243 N 1.06 0.00 -5.21 0.00 0.13 -1.90 -3.44 132.00 122.64 3ip3 h PRO 243 Ca -0.50 0.00 -0.38 0.00 -0.87 0.00 0.00 66.00 64.25 3ip3 h PRO 243 Cb 1.30 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 32.28 3ip3 h PRO 243 CO 0.56 0.05 -0.70 0.95 -0.23 0.00 0.00 178.00 178.63 3ip3 s THR 244 N -3.78 1.30 -0.72 1.56 -4.23 -1.26 -5.05 115.64 103.46 3ip3 s THR 244 Ca -0.00 -2.09 0.23 0.00 -1.18 0.00 0.00 61.69 58.65 3ip3 s THR 244 Cb 0.10 -2.05 0.23 0.00 1.34 0.00 0.00 72.50 72.12 3ip3 s THR 244 CO 0.55 -0.58 1.72 0.00 -0.54 0.00 0.00 174.62 175.76 3ip3 n HIS 245 N -0.32 0.58 -4.07 3.99 1.44 -1.26 -4.89 115.22 110.70 3ip3 n HIS 245 Ca -0.08 0.20 -0.07 0.00 -2.01 0.00 0.00 57.72 55.76 3ip3 n HIS 245 Cb 0.61 -0.83 -0.10 0.00 0.12 0.00 0.00 29.99 29.80 3ip3 n HIS 245 CO 0.00 0.00 0.00 0.16 -2.81 0.00 0.00 176.34 173.69 3ip3 s ASP 246 N -3.92 0.44 -0.43 4.39 -4.77 -1.26 -1.91 116.67 109.20 3ip3 s ASP 246 Ca 0.08 -0.90 0.05 0.00 -3.30 0.00 0.00 52.55 48.48 3ip3 s ASP 246 Cb 0.12 0.18 0.17 0.00 -1.09 0.00 0.00 42.92 42.30 3ip3 s ASP 246 CO 0.45 -0.54 0.44 -0.62 0.70 0.00 0.00 175.17 175.60 3ip3 s ASP 247 N -2.62 0.69 -0.04 2.11 2.15 -0.74 -5.01 116.67 113.21 3ip3 s ASP 247 Ca 0.02 -2.52 -0.22 0.00 0.43 0.00 0.00 52.55 50.26 3ip3 s ASP 247 Cb 0.04 0.29 -0.04 0.00 -0.30 0.00 0.00 42.92 42.91 3ip3 s ASP 247 CO -0.08 -0.15 0.64 -1.81 -0.17 0.00 0.00 175.17 173.60 3ip3 s ASP 248 N 0.46 6.96 0.18 -0.34 1.01 -1.26 -3.47 116.67 120.21 3ip3 s ASP 248 Ca 0.30 1.15 0.04 0.00 0.71 0.00 0.00 52.55 54.74 3ip3 s ASP 248 Cb -0.00 -2.38 -0.01 0.00 1.01 0.00 0.00 42.92 41.53 3ip3 s ASP 248 CO -0.13 -0.02 0.13 0.54 0.21 0.00 0.00 175.17 175.90 3ip3 n ARG 249 N 3.35 0.32 -3.32 8.23 1.74 -0.77 -4.35 116.66 121.86 3ip3 n ARG 249 Ca -0.04 -1.74 0.03 0.00 -0.77 0.00 0.00 57.85 55.33 3ip3 n ARG 249 Cb 0.51 1.32 -0.04 0.00 -1.02 0.00 0.00 32.46 33.23 3ip3 n ARG 249 CO 0.00 0.00 0.00 0.50 -1.52 0.00 0.00 177.63 176.61 3ip3 s ARG 251 N -2.72 0.11 -0.26 5.56 3.52 0.70 -0.67 118.95 125.19 3ip3 s ARG 251 Ca 0.19 0.25 -0.01 0.00 -0.13 0.00 0.00 55.73 56.02 3ip3 s ARG 251 Cb 0.01 0.13 0.04 0.00 -1.56 0.00 0.00 34.95 33.56 3ip3 s ARG 251 CO 0.13 -0.03 -0.06 0.42 -0.81 0.00 0.00 175.30 174.94 3ip3 s ILE 252 N 1.95 2.74 -0.25 4.11 1.01 -0.18 -0.66 121.20 129.92 3ip3 s ILE 252 Ca -0.02 -1.19 -0.08 0.00 0.00 0.00 0.00 60.65 59.37 3ip3 s ILE 252 Cb -0.02 -2.45 -0.03 0.00 0.01 0.00 0.00 42.46 39.97 3ip3 s ILE 252 CO -0.15 0.12 0.08 -0.69 0.00 0.00 0.00 174.94 174.30 3ip3 s VAL 253 N 1.27 4.47 0.49 2.92 1.01 0.13 -1.62 120.40 129.07 3ip3 s VAL 253 Ca -0.02 -0.12 0.01 0.00 0.00 0.00 0.00 61.98 61.85 3ip3 s VAL 253 Cb -0.18 -3.09 0.01 0.00 0.00 0.00 0.00 36.38 33.12 3ip3 s VAL 253 CO -0.04 0.34 0.07 0.61 0.00 0.00 0.00 175.10 176.07 3ip3 n GLY 254 N 4.85 3.45 0.20 4.51 0.00 0.57 -0.49 105.19 118.27 3ip3 n GLY 254 Ca -0.16 -2.35 0.08 0.00 0.00 0.00 0.00 46.02 43.59 3ip3 n GLY 254 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 3ip3 h THR 255 N 1.14 0.71 -0.00 2.61 1.35 0.49 -3.33 112.91 115.88 3ip3 h THR 255 Ca -0.38 -1.38 0.00 0.00 -0.55 0.00 0.00 66.41 64.10 3ip3 h THR 255 Cb 1.20 1.89 0.00 0.00 -1.73 0.00 0.00 68.15 69.51 3ip3 h THR 255 CO 0.63 0.30 -0.00 0.54 -0.25 0.00 0.00 175.52 176.74 3ip3 n ARG 256 N -3.43 5.34 -3.81 4.72 1.74 -0.29 -4.97 116.66 115.97 3ip3 n ARG 256 Ca 0.00 -0.10 -0.05 0.00 -0.77 0.00 0.00 57.85 56.93 3ip3 n ARG 256 Cb 0.49 -0.60 0.00 0.00 -1.02 0.00 0.00 32.46 31.33 3ip3 n ARG 256 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 3ip3 s GLY 257 N -0.79 -0.01 -0.08 -0.13 0.00 -1.11 -4.33 107.32 100.85 3ip3 s GLY 257 Ca 0.00 -0.21 -0.00 0.00 0.00 0.00 0.00 44.72 44.51 3ip3 s GLY 257 CO 0.00 0.68 -0.04 -0.42 0.00 0.00 0.00 173.10 173.32 3ip3 s ILE 258 N -2.85 0.68 -0.13 0.90 1.01 -0.05 -0.31 121.20 120.44 3ip3 s ILE 258 Ca 0.16 -0.09 -0.05 0.00 0.00 0.00 0.00 60.65 60.66 3ip3 s ILE 258 Cb -0.03 -0.75 -0.04 0.00 0.01 0.00 0.00 42.46 41.65 3ip3 s ILE 258 CO 0.05 0.30 0.06 -0.69 0.00 0.00 0.00 174.94 174.66 3ip3 s VAL 259 N 1.66 4.77 -0.01 2.92 1.01 -0.64 -0.66 120.40 129.45 3ip3 s VAL 259 Ca 0.02 -0.06 0.04 0.00 0.00 0.00 0.00 61.98 61.98 3ip3 s VAL 259 Cb -0.13 -3.08 -0.01 0.00 0.00 0.00 0.00 36.38 33.16 3ip3 s VAL 259 CO -0.05 0.55 -0.13 -0.70 0.00 0.00 0.00 175.10 174.76 3ip3 s GLU 260 N -0.40 1.11 -0.20 2.72 2.12 0.11 -1.01 118.70 123.14 3ip3 s GLU 260 Ca 0.09 -0.48 -0.03 0.00 0.36 0.00 0.00 54.97 54.91 3ip3 s GLU 260 Cb -0.12 -1.07 -0.01 0.00 0.26 0.00 0.00 34.13 33.19 3ip3 s GLU 260 CO 0.02 0.29 -0.05 0.08 -0.54 0.00 0.00 175.26 175.06 3ip3 s VAL 261 N -0.29 3.45 -0.27 3.70 1.01 -1.26 -0.29 120.40 126.44 3ip3 s VAL 261 Ca 0.05 -0.48 -0.19 0.00 0.00 0.00 0.00 61.98 61.36 3ip3 s VAL 261 Cb -0.05 -2.55 0.08 0.00 0.00 0.00 0.00 36.38 33.85 3ip3 s VAL 261 CO -0.00 0.44 0.69 -0.51 0.00 0.00 0.00 175.10 175.72 3ip3 s ILE 262 N 1.17 -0.00 -1.37 2.22 2.07 -0.58 -4.38 121.20 120.33 3ip3 s ILE 262 Ca 0.02 0.00 -0.08 0.00 -1.41 0.00 0.00 60.65 59.18 3ip3 s ILE 262 Cb -0.14 -0.99 0.01 0.00 0.13 0.00 0.00 42.46 41.47 3ip3 s ILE 262 CO -0.01 0.00 1.10 -3.20 -1.91 0.00 0.00 174.94 170.93 3ip3 n ASN 263 N 3.76 -6.34 -2.26 4.50 4.05 -1.26 -0.94 115.26 116.77 3ip3 n ASN 263 Ca -0.18 -0.50 -0.14 0.00 0.45 0.00 0.00 54.58 54.21 3ip3 n ASN 263 Cb 0.58 -4.99 -0.02 0.00 1.23 0.00 0.00 39.78 36.58 3ip3 n ASN 263 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 177.26 173.59 3ip3 n GLU 264 N -4.85 -1.99 -4.26 1.20 1.02 -1.26 -4.95 120.64 105.55 3ip3 n GLU 264 Ca -0.01 0.69 -0.16 0.00 -0.02 0.00 0.00 57.16 57.66 3ip3 n GLU 264 Cb 0.57 -5.25 -0.10 0.00 -0.02 0.00 0.00 31.44 26.64 3ip3 n GLU 264 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 3ip3 s ARG 265 N -4.72 1.09 -0.07 3.49 0.52 -0.12 -4.65 118.95 114.50 3ip3 s ARG 265 Ca 0.00 -1.38 0.05 0.00 -0.52 0.00 0.00 55.73 53.87 3ip3 s ARG 265 Cb 0.00 -0.82 -0.00 0.00 0.52 0.00 0.00 34.95 34.64 3ip3 s ARG 265 CO 0.00 0.13 -0.22 0.08 0.02 0.00 0.00 175.30 175.32 3ip3 s VAL 266 N -2.76 1.84 0.00 3.52 1.01 -1.26 -1.52 120.40 121.22 3ip3 s VAL 266 Ca 0.14 -0.92 0.06 0.00 0.00 0.00 0.00 61.98 61.27 3ip3 s VAL 266 Cb -0.01 -1.58 -0.02 0.00 0.00 0.00 0.00 36.38 34.77 3ip3 s VAL 266 CO 0.03 0.51 -0.20 -0.36 0.00 0.00 0.00 175.10 175.08 3ip3 s PHE 267 N 0.16 1.78 -0.07 5.22 0.40 0.60 -0.83 117.98 125.24 3ip3 s PHE 267 Ca -0.11 -0.35 0.04 0.00 -0.60 0.00 0.00 56.93 55.92 3ip3 s PHE 267 Cb -0.15 -1.12 -0.00 0.00 0.51 0.00 0.00 43.02 42.26 3ip3 s PHE 267 CO 0.05 0.01 -0.20 -1.17 0.70 0.00 0.00 175.22 174.61 3ip3 s LEU 268 N -0.68 1.95 -0.13 -0.37 2.96 -0.43 0.04 118.68 122.02 3ip3 s LEU 268 Ca 0.08 -0.44 0.02 0.00 -0.22 0.00 0.00 54.13 53.56 3ip3 s LEU 268 Cb -0.08 -1.17 0.01 0.00 0.50 0.00 0.00 46.19 45.45 3ip3 s LEU 268 CO -0.00 0.15 -0.18 -0.89 -1.32 0.00 0.00 176.35 174.11 3ip3 s THR 269 N 0.24 1.73 0.00 3.68 2.01 0.17 -1.65 115.64 121.82 3ip3 s THR 269 Ca -0.11 -0.77 0.00 0.00 0.31 0.00 0.00 61.69 61.12 3ip3 s THR 269 Cb -0.15 -1.56 0.00 0.00 0.01 0.00 0.00 72.50 70.80 3ip3 s THR 269 CO 0.05 0.49 0.00 -0.90 -0.69 0.00 0.00 174.62 173.57 3ip3 n ASP 270 N 4.25 0.00 -0.27 3.53 5.68 -0.78 -0.88 116.55 128.09 3ip3 n ASP 270 Ca -0.19 0.00 -0.00 0.00 -0.50 0.00 0.00 54.79 54.10 3ip3 n ASP 270 Cb 0.51 0.00 0.07 0.00 -1.14 0.00 0.00 41.12 40.56 3ip3 n ASP 270 CO 0.00 0.00 0.00 1.05 -1.33 0.00 0.00 177.20 176.92 3ip3 h GLU 271 N 0.00 -0.04 0.00 0.11 4.11 -1.97 -1.98 114.58 114.80 3ip3 h GLU 271 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 3ip3 h GLU 271 Cb 0.00 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.26 3ip3 h GLU 271 CO 0.00 -0.03 0.00 1.63 0.07 0.00 0.00 179.01 180.68 3ip3 n LYS 272 N -5.49 0.98 0.00 1.06 5.02 -1.26 -5.01 118.16 113.47 3ip3 n LYS 272 Ca 0.09 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.38 3ip3 n LYS 272 Cb 0.39 -1.13 0.00 0.00 -0.02 0.00 0.00 35.03 34.27 3ip3 n LYS 272 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3ip3 n GLY 273 N 0.61 -0.87 3.44 0.72 0.00 -0.75 -4.99 105.19 103.36 3ip3 n GLY 273 Ca 0.06 -2.16 -0.35 0.00 0.00 0.00 0.00 46.02 43.58 3ip3 n GLY 273 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 3ip3 s HIS 274 N 0.00 3.02 0.01 1.61 2.46 -1.26 -1.86 115.29 119.27 3ip3 s HIS 274 Ca 0.00 -0.48 -0.12 0.00 0.47 0.00 0.00 55.06 54.93 3ip3 s HIS 274 Cb 0.00 -2.07 0.01 0.00 -0.13 0.00 0.00 32.58 30.40 3ip3 s HIS 274 CO 0.00 -0.24 0.25 -0.98 -2.47 0.00 0.00 174.74 171.30 3ip3 s ARG 275 N 0.95 0.65 0.26 2.88 1.70 -0.66 -5.03 118.95 119.70 3ip3 s ARG 275 Ca 0.01 -0.35 -0.30 0.00 -0.47 0.00 0.00 55.73 54.62 3ip3 s ARG 275 Cb -0.14 0.28 -0.09 0.00 -0.57 0.00 0.00 34.95 34.42 3ip3 s ARG 275 CO 0.02 -0.18 0.98 -2.00 -1.08 0.00 0.00 175.30 173.03 3ip3 s GLU 276 N -1.69 4.78 -0.12 3.89 2.12 -1.26 -1.31 118.70 125.11 3ip3 s GLU 276 Ca -0.11 1.56 -0.06 0.00 0.36 0.00 0.00 54.97 56.71 3ip3 s GLU 276 Cb -0.05 -3.22 -0.04 0.00 0.26 0.00 0.00 34.13 31.08 3ip3 s GLU 276 CO 0.01 0.42 0.10 0.08 -0.54 0.00 0.00 175.26 175.34 3ip3 s VAL 277 N -1.21 5.17 0.50 3.70 1.01 -0.01 -4.92 120.40 124.65 3ip3 s VAL 277 Ca 0.43 0.08 -0.21 0.00 0.00 0.00 0.00 61.98 62.27 3ip3 s VAL 277 Cb -0.27 -3.24 -0.07 0.00 0.00 0.00 0.00 36.38 32.80 3ip3 s VAL 277 CO 0.34 0.60 1.16 -2.16 0.00 0.00 0.00 175.10 175.04 3ip3 s PRO 278 N -0.86 3.55 -0.01 2.72 0.04 -1.26 -4.52 135.00 134.66 3ip3 s PRO 278 Ca 0.14 1.74 -0.15 0.00 0.04 0.00 0.00 61.00 62.77 3ip3 s PRO 278 Cb -0.12 -2.24 -0.06 0.00 0.04 0.00 0.00 34.50 32.13 3ip3 s PRO 278 CO 0.03 -0.71 0.40 -0.51 0.04 0.00 0.00 177.00 176.25 3ip3 s LEU 279 N -3.36 4.46 1.12 -3.56 1.43 -1.26 -5.03 118.68 112.47 3ip3 s LEU 279 Ca 0.68 0.93 -0.14 0.00 -1.03 0.00 0.00 54.13 54.57 3ip3 s LEU 279 Cb -0.28 -2.57 0.25 0.00 0.03 0.00 0.00 46.19 43.62 3ip3 s LEU 279 CO 0.32 0.30 1.07 0.68 0.23 0.00 0.00 176.35 178.95 3ip3 s VAL 280 N -0.94 1.88 0.35 -1.59 -7.23 -1.26 -4.99 120.40 106.62 3ip3 s VAL 280 Ca 0.23 0.00 -0.27 0.00 -1.81 0.00 0.00 61.98 60.13 3ip3 s VAL 280 Cb -0.16 -2.36 -0.09 0.00 0.56 0.00 0.00 36.38 34.33 3ip3 s VAL 280 CO 0.13 0.00 1.22 -0.70 -0.31 0.00 0.00 175.10 175.44 3ip3 s GLU 281 N -4.93 4.25 0.80 4.82 2.12 -1.26 -4.65 118.70 119.85 3ip3 s GLU 281 Ca 0.67 2.01 -0.14 0.00 0.36 0.00 0.00 54.97 57.87 3ip3 s GLU 281 Cb -0.18 -2.92 0.06 0.00 0.26 0.00 0.00 34.13 31.35 3ip3 s GLU 281 CO 0.59 -0.20 1.04 0.36 -0.54 0.00 0.00 175.26 176.52 3ip3 n LYS 282 N 0.54 0.21 -1.78 4.30 2.85 -1.26 -4.75 118.16 118.26 3ip3 n LYS 282 Ca 0.02 0.14 -0.04 0.00 -1.05 0.00 0.00 58.31 57.38 3ip3 n LYS 282 Cb 0.44 -2.30 0.00 0.00 -0.65 0.00 0.00 35.03 32.52 3ip3 n LYS 282 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 3ip3 n GLY 283 N 0.81 2.89 3.13 2.58 0.00 0.34 -4.99 105.19 109.95 3ip3 n GLY 283 Ca 0.13 -2.18 -0.11 0.00 0.00 0.00 0.00 46.02 43.85 3ip3 n GLY 283 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3ip3 s GLN 284 N -2.34 0.25 0.26 1.61 -0.44 -1.26 -4.73 119.66 113.00 3ip3 s GLN 284 Ca 0.05 0.87 -0.02 0.00 -2.50 0.00 0.00 55.36 53.76 3ip3 s GLN 284 Cb -0.00 0.10 0.48 0.00 -1.64 0.00 0.00 33.01 31.94 3ip3 s GLN 284 CO 0.03 -0.30 1.81 0.97 0.50 0.00 0.00 175.29 178.30 3ip3 h ILE 285 N 6.22 0.87 0.00 -2.34 2.10 -1.87 -2.37 117.51 120.13 3ip3 h ILE 285 Ca -0.15 -0.28 -0.14 0.00 1.08 0.00 0.00 64.86 65.37 3ip3 h ILE 285 Cb 1.11 -0.01 -0.02 0.00 -1.09 0.00 0.00 36.82 36.81 3ip3 h ILE 285 CO 0.14 0.15 -0.66 0.15 -1.08 0.00 0.00 178.15 176.85 3ip3 h PHE 286 N 0.81 0.00 -0.70 2.19 3.57 -1.92 0.05 116.94 120.94 3ip3 h PHE 286 Ca 0.44 0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.96 3ip3 h PHE 286 Cb 0.47 0.00 -0.04 0.00 2.79 0.00 0.00 35.95 39.17 3ip3 h PHE 286 CO -0.05 0.66 0.45 0.93 -2.23 0.00 0.00 178.31 178.08 3ip3 h GLU 287 N 0.00 0.89 -0.53 1.11 5.08 -1.62 -0.02 114.58 119.50 3ip3 h GLU 287 Ca -0.01 -0.05 -0.12 0.00 -1.00 0.00 0.00 59.36 58.18 3ip3 h GLU 287 Cb 1.33 -0.20 -0.02 0.00 0.50 0.00 0.00 28.75 30.36 3ip3 h GLU 287 CO 0.09 0.59 -0.14 0.22 -1.00 0.00 0.00 179.01 178.77 3ip3 h ASP 288 N 0.92 1.04 -0.21 1.42 3.58 -1.02 -1.10 116.42 121.04 3ip3 h ASP 288 Ca 0.26 -0.36 0.03 0.00 0.42 0.00 0.00 57.03 57.38 3ip3 h ASP 288 Cb -0.07 -0.28 -0.03 0.00 1.72 0.00 0.00 39.33 40.66 3ip3 h ASP 288 CO -0.07 1.16 0.03 0.15 -2.88 0.00 0.00 179.24 177.63 3ip3 h PHE 289 N 0.90 0.04 -0.54 0.28 3.04 -0.73 -1.89 116.94 118.05 3ip3 h PHE 289 Ca 0.13 0.01 -0.01 0.00 3.98 0.00 0.00 57.97 62.09 3ip3 h PHE 289 Cb 0.72 0.01 -0.03 0.00 2.56 0.00 0.00 35.95 39.21 3ip3 h PHE 289 CO 0.05 0.00 0.31 -0.07 -2.02 0.00 0.00 178.31 176.59 3ip3 h LEU 290 N 0.11 0.65 -1.33 0.59 3.38 -0.84 -1.49 115.31 116.38 3ip3 h LEU 290 Ca 0.10 -0.07 0.03 0.00 0.09 0.00 0.00 57.88 58.03 3ip3 h LEU 290 Cb 0.10 -0.16 -0.04 0.00 0.09 0.00 0.00 40.66 40.65 3ip3 h LEU 290 CO -0.14 0.53 0.47 0.03 0.09 0.00 0.00 178.44 179.42 3ip3 h ARG 291 N 0.72 0.84 -0.41 1.13 3.08 -1.06 -1.27 114.38 117.42 3ip3 h ARG 291 Ca 0.19 -0.05 -0.02 0.00 0.07 0.00 0.00 59.98 60.17 3ip3 h ARG 291 Cb 0.00 -0.19 -0.02 0.00 0.08 0.00 0.00 29.97 29.85 3ip3 h ARG 291 CO -0.03 0.56 0.16 1.49 -1.07 0.00 0.00 179.97 181.08 3ip3 h GLU 292 N 0.87 0.61 -0.71 0.04 4.57 -0.57 0.79 114.58 120.18 3ip3 h GLU 292 Ca 0.29 -0.11 -0.04 0.00 -1.18 0.00 0.00 59.36 58.31 3ip3 h GLU 292 Cb 0.06 -0.10 -0.03 0.00 -0.16 0.00 0.00 28.75 28.52 3ip3 h GLU 292 CO -0.08 0.57 0.27 0.82 -1.18 0.00 0.00 179.01 179.41 3ip3 h ILE 293 N 0.51 1.25 -0.03 2.32 1.08 -0.57 -2.82 117.51 119.26 3ip3 h ILE 293 Ca 0.14 -0.79 0.00 0.00 -0.39 0.00 0.00 64.86 63.82 3ip3 h ILE 293 Cb 0.19 0.44 0.00 0.00 -3.07 0.00 0.00 36.82 34.38 3ip3 h ILE 293 CO -0.01 0.32 0.00 0.54 -0.69 0.00 0.00 178.15 178.30 3ip3 n ARG 294 N -4.36 1.16 -1.07 2.37 1.74 -0.55 -4.90 116.66 111.06 3ip3 n ARG 294 Ca 0.05 -0.24 -0.02 0.00 -0.77 0.00 0.00 57.85 56.87 3ip3 n ARG 294 Cb 0.18 -1.37 -0.01 0.00 -1.02 0.00 0.00 32.46 30.24 3ip3 n ARG 294 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3ip3 n GLY 295 N 0.93 0.52 0.59 -0.13 0.00 -1.04 -4.92 105.19 101.13 3ip3 n GLY 295 Ca 0.17 -0.22 0.05 0.00 0.00 0.00 0.00 46.02 46.02 3ip3 n GLY 295 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3ip3 n GLN 296 N -1.94 1.76 0.00 1.61 6.02 0.24 -4.98 117.38 120.10 3ip3 n GLN 296 Ca -0.02 -1.10 0.00 0.00 -0.01 0.00 0.00 57.00 55.86 3ip3 n GLN 296 Cb 0.20 -1.27 0.00 0.00 1.02 0.00 0.00 30.24 30.19 3ip3 n GLN 296 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3ip3 n GLY 297 N 0.94 3.99 3.69 1.08 0.00 -1.19 -4.92 105.19 108.78 3ip3 n GLY 297 Ca 0.10 -1.26 -0.38 0.00 0.00 0.00 0.00 46.02 44.48 3ip3 n GLY 297 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ip3 s LYS 298 N -2.69 4.22 0.00 1.61 -0.14 -1.26 -2.82 119.74 118.66 3ip3 s LYS 298 Ca 0.00 0.29 0.00 0.00 -1.36 0.00 0.00 55.97 54.90 3ip3 s LYS 298 Cb 0.00 -3.51 0.00 0.00 -1.68 0.00 0.00 37.83 32.64 3ip3 s LYS 298 CO 0.00 0.01 0.00 0.00 -0.76 0.00 0.00 175.35 174.60 3ip3 n VAL 301 N -0.67 0.00 -3.22 0.00 0.31 -1.26 -4.98 118.33 108.51 3ip3 n VAL 301 Ca 0.00 0.00 -0.25 0.00 -0.01 0.00 0.00 64.34 64.08 3ip3 n VAL 301 Cb 0.00 0.00 -0.01 0.00 -0.91 0.00 0.00 33.84 32.92 3ip3 n VAL 301 CO 0.00 0.00 0.00 0.42 -1.32 0.00 0.00 176.83 175.93 3ip3 s THR 302 N 0.00 5.05 0.23 2.52 -4.23 -1.26 -4.81 115.64 113.14 3ip3 s THR 302 Ca 0.00 -0.23 -0.09 0.00 -1.18 0.00 0.00 61.69 60.19 3ip3 s THR 302 Cb 0.00 -3.84 0.22 0.00 1.34 0.00 0.00 72.50 70.22 3ip3 s THR 302 CO 0.00 -0.58 1.66 -0.65 -0.54 0.00 0.00 174.62 174.52 3ip3 h PRO 303 N 0.81 0.15 -0.51 3.99 0.11 -1.94 -0.44 132.00 134.17 3ip3 h PRO 303 Ca -0.49 -0.01 0.04 0.00 0.11 0.00 0.00 66.00 65.66 3ip3 h PRO 303 Cb 1.21 -0.03 -0.04 0.00 0.11 0.00 0.00 31.00 32.24 3ip3 h PRO 303 CO 0.62 0.10 0.26 0.93 -0.21 0.00 0.00 178.00 179.70 3ip3 h GLU 304 N 0.16 0.49 -0.56 1.05 3.07 -1.94 -1.14 114.58 115.70 3ip3 h GLU 304 Ca 0.36 -0.03 0.06 0.00 -0.50 0.00 0.00 59.36 59.26 3ip3 h GLU 304 Cb 0.61 -0.11 -0.06 0.00 -0.84 0.00 0.00 28.75 28.35 3ip3 h GLU 304 CO -0.55 0.33 0.26 -0.44 -1.40 0.00 0.00 179.01 177.21 3ip3 h ASP 305 N 0.51 0.34 -0.35 1.42 3.32 -1.78 -0.72 116.42 119.17 3ip3 h ASP 305 Ca 0.22 0.05 -0.10 0.00 0.02 0.00 0.00 57.03 57.22 3ip3 h ASP 305 Cb 0.13 -0.01 -0.02 0.00 0.22 0.00 0.00 39.33 39.65 3ip3 h ASP 305 CO -0.15 0.22 -0.12 0.28 -1.72 0.00 0.00 179.24 177.75 3ip3 h SER 306 N 0.49 0.78 -0.04 6.45 0.02 -0.54 -0.07 113.55 120.63 3ip3 h SER 306 Ca 0.26 -0.24 -0.01 0.00 -0.84 0.00 0.00 61.79 60.97 3ip3 h SER 306 Cb 0.23 -0.21 -0.00 0.00 0.14 0.00 0.00 62.40 62.56 3ip3 h SER 306 CO -0.21 0.91 -0.02 0.40 -1.14 0.00 0.00 176.83 176.77 3ip3 h ILE 307 N 0.71 1.34 -0.51 3.27 2.04 -1.03 -3.12 117.51 120.21 3ip3 h ILE 307 Ca 0.12 -1.06 -0.04 0.00 1.00 0.00 0.00 64.86 64.88 3ip3 h ILE 307 Cb 0.60 1.97 -0.02 0.00 -0.74 0.00 0.00 36.82 38.63 3ip3 h ILE 307 CO 0.04 0.29 0.16 0.25 0.00 0.00 0.00 178.15 178.88 3ip3 h LEU 308 N -0.32 0.75 -0.75 1.44 5.85 -0.84 -0.77 115.31 120.68 3ip3 h LEU 308 Ca 0.01 -0.21 -0.13 0.00 0.84 0.00 0.00 57.88 58.39 3ip3 h LEU 308 Cb 0.47 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.29 3ip3 h LEU 308 CO 0.01 0.76 -0.49 0.71 -0.34 0.00 0.00 178.44 179.09 3ip3 h THR 309 N 0.70 1.33 -0.27 1.05 1.35 -1.13 0.18 112.91 116.13 3ip3 h THR 309 Ca 0.16 -1.71 -0.05 0.00 -0.55 0.00 0.00 66.41 64.27 3ip3 h THR 309 Cb 0.28 1.77 -0.01 0.00 -1.73 0.00 0.00 68.15 68.46 3ip3 h THR 309 CO -0.00 0.52 -0.01 0.74 -0.25 0.00 0.00 175.52 176.51 3ip3 h THR 310 N 0.27 1.26 -0.31 6.82 2.02 -1.46 0.71 112.91 122.22 3ip3 h THR 310 Ca 0.01 -0.94 0.06 0.00 0.77 0.00 0.00 66.41 66.32 3ip3 h THR 310 Cb 0.96 1.34 -0.06 0.00 -1.74 0.00 0.00 68.15 68.65 3ip3 h THR 310 CO 0.08 0.30 -0.10 -0.08 0.37 0.00 0.00 175.52 176.09 3ip3 h GLU 311 N 0.26 -0.03 -0.74 6.66 4.81 -0.85 -0.12 114.58 124.58 3ip3 h GLU 311 Ca 0.08 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.30 3ip3 h GLU 311 Cb 0.44 0.01 -0.04 0.00 0.63 0.00 0.00 28.75 29.79 3ip3 h GLU 311 CO 0.02 -0.02 0.45 0.82 -0.73 0.00 0.00 179.01 179.55 3ip3 h ILE 312 N -0.03 1.21 -0.62 2.32 2.04 -0.77 -1.91 117.51 119.74 3ip3 h ILE 312 Ca 0.15 -0.45 0.05 0.00 1.00 0.00 0.00 64.86 65.61 3ip3 h ILE 312 Cb 0.26 0.18 -0.05 0.00 -0.74 0.00 0.00 36.82 36.46 3ip3 h ILE 312 CO -0.33 0.22 0.34 0.00 0.00 0.00 0.00 178.15 178.38 3ip3 h ALA 313 N 1.24 0.81 -0.14 1.87 0.00 -0.22 -0.31 119.26 122.51 3ip3 h ALA 313 Ca 0.27 0.01 -0.13 0.00 0.00 0.00 0.00 54.91 55.05 3ip3 h ALA 313 Cb -0.04 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 3ip3 h ALA 313 CO -0.05 0.02 -0.49 -0.07 0.00 0.00 0.00 179.25 178.67 3ip3 h LEU 314 N 0.65 0.41 -0.18 0.00 3.38 -0.84 -0.56 115.31 118.16 3ip3 h LEU 314 Ca 0.27 -0.20 -0.01 0.00 0.09 0.00 0.00 57.88 58.04 3ip3 h LEU 314 Cb 0.15 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 3ip3 h LEU 314 CO -0.16 0.83 0.09 0.50 0.09 0.00 0.00 178.44 179.79 3ip3 h LYS 315 N 0.30 0.26 -0.59 1.13 1.63 -0.99 0.79 116.57 119.10 3ip3 h LYS 315 Ca 0.02 -0.04 -0.04 0.00 -0.85 0.00 0.00 60.65 59.74 3ip3 h LYS 315 Cb 0.97 -0.05 -0.03 0.00 -0.60 0.00 0.00 32.23 32.52 3ip3 h LYS 315 CO 0.08 0.28 0.21 0.00 -3.45 0.00 0.00 179.45 176.57 3ip3 h ALA 316 N 0.96 1.25 -0.70 5.00 0.00 -0.92 -0.40 119.26 124.45 3ip3 h ALA 316 Ca 0.06 -0.17 -0.06 0.00 0.00 0.00 0.00 54.91 54.74 3ip3 h ALA 316 Cb 0.10 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.63 3ip3 h ALA 316 CO -0.01 0.54 0.19 -0.09 0.00 0.00 0.00 179.25 179.88 3ip3 h ARG 317 N 0.86 1.11 0.17 0.00 2.43 -0.82 -1.52 114.38 116.60 3ip3 h ARG 317 Ca 0.20 -0.25 -0.01 0.00 -0.81 0.00 0.00 59.98 59.11 3ip3 h ARG 317 Cb 0.21 -0.15 0.00 0.00 -0.42 0.00 0.00 29.97 29.61 3ip3 h ARG 317 CO -0.01 0.96 -0.08 1.25 -1.51 0.00 0.00 179.97 180.58 3ip3 h LEU 318 N 1.06 -0.19 -0.59 3.80 5.85 -0.42 0.76 115.31 125.58 3ip3 h LEU 318 Ca 0.22 -0.04 0.12 0.00 0.84 0.00 0.00 57.88 59.02 3ip3 h LEU 318 Cb 0.34 0.05 -0.11 0.00 0.37 0.00 0.00 40.66 41.30 3ip3 h LEU 318 CO -0.00 -0.08 -0.22 -1.28 -0.34 0.00 0.00 178.44 176.52 3ip3 h SER 319 N -0.29 -0.77 -0.18 1.25 0.87 -0.96 -1.53 113.55 111.94 3ip3 h SER 319 Ca -0.02 0.20 -0.08 0.00 -1.23 0.00 0.00 61.79 60.65 3ip3 h SER 319 Cb 0.22 0.44 -0.02 0.00 -0.44 0.00 0.00 62.40 62.61 3ip3 h SER 319 CO 0.04 -0.24 -0.14 0.00 -0.53 0.00 0.00 176.83 175.96 3ip3 h ALA 320 N 1.38 1.16 -0.00 6.23 0.00 -0.81 -0.09 119.26 127.12 3ip3 h ALA 320 Ca 0.27 -0.29 -0.12 0.00 0.00 0.00 0.00 54.91 54.77 3ip3 h ALA 320 Cb 0.49 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 3ip3 h ALA 320 CO -0.64 0.53 -0.55 -0.44 0.00 0.00 0.00 179.25 178.16 3ip3 h ASP 321 N 0.52 0.01 -0.00 0.00 3.32 -0.35 -3.35 116.42 116.56 3ip3 h ASP 321 Ca 0.09 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.14 3ip3 h ASP 321 Cb 0.54 -0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.09 3ip3 h ASP 321 CO 0.03 0.55 -0.39 0.35 -1.72 0.00 0.00 179.24 178.07 3ip3 n THR 322 N -3.89 0.00 -1.22 0.35 -2.24 -0.62 -5.00 114.28 101.65 3ip3 n THR 322 Ca -0.01 -0.31 -0.08 0.00 -2.27 0.00 0.00 64.05 61.38 3ip3 n THR 322 Cb 0.55 1.05 -0.03 0.00 -2.10 0.00 0.00 70.33 69.81 3ip3 n THR 322 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3ip3 n GLY 323 N 1.12 0.88 3.62 3.38 0.00 -0.07 -5.02 105.19 109.10 3ip3 n GLY 323 Ca 0.03 -0.20 -0.27 0.00 0.00 0.00 0.00 46.02 45.58 3ip3 n GLY 323 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3ip3 s GLN 324 N -2.35 2.27 0.21 1.61 -1.52 -1.21 -5.06 119.66 113.61 3ip3 s GLN 324 Ca 0.00 -1.15 -0.31 0.00 -1.95 0.00 0.00 55.36 51.95 3ip3 s GLN 324 Cb 0.00 -2.29 -0.11 0.00 -0.22 0.00 0.00 33.01 30.39 3ip3 s GLN 324 CO 0.00 0.46 1.60 0.42 -0.25 0.00 0.00 175.29 177.52 3ip3 s ILE 325 N -1.66 2.36 -0.13 1.08 1.01 -1.26 -4.38 121.20 118.22 3ip3 s ILE 325 Ca 0.26 0.27 -0.01 0.00 0.00 0.00 0.00 60.65 61.17 3ip3 s ILE 325 Cb -0.09 -3.17 -0.02 0.00 0.01 0.00 0.00 42.46 39.19 3ip3 s ILE 325 CO 0.17 0.03 -0.11 -0.69 0.00 0.00 0.00 174.94 174.34 3ip3 s VAL 326 N 0.86 3.25 0.15 2.92 1.01 0.36 -4.98 120.40 123.96 3ip3 s VAL 326 Ca 0.69 -0.59 -0.27 0.00 0.00 0.00 0.00 61.98 61.81 3ip3 s VAL 326 Cb -0.46 -2.38 -0.07 0.00 0.00 0.00 0.00 36.38 33.47 3ip3 s VAL 326 CO 0.35 0.52 0.84 -0.76 0.00 0.00 0.00 175.10 176.05 3ip3 s LEU 327 N 0.32 4.56 -0.16 3.92 1.43 -1.26 -1.12 118.68 126.36 3ip3 s LEU 327 Ca -0.09 1.69 -0.12 0.00 -1.03 0.00 0.00 54.13 54.58 3ip3 s LEU 327 Cb -0.15 -3.40 -0.07 0.00 0.03 0.00 0.00 46.19 42.60 3ip3 s LEU 327 CO 0.05 0.11 -0.27 -0.38 0.23 0.00 0.00 176.35 176.09 3ip3 n ILE 328 N 2.03 1.31 -1.73 -0.59 5.41 0.25 -4.95 119.36 121.09 3ip3 n ILE 328 Ca -0.03 -0.04 -0.38 0.00 1.00 0.00 0.00 62.75 63.30 3ip3 n ILE 328 Cb 0.49 -1.99 0.05 0.00 -0.71 0.00 0.00 39.64 37.48 3ip3 n ILE 328 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 176.55 177.76 3ip3 n GLU 329 N -4.10 1.45 -0.94 0.38 4.07 -1.10 -5.03 120.64 115.38 3ip3 n GLU 329 Ca -0.26 0.54 0.00 0.00 -0.06 0.00 0.00 57.16 57.39 3ip3 n GLU 329 Cb 0.59 -2.53 0.00 0.00 -0.06 0.00 0.00 31.44 29.44 3ip3 n GLU 329 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48