#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ihp s ALA 2 N 0.00 2.57 0.03 -5.12 0.00 -1.26 -4.97 121.76 113.01 3ihp s ALA 2 Ca 0.00 0.34 -0.30 0.00 0.00 0.00 0.00 51.96 51.99 3ihp s ALA 2 Cb 0.00 -3.25 -0.07 0.00 0.00 0.00 0.00 23.12 19.80 3ihp s ALA 2 CO 0.00 -1.20 1.62 -2.00 0.00 0.00 0.00 175.76 174.18 3ihp s GLU 3 N -4.46 4.21 0.62 0.00 2.12 -1.26 -4.99 118.70 114.94 3ihp s GLU 3 Ca 0.63 2.25 -0.14 0.00 0.36 0.00 0.00 54.97 58.06 3ihp s GLU 3 Cb -0.17 -3.68 -0.03 0.00 0.26 0.00 0.00 34.13 30.52 3ihp s GLU 3 CO 0.46 -0.73 1.06 -0.51 -0.54 0.00 0.00 175.26 174.99 3ihp s LEU 4 N 2.90 3.40 0.16 2.70 1.43 -1.26 -4.95 118.68 123.06 3ihp s LEU 4 Ca 0.72 1.76 -0.16 0.00 -1.03 0.00 0.00 54.13 55.42 3ihp s LEU 4 Cb -0.37 -4.52 0.04 0.00 0.03 0.00 0.00 46.19 41.37 3ihp s LEU 4 CO 0.31 -1.23 1.79 0.28 0.23 0.00 0.00 176.35 177.73 3ihp h SER 5 N 0.14 0.33 0.17 2.29 0.02 -1.97 -2.54 113.55 111.99 3ihp h SER 5 Ca -0.46 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.50 3ihp h SER 5 Cb 1.22 -0.06 -0.01 0.00 0.14 0.00 0.00 62.40 63.69 3ihp h SER 5 CO 0.57 0.24 -0.14 1.05 -1.14 0.00 0.00 176.83 177.41 3ihp h GLU 6 N 0.43 -0.31 -0.55 3.45 9.09 -1.98 -0.15 114.58 124.57 3ihp h GLU 6 Ca 0.16 0.02 0.11 0.00 0.05 0.00 0.00 59.36 59.70 3ihp h GLU 6 Cb 0.04 0.07 -0.11 0.00 -1.65 0.00 0.00 28.75 27.10 3ihp h GLU 6 CO -0.09 -0.21 -0.27 0.93 0.05 0.00 0.00 179.01 179.43 3ihp h GLU 7 N -0.32 -0.12 -0.62 1.06 5.08 -1.93 0.59 114.58 118.32 3ihp h GLU 7 Ca -0.00 0.01 -0.06 0.00 -1.00 0.00 0.00 59.36 58.30 3ihp h GLU 7 Cb 0.30 0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.55 3ihp h GLU 7 CO -0.02 -0.08 0.13 0.00 -1.00 0.00 0.00 179.01 178.04 3ihp h ALA 8 N 1.16 1.07 0.31 3.43 0.00 -1.23 -1.95 119.26 122.05 3ihp h ALA 8 Ca 0.24 -0.24 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 3ihp h ALA 8 Cb 0.52 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.07 3ihp h ALA 8 CO -0.63 0.61 -0.15 1.25 0.00 0.00 0.00 179.25 180.33 3ihp h LEU 9 N 0.93 -0.35 -1.27 0.00 5.85 0.42 -2.75 115.31 118.14 3ihp h LEU 9 Ca 0.20 -0.16 0.19 0.00 0.84 0.00 0.00 57.88 58.94 3ihp h LEU 9 Cb 0.36 0.09 -0.08 0.00 0.37 0.00 0.00 40.66 41.39 3ihp h LEU 9 CO 0.00 -0.01 0.61 -0.07 -0.34 0.00 0.00 178.44 178.63 3ihp h LEU 10 N -0.72 0.61 -0.89 2.25 3.38 -0.94 -1.65 115.31 117.34 3ihp h LEU 10 Ca -0.04 0.06 -0.05 0.00 0.09 0.00 0.00 57.88 57.94 3ihp h LEU 10 Cb 0.49 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.18 3ihp h LEU 10 CO 0.07 0.25 -0.22 0.77 0.09 0.00 0.00 178.44 179.40 3ihp h SER 11 N 0.61 0.00 0.00 -0.43 4.64 -1.07 -3.17 113.55 114.12 3ihp h SER 11 Ca 0.51 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.83 3ihp h SER 11 Cb 0.98 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.07 3ihp h SER 11 CO -0.26 0.22 -0.04 1.33 -0.87 0.00 0.00 176.83 177.21 3ihp n VAL 12 N -3.31 1.72 -0.25 0.95 0.24 -0.99 -4.76 118.33 111.94 3ihp n VAL 12 Ca 0.01 -2.05 0.05 0.00 -2.04 0.00 0.00 64.34 60.30 3ihp n VAL 12 Cb 0.47 -0.16 0.16 0.00 -1.47 0.00 0.00 33.84 32.85 3ihp n VAL 12 CO 0.00 0.00 0.00 0.25 -2.14 0.00 0.00 176.83 174.94 3ihp h LEU 13 N 0.00 -0.17 -2.47 1.34 5.85 -1.29 -1.35 115.31 117.22 3ihp h LEU 13 Ca 0.00 0.17 0.02 0.00 0.84 0.00 0.00 57.88 58.91 3ihp h LEU 13 Cb 1.01 0.27 -0.00 0.00 0.37 0.00 0.00 40.66 42.31 3ihp h LEU 13 CO 0.00 -0.11 0.09 -0.65 -0.34 0.00 0.00 178.44 177.43 3ihp h PRO 14 N 0.17 0.00 -0.03 5.25 0.11 -1.85 0.17 132.00 135.81 3ihp h PRO 14 Ca 0.40 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.51 3ihp h PRO 14 Cb 0.70 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.81 3ihp h PRO 14 CO -0.58 0.00 0.00 0.25 -0.21 0.00 0.00 178.00 177.46 3ihp n THR 15 N -3.58 0.04 -3.13 -1.15 -2.24 -0.51 -4.60 114.28 99.11 3ihp n THR 15 Ca -0.01 -0.08 -0.44 0.00 -2.27 0.00 0.00 64.05 61.24 3ihp n THR 15 Cb 0.18 -0.15 -0.06 0.00 -2.10 0.00 0.00 70.33 68.21 3ihp n THR 15 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 3ihp s ILE 16 N -1.96 4.83 0.06 2.28 1.01 0.59 -3.32 121.20 124.69 3ihp s ILE 16 Ca 0.33 -0.63 -0.07 0.00 0.00 0.00 0.00 60.65 60.29 3ihp s ILE 16 Cb 0.16 -4.37 -0.05 0.00 0.01 0.00 0.00 42.46 38.21 3ihp s ILE 16 CO 0.26 -0.93 0.32 -0.13 0.00 0.00 0.00 174.94 174.47 3ihp s ARG 17 N 2.71 3.63 -0.23 2.79 1.81 -0.54 -5.02 118.95 124.10 3ihp s ARG 17 Ca 0.14 -0.03 -0.07 0.00 -1.72 0.00 0.00 55.73 54.06 3ihp s ARG 17 Cb -0.21 -3.00 -0.03 0.00 -0.45 0.00 0.00 34.95 31.26 3ihp s ARG 17 CO 0.10 0.58 0.05 0.54 -0.68 0.00 0.00 175.30 175.90 3ihp s VAL 18 N -1.42 4.31 0.93 3.52 0.11 -1.26 -4.80 120.40 121.79 3ihp s VAL 18 Ca 0.32 -0.18 -0.11 0.00 -2.93 0.00 0.00 61.98 59.08 3ihp s VAL 18 Cb -0.13 -2.99 0.11 0.00 -1.53 0.00 0.00 36.38 31.83 3ihp s VAL 18 CO 0.19 0.38 0.88 -2.65 -3.33 0.00 0.00 175.10 170.56 3ihp n PRO 19 N 4.57 -0.39 -4.47 1.54 -0.02 -1.26 -5.06 135.00 129.91 3ihp n PRO 19 Ca -0.16 -0.05 -0.23 0.00 -2.02 0.00 0.00 63.50 61.03 3ihp n PRO 19 Cb 0.52 -2.19 -0.09 0.00 -0.02 0.00 0.00 33.50 31.72 3ihp n PRO 19 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 3ihp s LYS 20 N -4.25 1.77 0.18 -0.52 1.02 -1.26 -4.99 119.74 111.68 3ihp s LYS 20 Ca 0.63 -2.04 -0.14 0.00 0.02 0.00 0.00 55.97 54.45 3ihp s LYS 20 Cb -0.23 -0.64 0.16 0.00 -0.52 0.00 0.00 37.83 36.60 3ihp s LYS 20 CO 0.61 -0.36 1.72 0.00 -0.92 0.00 0.00 175.35 176.40 3ihp h ALA 21 N 1.97 0.51 -0.15 5.17 0.00 -2.00 -2.26 119.26 122.50 3ihp h ALA 21 Ca -0.37 0.10 -0.11 0.00 0.00 0.00 0.00 54.91 54.52 3ihp h ALA 21 Cb 1.26 0.13 -0.05 0.00 0.00 0.00 0.00 17.79 19.14 3ihp h ALA 21 CO 0.61 -0.31 0.13 0.41 0.00 0.00 0.00 179.25 180.08 3ihp n GLY 22 N -1.27 3.03 3.02 0.00 0.00 -1.26 -4.86 105.19 103.85 3ihp n GLY 22 Ca 0.05 -0.39 -0.27 0.00 0.00 0.00 0.00 46.02 45.40 3ihp n GLY 22 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3ihp s ASP 23 N 1.41 2.24 -0.18 1.61 1.11 -0.85 -5.10 116.67 116.91 3ihp s ASP 23 Ca 0.12 -0.38 -0.29 0.00 0.18 0.00 0.00 52.55 52.18 3ihp s ASP 23 Cb 0.09 -0.99 -0.01 0.00 1.07 0.00 0.00 42.92 43.08 3ihp s ASP 23 CO -0.00 -0.00 1.28 0.00 1.18 0.00 0.00 175.17 177.62 3ihp s ARG 24 N 1.04 4.20 -0.33 8.23 1.70 -1.26 -4.87 118.95 127.66 3ihp s ARG 24 Ca -0.06 1.63 -0.03 0.00 -0.47 0.00 0.00 55.73 56.80 3ihp s ARG 24 Cb -0.15 -3.78 0.06 0.00 -0.57 0.00 0.00 34.95 30.51 3ihp s ARG 24 CO -0.02 -0.76 0.05 0.54 -1.08 0.00 0.00 175.30 174.04 3ihp s VAL 25 N 3.61 3.16 -0.98 4.99 0.11 -1.26 -4.80 120.40 125.23 3ihp s VAL 25 Ca 0.55 -1.48 -0.24 0.00 -2.93 0.00 0.00 61.98 57.89 3ihp s VAL 25 Cb -0.21 -2.88 0.01 0.00 -1.53 0.00 0.00 36.38 31.76 3ihp s VAL 25 CO 0.16 -0.23 1.68 -1.00 -3.33 0.00 0.00 175.10 172.37 3ihp s HIS 26 N 1.25 2.22 -0.22 1.54 3.76 0.51 -4.67 115.29 119.69 3ihp s HIS 26 Ca -0.02 -0.22 0.09 0.00 -0.15 0.00 0.00 55.06 54.76 3ihp s HIS 26 Cb -0.20 -4.41 -0.11 0.00 1.11 0.00 0.00 32.58 28.96 3ihp s HIS 26 CO -0.01 -1.84 0.28 1.17 -0.85 0.00 0.00 174.74 173.49 3ihp n LYS 27 N 8.85 2.36 -0.05 1.40 4.81 -1.26 -2.67 118.16 131.60 3ihp n LYS 27 Ca 0.37 -0.04 -0.03 0.00 -0.87 0.00 0.00 58.31 57.74 3ihp n LYS 27 Cb 0.49 -1.04 -0.12 0.00 0.02 0.00 0.00 35.03 34.38 3ihp n LYS 27 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 3ihp n ASP 28 N -1.48 1.41 -3.76 3.14 10.43 -1.26 -4.64 116.55 120.38 3ihp n ASP 28 Ca 0.00 0.00 -0.13 0.00 2.57 0.00 0.00 54.79 57.23 3ihp n ASP 28 Cb 0.18 1.12 -0.10 0.00 1.84 0.00 0.00 41.12 44.16 3ihp n ASP 28 CO 0.00 0.00 0.00 -0.70 -1.07 0.00 0.00 177.20 175.43 3ihp s GLU 29 N -2.58 0.52 0.54 -1.24 2.12 -1.26 -4.32 118.70 112.48 3ihp s GLU 29 Ca -0.07 0.14 -0.21 0.00 0.36 0.00 0.00 54.97 55.20 3ihp s GLU 29 Cb 0.06 0.24 -0.05 0.00 0.26 0.00 0.00 34.13 34.64 3ihp s GLU 29 CO 0.61 -0.11 1.21 0.00 -0.54 0.00 0.00 175.26 176.43 3ihp h ALA 31 N 1.36 0.44 0.00 0.00 0.00 -1.69 -3.34 119.26 116.03 3ihp h ALA 31 Ca -0.50 -0.38 -0.11 0.00 0.00 0.00 0.00 54.91 53.92 3ihp h ALA 31 Cb 1.28 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.95 3ihp h ALA 31 CO 0.57 0.41 -1.36 1.19 0.00 0.00 0.00 179.25 180.07 3ihp n PHE 32 N -4.30 0.89 -4.07 0.00 3.72 -1.26 -4.69 117.46 107.74 3ihp n PHE 32 Ca -0.03 0.28 -0.04 0.00 -0.05 0.00 0.00 57.45 57.61 3ihp n PHE 32 Cb 0.44 -1.01 -0.01 0.00 -0.94 0.00 0.00 39.48 37.96 3ihp n PHE 32 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 3ihp n SER 33 N -2.78 0.75 -1.54 4.37 3.41 -1.25 -4.67 113.62 111.91 3ihp n SER 33 Ca -0.07 -1.34 0.07 0.00 -0.26 0.00 0.00 58.87 57.27 3ihp n SER 33 Cb 0.74 0.18 0.33 0.00 -0.26 0.00 0.00 64.21 65.21 3ihp n SER 33 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 3ihp n PHE 34 N -0.14 1.50 -1.75 7.33 3.01 -1.26 -4.05 117.46 122.10 3ihp n PHE 34 Ca -0.00 -0.56 -0.36 0.00 1.01 0.00 0.00 57.45 57.53 3ihp n PHE 34 Cb 0.10 -0.31 0.06 0.00 -0.01 0.00 0.00 39.48 39.32 3ihp n PHE 34 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 3ihp s ASP 35 N -0.78 4.70 0.07 4.37 1.11 -1.26 -4.77 116.67 120.10 3ihp s ASP 35 Ca 0.46 2.45 -0.08 0.00 0.18 0.00 0.00 52.55 55.56 3ihp s ASP 35 Cb 0.32 -2.60 -0.00 0.00 1.07 0.00 0.00 42.92 41.70 3ihp s ASP 35 CO 0.19 -1.93 0.16 -0.89 1.18 0.00 0.00 175.17 173.88 3ihp s THR 36 N -1.65 0.14 0.51 -1.27 2.01 -1.26 -0.40 115.64 113.72 3ihp s THR 36 Ca 0.78 -1.13 0.37 0.00 0.31 0.00 0.00 61.69 62.02 3ihp s THR 36 Cb -0.32 -1.18 0.57 0.00 0.01 0.00 0.00 72.50 71.58 3ihp s THR 36 CO 0.39 -0.63 1.72 -0.65 -0.69 0.00 0.00 174.62 174.76 3ihp h PRO 37 N 3.09 0.06 0.00 4.92 0.11 -1.80 0.21 132.00 138.59 3ihp h PRO 37 Ca -0.33 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.77 3ihp h PRO 37 Cb 1.19 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.29 3ihp h PRO 37 CO 0.54 0.04 0.00 0.39 -0.21 0.00 0.00 178.00 178.76 3ihp n GLU 38 N -4.25 0.17 -2.26 1.05 1.02 -1.26 -1.50 120.64 113.61 3ihp n GLU 38 Ca 0.32 0.27 -0.39 0.00 -0.02 0.00 0.00 57.16 57.34 3ihp n GLU 38 Cb 1.42 -1.75 -0.02 0.00 -0.02 0.00 0.00 31.44 31.07 3ihp n GLU 38 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 3ihp s SER 39 N -4.02 6.55 0.29 1.62 0.01 0.74 -4.90 113.70 113.99 3ihp s SER 39 Ca 0.08 2.41 -0.29 0.00 1.31 0.00 0.00 55.95 59.46 3ihp s SER 39 Cb 0.12 -2.62 -0.13 0.00 0.21 0.00 0.00 66.02 63.60 3ihp s SER 39 CO 0.47 -0.66 1.29 -1.84 0.41 0.00 0.00 173.24 172.91 3ihp n GLU 40 N 0.19 1.95 0.00 12.44 0.00 -1.26 -0.96 120.64 133.00 3ihp n GLU 40 Ca 0.04 0.69 0.00 0.00 0.00 0.00 0.00 57.16 57.88 3ihp n GLU 40 Cb 0.46 -2.27 0.00 0.00 0.00 0.00 0.00 31.44 29.63 3ihp n GLU 40 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 3ihp n GLY 41 N 1.43 3.29 7.00 -1.84 0.00 -1.26 -4.87 105.19 108.94 3ihp n GLY 41 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.10 3ihp n GLY 41 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ihp n GLY 42 N -1.94 -0.51 2.86 -0.02 0.00 -0.13 -4.37 105.19 101.08 3ihp n GLY 42 Ca 0.00 -1.10 -0.15 0.00 0.00 0.00 0.00 46.02 44.76 3ihp n GLY 42 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3ihp s LEU 43 N 0.00 1.55 -0.28 0.99 2.96 0.37 -4.28 118.68 119.99 3ihp s LEU 43 Ca 0.00 -0.03 -0.11 0.00 -0.22 0.00 0.00 54.13 53.78 3ihp s LEU 43 Cb 0.00 -0.16 -0.04 0.00 0.50 0.00 0.00 46.19 46.49 3ihp s LEU 43 CO 0.00 -0.04 0.17 -0.31 -1.32 0.00 0.00 176.35 174.85 3ihp s TYR 44 N 0.52 3.20 -0.38 5.38 2.02 0.85 -0.49 117.35 128.45 3ihp s TYR 44 Ca -0.05 -0.06 -0.14 0.00 -0.37 0.00 0.00 57.07 56.45 3ihp s TYR 44 Cb -0.08 -2.37 0.00 0.00 -0.40 0.00 0.00 41.96 39.12 3ihp s TYR 44 CO -0.01 -0.24 0.27 0.42 -1.57 0.00 0.00 175.55 174.42 3ihp s ILE 45 N 1.72 5.24 0.15 2.71 1.01 0.81 -0.12 121.20 132.73 3ihp s ILE 45 Ca 0.07 -0.46 -0.32 0.00 0.00 0.00 0.00 60.65 59.93 3ihp s ILE 45 Cb -0.16 -3.81 -0.12 0.00 0.01 0.00 0.00 42.46 38.38 3ihp s ILE 45 CO 0.09 -0.17 1.75 0.00 0.00 0.00 0.00 174.94 176.62 3ihp n MET 47 N 4.64 1.86 -0.12 0.00 0.00 -1.13 -1.52 117.12 120.84 3ihp n MET 47 Ca 0.17 -1.32 -0.21 0.00 0.00 0.00 0.00 57.70 56.34 3ihp n MET 47 Cb 0.34 -1.29 -0.10 0.00 0.00 0.00 0.00 33.22 32.18 3ihp n MET 47 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 175.97 174.26 3ihp n ASN 48 N 0.57 1.97 -0.00 7.83 5.15 -1.21 -1.47 115.26 128.10 3ihp n ASN 48 Ca 0.12 0.09 0.06 0.00 -0.60 0.00 0.00 54.58 54.26 3ihp n ASN 48 Cb 0.31 -0.54 -0.08 0.00 -0.53 0.00 0.00 39.78 38.94 3ihp n ASN 48 CO 0.00 0.00 0.00 0.35 1.40 0.00 0.00 177.26 179.01 3ihp n THR 49 N -3.63 0.00 -1.40 -0.44 -2.24 -1.25 -4.70 114.28 100.63 3ihp n THR 49 Ca -0.44 -0.20 -0.12 0.00 -2.27 0.00 0.00 64.05 61.02 3ihp n THR 49 Cb 0.88 0.91 -0.05 0.00 -2.10 0.00 0.00 70.33 69.98 3ihp n THR 49 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 3ihp n PHE 50 N -1.39 -0.03 -2.98 4.78 3.72 -0.58 -4.92 117.46 116.06 3ihp n PHE 50 Ca 0.02 0.00 -0.34 0.00 -0.05 0.00 0.00 57.45 57.08 3ihp n PHE 50 Cb 0.22 -2.25 -0.06 0.00 -0.94 0.00 0.00 39.48 36.45 3ihp n PHE 50 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 3ihp s LEU 51 N -2.79 4.12 0.00 4.37 1.43 -1.25 -0.36 118.68 124.20 3ihp s LEU 51 Ca 0.00 1.51 -0.01 0.00 -1.03 0.00 0.00 54.13 54.60 3ihp s LEU 51 Cb 0.00 -4.12 -0.04 0.00 0.03 0.00 0.00 46.19 42.06 3ihp s LEU 51 CO 0.00 -0.19 0.11 -0.83 0.23 0.00 0.00 176.35 175.68 3ihp s GLY 52 N -2.03 2.07 -0.09 -3.19 0.00 -1.09 -0.84 107.32 102.14 3ihp s GLY 52 Ca 0.54 -0.85 -0.04 0.00 0.00 0.00 0.00 44.72 44.37 3ihp s GLY 52 CO 0.18 -0.73 0.21 -1.36 0.00 0.00 0.00 173.10 171.39 3ihp s PHE 53 N -1.25 -0.27 1.11 1.90 0.08 0.83 -1.73 117.98 118.65 3ihp s PHE 53 Ca 0.25 0.70 -0.13 0.00 0.12 0.00 0.00 56.93 57.87 3ihp s PHE 53 Cb -0.12 -0.05 0.25 0.00 -0.57 0.00 0.00 43.02 42.53 3ihp s PHE 53 CO 0.16 -0.24 1.05 0.20 -0.10 0.00 0.00 175.22 176.29 3ihp s GLY 54 N 1.59 1.55 0.41 4.36 0.00 -1.26 -0.11 107.32 113.86 3ihp s GLY 54 Ca -0.06 -0.24 0.10 0.00 0.00 0.00 0.00 44.72 44.53 3ihp s GLY 54 CO -0.07 0.45 2.00 0.50 0.00 0.00 0.00 173.10 175.98 3ihp h LYS 55 N -2.39 0.51 0.00 2.90 6.56 -1.76 -0.62 116.57 121.77 3ihp h LYS 55 Ca -0.60 -0.03 0.00 0.00 -1.06 0.00 0.00 60.65 58.96 3ihp h LYS 55 Cb 1.34 -0.12 0.00 0.00 -0.57 0.00 0.00 32.23 32.88 3ihp h LYS 55 CO 0.53 0.34 0.00 1.04 -2.06 0.00 0.00 179.45 179.30 3ihp n GLN 56 N -4.47 0.35 0.00 3.15 1.13 -1.26 -4.15 117.38 112.13 3ihp n GLN 56 Ca 0.08 0.01 0.00 0.00 -1.94 0.00 0.00 57.00 55.15 3ihp n GLN 56 Cb 0.25 -1.50 0.00 0.00 0.11 0.00 0.00 30.24 29.10 3ihp n GLN 56 CO 0.00 0.00 0.00 0.66 -1.44 0.00 0.00 177.06 176.28 3ihp n TYR 57 N -1.32 0.00 -0.25 1.08 4.01 -0.29 -4.66 117.16 115.73 3ihp n TYR 57 Ca 0.13 0.00 0.14 0.00 -0.16 0.00 0.00 57.90 58.01 3ihp n TYR 57 Cb 0.25 0.00 0.43 0.00 -0.31 0.00 0.00 39.34 39.71 3ihp n TYR 57 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 3ihp h VAL 58 N 0.00 0.78 0.00 -0.72 2.07 -1.58 -0.47 116.25 116.32 3ihp h VAL 58 Ca 0.00 -0.20 -0.02 0.00 0.82 0.00 0.00 66.70 67.30 3ihp h VAL 58 Cb 0.12 0.15 -0.00 0.00 -1.52 0.00 0.00 31.29 30.03 3ihp h VAL 58 CO 0.00 0.11 -0.10 -0.08 0.02 0.00 0.00 177.57 177.52 3ihp h GLU 59 N 0.58 0.00 -0.52 1.57 4.81 -1.83 -0.90 114.58 118.29 3ihp h GLU 59 Ca 0.45 0.00 -0.04 0.00 -0.13 0.00 0.00 59.36 59.64 3ihp h GLU 59 Cb 0.88 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.23 3ihp h GLU 59 CO -0.20 0.10 0.17 -0.09 -0.73 0.00 0.00 179.01 178.26 3ihp h ARG 60 N 0.00 0.81 -0.27 1.92 2.43 -1.39 -1.42 114.38 116.46 3ihp h ARG 60 Ca -0.00 -0.17 -0.08 0.00 -0.81 0.00 0.00 59.98 58.92 3ihp h ARG 60 Cb 0.18 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 29.60 3ihp h ARG 60 CO 0.01 0.74 -0.15 1.25 -1.51 0.00 0.00 179.97 180.32 3ihp h HIS 61 N 0.71 0.67 0.01 2.20 2.76 -1.27 -1.66 115.15 118.57 3ihp h HIS 61 Ca 0.17 -0.17 0.02 0.00 -2.20 0.00 0.00 60.37 58.19 3ihp h HIS 61 Cb 0.27 -0.15 -0.05 0.00 1.55 0.00 0.00 27.41 29.03 3ihp h HIS 61 CO 0.01 0.83 -0.46 0.35 -1.30 0.00 0.00 177.93 177.36 3ihp h PHE 62 N 0.31 -1.36 -0.98 5.26 3.57 -1.10 0.20 116.94 122.85 3ihp h PHE 62 Ca 0.06 0.04 0.01 0.00 3.53 0.00 0.00 57.97 61.61 3ihp h PHE 62 Cb 0.66 0.59 -0.05 0.00 2.79 0.00 0.00 35.95 39.95 3ihp h PHE 62 CO 0.06 -0.50 0.64 -0.91 -2.23 0.00 0.00 178.31 175.38 3ihp h ASN 63 N -0.59 1.14 0.75 0.41 -0.26 -1.28 0.21 115.58 115.96 3ihp h ASN 63 Ca 0.01 -0.04 -0.16 0.00 -0.56 0.00 0.00 56.30 55.55 3ihp h ASN 63 Cb 0.63 -0.28 -0.02 0.00 -1.06 0.00 0.00 38.32 37.58 3ihp h ASN 63 CO -0.30 0.83 -0.76 0.11 -1.06 0.00 0.00 177.43 176.25 3ihp h LYS 64 N 1.34 0.00 0.00 0.81 1.57 -1.15 -3.40 116.57 115.75 3ihp h LYS 64 Ca 0.36 -0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 59.13 3ihp h LYS 64 Cb -0.14 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.17 3ihp h LYS 64 CO -0.08 0.76 -1.02 2.41 -0.57 0.00 0.00 179.45 180.95 3ihp n THR 65 N -3.64 0.01 0.00 -0.16 -1.04 0.05 -5.02 114.28 104.48 3ihp n THR 65 Ca -0.01 -0.01 0.00 0.00 -2.04 0.00 0.00 64.05 61.99 3ihp n THR 65 Cb 0.73 -0.30 0.00 0.00 -1.82 0.00 0.00 70.33 68.94 3ihp n THR 65 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3ihp n GLY 66 N 2.75 2.04 3.67 3.41 0.00 0.72 -5.02 105.19 112.76 3ihp n GLY 66 Ca -0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 3ihp n GLY 66 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3ihp s GLN 67 N -0.62 4.16 -0.18 1.61 2.00 -1.25 -4.88 119.66 120.49 3ihp s GLN 67 Ca 0.00 2.47 0.18 0.00 -2.00 0.00 0.00 55.36 56.01 3ihp s GLN 67 Cb 0.00 -4.00 -0.25 0.00 0.80 0.00 0.00 33.01 29.56 3ihp s GLN 67 CO 0.00 -0.89 0.12 0.54 -0.50 0.00 0.00 175.29 174.56 3ihp n ARG 68 N 7.05 0.68 -3.62 1.67 1.74 -1.26 -4.34 116.66 118.58 3ihp n ARG 68 Ca 0.19 0.01 -0.38 0.00 -0.77 0.00 0.00 57.85 56.90 3ihp n ARG 68 Cb 0.41 -1.54 -0.11 0.00 -1.02 0.00 0.00 32.46 30.20 3ihp n ARG 68 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 3ihp s VAL 69 N -2.52 5.14 0.02 1.55 1.01 -1.26 0.17 120.40 124.52 3ihp s VAL 69 Ca -0.10 0.11 0.06 0.00 0.00 0.00 0.00 61.98 62.05 3ihp s VAL 69 Cb 0.06 -3.44 -0.02 0.00 0.00 0.00 0.00 36.38 32.98 3ihp s VAL 69 CO 0.83 0.27 -0.17 -0.31 0.00 0.00 0.00 175.10 175.72 3ihp s TYR 70 N 1.70 1.48 -0.30 5.22 2.02 -0.11 -2.83 117.35 124.53 3ihp s TYR 70 Ca 0.07 -0.33 -0.20 0.00 -0.37 0.00 0.00 57.07 56.24 3ihp s TYR 70 Cb -0.16 -0.90 -0.01 0.00 -0.40 0.00 0.00 41.96 40.49 3ihp s TYR 70 CO 0.09 0.03 0.60 -1.17 -1.57 0.00 0.00 175.55 173.54 3ihp s LEU 71 N -0.90 4.15 -0.24 -1.29 2.96 -0.10 -0.35 118.68 122.90 3ihp s LEU 71 Ca 0.05 0.41 -0.10 0.00 -0.22 0.00 0.00 54.13 54.26 3ihp s LEU 71 Cb -0.08 -2.78 -0.05 0.00 0.50 0.00 0.00 46.19 43.79 3ihp s LEU 71 CO 0.01 -0.45 0.15 -2.28 -1.32 0.00 0.00 176.35 172.46 3ihp s HIS 72 N 2.55 3.27 -0.08 5.38 5.65 0.16 -0.13 115.29 132.08 3ihp s HIS 72 Ca 0.24 0.13 -0.00 0.00 0.25 0.00 0.00 55.06 55.68 3ihp s HIS 72 Cb -0.15 -2.27 -0.03 0.00 -1.18 0.00 0.00 32.58 28.94 3ihp s HIS 72 CO 0.11 -0.02 -0.04 -0.51 -0.65 0.00 0.00 174.74 173.64 3ihp s LEU 73 N 1.20 3.32 -0.09 8.88 1.02 0.36 -1.65 118.68 131.72 3ihp s LEU 73 Ca 0.07 0.04 -0.03 0.00 0.02 0.00 0.00 54.13 54.22 3ihp s LEU 73 Cb -0.14 -1.74 0.05 0.00 0.02 0.00 0.00 46.19 44.38 3ihp s LEU 73 CO 0.05 0.36 0.17 -0.60 0.02 0.00 0.00 176.35 176.35 3ihp s ARG 74 N -0.80 0.04 -0.10 1.70 3.52 -0.98 -0.48 118.95 121.86 3ihp s ARG 74 Ca 0.12 0.55 -0.03 0.00 -0.13 0.00 0.00 55.73 56.24 3ihp s ARG 74 Cb -0.11 -0.31 -0.03 0.00 -1.56 0.00 0.00 34.95 32.93 3ihp s ARG 74 CO 0.02 -0.32 0.04 1.03 -0.81 0.00 0.00 175.30 175.25 3ihp s ARG 75 N 2.30 3.11 0.00 5.12 0.52 -0.56 -0.36 118.95 129.07 3ihp s ARG 75 Ca 0.03 -0.33 0.00 0.00 -0.52 0.00 0.00 55.73 54.91 3ihp s ARG 75 Cb -0.12 -2.90 0.00 0.00 0.52 0.00 0.00 34.95 32.45 3ihp s ARG 75 CO -0.06 0.72 0.15 -2.37 0.02 0.00 0.00 175.30 173.76 3ihp n THR 76 N 2.11 0.00 -1.80 0.02 5.66 -1.26 -4.14 114.28 114.87 3ihp n THR 76 Ca -0.19 0.00 -0.01 0.00 -3.05 0.00 0.00 64.05 60.80 3ihp n THR 76 Cb 0.54 0.00 -0.00 0.00 -1.55 0.00 0.00 70.33 69.32 3ihp n THR 76 CO 0.00 0.00 0.00 -0.67 -3.05 0.00 0.00 175.07 171.35 3ihp n ASP 117 N 0.00 -2.85 -4.53 1.09 2.03 -1.26 -5.20 116.55 105.83 3ihp n ASP 117 Ca 0.00 0.36 -0.34 0.00 0.52 0.00 0.00 54.79 55.34 3ihp n ASP 117 Cb 0.42 -2.12 -0.12 0.00 -0.72 0.00 0.00 41.12 38.58 3ihp n ASP 117 CO 0.00 0.00 0.00 -1.83 -1.92 0.00 0.00 177.20 173.45 3ihp s GLU 118 N -0.59 2.93 -0.25 -0.67 -1.05 -1.26 -5.02 118.70 112.78 3ihp s GLU 118 Ca -0.03 -0.58 0.01 0.00 -0.15 0.00 0.00 54.97 54.22 3ihp s GLU 118 Cb 0.00 -2.62 0.04 0.00 -0.44 0.00 0.00 34.13 31.12 3ihp s GLU 118 CO 0.20 0.55 -0.10 0.34 0.95 0.00 0.00 175.26 177.20 3ihp s ASP 119 N -0.49 4.23 0.01 0.83 2.15 0.51 -4.97 116.67 118.93 3ihp s ASP 119 Ca 0.07 -1.09 0.06 0.00 0.43 0.00 0.00 52.55 52.03 3ihp s ASP 119 Cb -0.12 -1.59 -0.03 0.00 -0.30 0.00 0.00 42.92 40.88 3ihp s ASP 119 CO 0.02 -0.15 -0.18 0.68 -0.17 0.00 0.00 175.17 175.37 3ihp s VAL 120 N 1.22 2.74 0.02 1.11 -7.23 -1.26 -2.31 120.40 114.69 3ihp s VAL 120 Ca -0.03 -1.05 -0.25 0.00 -1.81 0.00 0.00 61.98 58.84 3ihp s VAL 120 Cb -0.18 -2.10 0.06 0.00 0.56 0.00 0.00 36.38 34.72 3ihp s VAL 120 CO -0.06 0.45 0.57 -1.59 -0.31 0.00 0.00 175.10 174.16 3ihp s LYS 121 N -1.11 1.04 -0.02 4.82 -2.85 -0.66 -4.59 119.74 116.37 3ihp s LYS 121 Ca 0.13 -0.08 -0.17 0.00 -1.00 0.00 0.00 55.97 54.84 3ihp s LYS 121 Cb -0.10 0.48 -0.05 0.00 -2.06 0.00 0.00 37.83 36.09 3ihp s LYS 121 CO 0.03 -0.36 0.49 0.42 0.10 0.00 0.00 175.35 176.02 3ihp s ILE 122 N -2.06 5.00 -0.06 3.79 1.01 -0.42 0.35 121.20 128.82 3ihp s ILE 122 Ca -0.07 1.00 0.02 0.00 0.00 0.00 0.00 60.65 61.60 3ihp s ILE 122 Cb -0.01 -3.81 0.02 0.00 0.01 0.00 0.00 42.46 38.67 3ihp s ILE 122 CO 0.02 0.47 -0.09 -0.69 0.00 0.00 0.00 174.94 174.65 3ihp s VAL 123 N -0.43 0.89 -0.15 2.92 1.01 0.52 -1.07 120.40 124.10 3ihp s VAL 123 Ca 0.26 -0.33 -0.05 0.00 0.00 0.00 0.00 61.98 61.87 3ihp s VAL 123 Cb -0.17 -0.85 -0.03 0.00 0.00 0.00 0.00 36.38 35.33 3ihp s VAL 123 CO 0.14 0.30 0.02 -0.63 0.00 0.00 0.00 175.10 174.93 3ihp s ILE 124 N 0.82 4.42 0.28 2.22 1.09 -0.53 -0.93 121.20 128.58 3ihp s ILE 124 Ca -0.12 -0.18 -0.03 0.00 -1.10 0.00 0.00 60.65 59.22 3ihp s ILE 124 Cb -0.15 -2.94 -0.05 0.00 -1.06 0.00 0.00 42.46 38.26 3ihp s ILE 124 CO 0.02 0.52 0.52 -0.76 -0.10 0.00 0.00 174.94 175.13 3ihp s LEU 125 N -0.03 4.08 0.00 2.97 1.02 0.13 -1.22 118.68 125.63 3ihp s LEU 125 Ca 0.04 0.61 0.25 0.00 0.02 0.00 0.00 54.13 55.05 3ihp s LEU 125 Cb -0.13 -3.42 0.57 0.00 0.02 0.00 0.00 46.19 43.23 3ihp s LEU 125 CO 0.02 -0.19 1.45 -0.81 0.02 0.00 0.00 176.35 176.84 3ihp n PRO 126 N -1.03 0.44 -0.07 1.29 -0.04 -1.26 -4.75 135.00 129.58 3ihp n PRO 126 Ca -0.03 -0.27 0.12 0.00 -0.04 0.00 0.00 63.50 63.28 3ihp n PRO 126 Cb 0.54 -1.49 0.38 0.00 -0.04 0.00 0.00 33.50 32.89 3ihp n PRO 126 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 3ihp n ASP 127 N -1.05 1.86 -3.64 3.54 8.00 -1.25 -4.95 116.55 119.06 3ihp n ASP 127 Ca 0.09 -1.70 -0.21 0.00 0.71 0.00 0.00 54.79 53.68 3ihp n ASP 127 Cb 0.35 -0.09 0.05 0.00 -0.02 0.00 0.00 41.12 41.41 3ihp n ASP 127 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 3ihp n TYR 128 N 0.45 -2.05 -2.37 1.24 4.01 -0.35 -4.97 117.16 113.11 3ihp n TYR 128 Ca 0.17 0.88 -0.41 0.00 -0.16 0.00 0.00 57.90 58.38 3ihp n TYR 128 Cb 0.38 -4.57 -0.03 0.00 -0.31 0.00 0.00 39.34 34.81 3ihp n TYR 128 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 3ihp s LEU 129 N -6.67 4.44 -0.14 7.72 1.02 -1.01 -4.80 118.68 119.24 3ihp s LEU 129 Ca 0.08 2.21 -0.03 0.00 0.02 0.00 0.00 54.13 56.40 3ihp s LEU 129 Cb -0.04 -3.60 -0.03 0.00 0.02 0.00 0.00 46.19 42.54 3ihp s LEU 129 CO 0.79 -0.40 -0.02 -1.61 0.02 0.00 0.00 176.35 175.13 3ihp s GLU 130 N -0.01 3.50 -0.14 1.70 2.02 -1.26 -1.45 118.70 123.06 3ihp s GLU 130 Ca 0.54 -0.48 0.01 0.00 0.02 0.00 0.00 54.97 55.06 3ihp s GLU 130 Cb -0.32 -2.90 0.02 0.00 0.10 0.00 0.00 34.13 31.02 3ihp s GLU 130 CO 0.35 0.37 -0.15 0.42 0.02 0.00 0.00 175.26 176.28 3ihp s ILE 131 N 0.02 1.58 0.80 -1.63 1.01 -0.23 -4.99 121.20 117.76 3ihp s ILE 131 Ca 0.02 -0.65 -0.11 0.00 0.00 0.00 0.00 60.65 59.91 3ihp s ILE 131 Cb -0.13 -1.48 0.07 0.00 0.01 0.00 0.00 42.46 40.93 3ihp s ILE 131 CO 0.02 0.46 1.09 0.00 0.00 0.00 0.00 174.94 176.51 3ihp s ALA 132 N 1.41 2.21 0.44 9.38 0.00 -1.26 -1.30 121.76 132.63 3ihp s ALA 132 Ca 0.03 -0.14 0.17 0.00 0.00 0.00 0.00 51.96 52.03 3ihp s ALA 132 Cb -0.13 -3.13 1.10 0.00 0.00 0.00 0.00 23.12 20.95 3ihp s ALA 132 CO -0.09 -1.75 1.92 0.00 0.00 0.00 0.00 175.76 175.84 3ihp h ARG 133 N -1.11 0.35 -0.75 0.00 3.08 -1.97 -0.37 114.38 113.61 3ihp h ARG 133 Ca -0.47 -0.02 -0.38 0.00 0.07 0.00 0.00 59.98 59.18 3ihp h ARG 133 Cb 1.26 -0.08 -0.23 0.00 0.08 0.00 0.00 29.97 31.00 3ihp h ARG 133 CO 0.58 0.23 0.37 -0.40 -1.07 0.00 0.00 179.97 179.69 3ihp n ASP 134 N -4.47 3.33 -1.72 7.04 3.85 -1.26 -4.48 116.55 118.84 3ihp n ASP 134 Ca 0.14 -3.66 0.08 0.00 -0.71 0.00 0.00 54.79 50.64 3ihp n ASP 134 Cb 0.55 -0.76 0.38 0.00 -1.35 0.00 0.00 41.12 39.94 3ihp n ASP 134 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 3ihp n GLY 135 N -1.10 2.98 0.75 6.12 0.00 -0.15 -4.57 105.19 109.23 3ihp n GLY 135 Ca 0.49 -0.91 0.10 0.00 0.00 0.00 0.00 46.02 45.70 3ihp n GLY 135 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3ihp n LEU 136 N 0.73 2.23 -4.65 0.99 7.99 -1.26 -4.87 117.00 118.16 3ihp n LEU 136 Ca 0.27 -1.01 -0.40 0.00 -0.01 0.00 0.00 56.01 54.86 3ihp n LEU 136 Cb 1.07 -0.20 0.02 0.00 -0.11 0.00 0.00 43.42 44.20 3ihp n LEU 136 CO 0.28 0.50 0.69 0.61 -1.51 0.00 0.00 177.39 177.97 3ihp n GLY 137 N 1.22 0.05 3.88 -0.72 0.00 -1.26 -2.75 105.19 105.61 3ihp n GLY 137 Ca 0.16 0.09 0.00 0.00 0.00 0.00 0.00 46.02 46.28 3ihp n GLY 137 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ihp n GLY 138 N 1.07 2.85 3.79 -0.02 0.00 -1.26 -4.99 105.19 106.63 3ihp n GLY 138 Ca 0.09 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.79 3ihp n GLY 138 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3ihp s LEU 139 N 0.00 3.44 0.78 0.99 1.43 -1.11 -4.99 118.68 119.22 3ihp s LEU 139 Ca 0.00 1.85 -0.15 0.00 -1.03 0.00 0.00 54.13 54.81 3ihp s LEU 139 Cb 0.00 -4.54 0.02 0.00 0.03 0.00 0.00 46.19 41.71 3ihp s LEU 139 CO 0.00 -1.32 0.85 -2.65 0.23 0.00 0.00 176.35 173.46 3ihp n PRO 140 N -2.22 0.25 -0.31 1.29 -0.02 -1.26 -4.77 135.00 127.96 3ihp n PRO 140 Ca 0.09 0.14 -0.05 0.00 -2.02 0.00 0.00 63.50 61.67 3ihp n PRO 140 Cb 0.53 -2.14 0.08 0.00 -0.02 0.00 0.00 33.50 31.94 3ihp n PRO 140 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 3ihp h ASP 141 N -0.66 1.06 0.34 2.55 5.19 -1.97 -2.46 116.42 120.47 3ihp h ASP 141 Ca -0.46 -0.11 -0.05 0.00 -0.62 0.00 0.00 57.03 55.79 3ihp h ASP 141 Cb 1.32 -0.27 -0.01 0.00 0.18 0.00 0.00 39.33 40.55 3ihp h ASP 141 CO 0.44 0.87 -0.22 -0.29 -3.12 0.00 0.00 179.24 176.91 3ihp h ILE 142 N 1.17 0.96 0.18 0.35 6.09 -1.99 0.21 117.51 124.48 3ihp h ILE 142 Ca 0.29 -0.82 -0.27 0.00 -1.37 0.00 0.00 64.86 62.69 3ihp h ILE 142 Cb 0.06 1.47 0.03 0.00 0.47 0.00 0.00 36.82 38.85 3ihp h ILE 142 CO -0.04 0.22 -1.18 1.62 -3.07 0.00 0.00 178.15 175.70 3ihp h VAL 143 N 0.00 1.36 -0.78 2.19 3.04 -1.86 -1.91 116.25 118.28 3ihp h VAL 143 Ca -0.00 -2.56 0.10 0.00 -1.01 0.00 0.00 66.70 63.23 3ihp h VAL 143 Cb 0.45 2.99 -0.07 0.00 -2.01 0.00 0.00 31.29 32.65 3ihp h VAL 143 CO 0.03 0.76 0.42 0.03 -1.01 0.00 0.00 177.57 177.80 3ihp h ARG 144 N 0.01 0.69 -0.30 4.17 3.08 -0.95 0.75 114.38 121.82 3ihp h ARG 144 Ca -0.20 -0.04 -0.14 0.00 0.07 0.00 0.00 59.98 59.67 3ihp h ARG 144 Cb 1.91 -0.15 -0.01 0.00 0.08 0.00 0.00 29.97 31.79 3ihp h ARG 144 CO 0.22 0.45 -0.39 -0.44 -1.07 0.00 0.00 179.97 178.75 3ihp h ASP 145 N 0.71 0.77 -0.29 7.04 3.32 -0.63 -2.05 116.42 125.29 3ihp h ASP 145 Ca 0.38 -0.35 -0.04 0.00 0.02 0.00 0.00 57.03 57.05 3ihp h ASP 145 Cb 0.38 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.71 3ihp h ASP 145 CO -0.26 1.07 0.03 0.03 -1.72 0.00 0.00 179.24 178.39 3ihp h ARG 146 N 0.60 0.49 -0.33 3.56 2.47 -0.95 -2.30 114.38 117.90 3ihp h ARG 146 Ca 0.05 -0.14 -0.07 0.00 -1.26 0.00 0.00 59.98 58.56 3ihp h ARG 146 Cb 0.93 -0.05 -0.01 0.00 -1.65 0.00 0.00 29.97 29.19 3ihp h ARG 146 CO 0.08 0.61 -0.07 0.28 0.56 0.00 0.00 179.97 181.44 3ihp h VAL 147 N 0.29 1.28 0.06 2.04 2.07 -0.78 -1.78 116.25 119.42 3ihp h VAL 147 Ca 0.08 -1.11 -0.26 0.00 0.82 0.00 0.00 66.70 66.23 3ihp h VAL 147 Cb 0.38 1.31 0.01 0.00 -1.52 0.00 0.00 31.29 31.47 3ihp h VAL 147 CO 0.01 0.36 -1.10 0.71 0.02 0.00 0.00 177.57 177.57 3ihp h THR 148 N 0.42 1.36 -0.46 2.57 1.35 -1.46 -2.01 112.91 114.68 3ihp h THR 148 Ca 0.09 -2.51 0.09 0.00 -0.55 0.00 0.00 66.41 63.53 3ihp h THR 148 Cb 0.56 2.57 -0.08 0.00 -1.73 0.00 0.00 68.15 69.47 3ihp h THR 148 CO 0.03 0.75 -0.05 -1.28 -0.25 0.00 0.00 175.52 174.73 3ihp h SER 149 N 0.25 -0.29 -0.13 5.36 0.87 -1.42 0.35 113.55 118.54 3ihp h SER 149 Ca -0.13 0.12 0.00 0.00 -1.23 0.00 0.00 61.79 60.55 3ihp h SER 149 Cb 1.76 0.23 -0.01 0.00 -0.44 0.00 0.00 62.40 63.94 3ihp h SER 149 CO 0.20 -0.10 0.08 0.00 -0.53 0.00 0.00 176.83 176.48 3ihp h ALA 150 N 1.43 0.16 -0.13 6.23 0.00 -1.26 -1.63 119.26 124.07 3ihp h ALA 150 Ca 0.23 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.14 3ihp h ALA 150 Cb 0.34 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 3ihp h ALA 150 CO -0.42 -0.36 0.08 0.28 0.00 0.00 0.00 179.25 178.84 3ihp h VAL 151 N 0.17 1.03 -0.48 0.00 2.07 -0.76 -1.28 116.25 116.99 3ihp h VAL 151 Ca 0.05 -0.06 -0.00 0.00 0.82 0.00 0.00 66.70 67.51 3ihp h VAL 151 Cb -0.01 0.84 -0.02 0.00 -1.52 0.00 0.00 31.29 30.58 3ihp h VAL 151 CO -0.02 0.03 0.29 -0.33 0.02 0.00 0.00 177.57 177.56 3ihp h GLU 152 N 0.17 0.66 -0.16 1.57 5.08 -0.92 -1.24 114.58 119.73 3ihp h GLU 152 Ca 0.05 -0.06 0.01 0.00 -1.00 0.00 0.00 59.36 58.35 3ihp h GLU 152 Cb -0.01 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.09 3ihp h GLU 152 CO -0.02 0.49 0.11 0.00 -1.00 0.00 0.00 179.01 178.59 3ihp h ALA 153 N 1.13 1.91 -0.04 3.43 0.00 -1.10 -2.32 119.26 122.27 3ihp h ALA 153 Ca 0.17 -0.01 -0.22 0.00 0.00 0.00 0.00 54.91 54.85 3ihp h ALA 153 Cb 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.74 3ihp h ALA 153 CO -0.03 0.08 -0.88 -0.07 0.00 0.00 0.00 179.25 178.35 3ihp h LEU 154 N 0.20 0.62 -2.28 0.00 3.38 -0.09 -3.23 115.31 113.91 3ihp h LEU 154 Ca 0.06 -0.46 0.00 0.00 0.09 0.00 0.00 57.88 57.57 3ihp h LEU 154 Cb 0.00 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 40.57 3ihp h LEU 154 CO -0.01 1.25 0.00 0.18 0.09 0.00 0.00 178.44 179.94 3ihp n LEU 155 N -3.80 3.45 -3.96 1.67 4.77 -0.77 -5.04 117.00 113.31 3ihp n LEU 155 Ca -0.07 -1.66 -0.23 0.00 -0.03 0.00 0.00 56.01 54.03 3ihp n LEU 155 Cb 0.80 -0.64 -0.16 0.00 -2.33 0.00 0.00 43.42 41.09 3ihp n LEU 155 CO 0.51 0.61 -0.44 -0.44 -1.33 0.00 0.00 177.39 176.30 3ihp s SER 156 N 1.27 1.41 -0.27 -1.43 0.01 -1.22 -5.05 113.70 108.41 3ihp s SER 156 Ca 0.00 -0.22 -0.00 0.00 1.31 0.00 0.00 55.95 57.04 3ihp s SER 156 Cb 0.00 -0.66 0.15 0.00 0.21 0.00 0.00 66.02 65.72 3ihp s SER 156 CO 0.00 -0.01 0.39 -0.69 0.41 0.00 0.00 173.24 173.34 3ihp s VAL 173 N 0.79 -0.60 -0.15 3.43 1.01 -1.26 -4.98 120.40 118.64 3ihp s VAL 173 Ca -0.13 -0.22 -0.09 0.00 0.00 0.00 0.00 61.98 61.54 3ihp s VAL 173 Cb -0.15 -0.92 -0.04 0.00 0.00 0.00 0.00 36.38 35.27 3ihp s VAL 173 CO 0.02 -0.24 0.15 -0.13 0.00 0.00 0.00 175.10 174.91 3ihp s ARG 174 N 2.53 3.79 0.42 2.72 0.52 -1.26 -5.11 118.95 122.56 3ihp s ARG 174 Ca 0.11 -0.14 0.05 0.00 -0.52 0.00 0.00 55.73 55.23 3ihp s ARG 174 Cb -0.14 -3.29 0.01 0.00 0.52 0.00 0.00 34.95 32.04 3ihp s ARG 174 CO -0.25 0.56 0.60 1.14 0.02 0.00 0.00 175.30 177.37 3ihp s GLN 175 N -0.41 2.92 0.22 3.54 1.03 -1.26 -4.74 119.66 120.97 3ihp s GLN 175 Ca 0.13 -0.91 -0.30 0.00 0.04 0.00 0.00 55.36 54.32 3ihp s GLN 175 Cb -0.12 -2.68 -0.09 0.00 0.03 0.00 0.00 33.01 30.15 3ihp s GLN 175 CO 0.02 -0.24 1.20 0.14 -2.54 0.00 0.00 175.29 173.87 3ihp s VAL 176 N -2.41 3.41 0.37 3.63 -7.23 -1.26 -0.21 120.40 116.69 3ihp s VAL 176 Ca 0.51 1.25 -0.28 0.00 -1.81 0.00 0.00 61.98 61.64 3ihp s VAL 176 Cb -0.10 -3.80 -0.11 0.00 0.56 0.00 0.00 36.38 32.93 3ihp s VAL 176 CO 0.34 0.23 1.48 -0.24 -0.31 0.00 0.00 175.10 176.61 3ihp n SER 177 N 2.04 3.71 0.23 4.85 2.88 -0.30 -4.77 113.62 122.26 3ihp n SER 177 Ca 0.03 1.22 0.15 0.00 -1.33 0.00 0.00 58.87 58.93 3ihp n SER 177 Cb 0.44 -1.61 0.78 0.00 -0.75 0.00 0.00 64.21 63.07 3ihp n SER 177 CO 0.00 0.00 0.00 0.07 -1.23 0.00 0.00 175.04 173.88 3ihp h LYS 178 N 3.08 0.00 -0.02 -1.46 -0.00 -1.94 -2.87 116.57 113.37 3ihp h LYS 178 Ca -0.50 0.00 0.00 0.00 -0.00 0.00 0.00 60.65 60.15 3ihp h LYS 178 Cb 1.24 0.00 0.00 0.00 -0.00 0.00 0.00 32.23 33.47 3ihp h LYS 178 CO 0.65 0.00 -0.04 0.72 -0.00 0.00 0.00 179.45 180.78 3ihp n HIS 179 N -2.52 0.00 0.25 0.07 8.25 -1.26 -4.62 115.22 115.39 3ihp n HIS 179 Ca -0.02 0.00 0.08 0.00 -0.26 0.00 0.00 57.72 57.52 3ihp n HIS 179 Cb 0.08 0.00 0.63 0.00 1.12 0.00 0.00 29.99 31.83 3ihp n HIS 179 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3ihp h ALA 180 N 2.75 1.81 0.00 -1.41 0.00 -1.83 -2.56 119.26 118.01 3ihp h ALA 180 Ca 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.85 3ihp h ALA 180 Cb 0.58 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.36 3ihp h ALA 180 CO 0.00 0.08 -1.62 1.19 0.00 0.00 0.00 179.25 178.90 3ihp n PHE 181 N -4.34 0.00 1.18 0.00 3.72 -1.26 -4.39 117.46 112.37 3ihp n PHE 181 Ca -0.03 0.00 0.12 0.00 -0.05 0.00 0.00 57.45 57.50 3ihp n PHE 181 Cb 0.15 -0.33 0.25 0.00 -0.94 0.00 0.00 39.48 38.61 3ihp n PHE 181 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 3ihp n SER 182 N -1.98 1.67 -4.62 4.37 2.88 -1.16 -4.98 113.62 109.81 3ihp n SER 182 Ca -0.02 -1.33 -0.43 0.00 -1.33 0.00 0.00 58.87 55.76 3ihp n SER 182 Cb 0.41 0.21 -0.02 0.00 -0.75 0.00 0.00 64.21 64.05 3ihp n SER 182 CO 0.00 0.00 0.00 -0.22 -1.23 0.00 0.00 175.04 173.59 3ihp s LEU 183 N -2.35 3.83 -0.29 2.46 2.96 -0.98 -4.97 118.68 119.34 3ihp s LEU 183 Ca 0.25 1.37 -0.29 0.00 -0.22 0.00 0.00 54.13 55.24 3ihp s LEU 183 Cb 0.19 -3.54 0.01 0.00 0.50 0.00 0.00 46.19 43.36 3ihp s LEU 183 CO 0.48 -1.25 1.09 -1.59 -1.32 0.00 0.00 176.35 173.76 3ihp s LYS 184 N 4.60 4.11 -0.24 1.98 -2.85 -1.26 -5.03 119.74 121.05 3ihp s LYS 184 Ca 0.66 1.19 -0.10 0.00 -1.00 0.00 0.00 55.97 56.71 3ihp s LYS 184 Cb -0.21 -3.72 -0.05 0.00 -2.06 0.00 0.00 37.83 31.79 3ihp s LYS 184 CO 0.28 -0.84 0.15 -0.65 0.10 0.00 0.00 175.35 174.38 3ihp s GLN 185 N 3.57 3.99 0.61 1.78 -0.21 -1.26 -4.66 119.66 123.49 3ihp s GLN 185 Ca 0.46 -0.31 -0.19 0.00 0.02 0.00 0.00 55.36 55.35 3ihp s GLN 185 Cb -0.14 -3.51 -0.03 0.00 1.00 0.00 0.00 33.01 30.34 3ihp s GLN 185 CO 0.14 0.01 1.27 -0.51 -2.12 0.00 0.00 175.29 174.07 3ihp s LEU 186 N 1.18 3.65 0.84 2.90 1.43 0.06 -5.01 118.68 123.73 3ihp s LEU 186 Ca 0.07 2.55 -0.11 0.00 -1.03 0.00 0.00 54.13 55.61 3ihp s LEU 186 Cb -0.14 -4.57 0.10 0.00 0.03 0.00 0.00 46.19 41.61 3ihp s LEU 186 CO 0.05 -1.79 1.10 -1.81 0.23 0.00 0.00 176.35 174.13 3ihp s ASP 187 N -1.42 3.91 -1.17 2.29 1.01 -1.26 -4.30 116.67 115.73 3ihp s ASP 187 Ca 0.79 1.76 -0.18 0.00 0.71 0.00 0.00 52.55 55.63 3ihp s ASP 187 Cb -0.35 -2.42 -0.01 0.00 1.01 0.00 0.00 42.92 41.15 3ihp s ASP 187 CO 0.38 -2.40 0.75 0.59 0.21 0.00 0.00 175.17 174.70 3ihp n ASN 188 N -3.75 -4.65 -4.86 0.27 3.02 -1.26 -4.95 115.26 99.06 3ihp n ASN 188 Ca 0.09 -1.01 -0.31 0.00 -0.03 0.00 0.00 54.58 53.32 3ihp n ASN 188 Cb 0.54 -3.38 0.04 0.00 -0.61 0.00 0.00 39.78 36.36 3ihp n ASN 188 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 3ihp s PRO 189 N -6.04 3.11 0.68 3.52 0.04 -1.26 -5.06 135.00 129.99 3ihp s PRO 189 Ca 0.41 0.65 -0.11 0.00 0.04 0.00 0.00 61.00 61.99 3ihp s PRO 189 Cb -0.15 -2.03 -0.00 0.00 0.04 0.00 0.00 34.50 32.36 3ihp s PRO 189 CO 0.86 -0.90 1.06 0.00 0.04 0.00 0.00 177.00 178.06 3ihp s ALA 190 N -3.24 2.82 -0.78 8.56 0.00 -1.26 -5.01 121.76 122.85 3ihp s ALA 190 Ca 0.57 -0.07 -0.16 0.00 0.00 0.00 0.00 51.96 52.30 3ihp s ALA 190 Cb -0.12 -3.11 0.17 0.00 0.00 0.00 0.00 23.12 20.06 3ihp s ALA 190 CO 0.53 -1.07 0.82 1.03 0.00 0.00 0.00 175.76 177.08 3ihp s ARG 191 N -5.15 3.44 -0.05 0.00 3.00 -1.26 -4.68 118.95 114.25 3ihp s ARG 191 Ca 0.57 -2.00 -0.30 0.00 0.00 0.00 0.00 55.73 54.00 3ihp s ARG 191 Cb -0.13 -4.51 -0.04 0.00 0.00 0.00 0.00 34.95 30.28 3ihp s ARG 191 CO 0.54 -1.46 1.27 0.42 0.00 0.00 0.00 175.30 176.07 3ihp s ILE 192 N 1.40 4.09 0.88 1.52 1.09 -1.06 -5.02 121.20 124.10 3ihp s ILE 192 Ca 0.19 1.42 -0.12 0.00 -1.10 0.00 0.00 60.65 61.05 3ihp s ILE 192 Cb -0.13 -3.92 0.12 0.00 -1.06 0.00 0.00 42.46 37.47 3ihp s ILE 192 CO -0.05 -0.02 1.12 -2.84 -0.10 0.00 0.00 174.94 173.05 3ihp s PRO 193 N 2.42 1.44 0.00 2.79 0.02 -1.26 -4.81 135.00 135.60 3ihp s PRO 193 Ca 0.58 0.47 0.30 0.00 0.02 0.00 0.00 61.00 62.37 3ihp s PRO 193 Cb -0.26 -1.86 1.43 0.00 0.02 0.00 0.00 34.50 33.83 3ihp s PRO 193 CO 0.23 -2.03 2.00 -2.30 -0.33 0.00 0.00 177.00 174.57 3ihp n PRO 194 N -3.68 0.37 -3.68 5.54 -0.02 -1.26 -4.93 135.00 127.34 3ihp n PRO 194 Ca 0.07 -0.02 -0.08 0.00 -2.02 0.00 0.00 63.50 61.44 3ihp n PRO 194 Cb 0.58 -1.50 -0.02 0.00 -0.02 0.00 0.00 33.50 32.54 3ihp n PRO 194 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3ihp n GLY 196 N -0.42 0.37 3.80 0.00 0.00 -1.26 -4.92 105.19 102.75 3ihp n GLY 196 Ca -0.09 -0.89 -0.32 0.00 0.00 0.00 0.00 46.02 44.72 3ihp n GLY 196 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3ihp s TRP 197 N -2.01 2.90 0.03 1.61 0.51 -1.26 -5.08 118.94 115.64 3ihp s TRP 197 Ca 0.00 1.50 0.01 0.00 -2.12 0.00 0.00 56.10 55.50 3ihp s TRP 197 Cb 0.00 -3.01 -0.02 0.00 -0.81 0.00 0.00 33.47 29.63 3ihp s TRP 197 CO 0.00 -1.33 -0.06 0.15 -0.51 0.00 0.00 176.95 175.20 3ihp s LYS 198 N -4.41 0.43 -0.03 4.98 1.02 -1.26 -4.58 119.74 115.89 3ihp s LYS 198 Ca 0.63 -0.58 -0.34 0.00 0.02 0.00 0.00 55.97 55.70 3ihp s LYS 198 Cb -0.16 -0.21 -0.13 0.00 -0.52 0.00 0.00 37.83 36.81 3ihp s LYS 198 CO 0.44 0.04 1.79 0.00 -0.92 0.00 0.00 175.35 176.70 3ihp h SER 200 N 8.22 0.00 0.00 0.00 0.87 -1.13 -3.25 113.55 118.25 3ihp h SER 200 Ca -0.48 0.00 -0.10 0.00 -1.23 0.00 0.00 61.79 59.98 3ihp h SER 200 Cb 1.27 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 63.22 3ihp h SER 200 CO 0.93 0.00 -1.18 0.29 -0.53 0.00 0.00 176.83 176.34 3ihp n LYS 201 N -2.99 0.43 0.00 2.24 5.02 -1.26 -5.05 118.16 116.55 3ihp n LYS 201 Ca -0.00 0.18 0.00 0.00 -2.02 0.00 0.00 58.31 56.46 3ihp n LYS 201 Cb 0.45 -1.24 0.00 0.00 -0.02 0.00 0.00 35.03 34.22 3ihp n LYS 201 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3ihp n ASP 203 N 0.00 4.83 -3.00 0.00 8.00 -1.26 -4.63 116.55 120.49 3ihp n ASP 203 Ca 0.00 0.00 -0.35 0.00 0.71 0.00 0.00 54.79 55.15 3ihp n ASP 203 Cb 0.00 0.79 -0.03 0.00 -0.02 0.00 0.00 41.12 41.85 3ihp n ASP 203 CO 0.00 0.00 0.00 0.80 -0.39 0.00 0.00 177.20 177.61 3ihp n MET 204 N -1.63 0.00 -0.00 -1.24 1.56 -1.26 -4.55 117.12 109.99 3ihp n MET 204 Ca 0.00 0.00 0.01 0.00 -0.27 0.00 0.00 57.70 57.44 3ihp n MET 204 Cb 0.18 -0.81 -0.02 0.00 2.15 0.00 0.00 33.22 34.72 3ihp n MET 204 CO 0.00 0.00 0.00 0.54 -0.73 0.00 0.00 175.97 175.78 3ihp n ARG 205 N 0.81 3.35 -4.07 2.12 1.74 -1.26 -1.98 116.66 117.36 3ihp n ARG 205 Ca 0.13 -0.01 -0.23 0.00 -0.77 0.00 0.00 57.85 56.96 3ihp n ARG 205 Cb 0.12 -0.82 -0.06 0.00 -1.02 0.00 0.00 32.46 30.68 3ihp n ARG 205 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 3ihp s GLU 206 N -1.66 2.35 -0.82 5.56 2.02 -1.26 -4.73 118.70 120.16 3ihp s GLU 206 Ca 0.00 -1.60 -0.03 0.00 0.02 0.00 0.00 54.97 53.36 3ihp s GLU 206 Cb 0.02 -2.15 0.00 0.00 0.10 0.00 0.00 34.13 32.10 3ihp s GLU 206 CO 0.09 0.05 0.70 -1.71 0.02 0.00 0.00 175.26 174.41 3ihp n ASN 207 N -1.19 -3.29 -4.44 -0.19 2.85 -1.26 -4.83 115.26 102.91 3ihp n ASN 207 Ca -0.02 -0.38 -0.33 0.00 -0.11 0.00 0.00 54.58 53.74 3ihp n ASN 207 Cb 0.62 -3.47 -0.13 0.00 1.24 0.00 0.00 39.78 38.04 3ihp n ASN 207 CO 0.00 0.00 0.00 -0.76 -2.11 0.00 0.00 177.26 174.39 3ihp s LEU 208 N -4.94 2.87 -0.15 1.20 1.43 -1.26 -0.66 118.68 117.17 3ihp s LEU 208 Ca 0.17 -0.23 -0.06 0.00 -1.03 0.00 0.00 54.13 52.98 3ihp s LEU 208 Cb -0.08 -1.64 -0.04 0.00 0.03 0.00 0.00 46.19 44.46 3ihp s LEU 208 CO 0.47 0.22 0.07 0.26 0.23 0.00 0.00 176.35 177.61 3ihp s TRP 209 N 0.02 3.33 -0.32 0.29 0.52 0.11 -0.98 118.94 121.91 3ihp s TRP 209 Ca -0.03 0.23 -0.15 0.00 0.02 0.00 0.00 56.10 56.16 3ihp s TRP 209 Cb -0.14 -1.99 -0.02 0.00 -1.15 0.00 0.00 33.47 30.17 3ihp s TRP 209 CO 0.04 0.37 0.38 -1.17 0.02 0.00 0.00 176.95 176.59 3ihp s LEU 210 N -0.22 4.29 -0.18 2.99 2.96 0.56 -1.45 118.68 127.64 3ihp s LEU 210 Ca 0.08 -0.04 -0.29 0.00 -0.22 0.00 0.00 54.13 53.66 3ihp s LEU 210 Cb -0.12 -2.40 0.00 0.00 0.50 0.00 0.00 46.19 44.18 3ihp s LEU 210 CO 0.01 -0.31 1.02 0.21 -1.32 0.00 0.00 176.35 175.97 3ihp s ASN 211 N 1.71 7.15 0.00 3.68 3.84 -0.50 0.24 114.94 131.05 3ihp s ASN 211 Ca 0.14 1.43 0.15 0.00 0.21 0.00 0.00 52.86 54.78 3ihp s ASN 211 Cb -0.16 -2.54 0.77 0.00 -0.55 0.00 0.00 41.25 38.76 3ihp s ASN 211 CO 0.11 -0.58 1.38 0.18 -2.79 0.00 0.00 177.10 175.40 3ihp n LEU 212 N 5.80 0.00 0.01 3.21 4.77 0.45 -1.29 117.00 129.94 3ihp n LEU 212 Ca 0.10 0.22 -0.21 0.00 -0.03 0.00 0.00 56.01 56.09 3ihp n LEU 212 Cb 0.47 -0.22 -0.14 0.00 -2.33 0.00 0.00 43.42 41.20 3ihp n LEU 212 CO 0.52 -0.12 -0.81 0.41 -1.33 0.00 0.00 177.39 176.07 3ihp n THR 213 N -1.22 1.79 -0.67 -5.08 -1.04 -1.26 -4.71 114.28 102.08 3ihp n THR 213 Ca 0.08 -0.66 0.00 0.00 -2.04 0.00 0.00 64.05 61.43 3ihp n THR 213 Cb 0.10 -1.73 0.00 0.00 -1.82 0.00 0.00 70.33 66.88 3ihp n THR 213 CO 0.00 0.00 0.00 -0.90 -0.64 0.00 0.00 175.07 173.53 3ihp n ASP 214 N -3.48 0.52 0.00 8.00 5.75 -1.12 -0.76 116.55 125.47 3ihp n ASP 214 Ca -0.32 -1.19 0.00 0.00 -0.01 0.00 0.00 54.79 53.27 3ihp n ASP 214 Cb 1.05 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 41.14 3ihp n ASP 214 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3ihp n GLY 215 N -0.10 0.39 3.77 6.12 0.00 -0.41 -4.83 105.19 110.13 3ihp n GLY 215 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 3ihp n GLY 215 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3ihp s SER 216 N -2.12 6.73 -0.28 1.61 1.04 -1.26 -4.74 113.70 114.68 3ihp s SER 216 Ca 0.00 2.68 -0.01 0.00 0.48 0.00 0.00 55.95 59.10 3ihp s SER 216 Cb 0.00 -2.65 0.04 0.00 0.10 0.00 0.00 66.02 63.52 3ihp s SER 216 CO 0.00 -0.56 -0.04 -0.63 0.98 0.00 0.00 173.24 172.99 3ihp s ILE 217 N -1.15 2.80 0.03 -1.02 1.01 -1.26 -1.41 121.20 120.19 3ihp s ILE 217 Ca 0.50 -1.31 -0.01 0.00 0.00 0.00 0.00 60.65 59.82 3ihp s ILE 217 Cb -0.39 -2.55 -0.02 0.00 0.01 0.00 0.00 42.46 39.50 3ihp s ILE 217 CO 0.52 0.01 -0.01 -0.76 0.00 0.00 0.00 174.94 174.71 3ihp s LEU 218 N 1.25 2.20 0.69 2.97 1.43 -0.53 -0.45 118.68 126.25 3ihp s LEU 218 Ca -0.04 -0.58 -0.12 0.00 -1.03 0.00 0.00 54.13 52.36 3ihp s LEU 218 Cb -0.19 0.21 0.01 0.00 0.03 0.00 0.00 46.19 46.25 3ihp s LEU 218 CO -0.03 -0.38 1.08 0.00 0.23 0.00 0.00 176.35 177.25 3ihp n GLY 220 N -1.28 -1.96 3.87 0.00 0.00 0.17 -1.89 105.19 104.10 3ihp n GLY 220 Ca 0.09 -1.50 -0.34 0.00 0.00 0.00 0.00 46.02 44.27 3ihp n GLY 220 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3ihp s ARG 221 N -2.08 3.81 0.42 1.61 3.00 -1.26 -1.39 118.95 123.07 3ihp s ARG 221 Ca 0.00 0.25 0.04 0.00 0.00 0.00 0.00 55.73 56.02 3ihp s ARG 221 Cb 0.00 -2.85 0.00 0.00 0.00 0.00 0.00 34.95 32.10 3ihp s ARG 221 CO 0.00 0.45 0.60 -0.98 0.00 0.00 0.00 175.30 175.37 3ihp s ARG 222 N -2.31 2.95 0.00 3.54 3.03 -1.20 -2.54 118.95 122.43 3ihp s ARG 222 Ca 0.40 -0.84 0.00 0.00 2.03 0.00 0.00 55.73 57.32 3ihp s ARG 222 Cb -0.13 -2.67 0.00 0.00 -1.03 0.00 0.00 34.95 31.12 3ihp s ARG 222 CO 0.20 -0.23 0.00 0.66 -1.13 0.00 0.00 175.30 174.80 3ihp n TYR 223 N -1.94 0.00 0.00 5.89 4.02 -1.24 -4.98 117.16 118.92 3ihp n TYR 223 Ca 0.03 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.92 3ihp n TYR 223 Cb 0.58 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.90 3ihp n TYR 223 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 176.86 172.38 3ihp n ASP 225 N 0.00 0.00 0.00 7.72 2.03 -1.26 -5.02 116.55 120.02 3ihp n ASP 225 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 3ihp n ASP 225 Cb 0.00 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.40 3ihp n ASP 225 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3ihp n GLY 226 N 0.00 2.07 3.90 0.27 0.00 -1.26 -5.09 105.19 105.08 3ihp n GLY 226 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 3ihp n GLY 226 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3ihp s SER 227 N -0.62 6.45 0.00 1.61 1.04 -1.26 -4.98 113.70 115.94 3ihp s SER 227 Ca 0.00 0.89 0.00 0.00 0.48 0.00 0.00 55.95 57.32 3ihp s SER 227 Cb 0.00 -2.22 0.00 0.00 0.10 0.00 0.00 66.02 63.90 3ihp s SER 227 CO 0.00 -0.32 0.00 0.61 0.98 0.00 0.00 173.24 174.51 3ihp n GLY 228 N -1.27 0.51 0.00 7.32 0.00 -1.26 -3.63 105.19 106.86 3ihp n GLY 228 Ca -0.00 -2.04 0.00 0.00 0.00 0.00 0.00 46.02 43.98 3ihp n GLY 228 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ihp n GLY 229 N 0.00 2.38 1.96 -0.02 0.00 -1.05 -4.85 105.19 103.61 3ihp n GLY 229 Ca 0.00 -2.14 -0.14 0.00 0.00 0.00 0.00 46.02 43.74 3ihp n GLY 229 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3ihp n ASN 230 N -2.43 3.98 -1.75 1.61 4.13 -1.21 -3.26 115.26 116.33 3ihp n ASN 230 Ca 0.00 -3.23 -0.20 0.00 1.68 0.00 0.00 54.58 52.83 3ihp n ASN 230 Cb 0.00 -0.76 -0.07 0.00 -1.54 0.00 0.00 39.78 37.41 3ihp n ASN 230 CO 0.00 0.00 0.00 0.59 0.28 0.00 0.00 177.26 178.13 3ihp n ASN 231 N -0.55 -5.34 -0.08 6.41 3.02 -0.49 -4.88 115.26 113.35 3ihp n ASN 231 Ca 0.44 0.39 -0.10 0.00 -0.03 0.00 0.00 54.58 55.28 3ihp n ASN 231 Cb 1.40 -4.68 0.05 0.00 -0.61 0.00 0.00 39.78 35.93 3ihp n ASN 231 CO 0.00 0.00 0.00 0.45 -2.62 0.00 0.00 177.26 175.09 3ihp h HIS 232 N 0.00 0.92 0.06 3.10 3.86 -1.73 -2.83 115.15 118.53 3ihp h HIS 232 Ca -0.42 -0.26 -0.00 0.00 -1.16 0.00 0.00 60.37 58.53 3ihp h HIS 232 Cb 1.31 -0.20 0.00 0.00 1.06 0.00 0.00 27.41 29.58 3ihp h HIS 232 CO 0.56 1.02 -0.03 0.00 0.86 0.00 0.00 177.93 180.34 3ihp h ALA 233 N 0.95 -0.09 -0.65 2.45 0.00 -1.60 -1.58 119.26 118.74 3ihp h ALA 233 Ca 0.07 -0.14 -0.07 0.00 0.00 0.00 0.00 54.91 54.77 3ihp h ALA 233 Cb 0.89 0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.69 3ihp h ALA 233 CO 0.08 -0.42 0.14 -0.24 0.00 0.00 0.00 179.25 178.81 3ihp h VAL 234 N -0.34 1.26 0.00 0.00 3.04 -1.80 -1.32 116.25 117.08 3ihp h VAL 234 Ca -0.01 -0.98 -0.03 0.00 -1.01 0.00 0.00 66.70 64.68 3ihp h VAL 234 Cb 0.30 0.63 -0.00 0.00 -2.01 0.00 0.00 31.29 30.21 3ihp h VAL 234 CO 0.01 0.37 -0.13 -0.33 -1.01 0.00 0.00 177.57 176.48 3ihp h GLU 235 N 0.98 0.00 -0.34 4.17 4.39 -1.47 0.27 114.58 122.58 3ihp h GLU 235 Ca 0.20 0.00 -0.16 0.00 0.34 0.00 0.00 59.36 59.74 3ihp h GLU 235 Cb 0.39 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.04 3ihp h GLU 235 CO 0.01 0.13 -0.43 1.25 -1.16 0.00 0.00 179.01 178.81 3ihp h HIS 236 N 0.00 1.04 -0.51 4.33 2.76 -0.62 -1.46 115.15 120.69 3ihp h HIS 236 Ca -0.00 -0.33 -0.03 0.00 -2.20 0.00 0.00 60.37 57.81 3ihp h HIS 236 Cb 0.24 -0.21 -0.02 0.00 1.55 0.00 0.00 27.41 28.96 3ihp h HIS 236 CO 0.00 1.13 0.20 -0.92 -1.30 0.00 0.00 177.93 177.04 3ihp h TYR 237 N 0.69 0.79 -0.32 5.26 3.20 -0.26 -2.12 116.97 124.21 3ihp h TYR 237 Ca 0.05 -0.06 0.06 0.00 3.14 0.00 0.00 58.73 61.91 3ihp h TYR 237 Cb 1.02 -0.24 -0.05 0.00 1.54 0.00 0.00 36.73 39.00 3ihp h TYR 237 CO 0.06 0.66 -0.02 -0.09 -1.64 0.00 0.00 178.16 177.13 3ihp h ARG 238 N 0.69 0.06 0.00 1.82 9.65 -0.40 0.55 114.38 126.76 3ihp h ARG 238 Ca 0.17 -0.00 -0.04 0.00 -1.10 0.00 0.00 59.98 59.00 3ihp h ARG 238 Cb 0.21 -0.01 -0.01 0.00 -1.39 0.00 0.00 29.97 28.77 3ihp h ARG 238 CO -0.01 0.04 -0.21 0.93 2.80 0.00 0.00 179.97 183.52 3ihp h GLU 239 N 0.07 0.00 0.00 0.20 5.08 -1.13 -3.38 114.58 115.42 3ihp h GLU 239 Ca 0.15 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.43 3ihp h GLU 239 Cb 0.22 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.45 3ihp h GLU 239 CO -0.28 0.21 -1.31 0.25 -1.00 0.00 0.00 179.01 176.88 3ihp n THR 240 N -3.55 0.32 -0.47 1.13 -2.24 -0.81 -5.02 114.28 103.63 3ihp n THR 240 Ca -0.01 -0.13 0.00 0.00 -2.27 0.00 0.00 64.05 61.64 3ihp n THR 240 Cb 0.36 -0.73 0.00 0.00 -2.10 0.00 0.00 70.33 67.86 3ihp n THR 240 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3ihp n GLY 241 N 3.14 0.75 3.57 3.38 0.00 0.19 -5.02 105.19 111.19 3ihp n GLY 241 Ca -0.09 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.52 3ihp n GLY 241 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3ihp s TYR 242 N -2.59 2.04 0.23 1.61 2.02 -1.26 -4.90 117.35 114.50 3ihp s TYR 242 Ca 0.00 0.58 -0.00 0.00 -0.37 0.00 0.00 57.07 57.28 3ihp s TYR 242 Cb 0.00 -4.27 0.24 0.00 -0.40 0.00 0.00 41.96 37.53 3ihp s TYR 242 CO 0.00 -2.24 1.59 -1.00 -1.57 0.00 0.00 175.55 172.33 3ihp h PRO 243 N 12.38 0.49 -5.98 -1.71 0.13 -1.95 -3.44 132.00 131.91 3ihp h PRO 243 Ca -0.28 -0.26 -0.68 0.00 -0.87 0.00 0.00 66.00 63.91 3ihp h PRO 243 Cb 1.12 0.01 -0.17 0.00 0.13 0.00 0.00 31.00 32.10 3ihp h PRO 243 CO 1.16 0.84 -0.65 -0.51 -0.23 0.00 0.00 178.00 178.61 3ihp s LEU 244 N -8.41 3.42 0.02 1.56 1.43 -1.26 -1.21 118.68 114.23 3ihp s LEU 244 Ca -0.07 0.07 -0.00 0.00 -1.03 0.00 0.00 54.13 53.10 3ihp s LEU 244 Cb 0.12 -1.77 -0.02 0.00 0.03 0.00 0.00 46.19 44.55 3ihp s LEU 244 CO 0.82 0.36 -0.03 0.00 0.23 0.00 0.00 176.35 177.72 3ihp s ALA 245 N -0.77 0.17 -0.01 4.21 0.00 -0.50 -0.41 121.76 124.45 3ihp s ALA 245 Ca 0.12 -0.66 0.05 0.00 0.00 0.00 0.00 51.96 51.47 3ihp s ALA 245 Cb -0.11 0.16 -0.03 0.00 0.00 0.00 0.00 23.12 23.14 3ihp s ALA 245 CO 0.02 -0.18 -0.14 0.54 0.00 0.00 0.00 175.76 176.00 3ihp s VAL 246 N -1.71 3.08 -0.63 0.00 0.11 0.14 0.03 120.40 121.41 3ihp s VAL 246 Ca -0.13 -0.88 -0.26 0.00 -2.93 0.00 0.00 61.98 57.77 3ihp s VAL 246 Cb -0.08 -2.26 0.04 0.00 -1.53 0.00 0.00 36.38 32.55 3ihp s VAL 246 CO -0.02 0.47 1.11 -0.75 -3.33 0.00 0.00 175.10 172.59 3ihp s LYS 247 N -1.09 3.30 0.19 1.54 2.20 -0.37 -0.32 119.74 125.18 3ihp s LYS 247 Ca 0.14 -0.22 -0.33 0.00 -0.36 0.00 0.00 55.97 55.19 3ihp s LYS 247 Cb -0.11 -4.11 -0.14 0.00 -1.51 0.00 0.00 37.83 31.96 3ihp s LYS 247 CO 0.03 -1.79 1.53 1.28 -0.36 0.00 0.00 175.35 176.04 3ihp n LEU 248 N 8.33 3.11 0.00 5.43 4.77 -0.16 -1.19 117.00 137.30 3ihp n LEU 248 Ca 0.03 1.10 0.00 0.00 -0.03 0.00 0.00 56.01 57.11 3ihp n LEU 248 Cb 0.48 -1.43 0.00 0.00 -2.33 0.00 0.00 43.42 40.14 3ihp n LEU 248 CO 0.68 -0.34 0.00 0.61 -1.33 0.00 0.00 177.39 177.01 3ihp n GLY 249 N 3.01 0.14 0.67 -0.72 0.00 -1.26 -4.71 105.19 102.31 3ihp n GLY 249 Ca 0.15 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.29 3ihp n GLY 249 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3ihp n THR 250 N -2.00 0.00 -2.27 2.61 -2.24 -0.33 -4.88 114.28 105.17 3ihp n THR 250 Ca 0.00 -0.35 -0.34 0.00 -2.27 0.00 0.00 64.05 61.09 3ihp n THR 250 Cb 0.00 1.29 -0.04 0.00 -2.10 0.00 0.00 70.33 69.48 3ihp n THR 250 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 3ihp s ILE 251 N -2.28 3.62 0.38 2.28 1.01 -1.26 -4.25 121.20 120.71 3ihp s ILE 251 Ca 0.23 -0.37 0.07 0.00 0.00 0.00 0.00 60.65 60.59 3ihp s ILE 251 Cb 0.19 -4.44 -0.01 0.00 0.01 0.00 0.00 42.46 38.21 3ihp s ILE 251 CO 0.46 -1.37 0.43 0.42 0.00 0.00 0.00 174.94 174.88 3ihp s THR 252 N 7.82 3.32 0.61 2.92 -4.23 -0.84 -5.00 115.64 120.24 3ihp s THR 252 Ca 0.58 -1.17 0.27 0.00 -1.18 0.00 0.00 61.69 60.19 3ihp s THR 252 Cb -0.05 -3.15 0.37 0.00 1.34 0.00 0.00 72.50 71.01 3ihp s THR 252 CO -0.00 -0.08 1.67 -0.65 -0.54 0.00 0.00 174.62 175.01 3ihp h PRO 253 N 0.95 0.00 -0.00 3.99 0.10 -1.94 -2.91 132.00 132.19 3ihp h PRO 253 Ca -0.43 0.00 0.00 0.00 0.10 0.00 0.00 66.00 65.67 3ihp h PRO 253 Cb 1.26 0.00 0.00 0.00 0.10 0.00 0.00 31.00 32.36 3ihp h PRO 253 CO 0.53 0.00 -0.85 -0.25 0.10 0.00 0.00 178.00 177.53 3ihp n ASP 254 N -3.44 0.85 0.00 -2.05 8.00 -1.26 -4.92 116.55 113.74 3ihp n ASP 254 Ca 0.12 -0.78 0.00 0.00 0.71 0.00 0.00 54.79 54.84 3ihp n ASP 254 Cb 0.95 0.78 0.00 0.00 -0.02 0.00 0.00 41.12 42.83 3ihp n ASP 254 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3ihp n GLY 255 N 1.50 -0.24 3.62 0.44 0.00 -1.10 -5.16 105.19 104.24 3ihp n GLY 255 Ca 0.04 -1.51 -0.12 0.00 0.00 0.00 0.00 46.02 44.43 3ihp n GLY 255 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ihp s ALA 256 N -1.00 0.14 -0.49 4.61 0.00 -1.26 -1.98 121.76 121.78 3ihp s ALA 256 Ca 0.00 -1.19 -0.25 0.00 0.00 0.00 0.00 51.96 50.53 3ihp s ALA 256 Cb 0.00 0.97 0.03 0.00 0.00 0.00 0.00 23.12 24.12 3ihp s ALA 256 CO 0.00 -0.87 0.91 -0.51 0.00 0.00 0.00 175.76 175.29 3ihp s ASP 257 N -3.16 6.42 -0.21 0.00 1.01 -1.26 -5.02 116.67 114.44 3ihp s ASP 257 Ca 0.24 -0.10 -0.08 0.00 0.71 0.00 0.00 52.55 53.32 3ihp s ASP 257 Cb -0.02 -2.43 -0.04 0.00 1.01 0.00 0.00 42.92 41.43 3ihp s ASP 257 CO 0.16 -1.10 0.10 -0.69 0.21 0.00 0.00 175.17 173.85 3ihp s VAL 258 N 3.76 4.90 -0.08 -1.27 1.01 -1.26 -1.24 120.40 126.22 3ihp s VAL 258 Ca 0.33 0.01 0.00 0.00 0.00 0.00 0.00 61.98 62.33 3ihp s VAL 258 Cb -0.11 -3.25 -0.03 0.00 0.00 0.00 0.00 36.38 32.99 3ihp s VAL 258 CO 0.23 0.40 -0.06 -0.47 0.00 0.00 0.00 175.10 175.19 3ihp s TYR 259 N 0.84 2.96 -0.35 5.22 5.04 0.10 -1.00 117.35 130.16 3ihp s TYR 259 Ca 0.05 0.00 -0.09 0.00 -2.44 0.00 0.00 57.07 54.59 3ihp s TYR 259 Cb -0.13 -1.74 0.02 0.00 0.35 0.00 0.00 41.96 40.47 3ihp s TYR 259 CO 0.02 0.31 0.15 0.45 -1.34 0.00 0.00 175.55 175.14 3ihp s SER 260 N -0.71 5.51 0.42 4.32 0.15 0.42 -1.41 113.70 122.39 3ihp s SER 260 Ca 0.11 -0.94 0.10 0.00 0.70 0.00 0.00 55.95 55.91 3ihp s SER 260 Cb -0.11 -1.96 0.89 0.00 -1.71 0.00 0.00 66.02 63.13 3ihp s SER 260 CO 0.02 -0.32 2.01 1.88 1.20 0.00 0.00 173.24 178.03 3ihp h TYR 261 N 8.34 0.32 -0.04 3.44 0.05 -1.45 -1.88 116.97 125.73 3ihp h TYR 261 Ca -0.26 -0.01 -0.14 0.00 0.05 0.00 0.00 58.73 58.37 3ihp h TYR 261 Cb 1.11 -0.10 0.01 0.00 1.01 0.00 0.00 36.73 38.75 3ihp h TYR 261 CO 0.59 0.29 -0.50 0.22 -1.05 0.00 0.00 178.16 177.71 3ihp h ASP 262 N 0.32 0.52 -0.07 3.88 1.82 -1.93 -3.06 116.42 117.89 3ihp h ASP 262 Ca 0.08 -0.70 0.00 0.00 -0.39 0.00 0.00 57.03 56.01 3ihp h ASP 262 Cb 0.14 -0.16 0.00 0.00 0.68 0.00 0.00 39.33 40.00 3ihp h ASP 262 CO -0.00 1.15 0.00 -0.62 -1.61 0.00 0.00 179.24 178.16 3ihp n GLU 263 N -4.27 1.52 -3.99 0.28 1.02 -1.23 -4.96 120.64 109.00 3ihp n GLU 263 Ca -0.09 -0.77 -0.39 0.00 -0.02 0.00 0.00 57.16 55.89 3ihp n GLU 263 Cb 0.61 -1.42 0.02 0.00 -0.02 0.00 0.00 31.44 30.63 3ihp n GLU 263 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 3ihp n ASP 264 N -0.04 -3.58 -3.51 1.62 2.03 -0.75 -4.96 116.55 107.35 3ihp n ASP 264 Ca 0.18 -1.10 -0.14 0.00 0.52 0.00 0.00 54.79 54.25 3ihp n ASP 264 Cb 0.27 -1.36 -0.05 0.00 -0.72 0.00 0.00 41.12 39.27 3ihp n ASP 264 CO 0.00 0.00 0.00 -1.81 -1.92 0.00 0.00 177.20 173.47 3ihp s ASP 265 N -3.63 -0.54 0.17 1.67 1.01 -0.97 -5.03 116.67 109.36 3ihp s ASP 265 Ca 0.38 0.43 -0.30 0.00 0.71 0.00 0.00 52.55 53.76 3ihp s ASP 265 Cb -0.21 0.48 -0.08 0.00 1.01 0.00 0.00 42.92 44.11 3ihp s ASP 265 CO 0.83 -0.61 1.27 -0.04 0.21 0.00 0.00 175.17 176.83 3ihp s MET 266 N -1.86 4.42 0.16 8.23 -1.94 -1.26 -0.43 119.30 126.61 3ihp s MET 266 Ca -0.05 1.97 0.03 0.00 -1.71 0.00 0.00 55.69 55.93 3ihp s MET 266 Cb -0.00 -3.23 -0.05 0.00 2.01 0.00 0.00 34.83 33.56 3ihp s MET 266 CO 0.02 -0.22 -0.05 0.14 -0.01 0.00 0.00 175.02 174.90 3ihp s VAL 267 N 0.27 0.89 0.21 -6.03 -7.23 -0.17 -4.53 120.40 103.80 3ihp s VAL 267 Ca 0.56 -2.00 -0.08 0.00 -1.81 0.00 0.00 61.98 58.65 3ihp s VAL 267 Cb -0.34 -1.98 -0.07 0.00 0.56 0.00 0.00 36.38 34.55 3ihp s VAL 267 CO 0.36 -0.62 0.50 -0.76 -0.31 0.00 0.00 175.10 174.27 3ihp s LEU 268 N -3.16 4.19 -0.34 1.32 1.43 0.71 -4.28 118.68 118.53 3ihp s LEU 268 Ca 0.20 0.81 -0.01 0.00 -1.03 0.00 0.00 54.13 54.10 3ihp s LEU 268 Cb 0.05 -3.57 0.12 0.00 0.03 0.00 0.00 46.19 42.81 3ihp s LEU 268 CO 0.02 -0.05 0.16 -0.62 0.23 0.00 0.00 176.35 176.09 3ihp s ASP 269 N -2.44 3.55 0.64 2.29 2.15 -1.26 -1.15 116.67 120.44 3ihp s ASP 269 Ca 0.45 -1.89 0.28 0.00 0.43 0.00 0.00 52.55 51.82 3ihp s ASP 269 Cb -0.11 -0.64 1.46 0.00 -0.30 0.00 0.00 42.92 43.33 3ihp s ASP 269 CO 0.23 -0.36 1.85 -0.65 -0.17 0.00 0.00 175.17 176.06 3ihp h PRO 270 N 7.61 0.00 -0.40 4.34 0.11 -1.98 -0.85 132.00 140.84 3ihp h PRO 270 Ca -0.07 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.04 3ihp h PRO 270 Cb 0.98 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.09 3ihp h PRO 270 CO 0.41 0.00 0.00 0.43 -0.21 0.00 0.00 178.00 178.63 3ihp n SER 271 N -3.19 4.57 -0.03 -2.05 7.64 -1.26 -4.68 113.62 114.62 3ihp n SER 271 Ca 0.02 -2.91 -0.09 0.00 1.01 0.00 0.00 58.87 56.91 3ihp n SER 271 Cb 0.55 -0.58 -0.03 0.00 -1.01 0.00 0.00 64.21 63.14 3ihp n SER 271 CO 0.00 0.00 0.00 0.25 -3.01 0.00 0.00 175.04 172.28 3ihp h LEU 272 N 2.75 -0.79 -0.77 -3.43 5.85 -1.54 0.36 115.31 117.74 3ihp h LEU 272 Ca 0.00 0.13 0.15 0.00 0.84 0.00 0.00 57.88 59.00 3ihp h LEU 272 Cb 1.61 0.36 -0.15 0.00 0.37 0.00 0.00 40.66 42.85 3ihp h LEU 272 CO 0.31 -0.29 -0.22 0.00 -0.34 0.00 0.00 178.44 177.90 3ihp h ALA 273 N 0.70 0.43 -0.10 1.25 0.00 -1.84 0.81 119.26 120.50 3ihp h ALA 273 Ca 0.12 0.29 -0.15 0.00 0.00 0.00 0.00 54.91 55.16 3ihp h ALA 273 Cb 0.47 0.64 -0.01 0.00 0.00 0.00 0.00 17.79 18.89 3ihp h ALA 273 CO -0.36 -0.45 -0.60 0.93 0.00 0.00 0.00 179.25 178.77 3ihp h GLU 274 N -0.02 0.35 -0.24 0.00 4.39 -1.74 0.24 114.58 117.55 3ihp h GLU 274 Ca 0.36 -0.24 -0.15 0.00 0.34 0.00 0.00 59.36 59.67 3ihp h GLU 274 Cb 0.57 0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 29.25 3ihp h GLU 274 CO -0.80 0.84 -0.48 0.45 -1.16 0.00 0.00 179.01 177.86 3ihp h HIS 275 N 0.26 0.78 -0.03 4.33 3.86 0.73 -2.17 115.15 122.90 3ihp h HIS 275 Ca -0.01 -0.25 -0.21 0.00 -1.16 0.00 0.00 60.37 58.74 3ihp h HIS 275 Cb 1.12 -0.16 0.00 0.00 1.06 0.00 0.00 27.41 29.44 3ihp h HIS 275 CO 0.03 0.99 -0.87 -0.07 0.86 0.00 0.00 177.93 178.87 3ihp h LEU 276 N 0.50 0.55 -1.79 2.43 3.38 0.72 -3.07 115.31 118.04 3ihp h LEU 276 Ca 0.03 -0.41 -0.02 0.00 0.09 0.00 0.00 57.88 57.57 3ihp h LEU 276 Cb 1.02 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 41.60 3ihp h LEU 276 CO 0.10 1.19 -0.06 -1.28 0.09 0.00 0.00 178.44 178.48 3ihp h SER 277 N 0.27 0.05 -0.98 -0.43 0.87 -0.16 -0.50 113.55 112.67 3ihp h SER 277 Ca -0.06 -0.01 0.21 0.00 -1.23 0.00 0.00 61.79 60.70 3ihp h SER 277 Cb 1.48 -0.01 -0.11 0.00 -0.44 0.00 0.00 62.40 63.32 3ihp h SER 277 CO 0.15 0.12 0.57 -0.74 -0.53 0.00 0.00 176.83 176.41 3ihp h HIS 278 N 0.06 0.99 -0.48 2.24 6.17 -1.29 -0.57 115.15 122.27 3ihp h HIS 278 Ca 0.01 0.04 0.00 0.00 0.71 0.00 0.00 60.37 61.13 3ihp h HIS 278 Cb 0.14 -0.29 0.00 0.00 2.52 0.00 0.00 27.41 29.79 3ihp h HIS 278 CO 0.00 0.14 0.00 1.19 0.71 0.00 0.00 177.93 179.97 3ihp n PHE 279 N -4.85 0.76 -2.81 5.26 3.72 -0.28 -4.84 117.46 114.42 3ihp n PHE 279 Ca 0.24 -0.35 -0.09 0.00 -0.05 0.00 0.00 57.45 57.19 3ihp n PHE 279 Cb 0.63 -0.05 0.04 0.00 -0.94 0.00 0.00 39.48 39.17 3ihp n PHE 279 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3ihp n GLY 280 N 1.18 0.10 2.89 1.37 0.00 -0.22 -2.58 105.19 107.93 3ihp n GLY 280 Ca 0.17 -0.20 -0.30 0.00 0.00 0.00 0.00 46.02 45.69 3ihp n GLY 280 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3ihp s ILE 281 N -3.17 1.35 0.08 -0.61 1.01 -0.67 -4.77 121.20 114.42 3ihp s ILE 281 Ca 0.09 -1.20 0.01 0.00 0.00 0.00 0.00 60.65 59.56 3ihp s ILE 281 Cb -0.04 -1.71 -0.04 0.00 0.01 0.00 0.00 42.46 40.68 3ihp s ILE 281 CO 0.36 -0.20 0.20 1.51 0.00 0.00 0.00 174.94 176.80 3ihp s ASP 282 N 1.46 6.18 -0.10 3.58 -4.77 -1.26 -2.40 116.67 119.36 3ihp s ASP 282 Ca -0.03 0.19 -0.10 0.00 -3.30 0.00 0.00 52.55 49.31 3ihp s ASP 282 Cb -0.18 -1.85 -0.05 0.00 -1.09 0.00 0.00 42.92 39.75 3ihp s ASP 282 CO -0.08 0.14 0.22 -0.04 0.70 0.00 0.00 175.17 176.11 3ihp s MET 283 N -2.65 3.67 -0.30 2.11 -1.94 -1.26 -5.00 119.30 113.93 3ihp s MET 283 Ca 0.34 0.02 -0.10 0.00 -1.71 0.00 0.00 55.69 54.23 3ihp s MET 283 Cb -0.12 -3.23 0.16 0.00 2.01 0.00 0.00 34.83 33.65 3ihp s MET 283 CO 0.27 0.69 0.83 -2.14 -0.01 0.00 0.00 175.02 174.65 3ihp s PRO 319 N -0.85 0.41 0.15 2.03 0.02 -1.26 -4.61 135.00 130.89 3ihp s PRO 319 Ca 0.17 0.91 0.10 0.00 0.02 0.00 0.00 61.00 62.20 3ihp s PRO 319 Cb -0.13 0.54 -0.04 0.00 0.02 0.00 0.00 34.50 34.89 3ihp s PRO 319 CO 0.06 -0.26 -0.18 -0.51 -0.33 0.00 0.00 177.00 175.79 3ihp s LEU 320 N 2.74 2.70 0.04 -5.54 1.02 0.21 -4.86 118.68 114.99 3ihp s LEU 320 Ca 0.02 -0.63 -0.04 0.00 0.02 0.00 0.00 54.13 53.50 3ihp s LEU 320 Cb -0.10 -1.48 -0.02 0.00 0.02 0.00 0.00 46.19 44.60 3ihp s LEU 320 CO -0.18 0.15 0.05 -0.36 0.02 0.00 0.00 176.35 176.03 3ihp s PHE 321 N -1.38 0.30 0.00 0.29 0.08 -1.26 -4.84 117.98 111.17 3ihp s PHE 321 Ca 0.20 -0.69 0.00 0.00 0.12 0.00 0.00 56.93 56.56 3ihp s PHE 321 Cb -0.10 -0.22 0.00 0.00 -0.57 0.00 0.00 43.02 42.14 3ihp s PHE 321 CO 0.11 -0.36 0.00 0.41 -0.10 0.00 0.00 175.22 175.28 3ihp n GLY 322 N 0.60 -1.69 3.64 4.36 0.00 -1.26 -4.82 105.19 106.02 3ihp n GLY 322 Ca -0.18 -2.16 -0.49 0.00 0.00 0.00 0.00 46.02 43.19 3ihp n GLY 322 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3ihp n PRO 323 N -0.14 1.70 -0.92 1.61 -0.04 -1.06 -1.35 135.00 134.80 3ihp n PRO 323 Ca 0.00 0.61 0.00 0.00 -0.04 0.00 0.00 63.50 64.07 3ihp n PRO 323 Cb 0.00 -2.33 0.00 0.00 -0.04 0.00 0.00 33.50 31.13 3ihp n PRO 323 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3ihp n GLY 324 N 3.09 0.53 2.56 0.55 0.00 -0.67 -4.92 105.19 106.33 3ihp n GLY 324 Ca 0.18 -0.12 -0.12 0.00 0.00 0.00 0.00 46.02 45.96 3ihp n GLY 324 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3ihp n TYR 325 N -2.92 1.88 -3.26 1.61 4.02 -0.46 -4.99 117.16 113.05 3ihp n TYR 325 Ca 0.00 -2.50 -0.39 0.00 -0.01 0.00 0.00 57.90 55.01 3ihp n TYR 325 Cb 0.00 -0.27 -0.06 0.00 -0.02 0.00 0.00 39.34 38.99 3ihp n TYR 325 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 176.86 176.84 3ihp s THR 326 N -4.06 4.72 0.49 -0.72 2.01 -1.25 -4.48 115.64 112.34 3ihp s THR 326 Ca 0.35 1.24 -0.09 0.00 0.31 0.00 0.00 61.69 63.50 3ihp s THR 326 Cb 0.39 -3.91 -0.05 0.00 0.01 0.00 0.00 72.50 68.94 3ihp s THR 326 CO -0.03 0.54 0.85 -0.83 -0.69 0.00 0.00 174.62 174.47 3ihp s GLY 327 N -1.13 1.73 -0.20 4.40 0.00 -1.26 -4.97 107.32 105.88 3ihp s GLY 327 Ca 0.30 -0.26 0.01 0.00 0.00 0.00 0.00 44.72 44.77 3ihp s GLY 327 CO 0.20 -0.05 -0.17 -0.42 0.00 0.00 0.00 173.10 172.65 3ihp s ILE 328 N -2.70 2.18 0.27 0.90 1.01 0.40 -1.69 121.20 121.56 3ihp s ILE 328 Ca 0.51 -1.07 -0.30 0.00 0.00 0.00 0.00 60.65 59.79 3ihp s ILE 328 Cb -0.10 -2.01 -0.14 0.00 0.01 0.00 0.00 42.46 40.22 3ihp s ILE 328 CO 0.41 0.40 1.25 0.54 0.00 0.00 0.00 174.94 177.54 3ihp n ARG 329 N 4.59 1.79 -2.26 2.79 3.00 0.43 -2.52 116.66 124.48 3ihp n ARG 329 Ca -0.19 0.63 -0.41 0.00 -0.01 0.00 0.00 57.85 57.87 3ihp n ARG 329 Cb 0.48 -2.18 -0.03 0.00 0.00 0.00 0.00 32.46 30.73 3ihp n ARG 329 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.63 178.84 3ihp s ASN 330 N -0.10 6.94 -0.02 0.55 3.84 -1.26 -4.77 114.94 120.12 3ihp s ASN 330 Ca 0.63 2.35 0.18 0.00 0.21 0.00 0.00 52.86 56.23 3ihp s ASN 330 Cb -0.67 -2.61 0.53 0.00 -0.55 0.00 0.00 41.25 37.96 3ihp s ASN 330 CO 0.56 -0.49 1.44 0.18 -2.79 0.00 0.00 177.10 176.00 3ihp n LEU 331 N 2.68 3.69 -0.07 3.21 4.77 -1.26 -4.96 117.00 125.05 3ihp n LEU 331 Ca 0.06 -2.09 0.00 0.00 -0.03 0.00 0.00 56.01 53.95 3ihp n LEU 331 Cb 0.43 -0.41 0.00 0.00 -2.33 0.00 0.00 43.42 41.11 3ihp n LEU 331 CO 0.57 0.87 0.00 0.61 -1.33 0.00 0.00 177.39 178.11 3ihp n GLY 332 N 1.10 0.14 2.55 -0.72 0.00 -1.26 -4.81 105.19 102.19 3ihp n GLY 332 Ca 0.20 -0.83 -0.20 0.00 0.00 0.00 0.00 46.02 45.18 3ihp n GLY 332 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3ihp n ASN 333 N 0.00 -5.45 -1.00 1.61 3.02 -1.26 -4.79 115.26 107.40 3ihp n ASN 333 Ca 0.00 0.44 0.04 0.00 -0.03 0.00 0.00 54.58 55.03 3ihp n ASN 333 Cb 0.00 -4.78 0.18 0.00 -0.61 0.00 0.00 39.78 34.57 3ihp n ASN 333 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 3ihp n SER 334 N -1.41 2.81 -0.02 6.41 3.41 -1.26 -4.44 113.62 119.11 3ihp n SER 334 Ca -0.21 -2.30 0.01 0.00 -0.26 0.00 0.00 58.87 56.10 3ihp n SER 334 Cb 0.67 -0.48 0.32 0.00 -0.26 0.00 0.00 64.21 64.46 3ihp n SER 334 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3ihp h TYR 336 N 0.57 0.33 -0.24 0.00 -0.00 -1.85 0.93 116.97 116.71 3ihp h TYR 336 Ca 0.13 -0.00 -0.02 0.00 0.00 0.00 0.00 58.73 58.84 3ihp h TYR 336 Cb 0.20 -0.11 -0.01 0.00 0.00 0.00 0.00 36.73 36.82 3ihp h TYR 336 CO 0.01 0.26 0.08 1.25 -0.00 0.00 0.00 178.16 179.76 3ihp h LEU 337 N 0.29 0.34 -0.32 0.10 6.46 -1.73 -2.30 115.31 118.16 3ihp h LEU 337 Ca 0.09 -0.20 0.07 0.00 -0.12 0.00 0.00 57.88 57.71 3ihp h LEU 337 Cb 0.04 -0.09 -0.07 0.00 -0.73 0.00 0.00 40.66 39.81 3ihp h LEU 337 CO -0.02 0.45 -0.11 0.78 -0.62 0.00 0.00 178.44 178.92 3ihp h ASN 338 N 0.22 -0.40 -0.81 1.25 2.35 -0.88 -1.31 115.58 116.00 3ihp h ASN 338 Ca 0.08 0.11 -0.00 0.00 -0.55 0.00 0.00 56.30 55.93 3ihp h ASN 338 Cb 0.23 0.24 -0.04 0.00 0.05 0.00 0.00 38.32 38.80 3ihp h ASN 338 CO -0.00 -0.15 0.49 0.28 -1.65 0.00 0.00 177.43 176.40 3ihp h SER 339 N -0.05 0.97 0.46 5.81 0.02 -0.66 -1.52 113.55 118.57 3ihp h SER 339 Ca 0.16 -0.06 -0.02 0.00 -0.84 0.00 0.00 61.79 61.03 3ihp h SER 339 Cb 0.29 -0.24 0.00 0.00 0.14 0.00 0.00 62.40 62.59 3ihp h SER 339 CO -0.36 0.74 -0.22 0.58 -1.14 0.00 0.00 176.83 176.43 3ihp h VAL 340 N 1.11 0.36 -0.86 2.27 2.07 -1.05 -3.18 116.25 116.97 3ihp h VAL 340 Ca 0.29 -0.51 0.17 0.00 0.82 0.00 0.00 66.70 67.47 3ihp h VAL 340 Cb -0.05 0.52 -0.06 0.00 -1.52 0.00 0.00 31.29 30.18 3ihp h VAL 340 CO -0.06 0.06 0.57 0.58 0.02 0.00 0.00 177.57 178.74 3ihp h VAL 341 N -0.99 0.75 0.00 2.57 2.07 -1.19 0.25 116.25 119.71 3ihp h VAL 341 Ca -0.06 -0.17 -0.07 0.00 0.82 0.00 0.00 66.70 67.22 3ihp h VAL 341 Cb 0.58 0.22 -0.01 0.00 -1.52 0.00 0.00 31.29 30.56 3ihp h VAL 341 CO 0.10 0.09 -0.34 1.56 0.02 0.00 0.00 177.57 179.01 3ihp h GLN 342 N 0.49 0.00 0.11 1.57 1.08 -1.29 -2.62 115.11 114.44 3ihp h GLN 342 Ca 0.44 0.00 -0.21 0.00 -1.45 0.00 0.00 58.65 57.43 3ihp h GLN 342 Cb 0.96 0.00 0.01 0.00 -0.05 0.00 0.00 27.48 28.40 3ihp h GLN 342 CO -0.17 0.34 -1.02 0.28 -0.95 0.00 0.00 178.83 177.30 3ihp h VAL 343 N 0.00 1.29 -0.30 -0.54 2.07 -0.54 -3.21 116.25 115.02 3ihp h VAL 343 Ca -0.00 -2.44 0.07 0.00 0.82 0.00 0.00 66.70 65.15 3ihp h VAL 343 Cb 0.61 2.95 -0.08 0.00 -1.52 0.00 0.00 31.29 33.25 3ihp h VAL 343 CO 0.04 0.67 -0.34 -0.07 0.02 0.00 0.00 177.57 177.89 3ihp h LEU 344 N -0.45 -1.12 0.00 2.57 4.07 -1.17 0.27 115.31 119.48 3ihp h LEU 344 Ca -0.21 0.18 0.00 0.00 0.08 0.00 0.00 57.88 57.93 3ihp h LEU 344 Cb 1.61 0.50 0.00 0.00 1.08 0.00 0.00 40.66 43.85 3ihp h LEU 344 CO 0.07 -0.35 0.00 0.49 -1.08 0.00 0.00 178.44 177.58 3ihp n PHE 345 N -5.42 0.00 0.96 1.13 3.01 -0.99 -1.15 117.46 115.00 3ihp n PHE 345 Ca -0.01 0.00 0.12 0.00 1.01 0.00 0.00 57.45 58.57 3ihp n PHE 345 Cb 0.34 0.00 0.17 0.00 -0.01 0.00 0.00 39.48 39.98 3ihp n PHE 345 CO 0.00 0.00 0.00 0.43 1.01 0.00 0.00 176.76 178.20 3ihp n SER 346 N -0.69 0.60 -4.58 4.37 7.64 0.08 -4.80 113.62 116.24 3ihp n SER 346 Ca 0.07 -0.36 -0.40 0.00 1.01 0.00 0.00 58.87 59.18 3ihp n SER 346 Cb 0.03 0.41 -0.09 0.00 -1.01 0.00 0.00 64.21 63.55 3ihp n SER 346 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 3ihp s ILE 347 N -3.02 5.15 0.27 0.44 1.01 -0.30 -4.99 121.20 119.77 3ihp s ILE 347 Ca 0.10 0.36 -0.00 0.00 0.00 0.00 0.00 60.65 61.11 3ihp s ILE 347 Cb 0.17 -3.77 0.28 0.00 0.01 0.00 0.00 42.46 39.15 3ihp s ILE 347 CO 0.74 0.02 1.67 -0.65 0.00 0.00 0.00 174.94 176.72 3ihp h PRO 348 N 8.31 0.25 -0.84 2.79 0.11 -1.90 -0.22 132.00 140.49 3ihp h PRO 348 Ca -0.31 -0.01 0.09 0.00 0.11 0.00 0.00 66.00 65.88 3ihp h PRO 348 Cb 1.15 -0.06 -0.06 0.00 0.11 0.00 0.00 31.00 32.15 3ihp h PRO 348 CO 0.68 0.16 0.55 -0.44 -0.21 0.00 0.00 178.00 178.74 3ihp h ASP 349 N 0.25 0.75 0.46 -2.05 3.32 -1.93 0.20 116.42 117.42 3ihp h ASP 349 Ca 0.50 0.02 -0.19 0.00 0.02 0.00 0.00 57.03 57.38 3ihp h ASP 349 Cb 0.96 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 40.36 3ihp h ASP 349 CO -0.59 0.45 -0.83 -0.26 -1.72 0.00 0.00 179.24 176.29 3ihp h PHE 350 N 0.83 0.38 -0.34 4.55 0.04 -1.33 -2.39 116.94 118.68 3ihp h PHE 350 Ca 0.39 -0.20 -0.01 0.00 2.80 0.00 0.00 57.97 60.95 3ihp h PHE 350 Cb 0.39 -0.05 -0.02 0.00 2.20 0.00 0.00 35.95 38.48 3ihp h PHE 350 CO -0.00 0.98 0.19 1.96 -0.60 0.00 0.00 178.31 180.84 3ihp h GLN 351 N 0.16 0.47 -0.61 1.51 4.20 -0.33 -2.53 115.11 117.98 3ihp h GLN 351 Ca -0.04 -0.05 -0.07 0.00 0.06 0.00 0.00 58.65 58.54 3ihp h GLN 351 Cb 1.43 -0.09 -0.02 0.00 0.30 0.00 0.00 27.48 29.10 3ihp h GLN 351 CO 0.13 0.39 0.09 0.00 -0.67 0.00 0.00 178.83 178.77 3ihp h ARG 352 N 0.43 1.01 -0.35 1.46 3.08 -0.66 0.16 114.38 119.51 3ihp h ARG 352 Ca 0.12 -0.27 -0.08 0.00 0.07 0.00 0.00 59.98 59.82 3ihp h ARG 352 Cb 0.05 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 29.97 3ihp h ARG 352 CO -0.02 0.95 -0.09 -0.22 -1.07 0.00 0.00 179.97 179.52 3ihp h LYS 353 N 0.92 0.67 0.00 0.04 1.63 -1.41 -3.13 116.57 115.29 3ihp h LYS 353 Ca 0.18 -0.26 0.00 0.00 -0.85 0.00 0.00 60.65 59.72 3ihp h LYS 353 Cb 0.43 -0.04 0.00 0.00 -0.60 0.00 0.00 32.23 32.03 3ihp h LYS 353 CO 0.01 0.84 -1.02 0.66 -3.45 0.00 0.00 179.45 176.50 3ihp n TYR 354 N -4.41 0.00 -0.04 1.91 4.01 -0.96 -4.38 117.16 113.29 3ihp n TYR 354 Ca -0.02 0.00 -0.09 0.00 -0.16 0.00 0.00 57.90 57.63 3ihp n TYR 354 Cb 0.34 -0.11 -0.03 0.00 -0.31 0.00 0.00 39.34 39.23 3ihp n TYR 354 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 3ihp n VAL 355 N -1.57 0.47 0.20 -0.72 0.31 0.40 -4.13 118.33 113.29 3ihp n VAL 355 Ca -0.01 -0.13 0.05 0.00 -0.01 0.00 0.00 64.34 64.24 3ihp n VAL 355 Cb 0.16 -1.47 0.48 0.00 -0.91 0.00 0.00 33.84 32.09 3ihp n VAL 355 CO 0.00 0.00 0.00 0.44 -1.32 0.00 0.00 176.83 175.95 3ihp h ASP 356 N -0.26 0.05 -0.59 4.52 3.32 -1.25 -3.04 116.42 119.17 3ihp h ASP 356 Ca -0.21 -0.01 -0.15 0.00 0.02 0.00 0.00 57.03 56.68 3ihp h ASP 356 Cb 1.21 -0.01 -0.09 0.00 0.22 0.00 0.00 39.33 40.66 3ihp h ASP 356 CO -0.11 0.22 0.15 0.29 -1.72 0.00 0.00 179.24 178.07 3ihp n LYS 357 N -4.31 3.52 0.18 3.56 5.02 -1.18 -4.65 118.16 120.30 3ihp n LYS 357 Ca -0.02 -3.07 0.02 0.00 -2.02 0.00 0.00 58.31 53.23 3ihp n LYS 357 Cb 0.25 -2.11 0.36 0.00 -0.02 0.00 0.00 35.03 33.50 3ihp n LYS 357 CO 0.00 0.00 0.00 1.37 -0.52 0.00 0.00 177.40 178.25 3ihp h LEU 358 N 2.49 0.00 0.17 -0.35 8.10 -1.69 -2.15 115.31 121.89 3ihp h LEU 358 Ca 0.18 -0.00 -0.01 0.00 0.11 0.00 0.00 57.88 58.16 3ihp h LEU 358 Cb 2.06 -0.00 0.00 0.00 -0.44 0.00 0.00 40.66 42.28 3ihp h LEU 358 CO 0.58 0.38 -0.08 -0.33 -4.11 0.00 0.00 178.44 174.87 3ihp h GLU 359 N 0.00 -0.22 -0.90 0.17 4.39 -1.86 0.36 114.58 116.52 3ihp h GLU 359 Ca -0.00 0.01 0.14 0.00 0.34 0.00 0.00 59.36 59.85 3ihp h GLU 359 Cb 0.66 0.05 -0.09 0.00 -0.10 0.00 0.00 28.75 29.27 3ihp h GLU 359 CO 0.05 0.05 0.52 -0.22 -1.16 0.00 0.00 179.01 178.24 3ihp h LYS 360 N -0.48 0.74 0.04 2.33 3.64 -1.89 -0.02 116.57 120.93 3ihp h LYS 360 Ca -0.02 -0.04 -0.00 0.00 -1.27 0.00 0.00 60.65 59.31 3ihp h LYS 360 Cb 0.37 -0.17 0.00 0.00 -0.41 0.00 0.00 32.23 32.02 3ihp h LYS 360 CO 0.04 0.49 -0.02 0.82 -2.27 0.00 0.00 179.45 178.51 3ihp h ILE 361 N 0.76 1.18 -0.91 2.00 2.04 -1.00 -1.40 117.51 120.19 3ihp h ILE 361 Ca 0.48 -0.72 0.04 0.00 1.00 0.00 0.00 64.86 65.66 3ihp h ILE 361 Cb 0.60 1.66 -0.06 0.00 -0.74 0.00 0.00 36.82 38.28 3ihp h ILE 361 CO -0.32 0.18 0.59 -0.26 0.00 0.00 0.00 178.15 178.34 3ihp h PHE 362 N -0.37 1.09 -0.75 1.37 -1.00 0.16 -1.12 116.94 116.33 3ihp h PHE 362 Ca -0.01 0.03 0.05 0.00 2.81 0.00 0.00 57.97 60.85 3ihp h PHE 362 Cb 0.34 -0.36 -0.05 0.00 3.61 0.00 0.00 35.95 39.48 3ihp h PHE 362 CO 0.03 0.62 0.46 1.96 -1.61 0.00 0.00 178.31 179.76 3ihp h GLN 363 N 1.12 0.84 -0.03 1.51 4.20 -0.81 -2.88 115.11 119.06 3ihp h GLN 363 Ca 0.37 -0.05 0.00 0.00 0.06 0.00 0.00 58.65 59.03 3ihp h GLN 363 Cb 0.04 -0.19 0.00 0.00 0.30 0.00 0.00 27.48 27.63 3ihp h GLN 363 CO -0.13 0.55 0.00 0.09 -0.67 0.00 0.00 178.83 178.67 3ihp n ASN 364 N -4.67 0.96 -4.77 1.46 4.13 -0.50 -4.92 115.26 106.95 3ihp n ASN 364 Ca 0.09 -1.37 -0.39 0.00 1.68 0.00 0.00 54.58 54.59 3ihp n ASN 364 Cb 0.13 -0.01 -0.01 0.00 -1.54 0.00 0.00 39.78 38.35 3ihp n ASN 364 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3ihp s ALA 365 N -1.97 3.19 0.94 5.41 0.00 -0.74 -5.04 121.76 123.55 3ihp s ALA 365 Ca 0.39 1.15 -0.14 0.00 0.00 0.00 0.00 51.96 53.37 3ihp s ALA 365 Cb 0.20 -3.46 0.16 0.00 0.00 0.00 0.00 23.12 20.02 3ihp s ALA 365 CO 0.33 -0.76 1.16 -1.25 0.00 0.00 0.00 175.76 175.24 3ihp s PRO 366 N -2.31 0.88 0.26 0.00 0.04 -1.26 -4.95 135.00 127.66 3ihp s PRO 366 Ca 0.58 0.14 -0.08 0.00 0.04 0.00 0.00 61.00 61.68 3ihp s PRO 366 Cb -0.36 -1.82 0.42 0.00 0.04 0.00 0.00 34.50 32.78 3ihp s PRO 366 CO 0.45 -2.35 1.60 1.15 0.04 0.00 0.00 177.00 177.89 3ihp h THR 367 N -1.60 0.18 -3.14 1.26 2.02 -1.99 -3.16 112.91 106.47 3ihp h THR 367 Ca -0.49 -0.01 -0.74 0.00 0.77 0.00 0.00 66.41 65.94 3ihp h THR 367 Cb 1.31 0.16 -0.23 0.00 -1.74 0.00 0.00 68.15 67.66 3ihp h THR 367 CO 0.56 0.00 0.04 -0.62 0.37 0.00 0.00 175.52 175.87 3ihp s ASP 368 N -5.21 6.34 0.00 4.18 -1.08 -1.26 -4.92 116.67 114.72 3ihp s ASP 368 Ca -0.14 -1.89 0.29 0.00 -0.52 0.00 0.00 52.55 50.29 3ihp s ASP 368 Cb 0.24 -2.25 1.22 0.00 -1.46 0.00 0.00 42.92 40.67 3ihp s ASP 368 CO 0.76 -0.90 1.89 -2.65 0.52 0.00 0.00 175.17 174.80 3ihp n PRO 369 N 5.42 0.18 0.28 4.34 -0.02 -1.20 -3.21 135.00 140.79 3ihp n PRO 369 Ca -0.04 -0.03 0.17 0.00 -2.02 0.00 0.00 63.50 61.59 3ihp n PRO 369 Cb 0.43 -1.50 0.71 0.00 -0.02 0.00 0.00 33.50 33.12 3ihp n PRO 369 CO 0.00 0.00 0.00 1.79 1.98 0.00 0.00 175.50 179.27 3ihp h THR 370 N 0.06 0.00 -0.63 3.45 1.35 -1.91 -2.63 112.91 112.61 3ihp h THR 370 Ca 0.00 -0.47 0.00 0.00 -0.55 0.00 0.00 66.41 65.39 3ihp h THR 370 Cb 0.43 1.46 0.00 0.00 -1.73 0.00 0.00 68.15 68.31 3ihp h THR 370 CO 0.00 0.00 0.00 0.00 -0.25 0.00 0.00 175.52 175.27 3ihp n GLN 371 N -3.05 2.86 -3.84 4.72 3.00 -1.20 -4.86 117.38 115.01 3ihp n GLN 371 Ca 0.00 -2.54 -0.36 0.00 -0.01 0.00 0.00 57.00 54.10 3ihp n GLN 371 Cb 0.29 -1.53 -0.13 0.00 0.00 0.00 0.00 30.24 28.87 3ihp n GLN 371 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.06 177.40 3ihp s ASP 372 N -1.01 4.81 0.10 1.08 2.15 -0.99 -5.01 116.67 117.81 3ihp s ASP 372 Ca 0.43 -0.27 -0.34 0.00 0.43 0.00 0.00 52.55 52.80 3ihp s ASP 372 Cb 0.23 -1.85 -0.14 0.00 -0.30 0.00 0.00 42.92 40.86 3ihp s ASP 372 CO 0.28 -0.02 1.57 0.15 -0.17 0.00 0.00 175.17 176.98 3ihp h PHE 373 N 8.11 -1.43 -0.67 -5.34 3.57 -1.92 -1.53 116.94 117.73 3ihp h PHE 373 Ca -0.39 0.03 0.04 0.00 3.53 0.00 0.00 57.97 61.18 3ihp h PHE 373 Cb 1.17 0.60 -0.05 0.00 2.79 0.00 0.00 35.95 40.47 3ihp h PHE 373 CO 0.63 -0.60 0.41 0.77 -2.23 0.00 0.00 178.31 177.29 3ihp h SER 374 N -0.78 0.65 0.16 0.41 0.02 -1.96 -1.06 113.55 110.99 3ihp h SER 374 Ca -0.01 0.01 0.01 0.00 -0.84 0.00 0.00 61.79 60.96 3ihp h SER 374 Cb 0.77 -0.13 -0.02 0.00 0.14 0.00 0.00 62.40 63.16 3ihp h SER 374 CO -0.24 0.44 -0.19 0.74 -1.14 0.00 0.00 176.83 176.44 3ihp h THR 375 N 0.78 0.58 -0.11 -2.27 2.02 -1.82 0.29 112.91 112.39 3ihp h THR 375 Ca 0.28 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.46 3ihp h THR 375 Cb 0.06 0.58 -0.01 0.00 -1.74 0.00 0.00 68.15 67.05 3ihp h THR 375 CO -0.13 0.00 0.07 1.56 0.37 0.00 0.00 175.52 177.40 3ihp h GLN 376 N -0.40 0.15 -0.56 6.66 1.08 -0.74 0.17 115.11 121.48 3ihp h GLN 376 Ca 0.01 -0.01 0.06 0.00 -1.45 0.00 0.00 58.65 57.26 3ihp h GLN 376 Cb 0.39 -0.03 -0.06 0.00 -0.05 0.00 0.00 27.48 27.73 3ihp h GLN 376 CO -0.06 0.11 0.26 0.28 -0.95 0.00 0.00 178.83 178.47 3ihp h VAL 377 N 0.14 0.89 -0.22 -0.54 2.07 -1.13 -0.75 116.25 116.70 3ihp h VAL 377 Ca 0.04 -0.17 0.01 0.00 0.82 0.00 0.00 66.70 67.40 3ihp h VAL 377 Cb -0.00 0.36 -0.01 0.00 -1.52 0.00 0.00 31.29 30.11 3ihp h VAL 377 CO -0.01 0.09 0.13 0.00 0.02 0.00 0.00 177.57 177.80 3ihp h ALA 378 N 1.34 0.28 -0.49 1.67 0.00 -0.35 -1.53 119.26 120.18 3ihp h ALA 378 Ca 0.26 -0.01 0.07 0.00 0.00 0.00 0.00 54.91 55.24 3ihp h ALA 378 Cb 0.23 -0.07 -0.06 0.00 0.00 0.00 0.00 17.79 17.90 3ihp h ALA 378 CO -0.22 -0.27 0.16 -0.22 0.00 0.00 0.00 179.25 178.70 3ihp h LYS 379 N 0.27 0.31 0.18 0.00 3.64 -0.16 -0.25 116.57 120.57 3ihp h LYS 379 Ca 0.09 -0.02 0.01 0.00 -1.27 0.00 0.00 60.65 59.46 3ihp h LYS 379 Cb -0.01 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 31.72 3ihp h LYS 379 CO -0.04 0.21 -0.21 1.25 -2.27 0.00 0.00 179.45 178.39 3ihp h LEU 380 N 0.32 -0.58 -0.82 5.20 6.46 -0.87 -1.77 115.31 123.25 3ihp h LEU 380 Ca 0.24 0.06 0.04 0.00 -0.12 0.00 0.00 57.88 58.10 3ihp h LEU 380 Cb 0.27 0.21 -0.05 0.00 -0.73 0.00 0.00 40.66 40.36 3ihp h LEU 380 CO -0.26 -0.31 0.52 1.23 -0.62 0.00 0.00 178.44 179.00 3ihp h GLY 381 N -0.44 1.20 0.96 3.75 0.00 -0.86 -2.41 103.07 105.27 3ihp h GLY 381 Ca 0.01 -0.39 -0.00 0.00 0.00 0.00 0.00 47.33 46.95 3ihp h GLY 381 CO -0.07 0.32 0.08 0.84 0.00 0.00 0.00 176.54 177.71 3ihp h HIS 382 N 1.00 0.19 0.00 5.60 -0.00 -0.96 -1.85 115.15 119.12 3ihp h HIS 382 Ca 0.33 -0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.70 3ihp h HIS 382 Cb 0.05 -0.06 0.00 0.00 -0.00 0.00 0.00 27.41 27.40 3ihp h HIS 382 CO -0.03 0.17 0.00 0.41 -0.00 0.00 0.00 177.93 178.48 3ihp n GLY 383 N -0.99 -0.55 0.03 5.26 0.00 -0.68 -2.07 105.19 106.19 3ihp n GLY 383 Ca -0.05 -0.02 0.02 0.00 0.00 0.00 0.00 46.02 45.97 3ihp n GLY 383 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3ihp n LEU 384 N -1.41 0.00 -0.58 0.99 4.77 -0.79 -4.64 117.00 115.34 3ihp n LEU 384 Ca 0.01 0.00 0.06 0.00 -0.03 0.00 0.00 56.01 56.05 3ihp n LEU 384 Cb 0.04 0.14 0.11 0.00 -2.33 0.00 0.00 43.42 41.38 3ihp n LEU 384 CO 0.03 0.14 0.54 0.18 -1.33 0.00 0.00 177.39 176.96 3ihp n LEU 385 N -2.22 2.51 0.00 2.23 4.77 -0.77 -1.67 117.00 121.84 3ihp n LEU 385 Ca -0.11 -1.51 0.00 0.00 -0.03 0.00 0.00 56.01 54.36 3ihp n LEU 385 Cb 0.62 -0.13 0.00 0.00 -2.33 0.00 0.00 43.42 41.58 3ihp n LEU 385 CO 0.31 0.57 0.00 -1.54 -1.33 0.00 0.00 177.39 175.39 3ihp n SER 386 N 0.63 0.00 -3.91 -1.43 3.41 -0.96 -3.99 113.62 107.38 3ihp n SER 386 Ca 0.10 0.00 -0.28 0.00 -0.26 0.00 0.00 58.87 58.43 3ihp n SER 386 Cb 0.37 0.00 -0.17 0.00 -0.26 0.00 0.00 64.21 64.15 3ihp n SER 386 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 3ihp s GLY 387 N 0.00 0.91 0.00 5.00 0.00 -1.26 -2.55 107.32 109.42 3ihp s GLY 387 Ca 0.00 -0.71 0.00 0.00 0.00 0.00 0.00 44.72 44.01 3ihp s GLY 387 CO 0.00 0.85 0.00 -2.21 0.00 0.00 0.00 173.10 171.74 3ihp n GLU 388 N 4.90 0.00 0.00 2.90 2.13 -1.26 -5.10 120.64 124.21 3ihp n GLU 388 Ca -0.13 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.69 3ihp n GLU 388 Cb 0.49 0.00 0.00 0.00 0.27 0.00 0.00 31.44 32.20 3ihp n GLU 388 CO 0.00 0.00 0.00 -0.40 -0.41 0.00 0.00 177.13 176.32 3ihp n ASP 410 N 0.00 0.00 0.00 4.31 5.68 -1.26 -4.84 116.55 120.44 3ihp n ASP 410 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.29 3ihp n ASP 410 Cb 0.00 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 39.98 3ihp n ASP 410 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3ihp n GLY 411 N 0.00 -2.14 3.35 6.12 0.00 -1.26 -4.82 105.19 106.43 3ihp n GLY 411 Ca 0.00 -1.47 -0.26 0.00 0.00 0.00 0.00 46.02 44.29 3ihp n GLY 411 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3ihp s ILE 412 N -0.20 2.03 -0.45 -0.61 -4.36 -0.68 -4.92 121.20 112.02 3ihp s ILE 412 Ca 0.00 -1.71 0.01 0.00 -0.26 0.00 0.00 60.65 58.69 3ihp s ILE 412 Cb 0.00 -1.83 0.12 0.00 1.25 0.00 0.00 42.46 42.00 3ihp s ILE 412 CO 0.00 -0.01 0.21 0.00 0.24 0.00 0.00 174.94 175.38 3ihp s ALA 413 N -1.21 3.18 -0.13 2.27 0.00 -1.26 -0.43 121.76 124.19 3ihp s ALA 413 Ca 0.12 -2.81 -0.06 0.00 0.00 0.00 0.00 51.96 49.21 3ihp s ALA 413 Cb -0.10 -2.27 -0.25 0.00 0.00 0.00 0.00 23.12 20.50 3ihp s ALA 413 CO 0.06 -1.86 3.57 -0.35 0.00 0.00 0.00 175.76 177.17 3ihp n PRO 414 N 4.01 2.13 -0.25 0.00 -0.04 -1.26 -4.57 135.00 135.02 3ihp n PRO 414 Ca 0.03 -1.09 0.01 0.00 -0.04 0.00 0.00 63.50 62.41 3ihp n PRO 414 Cb 0.39 -2.06 0.13 0.00 -0.04 0.00 0.00 33.50 31.92 3ihp n PRO 414 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3ihp h ARG 415 N 3.17 0.62 -0.31 0.54 3.08 -1.97 -1.07 114.38 118.43 3ihp h ARG 415 Ca 0.24 -0.04 -0.04 0.00 0.07 0.00 0.00 59.98 60.21 3ihp h ARG 415 Cb 1.42 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 31.32 3ihp h ARG 415 CO 0.35 0.41 0.03 1.98 -1.07 0.00 0.00 179.97 181.67 3ihp h MET 416 N 0.63 0.53 0.19 0.04 4.05 -1.98 0.77 114.93 119.16 3ihp h MET 416 Ca 0.34 -0.15 -0.01 0.00 -0.28 0.00 0.00 59.70 59.60 3ihp h MET 416 Cb 0.33 -0.06 0.00 0.00 -0.80 0.00 0.00 31.60 31.08 3ihp h MET 416 CO -0.25 0.64 -0.09 0.35 0.23 0.00 0.00 176.91 177.79 3ihp h PHE 417 N 0.34 -0.24 -0.86 1.39 3.57 -1.89 -2.39 116.94 116.86 3ihp h PHE 417 Ca 0.09 -0.01 0.17 0.00 3.53 0.00 0.00 57.97 61.75 3ihp h PHE 417 Cb 0.38 0.08 -0.07 0.00 2.79 0.00 0.00 35.95 39.13 3ihp h PHE 417 CO 0.03 0.08 0.57 -0.22 -2.23 0.00 0.00 178.31 176.54 3ihp h LYS 418 N -0.57 0.51 -0.17 1.11 3.64 -1.14 -0.29 116.57 119.66 3ihp h LYS 418 Ca -0.03 -0.03 -0.20 0.00 -1.27 0.00 0.00 60.65 59.12 3ihp h LYS 418 Cb 0.42 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.13 3ihp h LYS 418 CO 0.04 0.34 -0.71 0.00 -2.27 0.00 0.00 179.45 176.85 3ihp h ALA 419 N 1.62 0.43 -0.00 5.00 0.00 -0.73 -2.94 119.26 122.63 3ihp h ALA 419 Ca 0.44 -0.58 -0.09 0.00 0.00 0.00 0.00 54.91 54.68 3ihp h ALA 419 Cb 0.92 -0.04 0.01 0.00 0.00 0.00 0.00 17.79 18.68 3ihp h ALA 419 CO -0.18 0.70 -0.36 1.25 0.00 0.00 0.00 179.25 180.65 3ihp h LEU 420 N 0.51 0.32 0.00 0.00 5.85 -0.73 -2.92 115.31 118.34 3ihp h LEU 420 Ca -0.03 -0.77 0.00 0.00 0.84 0.00 0.00 57.88 57.92 3ihp h LEU 420 Cb 1.32 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 42.25 3ihp h LEU 420 CO 0.14 1.05 0.00 2.30 -0.34 0.00 0.00 178.44 181.59 3ihp n ILE 421 N -4.41 0.13 1.02 4.05 -0.00 -0.23 -2.29 119.36 117.63 3ihp n ILE 421 Ca -0.10 0.03 0.11 0.00 -0.00 0.00 0.00 62.75 62.79 3ihp n ILE 421 Cb 0.56 -0.58 0.00 0.00 -0.00 0.00 0.00 39.64 39.63 3ihp n ILE 421 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 176.55 177.16 3ihp n GLY 422 N 1.14 -0.33 3.68 3.28 0.00 -1.11 -4.92 105.19 106.94 3ihp n GLY 422 Ca 0.10 -0.60 -0.44 0.00 0.00 0.00 0.00 46.02 45.08 3ihp n GLY 422 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 3ihp n LYS 423 N -0.51 2.56 -0.35 1.61 4.81 -0.97 -1.45 118.16 123.86 3ihp n LYS 423 Ca 0.08 0.93 0.00 0.00 -0.87 0.00 0.00 58.31 58.45 3ihp n LYS 423 Cb 0.42 -2.80 0.00 0.00 0.02 0.00 0.00 35.03 32.67 3ihp n LYS 423 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3ihp n GLY 424 N 4.13 2.23 3.74 3.14 0.00 -1.26 -5.00 105.19 112.17 3ihp n GLY 424 Ca 0.19 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.81 3ihp n GLY 424 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 3ihp s HIS 425 N -3.30 3.73 0.38 1.61 2.46 -0.53 -4.98 115.29 114.66 3ihp s HIS 425 Ca 0.00 1.54 0.05 0.00 0.47 0.00 0.00 55.06 57.12 3ihp s HIS 425 Cb 0.00 -2.89 0.74 0.00 -0.13 0.00 0.00 32.58 30.30 3ihp s HIS 425 CO 0.00 0.22 2.03 -1.35 -2.47 0.00 0.00 174.74 173.17 3ihp h PRO 426 N 5.84 0.67 0.00 2.88 0.11 -1.94 -2.99 132.00 136.57 3ihp h PRO 426 Ca -0.43 -0.05 -0.39 0.00 0.11 0.00 0.00 66.00 65.24 3ihp h PRO 426 Cb 1.21 -0.15 -0.06 0.00 0.11 0.00 0.00 31.00 32.11 3ihp h PRO 426 CO 0.72 0.46 -2.18 0.39 -0.21 0.00 0.00 178.00 177.17 3ihp n GLU 427 N -4.45 0.58 -0.00 1.05 -0.58 -1.26 -4.56 120.64 111.42 3ihp n GLU 427 Ca 0.04 0.34 0.13 0.00 -0.42 0.00 0.00 57.16 57.25 3ihp n GLU 427 Cb 0.06 -1.55 0.75 0.00 -0.57 0.00 0.00 31.44 30.13 3ihp n GLU 427 CO 0.00 0.00 0.00 1.19 -0.48 0.00 0.00 177.13 177.84 3ihp n PHE 428 N -4.30 0.00 0.07 -0.32 3.72 -1.25 -2.13 117.46 113.25 3ihp n PHE 428 Ca -0.48 -0.00 0.08 0.00 -0.05 0.00 0.00 57.45 57.00 3ihp n PHE 428 Cb 0.82 0.00 -0.04 0.00 -0.94 0.00 0.00 39.48 39.32 3ihp n PHE 428 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 3ihp n SER 429 N -0.85 0.75 -3.69 4.37 3.41 -1.13 -4.33 113.62 112.15 3ihp n SER 429 Ca 0.19 0.30 -0.24 0.00 -0.26 0.00 0.00 58.87 58.87 3ihp n SER 429 Cb 0.10 0.55 0.16 0.00 -0.26 0.00 0.00 64.21 64.76 3ihp n SER 429 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 3ihp n THR 430 N -2.69 0.00 -1.08 6.66 -2.24 -0.91 -5.03 114.28 109.00 3ihp n THR 430 Ca -0.03 -0.91 0.09 0.00 -2.27 0.00 0.00 64.05 60.93 3ihp n THR 430 Cb 0.63 -1.48 0.19 0.00 -2.10 0.00 0.00 70.33 67.56 3ihp n THR 430 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 3ihp n ASN 431 N -3.59 2.90 -4.91 3.42 6.94 -1.26 -5.05 115.26 113.71 3ihp n ASN 431 Ca 0.14 -3.12 -0.22 0.00 -0.02 0.00 0.00 54.58 51.36 3ihp n ASN 431 Cb 0.49 -0.49 0.05 0.00 -2.36 0.00 0.00 39.78 37.48 3ihp n ASN 431 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 3ihp s ARG 432 N -2.89 2.33 0.36 -3.83 1.70 -1.26 -4.48 118.95 110.87 3ihp s ARG 432 Ca 0.37 -0.84 -0.27 0.00 -0.47 0.00 0.00 55.73 54.51 3ihp s ARG 432 Cb 0.31 -2.44 -0.09 0.00 -0.57 0.00 0.00 34.95 32.16 3ihp s ARG 432 CO 0.05 -0.90 1.20 -0.65 -1.08 0.00 0.00 175.30 173.91 3ihp s GLN 433 N -4.87 4.25 0.08 3.89 -0.21 -1.26 -4.92 119.66 116.62 3ihp s GLN 433 Ca 0.59 1.96 0.01 0.00 0.02 0.00 0.00 55.36 57.94 3ihp s GLN 433 Cb -0.09 -2.89 -0.04 0.00 1.00 0.00 0.00 33.01 30.98 3ihp s GLN 433 CO 0.40 -0.19 -0.06 -0.65 -2.12 0.00 0.00 175.29 172.68 3ihp s GLN 434 N -1.98 0.77 0.11 2.91 -1.52 -1.26 -5.07 119.66 113.62 3ihp s GLN 434 Ca 0.52 -1.28 -0.28 0.00 -1.95 0.00 0.00 55.36 52.37 3ihp s GLN 434 Cb -0.34 -0.11 -0.06 0.00 -0.22 0.00 0.00 33.01 32.28 3ihp s GLN 434 CO 0.44 -0.04 0.88 0.34 -0.25 0.00 0.00 175.29 176.66 3ihp s ASP 435 N -2.96 7.42 0.16 5.90 2.15 -1.26 -4.82 116.67 123.26 3ihp s ASP 435 Ca 0.10 1.69 -0.15 0.00 0.43 0.00 0.00 52.55 54.62 3ihp s ASP 435 Cb 0.05 -2.54 0.03 0.00 -0.30 0.00 0.00 42.92 40.16 3ihp s ASP 435 CO -0.06 0.02 1.80 0.00 -0.17 0.00 0.00 175.17 176.76 3ihp h ALA 436 N 5.30 0.58 -0.72 3.66 0.00 -2.00 -1.84 119.26 124.25 3ihp h ALA 436 Ca -0.44 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.39 3ihp h ALA 436 Cb 1.21 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.78 3ihp h ALA 436 CO 0.70 0.07 0.36 0.37 0.00 0.00 0.00 179.25 180.75 3ihp h GLN 437 N 0.61 1.03 -0.53 0.00 -0.00 -1.98 -0.42 115.11 113.83 3ihp h GLN 437 Ca 0.17 -0.15 -0.03 0.00 -0.00 0.00 0.00 58.65 58.64 3ihp h GLN 437 Cb -0.02 -0.19 -0.02 0.00 0.00 0.00 0.00 27.48 27.25 3ihp h GLN 437 CO -0.03 0.80 0.22 1.49 0.00 0.00 0.00 178.83 181.31 3ihp h GLU 438 N 1.01 0.79 -0.42 1.69 4.81 -1.94 -1.23 114.58 119.30 3ihp h GLU 438 Ca 0.25 -0.14 -0.03 0.00 -0.13 0.00 0.00 59.36 59.31 3ihp h GLU 438 Cb 0.10 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 29.33 3ihp h GLU 438 CO -0.03 0.69 0.15 0.35 -0.73 0.00 0.00 179.01 179.44 3ihp h PHE 439 N 0.72 0.66 -0.06 0.92 3.57 -0.95 -1.75 116.94 120.05 3ihp h PHE 439 Ca 0.18 -0.06 0.04 0.00 3.53 0.00 0.00 57.97 61.66 3ihp h PHE 439 Cb 0.19 -0.19 -0.05 0.00 2.79 0.00 0.00 35.95 38.69 3ihp h PHE 439 CO 0.00 0.59 -0.20 0.35 -2.23 0.00 0.00 178.31 176.82 3ihp h PHE 440 N 0.54 -0.53 0.00 0.41 3.57 -0.79 -0.09 116.94 120.04 3ihp h PHE 440 Ca 0.14 0.02 -0.05 0.00 3.53 0.00 0.00 57.97 61.61 3ihp h PHE 440 Cb 0.22 0.25 -0.01 0.00 2.79 0.00 0.00 35.95 39.20 3ihp h PHE 440 CO 0.01 -0.28 -0.25 -0.07 -2.23 0.00 0.00 178.31 175.48 3ihp h LEU 441 N -0.29 0.00 -0.07 0.59 3.38 -1.16 0.56 115.31 118.32 3ihp h LEU 441 Ca 0.08 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.03 3ihp h LEU 441 Cb 0.40 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.15 3ihp h LEU 441 CO -0.23 0.25 -0.02 -0.74 0.09 0.00 0.00 178.44 177.79 3ihp h HIS 442 N 0.00 0.16 -0.55 1.13 2.76 -0.31 -0.76 115.15 117.58 3ihp h HIS 442 Ca -0.00 -0.03 -0.07 0.00 -2.20 0.00 0.00 60.37 58.06 3ihp h HIS 442 Cb 0.46 -0.04 -0.02 0.00 1.55 0.00 0.00 27.41 29.36 3ihp h HIS 442 CO 0.00 0.47 0.07 1.25 -1.30 0.00 0.00 177.93 178.42 3ihp h LEU 443 N -0.20 0.89 -0.47 0.26 5.85 -0.71 -1.41 115.31 119.52 3ihp h LEU 443 Ca 0.02 -0.27 0.06 0.00 0.84 0.00 0.00 57.88 58.53 3ihp h LEU 443 Cb 0.42 -0.24 -0.05 0.00 0.37 0.00 0.00 40.66 41.15 3ihp h LEU 443 CO 0.01 0.94 0.17 0.40 -0.34 0.00 0.00 178.44 179.61 3ihp h ILE 444 N 0.81 0.84 -0.59 4.05 1.08 -0.87 0.11 117.51 122.94 3ihp h ILE 444 Ca 0.17 -0.12 -0.04 0.00 -0.39 0.00 0.00 64.86 64.48 3ihp h ILE 444 Cb 0.43 0.47 -0.03 0.00 -3.07 0.00 0.00 36.82 34.63 3ihp h ILE 444 CO 0.01 0.06 0.21 -1.13 -0.69 0.00 0.00 178.15 176.61 3ihp h ASN 445 N 0.34 0.81 -0.25 1.72 -1.24 -0.92 -1.51 115.58 114.53 3ihp h ASN 445 Ca 0.22 -0.12 -0.08 0.00 0.71 0.00 0.00 56.30 57.03 3ihp h ASN 445 Cb 0.23 -0.21 -0.01 0.00 0.73 0.00 0.00 38.32 39.07 3ihp h ASN 445 CO -0.23 0.75 -0.18 -0.03 -1.29 0.00 0.00 177.43 176.45 3ihp h MET 446 N 0.86 0.56 -0.69 6.67 4.05 -0.58 -1.55 114.93 124.26 3ihp h MET 446 Ca 0.20 -0.27 0.08 0.00 -0.28 0.00 0.00 59.70 59.43 3ihp h MET 446 Cb 0.22 -0.00 -0.06 0.00 -0.80 0.00 0.00 31.60 30.95 3ihp h MET 446 CO -0.01 0.85 0.35 0.28 0.23 0.00 0.00 176.91 178.61 3ihp h VAL 447 N 0.28 0.89 -0.51 -5.77 2.07 -0.65 -2.59 116.25 109.97 3ihp h VAL 447 Ca 0.05 -0.21 0.04 0.00 0.82 0.00 0.00 66.70 67.40 3ihp h VAL 447 Cb 0.71 0.21 -0.04 0.00 -1.52 0.00 0.00 31.29 30.65 3ihp h VAL 447 CO 0.05 0.11 0.27 -0.08 0.02 0.00 0.00 177.57 177.94 3ihp h GLU 448 N 0.62 0.51 -0.01 1.57 4.57 -0.96 -1.51 114.58 119.38 3ihp h GLU 448 Ca 0.33 -0.03 -0.01 0.00 -1.18 0.00 0.00 59.36 58.47 3ihp h GLU 448 Cb 0.30 -0.12 -0.00 0.00 -0.16 0.00 0.00 28.75 28.77 3ihp h GLU 448 CO -0.24 0.34 -0.05 0.00 -1.18 0.00 0.00 179.01 177.88 3ihp h ARG 449 N 0.53 0.02 -0.49 1.92 3.08 -0.92 -2.90 114.38 115.61 3ihp h ARG 449 Ca 0.22 -0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.27 3ihp h ARG 449 Cb 0.11 -0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.16 3ihp h ARG 449 CO -0.15 0.07 0.00 0.09 -1.07 0.00 0.00 179.97 178.91 3ihp n ASN 450 N -4.47 3.45 -0.12 7.04 3.02 -0.67 -4.43 115.26 119.07 3ihp n ASN 450 Ca -0.03 -1.96 0.03 0.00 -0.03 0.00 0.00 54.58 52.59 3ihp n ASN 450 Cb 0.14 -0.33 0.04 0.00 -0.61 0.00 0.00 39.78 39.02 3ihp n ASN 450 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3ihp s ARG 452 N -1.21 4.14 -1.17 0.00 6.06 -1.22 -2.56 118.95 122.98 3ihp s ARG 452 Ca 0.10 2.53 -0.11 0.00 -2.50 0.00 0.00 55.73 55.75 3ihp s ARG 452 Cb 0.09 -3.00 0.02 0.00 0.06 0.00 0.00 34.95 32.12 3ihp s ARG 452 CO 0.01 -0.52 0.21 0.43 -2.50 0.00 0.00 175.30 172.93 3ihp n SER 453 N 1.01 -0.78 -3.26 -2.12 7.64 -1.26 -4.85 113.62 110.00 3ihp n SER 453 Ca 0.03 -1.06 -0.07 0.00 1.01 0.00 0.00 58.87 58.77 3ihp n SER 453 Cb 0.39 -1.30 0.01 0.00 -1.01 0.00 0.00 64.21 62.30 3ihp n SER 453 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 3ihp s SER 454 N -4.01 -0.07 -0.36 6.43 1.04 -1.06 -5.10 113.70 110.58 3ihp s SER 454 Ca 0.16 -0.91 -0.42 0.00 0.48 0.00 0.00 55.95 55.26 3ihp s SER 454 Cb -0.09 0.75 -0.17 0.00 0.10 0.00 0.00 66.02 66.62 3ihp s SER 454 CO 0.82 -1.47 1.76 -0.62 0.98 0.00 0.00 173.24 174.71 3ihp n GLU 455 N -0.53 0.79 -3.96 4.02 4.71 -1.26 -4.93 120.64 119.48 3ihp n GLU 455 Ca -0.07 0.28 -0.34 0.00 -0.01 0.00 0.00 57.16 57.03 3ihp n GLU 455 Cb 0.60 -1.94 -0.14 0.00 -1.01 0.00 0.00 31.44 28.95 3ihp n GLU 455 CO 0.00 0.00 0.00 1.21 0.09 0.00 0.00 177.13 178.43 3ihp s ASN 456 N 3.81 4.78 0.51 1.62 3.84 -1.26 -4.85 114.94 123.38 3ihp s ASN 456 Ca 1.02 -1.50 0.30 0.00 0.21 0.00 0.00 52.86 52.89 3ihp s ASN 456 Cb -1.19 -1.67 1.07 0.00 -0.55 0.00 0.00 41.25 38.91 3ihp s ASN 456 CO 0.69 -0.28 1.87 1.55 -2.79 0.00 0.00 177.10 178.14 3ihp h PRO 457 N 7.89 0.00 -0.32 0.43 0.13 -1.92 -2.63 132.00 135.57 3ihp h PRO 457 Ca -0.17 0.00 0.09 0.00 -0.87 0.00 0.00 66.00 65.05 3ihp h PRO 457 Cb 1.05 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.17 3ihp h PRO 457 CO 0.53 0.00 0.39 -0.91 -0.23 0.00 0.00 178.00 177.77 3ihp h ASN 458 N 0.00 0.00 -0.08 1.44 2.35 -1.95 -1.66 115.58 115.69 3ihp h ASN 458 Ca 0.00 0.00 0.02 0.00 -0.55 0.00 0.00 56.30 55.77 3ihp h ASN 458 Cb 0.64 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 39.01 3ihp h ASN 458 CO 0.00 0.00 0.28 -0.33 -1.65 0.00 0.00 177.43 175.73 3ihp h GLU 459 N 0.00 0.00 0.00 0.81 5.08 -1.84 0.40 114.58 119.03 3ihp h GLU 459 Ca 0.15 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.48 3ihp h GLU 459 Cb 0.93 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.17 3ihp h GLU 459 CO -0.00 0.00 -0.14 -0.24 -1.00 0.00 0.00 179.01 177.62 3ihp h VAL 460 N 0.00 0.30 0.00 3.13 3.04 -1.55 -3.29 116.25 117.88 3ihp h VAL 460 Ca 0.04 -1.08 -0.34 0.00 -1.01 0.00 0.00 66.70 64.30 3ihp h VAL 460 Cb 0.60 1.86 -0.06 0.00 -2.01 0.00 0.00 31.29 31.67 3ihp h VAL 460 CO -0.00 0.14 -2.29 0.49 -1.01 0.00 0.00 177.57 174.90 3ihp n PHE 461 N -3.21 0.00 -1.72 3.17 3.72 0.02 -1.14 117.46 118.31 3ihp n PHE 461 Ca 0.02 0.00 -0.43 0.00 -0.05 0.00 0.00 57.45 56.99 3ihp n PHE 461 Cb 0.47 -0.87 -0.01 0.00 -0.94 0.00 0.00 39.48 38.12 3ihp n PHE 461 CO 0.00 0.00 0.00 -2.13 -0.05 0.00 0.00 176.76 174.58 3ihp n ARG 462 N -3.13 2.32 -4.06 -1.08 0.63 -0.54 -4.71 116.66 106.09 3ihp n ARG 462 Ca -0.40 0.82 -0.10 0.00 -0.92 0.00 0.00 57.85 57.25 3ihp n ARG 462 Cb 0.94 -2.49 -0.07 0.00 0.45 0.00 0.00 32.46 31.29 3ihp n ARG 462 CO 0.00 0.00 0.00 -0.59 -2.51 0.00 0.00 177.63 174.53 3ihp s PHE 463 N -0.62 0.63 -0.23 -0.14 -0.12 -0.11 -4.55 117.98 112.83 3ihp s PHE 463 Ca 0.60 -0.94 -0.08 0.00 -0.05 0.00 0.00 56.93 56.45 3ihp s PHE 463 Cb -0.56 -0.09 -0.04 0.00 -0.63 0.00 0.00 43.02 41.70 3ihp s PHE 463 CO 0.57 -0.83 0.10 -0.51 -0.05 0.00 0.00 175.22 174.49 3ihp s LEU 464 N -3.06 3.71 -0.11 -1.99 1.02 -1.26 -0.65 118.68 116.35 3ihp s LEU 464 Ca 0.27 -0.06 -0.16 0.00 0.02 0.00 0.00 54.13 54.20 3ihp s LEU 464 Cb 0.02 -1.99 -0.05 0.00 0.02 0.00 0.00 46.19 44.20 3ihp s LEU 464 CO 0.08 0.04 0.40 -0.69 0.02 0.00 0.00 176.35 176.20 3ihp s VAL 465 N 1.21 5.20 -0.31 -1.59 1.01 0.98 0.17 120.40 127.07 3ihp s VAL 465 Ca 0.05 0.79 -0.14 0.00 0.00 0.00 0.00 61.98 62.69 3ihp s VAL 465 Cb -0.14 -3.73 -0.03 0.00 0.00 0.00 0.00 36.38 32.48 3ihp s VAL 465 CO 0.04 0.39 0.33 -0.70 0.00 0.00 0.00 175.10 175.16 3ihp s GLU 466 N 0.26 3.77 -0.19 2.72 2.12 -0.31 -1.69 118.70 125.37 3ihp s GLU 466 Ca 0.22 -0.27 -0.09 0.00 0.36 0.00 0.00 54.97 55.20 3ihp s GLU 466 Cb -0.15 -3.73 -0.04 0.00 0.26 0.00 0.00 34.13 30.46 3ihp s GLU 466 CO 0.09 -0.38 0.09 -2.00 -0.54 0.00 0.00 175.26 172.51 3ihp s GLU 467 N 1.97 4.06 -0.13 4.30 2.56 -0.73 -1.51 118.70 129.22 3ihp s GLU 467 Ca 0.12 -0.28 0.03 0.00 0.00 0.00 0.00 54.97 54.83 3ihp s GLU 467 Cb -0.16 -3.30 0.01 0.00 2.00 0.00 0.00 34.13 32.67 3ihp s GLU 467 CO 0.11 0.30 -0.22 0.21 -0.56 0.00 0.00 175.26 175.10 3ihp s LYS 468 N 0.32 3.04 -0.01 4.30 2.20 -0.82 -0.74 119.74 128.03 3ihp s LYS 468 Ca 0.06 -0.85 -0.03 0.00 -0.36 0.00 0.00 55.97 54.78 3ihp s LYS 468 Cb -0.12 -2.42 -0.04 0.00 -1.51 0.00 0.00 37.83 33.75 3ihp s LYS 468 CO -0.01 0.03 0.19 0.42 -0.36 0.00 0.00 175.35 175.62 3ihp s ILE 469 N 0.71 5.43 -0.08 5.43 1.01 -0.21 -1.35 121.20 132.13 3ihp s ILE 469 Ca -0.10 -0.12 -0.01 0.00 0.00 0.00 0.00 60.65 60.42 3ihp s ILE 469 Cb -0.16 -3.54 0.03 0.00 0.01 0.00 0.00 42.46 38.80 3ihp s ILE 469 CO 0.01 0.34 0.00 -0.75 0.00 0.00 0.00 174.94 174.53 3ihp s LYS 470 N -1.90 0.65 -0.31 2.79 2.20 -0.36 -1.68 119.74 121.13 3ihp s LYS 470 Ca 0.27 0.06 -0.29 0.00 -0.36 0.00 0.00 55.97 55.65 3ihp s LYS 470 Cb -0.13 -1.08 -0.02 0.00 -1.51 0.00 0.00 37.83 35.10 3ihp s LYS 470 CO 0.18 -0.33 1.74 0.00 -0.36 0.00 0.00 175.35 176.59 3ihp h LEU 472 N 13.22 0.60 -0.49 0.00 5.85 -1.80 0.27 115.31 132.95 3ihp h LEU 472 Ca -0.33 -0.13 -0.08 0.00 0.84 0.00 0.00 57.88 58.18 3ihp h LEU 472 Cb 1.16 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 42.02 3ihp h LEU 472 CO 1.03 0.69 0.01 0.00 -0.34 0.00 0.00 178.44 179.83 3ihp h ALA 473 N 1.38 0.66 0.00 1.25 0.00 -1.90 -3.29 119.26 117.37 3ihp h ALA 473 Ca 0.12 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.75 3ihp h ALA 473 Cb 0.41 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.02 3ihp h ALA 473 CO 0.02 0.46 -0.98 0.25 0.00 0.00 0.00 179.25 179.00 3ihp n THR 474 N -4.34 0.00 -1.20 0.00 -2.24 -1.08 -4.97 114.28 100.44 3ihp n THR 474 Ca 0.01 -0.08 -0.07 0.00 -2.27 0.00 0.00 64.05 61.64 3ihp n THR 474 Cb 0.30 0.93 -0.03 0.00 -2.10 0.00 0.00 70.33 69.44 3ihp n THR 474 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3ihp n GLU 475 N -1.50 -1.18 -2.99 -0.78 1.02 0.93 -5.01 120.64 111.12 3ihp n GLU 475 Ca 0.03 0.66 -0.32 0.00 -0.02 0.00 0.00 57.16 57.51 3ihp n GLU 475 Cb 0.31 -4.72 -0.05 0.00 -0.02 0.00 0.00 31.44 26.96 3ihp n GLU 475 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 3ihp s LYS 476 N -2.26 3.98 0.19 3.49 1.02 -1.20 -4.65 119.74 120.31 3ihp s LYS 476 Ca 0.00 0.70 0.08 0.00 0.02 0.00 0.00 55.97 56.77 3ihp s LYS 476 Cb 0.00 -2.37 -0.04 0.00 -0.52 0.00 0.00 37.83 34.89 3ihp s LYS 476 CO 0.00 0.07 -0.16 0.14 -0.92 0.00 0.00 175.35 174.47 3ihp s VAL 477 N -2.13 1.79 -0.04 3.17 -7.23 -0.13 -0.48 120.40 115.34 3ihp s VAL 477 Ca 0.55 -2.06 -0.02 0.00 -1.81 0.00 0.00 61.98 58.64 3ihp s VAL 477 Cb -0.10 -1.94 0.03 0.00 0.56 0.00 0.00 36.38 34.93 3ihp s VAL 477 CO 0.21 -0.45 0.09 -0.75 -0.31 0.00 0.00 175.10 173.88 3ihp s LYS 478 N -3.21 0.04 -0.21 4.82 2.20 -0.67 -0.84 119.74 121.87 3ihp s LYS 478 Ca 0.19 0.26 -0.08 0.00 -0.36 0.00 0.00 55.97 55.98 3ihp s LYS 478 Cb -0.03 -0.17 -0.04 0.00 -1.51 0.00 0.00 37.83 36.07 3ihp s LYS 478 CO 0.07 -0.14 0.08 0.71 -0.36 0.00 0.00 175.35 175.71 3ihp s TYR 479 N 0.97 3.20 0.33 4.03 2.02 -1.26 -1.05 117.35 125.59 3ihp s TYR 479 Ca -0.08 -0.04 0.08 0.00 -0.37 0.00 0.00 57.07 56.66 3ihp s TYR 479 Cb -0.10 -2.16 -0.04 0.00 -0.40 0.00 0.00 41.96 39.25 3ihp s TYR 479 CO -0.04 -0.02 0.10 0.99 -1.57 0.00 0.00 175.55 175.02 3ihp s THR 480 N 0.87 3.03 -0.02 -0.71 2.01 0.08 -4.99 115.64 115.90 3ihp s THR 480 Ca 0.04 -1.76 -0.04 0.00 0.31 0.00 0.00 61.69 60.24 3ihp s THR 480 Cb -0.14 -2.94 0.00 0.00 0.01 0.00 0.00 72.50 69.44 3ihp s THR 480 CO 0.03 -0.21 0.09 -1.58 -0.69 0.00 0.00 174.62 172.26 3ihp s GLN 481 N -3.80 0.23 0.04 4.92 0.74 -1.26 -1.77 119.66 118.75 3ihp s GLN 481 Ca 0.36 -0.09 -0.15 0.00 0.05 0.00 0.00 55.36 55.54 3ihp s GLN 481 Cb -0.03 0.10 0.02 0.00 1.10 0.00 0.00 33.01 34.20 3ihp s GLN 481 CO 0.22 -0.04 0.32 -0.98 -0.55 0.00 0.00 175.29 174.26 3ihp s ARG 482 N -0.48 0.82 0.53 1.67 1.70 -0.68 -4.99 118.95 117.53 3ihp s ARG 482 Ca -0.05 -0.46 -0.18 0.00 -0.47 0.00 0.00 55.73 54.57 3ihp s ARG 482 Cb -0.04 0.36 -0.06 0.00 -0.57 0.00 0.00 34.95 34.64 3ihp s ARG 482 CO 0.00 -0.26 1.03 0.08 -1.08 0.00 0.00 175.30 175.07 3ihp s VAL 483 N -2.46 3.99 0.22 4.99 1.01 -1.26 -0.01 120.40 126.87 3ihp s VAL 483 Ca -0.06 1.05 -0.22 0.00 0.00 0.00 0.00 61.98 62.75 3ihp s VAL 483 Cb -0.01 -3.48 0.04 0.00 0.00 0.00 0.00 36.38 32.93 3ihp s VAL 483 CO -0.03 -0.45 0.69 -0.62 0.00 0.00 0.00 175.10 174.70 3ihp s ASP 484 N -2.57 -0.37 -0.01 3.32 -1.08 0.18 -4.81 116.67 111.33 3ihp s ASP 484 Ca 0.64 -0.36 0.01 0.00 -0.52 0.00 0.00 52.55 52.31 3ihp s ASP 484 Cb -0.14 0.66 -0.01 0.00 -1.46 0.00 0.00 42.92 41.96 3ihp s ASP 484 CO 0.29 -1.17 0.01 -1.22 0.52 0.00 0.00 175.17 173.60 3ihp n TYR 485 N -0.43 0.00 -4.62 -5.34 4.01 -1.26 -0.93 117.16 108.59 3ihp n TYR 485 Ca -0.09 0.00 -0.25 0.00 -0.16 0.00 0.00 57.90 57.40 3ihp n TYR 485 Cb 0.61 -0.05 -0.17 0.00 -0.31 0.00 0.00 39.34 39.43 3ihp n TYR 485 CO 0.00 0.00 0.00 0.96 -0.46 0.00 0.00 176.86 177.36 3ihp s ILE 486 N -2.04 1.19 -0.08 -0.72 -4.36 -1.26 -4.15 121.20 109.78 3ihp s ILE 486 Ca -0.01 -0.51 -0.21 0.00 -0.26 0.00 0.00 60.65 59.66 3ihp s ILE 486 Cb 0.00 -1.08 -0.04 0.00 1.25 0.00 0.00 42.46 42.59 3ihp s ILE 486 CO 0.05 0.37 0.61 0.00 0.24 0.00 0.00 174.94 176.21 3ihp s MET 487 N 0.65 4.40 -0.39 0.37 0.23 0.10 -4.93 119.30 119.73 3ihp s MET 487 Ca -0.15 0.72 -0.17 0.00 -1.03 0.00 0.00 55.69 55.06 3ihp s MET 487 Cb -0.16 -3.43 0.01 0.00 -1.53 0.00 0.00 34.83 29.71 3ihp s MET 487 CO 0.04 0.12 0.46 -0.65 -2.03 0.00 0.00 175.02 172.96 3ihp s GLN 488 N 0.66 3.34 -0.25 3.16 -0.21 -1.26 -0.60 119.66 124.49 3ihp s GLN 488 Ca 0.33 -0.51 -0.19 0.00 0.02 0.00 0.00 55.36 55.02 3ihp s GLN 488 Cb -0.17 -3.89 -0.03 0.00 1.00 0.00 0.00 33.01 29.92 3ihp s GLN 488 CO 0.15 -0.75 0.54 -1.17 -2.12 0.00 0.00 175.29 171.95 3ihp s LEU 489 N 2.24 4.07 0.49 2.90 2.96 0.25 -4.93 118.68 126.67 3ihp s LEU 489 Ca 0.15 0.60 -0.20 0.00 -0.22 0.00 0.00 54.13 54.45 3ihp s LEU 489 Cb -0.16 -2.71 -0.09 0.00 0.50 0.00 0.00 46.19 43.73 3ihp s LEU 489 CO 0.14 -0.28 1.01 -2.16 -1.32 0.00 0.00 176.35 173.74 3ihp s PRO 490 N 2.20 3.88 -0.36 0.98 0.04 -1.26 -0.84 135.00 139.63 3ihp s PRO 490 Ca 0.23 1.24 0.01 0.00 0.04 0.00 0.00 61.00 62.52 3ihp s PRO 490 Cb -0.16 -2.11 0.10 0.00 0.04 0.00 0.00 34.50 32.37 3ihp s PRO 490 CO 0.09 -0.35 0.10 0.54 0.04 0.00 0.00 177.00 177.42 3ihp s VAL 491 N -2.16 2.65 -0.90 -0.36 0.11 -1.26 -4.49 120.40 113.99 3ihp s VAL 491 Ca 0.65 -2.20 -0.23 0.00 -2.93 0.00 0.00 61.98 57.26 3ihp s VAL 491 Cb -0.14 -2.88 0.06 0.00 -1.53 0.00 0.00 36.38 31.90 3ihp s VAL 491 CO 0.21 -0.60 1.30 -2.16 -3.33 0.00 0.00 175.10 170.52 3ihp s PRO 492 N 1.00 3.45 0.40 1.54 0.04 -1.26 -4.91 135.00 135.26 3ihp s PRO 492 Ca 0.09 -1.01 0.20 0.00 0.04 0.00 0.00 61.00 60.33 3ihp s PRO 492 Cb -0.20 -4.90 1.16 0.00 0.04 0.00 0.00 34.50 30.60 3ihp s PRO 492 CO -0.06 -2.08 1.73 0.52 0.04 0.00 0.00 177.00 177.15 3ihp h MET 493 N 9.66 0.32 0.00 4.56 2.86 -2.01 -0.58 114.93 129.73 3ihp h MET 493 Ca 0.03 -0.02 0.00 0.00 -2.06 0.00 0.00 59.70 57.65 3ihp h MET 493 Cb 1.03 -0.07 0.00 0.00 0.06 0.00 0.00 31.60 32.62 3ihp h MET 493 CO 1.31 0.21 0.00 -0.25 1.06 0.00 0.00 176.91 179.25 3ihp n ASP 494 N -4.68 0.00 0.02 1.22 10.43 -1.26 -0.94 116.55 121.34 3ihp n ASP 494 Ca 0.28 0.47 0.11 0.00 2.57 0.00 0.00 54.79 58.23 3ihp n ASP 494 Cb 1.00 -0.47 0.01 0.00 1.84 0.00 0.00 41.12 43.50 3ihp n ASP 494 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 3ihp n ALA 495 N -1.47 3.43 -1.34 2.24 0.00 -0.22 -4.96 120.51 118.18 3ihp n ALA 495 Ca 0.00 -0.41 -0.53 0.00 0.00 0.00 0.00 53.44 52.50 3ihp n ALA 495 Cb 0.00 -0.96 -0.07 0.00 0.00 0.00 0.00 19.45 18.42 3ihp n ALA 495 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3ihp n ALA 496 N -1.83 -3.31 1.47 0.00 0.00 -0.11 -4.57 120.51 112.16 3ihp n ALA 496 Ca 0.02 0.53 0.14 0.00 0.00 0.00 0.00 53.44 54.13 3ihp n ALA 496 Cb 0.44 -1.57 0.51 0.00 0.00 0.00 0.00 19.45 18.83 3ihp n ALA 496 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3ihp n LEU 497 N 1.34 1.39 -2.77 0.00 4.77 0.57 -4.29 117.00 118.01 3ihp n LEU 497 Ca 0.18 -0.45 -0.03 0.00 -0.03 0.00 0.00 56.01 55.68 3ihp n LEU 497 Cb 0.07 -0.02 0.05 0.00 -2.33 0.00 0.00 43.42 41.19 3ihp n LEU 497 CO 0.54 0.24 -0.03 -0.46 -1.33 0.00 0.00 177.39 176.35 3ihp n ASN 498 N 0.02 1.44 -0.26 -1.43 0.23 -1.26 -4.95 115.26 109.05 3ihp n ASN 498 Ca 0.18 -2.27 0.07 0.00 -0.53 0.00 0.00 54.58 52.03 3ihp n ASN 498 Cb 0.35 -0.46 0.20 0.00 -2.08 0.00 0.00 39.78 37.79 3ihp n ASN 498 CO 0.00 0.00 0.00 0.11 -0.93 0.00 0.00 177.26 176.44 3ihp h LYS 499 N 2.71 0.34 0.03 -3.83 1.57 -1.97 -0.89 116.57 114.53 3ihp h LYS 499 Ca -0.13 -0.02 -0.24 0.00 -1.87 0.00 0.00 60.65 58.38 3ihp h LYS 499 Cb 1.24 -0.08 0.01 0.00 0.08 0.00 0.00 32.23 33.48 3ihp h LYS 499 CO 0.28 0.23 -1.02 0.93 -0.57 0.00 0.00 179.45 179.30 3ihp h GLU 500 N 0.35 0.46 0.00 3.15 4.39 -1.96 -2.18 114.58 118.79 3ihp h GLU 500 Ca 0.44 -0.53 -0.03 0.00 0.34 0.00 0.00 59.36 59.58 3ihp h GLU 500 Cb 0.74 0.16 -0.00 0.00 -0.10 0.00 0.00 28.75 29.54 3ihp h GLU 500 CO -0.48 1.18 -0.16 0.93 -1.16 0.00 0.00 179.01 179.32 3ihp h GLU 501 N 0.24 0.00 0.10 2.33 3.07 -1.77 -2.08 114.58 116.47 3ihp h GLU 501 Ca -0.10 0.00 -0.28 0.00 -0.50 0.00 0.00 59.36 58.48 3ihp h GLU 501 Cb 1.67 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 29.57 3ihp h GLU 501 CO 0.18 0.16 -1.36 1.25 -1.40 0.00 0.00 179.01 177.83 3ihp h LEU 502 N 0.00 0.33 -0.62 1.33 6.46 -1.10 -3.13 115.31 118.57 3ihp h LEU 502 Ca -0.00 -0.40 -0.15 0.00 -0.12 0.00 0.00 57.88 57.21 3ihp h LEU 502 Cb 0.34 -0.11 -0.01 0.00 -0.73 0.00 0.00 40.66 40.16 3ihp h LEU 502 CO 0.02 1.33 -0.60 -0.07 -0.62 0.00 0.00 178.44 178.49 3ihp h LEU 503 N 0.06 0.33 -0.68 2.25 3.38 -0.76 -0.63 115.31 119.26 3ihp h LEU 503 Ca -0.17 -0.19 -0.13 0.00 0.09 0.00 0.00 57.88 57.48 3ihp h LEU 503 Cb 1.97 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 42.61 3ihp h LEU 503 CO 0.17 0.86 -0.38 -0.33 0.09 0.00 0.00 178.44 178.85 3ihp h GLU 504 N 0.22 0.59 -0.04 1.13 5.08 -1.54 -2.33 114.58 117.69 3ihp h GLU 504 Ca -0.01 -0.29 -0.00 0.00 -1.00 0.00 0.00 59.36 58.06 3ihp h GLU 504 Cb 1.12 -0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.36 3ihp h GLU 504 CO 0.10 0.87 0.01 -0.92 -1.00 0.00 0.00 179.01 178.07 3ihp h TYR 505 N 0.49 0.06 0.00 4.33 3.20 -1.43 -1.93 116.97 121.69 3ihp h TYR 505 Ca 0.05 -0.01 -0.04 0.00 3.14 0.00 0.00 58.73 61.87 3ihp h TYR 505 Cb 0.87 -0.02 -0.01 0.00 1.54 0.00 0.00 36.73 39.12 3ihp h TYR 505 CO 0.04 0.23 -0.20 0.93 -1.64 0.00 0.00 178.16 177.52 3ihp h GLU 506 N -0.13 0.00 -0.05 1.82 5.08 -1.12 -0.50 114.58 119.69 3ihp h GLU 506 Ca 0.01 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.35 3ihp h GLU 506 Cb 0.20 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.45 3ihp h GLU 506 CO -0.00 0.20 -0.07 1.49 -1.00 0.00 0.00 179.01 179.63 3ihp h GLU 507 N 0.00 0.14 -0.96 2.33 4.22 -1.35 -2.23 114.58 116.73 3ihp h GLU 507 Ca -0.00 -0.08 0.01 0.00 0.08 0.00 0.00 59.36 59.36 3ihp h GLU 507 Cb 0.37 0.01 -0.05 0.00 0.50 0.00 0.00 28.75 29.58 3ihp h GLU 507 CO 0.03 0.63 0.62 0.87 -2.18 0.00 0.00 179.01 178.97 3ihp h LYS 508 N -0.33 1.28 -0.18 1.92 1.79 -0.88 -1.33 116.57 118.85 3ihp h LYS 508 Ca 0.01 -0.09 -0.03 0.00 -2.18 0.00 0.00 60.65 58.36 3ihp h LYS 508 Cb 0.61 -0.28 -0.01 0.00 -1.58 0.00 0.00 32.23 30.97 3ihp h LYS 508 CO 0.02 0.86 0.01 1.57 -1.08 0.00 0.00 179.45 180.83 3ihp h LYS 509 N 1.31 0.31 -0.91 3.15 5.09 -1.15 -0.15 116.57 124.22 3ihp h LYS 509 Ca 0.35 -0.09 0.15 0.00 0.09 0.00 0.00 60.65 61.14 3ihp h LYS 509 Cb -0.13 -0.03 -0.09 0.00 0.10 0.00 0.00 32.23 32.08 3ihp h LYS 509 CO -0.07 0.51 0.52 -0.09 -2.09 0.00 0.00 179.45 178.23 3ihp h ARG 510 N 0.07 0.72 -0.25 0.07 2.43 -1.23 -0.44 114.38 115.75 3ihp h ARG 510 Ca 0.05 -0.04 -0.08 0.00 -0.81 0.00 0.00 59.98 59.10 3ihp h ARG 510 Cb 0.37 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 29.75 3ihp h ARG 510 CO 0.01 0.48 -0.15 0.37 -1.51 0.00 0.00 179.97 179.17 3ihp h GLN 511 N 0.75 0.54 0.00 0.20 4.15 -1.11 -2.72 115.11 116.93 3ihp h GLN 511 Ca 0.49 -0.25 -0.08 0.00 0.77 0.00 0.00 58.65 59.58 3ihp h GLN 511 Cb 0.65 -0.01 -0.01 0.00 0.21 0.00 0.00 27.48 28.31 3ihp h GLN 511 CO -0.34 0.81 -0.37 0.00 -1.93 0.00 0.00 178.83 177.00 3ihp h ALA 512 N 0.72 1.26 0.08 3.38 0.00 -0.50 -2.55 119.26 121.65 3ihp h ALA 512 Ca 0.05 -0.34 -0.00 0.00 0.00 0.00 0.00 54.91 54.62 3ihp h ALA 512 Cb 0.66 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.39 3ihp h ALA 512 CO 0.04 0.47 -0.04 0.93 0.00 0.00 0.00 179.25 180.65 3ihp h GLU 513 N 0.00 -0.10 -0.52 0.00 5.08 -1.09 0.20 114.58 118.16 3ihp h GLU 513 Ca -0.00 0.01 0.05 0.00 -1.00 0.00 0.00 59.36 58.41 3ihp h GLU 513 Cb 0.71 0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.96 3ihp h GLU 513 CO 0.05 0.38 0.35 1.49 -1.00 0.00 0.00 179.01 180.28 3ihp h GLU 514 N -0.64 0.51 -0.00 2.33 4.57 -1.42 0.91 114.58 120.84 3ihp h GLU 514 Ca -0.01 -0.03 0.00 0.00 -1.18 0.00 0.00 59.36 58.14 3ihp h GLU 514 Cb 0.53 -0.11 0.00 0.00 -0.16 0.00 0.00 28.75 29.00 3ihp h GLU 514 CO 0.02 0.34 -0.40 -1.91 -1.18 0.00 0.00 179.01 175.87 3ihp n GLU 515 N -4.47 0.22 -2.04 1.92 4.07 -0.97 -4.95 120.64 114.42 3ihp n GLU 515 Ca 0.07 -0.12 -0.19 0.00 -0.06 0.00 0.00 57.16 56.85 3ihp n GLU 515 Cb 0.20 -1.50 -0.04 0.00 -0.06 0.00 0.00 31.44 30.04 3ihp n GLU 515 CO 0.00 0.00 0.00 0.36 -0.06 0.00 0.00 177.13 177.43 3ihp n LYS 516 N -1.28 -1.43 -2.46 5.31 0.00 0.31 -5.01 118.16 113.59 3ihp n LYS 516 Ca 0.07 1.02 -0.24 0.00 -0.00 0.00 0.00 58.31 59.16 3ihp n LYS 516 Cb 0.34 -5.47 0.10 0.00 -0.00 0.00 0.00 35.03 30.00 3ihp n LYS 516 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.40 175.76 3ihp s MET 517 N -4.41 1.72 0.14 -1.58 -1.94 0.64 -4.99 119.30 108.87 3ihp s MET 517 Ca 0.00 -0.87 -0.31 0.00 -1.71 0.00 0.00 55.69 52.80 3ihp s MET 517 Cb 0.00 -2.27 -0.10 0.00 2.01 0.00 0.00 34.83 34.47 3ihp s MET 517 CO 0.00 -1.45 1.73 0.00 -0.01 0.00 0.00 175.02 175.29 3ihp s ALA 518 N -3.20 3.79 0.64 3.03 0.00 -1.26 -4.61 121.76 120.15 3ihp s ALA 518 Ca 0.65 1.43 -0.18 0.00 0.00 0.00 0.00 51.96 53.86 3ihp s ALA 518 Cb -0.06 -3.71 -0.02 0.00 0.00 0.00 0.00 23.12 19.33 3ihp s ALA 518 CO 0.45 -1.06 1.28 -0.51 0.00 0.00 0.00 175.76 175.92 3ihp s LEU 519 N 2.10 3.60 0.77 0.00 1.02 -1.26 -4.90 118.68 120.00 3ihp s LEU 519 Ca 0.76 2.60 -0.11 0.00 0.02 0.00 0.00 54.13 57.40 3ihp s LEU 519 Cb -0.45 -4.61 0.05 0.00 0.02 0.00 0.00 46.19 41.20 3ihp s LEU 519 CO 0.34 -1.93 1.09 -2.16 0.02 0.00 0.00 176.35 173.70 3ihp s PRO 520 N -3.36 2.29 0.35 1.29 0.04 -1.26 -4.97 135.00 129.38 3ihp s PRO 520 Ca 0.82 1.16 -0.28 0.00 0.04 0.00 0.00 61.00 62.74 3ihp s PRO 520 Cb -0.37 -1.90 -0.11 0.00 0.04 0.00 0.00 34.50 32.17 3ihp s PRO 520 CO 0.39 -1.62 1.46 -2.00 0.04 0.00 0.00 177.00 175.27 3ihp s GLU 521 N -4.90 4.17 0.31 4.56 2.12 -1.26 -4.90 118.70 118.81 3ihp s GLU 521 Ca 0.61 2.48 -0.29 0.00 0.36 0.00 0.00 54.97 58.14 3ihp s GLU 521 Cb -0.17 -3.00 -0.10 0.00 0.26 0.00 0.00 34.13 31.12 3ihp s GLU 521 CO 0.56 -0.47 1.21 -1.17 -0.54 0.00 0.00 175.26 174.86 3ihp s LEU 522 N -1.77 4.47 -0.04 2.70 2.96 -1.26 -5.05 118.68 120.69 3ihp s LEU 522 Ca 0.53 2.50 0.04 0.00 -0.22 0.00 0.00 54.13 56.98 3ihp s LEU 522 Cb -0.45 -3.65 -0.00 0.00 0.50 0.00 0.00 46.19 42.59 3ihp s LEU 522 CO 0.58 -0.37 -0.16 -0.69 -1.32 0.00 0.00 176.35 174.39 3ihp s VAL 523 N -1.16 1.31 0.07 1.68 1.01 -1.26 -5.15 120.40 116.90 3ihp s VAL 523 Ca 0.47 -0.65 0.08 0.00 0.00 0.00 0.00 61.98 61.88 3ihp s VAL 523 Cb -0.36 -1.13 -0.04 0.00 0.00 0.00 0.00 36.38 34.85 3ihp s VAL 523 CO 0.47 0.38 -0.20 -0.13 0.00 0.00 0.00 175.10 175.63 3ihp s ARG 524 N 0.06 1.88 -0.01 2.72 0.52 -1.26 -5.01 118.95 117.84 3ihp s ARG 524 Ca -0.03 -1.10 -0.34 0.00 -0.52 0.00 0.00 55.73 53.74 3ihp s ARG 524 Cb -0.11 -2.11 -0.12 0.00 0.52 0.00 0.00 34.95 33.13 3ihp s ARG 524 CO 0.02 0.51 1.79 0.00 0.02 0.00 0.00 175.30 177.64 3ihp n ALA 525 N 1.27 1.03 -3.08 2.13 0.00 -1.26 -4.73 120.51 115.87 3ihp n ALA 525 Ca -0.16 0.33 -0.45 0.00 0.00 0.00 0.00 53.44 53.16 3ihp n ALA 525 Cb 0.52 -2.46 -0.05 0.00 0.00 0.00 0.00 19.45 17.47 3ihp n ALA 525 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 3ihp s GLN 526 N 3.14 3.05 -0.23 0.00 0.74 -1.26 -0.80 119.66 124.30 3ihp s GLN 526 Ca 0.89 -1.28 -0.11 0.00 0.05 0.00 0.00 55.36 54.91 3ihp s GLN 526 Cb -0.68 -4.26 -0.05 0.00 1.10 0.00 0.00 33.01 29.12 3ihp s GLN 526 CO 0.47 -1.54 0.16 0.08 -0.55 0.00 0.00 175.29 173.91 3ihp s VAL 527 N 2.75 5.37 0.39 1.34 1.01 -0.37 -0.32 120.40 130.58 3ihp s VAL 527 Ca 0.12 0.19 -0.26 0.00 0.00 0.00 0.00 61.98 62.03 3ihp s VAL 527 Cb -0.24 -3.50 -0.09 0.00 0.00 0.00 0.00 36.38 32.56 3ihp s VAL 527 CO 0.07 0.36 1.28 -2.84 0.00 0.00 0.00 175.10 173.97 3ihp s PRO 528 N 0.92 4.05 0.17 2.72 0.02 -1.26 -4.15 135.00 137.46 3ihp s PRO 528 Ca 0.08 2.12 -0.10 0.00 0.02 0.00 0.00 61.00 63.11 3ihp s PRO 528 Cb -0.13 -2.80 0.05 0.00 0.02 0.00 0.00 34.50 31.64 3ihp s PRO 528 CO 0.03 -0.41 1.63 0.35 -0.33 0.00 0.00 177.00 178.26 3ihp h PHE 529 N 2.80 1.08 -1.17 6.54 3.57 -1.93 -2.65 116.94 125.18 3ihp h PHE 529 Ca -0.49 -0.19 0.33 0.00 3.53 0.00 0.00 57.97 61.15 3ihp h PHE 529 Cb 1.24 -0.28 -0.07 0.00 2.79 0.00 0.00 35.95 39.62 3ihp h PHE 529 CO 0.54 0.97 0.80 0.66 -2.23 0.00 0.00 178.31 179.06 3ihp h SER 530 N 0.88 0.19 -0.06 0.41 4.64 -1.93 -0.24 113.55 117.44 3ihp h SER 530 Ca 0.16 0.04 -0.11 0.00 -0.47 0.00 0.00 61.79 61.42 3ihp h SER 530 Cb 0.54 0.02 0.01 0.00 -0.31 0.00 0.00 62.40 62.65 3ihp h SER 530 CO 0.03 0.01 -0.38 0.28 -0.87 0.00 0.00 176.83 175.90 3ihp h SER 531 N 0.15 0.44 -0.44 4.97 0.02 -1.86 -2.24 113.55 114.59 3ihp h SER 531 Ca 0.61 -0.67 0.06 0.00 -0.84 0.00 0.00 61.79 60.95 3ihp h SER 531 Cb 2.07 -0.13 -0.05 0.00 0.14 0.00 0.00 62.40 64.42 3ihp h SER 531 CO -0.16 1.04 0.15 0.00 -1.14 0.00 0.00 176.83 176.73 3ihp h LEU 533 N 0.31 0.54 0.08 0.00 6.46 -1.24 -0.21 115.31 121.25 3ihp h LEU 533 Ca 0.21 -0.17 0.02 0.00 -0.12 0.00 0.00 57.88 57.82 3ihp h LEU 533 Cb 0.21 -0.14 -0.04 0.00 -0.73 0.00 0.00 40.66 39.96 3ihp h LEU 533 CO -0.22 0.56 -0.29 -0.33 -0.62 0.00 0.00 178.44 177.54 3ihp h GLU 534 N 0.48 -0.46 -0.98 1.25 5.08 -1.10 -1.54 114.58 117.31 3ihp h GLU 534 Ca 0.13 0.03 0.14 0.00 -1.00 0.00 0.00 59.36 58.66 3ihp h GLU 534 Cb 0.19 0.11 -0.08 0.00 0.50 0.00 0.00 28.75 29.47 3ihp h GLU 534 CO -0.01 -0.31 0.62 0.00 -1.00 0.00 0.00 179.01 178.31 3ihp h ALA 535 N 0.24 1.61 -0.12 3.43 0.00 -0.46 0.38 119.26 124.35 3ihp h ALA 535 Ca 0.04 0.03 0.04 0.00 0.00 0.00 0.00 54.91 55.02 3ihp h ALA 535 Cb 0.53 -0.17 -0.05 0.00 0.00 0.00 0.00 17.79 18.10 3ihp h ALA 535 CO -0.20 0.12 -0.16 -0.92 0.00 0.00 0.00 179.25 178.10 3ihp h TYR 536 N 0.90 -0.40 0.00 0.00 3.20 -0.43 -3.16 116.97 117.08 3ihp h TYR 536 Ca 0.50 0.02 -0.15 0.00 3.14 0.00 0.00 58.73 62.24 3ihp h TYR 536 Cb 0.60 0.20 -0.02 0.00 1.54 0.00 0.00 36.73 39.04 3ihp h TYR 536 CO -0.00 -0.23 -0.71 0.78 -1.64 0.00 0.00 178.16 176.36 3ihp h GLY 537 N -0.20 0.00 -4.48 1.82 0.00 0.23 -3.42 103.07 97.02 3ihp h GLY 537 Ca 0.09 0.00 -0.57 0.00 0.00 0.00 0.00 47.33 46.85 3ihp h GLY 537 CO -0.24 0.00 0.60 0.00 0.00 0.00 0.00 176.54 176.90 3ihp n ALA 538 N -2.33 1.27 -1.74 3.60 0.00 0.11 -4.64 120.51 116.77 3ihp n ALA 538 Ca 0.00 0.39 -0.38 0.00 0.00 0.00 0.00 53.44 53.46 3ihp n ALA 538 Cb 0.76 -2.28 0.05 0.00 0.00 0.00 0.00 19.45 17.97 3ihp n ALA 538 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 3ihp s PRO 539 N -0.84 2.95 -0.04 0.00 0.04 -1.26 -4.81 135.00 131.04 3ihp s PRO 539 Ca 0.64 2.15 0.02 0.00 0.04 0.00 0.00 61.00 63.85 3ihp s PRO 539 Cb -0.61 -2.11 0.01 0.00 0.04 0.00 0.00 34.50 31.83 3ihp s PRO 539 CO 0.53 -1.31 -0.08 -2.00 0.04 0.00 0.00 177.00 174.18 3ihp s GLU 540 N -3.08 1.07 0.14 4.56 2.12 -0.55 -4.96 118.70 118.01 3ihp s GLU 540 Ca 0.75 -0.25 -0.29 0.00 0.36 0.00 0.00 54.97 55.54 3ihp s GLU 540 Cb -0.39 -0.98 -0.07 0.00 0.26 0.00 0.00 34.13 32.95 3ihp s GLU 540 CO 0.44 0.02 0.94 -1.14 -0.54 0.00 0.00 175.26 174.98 3ihp s GLN 541 N 0.57 4.72 -0.11 4.30 0.74 -1.26 -1.30 119.66 127.32 3ihp s GLN 541 Ca -0.09 1.42 0.01 0.00 0.05 0.00 0.00 55.36 56.75 3ihp s GLN 541 Cb -0.13 -3.35 0.02 0.00 1.10 0.00 0.00 33.01 30.66 3ihp s GLN 541 CO 0.01 0.31 -0.11 0.08 -0.55 0.00 0.00 175.29 175.03 3ihp s VAL 542 N -0.34 1.22 0.34 1.34 1.01 0.67 -4.94 120.40 119.70 3ihp s VAL 542 Ca 0.44 -0.44 0.04 0.00 0.00 0.00 0.00 61.98 62.02 3ihp s VAL 542 Cb -0.24 -1.17 -0.02 0.00 0.00 0.00 0.00 36.38 34.95 3ihp s VAL 542 CO 0.30 0.39 0.50 -1.81 0.00 0.00 0.00 175.10 174.49 3ihp s ASP 543 N 1.34 6.09 -1.20 3.32 -0.00 -1.26 -0.21 116.67 124.74 3ihp s ASP 543 Ca -0.01 0.11 -0.02 0.00 -0.00 0.00 0.00 52.55 52.63 3ihp s ASP 543 Cb -0.14 -1.61 -0.01 0.00 -0.00 0.00 0.00 42.92 41.16 3ihp s ASP 543 CO -0.05 -0.38 0.88 -0.67 -0.00 0.00 0.00 175.17 174.95 3ihp n ASP 544 N -1.71 -2.69 -4.44 0.27 2.03 -1.13 -4.95 116.55 103.93 3ihp n ASP 544 Ca -0.03 -0.72 -0.35 0.00 0.52 0.00 0.00 54.79 54.22 3ihp n ASP 544 Cb 0.57 -4.72 -0.13 0.00 -0.72 0.00 0.00 41.12 36.12 3ihp n ASP 544 CO 0.00 0.00 0.00 0.12 -1.92 0.00 0.00 177.20 175.40 3ihp s PHE 545 N -3.47 3.02 -0.33 -0.67 5.36 0.07 -4.90 117.98 117.06 3ihp s PHE 545 Ca 0.10 -0.50 -0.29 0.00 -0.96 0.00 0.00 56.93 55.29 3ihp s PHE 545 Cb -0.02 -2.06 0.01 0.00 -0.34 0.00 0.00 43.02 40.61 3ihp s PHE 545 CO 0.76 -0.24 1.25 -0.46 -1.46 0.00 0.00 175.22 175.07 3ihp s TRP 546 N 0.93 2.76 -0.34 10.12 -0.11 -1.26 0.19 118.94 131.22 3ihp s TRP 546 Ca 0.01 0.90 -0.20 0.00 1.22 0.00 0.00 56.10 58.02 3ihp s TRP 546 Cb -0.14 -3.97 -0.00 0.00 -1.50 0.00 0.00 33.47 27.86 3ihp s TRP 546 CO 0.02 -1.51 0.60 0.45 -4.62 0.00 0.00 176.95 171.89 3ihp s SER 547 N 2.65 6.41 0.51 5.86 0.15 -1.10 -4.93 113.70 123.26 3ihp s SER 547 Ca 0.54 0.16 0.27 0.00 0.70 0.00 0.00 55.95 57.61 3ihp s SER 547 Cb -0.14 -2.31 1.40 0.00 -1.71 0.00 0.00 66.02 63.25 3ihp s SER 547 CO 0.23 -0.54 2.05 0.71 1.20 0.00 0.00 173.24 176.90 3ihp h THR 548 N 5.63 0.58 -0.00 6.45 1.35 -1.89 0.38 112.91 125.41 3ihp h THR 548 Ca -0.27 -0.58 -0.00 0.00 -0.55 0.00 0.00 66.41 65.01 3ihp h THR 548 Cb 1.12 1.37 -0.00 0.00 -1.73 0.00 0.00 68.15 68.91 3ihp h THR 548 CO 0.81 0.13 -0.00 0.00 -0.25 0.00 0.00 175.52 176.20 3ihp h ALA 549 N 1.87 0.00 0.00 6.62 0.00 -1.91 -3.28 119.26 122.57 3ihp h ALA 549 Ca -0.00 -0.23 -0.09 0.00 0.00 0.00 0.00 54.91 54.59 3ihp h ALA 549 Cb 0.36 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 3ihp h ALA 549 CO 0.02 -0.27 -0.43 -0.07 0.00 0.00 0.00 179.25 178.50 3ihp h LEU 550 N -0.44 0.00 -1.97 0.00 4.07 -1.90 -3.47 115.31 111.59 3ihp h LEU 550 Ca 0.00 0.00 -0.47 0.00 0.08 0.00 0.00 57.88 57.49 3ihp h LEU 550 Cb 0.46 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.18 3ihp h LEU 550 CO 0.00 0.43 -0.88 0.00 -1.08 0.00 0.00 178.44 176.92 3ihp n GLN 551 N -3.37 -3.60 -3.55 1.13 6.02 0.13 -5.00 117.38 109.14 3ihp n GLN 551 Ca 0.01 0.47 -0.16 0.00 -0.01 0.00 0.00 57.00 57.31 3ihp n GLN 551 Cb 0.61 -4.68 -0.06 0.00 1.02 0.00 0.00 30.24 27.13 3ihp n GLN 551 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3ihp s ALA 552 N -3.84 -1.81 0.15 -1.58 0.00 -1.19 -5.03 121.76 108.46 3ihp s ALA 552 Ca 0.04 1.50 -0.31 0.00 0.00 0.00 0.00 51.96 53.18 3ihp s ALA 552 Cb -0.01 -0.37 -0.11 0.00 0.00 0.00 0.00 23.12 22.63 3ihp s ALA 552 CO 0.86 -0.35 1.73 0.15 0.00 0.00 0.00 175.76 178.15 3ihp s LYS 553 N -0.87 4.15 0.00 0.00 -0.14 -1.26 -2.70 119.74 118.93 3ihp s LYS 553 Ca -0.07 2.53 0.00 0.00 -1.36 0.00 0.00 55.97 57.07 3ihp s LYS 553 Cb -0.01 -3.34 0.00 0.00 -1.68 0.00 0.00 37.83 32.80 3ihp s LYS 553 CO 0.06 -0.76 0.00 0.45 -0.76 0.00 0.00 175.35 174.34 3ihp n SER 554 N 4.79 0.06 -4.06 2.83 2.88 0.13 -4.90 113.62 115.35 3ihp n SER 554 Ca 0.16 0.00 -0.25 0.00 -1.33 0.00 0.00 58.87 57.45 3ihp n SER 554 Cb 0.37 0.00 -0.16 0.00 -0.75 0.00 0.00 64.21 63.67 3ihp n SER 554 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 3ihp s VAL 555 N 0.83 1.23 0.26 2.46 1.01 -1.26 -0.75 120.40 124.18 3ihp s VAL 555 Ca 0.00 -0.56 0.08 0.00 0.00 0.00 0.00 61.98 61.51 3ihp s VAL 555 Cb 0.00 -1.10 -0.04 0.00 0.00 0.00 0.00 36.38 35.24 3ihp s VAL 555 CO 0.00 0.37 0.07 0.00 0.00 0.00 0.00 175.10 175.54 3ihp s ALA 556 N 0.46 3.32 -0.27 5.51 0.00 0.71 -2.56 121.76 128.94 3ihp s ALA 556 Ca -0.11 -1.55 -0.01 0.00 0.00 0.00 0.00 51.96 50.29 3ihp s ALA 556 Cb -0.14 -0.98 0.04 0.00 0.00 0.00 0.00 23.12 22.03 3ihp s ALA 556 CO 0.03 0.27 -0.05 0.08 0.00 0.00 0.00 175.76 176.10 3ihp s VAL 557 N -2.22 2.79 -0.12 0.00 1.01 0.81 -0.24 120.40 122.43 3ihp s VAL 557 Ca 0.32 -1.23 -0.07 0.00 0.00 0.00 0.00 61.98 60.99 3ihp s VAL 557 Cb -0.07 -2.51 -0.04 0.00 0.00 0.00 0.00 36.38 33.76 3ihp s VAL 557 CO 0.22 0.07 0.14 -0.75 0.00 0.00 0.00 175.10 174.78 3ihp s LYS 558 N 1.27 3.45 0.04 2.72 2.20 -0.42 -1.22 119.74 127.78 3ihp s LYS 558 Ca -0.03 -0.14 0.02 0.00 -0.36 0.00 0.00 55.97 55.46 3ihp s LYS 558 Cb -0.18 -3.19 -0.02 0.00 -1.51 0.00 0.00 37.83 32.93 3ihp s LYS 558 CO -0.04 0.77 -0.07 -0.08 -0.36 0.00 0.00 175.35 175.57 3ihp s THR 559 N -1.00 0.50 -0.07 3.43 -1.32 -0.46 -1.48 115.64 115.25 3ihp s THR 559 Ca 0.15 -1.08 0.05 0.00 -1.21 0.00 0.00 61.69 59.59 3ihp s THR 559 Cb -0.12 -0.59 -0.00 0.00 -1.51 0.00 0.00 72.50 70.27 3ihp s THR 559 CO 0.04 -0.40 -0.22 -0.89 -2.21 0.00 0.00 174.62 170.94 3ihp s THR 560 N -1.43 1.83 0.18 5.08 2.01 -1.26 -1.95 115.64 120.10 3ihp s THR 560 Ca -0.10 -0.92 -0.01 0.00 0.31 0.00 0.00 61.69 60.97 3ihp s THR 560 Cb -0.10 -1.57 -0.04 0.00 0.01 0.00 0.00 72.50 70.80 3ihp s THR 560 CO 0.00 0.51 0.10 -0.13 -0.69 0.00 0.00 174.62 174.42 3ihp s ARG 561 N 0.13 1.13 -0.17 4.92 1.81 -0.57 -4.78 118.95 121.43 3ihp s ARG 561 Ca -0.10 -1.58 -0.21 0.00 -1.72 0.00 0.00 55.73 52.12 3ihp s ARG 561 Cb -0.15 0.22 -0.03 0.00 -0.45 0.00 0.00 34.95 34.54 3ihp s ARG 561 CO 0.05 -0.34 0.62 -0.06 -0.68 0.00 0.00 175.30 174.89 3ihp s PHE 562 N -4.09 3.41 -2.12 -0.53 0.40 -0.26 -1.16 117.98 113.63 3ihp s PHE 562 Ca 0.34 0.96 0.15 0.00 -0.60 0.00 0.00 56.93 57.78 3ihp s PHE 562 Cb 0.07 -2.77 0.50 0.00 0.51 0.00 0.00 43.02 41.33 3ihp s PHE 562 CO 0.09 -0.11 1.38 0.00 0.70 0.00 0.00 175.22 177.29 3ihp n ALA 563 N 4.76 2.47 0.00 5.36 0.00 0.13 0.11 120.51 133.34 3ihp n ALA 563 Ca -0.02 -0.60 0.00 0.00 0.00 0.00 0.00 53.44 52.82 3ihp n ALA 563 Cb 0.50 -1.02 0.00 0.00 0.00 0.00 0.00 19.45 18.94 3ihp n ALA 563 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3ihp n SER 564 N 0.49 0.00 -4.50 0.00 2.88 -1.20 -4.80 113.62 106.49 3ihp n SER 564 Ca 0.14 0.00 -0.34 0.00 -1.33 0.00 0.00 58.87 57.34 3ihp n SER 564 Cb 0.32 0.00 -0.12 0.00 -0.75 0.00 0.00 64.21 63.66 3ihp n SER 564 CO 0.00 0.00 0.00 -0.36 -1.23 0.00 0.00 175.04 173.45 3ihp s PHE 565 N -0.79 2.98 0.55 0.66 2.99 -1.26 -4.19 117.98 118.91 3ihp s PHE 565 Ca 0.00 -0.28 -0.04 0.00 0.00 0.00 0.00 56.93 56.60 3ihp s PHE 565 Cb 0.00 -1.89 0.00 0.00 0.00 0.00 0.00 43.02 41.13 3ihp s PHE 565 CO 0.00 0.02 0.83 -1.25 -0.00 0.00 0.00 175.22 174.82 3ihp s PRO 566 N 0.11 2.99 0.21 0.24 0.04 -1.26 -3.51 135.00 133.82 3ihp s PRO 566 Ca -0.02 -0.13 -0.08 0.00 0.04 0.00 0.00 61.00 60.81 3ihp s PRO 566 Cb -0.14 -2.36 0.16 0.00 0.04 0.00 0.00 34.50 32.20 3ihp s PRO 566 CO 0.03 -0.56 1.77 -0.44 0.04 0.00 0.00 177.00 177.84 3ihp h ASP 567 N 0.00 1.10 -3.24 6.66 3.32 -1.78 -3.40 116.42 119.08 3ihp h ASP 567 Ca -0.46 -0.19 -0.59 0.00 0.02 0.00 0.00 57.03 55.82 3ihp h ASP 567 Cb 1.25 -0.29 -0.35 0.00 0.22 0.00 0.00 39.33 40.17 3ihp h ASP 567 CO 0.60 0.99 -0.83 -0.31 -1.72 0.00 0.00 179.24 177.96 3ihp s TYR 568 N -5.48 2.00 -0.16 4.55 2.02 -0.29 -0.50 117.35 119.49 3ihp s TYR 568 Ca -0.12 -0.97 -0.14 0.00 -0.37 0.00 0.00 57.07 55.47 3ihp s TYR 568 Cb 0.16 -1.45 -0.05 0.00 -0.40 0.00 0.00 41.96 40.22 3ihp s TYR 568 CO 0.84 -0.51 0.30 -1.17 -1.57 0.00 0.00 175.55 173.44 3ihp s LEU 569 N 1.07 4.25 -0.20 -1.29 2.96 0.12 -4.34 118.68 121.25 3ihp s LEU 569 Ca -0.05 0.52 -0.08 0.00 -0.22 0.00 0.00 54.13 54.30 3ihp s LEU 569 Cb -0.15 -2.38 -0.04 0.00 0.50 0.00 0.00 46.19 44.12 3ihp s LEU 569 CO -0.03 0.10 0.08 -0.69 -1.32 0.00 0.00 176.35 174.49 3ihp s VAL 570 N 0.44 4.83 -0.13 1.68 1.01 -1.26 -0.69 120.40 126.30 3ihp s VAL 570 Ca 0.17 -0.01 0.02 0.00 0.00 0.00 0.00 61.98 62.16 3ihp s VAL 570 Cb -0.13 -3.20 0.01 0.00 0.00 0.00 0.00 36.38 33.06 3ihp s VAL 570 CO 0.04 0.42 -0.20 -0.63 0.00 0.00 0.00 175.10 174.73 3ihp s ILE 571 N 0.68 1.89 -0.23 2.22 1.01 0.11 0.03 121.20 126.89 3ihp s ILE 571 Ca 0.04 -0.88 -0.10 0.00 0.00 0.00 0.00 60.65 59.71 3ihp s ILE 571 Cb -0.13 -1.68 -0.05 0.00 0.01 0.00 0.00 42.46 40.62 3ihp s ILE 571 CO 0.02 0.52 0.15 -1.58 0.00 0.00 0.00 174.94 174.04 3ihp s GLN 572 N 0.83 4.06 -0.31 2.79 0.74 0.23 -0.29 119.66 127.70 3ihp s GLN 572 Ca -0.08 -0.28 -0.28 0.00 0.05 0.00 0.00 55.36 54.77 3ihp s GLN 572 Cb -0.16 -3.50 0.01 0.00 1.10 0.00 0.00 33.01 30.47 3ihp s GLN 572 CO -0.01 0.09 1.03 0.42 -0.55 0.00 0.00 175.29 176.27 3ihp s ILE 573 N 0.97 4.57 -0.69 -2.34 -1.09 -0.69 0.87 121.20 122.80 3ihp s ILE 573 Ca 0.07 1.70 -0.06 0.00 -2.23 0.00 0.00 60.65 60.13 3ihp s ILE 573 Cb -0.13 -4.37 -0.13 0.00 -1.58 0.00 0.00 42.46 36.26 3ihp s ILE 573 CO 0.04 -0.41 2.63 0.29 -1.23 0.00 0.00 174.94 176.26 3ihp n LYS 574 N 6.70 2.22 -1.13 2.79 5.02 -0.02 -4.73 118.16 129.02 3ihp n LYS 574 Ca 0.11 -1.33 -0.27 0.00 -2.02 0.00 0.00 58.31 54.80 3ihp n LYS 574 Cb 0.47 -2.28 -0.08 0.00 -0.02 0.00 0.00 35.03 33.12 3ihp n LYS 574 CO 0.00 0.00 0.00 0.36 -0.52 0.00 0.00 177.40 177.24 3ihp n LYS 575 N 3.37 2.88 -3.61 1.97 2.85 -1.26 -4.47 118.16 119.88 3ihp n LYS 575 Ca 0.47 -1.65 -0.11 0.00 -1.05 0.00 0.00 58.31 55.98 3ihp n LYS 575 Cb 0.40 -2.45 -0.04 0.00 -0.65 0.00 0.00 35.03 32.29 3ihp n LYS 575 CO 0.00 0.00 0.00 -0.59 -0.05 0.00 0.00 177.40 176.76 3ihp s PHE 576 N 1.82 -0.25 0.25 5.58 -0.12 -1.26 -1.37 117.98 122.64 3ihp s PHE 576 Ca 0.65 -0.03 -0.21 0.00 -0.05 0.00 0.00 56.93 57.29 3ihp s PHE 576 Cb 0.22 0.29 0.04 0.00 -0.63 0.00 0.00 43.02 42.94 3ihp s PHE 576 CO -0.03 -0.71 0.83 -0.08 -0.05 0.00 0.00 175.22 175.18 3ihp s THR 577 N -3.67 0.00 -0.05 -4.49 -1.32 -0.60 -4.86 115.64 100.64 3ihp s THR 577 Ca 0.02 -0.87 -0.22 0.00 -1.21 0.00 0.00 61.69 59.41 3ihp s THR 577 Cb 0.01 -2.21 -0.04 0.00 -1.51 0.00 0.00 72.50 68.75 3ihp s THR 577 CO -0.11 0.00 0.65 -0.36 -2.21 0.00 0.00 174.62 172.59 3ihp s PHE 578 N -3.34 3.60 0.00 9.09 0.40 -1.26 -0.24 117.98 126.23 3ihp s PHE 578 Ca 0.13 1.20 0.00 0.00 -0.60 0.00 0.00 56.93 57.66 3ihp s PHE 578 Cb -0.04 -2.73 0.00 0.00 0.51 0.00 0.00 43.02 40.76 3ihp s PHE 578 CO 0.06 0.17 0.00 0.41 0.70 0.00 0.00 175.22 176.56 3ihp n GLY 579 N 2.94 0.24 3.76 4.36 0.00 0.12 -4.87 105.19 111.74 3ihp n GLY 579 Ca -0.03 -1.87 -0.32 0.00 0.00 0.00 0.00 46.02 43.80 3ihp n GLY 579 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3ihp s LEU 580 N 0.00 3.21 -1.26 0.99 1.43 -1.26 -2.60 118.68 119.20 3ihp s LEU 580 Ca 0.00 1.98 0.00 0.00 -1.03 0.00 0.00 54.13 55.08 3ihp s LEU 580 Cb 0.00 -4.54 0.00 0.00 0.03 0.00 0.00 46.19 41.68 3ihp s LEU 580 CO 0.00 -1.93 0.00 0.47 0.23 0.00 0.00 176.35 175.12 3ihp n ASP 581 N -2.98 -3.36 -2.54 2.29 8.00 -1.26 -2.49 116.55 114.21 3ihp n ASP 581 Ca 0.10 0.28 -0.19 0.00 0.71 0.00 0.00 54.79 55.70 3ihp n ASP 581 Cb 0.52 -3.11 0.03 0.00 -0.02 0.00 0.00 41.12 38.54 3ihp n ASP 581 CO 0.00 0.00 0.00 0.79 -0.39 0.00 0.00 177.20 177.60 3ihp n TRP 582 N -2.11 -1.60 -3.24 1.24 7.02 -1.07 -5.00 117.44 112.68 3ihp n TRP 582 Ca -0.13 0.41 -0.39 0.00 -1.02 0.00 0.00 57.50 56.38 3ihp n TRP 582 Cb 0.44 -3.94 -0.06 0.00 -2.42 0.00 0.00 31.31 25.33 3ihp n TRP 582 CO 0.00 0.00 0.00 0.14 -2.02 0.00 0.00 177.69 175.81 3ihp s VAL 583 N -3.07 4.89 0.12 -0.99 -7.23 -1.04 -4.83 120.40 108.26 3ihp s VAL 583 Ca 0.24 1.20 -0.31 0.00 -1.81 0.00 0.00 61.98 61.30 3ihp s VAL 583 Cb -0.10 -3.91 -0.07 0.00 0.56 0.00 0.00 36.38 32.85 3ihp s VAL 583 CO 0.29 0.45 1.30 -2.84 -0.31 0.00 0.00 175.10 173.99 3ihp s PRO 584 N -0.40 4.39 -0.18 4.82 0.02 -1.26 0.10 135.00 142.48 3ihp s PRO 584 Ca 0.30 1.96 -0.06 0.00 0.02 0.00 0.00 61.00 63.21 3ihp s PRO 584 Cb -0.18 -3.27 -0.03 0.00 0.02 0.00 0.00 34.50 31.04 3ihp s PRO 584 CO 0.17 -0.31 0.03 0.15 -0.33 0.00 0.00 177.00 176.71 3ihp s LYS 585 N 0.72 3.82 0.14 5.54 1.02 0.67 -4.63 119.74 127.02 3ihp s LYS 585 Ca 0.60 -0.43 -0.31 0.00 0.02 0.00 0.00 55.97 55.86 3ihp s LYS 585 Cb -0.34 -3.13 -0.08 0.00 -0.52 0.00 0.00 37.83 33.76 3ihp s LYS 585 CO 0.32 0.19 1.32 0.21 -0.92 0.00 0.00 175.35 176.47 3ihp s LYS 586 N 0.57 4.37 -0.64 1.68 2.20 -1.26 -1.56 119.74 125.10 3ihp s LYS 586 Ca 0.01 2.01 -0.26 0.00 -0.36 0.00 0.00 55.97 57.38 3ihp s LYS 586 Cb -0.13 -3.25 0.04 0.00 -1.51 0.00 0.00 37.83 32.98 3ihp s LYS 586 CO 0.02 -0.33 1.11 -0.51 -0.36 0.00 0.00 175.35 175.27 3ihp s LEU 587 N 0.64 3.73 -0.90 5.43 1.43 -0.47 -4.93 118.68 123.61 3ihp s LEU 587 Ca 0.61 -0.44 -0.23 0.00 -1.03 0.00 0.00 54.13 53.04 3ihp s LEU 587 Cb -0.35 -2.72 0.07 0.00 0.03 0.00 0.00 46.19 43.22 3ihp s LEU 587 CO 0.33 -1.53 1.27 -0.62 0.23 0.00 0.00 176.35 176.03 3ihp s ASP 588 N 3.35 6.43 0.12 2.29 -1.08 -1.26 -4.78 116.67 121.74 3ihp s ASP 588 Ca 0.33 -1.37 0.06 0.00 -0.52 0.00 0.00 52.55 51.05 3ihp s ASP 588 Cb -0.11 -2.50 -0.04 0.00 -1.46 0.00 0.00 42.92 38.81 3ihp s ASP 588 CO 0.17 -1.44 -0.14 0.54 0.52 0.00 0.00 175.17 174.81 3ihp s VAL 589 N 4.40 1.37 -0.29 1.11 0.11 -1.26 -4.06 120.40 121.77 3ihp s VAL 589 Ca 0.37 -1.72 -0.00 0.00 -2.93 0.00 0.00 61.98 57.70 3ihp s VAL 589 Cb -0.05 -1.54 0.05 0.00 -1.53 0.00 0.00 36.38 33.31 3ihp s VAL 589 CO -0.03 -0.40 -0.02 -0.55 -3.33 0.00 0.00 175.10 170.77 3ihp s SER 590 N -2.44 4.78 -0.27 3.54 0.15 0.02 -4.73 113.70 114.75 3ihp s SER 590 Ca 0.09 -1.33 0.01 0.00 0.70 0.00 0.00 55.95 55.42 3ihp s SER 590 Cb -0.05 -1.67 0.08 0.00 -1.71 0.00 0.00 66.02 62.66 3ihp s SER 590 CO 0.03 -0.25 -0.00 -0.63 1.20 0.00 0.00 173.24 173.59 3ihp s ILE 591 N 1.21 1.58 -0.73 6.45 1.01 -0.81 -1.23 121.20 128.67 3ihp s ILE 591 Ca -0.06 -1.50 -0.26 0.00 0.00 0.00 0.00 60.65 58.84 3ihp s ILE 591 Cb -0.20 -1.97 -0.02 0.00 0.01 0.00 0.00 42.46 40.29 3ihp s ILE 591 CO -0.02 -0.31 1.78 -0.70 0.00 0.00 0.00 174.94 175.69 3ihp s GLU 592 N 1.33 2.75 0.12 2.79 2.56 -1.26 -4.24 118.70 122.75 3ihp s GLU 592 Ca 0.00 0.14 -0.30 0.00 0.00 0.00 0.00 54.97 54.81 3ihp s GLU 592 Cb -0.19 -4.61 -0.07 0.00 2.00 0.00 0.00 34.13 31.27 3ihp s GLU 592 CO -0.10 -2.79 1.20 -1.64 -0.56 0.00 0.00 175.26 171.37 3ihp s MET 593 N 6.72 4.46 0.66 4.30 -1.94 -1.19 -4.59 119.30 127.72 3ihp s MET 593 Ca 0.62 1.82 -0.15 0.00 -1.71 0.00 0.00 55.69 56.27 3ihp s MET 593 Cb -0.10 -3.30 -0.00 0.00 2.01 0.00 0.00 34.83 33.45 3ihp s MET 593 CO 0.12 -0.18 1.12 -2.14 -0.01 0.00 0.00 175.02 173.93 3ihp s PRO 594 N 0.48 2.79 0.42 2.03 0.02 -1.26 -4.90 135.00 134.58 3ihp s PRO 594 Ca 0.56 1.43 0.23 0.00 0.02 0.00 0.00 61.00 63.25 3ihp s PRO 594 Cb -0.31 -1.95 0.75 0.00 0.02 0.00 0.00 34.50 33.01 3ihp s PRO 594 CO 0.32 -1.26 1.75 0.93 -0.33 0.00 0.00 177.00 178.41 3ihp h GLU 595 N 0.09 0.00 -4.57 5.54 5.08 -1.95 -3.41 114.58 115.36 3ihp h GLU 595 Ca -0.47 0.00 -0.55 0.00 -1.00 0.00 0.00 59.36 57.34 3ihp h GLU 595 Cb 1.25 0.00 -0.35 0.00 0.50 0.00 0.00 28.75 30.15 3ihp h GLU 595 CO 0.54 0.22 -0.82 -1.21 -1.00 0.00 0.00 179.01 176.74 3ihp s GLU 596 N -3.48 1.92 -0.16 2.33 2.02 -1.26 -1.35 118.70 118.73 3ihp s GLU 596 Ca 0.02 -0.45 0.01 0.00 0.02 0.00 0.00 54.97 54.57 3ihp s GLU 596 Cb 0.09 -1.69 0.02 0.00 0.10 0.00 0.00 34.13 32.65 3ihp s GLU 596 CO 0.65 -0.08 -0.17 -1.17 0.02 0.00 0.00 175.26 174.50 3ihp s LEU 597 N 1.06 1.90 -0.34 1.80 0.20 -0.34 -4.98 118.68 117.98 3ihp s LEU 597 Ca -0.06 -0.56 -0.07 0.00 0.69 0.00 0.00 54.13 54.13 3ihp s LEU 597 Cb -0.15 -1.32 0.03 0.00 -0.43 0.00 0.00 46.19 44.33 3ihp s LEU 597 CO -0.02 -0.02 0.11 -0.62 -0.29 0.00 0.00 176.35 175.52 3ihp s ASP 598 N 1.32 5.34 -0.15 3.68 2.15 -1.26 -0.08 116.67 127.67 3ihp s ASP 598 Ca 0.03 -1.05 0.18 0.00 0.43 0.00 0.00 52.55 52.14 3ihp s ASP 598 Cb -0.13 -1.89 0.42 0.00 -0.30 0.00 0.00 42.92 41.01 3ihp s ASP 598 CO -0.10 -0.31 1.30 0.00 -0.17 0.00 0.00 175.17 175.88 3ihp n ILE 599 N 4.85 2.09 0.06 4.11 3.06 0.14 -4.68 119.36 128.99 3ihp n ILE 599 Ca -0.13 -2.04 -0.10 0.00 -2.50 0.00 0.00 62.75 57.99 3ihp n ILE 599 Cb 0.45 -0.24 0.02 0.00 0.54 0.00 0.00 39.64 40.42 3ihp n ILE 599 CO 0.00 0.00 0.00 0.77 -2.50 0.00 0.00 176.55 174.82 3ihp h SER 600 N 0.98 0.42 0.00 9.51 4.64 -1.91 -1.95 113.55 125.24 3ihp h SER 600 Ca 0.00 -0.29 0.00 0.00 -0.47 0.00 0.00 61.79 61.03 3ihp h SER 600 Cb 1.23 -0.12 0.00 0.00 -0.31 0.00 0.00 62.40 63.20 3ihp h SER 600 CO 0.12 1.04 0.13 0.00 -0.87 0.00 0.00 176.83 177.26 3ihp n GLN 601 N -3.79 0.00 -0.22 4.77 3.00 -1.26 -1.29 117.38 118.59 3ihp n GLN 601 Ca -0.04 0.38 0.10 0.00 -0.01 0.00 0.00 57.00 57.42 3ihp n GLN 601 Cb 0.74 -1.65 0.22 0.00 0.00 0.00 0.00 30.24 29.54 3ihp n GLN 601 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.06 176.95 3ihp n LEU 602 N -1.40 3.35 -4.72 1.08 7.94 -0.73 -4.96 117.00 117.55 3ihp n LEU 602 Ca -0.00 -1.72 -0.42 0.00 -1.11 0.00 0.00 56.01 52.76 3ihp n LEU 602 Cb 0.14 -0.29 -0.03 0.00 0.53 0.00 0.00 43.42 43.76 3ihp n LEU 602 CO 0.00 0.78 0.89 -0.60 -1.11 0.00 0.00 177.39 177.35 3ihp s ARG 603 N -1.17 4.46 0.64 1.96 6.06 -0.41 -1.10 118.95 129.38 3ihp s ARG 603 Ca 0.36 1.81 -0.14 0.00 -2.50 0.00 0.00 55.73 55.25 3ihp s ARG 603 Cb 0.20 -3.30 -0.01 0.00 0.06 0.00 0.00 34.95 31.89 3ihp s ARG 603 CO 0.27 -0.19 1.07 0.20 -2.50 0.00 0.00 175.30 174.15 3ihp s GLY 604 N 0.69 2.04 0.00 8.12 0.00 0.31 -4.78 107.32 113.70 3ihp s GLY 604 Ca 0.57 0.38 0.00 0.00 0.00 0.00 0.00 44.72 45.67 3ihp s GLY 604 CO 0.32 0.71 0.18 2.41 0.00 0.00 0.00 173.10 176.72 3ihp n THR 605 N -2.40 0.00 -1.54 0.90 -1.04 -1.26 -4.83 114.28 104.11 3ihp n THR 605 Ca 0.09 -0.40 0.07 0.00 -2.04 0.00 0.00 64.05 61.77 3ihp n THR 605 Cb 0.53 1.10 -0.02 0.00 -1.82 0.00 0.00 70.33 70.12 3ihp n THR 605 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3ihp n GLY 606 N 0.43 -1.99 3.74 3.41 0.00 -1.26 -4.84 105.19 104.69 3ihp n GLY 606 Ca 0.00 -1.34 -0.39 0.00 0.00 0.00 0.00 46.02 44.29 3ihp n GLY 606 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 3ihp n LEU 607 N 0.00 5.21 -4.35 0.99 7.94 -1.26 -5.02 117.00 120.51 3ihp n LEU 607 Ca 0.00 1.04 -0.25 0.00 -1.11 0.00 0.00 56.01 55.69 3ihp n LEU 607 Cb 0.22 -1.58 -0.12 0.00 0.53 0.00 0.00 43.42 42.48 3ihp n LEU 607 CO 0.00 -0.47 -0.52 -1.10 -1.11 0.00 0.00 177.39 174.20 3ihp s GLN 608 N -2.67 1.31 0.31 1.96 -1.52 -1.26 -5.09 119.66 112.70 3ihp s GLN 608 Ca 0.67 -1.36 -0.29 0.00 -1.95 0.00 0.00 55.36 52.42 3ihp s GLN 608 Cb -0.44 -1.56 -0.11 0.00 -0.22 0.00 0.00 33.01 30.69 3ihp s GLN 608 CO 0.53 0.34 1.53 -2.14 -0.25 0.00 0.00 175.29 175.30 3ihp s PRO 609 N -2.42 4.16 0.00 2.91 0.02 -1.26 -1.94 135.00 136.47 3ihp s PRO 609 Ca 0.14 2.51 0.00 0.00 0.02 0.00 0.00 61.00 63.67 3ihp s PRO 609 Cb -0.08 -3.03 0.00 0.00 0.02 0.00 0.00 34.50 31.41 3ihp s PRO 609 CO 0.07 -0.55 0.00 0.41 -0.33 0.00 0.00 177.00 176.60 3ihp n GLY 610 N 1.70 3.06 3.71 0.52 0.00 -1.26 -5.03 105.19 107.89 3ihp n GLY 610 Ca 0.06 -0.53 -0.42 0.00 0.00 0.00 0.00 46.02 45.13 3ihp n GLY 610 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3ihp s GLU 611 N 0.00 4.42 -0.11 1.61 2.02 -0.82 -5.03 118.70 120.79 3ihp s GLU 611 Ca 0.00 1.79 -0.06 0.00 0.02 0.00 0.00 54.97 56.72 3ihp s GLU 611 Cb 0.00 -3.34 -0.04 0.00 0.10 0.00 0.00 34.13 30.85 3ihp s GLU 611 CO 0.00 -0.27 0.13 -1.21 0.02 0.00 0.00 175.26 173.92 3ihp s GLU 612 N 1.07 3.39 0.23 1.61 2.02 -1.26 -4.79 118.70 120.97 3ihp s GLU 612 Ca 0.59 -0.17 -0.19 0.00 0.02 0.00 0.00 54.97 55.22 3ihp s GLU 612 Cb -0.30 -3.14 -0.08 0.00 0.10 0.00 0.00 34.13 30.71 3ihp s GLU 612 CO 0.29 0.77 0.73 -2.00 0.02 0.00 0.00 175.26 175.07 3ihp s GLU 613 N -1.07 4.23 0.19 1.61 2.12 -1.26 -0.96 118.70 123.56 3ihp s GLU 613 Ca 0.15 0.86 -0.30 0.00 0.36 0.00 0.00 54.97 56.04 3ihp s GLU 613 Cb -0.12 -2.83 -0.08 0.00 0.26 0.00 0.00 34.13 31.36 3ihp s GLU 613 CO 0.05 0.37 1.20 -0.51 -0.54 0.00 0.00 175.26 175.82 3ihp s LEU 614 N -2.08 4.45 0.82 2.70 1.43 -0.02 -4.70 118.68 121.28 3ihp s LEU 614 Ca 0.44 2.24 -0.12 0.00 -1.03 0.00 0.00 54.13 55.67 3ihp s LEU 614 Cb -0.16 -3.61 0.09 0.00 0.03 0.00 0.00 46.19 42.54 3ihp s LEU 614 CO 0.21 -0.37 1.15 -2.84 0.23 0.00 0.00 176.35 174.72 3ihp s PRO 615 N -0.27 1.70 0.00 1.29 0.02 -1.26 -4.95 135.00 131.53 3ihp s PRO 615 Ca 0.53 1.50 0.00 0.00 0.02 0.00 0.00 61.00 63.05 3ihp s PRO 615 Cb -0.33 -1.81 0.00 0.00 0.02 0.00 0.00 34.50 32.38 3ihp s PRO 615 CO 0.37 -2.11 0.00 -0.40 -0.33 0.00 0.00 177.00 174.52 3ihp n ASP 616 N -3.58 0.90 -0.92 2.53 5.68 -1.26 -4.72 116.55 115.18 3ihp n ASP 616 Ca 0.11 0.00 0.04 0.00 -0.50 0.00 0.00 54.79 54.44 3ihp n ASP 616 Cb 0.52 0.00 -0.01 0.00 -1.14 0.00 0.00 41.12 40.49 3ihp n ASP 616 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3ihp n ILE 617 N 0.00 0.00 0.00 2.12 0.13 -1.26 -5.14 119.36 115.21 3ihp n ILE 617 Ca 0.00 0.00 0.00 0.00 -1.10 0.00 0.00 62.75 61.65 3ihp n ILE 617 Cb 0.00 -0.09 0.00 0.00 -0.84 0.00 0.00 39.64 38.71 3ihp n ILE 617 CO 0.00 0.00 0.00 -0.62 2.80 0.00 0.00 176.55 178.73 3ihp n GLU 634 N -2.11 0.00 0.15 9.51 1.02 -1.26 -4.89 120.64 123.07 3ihp n GLU 634 Ca 0.00 0.00 0.06 0.00 -0.02 0.00 0.00 57.16 57.20 3ihp n GLU 634 Cb 0.12 0.00 0.06 0.00 -0.02 0.00 0.00 31.44 31.60 3ihp n GLU 634 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 3ihp h SER 635 N 0.00 0.00 0.01 1.62 0.87 -2.05 -3.11 113.55 110.89 3ihp h SER 635 Ca 0.00 0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 60.56 3ihp h SER 635 Cb 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 61.96 3ihp h SER 635 CO 0.00 0.33 -0.00 0.58 -0.53 0.00 0.00 176.83 177.20 3ihp h VAL 636 N 0.00 1.48 -0.89 2.23 2.07 -2.00 -3.22 116.25 115.92 3ihp h VAL 636 Ca -0.02 -1.51 0.13 0.00 0.82 0.00 0.00 66.70 66.12 3ihp h VAL 636 Cb 1.26 2.50 -0.09 0.00 -1.52 0.00 0.00 31.29 33.45 3ihp h VAL 636 CO 0.04 0.39 0.51 0.40 0.02 0.00 0.00 177.57 178.93 3ihp h ILE 637 N -0.66 0.81 -0.66 4.57 2.04 -1.87 -1.16 117.51 120.57 3ihp h ILE 637 Ca -0.00 -0.26 -0.04 0.00 1.00 0.00 0.00 64.86 65.56 3ihp h ILE 637 Cb 0.64 -0.02 -0.03 0.00 -0.74 0.00 0.00 36.82 36.68 3ihp h ILE 637 CO 0.00 0.14 0.26 0.16 0.00 0.00 0.00 178.15 178.71 3ihp h ILE 638 N 0.76 1.23 -0.13 -0.67 3.07 -1.64 -1.78 117.51 118.35 3ihp h ILE 638 Ca 0.47 -0.72 -0.14 0.00 1.55 0.00 0.00 64.86 66.02 3ihp h ILE 638 Cb 0.57 0.44 -0.01 0.00 -0.27 0.00 0.00 36.82 37.56 3ihp h ILE 638 CO -0.31 0.29 -0.53 -0.61 -1.05 0.00 0.00 178.15 175.94 3ihp h GLN 639 N 0.95 0.37 0.01 0.16 4.15 -1.24 -2.66 115.11 116.84 3ihp h GLN 639 Ca 0.22 -0.22 -0.26 0.00 0.77 0.00 0.00 58.65 59.16 3ihp h GLN 639 Cb 0.18 0.02 0.02 0.00 0.21 0.00 0.00 27.48 27.92 3ihp h GLN 639 CO -0.02 0.81 -1.01 -0.07 -1.93 0.00 0.00 178.83 176.61 3ihp h LEU 640 N 0.29 0.88 -1.21 -2.39 3.38 -1.29 -3.03 115.31 111.93 3ihp h LEU 640 Ca 0.01 -0.75 -0.06 0.00 0.09 0.00 0.00 57.88 57.18 3ihp h LEU 640 Cb 1.02 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 41.49 3ihp h LEU 640 CO 0.09 1.51 -0.06 -0.37 0.09 0.00 0.00 178.44 179.69 3ihp h VAL 641 N 0.34 1.20 -0.48 1.22 -1.51 -1.29 -2.43 116.25 113.30 3ihp h VAL 641 Ca -0.13 -0.86 0.00 0.00 -1.23 0.00 0.00 66.70 64.49 3ihp h VAL 641 Cb 1.67 1.06 -0.02 0.00 -2.13 0.00 0.00 31.29 31.86 3ihp h VAL 641 CO 0.20 0.28 0.31 -0.33 -1.23 0.00 0.00 177.57 176.81 3ihp h GLU 642 N 0.44 0.63 -0.04 5.19 4.39 -1.54 -2.83 114.58 120.82 3ihp h GLU 642 Ca 0.09 -0.04 0.01 0.00 0.34 0.00 0.00 59.36 59.76 3ihp h GLU 642 Cb 0.39 -0.14 -0.00 0.00 -0.10 0.00 0.00 28.75 28.90 3ihp h GLU 642 CO 0.02 0.42 0.03 0.52 -1.16 0.00 0.00 179.01 178.84 3ihp h MET 643 N 0.64 0.00 0.00 2.33 2.86 -1.31 -3.46 114.93 115.99 3ihp h MET 643 Ca 0.17 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.81 3ihp h MET 643 Cb -0.07 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.59 3ihp h MET 643 CO -0.04 0.00 0.00 0.41 1.06 0.00 0.00 176.91 178.34 3ihp n GLY 644 N -1.49 0.44 3.78 8.32 0.00 -1.07 -5.12 105.19 110.06 3ihp n GLY 644 Ca -0.02 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.62 3ihp n GLY 644 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3ihp s PHE 645 N -1.32 3.51 0.38 1.61 0.08 -1.14 -5.02 117.98 116.09 3ihp s PHE 645 Ca 0.00 1.72 -0.27 0.00 0.12 0.00 0.00 56.93 58.50 3ihp s PHE 645 Cb 0.00 -3.08 -0.09 0.00 -0.57 0.00 0.00 43.02 39.28 3ihp s PHE 645 CO 0.00 -0.26 1.33 -1.25 -0.10 0.00 0.00 175.22 174.94 3ihp s PRO 646 N -2.09 4.09 0.26 0.24 0.04 -1.26 -4.32 135.00 131.97 3ihp s PRO 646 Ca 0.52 2.24 -0.01 0.00 0.04 0.00 0.00 61.00 63.79 3ihp s PRO 646 Cb -0.23 -2.88 0.54 0.00 0.04 0.00 0.00 34.50 31.97 3ihp s PRO 646 CO 0.29 -0.42 1.75 1.98 0.04 0.00 0.00 177.00 180.64 3ihp h MET 647 N 2.92 0.55 -0.04 4.56 1.85 -1.95 -1.57 114.93 121.25 3ihp h MET 647 Ca -0.50 -0.03 -0.00 0.00 -0.61 0.00 0.00 59.70 58.56 3ihp h MET 647 Cb 1.24 -0.12 -0.00 0.00 0.43 0.00 0.00 31.60 33.14 3ihp h MET 647 CO 0.64 0.36 0.02 -0.44 -0.40 0.00 0.00 176.91 177.09 3ihp h ASP 648 N 0.56 0.05 -0.75 1.39 5.19 -2.00 -0.74 116.42 120.12 3ihp h ASP 648 Ca 0.46 -0.06 -0.02 0.00 -0.62 0.00 0.00 57.03 56.79 3ihp h ASP 648 Cb 0.69 -0.01 -0.03 0.00 0.18 0.00 0.00 39.33 40.15 3ihp h ASP 648 CO -0.39 0.10 0.38 0.00 -3.12 0.00 0.00 179.24 176.22 3ihp h ALA 649 N 0.95 0.96 -0.69 3.45 0.00 -1.85 -2.88 119.26 119.20 3ihp h ALA 649 Ca 0.01 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.79 3ihp h ALA 649 Cb 0.06 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.52 3ihp h ALA 649 CO -0.00 0.51 0.44 0.00 0.00 0.00 0.00 179.25 180.19 3ihp h ARG 651 N 0.95 -0.20 -0.00 0.00 3.08 -1.02 -2.99 114.38 114.20 3ihp h ARG 651 Ca 0.25 0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.32 3ihp h ARG 651 Cb -0.07 0.04 -0.00 0.00 0.08 0.00 0.00 29.97 30.02 3ihp h ARG 651 CO -0.05 0.11 0.04 0.87 -1.07 0.00 0.00 179.97 179.86 3ihp h LYS 652 N -0.50 0.00 0.02 0.04 1.57 -1.29 -2.75 116.57 113.65 3ihp h LYS 652 Ca -0.02 0.00 -0.19 0.00 -1.87 0.00 0.00 60.65 58.57 3ihp h LYS 652 Cb 0.39 0.00 0.02 0.00 0.08 0.00 0.00 32.23 32.72 3ihp h LYS 652 CO 0.03 0.00 -0.74 0.00 -0.57 0.00 0.00 179.45 178.17 3ihp h ALA 653 N 1.92 0.07 -0.25 3.86 0.00 -1.20 -2.30 119.26 121.36 3ihp h ALA 653 Ca 0.00 -0.62 -0.16 0.00 0.00 0.00 0.00 54.91 54.13 3ihp h ALA 653 Cb 0.08 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 3ihp h ALA 653 CO -0.00 0.44 -0.49 0.28 0.00 0.00 0.00 179.25 179.48 3ihp h VAL 654 N -0.00 1.30 -0.34 0.00 2.07 -1.48 -2.97 116.25 114.83 3ihp h VAL 654 Ca -0.10 -1.69 -0.08 0.00 0.82 0.00 0.00 66.70 65.65 3ihp h VAL 654 Cb 1.45 1.63 -0.01 0.00 -1.52 0.00 0.00 31.29 32.84 3ihp h VAL 654 CO 0.15 0.54 -0.10 0.22 0.02 0.00 0.00 177.57 178.39 3ihp h TYR 655 N 0.54 0.76 -0.00 1.57 3.20 -1.57 -1.64 116.97 119.83 3ihp h TYR 655 Ca 0.03 -0.17 0.00 0.00 3.14 0.00 0.00 58.73 61.73 3ihp h TYR 655 Cb 1.05 -0.18 0.00 0.00 1.54 0.00 0.00 36.73 39.13 3ihp h TYR 655 CO 0.05 0.85 -0.25 0.66 -1.64 0.00 0.00 178.16 177.83 3ihp n TYR 656 N -4.40 0.00 0.82 -3.82 4.02 -0.87 -2.65 117.16 110.27 3ihp n TYR 656 Ca -0.02 0.00 0.11 0.00 -0.01 0.00 0.00 57.90 57.98 3ihp n TYR 656 Cb 0.35 -0.31 0.11 0.00 -0.02 0.00 0.00 39.34 39.47 3ihp n TYR 656 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 176.86 176.10 3ihp n THR 657 N -1.33 0.07 -3.31 -0.72 -2.24 -1.12 -5.01 114.28 100.63 3ihp n THR 657 Ca 0.08 -0.54 -0.16 0.00 -2.27 0.00 0.00 64.05 61.17 3ihp n THR 657 Cb 0.33 1.39 0.08 0.00 -2.10 0.00 0.00 70.33 70.02 3ihp n THR 657 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3ihp n GLY 658 N 1.26 -0.42 3.82 3.38 0.00 -1.08 -3.89 105.19 108.25 3ihp n GLY 658 Ca 0.14 0.13 -0.35 0.00 0.00 0.00 0.00 46.02 45.94 3ihp n GLY 658 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3ihp n ASN 659 N -3.01 -4.94 -1.21 1.61 4.13 -0.63 -4.91 115.26 106.30 3ihp n ASN 659 Ca -0.24 -1.07 0.08 0.00 1.68 0.00 0.00 54.58 55.03 3ihp n ASN 659 Cb 0.65 -2.50 0.29 0.00 -1.54 0.00 0.00 39.78 36.68 3ihp n ASN 659 CO 0.00 0.00 0.00 -1.20 0.28 0.00 0.00 177.26 176.34 3ihp n SER 660 N -2.41 4.28 0.00 6.41 7.64 -1.25 -5.07 113.62 123.22 3ihp n SER 660 Ca -0.14 -2.67 0.00 0.00 1.01 0.00 0.00 58.87 57.07 3ihp n SER 660 Cb 0.59 -0.52 0.00 0.00 -1.01 0.00 0.00 64.21 63.27 3ihp n SER 660 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3ihp n GLY 661 N 0.31 0.81 0.20 0.23 0.00 -1.26 -4.64 105.19 100.84 3ihp n GLY 661 Ca 0.22 -1.91 -0.05 0.00 0.00 0.00 0.00 46.02 44.28 3ihp n GLY 661 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ihp h ALA 662 N 0.00 0.60 -0.09 4.61 0.00 -1.97 -3.04 119.26 119.36 3ihp h ALA 662 Ca 0.00 0.02 0.04 0.00 0.00 0.00 0.00 54.91 54.97 3ihp h ALA 662 Cb 0.00 -0.07 -0.06 0.00 0.00 0.00 0.00 17.79 17.66 3ihp h ALA 662 CO 0.00 -0.11 -0.40 0.93 0.00 0.00 0.00 179.25 179.67 3ihp h GLU 663 N 0.48 -0.48 -0.38 0.00 5.08 -2.00 0.88 114.58 118.16 3ihp h GLU 663 Ca 0.21 0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.59 3ihp h GLU 663 Cb 0.11 0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.45 3ihp h GLU 663 CO -0.14 -0.32 0.19 0.00 -1.00 0.00 0.00 179.01 177.74 3ihp h ALA 664 N 0.13 1.63 -0.05 3.43 0.00 -1.80 -1.86 119.26 120.74 3ihp h ALA 664 Ca 0.07 -0.07 -0.19 0.00 0.00 0.00 0.00 54.91 54.71 3ihp h ALA 664 Cb 0.62 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.25 3ihp h ALA 664 CO -0.37 0.31 -0.79 0.00 0.00 0.00 0.00 179.25 178.40 3ihp h ALA 665 N 1.69 0.54 -0.74 0.00 0.00 -1.33 -2.58 119.26 116.85 3ihp h ALA 665 Ca 0.14 -0.64 -0.03 0.00 0.00 0.00 0.00 54.91 54.37 3ihp h ALA 665 Cb 0.04 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 17.74 3ihp h ALA 665 CO -0.02 0.79 0.34 1.98 0.00 0.00 0.00 179.25 182.34 3ihp h MET 666 N 0.24 1.07 -0.69 0.00 -1.53 -0.20 -2.30 114.93 111.52 3ihp h MET 666 Ca -0.04 -0.17 -0.06 0.00 -3.44 0.00 0.00 59.70 55.99 3ihp h MET 666 Cb 1.39 -0.19 -0.03 0.00 -0.55 0.00 0.00 31.60 32.22 3ihp h MET 666 CO 0.13 0.85 0.21 -0.91 0.14 0.00 0.00 176.91 177.33 3ihp h ASN 667 N 1.04 1.01 0.16 1.39 -0.26 -1.30 -2.58 115.58 115.04 3ihp h ASN 667 Ca 0.25 -0.21 -0.01 0.00 -0.56 0.00 0.00 56.30 55.77 3ihp h ASN 667 Cb 0.14 -0.26 0.00 0.00 -1.06 0.00 0.00 38.32 37.14 3ihp h ASN 667 CO -0.03 0.95 -0.08 -0.25 -1.06 0.00 0.00 177.43 176.97 3ihp h TRP 668 N 1.01 -0.20 -0.52 1.19 7.01 -1.27 -2.45 115.95 120.71 3ihp h TRP 668 Ca 0.22 -0.00 0.03 0.00 2.11 0.00 0.00 58.89 61.24 3ihp h TRP 668 Cb 0.31 0.07 -0.03 0.00 -2.10 0.00 0.00 29.16 27.41 3ihp h TRP 668 CO 0.02 0.04 0.35 -0.39 -2.79 0.00 0.00 178.44 175.67 3ihp h VAL 669 N -0.42 1.07 -0.42 2.65 -1.51 -1.39 0.80 116.25 117.03 3ihp h VAL 669 Ca -0.02 -0.21 -0.07 0.00 -1.23 0.00 0.00 66.70 65.17 3ihp h VAL 669 Cb 0.33 0.40 -0.02 0.00 -2.13 0.00 0.00 31.29 29.87 3ihp h VAL 669 CO 0.04 0.11 -0.01 0.24 -1.23 0.00 0.00 177.57 176.72 3ihp h MET 670 N 0.62 0.69 0.06 5.19 2.86 -1.34 0.16 114.93 123.17 3ihp h MET 670 Ca 0.21 -0.18 -0.24 0.00 -2.06 0.00 0.00 59.70 57.43 3ihp h MET 670 Cb 0.06 -0.08 -0.00 0.00 0.06 0.00 0.00 31.60 31.64 3ihp h MET 670 CO -0.05 0.72 -1.06 0.77 1.06 0.00 0.00 176.91 178.34 3ihp h SER 671 N 0.65 0.41 0.00 1.22 0.02 -0.82 -3.41 113.55 111.61 3ihp h SER 671 Ca 0.13 -0.38 0.00 0.00 -0.84 0.00 0.00 61.79 60.70 3ihp h SER 671 Cb 0.42 -0.13 0.00 0.00 0.14 0.00 0.00 62.40 62.84 3ihp h SER 671 CO 0.02 1.23 0.00 1.41 -1.14 0.00 0.00 176.83 178.35 3ihp n HIS 672 N -3.62 0.00 0.23 3.45 -0.00 0.19 -4.72 115.22 110.75 3ihp n HIS 672 Ca -0.07 -0.13 0.07 0.00 -0.00 0.00 0.00 57.72 57.60 3ihp n HIS 672 Cb 0.92 -0.01 0.56 0.00 -0.00 0.00 0.00 29.99 31.45 3ihp n HIS 672 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 3ihp h MET 673 N 0.00 0.00 -0.00 -0.41 -0.00 -1.15 -2.61 114.93 110.76 3ihp h MET 673 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.70 3ihp h MET 673 Cb 0.20 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 31.80 3ihp h MET 673 CO 0.00 0.19 -0.25 -0.25 -0.00 0.00 0.00 176.91 176.60 3ihp n ASP 674 N -4.05 0.53 -4.71 -0.10 8.00 -1.26 -4.92 116.55 110.04 3ihp n ASP 674 Ca -0.02 -0.37 -0.36 0.00 0.71 0.00 0.00 54.79 54.74 3ihp n ASP 674 Cb 0.27 0.02 0.08 0.00 -0.02 0.00 0.00 41.12 41.47 3ihp n ASP 674 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 3ihp n ASP 675 N -1.15 1.65 -4.78 -2.24 8.00 -0.99 -4.99 116.55 112.05 3ihp n ASP 675 Ca 0.10 0.76 -0.35 0.00 0.71 0.00 0.00 54.79 56.00 3ihp n ASP 675 Cb 0.32 -1.53 -0.02 0.00 -0.02 0.00 0.00 41.12 39.87 3ihp n ASP 675 CO 0.00 0.00 0.00 -2.84 -0.39 0.00 0.00 177.20 173.97 3ihp s PRO 676 N -3.53 3.71 0.27 -0.24 0.02 -1.26 -4.95 135.00 129.03 3ihp s PRO 676 Ca 0.80 1.53 -0.00 0.00 0.02 0.00 0.00 61.00 63.35 3ihp s PRO 676 Cb -0.36 -2.19 0.63 0.00 0.02 0.00 0.00 34.50 32.60 3ihp s PRO 676 CO 0.44 -0.54 1.67 -0.44 -0.33 0.00 0.00 177.00 177.79 3ihp h ASP 677 N 1.67 0.04 0.56 2.53 3.45 -1.94 -1.25 116.42 121.49 3ihp h ASP 677 Ca -0.49 0.17 0.00 0.00 0.43 0.00 0.00 57.03 57.14 3ihp h ASP 677 Cb 1.24 0.23 0.00 0.00 -0.56 0.00 0.00 39.33 40.23 3ihp h ASP 677 CO 0.59 -0.09 0.00 2.22 -1.57 0.00 0.00 179.24 180.39 3ihp n PHE 678 N -5.18 0.00 0.13 4.55 -1.74 -1.26 -2.75 117.46 111.22 3ihp n PHE 678 Ca 0.19 0.00 0.02 0.00 -0.56 0.00 0.00 57.45 57.10 3ihp n PHE 678 Cb 0.60 -0.46 0.01 0.00 1.52 0.00 0.00 39.48 41.16 3ihp n PHE 678 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 3ihp h ALA 679 N 2.66 0.65 -1.80 1.98 0.00 -1.56 -3.38 119.26 117.81 3ihp h ALA 679 Ca 0.00 -0.50 -0.52 0.00 0.00 0.00 0.00 54.91 53.89 3ihp h ALA 679 Cb 0.28 -0.09 -0.36 0.00 0.00 0.00 0.00 17.79 17.62 3ihp h ALA 679 CO 0.00 0.68 -1.03 0.09 0.00 0.00 0.00 179.25 178.99 3ihp n ASN 680 N -3.23 -0.21 -4.81 0.00 3.02 -1.11 -5.05 115.26 103.87 3ihp n ASN 680 Ca 0.02 -2.74 -0.34 0.00 -0.03 0.00 0.00 54.58 51.48 3ihp n ASN 680 Cb 0.75 -0.36 -0.07 0.00 -0.61 0.00 0.00 39.78 39.50 3ihp n ASN 680 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 3ihp s PRO 681 N -0.91 4.29 -0.04 3.52 0.04 -1.22 -4.95 135.00 135.71 3ihp s PRO 681 Ca 0.35 1.08 -0.01 0.00 0.04 0.00 0.00 61.00 62.46 3ihp s PRO 681 Cb 0.17 -2.43 0.03 0.00 0.04 0.00 0.00 34.50 32.30 3ihp s PRO 681 CO -0.13 0.11 0.03 -0.48 0.04 0.00 0.00 177.00 176.57 3ihp s LEU 682 N -2.76 0.61 0.18 -3.56 2.34 -1.26 -5.06 118.68 109.17 3ihp s LEU 682 Ca 0.56 0.01 0.19 0.00 0.06 0.00 0.00 54.13 54.95 3ihp s LEU 682 Cb -0.12 -0.22 0.83 0.00 -0.56 0.00 0.00 46.19 46.12 3ihp s LEU 682 CO 0.17 -0.19 1.57 2.30 -1.06 0.00 0.00 176.35 179.15 3ihp n ILE 683 N 4.84 1.02 0.00 1.48 -6.64 -1.26 -5.14 119.36 113.67 3ihp n ILE 683 Ca -0.13 0.35 0.00 0.00 -1.77 0.00 0.00 62.75 61.20 3ihp n ILE 683 Cb 0.50 -1.26 0.00 0.00 -1.44 0.00 0.00 39.64 37.45 3ihp n ILE 683 CO 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 176.55 174.78 3ihp n LEU 684 N -1.99 0.00 -4.47 7.28 -0.00 -1.26 -5.33 117.00 111.23 3ihp n LEU 684 Ca 0.02 0.00 -0.33 0.00 -0.00 0.00 0.00 56.01 55.70 3ihp n LEU 684 Cb 0.16 0.00 -0.13 0.00 -0.00 0.00 0.00 43.42 43.45 3ihp n LEU 684 CO 0.14 0.00 -0.43 -2.84 -0.00 0.00 0.00 177.39 174.26 3ihp s PRO 698 N 0.00 2.83 0.17 1.47 0.02 -1.26 -5.34 135.00 132.89 3ihp s PRO 698 Ca 0.00 -0.66 0.05 0.00 0.02 0.00 0.00 61.00 60.41 3ihp s PRO 698 Cb 0.00 -2.51 -0.04 0.00 0.02 0.00 0.00 34.50 31.97 3ihp s PRO 698 CO 0.00 0.51 0.14 -1.25 -0.33 0.00 0.00 177.00 176.06 3ihp s PRO 699 N -0.41 2.89 -0.00 5.54 0.05 -1.26 -5.05 135.00 136.76 3ihp s PRO 699 Ca 0.05 -0.88 -0.07 0.00 0.05 0.00 0.00 61.00 60.14 3ihp s PRO 699 Cb -0.12 -2.64 -0.05 0.00 0.05 0.00 0.00 34.50 31.75 3ihp s PRO 699 CO 0.02 0.48 0.27 -2.14 0.05 0.00 0.00 177.00 175.68 3ihp s PRO 700 N -3.14 3.60 0.24 0.56 0.02 -1.26 -5.05 135.00 129.97 3ihp s PRO 700 Ca 0.31 -0.04 0.17 0.00 0.02 0.00 0.00 61.00 61.46 3ihp s PRO 700 Cb -0.10 -3.10 0.05 0.00 0.02 0.00 0.00 34.50 31.37 3ihp s PRO 700 CO 0.23 0.66 1.28 0.93 -0.33 0.00 0.00 177.00 179.77 3ihp h GLU 701 N 4.12 0.00 -0.16 5.54 4.39 -2.00 -2.98 114.58 123.49 3ihp h GLU 701 Ca -0.51 0.00 -0.10 0.00 0.34 0.00 0.00 59.36 59.10 3ihp h GLU 701 Cb 1.20 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.84 3ihp h GLU 701 CO 0.65 0.34 -0.33 0.38 -1.16 0.00 0.00 179.01 178.89 3ihp h ASP 702 N 0.00 0.32 0.33 1.42 3.04 -2.00 -2.97 116.42 116.56 3ihp h ASP 702 Ca -0.04 -0.11 -0.02 0.00 -3.24 0.00 0.00 57.03 53.62 3ihp h ASP 702 Cb 1.34 -0.09 0.00 0.00 -1.04 0.00 0.00 39.33 39.55 3ihp h ASP 702 CO 0.05 0.63 -0.16 0.00 -2.04 0.00 0.00 179.24 177.72 3ihp h VAL 704 N -0.84 0.10 0.00 0.00 2.07 -1.55 -1.16 116.25 114.88 3ihp h VAL 704 Ca -0.05 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.46 3ihp h VAL 704 Cb 0.52 0.10 -0.00 0.00 -1.52 0.00 0.00 31.29 30.39 3ihp h VAL 704 CO 0.07 0.00 -0.07 0.71 0.02 0.00 0.00 177.57 178.31 3ihp h THR 705 N -0.27 1.01 -0.51 2.57 1.35 -1.64 -1.51 112.91 113.92 3ihp h THR 705 Ca 0.16 -0.23 -0.06 0.00 -0.55 0.00 0.00 66.41 65.73 3ihp h THR 705 Cb 0.57 1.13 -0.02 0.00 -1.73 0.00 0.00 68.15 68.10 3ihp h THR 705 CO -0.63 0.07 0.08 0.74 -0.25 0.00 0.00 175.52 175.53 3ihp h THR 706 N 0.00 1.25 0.12 6.82 2.02 -1.15 -1.39 112.91 120.59 3ihp h THR 706 Ca -0.00 -0.93 -0.01 0.00 0.77 0.00 0.00 66.41 66.24 3ihp h THR 706 Cb 0.12 0.87 0.00 0.00 -1.74 0.00 0.00 68.15 67.40 3ihp h THR 706 CO 0.01 0.33 -0.06 0.40 0.37 0.00 0.00 175.52 176.58 3ihp h ILE 707 N 0.72 1.07 -0.78 3.11 2.04 -1.02 -3.05 117.51 119.60 3ihp h ILE 707 Ca 0.16 -0.93 0.17 0.00 1.00 0.00 0.00 64.86 65.26 3ihp h ILE 707 Cb 0.40 1.64 -0.05 0.00 -0.74 0.00 0.00 36.82 38.06 3ihp h ILE 707 CO 0.01 0.22 0.53 0.58 0.00 0.00 0.00 178.15 179.48 3ihp h VAL 708 N -0.61 0.74 0.00 1.67 2.07 -1.30 0.37 116.25 119.19 3ihp h VAL 708 Ca -0.02 -0.12 -0.01 0.00 0.82 0.00 0.00 66.70 67.38 3ihp h VAL 708 Cb 0.48 0.37 -0.00 0.00 -1.52 0.00 0.00 31.29 30.61 3ihp h VAL 708 CO 0.03 0.06 -0.04 0.28 0.02 0.00 0.00 177.57 177.92 3ihp h SER 709 N 0.34 0.00 0.61 0.57 0.02 -1.15 -1.74 113.55 112.20 3ihp h SER 709 Ca 0.39 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.34 3ihp h SER 709 Cb 1.01 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.55 3ihp h SER 709 CO -0.12 0.04 -0.00 0.23 -1.14 0.00 0.00 176.83 175.85 3ihp n MET 710 N -3.22 0.39 0.00 3.45 2.00 0.13 -4.89 117.12 114.98 3ihp n MET 710 Ca -0.01 -0.00 0.00 0.00 0.00 0.00 0.00 57.70 57.69 3ihp n MET 710 Cb 0.25 -1.50 0.00 0.00 0.00 0.00 0.00 33.22 31.97 3ihp n MET 710 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 3ihp n GLY 711 N 1.31 1.88 3.65 3.03 0.00 -0.67 -4.54 105.19 109.85 3ihp n GLY 711 Ca 0.14 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.86 3ihp n GLY 711 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3ihp s PHE 712 N -2.00 2.33 0.75 1.61 0.08 -1.14 -4.81 117.98 114.79 3ihp s PHE 712 Ca 0.00 -0.76 -0.07 0.00 0.12 0.00 0.00 56.93 56.23 3ihp s PHE 712 Cb 0.00 -1.72 0.10 0.00 -0.57 0.00 0.00 43.02 40.83 3ihp s PHE 712 CO 0.00 0.38 1.05 -1.54 -0.10 0.00 0.00 175.22 175.01 3ihp s SER 713 N -3.75 4.41 0.07 1.36 1.04 -1.26 -4.49 113.70 111.09 3ihp s SER 713 Ca 0.27 0.21 -0.17 0.00 0.48 0.00 0.00 55.95 56.74 3ihp s SER 713 Cb 0.08 -0.70 -0.11 0.00 0.10 0.00 0.00 66.02 65.39 3ihp s SER 713 CO 0.14 -1.85 1.38 -0.09 0.98 0.00 0.00 173.24 173.80 3ihp h ARG 714 N -0.74 0.57 -0.76 4.02 2.43 -1.97 -2.47 114.38 115.46 3ihp h ARG 714 Ca -0.42 -0.31 0.04 0.00 -0.81 0.00 0.00 59.98 58.48 3ihp h ARG 714 Cb 1.29 0.02 -0.05 0.00 -0.42 0.00 0.00 29.97 30.80 3ihp h ARG 714 CO 0.51 0.90 0.47 0.22 -1.51 0.00 0.00 179.97 180.56 3ihp h ASP 715 N 0.26 0.76 -0.64 -3.80 -0.00 -1.99 -0.60 116.42 110.41 3ihp h ASP 715 Ca 0.03 0.01 -0.04 0.00 -0.00 0.00 0.00 57.03 57.02 3ihp h ASP 715 Cb 0.81 -0.16 -0.03 0.00 -0.00 0.00 0.00 39.33 39.95 3ihp h ASP 715 CO 0.06 0.52 0.23 1.56 -0.00 0.00 0.00 179.24 181.61 3ihp h GLN 716 N 0.90 0.97 -0.55 0.28 4.20 -1.95 -2.39 115.11 116.58 3ihp h GLN 716 Ca 0.31 -0.19 -0.04 0.00 0.06 0.00 0.00 58.65 58.79 3ihp h GLN 716 Cb 0.06 -0.15 -0.02 0.00 0.30 0.00 0.00 27.48 27.67 3ihp h GLN 716 CO -0.13 0.84 0.19 0.00 -0.67 0.00 0.00 178.83 179.05 3ihp h ALA 717 N 1.09 0.72 -0.48 3.87 0.00 -0.90 -2.51 119.26 121.05 3ihp h ALA 717 Ca 0.21 -0.19 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 3ihp h ALA 717 Cb 0.25 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 3ihp h ALA 717 CO -0.01 0.38 0.20 -0.07 0.00 0.00 0.00 179.25 179.74 3ihp h LEU 718 N 0.77 0.66 -0.46 0.00 3.38 -1.03 -2.53 115.31 116.11 3ihp h LEU 718 Ca 0.18 -0.16 0.04 0.00 0.09 0.00 0.00 57.88 58.02 3ihp h LEU 718 Cb 0.26 -0.17 -0.04 0.00 0.09 0.00 0.00 40.66 40.80 3ihp h LEU 718 CO -0.01 0.65 0.22 0.11 0.09 0.00 0.00 178.44 179.50 3ihp h LYS 719 N 0.64 0.43 0.20 1.13 1.57 -1.27 -1.28 116.57 117.99 3ihp h LYS 719 Ca 0.16 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.92 3ihp h LYS 719 Cb 0.19 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.38 3ihp h LYS 719 CO -0.01 0.29 -0.20 0.00 -0.57 0.00 0.00 179.45 178.95 3ihp h ALA 720 N 1.25 -0.40 -0.80 3.86 0.00 -1.26 -0.71 119.26 121.19 3ihp h ALA 720 Ca 0.20 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.05 3ihp h ALA 720 Cb 0.12 0.29 -0.04 0.00 0.00 0.00 0.00 17.79 18.15 3ihp h ALA 720 CO -0.15 -0.75 0.50 -0.07 0.00 0.00 0.00 179.25 178.78 3ihp h LEU 721 N -0.43 0.94 -1.36 0.00 3.38 -1.31 -1.26 115.31 115.26 3ihp h LEU 721 Ca 0.00 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.92 3ihp h LEU 721 Cb 0.41 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 40.92 3ihp h LEU 721 CO -0.05 0.71 0.00 -0.09 0.09 0.00 0.00 178.44 179.10 3ihp h ARG 722 N 1.09 0.00 0.00 1.13 2.43 -1.03 0.76 114.38 118.76 3ihp h ARG 722 Ca 0.29 0.00 -0.16 0.00 -0.81 0.00 0.00 59.98 59.30 3ihp h ARG 722 Cb -0.08 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 29.45 3ihp h ARG 722 CO -0.06 0.00 -1.24 0.00 -1.51 0.00 0.00 179.97 177.16 3ihp h ALA 723 N 2.05 0.65 -0.73 2.80 0.00 -0.57 -3.39 119.26 120.07 3ihp h ALA 723 Ca 0.00 -0.80 -0.49 0.00 0.00 0.00 0.00 54.91 53.63 3ihp h ALA 723 Cb 0.47 0.20 -0.30 0.00 0.00 0.00 0.00 17.79 18.17 3ihp h ALA 723 CO 0.00 0.90 -0.04 0.25 0.00 0.00 0.00 179.25 180.36 3ihp n THR 724 N -2.97 2.91 -4.12 0.00 -2.24 -0.53 -4.93 114.28 102.40 3ihp n THR 724 Ca -0.07 -3.34 -0.35 0.00 -2.27 0.00 0.00 64.05 58.02 3ihp n THR 724 Cb 0.83 -0.90 -0.05 0.00 -2.10 0.00 0.00 70.33 68.12 3ihp n THR 724 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 3ihp n ASN 725 N -0.91 -2.46 -1.49 3.42 2.85 -1.11 -0.54 115.26 115.01 3ihp n ASN 725 Ca 0.48 -0.91 -0.16 0.00 -0.11 0.00 0.00 54.58 53.87 3ihp n ASN 725 Cb 0.93 -2.09 -0.05 0.00 1.24 0.00 0.00 39.78 39.81 3ihp n ASN 725 CO 0.00 0.00 0.00 0.59 -2.11 0.00 0.00 177.26 175.74 3ihp n ASN 726 N -2.41 -4.95 -4.63 1.20 5.03 0.21 -5.01 115.26 104.70 3ihp n ASN 726 Ca 0.08 0.25 -0.40 0.00 0.87 0.00 0.00 54.58 55.39 3ihp n ASN 726 Cb 0.48 -3.96 -0.07 0.00 -1.02 0.00 0.00 39.78 35.20 3ihp n ASN 726 CO 0.00 0.00 0.00 -0.55 -1.83 0.00 0.00 177.26 174.88 3ihp s SER 727 N -2.61 6.46 0.07 6.41 0.15 0.30 -5.01 113.70 119.47 3ihp s SER 727 Ca 0.00 0.55 -0.37 0.00 0.70 0.00 0.00 55.95 56.84 3ihp s SER 727 Cb 0.00 -2.28 -0.19 0.00 -1.71 0.00 0.00 66.02 61.84 3ihp s SER 727 CO 0.00 -0.25 1.57 0.25 1.20 0.00 0.00 173.24 176.02 3ihp h LEU 728 N 8.51 -1.26 -0.54 3.45 5.85 -1.95 -0.60 115.31 128.77 3ihp h LEU 728 Ca -0.31 0.08 0.09 0.00 0.84 0.00 0.00 57.88 58.58 3ihp h LEU 728 Cb 1.15 0.38 -0.07 0.00 0.37 0.00 0.00 40.66 42.48 3ihp h LEU 728 CO 0.72 -0.73 0.14 -0.33 -0.34 0.00 0.00 178.44 177.91 3ihp h GLU 729 N -1.14 0.29 -0.53 1.25 4.39 -1.98 -1.09 114.58 115.76 3ihp h GLU 729 Ca -0.09 -0.02 -0.09 0.00 0.34 0.00 0.00 59.36 59.50 3ihp h GLU 729 Cb 0.93 -0.06 -0.02 0.00 -0.10 0.00 0.00 28.75 29.50 3ihp h GLU 729 CO 0.06 0.19 -0.01 0.00 -1.16 0.00 0.00 179.01 178.09 3ihp h ARG 730 N 0.29 0.91 -0.59 2.33 3.08 -1.91 -2.07 114.38 116.43 3ihp h ARG 730 Ca 0.27 -0.27 0.01 0.00 0.07 0.00 0.00 59.98 60.06 3ihp h ARG 730 Cb 0.36 -0.09 -0.03 0.00 0.08 0.00 0.00 29.97 30.28 3ihp h ARG 730 CO -0.32 0.91 0.38 0.00 -1.07 0.00 0.00 179.97 179.87 3ihp h ALA 731 N 1.14 0.76 -0.46 0.04 0.00 -0.09 0.11 119.26 120.76 3ihp h ALA 731 Ca 0.16 -0.03 0.02 0.00 0.00 0.00 0.00 54.91 55.06 3ihp h ALA 731 Cb 0.51 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.05 3ihp h ALA 731 CO 0.03 0.15 0.26 0.28 0.00 0.00 0.00 179.25 179.97 3ihp h VAL 732 N 0.77 1.03 -0.59 0.00 2.07 -0.97 -1.38 116.25 117.20 3ihp h VAL 732 Ca 0.22 -0.18 0.03 0.00 0.82 0.00 0.00 66.70 67.60 3ihp h VAL 732 Cb -0.05 0.46 -0.03 0.00 -1.52 0.00 0.00 31.29 30.14 3ihp h VAL 732 CO -0.07 0.10 0.39 0.44 0.02 0.00 0.00 177.57 178.45 3ihp h ASP 733 N 0.53 0.59 0.49 0.57 3.32 -0.97 -2.93 116.42 118.01 3ihp h ASP 733 Ca 0.19 -0.01 -0.02 0.00 0.02 0.00 0.00 57.03 57.20 3ihp h ASP 733 Cb 0.03 -0.14 0.00 0.00 0.22 0.00 0.00 39.33 39.45 3ihp h ASP 733 CO -0.09 0.41 -0.23 -0.25 -1.72 0.00 0.00 179.24 177.35 3ihp h TRP 734 N 0.69 -0.61 -0.52 4.55 7.01 0.14 -2.82 115.95 124.38 3ihp h TRP 734 Ca 0.23 -0.01 -0.09 0.00 2.11 0.00 0.00 58.89 61.13 3ihp h TRP 734 Cb 0.08 0.20 -0.02 0.00 -2.10 0.00 0.00 29.16 27.32 3ihp h TRP 734 CO -0.00 -0.29 -0.02 0.82 -2.79 0.00 0.00 178.44 176.16 3ihp h ILE 735 N -0.89 1.26 -0.80 2.65 2.04 -1.27 0.07 117.51 120.56 3ihp h ILE 735 Ca -0.07 -1.09 -0.04 0.00 1.00 0.00 0.00 64.86 64.66 3ihp h ILE 735 Cb 0.59 0.87 -0.04 0.00 -0.74 0.00 0.00 36.82 37.50 3ihp h ILE 735 CO 0.11 0.39 0.34 -0.26 0.00 0.00 0.00 178.15 178.73 3ihp h PHE 736 N 0.83 1.21 0.00 1.37 -1.00 -1.60 0.47 116.94 118.22 3ihp h PHE 736 Ca 0.15 -0.08 0.00 0.00 2.81 0.00 0.00 57.97 60.85 3ihp h PHE 736 Cb 0.52 -0.37 0.00 0.00 3.61 0.00 0.00 35.95 39.71 3ihp h PHE 736 CO 0.03 0.91 -0.13 -1.13 -1.61 0.00 0.00 178.31 176.38 3ihp n SER 737 N -4.29 0.75 -0.02 2.17 3.41 -0.95 -4.02 113.62 110.67 3ihp n SER 737 Ca 0.07 0.48 0.04 0.00 -0.26 0.00 0.00 58.87 59.20 3ihp n SER 737 Cb 0.18 -0.59 -0.10 0.00 -0.26 0.00 0.00 64.21 63.44 3ihp n SER 737 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 3ihp n HIS 738 N -2.19 0.00 -0.22 7.33 8.25 -0.03 -4.75 115.22 123.61 3ihp n HIS 738 Ca 0.05 0.00 0.03 0.00 -0.26 0.00 0.00 57.72 57.54 3ihp n HIS 738 Cb 0.43 -0.36 0.14 0.00 1.12 0.00 0.00 29.99 31.31 3ihp n HIS 738 CO 0.00 0.00 0.00 -0.84 0.64 0.00 0.00 176.34 176.14 3ihp h ILE 739 N 0.00 0.56 -0.63 1.59 3.07 -0.20 -1.17 117.51 120.72 3ihp h ILE 739 Ca -0.07 -0.08 0.11 0.00 1.55 0.00 0.00 64.86 66.36 3ihp h ILE 739 Cb 0.85 0.30 -0.04 0.00 -0.27 0.00 0.00 36.82 37.66 3ihp h ILE 739 CO 0.00 0.04 0.42 0.44 -1.05 0.00 0.00 178.15 178.01 3ihp h ASP 740 N 0.23 0.38 -0.07 2.16 3.32 -1.84 0.15 116.42 120.75 3ihp h ASP 740 Ca 0.36 0.01 -0.19 0.00 0.02 0.00 0.00 57.03 57.23 3ihp h ASP 740 Cb 0.58 -0.07 0.01 0.00 0.22 0.00 0.00 39.33 40.07 3ihp h ASP 740 CO -0.47 0.22 -0.70 0.44 -1.72 0.00 0.00 179.24 177.01 3ihp h ASP 741 N 0.42 0.73 -0.07 6.45 3.32 -1.57 -3.17 116.42 122.52 3ihp h ASP 741 Ca 0.29 -0.69 -0.04 0.00 0.02 0.00 0.00 57.03 56.61 3ihp h ASP 741 Cb 0.59 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.91 3ihp h ASP 741 CO -0.08 1.31 -0.05 -0.07 -1.72 0.00 0.00 179.24 178.62 3ihp h LEU 742 N 0.21 0.29 -1.12 1.55 3.38 -0.27 -1.96 115.31 117.39 3ihp h LEU 742 Ca -0.07 -0.05 -0.08 0.00 0.09 0.00 0.00 57.88 57.77 3ihp h LEU 742 Cb 1.36 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 42.02 3ihp h LEU 742 CO 0.14 0.39 -0.31 0.44 0.09 0.00 0.00 178.44 179.19 3ihp h ASP 743 N 0.30 0.23 1.23 -0.43 3.32 -0.88 -2.20 116.42 117.99 3ihp h ASP 743 Ca 0.07 -0.08 0.00 0.00 0.02 0.00 0.00 57.03 57.04 3ihp h ASP 743 Cb 0.29 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 39.78 3ihp h ASP 743 CO 0.01 0.53 0.00 0.00 -1.72 0.00 0.00 179.24 178.06 3ihp h ALA 744 N 1.49 1.00 0.00 3.45 0.00 -1.33 0.35 119.26 124.21 3ihp h ALA 744 Ca 0.03 0.00 -0.22 0.00 0.00 0.00 0.00 54.91 54.72 3ihp h ALA 744 Cb 0.65 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.40 3ihp h ALA 744 CO 0.05 0.00 -1.29 0.93 0.00 0.00 0.00 179.25 178.94 3ihp h GLU 745 N 0.00 0.00 -0.37 0.00 5.08 -1.24 -2.70 114.58 115.35 3ihp h GLU 745 Ca 0.00 0.00 -0.12 0.00 -1.00 0.00 0.00 59.36 58.24 3ihp h GLU 745 Cb 0.62 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.85 3ihp h GLU 745 CO 0.00 0.61 -0.27 0.00 -1.00 0.00 0.00 179.01 178.35 3ihp h ALA 746 N 1.14 0.83 0.00 3.43 0.00 -0.87 -3.03 119.26 120.76 3ihp h ALA 746 Ca -0.14 -0.39 -0.10 0.00 0.00 0.00 0.00 54.91 54.28 3ihp h ALA 746 Cb 1.78 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 19.41 3ihp h ALA 746 CO 0.09 0.64 -0.47 0.00 0.00 0.00 0.00 179.25 179.51 3ihp h ALA 747 N 1.04 1.02 -1.71 0.00 0.00 -1.03 -3.41 119.26 115.17 3ihp h ALA 747 Ca 0.08 -0.42 -0.56 0.00 0.00 0.00 0.00 54.91 54.01 3ihp h ALA 747 Cb 0.79 -0.07 -0.06 0.00 0.00 0.00 0.00 17.79 18.44 3ihp h ALA 747 CO 0.06 0.58 1.00 1.41 0.00 0.00 0.00 179.25 182.31 3ihp s MET 748 N -3.66 3.60 0.00 0.00 0.00 -1.02 -5.08 119.30 113.14 3ihp s MET 748 Ca -0.01 0.65 0.00 0.00 0.00 0.00 0.00 55.69 56.33 3ihp s MET 748 Cb 0.12 -3.98 0.00 0.00 0.00 0.00 0.00 34.83 30.96 3ihp s MET 748 CO 0.72 -1.54 0.17 -0.25 0.00 0.00 0.00 175.02 174.11 3ihp n ASP 749 N 8.45 0.33 -4.79 1.11 8.00 -1.26 -4.87 116.55 123.52 3ihp n ASP 749 Ca 0.13 -0.68 -0.37 0.00 0.71 0.00 0.00 54.79 54.58 3ihp n ASP 749 Cb 0.49 0.29 -0.06 0.00 -0.02 0.00 0.00 41.12 41.82 3ihp n ASP 749 CO 0.00 0.00 0.00 -2.16 -0.39 0.00 0.00 177.20 174.65 3ihp s PRO 769 N -0.29 4.03 0.03 -0.24 0.04 -1.26 -5.23 135.00 132.08 3ihp s PRO 769 Ca 0.00 0.24 -0.30 0.00 0.04 0.00 0.00 61.00 60.98 3ihp s PRO 769 Cb 0.00 -3.32 -0.06 0.00 0.04 0.00 0.00 34.50 31.16 3ihp s PRO 769 CO 0.00 0.47 1.37 -1.59 0.04 0.00 0.00 177.00 177.29 3ihp s LYS 770 N -0.30 4.31 0.03 4.56 0.00 -1.26 -5.03 119.74 122.05 3ihp s LYS 770 Ca 0.21 1.96 0.03 0.00 0.00 0.00 0.00 55.97 58.16 3ihp s LYS 770 Cb -0.15 -3.48 -0.02 0.00 0.00 0.00 0.00 37.83 34.18 3ihp s LYS 770 CO 0.09 -0.51 -0.09 0.14 0.00 0.00 0.00 175.35 174.98 3ihp s VAL 771 N 1.99 0.68 -0.12 1.79 -7.23 -1.26 -4.97 120.40 111.28 3ihp s VAL 771 Ca 0.63 -0.81 -0.20 0.00 -1.81 0.00 0.00 61.98 59.79 3ihp s VAL 771 Cb -0.32 -0.66 -0.04 0.00 0.56 0.00 0.00 36.38 35.93 3ihp s VAL 771 CO 0.27 -0.12 0.56 -0.13 -0.31 0.00 0.00 175.10 175.38 3ihp s ARG 772 N -1.02 4.34 0.47 4.82 0.52 -1.26 -5.08 118.95 121.74 3ihp s ARG 772 Ca -0.03 0.59 0.08 0.00 -0.52 0.00 0.00 55.73 55.85 3ihp s ARG 772 Cb -0.07 -3.47 0.01 0.00 0.52 0.00 0.00 34.95 31.95 3ihp s ARG 772 CO 0.00 0.05 0.48 0.34 0.02 0.00 0.00 175.30 176.19 3ihp s ASP 773 N 0.79 5.04 0.00 0.23 -1.08 -1.26 -4.44 116.67 115.95 3ihp s ASP 773 Ca 0.29 -0.84 0.00 0.00 -0.52 0.00 0.00 52.55 51.49 3ihp s ASP 773 Cb -0.16 -0.21 0.00 0.00 -1.46 0.00 0.00 42.92 41.09 3ihp s ASP 773 CO 0.12 -0.88 0.00 0.61 0.52 0.00 0.00 175.17 175.54 3ihp n GLY 774 N -1.75 -0.79 3.76 2.66 0.00 -1.23 -4.95 105.19 102.89 3ihp n GLY 774 Ca 0.05 -1.13 -0.35 0.00 0.00 0.00 0.00 46.02 44.59 3ihp n GLY 774 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3ihp s PRO 775 N -2.00 2.93 -1.25 1.61 0.02 -1.26 -4.38 135.00 130.67 3ihp s PRO 775 Ca 0.00 1.66 -0.05 0.00 0.02 0.00 0.00 61.00 62.64 3ihp s PRO 775 Cb 0.00 -1.94 0.17 0.00 0.02 0.00 0.00 34.50 32.75 3ihp s PRO 775 CO 0.00 -1.20 2.19 0.41 -0.33 0.00 0.00 177.00 178.07 3ihp n GLY 776 N 0.17 5.37 2.85 0.52 0.00 -1.26 -4.89 105.19 107.95 3ihp n GLY 776 Ca 0.12 -2.19 -0.27 0.00 0.00 0.00 0.00 46.02 43.68 3ihp n GLY 776 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3ihp s LYS 777 N -1.72 1.19 0.19 1.61 2.36 -1.26 0.29 119.74 122.40 3ihp s LYS 777 Ca 0.49 -0.41 0.06 0.00 -2.55 0.00 0.00 55.97 53.56 3ihp s LYS 777 Cb 0.17 -1.87 -0.05 0.00 -1.05 0.00 0.00 37.83 35.03 3ihp s LYS 777 CO -0.09 -0.45 -0.12 0.71 1.55 0.00 0.00 175.35 176.96 3ihp s TYR 778 N 1.72 1.58 -0.02 4.03 1.51 0.89 -1.73 117.35 125.32 3ihp s TYR 778 Ca 0.01 -0.66 0.05 0.00 -1.01 0.00 0.00 57.07 55.46 3ihp s TYR 778 Cb -0.15 -0.77 -0.01 0.00 -0.11 0.00 0.00 41.96 40.91 3ihp s TYR 778 CO -0.07 0.24 -0.18 -0.65 -1.11 0.00 0.00 175.55 173.78 3ihp s GLN 779 N -3.69 1.57 0.21 -0.62 -0.21 0.07 -1.20 119.66 115.78 3ihp s GLN 779 Ca 0.21 -0.64 -0.32 0.00 0.02 0.00 0.00 55.36 54.64 3ihp s GLN 779 Cb 0.01 -1.47 -0.11 0.00 1.00 0.00 0.00 33.01 32.44 3ihp s GLN 779 CO 0.05 0.35 1.67 -1.17 -2.12 0.00 0.00 175.29 174.07 3ihp s LEU 780 N -0.29 4.37 -0.06 2.90 2.96 -0.45 -0.63 118.68 127.48 3ihp s LEU 780 Ca 0.04 2.82 -0.03 0.00 -0.22 0.00 0.00 54.13 56.74 3ihp s LEU 780 Cb -0.08 -3.60 -0.03 0.00 0.50 0.00 0.00 46.19 42.98 3ihp s LEU 780 CO 0.00 -0.93 -0.07 0.33 -1.32 0.00 0.00 176.35 174.36 3ihp n PHE 781 N 3.75 0.00 -3.63 5.38 7.35 0.06 -4.83 117.46 125.54 3ihp n PHE 781 Ca 0.14 0.00 -0.13 0.00 -0.76 0.00 0.00 57.45 56.70 3ihp n PHE 781 Cb 0.36 -0.21 -0.06 0.00 0.35 0.00 0.00 39.48 39.92 3ihp n PHE 781 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 3ihp s ALA 782 N -2.11 -1.13 -0.03 3.13 0.00 -0.84 -0.73 121.76 120.05 3ihp s ALA 782 Ca -0.08 0.44 -0.07 0.00 0.00 0.00 0.00 51.96 52.25 3ihp s ALA 782 Cb 0.03 0.34 0.01 0.00 0.00 0.00 0.00 23.12 23.50 3ihp s ALA 782 CO 0.11 -0.46 0.16 -0.59 0.00 0.00 0.00 175.76 174.98 3ihp s PHE 783 N -2.38 -0.06 -0.18 0.00 -0.12 0.16 0.38 117.98 115.78 3ihp s PHE 783 Ca -0.06 0.13 -0.06 0.00 -0.05 0.00 0.00 56.93 56.90 3ihp s PHE 783 Cb -0.01 0.01 -0.03 0.00 -0.63 0.00 0.00 43.02 42.35 3ihp s PHE 783 CO -0.01 -0.22 0.02 0.42 -0.05 0.00 0.00 175.22 175.38 3ihp s ILE 784 N -0.79 4.32 -0.11 -4.49 1.01 0.22 -1.12 121.20 120.23 3ihp s ILE 784 Ca -0.09 -0.20 0.02 0.00 0.00 0.00 0.00 60.65 60.39 3ihp s ILE 784 Cb -0.05 -2.94 -0.00 0.00 0.01 0.00 0.00 42.46 39.48 3ihp s ILE 784 CO 0.01 0.46 -0.20 -0.44 0.00 0.00 0.00 174.94 174.77 3ihp s SER 785 N 0.52 3.43 -0.33 3.58 0.01 -0.16 -0.29 113.70 120.47 3ihp s SER 785 Ca 0.00 -0.48 -0.12 0.00 1.31 0.00 0.00 55.95 56.66 3ihp s SER 785 Cb -0.13 -1.49 -0.02 0.00 0.21 0.00 0.00 66.02 64.59 3ihp s SER 785 CO 0.02 0.16 0.23 -2.28 0.41 0.00 0.00 173.24 171.77 3ihp s HIS 786 N 0.38 3.23 -0.15 2.43 2.46 -1.26 -2.34 115.29 120.04 3ihp s HIS 786 Ca -0.15 -0.16 -0.08 0.00 0.47 0.00 0.00 55.06 55.14 3ihp s HIS 786 Cb -0.17 -2.46 -0.04 0.00 -0.13 0.00 0.00 32.58 29.78 3ihp s HIS 786 CO 0.07 -0.33 0.14 -1.64 -2.47 0.00 0.00 174.74 170.52 3ihp s MET 787 N 1.73 3.73 0.00 2.88 -1.94 0.79 -4.94 119.30 121.54 3ihp s MET 787 Ca 0.06 -0.15 0.00 0.00 -1.71 0.00 0.00 55.69 53.89 3ihp s MET 787 Cb -0.17 -3.28 0.00 0.00 2.01 0.00 0.00 34.83 33.39 3ihp s MET 787 CO 0.11 0.60 0.00 0.41 -0.01 0.00 0.00 175.02 176.13 3ihp n GLY 788 N 2.54 1.38 0.04 -0.03 0.00 -1.26 -2.01 105.19 105.84 3ihp n GLY 788 Ca -0.18 -2.07 0.07 0.00 0.00 0.00 0.00 46.02 43.83 3ihp n GLY 788 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3ihp n THR 789 N -1.56 0.00 -3.75 2.61 -2.24 -1.26 -4.97 114.28 103.10 3ihp n THR 789 Ca 0.00 -0.17 -0.33 0.00 -2.27 0.00 0.00 64.05 61.29 3ihp n THR 789 Cb 0.00 1.02 -0.05 0.00 -2.10 0.00 0.00 70.33 69.20 3ihp n THR 789 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 3ihp s SER 790 N -2.36 6.47 0.35 3.42 0.15 -1.26 -4.40 113.70 116.08 3ihp s SER 790 Ca 0.07 0.52 0.16 0.00 0.70 0.00 0.00 55.95 57.40 3ihp s SER 790 Cb 0.12 -2.07 0.64 0.00 -1.71 0.00 0.00 66.02 63.00 3ihp s SER 790 CO 0.59 0.16 1.73 0.74 1.20 0.00 0.00 173.24 177.67 3ihp h THR 791 N 2.49 1.09 0.00 6.45 2.02 -1.94 -3.38 112.91 119.64 3ihp h THR 791 Ca -0.48 -1.59 -0.01 0.00 0.77 0.00 0.00 66.41 65.11 3ihp h THR 791 Cb 1.18 1.92 -0.00 0.00 -1.74 0.00 0.00 68.15 69.50 3ihp h THR 791 CO 0.70 0.42 -1.99 0.23 0.37 0.00 0.00 175.52 175.26 3ihp n MET 792 N -3.71 0.66 -4.23 6.66 0.00 -1.26 -4.93 117.12 110.31 3ihp n MET 792 Ca -0.01 -0.19 -0.13 0.00 0.00 0.00 0.00 57.70 57.37 3ihp n MET 792 Cb 0.51 -1.53 -0.10 0.00 0.00 0.00 0.00 33.22 32.10 3ihp n MET 792 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 3ihp n GLY 794 N -0.23 -0.44 3.22 0.00 0.00 -1.26 -4.43 105.19 102.05 3ihp n GLY 794 Ca -0.06 -1.25 -0.26 0.00 0.00 0.00 0.00 46.02 44.46 3ihp n GLY 794 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 3ihp s HIS 795 N -2.00 1.74 -0.11 1.61 5.65 -0.85 -4.95 115.29 116.38 3ihp s HIS 795 Ca 0.00 -0.35 -0.03 0.00 0.25 0.00 0.00 55.06 54.93 3ihp s HIS 795 Cb 0.00 -1.08 -0.03 0.00 -1.18 0.00 0.00 32.58 30.29 3ihp s HIS 795 CO 0.00 0.03 0.00 0.71 -0.65 0.00 0.00 174.74 174.83 3ihp s TYR 796 N -0.63 3.14 0.17 3.88 1.51 -1.26 -0.15 117.35 124.02 3ihp s TYR 796 Ca 0.07 0.10 0.01 0.00 -1.01 0.00 0.00 57.07 56.23 3ihp s TYR 796 Cb -0.08 -1.85 -0.04 0.00 -0.11 0.00 0.00 41.96 39.88 3ihp s TYR 796 CO 0.00 0.35 0.03 0.14 -1.11 0.00 0.00 175.55 174.97 3ihp s VAL 797 N -0.54 0.47 0.06 0.71 -7.23 -0.99 -4.73 120.40 108.16 3ihp s VAL 797 Ca 0.09 -1.96 0.04 0.00 -1.81 0.00 0.00 61.98 58.34 3ihp s VAL 797 Cb -0.12 -2.18 -0.03 0.00 0.56 0.00 0.00 36.38 34.62 3ihp s VAL 797 CO 0.02 -0.40 -0.12 0.00 -0.31 0.00 0.00 175.10 174.30 3ihp s HIS 799 N -1.35 2.92 -0.05 0.00 3.76 -0.28 -0.77 115.29 119.53 3ihp s HIS 799 Ca -0.05 -0.30 0.02 0.00 -0.15 0.00 0.00 55.06 54.58 3ihp s HIS 799 Cb -0.10 -1.84 0.01 0.00 1.11 0.00 0.00 32.58 31.76 3ihp s HIS 799 CO 0.01 0.03 -0.10 0.42 -0.85 0.00 0.00 174.74 174.26 3ihp s ILE 800 N -0.03 0.91 -0.31 0.60 1.01 -0.02 -0.66 121.20 122.69 3ihp s ILE 800 Ca -0.01 -0.38 -0.22 0.00 0.00 0.00 0.00 60.65 60.05 3ihp s ILE 800 Cb -0.14 -0.84 -0.00 0.00 0.01 0.00 0.00 42.46 41.50 3ihp s ILE 800 CO 0.03 0.29 0.70 -0.75 0.00 0.00 0.00 174.94 175.22 3ihp s LYS 801 N 0.52 3.89 0.02 2.79 2.20 0.09 -1.42 119.74 127.82 3ihp s LYS 801 Ca -0.10 0.39 0.03 0.00 -0.36 0.00 0.00 55.97 55.94 3ihp s LYS 801 Cb -0.13 -3.74 -0.01 0.00 -1.51 0.00 0.00 37.83 32.44 3ihp s LYS 801 CO 0.02 -0.65 -0.10 0.15 -0.36 0.00 0.00 175.35 174.41 3ihp s LYS 802 N 2.78 0.76 -1.12 4.03 1.02 -0.43 -4.83 119.74 121.96 3ihp s LYS 802 Ca 0.28 -0.53 -0.08 0.00 0.02 0.00 0.00 55.97 55.67 3ihp s LYS 802 Cb -0.14 -0.72 0.06 0.00 -0.52 0.00 0.00 37.83 36.51 3ihp s LYS 802 CO 0.13 0.18 0.36 0.39 -0.92 0.00 0.00 175.35 175.49 3ihp n GLU 803 N 2.34 -2.95 -0.16 1.68 4.71 -1.26 0.16 120.64 125.17 3ihp n GLU 803 Ca -0.16 0.40 0.00 0.00 -0.01 0.00 0.00 57.16 57.39 3ihp n GLU 803 Cb 0.56 -5.06 0.00 0.00 -1.01 0.00 0.00 31.44 25.93 3ihp n GLU 803 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 3ihp n GLY 804 N -1.02 2.27 3.14 0.62 0.00 -1.26 -5.03 105.19 103.91 3ihp n GLY 804 Ca -0.02 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.77 3ihp n GLY 804 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3ihp s ARG 805 N -0.14 1.15 0.33 1.61 3.00 0.12 -5.11 118.95 119.91 3ihp s ARG 805 Ca 0.00 -0.62 -0.27 0.00 -1.00 0.00 0.00 55.73 53.84 3ihp s ARG 805 Cb 0.00 -1.13 -0.09 0.00 0.00 0.00 0.00 34.95 33.72 3ihp s ARG 805 CO 0.00 0.30 1.08 -1.58 0.00 0.00 0.00 175.30 175.10 3ihp s TRP 806 N -0.51 3.45 -0.02 5.12 0.52 -1.26 -1.31 118.94 124.92 3ihp s TRP 806 Ca 0.05 1.68 0.00 0.00 0.02 0.00 0.00 56.10 57.85 3ihp s TRP 806 Cb -0.06 -3.22 0.02 0.00 -1.15 0.00 0.00 33.47 29.06 3ihp s TRP 806 CO 0.00 -0.58 0.01 0.08 0.02 0.00 0.00 176.95 176.48 3ihp s VAL 807 N -1.36 0.06 -0.15 4.03 1.01 -0.51 -1.94 120.40 121.54 3ihp s VAL 807 Ca 0.50 0.10 -0.09 0.00 0.00 0.00 0.00 61.98 62.49 3ihp s VAL 807 Cb -0.28 -0.14 -0.04 0.00 0.00 0.00 0.00 36.38 35.91 3ihp s VAL 807 CO 0.35 0.09 0.16 -0.51 0.00 0.00 0.00 175.10 175.19 3ihp s ILE 808 N 0.75 5.44 -0.36 2.22 2.07 0.60 -0.84 121.20 131.07 3ihp s ILE 808 Ca -0.07 0.25 0.01 0.00 -1.41 0.00 0.00 60.65 59.44 3ihp s ILE 808 Cb -0.10 -3.45 0.10 0.00 0.13 0.00 0.00 42.46 39.14 3ihp s ILE 808 CO -0.02 0.54 0.10 -0.31 -1.91 0.00 0.00 174.94 173.34 3ihp s TYR 809 N -0.43 3.70 -0.59 3.50 1.51 0.05 -1.64 117.35 123.45 3ihp s TYR 809 Ca 0.13 -2.78 -0.07 0.00 -1.01 0.00 0.00 57.07 53.34 3ihp s TYR 809 Cb -0.12 -3.02 0.15 0.00 -0.11 0.00 0.00 41.96 38.86 3ihp s TYR 809 CO 0.02 -0.96 0.44 1.21 -1.11 0.00 0.00 175.55 175.15 3ihp s ASN 810 N 1.23 5.66 0.29 2.29 3.84 0.11 -2.81 114.94 125.54 3ihp s ASN 810 Ca 0.10 -2.43 0.00 0.00 0.21 0.00 0.00 52.86 50.74 3ihp s ASN 810 Cb -0.20 -1.96 0.00 0.00 -0.55 0.00 0.00 41.25 38.53 3ihp s ASN 810 CO -0.07 -0.53 0.00 0.47 -2.79 0.00 0.00 177.10 174.18 3ihp n ASP 811 N 4.16 0.00 0.22 -4.21 9.92 -1.26 0.56 116.55 125.94 3ihp n ASP 811 Ca 0.03 0.00 0.14 0.00 -0.53 0.00 0.00 54.79 54.42 3ihp n ASP 811 Cb 0.41 0.00 0.39 0.00 -0.64 0.00 0.00 41.12 41.28 3ihp n ASP 811 CO 0.00 0.00 0.00 -0.61 0.13 0.00 0.00 177.20 176.72 3ihp h GLN 812 N 0.00 0.00 -5.37 -1.24 4.15 -1.82 0.11 115.11 110.94 3ihp h GLN 812 Ca 0.00 0.00 -0.61 0.00 0.77 0.00 0.00 58.65 58.81 3ihp h GLN 812 Cb 0.00 0.00 -0.12 0.00 0.21 0.00 0.00 27.48 27.57 3ihp h GLN 812 CO 0.00 0.00 -0.15 0.21 -1.93 0.00 0.00 178.83 176.96 3ihp s LYS 813 N -3.36 4.13 -0.21 1.69 2.47 0.19 -4.38 119.74 120.27 3ihp s LYS 813 Ca 0.05 0.22 0.01 0.00 -1.56 0.00 0.00 55.97 54.69 3ihp s LYS 813 Cb 0.07 -3.58 0.05 0.00 -1.46 0.00 0.00 37.83 32.91 3ihp s LYS 813 CO 0.60 -0.15 -0.08 0.08 0.16 0.00 0.00 175.35 175.96 3ihp s VAL 814 N 1.67 1.58 0.04 4.02 1.01 -1.26 0.06 120.40 127.53 3ihp s VAL 814 Ca 0.19 -1.10 0.03 0.00 0.00 0.00 0.00 61.98 61.10 3ihp s VAL 814 Cb -0.15 -1.74 -0.02 0.00 0.00 0.00 0.00 36.38 34.46 3ihp s VAL 814 CO 0.09 0.05 -0.08 0.00 0.00 0.00 0.00 175.10 175.15 3ihp s ALA 816 N -1.23 3.67 -0.05 0.00 0.00 -1.26 -0.29 121.76 122.59 3ihp s ALA 816 Ca -0.08 1.17 0.02 0.00 0.00 0.00 0.00 51.96 53.07 3ihp s ALA 816 Cb -0.09 -3.65 -0.03 0.00 0.00 0.00 0.00 23.12 19.35 3ihp s ALA 816 CO 0.01 -0.97 -0.11 -1.54 0.00 0.00 0.00 175.76 173.15 3ihp s SER 817 N 1.98 4.34 -0.14 0.00 1.04 -0.82 -4.74 113.70 115.36 3ihp s SER 817 Ca 0.71 -0.12 0.17 0.00 0.48 0.00 0.00 55.95 57.18 3ihp s SER 817 Cb -0.39 -1.00 -0.24 0.00 0.10 0.00 0.00 66.02 64.49 3ihp s SER 817 CO 0.31 0.35 0.27 -0.62 0.98 0.00 0.00 173.24 174.53 3ihp n GLU 818 N 2.20 0.67 -3.07 4.02 -0.58 -1.26 -4.28 120.64 118.35 3ihp n GLU 818 Ca -0.17 0.08 -0.30 0.00 -0.42 0.00 0.00 57.16 56.35 3ihp n GLU 818 Cb 0.53 -1.61 -0.04 0.00 -0.57 0.00 0.00 31.44 29.75 3ihp n GLU 818 CO 0.00 0.00 0.00 0.36 -0.48 0.00 0.00 177.13 177.01 3ihp n LYS 819 N -2.82 3.35 -1.83 3.49 0.00 -1.26 -5.02 118.16 114.06 3ihp n LYS 819 Ca -0.27 -4.76 -0.42 0.00 -0.00 0.00 0.00 58.31 52.86 3ihp n LYS 819 Cb 1.10 -2.29 -0.03 0.00 -0.00 0.00 0.00 35.03 33.81 3ihp n LYS 819 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.40 175.26 3ihp s PRO 820 N -3.19 4.17 -1.29 -1.58 0.02 -1.26 -4.81 135.00 127.05 3ihp s PRO 820 Ca 0.44 2.48 -0.11 0.00 0.02 0.00 0.00 61.00 63.83 3ihp s PRO 820 Cb 0.21 -3.12 -0.06 0.00 0.02 0.00 0.00 34.50 31.55 3ihp s PRO 820 CO -0.08 -0.68 2.47 -0.35 -0.33 0.00 0.00 177.00 178.04 3ihp n PRO 821 N 3.99 2.84 0.00 5.54 -0.04 -1.26 -4.68 135.00 141.39 3ihp n PRO 821 Ca 0.15 -1.99 0.02 0.00 -0.04 0.00 0.00 63.50 61.64 3ihp n PRO 821 Cb 0.37 -2.78 0.13 0.00 -0.04 0.00 0.00 33.50 31.17 3ihp n PRO 821 CO 0.00 0.00 0.00 0.36 -0.04 0.00 0.00 175.50 175.82 3ihp n LYS 822 N 4.53 0.29 -0.00 0.54 2.85 -1.26 -1.60 118.16 123.51 3ihp n LYS 822 Ca 0.61 0.00 0.06 0.00 -1.05 0.00 0.00 58.31 57.93 3ihp n LYS 822 Cb 0.24 -1.23 -0.08 0.00 -0.65 0.00 0.00 35.03 33.31 3ihp n LYS 822 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 177.40 176.95 3ihp n ASP 823 N -0.73 0.70 -0.76 -5.58 5.75 -1.26 -3.19 116.55 111.48 3ihp n ASP 823 Ca 0.03 -0.76 0.09 0.00 -0.01 0.00 0.00 54.79 54.14 3ihp n ASP 823 Cb 0.01 1.04 0.11 0.00 -1.03 0.00 0.00 41.12 41.25 3ihp n ASP 823 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 3ihp n LEU 824 N -1.35 2.65 -4.59 -2.12 7.99 -0.62 -1.92 117.00 117.03 3ihp n LEU 824 Ca 0.02 -1.19 -0.29 0.00 -0.01 0.00 0.00 56.01 54.55 3ihp n LEU 824 Cb 0.21 -0.07 0.21 0.00 -0.11 0.00 0.00 43.42 43.66 3ihp n LEU 824 CO 0.27 0.51 0.59 -0.83 -1.51 0.00 0.00 177.39 176.42 3ihp s GLY 825 N -1.37 1.56 0.06 -0.72 0.00 -1.25 -4.55 107.32 101.05 3ihp s GLY 825 Ca 0.24 -0.23 -0.02 0.00 0.00 0.00 0.00 44.72 44.71 3ihp s GLY 825 CO 0.22 0.42 -0.03 2.98 0.00 0.00 0.00 173.10 176.70 3ihp n TYR 826 N -4.51 0.00 -4.15 1.90 9.36 0.60 -4.86 117.16 115.50 3ihp n TYR 826 Ca 0.04 0.00 -0.34 0.00 3.32 0.00 0.00 57.90 60.92 3ihp n TYR 826 Cb 0.56 -0.05 -0.14 0.00 -0.63 0.00 0.00 39.34 39.08 3ihp n TYR 826 CO 0.00 0.00 0.00 0.42 0.22 0.00 0.00 176.86 177.50 3ihp s ILE 827 N -2.08 3.44 -0.00 2.97 1.01 -0.46 -1.70 121.20 124.37 3ihp s ILE 827 Ca -0.03 -0.49 0.02 0.00 0.00 0.00 0.00 60.65 60.16 3ihp s ILE 827 Cb 0.00 -2.53 -0.03 0.00 0.01 0.00 0.00 42.46 39.91 3ihp s ILE 827 CO 0.04 0.45 -0.04 -0.31 0.00 0.00 0.00 174.94 175.08 3ihp s TYR 828 N 1.07 2.96 -0.19 3.97 1.51 0.60 0.71 117.35 127.98 3ihp s TYR 828 Ca 0.01 0.01 0.01 0.00 -1.01 0.00 0.00 57.07 56.09 3ihp s TYR 828 Cb -0.15 -1.63 0.04 0.00 -0.11 0.00 0.00 41.96 40.11 3ihp s TYR 828 CO -0.00 0.41 -0.13 -0.06 -1.11 0.00 0.00 175.55 174.66 3ihp s PHE 829 N -1.02 2.50 -0.19 2.71 0.40 0.16 0.05 117.98 122.60 3ihp s PHE 829 Ca 0.18 -1.59 -0.04 0.00 -0.60 0.00 0.00 56.93 54.88 3ihp s PHE 829 Cb -0.11 -1.70 -0.02 0.00 0.51 0.00 0.00 43.02 41.70 3ihp s PHE 829 CO 0.08 -0.75 -0.04 0.71 0.70 0.00 0.00 175.22 175.92 3ihp s TYR 830 N 1.37 2.97 -0.04 0.36 1.51 0.14 -0.76 117.35 122.90 3ihp s TYR 830 Ca 0.00 -0.62 -0.15 0.00 -1.01 0.00 0.00 57.07 55.28 3ihp s TYR 830 Cb -0.15 -2.03 -0.05 0.00 -0.11 0.00 0.00 41.96 39.61 3ihp s TYR 830 CO -0.09 -0.31 0.42 -1.14 -1.11 0.00 0.00 175.55 173.32 3ihp s GLN 831 N 0.95 4.04 0.41 -0.62 0.74 0.20 0.16 119.66 125.54 3ihp s GLN 831 Ca -0.00 0.40 -0.25 0.00 0.05 0.00 0.00 55.36 55.57 3ihp s GLN 831 Cb -0.15 -3.28 -0.08 0.00 1.10 0.00 0.00 33.01 30.60 3ihp s GLN 831 CO 0.01 0.54 1.14 0.50 -0.55 0.00 0.00 175.29 176.93 3ihp s ARG 832 N -0.60 4.03 0.30 1.67 3.52 0.35 -0.75 118.95 127.47 3ihp s ARG 832 Ca 0.24 1.76 -0.18 0.00 -0.13 0.00 0.00 55.73 57.42 3ihp s ARG 832 Cb -0.16 -2.61 -0.09 0.00 -1.56 0.00 0.00 34.95 30.53 3ihp s ARG 832 CO 0.12 -0.32 0.77 0.14 -0.81 0.00 0.00 175.30 175.21 3ihp s VAL 833 N -1.48 4.57 -1.03 7.11 -7.23 -0.70 -4.85 120.40 116.79 3ihp s VAL 833 Ca 0.58 1.20 0.00 0.00 -1.81 0.00 0.00 61.98 61.95 3ihp s VAL 833 Cb -0.29 -3.73 0.00 0.00 0.56 0.00 0.00 36.38 32.93 3ihp s VAL 833 CO 0.36 -0.04 0.26 0.00 -0.31 0.00 0.00 175.10 175.37