#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3i7q n PHE 2 N 0.00 0.00 -4.54 1.12 3.01 -1.26 -4.67 117.46 111.12 3i7q n PHE 2 Ca 0.00 -0.49 -0.25 0.00 1.01 0.00 0.00 57.45 57.72 3i7q n PHE 2 Cb 0.00 -0.10 -0.10 0.00 -0.01 0.00 0.00 39.48 39.27 3i7q n PHE 2 CO 0.00 0.00 0.00 0.95 1.01 0.00 0.00 176.76 178.72 3i7q s THR 3 N -1.41 1.25 0.00 4.37 -4.23 -1.26 -4.82 115.64 109.54 3i7q s THR 3 Ca 0.16 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.67 3i7q s THR 3 Cb 0.14 -2.68 0.00 0.00 1.34 0.00 0.00 72.50 71.30 3i7q s THR 3 CO 0.01 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.70 3i7q n GLY 4 N -0.86 -0.45 3.58 3.99 0.00 -0.88 -4.66 105.19 105.91 3i7q n GLY 4 Ca -0.06 -1.09 -0.42 0.00 0.00 0.00 0.00 46.02 44.45 3i7q n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3i7q s SER 5 N -4.00 6.53 -0.19 1.61 0.15 -1.26 -1.66 113.70 114.88 3i7q s SER 5 Ca 0.00 0.29 -0.03 0.00 0.70 0.00 0.00 55.95 56.90 3i7q s SER 5 Cb 0.00 -2.39 -0.01 0.00 -1.71 0.00 0.00 66.02 61.90 3i7q s SER 5 CO 0.00 -0.76 -0.06 -0.63 1.20 0.00 0.00 173.24 173.00 3i7q s ILE 6 N 3.12 3.42 -0.11 6.45 1.01 -0.49 -0.41 121.20 134.18 3i7q s ILE 6 Ca 0.31 -0.50 -0.23 0.00 0.00 0.00 0.00 60.65 60.23 3i7q s ILE 6 Cb -0.13 -2.52 -0.03 0.00 0.01 0.00 0.00 42.46 39.79 3i7q s ILE 6 CO 0.18 0.46 0.69 0.54 0.00 0.00 0.00 174.94 176.80 3i7q s VAL 7 N 1.04 5.03 -1.05 2.92 0.11 -0.56 -0.03 120.40 127.86 3i7q s VAL 7 Ca 0.00 1.38 -0.21 0.00 -2.93 0.00 0.00 61.98 60.22 3i7q s VAL 7 Cb -0.15 -4.02 0.07 0.00 -1.53 0.00 0.00 36.38 30.76 3i7q s VAL 7 CO -0.00 0.19 1.44 0.00 -3.33 0.00 0.00 175.10 173.40 3i7q s ALA 8 N 1.23 2.92 0.32 1.54 0.00 -0.26 -0.11 121.76 127.41 3i7q s ALA 8 Ca 0.35 -2.45 -0.27 0.00 0.00 0.00 0.00 51.96 49.59 3i7q s ALA 8 Cb -0.17 -4.47 -0.09 0.00 0.00 0.00 0.00 23.12 18.39 3i7q s ALA 8 CO 0.15 -3.46 1.00 -1.50 0.00 0.00 0.00 175.76 171.95 3i7q s ILE 9 N 4.45 3.91 0.63 0.00 2.07 -0.89 -4.68 121.20 126.69 3i7q s ILE 9 Ca 0.45 1.66 -0.16 0.00 -1.41 0.00 0.00 60.65 61.19 3i7q s ILE 9 Cb -0.00 -3.95 -0.02 0.00 0.13 0.00 0.00 42.46 38.62 3i7q s ILE 9 CO -0.07 0.20 1.12 0.68 -1.91 0.00 0.00 174.94 174.95 3i7q s VAL 10 N -1.48 3.22 -0.61 4.00 -7.23 -1.26 -3.03 120.40 114.01 3i7q s VAL 10 Ca 0.50 0.61 -0.15 0.00 -1.81 0.00 0.00 61.98 61.13 3i7q s VAL 10 Cb -0.23 -3.15 0.15 0.00 0.56 0.00 0.00 36.38 33.71 3i7q s VAL 10 CO 0.29 -0.30 0.56 -0.89 -0.31 0.00 0.00 175.10 174.45 3i7q s THR 11 N -2.19 5.23 0.32 5.32 2.01 -1.26 -4.88 115.64 120.19 3i7q s THR 11 Ca 0.69 -1.78 -0.29 0.00 0.31 0.00 0.00 61.69 60.62 3i7q s THR 11 Cb -0.21 -4.33 -0.10 0.00 0.01 0.00 0.00 72.50 67.87 3i7q s THR 11 CO 0.38 -0.90 1.23 -2.16 -0.69 0.00 0.00 174.62 172.47 3i7q s PRO 12 N 1.20 4.44 0.07 4.92 0.04 -1.26 -4.95 135.00 139.46 3i7q s PRO 12 Ca 0.07 2.07 0.06 0.00 0.04 0.00 0.00 61.00 63.24 3i7q s PRO 12 Cb -0.25 -3.10 -0.03 0.00 0.04 0.00 0.00 34.50 31.17 3i7q s PRO 12 CO -0.00 -0.06 -0.16 -1.64 0.04 0.00 0.00 177.00 175.18 3i7q s MET 13 N -1.70 0.92 0.77 4.56 -1.94 -1.26 -0.75 119.30 119.90 3i7q s MET 13 Ca 0.48 -0.95 -0.13 0.00 -1.71 0.00 0.00 55.69 53.38 3i7q s MET 13 Cb -0.37 -0.99 0.18 0.00 2.01 0.00 0.00 34.83 35.67 3i7q s MET 13 CO 0.49 0.23 0.88 -0.40 -0.01 0.00 0.00 175.02 176.20 3i7q n ASP 14 N 1.40 -0.68 0.28 3.03 5.68 0.06 -4.19 116.55 122.13 3i7q n ASP 14 Ca -0.20 -1.19 0.16 0.00 -0.50 0.00 0.00 54.79 53.05 3i7q n ASP 14 Cb 0.54 -0.72 0.91 0.00 -1.14 0.00 0.00 41.12 40.71 3i7q n ASP 14 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 3i7q h GLU 15 N 0.00 0.00 -0.01 0.11 4.39 -1.97 -1.88 114.58 115.22 3i7q h GLU 15 Ca -0.30 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.40 3i7q h GLU 15 Cb 0.86 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.51 3i7q h GLU 15 CO 0.21 0.00 -0.14 1.63 -1.16 0.00 0.00 179.01 179.55 3i7q n LYS 16 N -3.82 1.23 -0.47 2.33 5.02 -1.26 -4.93 118.16 116.27 3i7q n LYS 16 Ca -0.02 -0.73 0.00 0.00 -2.02 0.00 0.00 58.31 55.54 3i7q n LYS 16 Cb 0.12 -1.48 0.00 0.00 -0.02 0.00 0.00 35.03 33.65 3i7q n LYS 16 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3i7q n GLY 17 N 1.27 0.76 3.90 0.72 0.00 -0.71 -5.06 105.19 106.06 3i7q n GLY 17 Ca 0.15 -0.08 -0.34 0.00 0.00 0.00 0.00 46.02 45.75 3i7q n GLY 17 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3i7q s ASN 18 N -2.08 6.42 0.20 1.61 0.01 -1.26 -4.83 114.94 115.01 3i7q s ASN 18 Ca 0.00 0.43 -0.32 0.00 -0.71 0.00 0.00 52.86 52.26 3i7q s ASN 18 Cb 0.00 -2.04 -0.13 0.00 0.41 0.00 0.00 41.25 39.49 3i7q s ASN 18 CO 0.00 0.27 1.61 0.55 -1.51 0.00 0.00 177.10 178.02 3i7q n VAL 19 N 1.07 0.24 -3.33 1.60 3.14 -1.26 -0.76 118.33 119.03 3i7q n VAL 19 Ca -0.11 -0.06 -0.44 0.00 -2.96 0.00 0.00 64.34 60.76 3i7q n VAL 19 Cb 0.53 -1.74 -0.07 0.00 -1.06 0.00 0.00 33.84 31.50 3i7q n VAL 19 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 3i7q h ARG 21 N 8.81 1.23 -0.26 0.00 2.43 -1.92 -1.70 114.38 122.96 3i7q h ARG 21 Ca -0.28 -0.07 -0.11 0.00 -0.81 0.00 0.00 59.98 58.71 3i7q h ARG 21 Cb 1.11 -0.28 -0.01 0.00 -0.42 0.00 0.00 29.97 30.37 3i7q h ARG 21 CO 0.89 0.81 -0.28 0.00 -1.51 0.00 0.00 179.97 179.88 3i7q h ALA 22 N 1.37 1.02 -0.20 2.80 0.00 -1.99 -1.01 119.26 121.26 3i7q h ALA 22 Ca 0.36 -0.37 -0.19 0.00 0.00 0.00 0.00 54.91 54.71 3i7q h ALA 22 Cb -0.09 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.57 3i7q h ALA 22 CO -0.09 0.59 -0.63 0.77 0.00 0.00 0.00 179.25 179.88 3i7q h SER 23 N 0.46 0.81 -0.61 0.00 0.02 -1.81 -2.85 113.55 109.56 3i7q h SER 23 Ca 0.06 -0.47 -0.05 0.00 -0.84 0.00 0.00 61.79 60.49 3i7q h SER 23 Cb 0.73 -0.23 -0.03 0.00 0.14 0.00 0.00 62.40 63.01 3i7q h SER 23 CO 0.06 1.24 0.17 0.25 -1.14 0.00 0.00 176.83 177.41 3i7q h LEU 24 N 0.52 0.90 -0.58 5.07 5.85 -1.05 -1.72 115.31 124.30 3i7q h LEU 24 Ca -0.01 -0.22 0.01 0.00 0.84 0.00 0.00 57.88 58.50 3i7q h LEU 24 Cb 1.23 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 41.99 3i7q h LEU 24 CO 0.13 0.88 0.38 0.50 -0.34 0.00 0.00 178.44 179.99 3i7q h LYS 25 N 0.88 0.75 0.03 1.25 3.64 -1.21 -0.09 116.57 121.81 3i7q h LYS 25 Ca 0.19 -0.04 -0.00 0.00 -1.27 0.00 0.00 60.65 59.53 3i7q h LYS 25 Cb 0.32 -0.17 0.00 0.00 -0.41 0.00 0.00 32.23 31.97 3i7q h LYS 25 CO -0.00 0.49 -0.01 -0.22 -2.27 0.00 0.00 179.45 177.44 3i7q h LYS 26 N 0.77 -0.04 -0.64 1.90 3.64 -1.26 0.23 116.57 121.17 3i7q h LYS 26 Ca 0.22 0.00 0.07 0.00 -1.27 0.00 0.00 60.65 59.67 3i7q h LYS 26 Cb -0.07 0.01 -0.06 0.00 -0.41 0.00 0.00 32.23 31.70 3i7q h LYS 26 CO -0.06 -0.00 0.33 -0.07 -2.27 0.00 0.00 179.45 177.38 3i7q h LEU 27 N -0.06 0.47 -0.31 5.20 3.38 -1.01 -0.03 115.31 122.94 3i7q h LEU 27 Ca -0.00 0.04 -0.07 0.00 0.09 0.00 0.00 57.88 57.94 3i7q h LEU 27 Cb 0.05 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 3i7q h LEU 27 CO 0.01 0.30 -0.08 0.40 0.09 0.00 0.00 178.44 179.15 3i7q h ILE 28 N 0.61 1.28 -0.89 1.22 2.04 -0.81 -1.10 117.51 119.85 3i7q h ILE 28 Ca 0.30 -1.12 0.00 0.00 1.00 0.00 0.00 64.86 65.04 3i7q h ILE 28 Cb 0.24 1.37 -0.04 0.00 -0.74 0.00 0.00 36.82 37.64 3i7q h ILE 28 CO -0.21 0.36 0.57 0.44 0.00 0.00 0.00 178.15 179.31 3i7q h ASP 29 N 0.38 1.05 -0.60 1.72 3.32 -0.59 -0.59 116.42 121.10 3i7q h ASP 29 Ca 0.08 -0.04 -0.00 0.00 0.02 0.00 0.00 57.03 57.09 3i7q h ASP 29 Cb 0.57 -0.26 -0.03 0.00 0.22 0.00 0.00 39.33 39.83 3i7q h ASP 29 CO 0.03 0.78 0.37 0.22 -1.72 0.00 0.00 179.24 178.92 3i7q h TYR 30 N 1.22 0.79 -0.20 4.55 3.20 -0.74 -0.64 116.97 125.14 3i7q h TYR 30 Ca 0.32 0.00 -0.16 0.00 3.14 0.00 0.00 58.73 62.03 3i7q h TYR 30 Cb -0.10 -0.26 -0.00 0.00 1.54 0.00 0.00 36.73 37.90 3i7q h TYR 30 CO 0.00 0.53 -0.55 0.45 -1.64 0.00 0.00 178.16 176.95 3i7q h HIS 31 N 0.81 0.77 -0.05 -3.82 3.86 -0.45 -1.18 115.15 115.09 3i7q h HIS 31 Ca 0.22 -0.27 0.02 0.00 -1.16 0.00 0.00 60.37 59.18 3i7q h HIS 31 Cb -0.04 -0.14 -0.02 0.00 1.06 0.00 0.00 27.41 28.27 3i7q h HIS 31 CO -0.02 1.02 -0.08 0.28 0.86 0.00 0.00 177.93 179.99 3i7q h VAL 32 N 0.47 0.78 0.00 2.45 2.07 -0.97 -2.83 116.25 118.22 3i7q h VAL 32 Ca 0.01 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.51 3i7q h VAL 32 Cb 1.10 0.78 -0.00 0.00 -1.52 0.00 0.00 31.29 31.65 3i7q h VAL 32 CO 0.11 0.00 -0.07 0.00 0.02 0.00 0.00 177.57 177.63 3i7q h ALA 33 N 0.92 1.09 -0.02 1.67 0.00 -1.02 -3.23 119.26 118.67 3i7q h ALA 33 Ca 0.05 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3i7q h ALA 33 Cb 0.18 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.96 3i7q h ALA 33 CO -0.12 0.09 -0.13 0.43 0.00 0.00 0.00 179.25 179.51 3i7q n SER 34 N -3.30 2.55 0.00 0.00 7.64 -0.45 -4.98 113.62 115.07 3i7q n SER 34 Ca -0.01 -1.77 0.00 0.00 1.01 0.00 0.00 58.87 58.10 3i7q n SER 34 Cb 0.26 0.15 0.00 0.00 -1.01 0.00 0.00 64.21 63.61 3i7q n SER 34 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3i7q n GLY 35 N 1.27 0.48 3.74 0.23 0.00 -1.10 -3.93 105.19 105.88 3i7q n GLY 35 Ca 0.11 -0.58 -0.42 0.00 0.00 0.00 0.00 46.02 45.14 3i7q n GLY 35 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 3i7q n THR 36 N -2.90 1.52 0.07 2.61 -1.04 -1.10 -4.81 114.28 108.62 3i7q n THR 36 Ca 0.00 -0.38 -0.17 0.00 -2.04 0.00 0.00 64.05 61.46 3i7q n THR 36 Cb 0.00 -1.84 -0.08 0.00 -1.82 0.00 0.00 70.33 66.59 3i7q n THR 36 CO 0.00 0.00 0.00 0.28 -0.64 0.00 0.00 175.07 174.71 3i7q h SER 37 N 3.69 0.68 -5.00 8.00 0.02 -1.02 -3.46 113.55 116.45 3i7q h SER 37 Ca -0.48 -0.57 0.05 0.00 -0.84 0.00 0.00 61.79 59.96 3i7q h SER 37 Cb 1.25 -0.21 -0.09 0.00 0.14 0.00 0.00 62.40 63.49 3i7q h SER 37 CO 0.71 1.37 0.28 0.00 -1.14 0.00 0.00 176.83 178.05 3i7q s ALA 38 N -3.20 -1.48 -0.17 3.77 0.00 -1.25 -4.25 121.76 115.18 3i7q s ALA 38 Ca -0.07 0.18 -0.02 0.00 0.00 0.00 0.00 51.96 52.05 3i7q s ALA 38 Cb 0.08 0.79 -0.01 0.00 0.00 0.00 0.00 23.12 23.98 3i7q s ALA 38 CO 0.89 -0.90 -0.10 0.42 0.00 0.00 0.00 175.76 176.07 3i7q s ILE 39 N -3.69 3.18 -0.33 0.00 1.01 -0.31 -1.49 121.20 119.56 3i7q s ILE 39 Ca 0.07 -0.59 -0.22 0.00 0.00 0.00 0.00 60.65 59.91 3i7q s ILE 39 Cb -0.03 -2.38 0.00 0.00 0.01 0.00 0.00 42.46 40.06 3i7q s ILE 39 CO -0.03 0.49 0.72 -0.69 0.00 0.00 0.00 174.94 175.43 3i7q s VAL 40 N 0.80 4.83 -0.21 2.92 1.01 0.84 -0.10 120.40 130.49 3i7q s VAL 40 Ca -0.04 0.89 -0.11 0.00 0.00 0.00 0.00 61.98 62.72 3i7q s VAL 40 Cb -0.15 -4.12 -0.05 0.00 0.00 0.00 0.00 36.38 32.07 3i7q s VAL 40 CO 0.01 -0.29 0.19 -0.55 0.00 0.00 0.00 175.10 174.46 3i7q s SER 41 N 1.73 6.23 -1.26 3.32 0.15 0.74 -2.09 113.70 122.52 3i7q s SER 41 Ca 0.29 0.26 -0.01 0.00 0.70 0.00 0.00 55.95 57.19 3i7q s SER 41 Cb -0.14 -2.12 -0.00 0.00 -1.71 0.00 0.00 66.02 62.04 3i7q s SER 41 CO 0.14 0.10 0.80 0.52 1.20 0.00 0.00 173.24 176.01 3i7q n VAL 42 N 3.87 -5.14 -0.92 4.45 0.31 -1.26 -0.94 118.33 118.71 3i7q n VAL 42 Ca -0.14 -0.54 0.00 0.00 -0.01 0.00 0.00 64.34 63.65 3i7q n VAL 42 Cb 0.52 -4.27 0.00 0.00 -0.91 0.00 0.00 33.84 29.18 3i7q n VAL 42 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3i7q n GLY 43 N -1.42 1.43 0.17 2.92 0.00 -1.26 -4.13 105.19 102.89 3i7q n GLY 43 Ca -0.29 -1.82 -0.07 0.00 0.00 0.00 0.00 46.02 43.85 3i7q n GLY 43 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 3i7q h THR 44 N 0.00 0.98 0.00 2.61 2.02 -1.96 -1.71 112.91 114.84 3i7q h THR 44 Ca 0.00 -0.13 -0.03 0.00 0.77 0.00 0.00 66.41 67.02 3i7q h THR 44 Cb 0.00 0.56 -0.00 0.00 -1.74 0.00 0.00 68.15 66.96 3i7q h THR 44 CO 0.00 0.07 -0.13 0.74 0.37 0.00 0.00 175.52 176.57 3i7q h THR 45 N 0.39 0.29 -0.16 3.16 2.02 -1.85 -2.61 112.91 114.14 3i7q h THR 45 Ca 0.16 -1.00 0.00 0.00 0.77 0.00 0.00 66.41 66.34 3i7q h THR 45 Cb 0.07 1.80 0.00 0.00 -1.74 0.00 0.00 68.15 68.28 3i7q h THR 45 CO -0.12 0.13 0.00 0.61 0.37 0.00 0.00 175.52 176.51 3i7q n GLY 46 N 0.41 -0.23 3.56 2.16 0.00 -0.73 -4.27 105.19 106.09 3i7q n GLY 46 Ca 0.01 -0.17 -0.22 0.00 0.00 0.00 0.00 46.02 45.64 3i7q n GLY 46 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3i7q n GLU 47 N -0.03 -7.16 -0.22 1.61 1.02 -0.98 -4.26 120.64 110.61 3i7q n GLU 47 Ca 0.05 0.81 0.19 0.00 -0.02 0.00 0.00 57.16 58.20 3i7q n GLU 47 Cb 0.14 -5.82 0.52 0.00 -0.02 0.00 0.00 31.44 26.26 3i7q n GLU 47 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 3i7q h SER 48 N -2.32 0.37 -0.39 1.62 4.64 -1.53 -2.29 113.55 113.66 3i7q h SER 48 Ca -0.58 0.04 0.01 0.00 -0.47 0.00 0.00 61.79 60.79 3i7q h SER 48 Cb 1.36 -0.04 -0.02 0.00 -0.31 0.00 0.00 62.40 63.39 3i7q h SER 48 CO 0.54 0.16 0.26 0.00 -0.87 0.00 0.00 176.83 176.92 3i7q h ALA 49 N 1.62 1.78 -0.14 5.18 0.00 -1.88 -3.19 119.26 122.62 3i7q h ALA 49 Ca 0.44 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.33 3i7q h ALA 49 Cb 1.13 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.78 3i7q h ALA 49 CO -0.15 0.19 0.00 0.25 0.00 0.00 0.00 179.25 179.54 3i7q n THR 50 N -4.48 1.00 -4.18 0.00 -2.24 -0.88 -4.91 114.28 98.59 3i7q n THR 50 Ca 0.03 -1.00 -0.35 0.00 -2.27 0.00 0.00 64.05 60.46 3i7q n THR 50 Cb 0.10 0.50 -0.09 0.00 -2.10 0.00 0.00 70.33 68.73 3i7q n THR 50 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 3i7q s LEU 51 N -1.01 3.77 0.78 3.22 1.02 -1.13 -5.03 118.68 120.30 3i7q s LEU 51 Ca 0.09 0.16 -0.11 0.00 0.02 0.00 0.00 54.13 54.29 3i7q s LEU 51 Cb 0.05 -1.90 0.06 0.00 0.02 0.00 0.00 46.19 44.41 3i7q s LEU 51 CO 0.06 0.31 1.09 0.54 0.02 0.00 0.00 176.35 178.37 3i7q s ASN 52 N -0.43 4.62 0.57 2.29 2.20 -1.26 -4.72 114.94 118.20 3i7q s ASN 52 Ca 0.09 1.43 0.26 0.00 -0.94 0.00 0.00 52.86 53.70 3i7q s ASN 52 Cb -0.12 -2.19 1.56 0.00 -2.00 0.00 0.00 41.25 38.49 3i7q s ASN 52 CO 0.02 -1.90 2.10 0.45 -2.94 0.00 0.00 177.10 174.83 3i7q h HIS 53 N -1.04 0.00 -0.06 1.54 3.86 -1.98 0.22 115.15 117.69 3i7q h HIS 53 Ca -0.46 0.00 -0.09 0.00 -1.16 0.00 0.00 60.37 58.65 3i7q h HIS 53 Cb 1.25 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.73 3i7q h HIS 53 CO 0.51 0.00 -0.32 0.22 0.86 0.00 0.00 177.93 179.19 3i7q h ASP 54 N 0.00 0.40 -0.60 2.45 3.58 -1.99 -0.59 116.42 119.66 3i7q h ASP 54 Ca 0.10 -0.65 -0.07 0.00 0.42 0.00 0.00 57.03 56.82 3i7q h ASP 54 Cb 0.47 -0.12 -0.02 0.00 1.72 0.00 0.00 39.33 41.38 3i7q h ASP 54 CO -0.00 0.99 0.10 -0.33 -2.88 0.00 0.00 179.24 177.12 3i7q h GLU 55 N -0.17 1.00 0.09 0.28 5.08 -1.64 -1.60 114.58 117.62 3i7q h GLU 55 Ca -0.02 -0.27 0.02 0.00 -1.00 0.00 0.00 59.36 58.09 3i7q h GLU 55 Cb 0.98 -0.12 -0.05 0.00 0.50 0.00 0.00 28.75 30.06 3i7q h GLU 55 CO 0.07 0.94 -0.46 1.25 -1.00 0.00 0.00 179.01 179.80 3i7q h HIS 56 N 0.90 -1.33 -0.84 4.33 2.76 -0.61 -0.27 115.15 120.10 3i7q h HIS 56 Ca 0.18 0.04 0.01 0.00 -2.20 0.00 0.00 60.37 58.40 3i7q h HIS 56 Cb 0.42 0.57 -0.04 0.00 1.55 0.00 0.00 27.41 29.91 3i7q h HIS 56 CO 0.03 -0.55 0.56 0.00 -1.30 0.00 0.00 177.93 176.67 3i7q h ALA 57 N -0.28 1.42 -0.53 5.26 0.00 -1.06 -2.04 119.26 122.02 3i7q h ALA 57 Ca 0.02 -0.06 0.01 0.00 0.00 0.00 0.00 54.91 54.89 3i7q h ALA 57 Cb 0.71 -0.33 -0.03 0.00 0.00 0.00 0.00 17.79 18.14 3i7q h ALA 57 CO -0.28 0.54 0.34 -0.44 0.00 0.00 0.00 179.25 179.40 3i7q h ASP 58 N 1.12 0.57 -0.18 0.00 5.19 -0.75 -0.92 116.42 121.45 3i7q h ASP 58 Ca 0.31 -0.01 -0.02 0.00 -0.62 0.00 0.00 57.03 56.69 3i7q h ASP 58 Cb -0.10 -0.13 -0.01 0.00 0.18 0.00 0.00 39.33 39.26 3i7q h ASP 58 CO -0.07 0.41 0.02 0.58 -3.12 0.00 0.00 179.24 177.06 3i7q h VAL 59 N 0.69 1.23 -0.52 -1.35 2.07 -0.47 -0.64 116.25 117.27 3i7q h VAL 59 Ca 0.20 -0.77 0.05 0.00 0.82 0.00 0.00 66.70 67.00 3i7q h VAL 59 Cb -0.04 1.40 -0.05 0.00 -1.52 0.00 0.00 31.29 31.08 3i7q h VAL 59 CO -0.06 0.23 0.25 0.58 0.02 0.00 0.00 177.57 178.60 3i7q h VAL 60 N 0.07 0.94 -0.55 2.57 2.07 -1.25 0.85 116.25 120.96 3i7q h VAL 60 Ca 0.05 -0.17 -0.09 0.00 0.82 0.00 0.00 66.70 67.31 3i7q h VAL 60 Cb 0.34 0.40 -0.02 0.00 -1.52 0.00 0.00 31.29 30.49 3i7q h VAL 60 CO 0.01 0.09 -0.01 0.24 0.02 0.00 0.00 177.57 177.92 3i7q h MET 61 N 0.49 0.94 -0.69 1.57 2.07 -1.04 0.38 114.93 118.66 3i7q h MET 61 Ca 0.23 -0.28 -0.07 0.00 -2.07 0.00 0.00 59.70 57.51 3i7q h MET 61 Cb 0.15 -0.09 -0.03 0.00 -1.87 0.00 0.00 31.60 29.76 3i7q h MET 61 CO -0.17 0.94 0.16 1.98 1.07 0.00 0.00 176.91 180.89 3i7q h MET 62 N 0.87 1.11 -0.09 1.72 -1.53 -0.77 -0.80 114.93 115.44 3i7q h MET 62 Ca 0.16 -0.27 -0.00 0.00 -3.44 0.00 0.00 59.70 56.14 3i7q h MET 62 Cb 0.52 -0.14 -0.00 0.00 -0.55 0.00 0.00 31.60 31.43 3i7q h MET 62 CO 0.03 0.99 0.05 1.15 0.14 0.00 0.00 176.91 179.26 3i7q h THR 63 N 1.04 1.09 -0.75 -0.77 2.02 -0.26 -0.37 112.91 114.92 3i7q h THR 63 Ca 0.21 -0.27 0.06 0.00 0.77 0.00 0.00 66.41 67.18 3i7q h THR 63 Cb 0.38 1.12 -0.06 0.00 -1.74 0.00 0.00 68.15 67.85 3i7q h THR 63 CO 0.00 0.08 0.44 -0.07 0.37 0.00 0.00 175.52 176.35 3i7q h LEU 64 N 0.04 0.68 0.41 2.58 3.38 -0.81 0.82 115.31 122.40 3i7q h LEU 64 Ca 0.03 0.02 -0.02 0.00 0.09 0.00 0.00 57.88 58.00 3i7q h LEU 64 Cb 0.09 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 40.73 3i7q h LEU 64 CO -0.00 0.44 -0.20 -0.78 0.09 0.00 0.00 178.44 177.99 3i7q h ASP 65 N 0.81 -0.47 -0.54 -0.43 3.58 -0.83 -1.78 116.42 116.76 3i7q h ASP 65 Ca 0.33 -0.03 -0.02 0.00 0.42 0.00 0.00 57.03 57.73 3i7q h ASP 65 Cb 0.17 0.12 -0.02 0.00 1.72 0.00 0.00 39.33 41.32 3i7q h ASP 65 CO -0.17 -0.27 0.25 -0.07 -2.88 0.00 0.00 179.24 176.10 3i7q h LEU 66 N -0.63 0.71 -0.87 2.28 3.38 -0.95 -2.68 115.31 116.55 3i7q h LEU 66 Ca -0.06 -0.14 0.11 0.00 0.09 0.00 0.00 57.88 57.88 3i7q h LEU 66 Cb 0.47 -0.18 -0.08 0.00 0.09 0.00 0.00 40.66 40.95 3i7q h LEU 66 CO 0.09 0.65 0.51 0.00 0.09 0.00 0.00 178.44 179.78 3i7q h ALA 67 N 1.09 1.27 -6.00 1.53 0.00 -0.82 -3.47 119.26 112.87 3i7q h ALA 67 Ca 0.18 0.04 -0.41 0.00 0.00 0.00 0.00 54.91 54.72 3i7q h ALA 67 Cb 0.13 -0.13 0.07 0.00 0.00 0.00 0.00 17.79 17.86 3i7q h ALA 67 CO -0.02 0.10 -0.77 -3.47 0.00 0.00 0.00 179.25 175.09 3i7q n ASP 68 N -4.73 -3.17 0.00 0.00 2.03 -0.67 -1.30 116.55 108.71 3i7q n ASP 68 Ca 0.15 -0.72 0.00 0.00 0.52 0.00 0.00 54.79 54.75 3i7q n ASP 68 Cb 0.32 -4.43 0.00 0.00 -0.72 0.00 0.00 41.12 36.29 3i7q n ASP 68 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3i7q n GLY 69 N -1.59 0.59 0.19 0.27 0.00 -1.26 -4.89 105.19 98.51 3i7q n GLY 69 Ca -0.16 0.00 0.08 0.00 0.00 0.00 0.00 46.02 45.94 3i7q n GLY 69 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3i7q h ARG 70 N 1.61 0.00 -2.52 1.61 3.08 -1.56 -3.45 114.38 113.15 3i7q h ARG 70 Ca 0.00 0.00 -0.09 0.00 0.07 0.00 0.00 59.98 59.96 3i7q h ARG 70 Cb 0.00 0.00 -0.24 0.00 0.08 0.00 0.00 29.97 29.81 3i7q h ARG 70 CO 0.00 0.24 -0.18 -1.50 -1.07 0.00 0.00 179.97 177.46 3i7q s ILE 71 N -3.24 -0.01 0.49 2.04 2.07 -1.26 -4.96 121.20 116.33 3i7q s ILE 71 Ca 0.04 0.04 -0.22 0.00 -1.41 0.00 0.00 60.65 59.09 3i7q s ILE 71 Cb 0.07 -0.69 -0.06 0.00 0.13 0.00 0.00 42.46 41.90 3i7q s ILE 71 CO 0.68 0.01 1.23 -2.84 -1.91 0.00 0.00 174.94 172.12 3i7q s PRO 72 N 0.86 3.54 -0.07 3.50 0.02 -1.26 -4.87 135.00 136.72 3i7q s PRO 72 Ca -0.05 1.93 0.05 0.00 0.02 0.00 0.00 61.00 62.95 3i7q s PRO 72 Cb -0.05 -2.35 -0.00 0.00 0.02 0.00 0.00 34.50 32.11 3i7q s PRO 72 CO -0.07 -0.78 -0.22 0.08 -0.33 0.00 0.00 177.00 175.68 3i7q s VAL 73 N -1.46 1.84 -0.12 3.83 1.01 -1.26 -1.17 120.40 123.07 3i7q s VAL 73 Ca 0.66 -0.92 0.01 0.00 0.00 0.00 0.00 61.98 61.73 3i7q s VAL 73 Cb -0.33 -1.57 -0.01 0.00 0.00 0.00 0.00 36.38 34.47 3i7q s VAL 73 CO 0.39 0.51 -0.15 -0.63 0.00 0.00 0.00 175.10 175.22 3i7q s ILE 74 N 0.10 2.87 0.01 2.22 1.01 0.85 -0.96 121.20 127.31 3i7q s ILE 74 Ca -0.09 -0.73 -0.20 0.00 0.00 0.00 0.00 60.65 59.62 3i7q s ILE 74 Cb -0.15 -2.18 -0.06 0.00 0.01 0.00 0.00 42.46 40.09 3i7q s ILE 74 CO 0.05 0.54 0.60 0.00 0.00 0.00 0.00 174.94 176.12 3i7q s ALA 75 N 0.26 3.50 0.14 9.38 0.00 -0.79 -0.18 121.76 134.06 3i7q s ALA 75 Ca -0.11 0.04 -0.31 0.00 0.00 0.00 0.00 51.96 51.59 3i7q s ALA 75 Cb -0.16 -2.73 -0.08 0.00 0.00 0.00 0.00 23.12 20.14 3i7q s ALA 75 CO 0.06 0.20 1.38 0.20 0.00 0.00 0.00 175.76 177.60 3i7q s GLY 76 N -0.35 2.07 -0.01 0.00 0.00 -0.11 -0.83 107.32 108.09 3i7q s GLY 76 Ca 0.31 1.13 0.02 0.00 0.00 0.00 0.00 44.72 46.18 3i7q s GLY 76 CO 0.18 2.30 0.89 -1.30 0.00 0.00 0.00 173.10 175.17 3i7q n THR 77 N 3.62 0.18 -2.31 0.90 -2.24 -0.83 -4.87 114.28 108.74 3i7q n THR 77 Ca 0.10 -0.21 -0.37 0.00 -2.27 0.00 0.00 64.05 61.30 3i7q n THR 77 Cb 0.42 0.56 -0.01 0.00 -2.10 0.00 0.00 70.33 69.20 3i7q n THR 77 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 3i7q s GLY 78 N -0.91 2.76 -0.03 3.38 0.00 -1.25 -4.75 107.32 106.52 3i7q s GLY 78 Ca 0.03 0.89 -0.26 0.00 0.00 0.00 0.00 44.72 45.38 3i7q s GLY 78 CO 0.00 1.33 0.56 0.00 0.00 0.00 0.00 173.10 175.00 3i7q s ALA 79 N -1.58 -1.45 -2.13 3.20 0.00 -1.26 -4.92 121.76 113.63 3i7q s ALA 79 Ca 0.63 0.96 0.29 0.00 0.00 0.00 0.00 51.96 53.84 3i7q s ALA 79 Cb -0.27 0.06 1.22 0.00 0.00 0.00 0.00 23.12 24.13 3i7q s ALA 79 CO 0.33 -0.35 1.84 0.27 0.00 0.00 0.00 175.76 177.85 3i7q n ASN 80 N 0.95 0.93 -4.32 0.00 6.94 -1.26 -4.44 115.26 114.07 3i7q n ASN 80 Ca -0.20 -1.13 -0.33 0.00 -0.02 0.00 0.00 54.58 52.90 3i7q n ASN 80 Cb 0.57 0.00 -0.15 0.00 -2.36 0.00 0.00 39.78 37.85 3i7q n ASN 80 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 3i7q s ALA 81 N -2.16 2.58 0.25 -2.53 0.00 -1.26 -4.84 121.76 113.80 3i7q s ALA 81 Ca 0.36 -0.99 -0.05 0.00 0.00 0.00 0.00 51.96 51.29 3i7q s ALA 81 Cb 0.21 -1.26 0.34 0.00 0.00 0.00 0.00 23.12 22.40 3i7q s ALA 81 CO 0.40 0.05 1.87 1.15 0.00 0.00 0.00 175.76 179.23 3i7q h THR 82 N 5.55 1.09 -0.89 0.00 2.02 -1.95 -1.09 112.91 117.64 3i7q h THR 82 Ca -0.30 -0.37 -0.02 0.00 0.77 0.00 0.00 66.41 66.49 3i7q h THR 82 Cb 1.20 -0.09 -0.04 0.00 -1.74 0.00 0.00 68.15 67.48 3i7q h THR 82 CO 0.57 0.20 0.48 0.00 0.37 0.00 0.00 175.52 177.14 3i7q h ALA 83 N 1.41 1.14 -0.31 6.16 0.00 -1.97 -0.57 119.26 125.12 3i7q h ALA 83 Ca 0.39 -0.13 -0.18 0.00 0.00 0.00 0.00 54.91 54.99 3i7q h ALA 83 Cb 0.12 -0.35 -0.00 0.00 0.00 0.00 0.00 17.79 17.55 3i7q h ALA 83 CO -0.16 0.65 -0.50 1.49 0.00 0.00 0.00 179.25 180.73 3i7q h GLU 84 N 1.24 0.89 -0.32 0.00 4.57 -1.76 -0.80 114.58 118.40 3i7q h GLU 84 Ca 0.31 -0.54 0.03 0.00 -1.18 0.00 0.00 59.36 57.98 3i7q h GLU 84 Cb 0.03 0.05 -0.03 0.00 -0.16 0.00 0.00 28.75 28.64 3i7q h GLU 84 CO -0.05 1.18 0.13 0.00 -1.18 0.00 0.00 179.01 179.09 3i7q h ALA 85 N 0.70 0.38 -0.42 2.92 0.00 -0.85 -0.01 119.26 121.97 3i7q h ALA 85 Ca 0.03 0.03 0.01 0.00 0.00 0.00 0.00 54.91 54.97 3i7q h ALA 85 Cb 1.11 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.86 3i7q h ALA 85 CO 0.11 -0.26 0.26 0.82 0.00 0.00 0.00 179.25 180.19 3i7q h ILE 86 N 0.29 1.07 -0.64 0.00 2.04 -1.01 -0.68 117.51 118.59 3i7q h ILE 86 Ca 0.14 -0.18 -0.03 0.00 1.00 0.00 0.00 64.86 65.79 3i7q h ILE 86 Cb 0.09 0.49 -0.03 0.00 -0.74 0.00 0.00 36.82 36.63 3i7q h ILE 86 CO -0.12 0.10 0.28 0.28 0.00 0.00 0.00 178.15 178.69 3i7q h SER 87 N 0.54 0.85 -0.63 1.72 0.02 -0.90 -2.22 113.55 112.93 3i7q h SER 87 Ca 0.16 -0.15 -0.09 0.00 -0.84 0.00 0.00 61.79 60.87 3i7q h SER 87 Cb -0.03 -0.22 -0.02 0.00 0.14 0.00 0.00 62.40 62.27 3i7q h SER 87 CO -0.06 0.77 0.03 0.25 -1.14 0.00 0.00 176.83 176.68 3i7q h LEU 88 N 0.88 1.07 -0.58 5.07 5.85 -0.79 -2.92 115.31 123.89 3i7q h LEU 88 Ca 0.22 -0.29 0.04 0.00 0.84 0.00 0.00 57.88 58.69 3i7q h LEU 88 Cb 0.16 -0.29 -0.05 0.00 0.37 0.00 0.00 40.66 40.85 3i7q h LEU 88 CO -0.02 1.10 0.32 0.74 -0.34 0.00 0.00 178.44 180.24 3i7q h THR 89 N 1.00 0.99 -0.52 1.05 2.02 -0.80 -2.60 112.91 114.05 3i7q h THR 89 Ca 0.18 -0.21 0.08 0.00 0.77 0.00 0.00 66.41 67.23 3i7q h THR 89 Cb 0.53 0.32 -0.03 0.00 -1.74 0.00 0.00 68.15 67.23 3i7q h THR 89 CO 0.03 0.11 0.35 1.56 0.37 0.00 0.00 175.52 177.94 3i7q h GLN 90 N 0.62 0.39 -0.02 6.66 1.08 -1.21 -0.34 115.11 122.28 3i7q h GLN 90 Ca 0.25 -0.02 0.00 0.00 -1.45 0.00 0.00 58.65 57.43 3i7q h GLN 90 Cb 0.12 -0.09 -0.00 0.00 -0.05 0.00 0.00 27.48 27.46 3i7q h GLN 90 CO -0.15 0.26 0.14 0.00 -0.95 0.00 0.00 178.83 178.13 3i7q h ARG 91 N 0.40 0.00 -0.25 1.46 3.08 -1.41 -2.47 114.38 115.20 3i7q h ARG 91 Ca 0.23 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.28 3i7q h ARG 91 Cb 0.41 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.46 3i7q h ARG 91 CO -0.06 0.00 0.00 1.19 -1.07 0.00 0.00 179.97 180.03 3i7q n PHE 92 N -3.09 0.32 -1.66 3.04 3.01 -0.14 -4.88 117.46 114.05 3i7q n PHE 92 Ca -0.02 -0.28 -0.46 0.00 1.01 0.00 0.00 57.45 57.69 3i7q n PHE 92 Cb 0.21 -0.01 -0.04 0.00 -0.01 0.00 0.00 39.48 39.62 3i7q n PHE 92 CO 0.00 0.00 0.00 0.09 1.01 0.00 0.00 176.76 177.86 3i7q n ASN 93 N 0.74 2.89 -1.09 4.37 3.02 -0.93 -2.11 115.26 122.15 3i7q n ASN 93 Ca 0.11 1.10 -0.11 0.00 -0.03 0.00 0.00 54.58 55.65 3i7q n ASN 93 Cb 0.41 -1.40 -0.05 0.00 -0.61 0.00 0.00 39.78 38.13 3i7q n ASN 93 CO 0.00 0.00 0.00 -0.90 -2.62 0.00 0.00 177.26 173.74 3i7q n ASP 94 N 3.09 -3.87 0.21 6.41 5.68 -1.26 -4.83 116.55 121.98 3i7q n ASP 94 Ca 0.16 0.27 0.07 0.00 -0.50 0.00 0.00 54.79 54.80 3i7q n ASP 94 Cb 0.28 -3.28 0.43 0.00 -1.14 0.00 0.00 41.12 37.41 3i7q n ASP 94 CO 0.00 0.00 0.00 0.77 -1.33 0.00 0.00 177.20 176.64 3i7q h SER 95 N 0.00 0.00 0.00 -1.12 4.64 -1.76 -3.47 113.55 111.84 3i7q h SER 95 Ca -0.23 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.09 3i7q h SER 95 Cb 0.88 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.97 3i7q h SER 95 CO 0.33 0.30 0.00 0.61 -0.87 0.00 0.00 176.83 177.20 3i7q n GLY 96 N -0.02 0.40 3.73 -0.77 0.00 -1.26 -5.05 105.19 102.22 3i7q n GLY 96 Ca -0.01 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.66 3i7q n GLY 96 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3i7q s ILE 97 N -2.00 2.33 -0.90 -0.61 -4.36 -1.26 -4.80 121.20 109.60 3i7q s ILE 97 Ca 0.00 0.18 0.23 0.00 -0.26 0.00 0.00 60.65 60.80 3i7q s ILE 97 Cb 0.00 -2.88 -0.10 0.00 1.25 0.00 0.00 42.46 40.73 3i7q s ILE 97 CO 0.00 -0.07 1.16 1.33 0.24 0.00 0.00 174.94 177.60 3i7q n VAL 98 N -2.29 0.04 0.00 8.37 0.24 -0.14 -5.00 118.33 119.56 3i7q n VAL 98 Ca 0.14 -0.06 0.00 0.00 -2.04 0.00 0.00 64.34 62.38 3i7q n VAL 98 Cb 0.50 0.47 0.00 0.00 -1.47 0.00 0.00 33.84 33.33 3i7q n VAL 98 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3i7q n GLY 99 N 1.47 -0.18 3.22 7.63 0.00 -1.26 -4.35 105.19 111.72 3i7q n GLY 99 Ca 0.04 -0.97 -0.24 0.00 0.00 0.00 0.00 46.02 44.85 3i7q n GLY 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3i7q s LEU 101 N -1.18 3.66 -0.20 0.00 2.96 -0.01 -0.24 118.68 123.68 3i7q s LEU 101 Ca 0.06 -0.77 0.01 0.00 -0.22 0.00 0.00 54.13 53.21 3i7q s LEU 101 Cb -0.09 -1.81 0.04 0.00 0.50 0.00 0.00 46.19 44.83 3i7q s LEU 101 CO 0.02 -0.17 -0.13 0.28 -1.32 0.00 0.00 176.35 175.02 3i7q s THR 102 N 1.44 1.78 0.41 3.68 -1.32 0.13 -1.96 115.64 119.80 3i7q s THR 102 Ca 0.02 -1.02 -0.21 0.00 -1.21 0.00 0.00 61.69 59.26 3i7q s THR 102 Cb -0.17 -1.78 -0.11 0.00 -1.51 0.00 0.00 72.50 68.93 3i7q s THR 102 CO 0.00 0.26 0.93 0.54 -2.21 0.00 0.00 174.62 174.15 3i7q s VAL 103 N 1.35 4.39 0.25 5.08 0.11 -1.26 -0.96 120.40 129.35 3i7q s VAL 103 Ca -0.00 1.50 -0.31 0.00 -2.93 0.00 0.00 61.98 60.24 3i7q s VAL 103 Cb -0.16 -3.66 -0.13 0.00 -1.53 0.00 0.00 36.38 30.91 3i7q s VAL 103 CO -0.09 -0.25 1.46 0.35 -3.33 0.00 0.00 175.10 173.24 3i7q n THR 104 N -0.46 0.91 -1.52 5.04 -2.24 -0.72 -4.51 114.28 110.79 3i7q n THR 104 Ca 0.06 -0.23 -0.55 0.00 -2.27 0.00 0.00 64.05 61.06 3i7q n THR 104 Cb 0.53 -1.59 -0.07 0.00 -2.10 0.00 0.00 70.33 67.10 3i7q n THR 104 CO 0.00 0.00 0.00 -2.65 -0.57 0.00 0.00 175.07 171.85 3i7q n PRO 105 N 2.14 0.38 -3.84 -0.78 -0.02 -1.26 -4.93 135.00 126.69 3i7q n PRO 105 Ca 0.11 0.14 -0.29 0.00 -2.02 0.00 0.00 63.50 61.44 3i7q n PRO 105 Cb 0.33 -1.62 -0.04 0.00 -0.02 0.00 0.00 33.50 32.15 3i7q n PRO 105 CO 0.00 0.00 0.00 1.52 1.98 0.00 0.00 175.50 179.00 3i7q s TYR 106 N -0.01 3.50 0.00 6.00 -0.85 -1.26 -4.51 117.35 120.22 3i7q s TYR 106 Ca 0.85 0.28 0.00 0.00 -0.52 0.00 0.00 57.07 57.68 3i7q s TYR 106 Cb -1.12 -1.79 0.00 0.00 0.38 0.00 0.00 41.96 39.43 3i7q s TYR 106 CO 0.54 0.50 0.00 0.98 -1.52 0.00 0.00 175.55 176.06 3i7q n TYR 107 N -0.14 0.00 1.24 -3.49 9.36 -0.64 -4.59 117.16 118.89 3i7q n TYR 107 Ca -0.05 0.00 0.14 0.00 3.32 0.00 0.00 57.90 61.31 3i7q n TYR 107 Cb 0.52 0.00 0.69 0.00 -0.63 0.00 0.00 39.34 39.93 3i7q n TYR 107 CO 0.00 0.00 0.00 0.27 0.22 0.00 0.00 176.86 177.35 3i7q n ASN 108 N 2.45 0.02 -3.75 2.98 0.23 -1.26 -4.98 115.26 110.94 3i7q n ASN 108 Ca 0.00 0.12 -0.32 0.00 -0.53 0.00 0.00 54.58 53.85 3i7q n ASN 108 Cb 0.00 -0.37 0.03 0.00 -2.08 0.00 0.00 39.78 37.36 3i7q n ASN 108 CO 0.00 0.00 0.00 0.54 -0.93 0.00 0.00 177.26 176.87 3i7q n ARG 109 N -1.37 -1.03 -1.36 -3.83 1.74 -1.26 -4.94 116.66 104.61 3i7q n ARG 109 Ca 0.11 0.50 -0.30 0.00 -0.77 0.00 0.00 57.85 57.39 3i7q n ARG 109 Cb 0.28 -3.53 0.12 0.00 -1.02 0.00 0.00 32.46 28.32 3i7q n ARG 109 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 3i7q s PRO 110 N -5.93 1.56 0.92 5.56 0.04 -1.26 -5.04 135.00 130.85 3i7q s PRO 110 Ca 0.36 0.72 -0.13 0.00 0.04 0.00 0.00 61.00 61.99 3i7q s PRO 110 Cb -0.15 -1.85 0.14 0.00 0.04 0.00 0.00 34.50 32.68 3i7q s PRO 110 CO 0.89 -2.00 1.15 -1.54 0.04 0.00 0.00 177.00 175.53 3i7q s SER 111 N -3.64 3.45 0.27 6.66 1.04 -1.26 -4.79 113.70 115.42 3i7q s SER 111 Ca 0.62 0.89 -0.03 0.00 0.48 0.00 0.00 55.95 57.91 3i7q s SER 111 Cb -0.16 -1.41 0.37 0.00 0.10 0.00 0.00 66.02 64.91 3i7q s SER 111 CO 0.56 -2.58 1.92 1.56 0.98 0.00 0.00 173.24 175.67 3i7q h GLN 112 N -1.52 1.19 -0.51 4.02 1.08 -1.96 0.86 115.11 118.27 3i7q h GLN 112 Ca -0.50 -0.07 -0.00 0.00 -1.45 0.00 0.00 58.65 56.63 3i7q h GLN 112 Cb 1.32 -0.27 -0.02 0.00 -0.05 0.00 0.00 27.48 28.46 3i7q h GLN 112 CO 0.60 0.79 0.32 1.49 -0.95 0.00 0.00 178.83 181.07 3i7q h GLU 113 N 1.23 0.69 -0.52 1.46 4.57 -1.99 0.39 114.58 120.41 3i7q h GLU 113 Ca 0.38 -0.06 0.02 0.00 -1.18 0.00 0.00 59.36 58.52 3i7q h GLU 113 Cb -0.02 -0.15 -0.03 0.00 -0.16 0.00 0.00 28.75 28.39 3i7q h GLU 113 CO -0.11 0.49 0.32 0.78 -1.18 0.00 0.00 179.01 179.30 3i7q h GLY 114 N 0.69 0.74 0.85 1.92 0.00 -1.67 -0.45 103.07 105.14 3i7q h GLY 114 Ca 0.18 -0.24 0.03 0.00 0.00 0.00 0.00 47.33 47.30 3i7q h GLY 114 CO -0.04 0.20 0.24 1.41 0.00 0.00 0.00 176.54 178.36 3i7q h LEU 115 N 0.63 0.37 -0.22 3.11 4.07 -0.67 0.97 115.31 123.57 3i7q h LEU 115 Ca 0.21 0.01 0.02 0.00 0.08 0.00 0.00 57.88 58.20 3i7q h LEU 115 Cb 0.01 -0.06 -0.02 0.00 1.08 0.00 0.00 40.66 41.66 3i7q h LEU 115 CO -0.09 0.26 0.07 0.22 -1.08 0.00 0.00 178.44 177.82 3i7q h TYR 116 N 0.48 0.12 -0.51 1.13 3.20 -0.56 -1.66 116.97 119.16 3i7q h TYR 116 Ca 0.18 0.01 -0.09 0.00 3.14 0.00 0.00 58.73 61.97 3i7q h TYR 116 Cb 0.04 -0.02 -0.02 0.00 1.54 0.00 0.00 36.73 38.27 3i7q h TYR 116 CO -0.08 0.05 -0.04 1.96 -1.64 0.00 0.00 178.16 178.41 3i7q h GLN 117 N 0.16 0.89 0.47 1.82 1.08 -0.83 -1.16 115.11 117.55 3i7q h GLN 117 Ca 0.10 -0.27 -0.01 0.00 -1.45 0.00 0.00 58.65 57.01 3i7q h GLN 117 Cb 0.07 -0.09 -0.02 0.00 -0.05 0.00 0.00 27.48 27.39 3i7q h GLN 117 CO -0.11 0.91 -0.50 1.25 -0.95 0.00 0.00 178.83 179.43 3i7q h HIS 118 N 0.82 -1.40 -0.03 2.96 2.76 -0.43 -1.75 115.15 118.08 3i7q h HIS 118 Ca 0.15 0.01 -0.12 0.00 -2.20 0.00 0.00 60.37 58.21 3i7q h HIS 118 Cb 0.54 0.55 -0.01 0.00 1.55 0.00 0.00 27.41 30.03 3i7q h HIS 118 CO 0.03 -0.66 -0.52 0.74 -1.30 0.00 0.00 177.93 176.22 3i7q h PHE 119 N -0.98 0.10 -0.31 5.26 0.05 -1.27 -2.28 116.94 117.50 3i7q h PHE 119 Ca -0.06 -0.03 -0.03 0.00 3.82 0.00 0.00 57.97 61.67 3i7q h PHE 119 Cb 0.86 -0.02 -0.01 0.00 2.00 0.00 0.00 35.95 38.77 3i7q h PHE 119 CO -0.27 0.59 0.10 -0.22 -0.18 0.00 0.00 178.31 178.33 3i7q h LYS 120 N 0.07 0.49 -0.67 1.51 3.64 -1.14 -1.76 116.57 118.70 3i7q h LYS 120 Ca -0.00 -0.11 -0.02 0.00 -1.27 0.00 0.00 60.65 59.25 3i7q h LYS 120 Cb 0.95 -0.07 -0.03 0.00 -0.41 0.00 0.00 32.23 32.67 3i7q h LYS 120 CO 0.07 0.53 0.35 0.00 -2.27 0.00 0.00 179.45 178.13 3i7q h ALA 121 N 0.93 0.86 -0.37 5.00 0.00 -1.18 -0.60 119.26 123.91 3i7q h ALA 121 Ca 0.10 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 3i7q h ALA 121 Cb 0.25 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 3i7q h ALA 121 CO -0.00 0.40 0.18 0.82 0.00 0.00 0.00 179.25 180.64 3i7q h ILE 122 N 0.92 1.17 -0.49 0.00 2.04 -1.29 -3.00 117.51 116.86 3i7q h ILE 122 Ca 0.23 -0.50 -0.09 0.00 1.00 0.00 0.00 64.86 65.50 3i7q h ILE 122 Cb 0.08 0.81 -0.02 0.00 -0.74 0.00 0.00 36.82 36.95 3i7q h ILE 122 CO -0.03 0.18 -0.06 0.00 0.00 0.00 0.00 178.15 178.24 3i7q h ALA 123 N 1.02 0.96 -0.91 1.87 0.00 -1.08 -2.91 119.26 118.23 3i7q h ALA 123 Ca 0.13 -0.31 0.12 0.00 0.00 0.00 0.00 54.91 54.85 3i7q h ALA 123 Cb 0.13 -0.19 -0.07 0.00 0.00 0.00 0.00 17.79 17.66 3i7q h ALA 123 CO -0.02 0.62 0.58 0.93 0.00 0.00 0.00 179.25 181.36 3i7q h GLU 124 N 0.79 0.81 -0.62 0.00 4.39 -0.97 -3.15 114.58 115.83 3i7q h GLU 124 Ca 0.14 -0.05 -0.01 0.00 0.34 0.00 0.00 59.36 59.78 3i7q h GLU 124 Cb 0.56 -0.18 -0.01 0.00 -0.10 0.00 0.00 28.75 29.02 3i7q h GLU 124 CO 0.03 0.53 0.02 0.72 -1.16 0.00 0.00 179.01 179.16 3i7q n HIS 125 N -4.55 2.01 -3.86 4.33 8.25 -1.10 -4.88 115.22 115.42 3i7q n HIS 125 Ca 0.16 -0.72 -0.09 0.00 -0.26 0.00 0.00 57.72 56.81 3i7q n HIS 125 Cb 0.37 -0.51 -0.07 0.00 1.12 0.00 0.00 29.99 30.91 3i7q n HIS 125 CO 0.00 0.00 0.00 -0.08 0.64 0.00 0.00 176.34 176.90 3i7q s THR 126 N -2.69 0.09 -1.33 1.59 -1.32 -1.19 -4.90 115.64 105.90 3i7q s THR 126 Ca 0.52 -1.15 0.21 0.00 -1.21 0.00 0.00 61.69 60.05 3i7q s THR 126 Cb 0.40 -1.53 -0.14 0.00 -1.51 0.00 0.00 72.50 69.71 3i7q s THR 126 CO 0.15 -0.43 0.93 0.47 -2.21 0.00 0.00 174.62 173.54 3i7q n ASP 127 N -0.16 1.34 -4.75 8.08 8.00 -1.26 -4.93 116.55 122.86 3i7q n ASP 127 Ca -0.12 -1.17 -0.41 0.00 0.71 0.00 0.00 54.79 53.80 3i7q n ASP 127 Cb 0.63 0.81 -0.03 0.00 -0.02 0.00 0.00 41.12 42.50 3i7q n ASP 127 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3i7q s LEU 128 N -2.76 4.45 0.33 0.64 1.43 -1.26 -4.99 118.68 116.52 3i7q s LEU 128 Ca 0.11 2.50 -0.28 0.00 -1.03 0.00 0.00 54.13 55.43 3i7q s LEU 128 Cb 0.16 -3.63 -0.13 0.00 0.03 0.00 0.00 46.19 42.63 3i7q s LEU 128 CO 0.73 -0.45 1.28 -2.65 0.23 0.00 0.00 176.35 175.48 3i7q n PRO 129 N 1.59 2.05 -4.78 1.29 -0.02 -1.26 -4.86 135.00 129.01 3i7q n PRO 129 Ca 0.02 0.72 -0.33 0.00 -2.02 0.00 0.00 63.50 61.89 3i7q n PRO 129 Cb 0.43 -2.29 -0.15 0.00 -0.02 0.00 0.00 33.50 31.46 3i7q n PRO 129 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 3i7q s GLN 130 N -1.69 3.24 -0.24 -0.52 -1.52 0.10 -0.92 119.66 118.11 3i7q s GLN 130 Ca 0.57 -0.76 -0.07 0.00 -1.95 0.00 0.00 55.36 53.16 3i7q s GLN 130 Cb -0.59 -2.55 -0.02 0.00 -0.22 0.00 0.00 33.01 29.63 3i7q s GLN 130 CO 0.61 0.13 0.04 0.42 -0.25 0.00 0.00 175.29 176.24 3i7q s ILE 131 N 0.53 4.11 0.46 1.08 1.01 0.67 -0.97 121.20 128.09 3i7q s ILE 131 Ca -0.11 -0.24 -0.22 0.00 0.00 0.00 0.00 60.65 60.09 3i7q s ILE 131 Cb -0.16 -2.91 -0.08 0.00 0.01 0.00 0.00 42.46 39.32 3i7q s ILE 131 CO 0.04 0.36 1.08 -0.76 0.00 0.00 0.00 174.94 175.66 3i7q s LEU 132 N 1.57 3.95 -0.14 2.97 1.43 -0.32 -0.70 118.68 127.44 3i7q s LEU 132 Ca 0.06 2.06 -0.01 0.00 -1.03 0.00 0.00 54.13 55.21 3i7q s LEU 132 Cb -0.15 -4.40 0.04 0.00 0.03 0.00 0.00 46.19 41.71 3i7q s LEU 132 CO 0.02 -0.78 -0.01 -0.47 0.23 0.00 0.00 176.35 175.34 3i7q s TYR 133 N -1.78 1.16 -0.23 0.29 5.04 -0.14 0.28 117.35 121.98 3i7q s TYR 133 Ca 0.65 -0.70 -0.05 0.00 -2.44 0.00 0.00 57.07 54.53 3i7q s TYR 133 Cb -0.21 -1.06 -0.01 0.00 0.35 0.00 0.00 41.96 41.02 3i7q s TYR 133 CO 0.26 -0.51 -0.02 1.21 -1.34 0.00 0.00 175.55 175.14 3i7q s ASN 134 N 1.81 4.47 -0.43 4.32 2.47 -0.36 -1.75 114.94 125.46 3i7q s ASN 134 Ca 0.02 -0.35 0.07 0.00 0.42 0.00 0.00 52.86 53.02 3i7q s ASN 134 Cb -0.15 -1.78 0.24 0.00 -1.45 0.00 0.00 41.25 38.12 3i7q s ASN 134 CO -0.07 -0.02 0.67 0.55 -3.72 0.00 0.00 177.10 174.51 3i7q n VAL 135 N 4.81 -0.41 -0.21 -5.21 3.14 -1.26 -0.55 118.33 118.64 3i7q n VAL 135 Ca -0.18 -2.90 0.26 0.00 -2.96 0.00 0.00 64.34 58.57 3i7q n VAL 135 Cb 0.51 -0.46 0.66 0.00 -1.06 0.00 0.00 33.84 33.50 3i7q n VAL 135 CO 0.00 0.00 0.00 -0.65 -6.46 0.00 0.00 176.83 169.72 3i7q h PRO 136 N 4.05 0.11 0.00 1.45 0.11 -1.88 0.46 132.00 136.30 3i7q h PRO 136 Ca -0.02 -0.01 -0.04 0.00 0.11 0.00 0.00 66.00 66.04 3i7q h PRO 136 Cb 0.95 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 32.03 3i7q h PRO 136 CO 0.40 0.08 -0.19 0.66 -0.21 0.00 0.00 178.00 178.73 3i7q h SER 137 N 0.12 0.00 0.17 -2.05 4.64 -1.92 -0.86 113.55 113.65 3i7q h SER 137 Ca 0.45 0.00 -0.32 0.00 -0.47 0.00 0.00 61.79 61.45 3i7q h SER 137 Cb 1.60 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 63.63 3i7q h SER 137 CO -0.07 0.19 -2.13 0.54 -0.87 0.00 0.00 176.83 174.49 3i7q n ARG 138 N -3.74 0.67 -0.03 4.77 1.74 0.12 -4.68 116.66 115.51 3i7q n ARG 138 Ca -0.02 0.08 0.04 0.00 -0.77 0.00 0.00 57.85 57.19 3i7q n ARG 138 Cb 0.30 -1.61 -0.13 0.00 -1.02 0.00 0.00 32.46 29.99 3i7q n ARG 138 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 3i7q n THR 139 N -2.82 0.31 -0.98 0.55 -2.24 -1.01 -4.79 114.28 103.29 3i7q n THR 139 Ca -0.26 -0.48 0.00 0.00 -2.27 0.00 0.00 64.05 61.04 3i7q n THR 139 Cb 1.09 -0.09 0.00 0.00 -2.10 0.00 0.00 70.33 69.23 3i7q n THR 139 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3i7q n GLY 140 N 1.65 0.48 3.10 3.38 0.00 -0.35 -1.63 105.19 111.82 3i7q n GLY 140 Ca -0.10 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.85 3i7q n GLY 140 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3i7q s ASP 142 N -2.71 3.55 -0.44 0.00 -1.08 -1.26 -3.72 116.67 111.01 3i7q s ASP 142 Ca 0.04 -1.11 -0.28 0.00 -0.52 0.00 0.00 52.55 50.68 3i7q s ASP 142 Cb 0.05 -0.96 -0.01 0.00 -1.46 0.00 0.00 42.92 40.54 3i7q s ASP 142 CO -0.09 -0.28 1.75 -0.22 0.52 0.00 0.00 175.17 176.86 3i7q s LEU 143 N 1.57 3.44 0.45 -1.34 2.96 -1.26 -4.98 118.68 119.51 3i7q s LEU 143 Ca -0.03 0.88 -0.12 0.00 -0.22 0.00 0.00 54.13 54.64 3i7q s LEU 143 Cb -0.18 -3.17 -0.07 0.00 0.50 0.00 0.00 46.19 43.28 3i7q s LEU 143 CO -0.08 -1.90 0.84 -0.76 -1.32 0.00 0.00 176.35 173.13 3i7q s LEU 144 N 7.40 3.74 0.30 -0.68 1.43 -1.26 -4.85 118.68 124.77 3i7q s LEU 144 Ca 0.72 1.25 0.06 0.00 -1.03 0.00 0.00 54.13 55.13 3i7q s LEU 144 Cb -0.17 -4.15 0.76 0.00 0.03 0.00 0.00 46.19 42.66 3i7q s LEU 144 CO 0.29 -0.48 1.74 -0.65 0.23 0.00 0.00 176.35 177.49 3i7q h PRO 145 N 1.06 0.60 -0.54 1.29 0.11 -1.95 -0.50 132.00 132.07 3i7q h PRO 145 Ca -0.47 -0.04 0.07 0.00 0.11 0.00 0.00 66.00 65.67 3i7q h PRO 145 Cb 1.19 -0.14 -0.06 0.00 0.11 0.00 0.00 31.00 32.10 3i7q h PRO 145 CO 0.63 0.40 0.22 1.49 -0.21 0.00 0.00 178.00 180.52 3i7q h GLU 146 N 0.62 0.40 -0.14 1.05 4.81 -1.93 0.91 114.58 120.30 3i7q h GLU 146 Ca 0.59 -0.02 -0.16 0.00 -0.13 0.00 0.00 59.36 59.63 3i7q h GLU 146 Cb 1.01 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 30.30 3i7q h GLU 146 CO -0.44 0.26 -0.59 1.15 -0.73 0.00 0.00 179.01 178.67 3i7q h THR 147 N 0.41 1.34 -0.78 0.32 2.02 -1.51 -2.19 112.91 112.53 3i7q h THR 147 Ca 0.26 -1.89 0.00 0.00 0.77 0.00 0.00 66.41 65.55 3i7q h THR 147 Cb 0.26 1.88 -0.04 0.00 -1.74 0.00 0.00 68.15 68.51 3i7q h THR 147 CO -0.24 0.58 0.49 0.58 0.37 0.00 0.00 175.52 177.29 3i7q h VAL 148 N 0.34 1.21 -0.72 3.16 2.07 -0.63 -1.47 116.25 120.21 3i7q h VAL 148 Ca -0.00 -0.44 0.05 0.00 0.82 0.00 0.00 66.70 67.13 3i7q h VAL 148 Cb 1.12 0.10 -0.05 0.00 -1.52 0.00 0.00 31.29 30.94 3i7q h VAL 148 CO 0.10 0.22 0.43 1.23 0.02 0.00 0.00 177.57 179.57 3i7q h GLY 149 N 1.06 1.06 1.01 2.17 0.00 -0.48 0.27 103.07 108.16 3i7q h GLY 149 Ca 0.28 -0.31 -0.05 0.00 0.00 0.00 0.00 47.33 47.25 3i7q h GLY 149 CO -0.06 0.22 0.16 3.21 0.00 0.00 0.00 176.54 180.08 3i7q h ARG 150 N 0.80 0.93 -0.02 4.80 3.08 -0.97 -3.08 114.38 119.93 3i7q h ARG 150 Ca 0.31 -0.21 -0.14 0.00 0.07 0.00 0.00 59.98 60.00 3i7q h ARG 150 Cb 0.13 -0.13 -0.02 0.00 0.08 0.00 0.00 29.97 30.03 3i7q h ARG 150 CO -0.15 0.85 -0.64 -0.07 -1.07 0.00 0.00 179.97 178.89 3i7q h LEU 151 N 0.85 0.10 -2.38 3.04 3.38 -0.85 -3.06 115.31 116.38 3i7q h LEU 151 Ca 0.19 -0.06 0.03 0.00 0.09 0.00 0.00 57.88 58.13 3i7q h LEU 151 Cb 0.32 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 41.04 3i7q h LEU 151 CO -0.00 0.71 0.13 0.00 0.09 0.00 0.00 178.44 179.36 3i7q h ALA 152 N 1.29 1.59 0.00 1.53 0.00 -0.85 -0.68 119.26 122.14 3i7q h ALA 152 Ca -0.01 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3i7q h ALA 152 Cb 1.14 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.94 3i7q h ALA 152 CO 0.09 -0.18 0.00 1.63 0.00 0.00 0.00 179.25 180.79 3i7q n LYS 153 N -3.65 0.22 -2.35 0.00 5.02 -1.15 -4.69 118.16 111.56 3i7q n LYS 153 Ca -0.01 0.32 -0.42 0.00 -2.02 0.00 0.00 58.31 56.18 3i7q n LYS 153 Cb 0.23 -1.83 -0.03 0.00 -0.02 0.00 0.00 35.03 33.38 3i7q n LYS 153 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3i7q s VAL 154 N -3.21 3.93 0.23 -0.18 1.01 -0.26 -4.94 120.40 116.99 3i7q s VAL 154 Ca 0.07 1.34 -0.07 0.00 0.00 0.00 0.00 61.98 63.33 3i7q s VAL 154 Cb 0.11 -3.86 0.22 0.00 0.00 0.00 0.00 36.38 32.85 3i7q s VAL 154 CO 0.49 0.05 1.68 0.50 0.00 0.00 0.00 175.10 177.81 3i7q h LYS 155 N 7.26 0.21 -0.68 2.72 3.64 -1.87 -2.29 116.57 125.56 3i7q h LYS 155 Ca -0.39 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 58.98 3i7q h LYS 155 Cb 1.19 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.96 3i7q h LYS 155 CO 0.86 0.14 0.00 0.27 -2.27 0.00 0.00 179.45 178.45 3i7q n ASN 156 N -5.20 4.03 -4.52 4.20 2.04 -1.26 -4.72 115.26 109.83 3i7q n ASN 156 Ca 0.12 -2.10 -0.43 0.00 -0.44 0.00 0.00 54.58 51.73 3i7q n ASN 156 Cb 0.42 -0.48 -0.06 0.00 -2.53 0.00 0.00 39.78 37.13 3i7q n ASN 156 CO 0.00 0.00 0.00 -0.63 -0.44 0.00 0.00 177.26 176.19 3i7q s ILE 157 N -1.19 4.75 -0.87 1.53 1.01 -0.86 0.03 121.20 125.60 3i7q s ILE 157 Ca 0.47 0.17 0.12 0.00 0.00 0.00 0.00 60.65 61.41 3i7q s ILE 157 Cb 0.26 -4.27 -0.05 0.00 0.01 0.00 0.00 42.46 38.41 3i7q s ILE 157 CO 0.30 -0.68 0.61 2.30 0.00 0.00 0.00 174.94 177.47 3i7q n ILE 158 N 5.95 0.00 -0.86 2.92 -6.64 -0.15 -4.74 119.36 115.85 3i7q n ILE 158 Ca -0.01 -0.32 0.00 0.00 -1.77 0.00 0.00 62.75 60.65 3i7q n ILE 158 Cb 0.48 1.09 0.00 0.00 -1.44 0.00 0.00 39.64 39.76 3i7q n ILE 158 CO 0.00 0.00 0.00 0.61 -1.77 0.00 0.00 176.55 175.39 3i7q n GLY 159 N 1.09 -1.24 2.97 3.28 0.00 -1.24 -1.16 105.19 108.89 3i7q n GLY 159 Ca 0.04 -0.98 -0.13 0.00 0.00 0.00 0.00 46.02 44.95 3i7q n GLY 159 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 3i7q s ILE 160 N -2.28 -0.02 -0.41 -0.61 2.07 -0.11 -1.18 121.20 118.66 3i7q s ILE 160 Ca 0.00 0.06 -0.16 0.00 -1.41 0.00 0.00 60.65 59.14 3i7q s ILE 160 Cb 0.00 -0.20 0.02 0.00 0.13 0.00 0.00 42.46 42.41 3i7q s ILE 160 CO 0.00 0.02 0.37 0.00 -1.91 0.00 0.00 174.94 173.43 3i7q s ARG 161 N 0.42 3.05 -0.45 3.50 1.04 0.14 -0.51 118.95 126.14 3i7q s ARG 161 Ca -0.03 -0.87 -0.16 0.00 -1.04 0.00 0.00 55.73 53.63 3i7q s ARG 161 Cb -0.04 -3.97 0.05 0.00 -2.04 0.00 0.00 34.95 28.95 3i7q s ARG 161 CO -0.02 -0.80 0.39 -2.00 -0.04 0.00 0.00 175.30 172.83 3i7q s GLU 162 N 1.92 3.00 -0.16 3.89 -6.30 0.33 -1.23 118.70 120.15 3i7q s GLU 162 Ca 0.09 -1.15 0.16 0.00 -2.50 0.00 0.00 54.97 51.56 3i7q s GLU 162 Cb -0.18 -4.07 0.60 0.00 0.00 0.00 0.00 34.13 30.48 3i7q s GLU 162 CO 0.12 -0.94 1.50 0.00 0.02 0.00 0.00 175.26 175.97 3i7q n ALA 163 N 5.30 3.11 0.21 6.30 0.00 0.29 -0.82 120.51 134.89 3i7q n ALA 163 Ca -0.11 -1.99 0.05 0.00 0.00 0.00 0.00 53.44 51.39 3i7q n ALA 163 Cb 0.45 -0.81 0.45 0.00 0.00 0.00 0.00 19.45 19.54 3i7q n ALA 163 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 3i7q h THR 164 N 2.62 1.03 0.00 0.00 1.35 -1.91 -3.44 112.91 112.57 3i7q h THR 164 Ca 0.00 -1.09 0.00 0.00 -0.55 0.00 0.00 66.41 64.77 3i7q h THR 164 Cb 1.48 1.62 0.00 0.00 -1.73 0.00 0.00 68.15 69.52 3i7q h THR 164 CO 0.26 0.29 0.00 0.61 -0.25 0.00 0.00 175.52 176.43 3i7q n GLY 165 N -0.45 0.67 3.46 5.82 0.00 -1.26 -4.98 105.19 108.45 3i7q n GLY 165 Ca -0.02 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.57 3i7q n GLY 165 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3i7q s ASN 166 N -2.56 6.24 0.31 1.61 3.84 -1.26 -4.93 114.94 118.18 3i7q s ASN 166 Ca 0.00 -0.84 0.26 0.00 0.21 0.00 0.00 52.86 52.48 3i7q s ASN 166 Cb 0.00 -2.36 0.82 0.00 -0.55 0.00 0.00 41.25 39.16 3i7q s ASN 166 CO 0.00 -1.13 1.75 -0.07 -2.79 0.00 0.00 177.10 174.86 3i7q h LEU 167 N 10.43 0.00 -2.42 3.21 3.38 -1.98 -2.47 115.31 125.47 3i7q h LEU 167 Ca -0.28 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.69 3i7q h LEU 167 Cb 1.08 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.83 3i7q h LEU 167 CO 1.06 0.00 -0.03 0.71 0.09 0.00 0.00 178.44 180.27 3i7q h THR 168 N 0.00 0.27 0.00 0.22 1.35 -2.02 -2.80 112.91 109.92 3i7q h THR 168 Ca 0.00 -0.19 -0.05 0.00 -0.55 0.00 0.00 66.41 65.62 3i7q h THR 168 Cb 0.68 1.15 -0.01 0.00 -1.73 0.00 0.00 68.15 68.24 3i7q h THR 168 CO 0.00 0.03 -0.22 0.03 -0.25 0.00 0.00 175.52 175.11 3i7q h ARG 169 N 0.00 0.00 0.10 4.72 2.47 -1.87 -2.82 114.38 116.99 3i7q h ARG 169 Ca -0.00 0.00 0.02 0.00 -1.26 0.00 0.00 59.98 58.74 3i7q h ARG 169 Cb 0.14 0.00 -0.04 0.00 -1.65 0.00 0.00 29.97 28.42 3i7q h ARG 169 CO 0.00 0.22 -0.32 0.28 0.56 0.00 0.00 179.97 180.72 3i7q h VAL 170 N 0.00 0.32 0.00 2.04 2.07 -1.71 -0.83 116.25 118.14 3i7q h VAL 170 Ca -0.00 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.46 3i7q h VAL 170 Cb 0.41 0.32 -0.01 0.00 -1.52 0.00 0.00 31.29 30.49 3i7q h VAL 170 CO 0.03 0.00 -0.57 0.78 0.02 0.00 0.00 177.57 177.83 3i7q h ASN 171 N -0.53 0.00 -0.62 0.57 2.35 -1.76 -0.80 115.58 114.79 3i7q h ASN 171 Ca 0.04 0.00 -0.06 0.00 -0.55 0.00 0.00 56.30 55.72 3i7q h ASN 171 Cb 0.57 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.91 3i7q h ASN 171 CO -0.20 0.23 0.16 1.56 -1.65 0.00 0.00 177.43 177.53 3i7q h GLN 172 N 0.00 1.01 -0.01 0.81 4.20 -1.38 -2.37 115.11 117.38 3i7q h GLN 172 Ca -0.02 -0.23 -0.03 0.00 0.06 0.00 0.00 58.65 58.43 3i7q h GLN 172 Cb 1.19 -0.14 0.00 0.00 0.30 0.00 0.00 27.48 28.84 3i7q h GLN 172 CO 0.03 0.90 -0.10 0.82 -0.67 0.00 0.00 178.83 179.80 3i7q h ILE 173 N 0.97 1.54 -0.93 2.54 2.04 -1.09 -3.34 117.51 119.24 3i7q h ILE 173 Ca 0.21 -1.74 0.13 0.00 1.00 0.00 0.00 64.86 64.45 3i7q h ILE 173 Cb 0.34 2.66 -0.09 0.00 -0.74 0.00 0.00 36.82 39.00 3i7q h ILE 173 CO 0.00 0.47 0.55 0.50 0.00 0.00 0.00 178.15 179.66 3i7q h LYS 174 N -0.58 0.80 0.00 2.37 3.64 -1.12 0.89 116.57 122.58 3i7q h LYS 174 Ca -0.01 -0.05 -0.00 0.00 -1.27 0.00 0.00 60.65 59.32 3i7q h LYS 174 Cb 0.82 -0.18 -0.00 0.00 -0.41 0.00 0.00 32.23 32.46 3i7q h LYS 174 CO 0.02 0.53 -0.00 0.93 -2.27 0.00 0.00 179.45 178.66 3i7q h GLU 175 N 0.83 0.00 -0.00 1.90 4.39 -1.55 -3.11 114.58 117.03 3i7q h GLU 175 Ca 0.48 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.18 3i7q h GLU 175 Cb 0.56 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.21 3i7q h GLU 175 CO -0.30 0.00 -0.89 1.28 -1.16 0.00 0.00 179.01 177.94 3i7q n LEU 176 N -3.48 1.08 -4.37 1.33 4.32 0.29 -4.98 117.00 111.19 3i7q n LEU 176 Ca -0.03 -0.53 -0.19 0.00 -0.02 0.00 0.00 56.01 55.24 3i7q n LEU 176 Cb 0.08 0.00 -0.10 0.00 -1.62 0.00 0.00 43.42 41.78 3i7q n LEU 176 CO 0.24 0.25 -0.36 0.68 -1.22 0.00 0.00 177.39 176.98 3i7q s VAL 177 N -2.84 1.38 0.79 4.08 -7.23 -1.11 -4.75 120.40 110.72 3i7q s VAL 177 Ca 0.09 -2.09 -0.11 0.00 -1.81 0.00 0.00 61.98 58.05 3i7q s VAL 177 Cb 0.15 -2.32 0.06 0.00 0.56 0.00 0.00 36.38 34.84 3i7q s VAL 177 CO 0.79 -0.38 1.09 -0.94 -0.31 0.00 0.00 175.10 175.36 3i7q s SER 178 N -3.36 4.57 0.61 4.85 1.04 -1.26 -4.91 113.70 115.25 3i7q s SER 178 Ca 0.27 1.41 0.39 0.00 0.48 0.00 0.00 55.95 58.50 3i7q s SER 178 Cb 0.04 -2.17 1.92 0.00 0.10 0.00 0.00 66.02 65.91 3i7q s SER 178 CO 0.09 -1.93 2.19 -2.24 0.98 0.00 0.00 173.24 172.33 3i7q h ASP 179 N -1.06 0.00 -0.09 7.02 2.03 -2.01 -2.05 116.42 120.26 3i7q h ASP 179 Ca -0.46 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 55.84 3i7q h ASP 179 Cb 1.26 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.76 3i7q h ASP 179 CO 0.58 0.01 0.00 -0.90 -1.03 0.00 0.00 179.24 177.90 3i7q n ASP 180 N -3.13 1.94 -4.70 4.15 5.68 -1.26 -4.88 116.55 114.34 3i7q n ASP 180 Ca -0.01 -1.67 -0.42 0.00 -0.50 0.00 0.00 54.79 52.18 3i7q n ASP 180 Cb 0.18 -0.05 -0.03 0.00 -1.14 0.00 0.00 41.12 40.08 3i7q n ASP 180 CO 0.00 0.00 0.00 0.12 -1.33 0.00 0.00 177.20 175.99 3i7q s PHE 181 N -1.90 3.11 -0.03 2.11 5.36 -0.77 -4.96 117.98 120.90 3i7q s PHE 181 Ca 0.35 1.03 -0.24 0.00 -0.96 0.00 0.00 56.93 57.10 3i7q s PHE 181 Cb 0.20 -3.56 -0.04 0.00 -0.34 0.00 0.00 43.02 39.27 3i7q s PHE 181 CO 0.31 -1.95 0.74 0.08 -1.46 0.00 0.00 175.22 172.93 3i7q s VAL 182 N 1.85 4.94 -0.27 3.12 1.01 -0.31 -4.95 120.40 125.79 3i7q s VAL 182 Ca 0.61 1.54 -0.03 0.00 0.00 0.00 0.00 61.98 64.11 3i7q s VAL 182 Cb -0.31 -4.08 0.02 0.00 0.00 0.00 0.00 36.38 32.02 3i7q s VAL 182 CO 0.27 0.28 -0.02 -0.76 0.00 0.00 0.00 175.10 174.87 3i7q s LEU 183 N 0.53 3.42 -0.05 3.92 1.02 -1.26 -0.94 118.68 125.32 3i7q s LEU 183 Ca 0.39 -0.87 0.06 0.00 0.02 0.00 0.00 54.13 53.73 3i7q s LEU 183 Cb -0.19 -1.72 -0.01 0.00 0.02 0.00 0.00 46.19 44.29 3i7q s LEU 183 CO 0.20 -0.16 -0.24 -0.76 0.02 0.00 0.00 176.35 175.41 3i7q s LEU 184 N 1.36 2.12 0.33 1.79 1.43 0.33 0.03 118.68 126.07 3i7q s LEU 184 Ca 0.00 -0.48 -0.27 0.00 -1.03 0.00 0.00 54.13 52.35 3i7q s LEU 184 Cb -0.17 -1.38 -0.09 0.00 0.03 0.00 0.00 46.19 44.57 3i7q s LEU 184 CO -0.02 0.26 1.03 -0.55 0.23 0.00 0.00 176.35 177.30 3i7q s SER 185 N -0.27 7.12 -0.18 2.29 0.15 -0.39 -0.51 113.70 121.91 3i7q s SER 185 Ca -0.00 2.05 0.16 0.00 0.70 0.00 0.00 55.95 58.86 3i7q s SER 185 Cb -0.13 -2.60 0.46 0.00 -1.71 0.00 0.00 66.02 62.04 3i7q s SER 185 CO 0.03 -0.23 1.35 0.61 1.20 0.00 0.00 173.24 176.19 3i7q n GLY 186 N 0.75 4.45 2.63 9.45 0.00 -0.00 -0.36 105.19 122.11 3i7q n GLY 186 Ca 0.02 -1.11 -0.29 0.00 0.00 0.00 0.00 46.02 44.64 3i7q n GLY 186 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3i7q s ASP 187 N -2.34 3.70 0.25 1.61 2.15 -1.26 -4.64 116.67 116.14 3i7q s ASP 187 Ca 0.40 -1.69 -0.04 0.00 0.43 0.00 0.00 52.55 51.65 3i7q s ASP 187 Cb 0.34 -0.65 0.50 0.00 -0.30 0.00 0.00 42.92 42.80 3i7q s ASP 187 CO 0.05 -0.40 1.69 0.44 -0.17 0.00 0.00 175.17 176.79 3i7q h ASP 188 N 7.93 0.08 0.40 -0.34 3.32 -1.88 -0.83 116.42 125.10 3i7q h ASP 188 Ca -0.12 0.14 -0.04 0.00 0.02 0.00 0.00 57.03 57.04 3i7q h ASP 188 Cb 1.00 0.18 -0.01 0.00 0.22 0.00 0.00 39.33 40.72 3i7q h ASP 188 CO 0.44 -0.02 -0.18 0.00 -1.72 0.00 0.00 179.24 177.76 3i7q h ALA 189 N 1.62 1.32 -0.23 3.45 0.00 -1.95 -2.62 119.26 120.85 3i7q h ALA 189 Ca 0.44 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 55.18 3i7q h ALA 189 Cb 0.75 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.51 3i7q h ALA 189 CO -0.50 0.23 0.00 -1.13 0.00 0.00 0.00 179.25 177.84 3i7q n SER 190 N -3.77 2.63 -0.30 0.00 3.41 -0.54 -4.76 113.62 110.29 3i7q n SER 190 Ca -0.02 -1.79 -0.05 0.00 -0.26 0.00 0.00 58.87 56.76 3i7q n SER 190 Cb 0.29 -0.15 0.07 0.00 -0.26 0.00 0.00 64.21 64.16 3i7q n SER 190 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3i7q h ALA 191 N 2.47 1.03 -0.45 7.33 0.00 -0.80 -0.11 119.26 128.73 3i7q h ALA 191 Ca 0.00 -0.11 -0.12 0.00 0.00 0.00 0.00 54.91 54.68 3i7q h ALA 191 Cb 0.67 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 3i7q h ALA 191 CO 0.00 0.53 -0.18 1.25 0.00 0.00 0.00 179.25 180.85 3i7q h LEU 192 N 1.12 0.93 -0.66 0.00 5.85 -1.86 -0.60 115.31 120.08 3i7q h LEU 192 Ca 0.29 -0.39 0.07 0.00 0.84 0.00 0.00 57.88 58.69 3i7q h LEU 192 Cb 0.01 -0.26 -0.06 0.00 0.37 0.00 0.00 40.66 40.72 3i7q h LEU 192 CO -0.05 1.11 0.35 0.44 -0.34 0.00 0.00 178.44 179.95 3i7q h ASP 193 N 0.75 0.48 -0.16 1.25 3.32 -1.80 0.12 116.42 120.38 3i7q h ASP 193 Ca 0.10 0.04 0.03 0.00 0.02 0.00 0.00 57.03 57.23 3i7q h ASP 193 Cb 0.74 -0.04 -0.03 0.00 0.22 0.00 0.00 39.33 40.22 3i7q h ASP 193 CO 0.06 0.30 -0.03 0.15 -1.72 0.00 0.00 179.24 178.00 3i7q h PHE 194 N 0.62 -0.07 -0.67 4.55 3.57 -0.65 -1.42 116.94 122.88 3i7q h PHE 194 Ca 0.31 0.01 -0.05 0.00 3.53 0.00 0.00 57.97 61.77 3i7q h PHE 194 Cb 0.26 0.05 -0.03 0.00 2.79 0.00 0.00 35.95 39.02 3i7q h PHE 194 CO -0.10 -0.06 0.22 0.52 -2.23 0.00 0.00 178.31 176.66 3i7q h MET 195 N 0.01 1.04 -0.40 1.11 2.86 -0.76 -1.41 114.93 117.38 3i7q h MET 195 Ca 0.08 -0.22 0.03 0.00 -2.06 0.00 0.00 59.70 57.53 3i7q h MET 195 Cb 0.11 -0.15 -0.02 0.00 0.06 0.00 0.00 31.60 31.60 3i7q h MET 195 CO -0.15 0.90 0.27 0.37 1.06 0.00 0.00 176.91 179.35 3i7q h GLN 196 N 0.97 0.42 0.00 1.72 4.15 -0.33 -1.97 115.11 120.08 3i7q h GLN 196 Ca 0.22 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.61 3i7q h GLN 196 Cb 0.29 -0.09 0.00 0.00 0.21 0.00 0.00 27.48 27.88 3i7q h GLN 196 CO -0.01 0.28 0.00 1.28 -1.93 0.00 0.00 178.83 178.45 3i7q n LEU 197 N -4.48 0.00 0.00 -2.39 4.77 -0.57 -4.85 117.00 109.48 3i7q n LEU 197 Ca 0.04 0.49 0.00 0.00 -0.03 0.00 0.00 56.01 56.51 3i7q n LEU 197 Cb 0.15 -0.49 0.00 0.00 -2.33 0.00 0.00 43.42 40.75 3i7q n LEU 197 CO 0.35 -0.05 0.00 0.61 -1.33 0.00 0.00 177.39 176.97 3i7q n GLY 198 N 1.21 0.09 3.72 -0.72 0.00 -0.75 -4.76 105.19 103.98 3i7q n GLY 198 Ca 0.07 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.76 3i7q n GLY 198 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3i7q s GLY 199 N -0.19 2.00 -0.00 -0.02 0.00 -0.57 -4.90 107.32 103.64 3i7q s GLY 199 Ca 0.00 0.64 0.14 0.00 0.00 0.00 0.00 44.72 45.50 3i7q s GLY 199 CO 0.00 1.04 0.56 1.42 0.00 0.00 0.00 173.10 176.12 3i7q n HIS 200 N -3.31 0.00 -3.30 1.90 8.25 0.10 -4.46 115.22 114.40 3i7q n HIS 200 Ca 0.12 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.58 3i7q n HIS 200 Cb 0.51 -0.04 0.00 0.00 1.12 0.00 0.00 29.99 31.59 3i7q n HIS 200 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3i7q n GLY 201 N 1.37 -1.17 2.97 -1.41 0.00 -1.22 -2.07 105.19 103.65 3i7q n GLY 201 Ca 0.02 -0.90 -0.12 0.00 0.00 0.00 0.00 46.02 45.02 3i7q n GLY 201 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3i7q s VAL 202 N -3.00 0.00 -0.42 1.61 0.11 -0.66 -1.26 120.40 116.78 3i7q s VAL 202 Ca 0.00 -0.04 -0.17 0.00 -2.93 0.00 0.00 61.98 58.84 3i7q s VAL 202 Cb 0.00 -0.15 0.02 0.00 -1.53 0.00 0.00 36.38 34.73 3i7q s VAL 202 CO 0.00 -0.02 0.44 -0.63 -3.33 0.00 0.00 175.10 171.56 3i7q s ILE 203 N -0.03 5.08 -0.07 7.04 1.01 0.51 -1.40 121.20 133.35 3i7q s ILE 203 Ca -0.01 -0.37 0.03 0.00 0.00 0.00 0.00 60.65 60.31 3i7q s ILE 203 Cb -0.01 -4.05 -0.02 0.00 0.01 0.00 0.00 42.46 38.39 3i7q s ILE 203 CO 0.00 -0.44 -0.16 -0.55 0.00 0.00 0.00 174.94 173.80 3i7q s SER 204 N 1.84 3.87 -0.12 3.58 0.15 0.95 -4.54 113.70 119.44 3i7q s SER 204 Ca 0.12 -0.28 -0.24 0.00 0.70 0.00 0.00 55.95 56.25 3i7q s SER 204 Cb -0.17 -1.06 -0.27 0.00 -1.71 0.00 0.00 66.02 62.81 3i7q s SER 204 CO 0.13 0.28 0.70 0.58 1.20 0.00 0.00 173.24 176.14 3i7q h VAL 205 N 4.75 1.49 -0.92 4.45 2.07 -1.87 -0.69 116.25 125.52 3i7q h VAL 205 Ca -0.38 -2.39 0.23 0.00 0.82 0.00 0.00 66.70 64.98 3i7q h VAL 205 Cb 1.17 3.09 -0.06 0.00 -1.52 0.00 0.00 31.29 33.97 3i7q h VAL 205 CO 0.51 0.62 0.62 0.74 0.02 0.00 0.00 177.57 180.09 3i7q h THR 206 N -0.71 0.61 0.00 2.57 2.02 -1.95 -1.34 112.91 114.11 3i7q h THR 206 Ca -0.13 -0.09 0.00 0.00 0.77 0.00 0.00 66.41 66.95 3i7q h THR 206 Cb 1.35 0.32 0.00 0.00 -1.74 0.00 0.00 68.15 68.07 3i7q h THR 206 CO 0.03 0.05 0.00 0.00 0.37 0.00 0.00 175.52 175.97 3i7q h ALA 207 N 1.59 1.00 -0.47 6.16 0.00 -1.83 -1.14 119.26 124.57 3i7q h ALA 207 Ca 0.47 0.00 0.10 0.00 0.00 0.00 0.00 54.91 55.48 3i7q h ALA 207 Cb 1.40 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 19.16 3i7q h ALA 207 CO -0.14 0.00 0.33 -0.91 0.00 0.00 0.00 179.25 178.53 3i7q h ASN 208 N 0.00 0.19 0.00 0.00 2.35 -1.45 -3.09 115.58 113.58 3i7q h ASN 208 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 3i7q h ASN 208 Cb 0.07 -0.04 0.00 0.00 0.05 0.00 0.00 38.32 38.40 3i7q h ASN 208 CO 0.00 0.11 0.00 1.33 -1.65 0.00 0.00 177.43 177.22 3i7q n VAL 209 N -4.45 0.00 -2.60 2.81 0.24 -0.69 -4.78 118.33 108.86 3i7q n VAL 209 Ca 0.08 -0.33 -0.15 0.00 -2.04 0.00 0.00 64.34 61.89 3i7q n VAL 209 Cb 0.40 1.04 0.02 0.00 -1.47 0.00 0.00 33.84 33.82 3i7q n VAL 209 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3i7q n ALA 210 N -0.60 3.96 -0.19 2.33 0.00 -0.52 -4.97 120.51 120.53 3i7q n ALA 210 Ca 0.00 -3.52 -0.07 0.00 0.00 0.00 0.00 53.44 49.85 3i7q n ALA 210 Cb 0.01 -0.80 0.03 0.00 0.00 0.00 0.00 19.45 18.68 3i7q n ALA 210 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3i7q h ALA 211 N 2.85 0.70 -0.17 0.00 0.00 -1.77 -1.20 119.26 119.68 3i7q h ALA 211 Ca 0.03 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.85 3i7q h ALA 211 Cb 1.10 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.66 3i7q h ALA 211 CO 0.61 0.14 -0.10 -0.09 0.00 0.00 0.00 179.25 179.81 3i7q h ARG 212 N 0.75 0.36 -0.77 0.00 2.43 -1.90 0.23 114.38 115.48 3i7q h ARG 212 Ca 0.20 -0.17 0.00 0.00 -0.81 0.00 0.00 59.98 59.21 3i7q h ARG 212 Cb -0.08 -0.01 -0.04 0.00 -0.42 0.00 0.00 29.97 29.42 3i7q h ARG 212 CO -0.04 0.69 0.50 -0.44 -1.51 0.00 0.00 179.97 179.16 3i7q h ASP 213 N 0.03 0.89 0.01 -3.80 3.32 -1.87 -0.26 116.42 114.74 3i7q h ASP 213 Ca 0.03 -0.03 -0.00 0.00 0.02 0.00 0.00 57.03 57.05 3i7q h ASP 213 Cb 0.59 -0.22 0.00 0.00 0.22 0.00 0.00 39.33 39.92 3i7q h ASP 213 CO 0.03 0.66 -0.01 0.24 -1.72 0.00 0.00 179.24 178.44 3i7q h MET 214 N 1.04 -0.02 -0.34 3.56 2.86 -1.07 0.15 114.93 121.11 3i7q h MET 214 Ca 0.28 0.00 0.07 0.00 -2.06 0.00 0.00 59.70 57.99 3i7q h MET 214 Cb -0.10 0.00 -0.06 0.00 0.06 0.00 0.00 31.60 31.50 3i7q h MET 214 CO -0.06 0.04 -0.05 0.00 1.06 0.00 0.00 176.91 177.90 3i7q h ALA 215 N 0.92 0.25 -0.42 6.32 0.00 -0.73 -1.24 119.26 124.37 3i7q h ALA 215 Ca -0.00 0.12 -0.04 0.00 0.00 0.00 0.00 54.91 54.99 3i7q h ALA 215 Cb 0.06 0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.06 3i7q h ALA 215 CO 0.00 -0.44 0.11 0.37 0.00 0.00 0.00 179.25 179.30 3i7q h GLN 216 N 0.03 0.67 -0.57 0.00 5.75 -0.96 -1.91 115.11 118.12 3i7q h GLN 216 Ca 0.16 -0.15 0.05 0.00 -0.15 0.00 0.00 58.65 58.55 3i7q h GLN 216 Cb 0.24 -0.09 -0.05 0.00 1.07 0.00 0.00 27.48 28.65 3i7q h GLN 216 CO -0.32 0.67 0.31 1.98 -2.65 0.00 0.00 178.83 178.82 3i7q h MET 217 N 0.54 0.58 -0.42 1.69 4.05 -0.73 -0.69 114.93 119.95 3i7q h MET 217 Ca 0.13 -0.03 -0.08 0.00 -0.28 0.00 0.00 59.70 59.44 3i7q h MET 217 Cb 0.30 -0.13 -0.02 0.00 -0.80 0.00 0.00 31.60 30.95 3i7q h MET 217 CO -0.00 0.38 -0.08 0.00 0.23 0.00 0.00 176.91 177.44 3i7q h LYS 219 N 0.66 0.37 -0.72 0.00 3.64 -0.89 -1.04 116.57 118.60 3i7q h LYS 219 Ca 0.12 -0.14 0.05 0.00 -1.27 0.00 0.00 60.65 59.41 3i7q h LYS 219 Cb 0.52 -0.02 -0.05 0.00 -0.41 0.00 0.00 32.23 32.27 3i7q h LYS 219 CO 0.03 0.62 0.43 -0.07 -2.27 0.00 0.00 179.45 178.19 3i7q h LEU 220 N 0.09 0.68 -0.63 5.20 3.38 -0.98 -1.65 115.31 121.40 3i7q h LEU 220 Ca 0.05 0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.03 3i7q h LEU 220 Cb 0.48 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 41.07 3i7q h LEU 220 CO 0.02 0.45 0.39 0.00 0.09 0.00 0.00 178.44 179.38 3i7q h ALA 221 N 1.34 0.80 0.00 1.53 0.00 -1.01 0.25 119.26 122.17 3i7q h ALA 221 Ca 0.30 -0.07 -0.04 0.00 0.00 0.00 0.00 54.91 55.10 3i7q h ALA 221 Cb 0.11 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 3i7q h ALA 221 CO -0.15 0.27 -0.19 0.00 0.00 0.00 0.00 179.25 179.18 3i7q h ALA 222 N 1.20 1.49 -0.01 0.00 0.00 -0.79 -1.62 119.26 119.52 3i7q h ALA 222 Ca 0.23 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.96 3i7q h ALA 222 Cb -0.04 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.72 3i7q h ALA 222 CO -0.04 0.24 -0.09 0.39 0.00 0.00 0.00 179.25 179.74 3i7q n GLU 223 N -4.02 1.28 -0.68 0.00 1.02 -0.65 -4.93 120.64 112.65 3i7q n GLU 223 Ca -0.02 -0.69 0.00 0.00 -0.02 0.00 0.00 57.16 56.43 3i7q n GLU 223 Cb 0.27 -1.49 0.00 0.00 -0.02 0.00 0.00 31.44 30.20 3i7q n GLU 223 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3i7q n GLY 224 N 1.22 0.72 2.77 0.62 0.00 -0.61 -4.98 105.19 104.94 3i7q n GLY 224 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 3i7q n GLY 224 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3i7q n HIS 225 N -2.47 2.82 0.04 1.61 8.25 0.82 -4.77 115.22 121.51 3i7q n HIS 225 Ca 0.00 -2.79 -0.05 0.00 -0.26 0.00 0.00 57.72 54.62 3i7q n HIS 225 Cb 0.00 -1.91 0.15 0.00 1.12 0.00 0.00 29.99 29.35 3i7q n HIS 225 CO 0.00 0.00 0.00 0.74 0.64 0.00 0.00 176.34 177.72 3i7q h PHE 226 N 5.46 0.50 -0.48 4.41 -1.00 -1.89 -1.46 116.94 122.49 3i7q h PHE 226 Ca 0.47 -0.14 -0.13 0.00 2.81 0.00 0.00 57.97 60.97 3i7q h PHE 226 Cb 0.55 -0.11 -0.01 0.00 3.61 0.00 0.00 35.95 39.99 3i7q h PHE 226 CO 1.33 0.77 -0.20 0.00 -1.61 0.00 0.00 178.31 178.60 3i7q h ALA 227 N 1.21 0.67 -0.36 2.45 0.00 -1.96 -0.28 119.26 120.99 3i7q h ALA 227 Ca 0.03 -0.39 -0.03 0.00 0.00 0.00 0.00 54.91 54.53 3i7q h ALA 227 Cb 0.87 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.48 3i7q h ALA 227 CO 0.07 0.65 0.12 0.93 0.00 0.00 0.00 179.25 181.02 3i7q h GLU 228 N 0.84 0.55 -0.80 0.00 3.07 -1.91 -2.53 114.58 113.79 3i7q h GLU 228 Ca 0.11 -0.12 -0.01 0.00 -0.50 0.00 0.00 59.36 58.85 3i7q h GLU 228 Cb 0.78 -0.08 -0.04 0.00 -0.84 0.00 0.00 28.75 28.57 3i7q h GLU 228 CO 0.06 0.57 0.47 0.00 -1.40 0.00 0.00 179.01 178.71 3i7q h ALA 229 N 0.96 1.32 0.00 3.43 0.00 -1.17 -2.86 119.26 120.93 3i7q h ALA 229 Ca 0.12 -0.10 -0.07 0.00 0.00 0.00 0.00 54.91 54.86 3i7q h ALA 229 Cb 0.24 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 3i7q h ALA 229 CO -0.00 0.58 -0.34 -0.09 0.00 0.00 0.00 179.25 179.39 3i7q h ARG 230 N 1.11 0.00 -0.21 0.00 2.43 -0.76 -0.87 114.38 116.07 3i7q h ARG 230 Ca 0.29 0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.45 3i7q h ARG 230 Cb -0.02 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.52 3i7q h ARG 230 CO -0.05 0.34 0.12 0.28 -1.51 0.00 0.00 179.97 179.15 3i7q h VAL 231 N 0.00 1.09 -0.40 0.20 2.07 -1.22 1.00 116.25 118.98 3i7q h VAL 231 Ca -0.00 -0.22 -0.01 0.00 0.82 0.00 0.00 66.70 67.29 3i7q h VAL 231 Cb 0.60 0.85 -0.02 0.00 -1.52 0.00 0.00 31.29 31.21 3i7q h VAL 231 CO 0.04 0.08 0.23 0.40 0.02 0.00 0.00 177.57 178.34 3i7q h ILE 232 N 0.25 1.15 -0.68 4.57 2.04 -1.48 -2.83 117.51 120.53 3i7q h ILE 232 Ca 0.07 -0.38 0.01 0.00 1.00 0.00 0.00 64.86 65.57 3i7q h ILE 232 Cb 0.03 0.66 -0.03 0.00 -0.74 0.00 0.00 36.82 36.74 3i7q h ILE 232 CO -0.01 0.15 0.45 -1.13 0.00 0.00 0.00 178.15 177.61 3i7q h ASN 233 N 0.52 0.76 -0.34 1.72 -0.00 -0.75 -1.68 115.58 115.81 3i7q h ASN 233 Ca 0.14 -0.02 -0.09 0.00 -0.00 0.00 0.00 56.30 56.33 3i7q h ASN 233 Cb 0.05 -0.19 -0.02 0.00 -0.00 0.00 0.00 38.32 38.16 3i7q h ASN 233 CO -0.02 0.55 -0.10 1.56 -0.00 0.00 0.00 177.43 179.41 3i7q h GLN 234 N 0.90 0.77 0.00 6.67 1.08 -0.57 0.48 115.11 124.43 3i7q h GLN 234 Ca 0.25 -0.25 -0.04 0.00 -1.45 0.00 0.00 58.65 57.16 3i7q h GLN 234 Cb -0.07 -0.07 -0.01 0.00 -0.05 0.00 0.00 27.48 27.28 3i7q h GLN 234 CO -0.06 0.85 -0.20 0.07 -0.95 0.00 0.00 178.83 178.54 3i7q h ARG 235 N 0.70 0.00 0.00 1.46 0.11 -1.17 -3.12 114.38 112.35 3i7q h ARG 235 Ca 0.12 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.20 3i7q h ARG 235 Cb 0.58 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.66 3i7q h ARG 235 CO 0.04 0.20 -0.69 1.28 0.10 0.00 0.00 179.97 180.90 3i7q n LEU 236 N -3.32 0.64 -0.26 0.08 4.77 -0.82 -3.49 117.00 114.59 3i7q n LEU 236 Ca 0.01 0.13 -0.00 0.00 -0.03 0.00 0.00 56.01 56.12 3i7q n LEU 236 Cb 0.44 -0.18 0.12 0.00 -2.33 0.00 0.00 43.42 41.47 3i7q n LEU 236 CO 0.33 0.00 1.13 -0.03 -1.33 0.00 0.00 177.39 177.49 3i7q h MET 237 N 0.00 0.76 -0.81 3.23 4.05 -0.86 0.13 114.93 121.43 3i7q h MET 237 Ca 0.00 -0.05 0.08 0.00 -0.28 0.00 0.00 59.70 59.46 3i7q h MET 237 Cb 0.69 -0.17 -0.07 0.00 -0.80 0.00 0.00 31.60 31.26 3i7q h MET 237 CO 0.00 0.50 0.47 -1.35 0.23 0.00 0.00 176.91 176.76 3i7q h PRO 238 N 0.78 0.78 -0.49 0.39 0.11 -1.79 -1.37 132.00 130.41 3i7q h PRO 238 Ca 0.33 -0.05 0.01 0.00 0.11 0.00 0.00 66.00 66.41 3i7q h PRO 238 Cb 0.20 -0.18 -0.03 0.00 0.11 0.00 0.00 31.00 31.11 3i7q h PRO 238 CO -0.19 0.52 0.32 -0.07 -0.21 0.00 0.00 178.00 178.37 3i7q h LEU 239 N 0.80 0.54 -0.92 2.35 3.38 -1.35 0.61 115.31 120.73 3i7q h LEU 239 Ca 0.38 -0.01 0.11 0.00 0.09 0.00 0.00 57.88 58.45 3i7q h LEU 239 Cb 0.31 -0.13 -0.08 0.00 0.09 0.00 0.00 40.66 40.85 3i7q h LEU 239 CO -0.23 0.39 0.56 0.45 0.09 0.00 0.00 178.44 179.70 3i7q h HIS 240 N 0.64 1.01 0.01 1.13 3.86 -0.20 -0.99 115.15 120.61 3i7q h HIS 240 Ca 0.19 0.03 -0.00 0.00 -1.16 0.00 0.00 60.37 59.43 3i7q h HIS 240 Cb -0.05 -0.31 0.00 0.00 1.06 0.00 0.00 27.41 28.11 3i7q h HIS 240 CO -0.05 0.40 -0.01 -0.91 0.86 0.00 0.00 177.93 178.22 3i7q h ASN 241 N 0.90 -0.01 1.35 2.45 -0.26 -1.08 -3.41 115.58 115.51 3i7q h ASN 241 Ca 0.45 -0.57 0.00 0.00 -0.56 0.00 0.00 56.30 55.62 3i7q h ASN 241 Cb 0.44 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.70 3i7q h ASN 241 CO -0.26 0.76 0.00 0.11 -1.06 0.00 0.00 177.43 176.98 3i7q h LYS 242 N -0.99 0.00 0.00 0.81 1.79 0.37 -2.27 116.57 116.28 3i7q h LYS 242 Ca -0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 3i7q h LYS 242 Cb 0.58 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.23 3i7q h LYS 242 CO 0.00 0.00 0.00 1.28 -1.08 0.00 0.00 179.45 179.65 3i7q n LEU 243 N -2.68 0.00 -0.09 2.94 4.77 -0.39 -1.54 117.00 120.01 3i7q n LEU 243 Ca 0.03 0.21 0.08 0.00 -0.03 0.00 0.00 56.01 56.31 3i7q n LEU 243 Cb 0.38 -0.21 0.12 0.00 -2.33 0.00 0.00 43.42 41.38 3i7q n LEU 243 CO 0.28 -0.15 0.56 0.49 -1.33 0.00 0.00 177.39 177.24 3i7q n PHE 244 N -1.21 0.03 -0.11 -1.77 3.01 -0.86 -4.50 117.46 112.06 3i7q n PHE 244 Ca 0.05 -0.91 -0.00 0.00 1.01 0.00 0.00 57.45 57.60 3i7q n PHE 244 Cb 0.06 -0.14 0.27 0.00 -0.01 0.00 0.00 39.48 39.66 3i7q n PHE 244 CO 0.00 0.00 0.00 -0.24 1.01 0.00 0.00 176.76 177.53 3i7q h VAL 245 N 0.07 1.19 -2.35 -4.37 3.04 -1.39 -3.42 116.25 109.03 3i7q h VAL 245 Ca 0.00 -0.54 -0.54 0.00 -1.01 0.00 0.00 66.70 64.60 3i7q h VAL 245 Cb 0.93 0.50 -0.14 0.00 -2.01 0.00 0.00 31.29 30.57 3i7q h VAL 245 CO 0.01 0.22 -0.66 -1.61 -1.01 0.00 0.00 177.57 174.52 3i7q s GLU 246 N -5.43 1.68 0.09 4.17 2.02 -1.26 -5.09 118.70 114.89 3i7q s GLU 246 Ca -0.09 -1.88 -0.34 0.00 0.02 0.00 0.00 54.97 52.68 3i7q s GLU 246 Cb 0.17 -1.35 -0.13 0.00 0.10 0.00 0.00 34.13 32.92 3i7q s GLU 246 CO 0.78 0.04 1.66 -2.30 0.02 0.00 0.00 175.26 175.45 3i7q n PRO 247 N -0.70 2.13 -1.74 0.39 -0.02 -1.26 -4.56 135.00 129.24 3i7q n PRO 247 Ca -0.05 0.77 -0.42 0.00 -2.02 0.00 0.00 63.50 61.79 3i7q n PRO 247 Cb 0.64 -2.56 -0.01 0.00 -0.02 0.00 0.00 33.50 31.55 3i7q n PRO 247 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 3i7q n ASN 248 N 4.29 3.76 -1.86 2.55 4.05 -1.26 -0.63 115.26 126.15 3i7q n ASN 248 Ca 0.19 1.15 -0.07 0.00 0.45 0.00 0.00 54.58 56.30 3i7q n ASN 248 Cb 0.29 -1.58 0.25 0.00 1.23 0.00 0.00 39.78 39.97 3i7q n ASN 248 CO 0.00 0.00 0.00 -0.81 -3.05 0.00 0.00 177.26 173.40 3i7q n PRO 249 N 1.99 3.24 0.19 1.20 -0.04 -1.26 -4.95 135.00 135.36 3i7q n PRO 249 Ca 0.08 -2.62 -0.14 0.00 -0.04 0.00 0.00 63.50 60.77 3i7q n PRO 249 Cb 0.36 -2.08 -0.07 0.00 -0.04 0.00 0.00 33.50 31.67 3i7q n PRO 249 CO 0.00 0.00 0.00 0.82 -0.04 0.00 0.00 175.50 176.28 3i7q h ILE 250 N 2.17 0.42 -0.80 0.52 2.04 -1.16 -1.27 117.51 119.43 3i7q h ILE 250 Ca 0.26 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 66.09 3i7q h ILE 250 Cb 2.17 0.42 -0.04 0.00 -0.74 0.00 0.00 36.82 38.63 3i7q h ILE 250 CO 0.67 0.00 0.39 -0.65 0.00 0.00 0.00 178.15 178.56 3i7q h PRO 251 N -0.58 1.16 -0.18 2.37 0.11 -1.79 -2.27 132.00 130.81 3i7q h PRO 251 Ca -0.01 -0.17 -0.14 0.00 0.11 0.00 0.00 66.00 65.79 3i7q h PRO 251 Cb 0.53 -0.21 -0.01 0.00 0.11 0.00 0.00 31.00 31.43 3i7q h PRO 251 CO -0.05 0.89 -0.49 -0.24 -0.21 0.00 0.00 178.00 177.90 3i7q h VAL 252 N 1.14 1.32 -0.51 3.15 3.04 -1.76 -0.01 116.25 122.62 3i7q h VAL 252 Ca 0.28 -1.72 -0.11 0.00 -1.01 0.00 0.00 66.70 64.14 3i7q h VAL 252 Cb 0.12 1.72 -0.02 0.00 -2.01 0.00 0.00 31.29 31.11 3i7q h VAL 252 CO -0.03 0.53 -0.12 0.11 -1.01 0.00 0.00 177.57 177.05 3i7q h LYS 253 N 0.38 0.95 -0.34 4.17 1.57 -1.17 -0.54 116.57 121.59 3i7q h LYS 253 Ca 0.02 -0.35 -0.01 0.00 -1.87 0.00 0.00 60.65 58.44 3i7q h LYS 253 Cb 1.00 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 33.23 3i7q h LYS 253 CO 0.09 1.01 0.16 2.35 -0.57 0.00 0.00 179.45 182.50 3i7q h TRP 254 N 0.85 0.49 -0.32 -1.35 7.01 -1.02 -0.80 115.95 120.80 3i7q h TRP 254 Ca 0.13 -0.02 0.03 0.00 2.11 0.00 0.00 58.89 61.14 3i7q h TRP 254 Cb 0.67 -0.15 -0.03 0.00 -2.10 0.00 0.00 29.16 27.54 3i7q h TRP 254 CO 0.04 0.42 0.14 0.00 -2.79 0.00 0.00 178.44 176.25 3i7q h ALA 255 N 1.02 0.38 -0.61 2.65 0.00 -0.88 0.22 119.26 122.04 3i7q h ALA 255 Ca 0.12 0.02 0.07 0.00 0.00 0.00 0.00 54.91 55.13 3i7q h ALA 255 Cb 0.11 -0.02 -0.06 0.00 0.00 0.00 0.00 17.79 17.83 3i7q h ALA 255 CO -0.01 -0.25 0.28 0.00 0.00 0.00 0.00 179.25 179.26 3i7q h LYS 257 N 0.51 0.31 -0.68 0.00 3.11 -0.50 0.41 116.57 119.73 3i7q h LYS 257 Ca 0.29 -0.02 0.01 0.00 -2.81 0.00 0.00 60.65 58.12 3i7q h LYS 257 Cb 0.28 -0.07 -0.03 0.00 -1.00 0.00 0.00 32.23 31.41 3i7q h LYS 257 CO -0.24 0.20 0.45 1.49 -2.81 0.00 0.00 179.45 178.54 3i7q h GLU 258 N 0.32 0.88 0.00 1.90 4.57 -0.14 -1.19 114.58 120.92 3i7q h GLU 258 Ca 0.11 -0.05 0.00 0.00 -1.18 0.00 0.00 59.36 58.23 3i7q h GLU 258 Cb 0.00 -0.20 0.00 0.00 -0.16 0.00 0.00 28.75 28.40 3i7q h GLU 258 CO -0.05 0.58 0.00 1.28 -1.18 0.00 0.00 179.01 179.64 3i7q n LEU 259 N -4.44 0.29 0.00 1.64 4.32 -0.46 -4.92 117.00 113.43 3i7q n LEU 259 Ca 0.07 0.53 0.00 0.00 -0.02 0.00 0.00 56.01 56.59 3i7q n LEU 259 Cb 0.05 -0.44 0.00 0.00 -1.62 0.00 0.00 43.42 41.41 3i7q n LEU 259 CO 0.36 -0.08 0.00 0.61 -1.22 0.00 0.00 177.39 177.06 3i7q n GLY 260 N 1.37 0.66 0.14 -0.72 0.00 -0.45 -4.95 105.19 101.23 3i7q n GLY 260 Ca 0.06 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3i7q n GLY 260 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3i7q h LEU 261 N 0.00 0.00 -8.54 0.99 3.38 -1.15 -3.45 115.31 106.54 3i7q h LEU 261 Ca 0.00 0.00 -0.37 0.00 0.09 0.00 0.00 57.88 57.60 3i7q h LEU 261 Cb 0.00 0.00 -0.18 0.00 0.09 0.00 0.00 40.66 40.57 3i7q h LEU 261 CO 0.00 0.60 -0.75 0.68 0.09 0.00 0.00 178.44 179.07 3i7q s VAL 262 N -3.27 1.16 0.03 1.22 -7.23 -1.16 -4.31 120.40 106.84 3i7q s VAL 262 Ca 0.01 -1.68 -0.19 0.00 -1.81 0.00 0.00 61.98 58.30 3i7q s VAL 262 Cb 0.10 -1.46 -0.19 0.00 0.56 0.00 0.00 36.38 35.40 3i7q s VAL 262 CO 0.75 -0.48 1.20 0.00 -0.31 0.00 0.00 175.10 176.26 3i7q h ALA 263 N 3.53 0.16 -2.27 1.32 0.00 -1.90 -3.38 119.26 116.72 3i7q h ALA 263 Ca -0.39 -0.49 -0.34 0.00 0.00 0.00 0.00 54.91 53.69 3i7q h ALA 263 Cb 1.19 -0.00 -0.15 0.00 0.00 0.00 0.00 17.79 18.83 3i7q h ALA 263 CO 0.52 0.31 -0.72 0.95 0.00 0.00 0.00 179.25 180.31 3i7q s THR 264 N -3.61 1.23 -0.29 0.00 -4.23 -1.26 -5.00 115.64 102.48 3i7q s THR 264 Ca -0.13 -2.05 0.12 0.00 -1.18 0.00 0.00 61.69 58.44 3i7q s THR 264 Cb 0.05 -1.84 0.77 0.00 1.34 0.00 0.00 72.50 72.82 3i7q s THR 264 CO 0.81 -0.71 1.78 -0.90 -0.54 0.00 0.00 174.62 175.06 3i7q n ASP 265 N -0.16 5.14 -4.76 3.99 5.75 -1.26 -4.54 116.55 120.71 3i7q n ASP 265 Ca -0.10 -3.12 -0.41 0.00 -0.01 0.00 0.00 54.79 51.14 3i7q n ASP 265 Cb 0.60 -0.72 -0.02 0.00 -1.03 0.00 0.00 41.12 39.96 3i7q n ASP 265 CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 3i7q s THR 266 N -2.92 2.44 0.38 2.12 2.01 -1.26 -4.73 115.64 113.68 3i7q s THR 266 Ca 0.55 0.41 0.05 0.00 0.31 0.00 0.00 61.69 63.00 3i7q s THR 266 Cb 0.43 -3.26 -0.06 0.00 0.01 0.00 0.00 72.50 69.62 3i7q s THR 266 CO 0.14 0.08 0.04 -0.76 -0.69 0.00 0.00 174.62 173.44 3i7q s LEU 267 N -1.27 2.41 -0.09 4.42 1.02 -1.26 -4.37 118.68 119.53 3i7q s LEU 267 Ca 0.55 -1.43 -0.05 0.00 0.02 0.00 0.00 54.13 53.22 3i7q s LEU 267 Cb -0.43 -0.56 -0.04 0.00 0.02 0.00 0.00 46.19 45.18 3i7q s LEU 267 CO 0.52 -0.61 0.10 -0.13 0.02 0.00 0.00 176.35 176.25 3i7q s ARG 268 N -3.81 3.30 0.37 1.70 0.52 -1.26 -4.88 118.95 114.88 3i7q s ARG 268 Ca 0.32 -0.24 -0.26 0.00 -0.52 0.00 0.00 55.73 55.02 3i7q s ARG 268 Cb 0.08 -3.06 -0.12 0.00 0.52 0.00 0.00 34.95 32.37 3i7q s ARG 268 CO 0.15 0.74 1.09 1.28 0.02 0.00 0.00 175.30 178.59 3i7q n LEU 269 N 1.87 2.73 -0.04 2.53 4.77 -1.26 -1.44 117.00 126.15 3i7q n LEU 269 Ca -0.18 1.12 0.02 0.00 -0.03 0.00 0.00 56.01 56.93 3i7q n LEU 269 Cb 0.54 -1.38 0.09 0.00 -2.33 0.00 0.00 43.42 40.34 3i7q n LEU 269 CO 0.32 -1.16 0.56 -0.81 -1.33 0.00 0.00 177.39 174.96 3i7q n PRO 270 N 0.38 1.05 -2.52 3.23 -0.04 -1.26 -4.96 135.00 130.88 3i7q n PRO 270 Ca 0.08 -0.07 -0.41 0.00 -0.04 0.00 0.00 63.50 63.06 3i7q n PRO 270 Cb 0.37 -1.06 -0.04 0.00 -0.04 0.00 0.00 33.50 32.73 3i7q n PRO 270 CO 0.00 0.00 0.00 -1.64 -0.04 0.00 0.00 175.50 173.82 3i7q s MET 271 N -1.97 4.60 0.33 0.54 -1.94 -0.52 -5.06 119.30 115.27 3i7q s MET 271 Ca 0.05 1.71 0.10 0.00 -1.71 0.00 0.00 55.69 55.84 3i7q s MET 271 Cb 0.03 -3.28 -0.06 0.00 2.01 0.00 0.00 34.83 33.52 3i7q s MET 271 CO 0.04 0.08 -0.10 0.95 -0.01 0.00 0.00 175.02 175.97 3i7q s THR 272 N -0.22 2.22 0.60 2.05 -4.23 -1.26 -4.52 115.64 110.27 3i7q s THR 272 Ca 0.49 -2.22 -0.19 0.00 -1.18 0.00 0.00 61.69 58.59 3i7q s THR 272 Cb -0.29 -2.60 -0.04 0.00 1.34 0.00 0.00 72.50 70.91 3i7q s THR 272 CO 0.35 -0.23 1.20 -2.65 -0.54 0.00 0.00 174.62 172.75 3i7q n PRO 273 N -0.76 1.22 -1.73 3.99 -0.02 -1.26 -4.93 135.00 131.51 3i7q n PRO 273 Ca -0.05 0.46 -0.41 0.00 -2.02 0.00 0.00 63.50 61.48 3i7q n PRO 273 Cb 0.63 -2.41 0.00 0.00 -0.02 0.00 0.00 33.50 31.70 3i7q n PRO 273 CO 0.00 0.00 0.00 1.51 1.98 0.00 0.00 175.50 178.99 3i7q n ILE 274 N -1.55 2.18 -1.86 4.25 3.06 -1.26 -5.01 119.36 119.17 3i7q n ILE 274 Ca 0.13 -0.50 -0.30 0.00 -2.50 0.00 0.00 62.75 59.58 3i7q n ILE 274 Cb 0.46 -1.75 0.04 0.00 0.54 0.00 0.00 39.64 38.94 3i7q n ILE 274 CO 0.00 0.00 0.00 0.42 -2.50 0.00 0.00 176.55 174.47 3i7q s THR 275 N -1.13 3.60 0.32 9.51 -4.23 -1.26 -4.89 115.64 117.55 3i7q s THR 275 Ca 0.56 0.52 0.01 0.00 -1.18 0.00 0.00 61.69 61.60 3i7q s THR 275 Cb -0.51 -3.50 0.20 0.00 1.34 0.00 0.00 72.50 70.03 3i7q s THR 275 CO 0.62 -0.68 1.91 0.44 -0.54 0.00 0.00 174.62 176.37 3i7q h ASP 276 N -0.64 0.72 -0.57 3.99 3.32 -1.99 -0.70 116.42 120.54 3i7q h ASP 276 Ca -0.45 -0.08 -0.11 0.00 0.02 0.00 0.00 57.03 56.41 3i7q h ASP 276 Cb 1.25 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 40.59 3i7q h ASP 276 CO 0.63 0.64 -0.07 -1.28 -1.72 0.00 0.00 179.24 177.44 3i7q h SER 277 N 0.78 1.05 -0.36 6.45 0.87 -2.00 -2.38 113.55 117.96 3i7q h SER 277 Ca 0.19 -0.33 0.03 0.00 -1.23 0.00 0.00 61.79 60.45 3i7q h SER 277 Cb 0.14 -0.28 -0.03 0.00 -0.44 0.00 0.00 62.40 61.78 3i7q h SER 277 CO -0.02 1.13 0.16 1.23 -0.53 0.00 0.00 176.83 178.80 3i7q h GLY 278 N 0.96 0.48 0.36 5.77 0.00 -1.74 -1.86 103.07 107.03 3i7q h GLY 278 Ca 0.15 -0.10 0.08 0.00 0.00 0.00 0.00 47.33 47.46 3i7q h GLY 278 CO 0.04 0.07 0.03 3.21 0.00 0.00 0.00 176.54 179.89 3i7q h ARG 279 N 0.33 0.14 -0.34 4.80 3.08 -0.83 -0.74 114.38 120.83 3i7q h ARG 279 Ca 0.16 -0.01 -0.14 0.00 0.07 0.00 0.00 59.98 60.06 3i7q h ARG 279 Cb 0.10 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.11 3i7q h ARG 279 CO -0.13 0.10 -0.35 1.05 -1.07 0.00 0.00 179.97 179.56 3i7q h GLU 280 N 0.15 0.76 -0.40 0.04 4.11 -1.25 0.23 114.58 118.22 3i7q h GLU 280 Ca 0.21 -0.37 -0.03 0.00 0.07 0.00 0.00 59.36 59.24 3i7q h GLU 280 Cb 0.30 -0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.53 3i7q h GLU 280 CO -0.33 0.99 0.14 1.15 0.07 0.00 0.00 179.01 181.04 3i7q h THR 281 N 0.64 1.21 -0.17 -1.06 2.02 -1.06 -1.67 112.91 112.81 3i7q h THR 281 Ca 0.06 -0.66 -0.13 0.00 0.77 0.00 0.00 66.41 66.46 3i7q h THR 281 Cb 0.89 0.88 0.00 0.00 -1.74 0.00 0.00 68.15 68.18 3i7q h THR 281 CO 0.08 0.23 -0.40 0.58 0.37 0.00 0.00 175.52 176.39 3i7q h VAL 282 N 0.51 1.34 -1.00 3.16 2.07 -0.98 -2.49 116.25 118.85 3i7q h VAL 282 Ca 0.13 -1.65 0.03 0.00 0.82 0.00 0.00 66.70 66.04 3i7q h VAL 282 Cb 0.22 1.94 -0.06 0.00 -1.52 0.00 0.00 31.29 31.88 3i7q h VAL 282 CO -0.01 0.50 0.66 -0.09 0.02 0.00 0.00 177.57 178.65 3i7q h ARG 283 N 0.23 1.25 -0.83 1.57 2.43 -0.50 -0.42 114.38 118.11 3i7q h ARG 283 Ca -0.00 -0.08 -0.04 0.00 -0.81 0.00 0.00 59.98 59.06 3i7q h ARG 283 Cb 1.00 -0.28 -0.04 0.00 -0.42 0.00 0.00 29.97 30.23 3i7q h ARG 283 CO 0.09 0.83 0.37 0.00 -1.51 0.00 0.00 179.97 179.74 3i7q h ALA 284 N 1.41 1.07 -0.71 2.80 0.00 -1.24 -1.22 119.26 121.37 3i7q h ALA 284 Ca 0.39 -0.18 -0.04 0.00 0.00 0.00 0.00 54.91 55.08 3i7q h ALA 284 Cb -0.03 -0.33 -0.03 0.00 0.00 0.00 0.00 17.79 17.40 3i7q h ALA 284 CO -0.12 0.66 0.27 0.00 0.00 0.00 0.00 179.25 180.07 3i7q h ALA 285 N 1.20 0.92 -0.44 0.00 0.00 -0.92 -1.02 119.26 119.00 3i7q h ALA 285 Ca 0.28 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 3i7q h ALA 285 Cb 0.16 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 3i7q h ALA 285 CO -0.03 0.55 0.22 -0.07 0.00 0.00 0.00 179.25 179.92 3i7q h LEU 286 N 1.02 0.57 -0.69 0.00 3.38 -0.82 -2.04 115.31 116.73 3i7q h LEU 286 Ca 0.24 -0.12 -0.04 0.00 0.09 0.00 0.00 57.88 58.05 3i7q h LEU 286 Cb 0.23 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 40.80 3i7q h LEU 286 CO -0.02 0.53 0.29 0.11 0.09 0.00 0.00 178.44 179.44 3i7q h LYS 287 N 0.56 1.02 -0.53 1.13 1.57 -1.05 0.03 116.57 119.30 3i7q h LYS 287 Ca 0.15 -0.17 0.05 0.00 -1.87 0.00 0.00 60.65 58.81 3i7q h LYS 287 Cb 0.11 -0.17 -0.03 0.00 0.08 0.00 0.00 32.23 32.22 3i7q h LYS 287 CO -0.02 0.83 0.35 1.25 -0.57 0.00 0.00 179.45 181.29 3i7q h HIS 288 N 0.97 0.51 -0.00 -1.35 2.76 -1.03 -0.95 115.15 116.06 3i7q h HIS 288 Ca 0.23 0.01 0.00 0.00 -2.20 0.00 0.00 60.37 58.41 3i7q h HIS 288 Cb 0.18 -0.17 0.00 0.00 1.55 0.00 0.00 27.41 28.97 3i7q h HIS 288 CO 0.01 0.28 -0.05 0.00 -1.30 0.00 0.00 177.93 176.87 3i7q n ALA 289 N -2.49 2.54 -1.20 5.26 0.00 -0.78 -4.83 120.51 119.01 3i7q n ALA 289 Ca 0.07 -0.16 0.00 0.00 0.00 0.00 0.00 53.44 53.35 3i7q n ALA 289 Cb 0.21 -1.43 0.00 0.00 0.00 0.00 0.00 19.45 18.23 3i7q n ALA 289 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3i7q n GLY 290 N 1.40 0.41 0.04 0.00 0.00 -0.36 -4.95 105.19 101.74 3i7q n GLY 290 Ca 0.10 -1.01 0.04 0.00 0.00 0.00 0.00 46.02 45.16 3i7q n GLY 290 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3i7q n LEU 291 N 0.00 0.06 -0.18 0.99 4.77 -0.06 -5.00 117.00 117.58 3i7q n LEU 291 Ca 0.00 0.03 0.02 0.00 -0.03 0.00 0.00 56.01 56.03 3i7q n LEU 291 Cb 0.12 0.15 0.02 0.00 -2.33 0.00 0.00 43.42 41.37 3i7q n LEU 291 CO 0.00 0.15 0.32 0.18 -1.33 0.00 0.00 177.39 176.71