#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1n7g s LYS 29 N 0.00 4.15 -0.21 -0.14 1.02 -1.26 -4.83 119.74 118.46 1n7g s LYS 29 Ca 0.00 2.55 -0.05 0.00 0.02 0.00 0.00 55.97 58.48 1n7g s LYS 29 Cb 0.00 -3.30 -0.02 0.00 -0.52 0.00 0.00 37.83 33.98 1n7g s LYS 29 CO 0.00 -0.76 0.01 0.42 -0.92 0.00 0.00 175.35 174.10 1n7g s ILE 30 N 1.82 3.97 -0.09 2.17 1.01 -1.26 -0.39 121.20 128.43 1n7g s ILE 30 Ca 0.76 -0.30 0.02 0.00 0.00 0.00 0.00 60.65 61.13 1n7g s ILE 30 Cb -0.47 -2.81 -0.02 0.00 0.01 0.00 0.00 42.46 39.18 1n7g s ILE 30 CO 0.33 0.41 -0.15 0.00 0.00 0.00 0.00 174.94 175.54 1n7g s ALA 31 N 1.12 2.60 -0.20 9.38 0.00 0.14 0.38 121.76 135.18 1n7g s ALA 31 Ca 0.03 -0.94 -0.04 0.00 0.00 0.00 0.00 51.96 51.00 1n7g s ALA 31 Cb -0.14 -1.05 -0.02 0.00 0.00 0.00 0.00 23.12 21.91 1n7g s ALA 31 CO 0.02 0.41 -0.02 -1.17 0.00 0.00 0.00 175.76 174.99 1n7g s LEU 32 N -0.20 3.11 -0.13 0.00 2.96 0.41 0.28 118.68 125.10 1n7g s LEU 32 Ca 0.00 -0.26 0.02 0.00 -0.22 0.00 0.00 54.13 53.67 1n7g s LEU 32 Cb -0.13 -1.78 0.00 0.00 0.50 0.00 0.00 46.19 44.78 1n7g s LEU 32 CO 0.03 0.06 -0.21 -0.63 -1.32 0.00 0.00 176.35 174.28 1n7g s ILE 33 N 1.04 2.24 -0.06 6.68 1.01 0.19 -0.74 121.20 131.56 1n7g s ILE 33 Ca 0.01 -0.93 -0.07 0.00 0.00 0.00 0.00 60.65 59.66 1n7g s ILE 33 Cb -0.14 -1.90 -0.04 0.00 0.01 0.00 0.00 42.46 40.38 1n7g s ILE 33 CO 0.01 0.54 0.20 0.42 0.00 0.00 0.00 174.94 176.12 1n7g s THR 34 N 0.65 5.40 -0.48 2.92 -4.23 -0.41 -1.12 115.64 118.37 1n7g s THR 34 Ca -0.10 0.22 -0.01 0.00 -1.18 0.00 0.00 61.69 60.61 1n7g s THR 34 Cb -0.16 -3.49 0.00 0.00 1.34 0.00 0.00 72.50 70.19 1n7g s THR 34 CO 0.02 0.52 0.10 0.61 -0.54 0.00 0.00 174.62 175.33 1n7g n GLY 35 N 1.63 0.24 0.22 3.99 0.00 -1.24 -1.91 105.19 108.11 1n7g n GLY 35 Ca -0.16 -0.57 0.06 0.00 0.00 0.00 0.00 46.02 45.35 1n7g n GLY 35 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1n7g h ILE 36 N -0.22 1.06 0.00 -0.61 2.10 -1.73 -2.34 117.51 115.77 1n7g h ILE 36 Ca -0.15 -0.74 0.00 0.00 1.08 0.00 0.00 64.86 65.05 1n7g h ILE 36 Cb 1.11 1.41 0.00 0.00 -1.09 0.00 0.00 36.82 38.25 1n7g h ILE 36 CO 0.17 0.21 0.00 0.35 -1.08 0.00 0.00 178.15 177.79 1n7g n THR 37 N -4.15 0.62 -1.98 2.19 -2.24 -1.26 -2.72 114.28 104.74 1n7g n THR 37 Ca -0.02 0.14 -0.29 0.00 -2.27 0.00 0.00 64.05 61.61 1n7g n THR 37 Cb 0.28 -0.82 0.15 0.00 -2.10 0.00 0.00 70.33 67.84 1n7g n THR 37 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1n7g s GLY 38 N -3.04 1.73 0.10 3.38 0.00 -0.88 -4.62 107.32 103.98 1n7g s GLY 38 Ca 0.09 -1.08 -0.30 0.00 0.00 0.00 0.00 44.72 43.43 1n7g s GLY 38 CO 0.38 -0.41 1.49 -1.61 0.00 0.00 0.00 173.10 172.94 1n7g h GLN 39 N -1.38 -0.58 -0.91 2.90 4.15 -1.86 -1.03 115.11 116.40 1n7g h GLN 39 Ca -0.44 0.04 -0.02 0.00 0.77 0.00 0.00 58.65 59.00 1n7g h GLN 39 Cb 1.26 0.13 -0.04 0.00 0.21 0.00 0.00 27.48 29.04 1n7g h GLN 39 CO 0.46 -0.39 0.50 -0.44 -1.93 0.00 0.00 178.83 177.04 1n7g h ASP 40 N -0.60 1.13 -0.60 -0.69 5.19 -1.92 -2.62 116.42 116.31 1n7g h ASP 40 Ca 0.01 -0.10 -0.01 0.00 -0.62 0.00 0.00 57.03 56.32 1n7g h ASP 40 Cb 0.64 -0.29 -0.03 0.00 0.18 0.00 0.00 39.33 39.83 1n7g h ASP 40 CO -0.31 0.90 0.36 1.23 -3.12 0.00 0.00 179.24 178.30 1n7g h GLY 41 N 1.27 0.88 1.00 2.75 0.00 -1.61 0.17 103.07 107.53 1n7g h GLY 41 Ca 0.32 -0.36 -0.11 0.00 0.00 0.00 0.00 47.33 47.17 1n7g h GLY 41 CO -0.05 0.35 -0.23 1.48 0.00 0.00 0.00 176.54 178.09 1n7g h SER 42 N 0.84 0.80 -0.17 0.19 4.64 -0.83 -1.80 113.55 117.22 1n7g h SER 42 Ca 0.22 -0.43 -0.10 0.00 -0.47 0.00 0.00 61.79 61.01 1n7g h SER 42 Cb -0.02 -0.22 -0.00 0.00 -0.31 0.00 0.00 62.40 61.85 1n7g h SER 42 CO -0.04 1.06 -0.28 1.88 -0.87 0.00 0.00 176.83 178.57 1n7g h TYR 43 N 0.55 0.61 -0.74 4.77 -1.99 -1.21 -2.79 116.97 116.17 1n7g h TYR 43 Ca 0.07 -0.21 0.01 0.00 2.00 0.00 0.00 58.73 60.60 1n7g h TYR 43 Cb 0.78 -0.12 -0.04 0.00 2.00 0.00 0.00 36.73 39.36 1n7g h TYR 43 CO 0.06 0.92 0.49 1.25 -0.00 0.00 0.00 178.16 180.88 1n7g h LEU 44 N 0.12 0.85 -0.05 3.88 5.85 -0.71 -0.51 115.31 124.74 1n7g h LEU 44 Ca 0.01 -0.02 -0.00 0.00 0.84 0.00 0.00 57.88 58.71 1n7g h LEU 44 Cb 0.87 -0.21 -0.00 0.00 0.37 0.00 0.00 40.66 41.68 1n7g h LEU 44 CO 0.06 0.62 0.03 0.74 -0.34 0.00 0.00 178.44 179.56 1n7g h THR 45 N 1.01 1.04 -0.87 1.05 2.02 -1.28 0.13 112.91 116.01 1n7g h THR 45 Ca 0.27 -0.11 -0.02 0.00 0.77 0.00 0.00 66.41 67.33 1n7g h THR 45 Cb -0.11 1.02 -0.04 0.00 -1.74 0.00 0.00 68.15 67.28 1n7g h THR 45 CO -0.06 0.03 0.48 -0.33 0.37 0.00 0.00 175.52 176.02 1n7g h GLU 46 N 0.03 1.22 -0.48 6.66 5.08 -1.15 -0.89 114.58 125.06 1n7g h GLU 46 Ca 0.02 -0.14 -0.05 0.00 -1.00 0.00 0.00 59.36 58.19 1n7g h GLU 46 Cb 0.03 -0.24 -0.02 0.00 0.50 0.00 0.00 28.75 29.02 1n7g h GLU 46 CO -0.00 0.89 0.10 0.35 -1.00 0.00 0.00 179.01 179.35 1n7g h PHE 47 N 1.22 0.81 -0.25 4.33 3.57 -0.67 -1.51 116.94 124.45 1n7g h PHE 47 Ca 0.31 -0.10 -0.16 0.00 3.53 0.00 0.00 57.97 61.55 1n7g h PHE 47 Cb 0.03 -0.23 0.00 0.00 2.79 0.00 0.00 35.95 38.54 1n7g h PHE 47 CO 0.01 0.74 -0.46 -0.07 -2.23 0.00 0.00 178.31 176.30 1n7g h LEU 48 N 0.65 0.83 -1.36 0.59 3.38 -0.55 -2.78 115.31 116.07 1n7g h LEU 48 Ca 0.15 -0.54 0.01 0.00 0.09 0.00 0.00 57.88 57.59 1n7g h LEU 48 Cb 0.35 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.82 1n7g h LEU 48 CO 0.00 1.21 0.44 -0.07 0.09 0.00 0.00 178.44 180.12 1n7g h LEU 49 N 0.48 0.74 -2.14 1.67 3.38 -1.12 0.19 115.31 118.51 1n7g h LEU 49 Ca 0.01 -0.02 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 1n7g h LEU 49 Cb 1.06 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 41.63 1n7g h LEU 49 CO 0.10 0.53 -0.04 1.23 0.09 0.00 0.00 178.44 180.36 1n7g h GLY 50 N 0.87 0.00 -1.51 0.83 0.00 -1.04 -0.29 103.07 101.93 1n7g h GLY 50 Ca 0.25 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.58 1n7g h GLY 50 CO -0.06 0.00 0.00 0.28 0.00 0.00 0.00 176.54 176.76 1n7g n LYS 51 N -3.26 2.07 -0.66 4.80 4.76 0.58 -4.92 118.16 121.54 1n7g n LYS 51 Ca -0.01 -1.63 0.00 0.00 -2.87 0.00 0.00 58.31 53.80 1n7g n LYS 51 Cb 0.20 -1.43 0.00 0.00 -1.84 0.00 0.00 35.03 31.96 1n7g n LYS 51 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1n7g n GLY 52 N 1.29 0.77 3.72 0.72 0.00 -0.12 -5.04 105.19 106.53 1n7g n GLY 52 Ca 0.17 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.87 1n7g n GLY 52 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1n7g s TYR 53 N -2.81 2.12 -0.30 1.61 1.51 -0.69 -4.71 117.35 114.07 1n7g s TYR 53 Ca 0.00 1.66 -0.09 0.00 -1.01 0.00 0.00 57.07 57.62 1n7g s TYR 53 Cb 0.00 -3.25 -0.01 0.00 -0.11 0.00 0.00 41.96 38.59 1n7g s TYR 53 CO 0.00 -2.33 0.14 -2.00 -1.11 0.00 0.00 175.55 170.25 1n7g s GLU 54 N -4.53 3.37 -0.19 -0.62 2.12 0.47 -4.55 118.70 114.77 1n7g s GLU 54 Ca 0.66 -0.69 -0.08 0.00 0.36 0.00 0.00 54.97 55.22 1n7g s GLU 54 Cb -0.22 -3.53 -0.04 0.00 0.26 0.00 0.00 34.13 30.60 1n7g s GLU 54 CO 0.53 -0.39 0.08 0.08 -0.54 0.00 0.00 175.26 175.02 1n7g s VAL 55 N 1.61 4.89 -0.09 3.70 1.01 0.66 -0.68 120.40 131.50 1n7g s VAL 55 Ca 0.05 0.01 0.04 0.00 0.00 0.00 0.00 61.98 62.07 1n7g s VAL 55 Cb -0.17 -3.22 -0.01 0.00 0.00 0.00 0.00 36.38 32.99 1n7g s VAL 55 CO 0.06 0.44 -0.21 -1.00 0.00 0.00 0.00 175.10 174.39 1n7g s HIS 56 N 0.48 2.59 0.04 5.22 3.76 0.14 -1.64 115.29 125.88 1n7g s HIS 56 Ca 0.04 -0.81 0.06 0.00 -0.15 0.00 0.00 55.06 54.20 1n7g s HIS 56 Cb -0.12 -1.70 -0.02 0.00 1.11 0.00 0.00 32.58 31.84 1n7g s HIS 56 CO 0.00 -0.28 -0.18 0.20 -0.85 0.00 0.00 174.74 173.63 1n7g s GLY 57 N 0.13 0.99 -0.18 -2.22 0.00 -0.07 0.53 107.32 106.50 1n7g s GLY 57 Ca -0.11 -0.96 -0.09 0.00 0.00 0.00 0.00 44.72 43.56 1n7g s GLY 57 CO 0.06 -0.89 0.13 1.08 0.00 0.00 0.00 173.10 173.48 1n7g s LEU 58 N -1.11 4.26 0.18 0.66 1.43 -0.27 -0.53 118.68 123.30 1n7g s LEU 58 Ca 0.05 0.29 0.06 0.00 -1.03 0.00 0.00 54.13 53.51 1n7g s LEU 58 Cb -0.08 -2.09 -0.05 0.00 0.03 0.00 0.00 46.19 44.00 1n7g s LEU 58 CO 0.01 0.24 -0.11 0.27 0.23 0.00 0.00 176.35 176.99 1n7g s ILE 59 N 0.01 1.41 0.04 -0.59 -4.36 0.12 -3.71 121.20 114.11 1n7g s ILE 59 Ca 0.10 -2.12 -0.07 0.00 -0.26 0.00 0.00 60.65 58.29 1n7g s ILE 59 Cb -0.11 -1.97 -0.05 0.00 1.25 0.00 0.00 42.46 41.58 1n7g s ILE 59 CO -0.00 -0.65 0.32 -0.13 0.24 0.00 0.00 174.94 174.71 1n7g s ARG 60 N -3.71 3.64 0.22 0.37 0.52 -1.26 -0.95 118.95 117.79 1n7g s ARG 60 Ca 0.20 -0.00 -0.30 0.00 -0.52 0.00 0.00 55.73 55.11 1n7g s ARG 60 Cb 0.01 -3.04 -0.09 0.00 0.52 0.00 0.00 34.95 32.36 1n7g s ARG 60 CO 0.04 0.61 1.14 0.50 0.02 0.00 0.00 175.30 177.61 1n7g s ARG 61 N -1.86 4.57 0.03 3.54 3.00 -1.26 -5.00 118.95 121.97 1n7g s ARG 61 Ca 0.30 1.82 0.01 0.00 -1.00 0.00 0.00 55.73 56.86 1n7g s ARG 61 Cb -0.13 -3.23 -0.02 0.00 0.00 0.00 0.00 34.95 31.57 1n7g s ARG 61 CO 0.17 0.07 -0.06 0.45 0.00 0.00 0.00 175.30 175.93 1n7g s SER 62 N -0.33 0.65 0.18 -2.12 0.15 -1.26 -5.02 113.70 105.95 1n7g s SER 62 Ca 0.49 -0.53 0.22 0.00 0.70 0.00 0.00 55.95 56.83 1n7g s SER 62 Cb -0.32 0.06 0.89 0.00 -1.71 0.00 0.00 66.02 64.94 1n7g s SER 62 CO 0.38 -0.24 1.68 -1.54 1.20 0.00 0.00 173.24 174.73 1n7g n SER 63 N 1.51 0.51 -4.47 5.45 3.41 -1.26 -4.77 113.62 114.01 1n7g n SER 63 Ca -0.23 0.61 -0.23 0.00 -0.26 0.00 0.00 58.87 58.76 1n7g n SER 63 Cb 0.55 -0.72 -0.11 0.00 -0.26 0.00 0.00 64.21 63.67 1n7g n SER 63 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 1n7g s ASN 64 N -3.95 2.86 0.22 4.04 0.01 -1.26 -5.11 114.94 111.74 1n7g s ASN 64 Ca 0.06 -1.28 -0.32 0.00 -0.71 0.00 0.00 52.86 50.61 1n7g s ASN 64 Cb 0.10 -0.19 -0.13 0.00 0.41 0.00 0.00 41.25 41.44 1n7g s ASN 64 CO 0.40 -0.44 1.51 0.33 -1.51 0.00 0.00 177.10 177.40 1n7g n PHE 65 N -0.69 2.34 -1.12 2.20 7.35 -1.26 -4.90 117.46 121.38 1n7g n PHE 65 Ca -0.04 0.33 0.00 0.00 -0.76 0.00 0.00 57.45 56.98 1n7g n PHE 65 Cb 0.65 -2.52 0.00 0.00 0.35 0.00 0.00 39.48 37.96 1n7g n PHE 65 CO 0.00 0.00 0.00 0.27 -0.76 0.00 0.00 176.76 176.27 1n7g n ASN 66 N 2.71 0.25 -0.96 -2.13 6.94 -1.26 -4.84 115.26 115.98 1n7g n ASN 66 Ca 0.13 -1.37 -0.01 0.00 -0.02 0.00 0.00 54.58 53.32 1n7g n ASN 66 Cb 0.31 -0.06 0.20 0.00 -2.36 0.00 0.00 39.78 37.88 1n7g n ASN 66 CO 0.00 0.00 0.00 0.35 -1.03 0.00 0.00 177.26 176.58 1n7g n THR 67 N -0.09 2.43 -0.22 5.53 -2.24 -1.26 -4.78 114.28 113.65 1n7g n THR 67 Ca 0.00 -2.92 0.15 0.00 -2.27 0.00 0.00 64.05 59.02 1n7g n THR 67 Cb 0.52 -0.29 0.46 0.00 -2.10 0.00 0.00 70.33 68.92 1n7g n THR 67 CO 0.00 0.00 0.00 1.56 -0.57 0.00 0.00 175.07 176.06 1n7g h GLN 68 N 1.00 0.50 0.00 -0.78 7.50 -1.90 -0.35 115.11 121.08 1n7g h GLN 68 Ca 0.14 -0.03 -0.07 0.00 0.50 0.00 0.00 58.65 59.20 1n7g h GLN 68 Cb 1.43 -0.11 -0.01 0.00 0.05 0.00 0.00 27.48 28.84 1n7g h GLN 68 CO 0.25 0.33 -0.32 0.00 -1.50 0.00 0.00 178.83 177.59 1n7g h ARG 69 N 0.51 0.00 -0.03 1.46 3.08 -1.86 -3.35 114.38 114.20 1n7g h ARG 69 Ca 0.42 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.47 1n7g h ARG 69 Cb 0.88 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.93 1n7g h ARG 69 CO -0.17 0.32 0.00 0.44 -1.07 0.00 0.00 179.97 179.49 1n7g n ILE 70 N -3.21 0.84 -0.06 2.04 -5.35 -0.85 -4.76 119.36 108.01 1n7g n ILE 70 Ca 0.02 -0.92 -0.08 0.00 -0.27 0.00 0.00 62.75 61.50 1n7g n ILE 70 Cb 0.63 0.58 -0.02 0.00 -1.74 0.00 0.00 39.64 39.10 1n7g n ILE 70 CO 0.00 0.00 0.00 -1.13 -1.76 0.00 0.00 176.55 173.66 1n7g h ASN 71 N 0.18 0.11 -0.00 7.28 -0.00 -1.22 -1.69 115.58 120.25 1n7g h ASN 71 Ca 0.00 0.02 0.00 0.00 -0.00 0.00 0.00 56.30 56.32 1n7g h ASN 71 Cb 0.44 0.01 -0.00 0.00 -0.00 0.00 0.00 38.32 38.77 1n7g h ASN 71 CO 0.00 0.10 0.00 1.12 -0.00 0.00 0.00 177.43 178.65 1n7g h HIS 72 N 0.21 0.00 0.14 0.67 2.07 -1.85 -0.51 115.15 115.88 1n7g h HIS 72 Ca 0.11 0.00 -0.31 0.00 -2.85 0.00 0.00 60.37 57.32 1n7g h HIS 72 Cb 0.07 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 30.05 1n7g h HIS 72 CO -0.12 0.00 -1.59 0.82 -3.07 0.00 0.00 177.93 173.97 1n7g h ILE 73 N 0.00 0.95 -0.49 6.12 2.04 -1.74 -3.20 117.51 121.19 1n7g h ILE 73 Ca 0.00 -2.43 -0.09 0.00 1.00 0.00 0.00 64.86 63.35 1n7g h ILE 73 Cb 0.01 2.70 -0.02 0.00 -0.74 0.00 0.00 36.82 38.77 1n7g h ILE 73 CO -0.00 0.77 -0.04 0.22 0.00 0.00 0.00 178.15 179.10 1n7g h TYR 74 N -0.14 0.92 0.00 1.37 5.03 -0.73 -2.90 116.97 120.52 1n7g h TYR 74 Ca -0.33 -0.15 0.00 0.00 2.58 0.00 0.00 58.73 60.83 1n7g h TYR 74 Cb 1.90 -0.24 0.00 0.00 1.55 0.00 0.00 36.73 39.93 1n7g h TYR 74 CO 0.11 0.86 0.00 0.82 -1.32 0.00 0.00 178.16 178.63 1n7g h ILE 75 N 0.78 0.00 0.00 1.81 1.08 -1.27 -3.50 117.51 116.41 1n7g h ILE 75 Ca 0.14 -0.50 -0.06 0.00 -0.39 0.00 0.00 64.86 64.05 1n7g h ILE 75 Cb 0.53 1.48 -0.01 0.00 -3.07 0.00 0.00 36.82 35.75 1n7g h ILE 75 CO 0.03 0.00 -0.29 -2.24 -0.69 0.00 0.00 178.15 174.96 1n7g h ASP 76 N 0.00 0.00 0.00 1.72 -0.00 -1.50 -3.51 116.42 113.13 1n7g h ASP 76 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.03 57.03 1n7g h ASP 76 Cb 0.73 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 40.06 1n7g h ASP 76 CO 0.00 0.29 0.00 2.29 -0.00 0.00 0.00 179.24 181.82 1n7g n LYS 82 N -4.12 0.00 0.00 4.15 0.00 -1.24 -5.13 118.16 111.82 1n7g n LYS 82 Ca -0.02 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.29 1n7g n LYS 82 Cb 0.34 -2.53 0.00 0.00 -0.00 0.00 0.00 35.03 32.84 1n7g n LYS 82 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1n7g n ALA 83 N 0.46 0.00 0.78 0.58 0.00 -1.26 -4.97 120.51 116.10 1n7g n ALA 83 Ca 0.00 0.00 0.10 0.00 0.00 0.00 0.00 53.44 53.54 1n7g n ALA 83 Cb 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 19.45 19.32 1n7g n ALA 83 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1n7g n LEU 84 N 0.00 0.78 -3.71 0.00 4.77 -1.26 -4.81 117.00 112.77 1n7g n LEU 84 Ca 0.00 -0.39 -0.28 0.00 -0.03 0.00 0.00 56.01 55.31 1n7g n LEU 84 Cb 0.00 -0.00 -0.16 0.00 -2.33 0.00 0.00 43.42 40.93 1n7g n LEU 84 CO 0.00 0.20 -0.35 -0.32 -1.33 0.00 0.00 177.39 175.58 1n7g s MET 85 N -3.11 0.59 0.08 3.23 1.75 -1.25 -0.24 119.30 120.34 1n7g s MET 85 Ca 0.05 -0.55 0.06 0.00 -1.25 0.00 0.00 55.69 54.00 1n7g s MET 85 Cb 0.16 -1.98 -0.04 0.00 2.84 0.00 0.00 34.83 35.81 1n7g s MET 85 CO 0.88 -0.75 -0.08 -1.59 -0.65 0.00 0.00 175.02 172.83 1n7g s LYS 86 N 1.85 2.27 -0.05 4.11 -2.85 -0.65 -3.64 119.74 120.78 1n7g s LYS 86 Ca 0.02 -0.93 0.06 0.00 -1.00 0.00 0.00 55.97 54.12 1n7g s LYS 86 Cb -0.17 -2.38 -0.01 0.00 -2.06 0.00 0.00 37.83 33.22 1n7g s LYS 86 CO -0.14 0.53 -0.23 -0.51 0.10 0.00 0.00 175.35 175.10 1n7g s LEU 87 N -2.04 2.03 0.01 2.77 1.43 -1.26 -0.89 118.68 120.74 1n7g s LEU 87 Ca 0.21 -0.48 0.04 0.00 -1.03 0.00 0.00 54.13 52.87 1n7g s LEU 87 Cb -0.11 -1.28 -0.01 0.00 0.03 0.00 0.00 46.19 44.81 1n7g s LEU 87 CO 0.13 0.23 -0.12 -1.00 0.23 0.00 0.00 176.35 175.81 1n7g s HIS 88 N -0.13 1.09 0.05 0.29 3.76 0.31 -4.96 115.29 115.69 1n7g s HIS 88 Ca -0.03 -0.27 -0.30 0.00 -0.15 0.00 0.00 55.06 54.31 1n7g s HIS 88 Cb -0.13 -0.67 -0.05 0.00 1.11 0.00 0.00 32.58 32.84 1n7g s HIS 88 CO 0.03 -0.00 1.11 0.71 -0.85 0.00 0.00 174.74 175.74 1n7g s TYR 89 N -0.54 3.54 0.22 1.40 1.51 -1.26 0.11 117.35 122.32 1n7g s TYR 89 Ca 0.03 1.47 -0.21 0.00 -1.01 0.00 0.00 57.07 57.35 1n7g s TYR 89 Cb -0.06 -3.30 0.07 0.00 -0.11 0.00 0.00 41.96 38.56 1n7g s TYR 89 CO 0.00 -0.75 0.96 0.00 -1.11 0.00 0.00 175.55 174.66 1n7g s ALA 90 N 0.94 -1.42 -0.21 3.71 0.00 -0.12 -4.86 121.76 119.80 1n7g s ALA 90 Ca 0.55 -0.32 -0.16 0.00 0.00 0.00 0.00 51.96 52.03 1n7g s ALA 90 Cb -0.26 0.72 0.06 0.00 0.00 0.00 0.00 23.12 23.64 1n7g s ALA 90 CO 0.29 -1.04 0.53 0.34 0.00 0.00 0.00 175.76 175.88 1n7g s ASP 91 N -3.23 -0.61 0.00 0.00 -1.08 -1.26 -3.99 116.67 106.51 1n7g s ASP 91 Ca 0.18 1.10 0.07 0.00 -0.52 0.00 0.00 52.55 53.39 1n7g s ASP 91 Cb -0.03 1.07 0.34 0.00 -1.46 0.00 0.00 42.92 42.85 1n7g s ASP 91 CO 0.06 -0.20 1.17 0.18 0.52 0.00 0.00 175.17 176.91 1n7g n LEU 92 N 3.33 0.00 -0.88 -1.34 4.32 -1.26 -0.90 117.00 120.26 1n7g n LEU 92 Ca -0.17 0.40 0.12 0.00 -0.02 0.00 0.00 56.01 56.35 1n7g n LEU 92 Cb 0.56 -0.40 0.20 0.00 -1.62 0.00 0.00 43.42 42.17 1n7g n LEU 92 CO 0.07 -0.30 0.69 0.35 -1.22 0.00 0.00 177.39 176.98 1n7g n THR 93 N -1.40 0.06 -3.97 -5.08 -2.24 -1.26 -4.34 114.28 96.06 1n7g n THR 93 Ca 0.03 -0.48 -0.31 0.00 -2.27 0.00 0.00 64.05 61.02 1n7g n THR 93 Cb 0.07 1.22 -0.14 0.00 -2.10 0.00 0.00 70.33 69.38 1n7g n THR 93 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1n7g s ASP 94 N -1.93 4.58 0.47 3.42 3.68 -0.08 -4.98 116.67 121.83 1n7g s ASP 94 Ca 0.31 -2.59 0.14 0.00 2.13 0.00 0.00 52.55 52.54 1n7g s ASP 94 Cb 0.20 -1.65 1.11 0.00 -1.45 0.00 0.00 42.92 41.14 1n7g s ASP 94 CO 0.31 -0.31 2.07 0.00 0.13 0.00 0.00 175.17 177.37 1n7g h ALA 95 N 7.07 1.97 -0.27 3.66 0.00 -1.84 -2.61 119.26 127.25 1n7g h ALA 95 Ca -0.06 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.77 1n7g h ALA 95 Cb 0.96 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.68 1n7g h ALA 95 CO 0.61 -0.02 -0.07 0.77 0.00 0.00 0.00 179.25 180.54 1n7g h SER 96 N 0.25 0.53 -0.24 0.00 0.02 -1.93 -2.22 113.55 109.96 1n7g h SER 96 Ca 0.13 -0.37 0.01 0.00 -0.84 0.00 0.00 61.79 60.71 1n7g h SER 96 Cb 0.20 -0.14 -0.01 0.00 0.14 0.00 0.00 62.40 62.59 1n7g h SER 96 CO -0.02 0.78 0.16 0.77 -1.14 0.00 0.00 176.83 177.37 1n7g h SER 97 N 0.27 0.26 0.10 3.07 4.64 -1.80 -0.13 113.55 119.96 1n7g h SER 97 Ca 0.07 -0.01 -0.00 0.00 -0.47 0.00 0.00 61.79 61.38 1n7g h SER 97 Cb 0.55 -0.06 0.00 0.00 -0.31 0.00 0.00 62.40 62.58 1n7g h SER 97 CO 0.03 0.18 -0.05 -0.07 -0.87 0.00 0.00 176.83 176.05 1n7g h LEU 98 N 0.30 -0.11 -0.92 5.97 3.38 -1.36 -3.09 115.31 119.49 1n7g h LEU 98 Ca 0.09 -0.47 0.02 0.00 0.09 0.00 0.00 57.88 57.61 1n7g h LEU 98 Cb -0.00 0.03 -0.05 0.00 0.09 0.00 0.00 40.66 40.73 1n7g h LEU 98 CO -0.02 0.48 0.60 -0.09 0.09 0.00 0.00 178.44 179.50 1n7g h ARG 99 N -0.78 1.18 -0.24 1.13 9.65 -1.18 -2.09 114.38 122.06 1n7g h ARG 99 Ca -0.01 -0.07 0.05 0.00 -1.10 0.00 0.00 59.98 58.85 1n7g h ARG 99 Cb 0.57 -0.27 -0.05 0.00 -1.39 0.00 0.00 29.97 28.83 1n7g h ARG 99 CO 0.02 0.78 -0.11 -0.09 2.80 0.00 0.00 179.97 183.37 1n7g h ARG 100 N 1.22 -0.08 0.00 0.20 2.43 -1.09 -0.48 114.38 116.57 1n7g h ARG 100 Ca 0.34 0.01 -0.04 0.00 -0.81 0.00 0.00 59.98 59.48 1n7g h ARG 100 Cb -0.10 0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.46 1n7g h ARG 100 CO -0.09 -0.05 -0.19 -1.49 -1.51 0.00 0.00 179.97 176.64 1n7g h TRP 101 N -0.08 0.00 -0.23 2.20 4.06 -1.42 -1.89 115.95 118.59 1n7g h TRP 101 Ca 0.13 0.00 -0.19 0.00 2.06 0.00 0.00 58.89 60.88 1n7g h TRP 101 Cb 0.28 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.44 1n7g h TRP 101 CO -0.29 0.19 -0.62 0.82 -3.56 0.00 0.00 178.44 174.98 1n7g h ILE 102 N 0.00 1.29 -0.40 1.49 2.04 -0.71 -0.15 117.51 121.06 1n7g h ILE 102 Ca -0.00 -1.83 -0.09 0.00 1.00 0.00 0.00 64.86 63.94 1n7g h ILE 102 Cb 0.85 1.77 -0.01 0.00 -0.74 0.00 0.00 36.82 38.68 1n7g h ILE 102 CO 0.02 0.59 -0.10 0.44 0.00 0.00 0.00 178.15 179.10 1n7g h ASP 103 N 0.58 0.79 -0.29 1.72 3.32 -0.90 -0.25 116.42 121.39 1n7g h ASP 103 Ca -0.01 -0.37 -0.12 0.00 0.02 0.00 0.00 57.03 56.55 1n7g h ASP 103 Cb 1.22 -0.22 -0.00 0.00 0.22 0.00 0.00 39.33 40.55 1n7g h ASP 103 CO 0.13 0.97 -0.30 0.58 -1.72 0.00 0.00 179.24 178.90 1n7g h VAL 104 N 0.59 1.30 0.14 -1.35 2.07 -1.31 -3.34 116.25 114.36 1n7g h VAL 104 Ca 0.10 -1.47 -0.29 0.00 0.82 0.00 0.00 66.70 65.86 1n7g h VAL 104 Cb 0.63 1.59 0.01 0.00 -1.52 0.00 0.00 31.29 31.99 1n7g h VAL 104 CO 0.04 0.47 -1.34 0.40 0.02 0.00 0.00 177.57 177.16 1n7g h ILE 105 N 0.46 1.40 -5.97 4.57 2.04 -1.03 -3.49 117.51 115.49 1n7g h ILE 105 Ca 0.04 -2.96 -0.38 0.00 1.00 0.00 0.00 64.86 62.57 1n7g h ILE 105 Cb 0.87 2.92 0.11 0.00 -0.74 0.00 0.00 36.82 39.98 1n7g h ILE 105 CO 0.07 0.87 -0.88 0.29 0.00 0.00 0.00 178.15 178.50 1n7g n LYS 106 N -3.54 -2.90 -1.70 2.37 5.02 -0.11 -4.93 118.16 112.38 1n7g n LYS 106 Ca -0.11 0.63 -0.33 0.00 -2.02 0.00 0.00 58.31 56.48 1n7g n LYS 106 Cb 1.04 -4.97 0.05 0.00 -0.02 0.00 0.00 35.03 31.13 1n7g n LYS 106 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 1n7g s PRO 107 N -5.56 2.74 -0.15 1.97 0.04 -1.26 -4.89 135.00 127.89 1n7g s PRO 107 Ca 0.29 1.35 0.05 0.00 0.04 0.00 0.00 61.00 62.73 1n7g s PRO 107 Cb -0.08 -1.95 -0.23 0.00 0.04 0.00 0.00 34.50 32.29 1n7g s PRO 107 CO 0.81 -1.29 0.23 -0.25 0.04 0.00 0.00 177.00 176.54 1n7g n ASP 108 N -2.56 1.41 -4.09 6.66 8.00 0.16 -4.73 116.55 121.40 1n7g n ASP 108 Ca 0.10 0.13 -0.22 0.00 0.71 0.00 0.00 54.79 55.51 1n7g n ASP 108 Cb 0.52 -0.22 -0.15 0.00 -0.02 0.00 0.00 41.12 41.25 1n7g n ASP 108 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1n7g s GLU 109 N -2.55 1.10 -0.11 -1.24 2.02 -0.89 -1.09 118.70 115.94 1n7g s GLU 109 Ca -0.19 -0.46 0.02 0.00 0.02 0.00 0.00 54.97 54.36 1n7g s GLU 109 Cb 0.07 -1.05 0.01 0.00 0.10 0.00 0.00 34.13 33.27 1n7g s GLU 109 CO 0.75 0.26 -0.18 0.08 0.02 0.00 0.00 175.26 176.20 1n7g s VAL 110 N -0.24 1.68 -0.29 2.63 1.01 0.50 -0.45 120.40 125.25 1n7g s VAL 110 Ca 0.04 -0.76 -0.01 0.00 0.00 0.00 0.00 61.98 61.25 1n7g s VAL 110 Cb -0.06 -1.51 0.05 0.00 0.00 0.00 0.00 36.38 34.87 1n7g s VAL 110 CO -0.00 0.48 -0.03 -0.31 0.00 0.00 0.00 175.10 175.24 1n7g s TYR 111 N 0.85 3.27 -0.78 5.22 2.02 0.09 -0.27 117.35 127.75 1n7g s TYR 111 Ca -0.09 -1.99 -0.18 0.00 -0.37 0.00 0.00 57.07 54.44 1n7g s TYR 111 Cb -0.15 -2.07 0.13 0.00 -0.40 0.00 0.00 41.96 39.47 1n7g s TYR 111 CO -0.00 -0.82 0.92 1.21 -1.57 0.00 0.00 175.55 175.29 1n7g s ASN 112 N 1.22 6.47 0.00 2.29 2.47 -0.19 -1.29 114.94 125.91 1n7g s ASN 112 Ca -0.06 -1.85 0.14 0.00 0.42 0.00 0.00 52.86 51.51 1n7g s ASN 112 Cb -0.20 -2.34 -0.11 0.00 -1.45 0.00 0.00 41.25 37.15 1n7g s ASN 112 CO -0.02 -1.04 0.64 0.18 -3.72 0.00 0.00 177.10 173.14 1n7g n LEU 113 N 6.19 0.87 -4.74 3.21 4.77 -0.80 -2.39 117.00 124.11 1n7g n LEU 113 Ca 0.09 -0.57 -0.42 0.00 -0.03 0.00 0.00 56.01 55.09 1n7g n LEU 113 Cb 0.46 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.53 1n7g n LEU 113 CO 0.51 0.20 1.23 0.00 -1.33 0.00 0.00 177.39 178.00 1n7g s ALA 114 N -2.18 3.76 -0.26 -1.18 0.00 -0.97 -4.72 121.76 116.21 1n7g s ALA 114 Ca 0.07 1.47 -0.32 0.00 0.00 0.00 0.00 51.96 53.18 1n7g s ALA 114 Cb 0.11 -3.63 0.17 0.00 0.00 0.00 0.00 23.12 19.77 1n7g s ALA 114 CO 0.52 -0.87 1.32 0.00 0.00 0.00 0.00 175.76 176.73 1n7g s ALA 115 N 0.50 -2.12 -0.80 0.00 0.00 -1.26 -4.82 121.76 113.26 1n7g s ALA 115 Ca 0.66 1.83 -0.23 0.00 0.00 0.00 0.00 51.96 54.23 1n7g s ALA 115 Cb -0.46 -0.99 0.07 0.00 0.00 0.00 0.00 23.12 21.74 1n7g s ALA 115 CO 0.40 -0.37 1.15 -1.14 0.00 0.00 0.00 175.76 175.80 1n7g s GLN 116 N -1.48 3.32 0.00 0.00 -0.44 -1.26 -4.86 119.66 114.95 1n7g s GLN 116 Ca 0.09 -0.97 0.28 0.00 -2.50 0.00 0.00 55.36 52.26 1n7g s GLN 116 Cb -0.01 -4.58 1.04 0.00 -1.64 0.00 0.00 33.01 27.82 1n7g s GLN 116 CO -0.05 -1.95 1.74 -1.13 0.50 0.00 0.00 175.29 174.39 1n7g n SER 117 N 8.01 1.05 -4.64 6.67 3.41 -1.26 -4.87 113.62 121.99 1n7g n SER 117 Ca 0.10 -1.09 -0.41 0.00 -0.26 0.00 0.00 58.87 57.22 1n7g n SER 117 Cb 0.48 0.03 -0.06 0.00 -0.26 0.00 0.00 64.21 64.41 1n7g n SER 117 CO 0.00 0.00 0.00 -2.28 -0.16 0.00 0.00 175.04 172.60 1n7g s HIS 118 N -2.26 3.31 0.14 7.33 5.65 -1.26 -4.96 115.29 123.24 1n7g s HIS 118 Ca 0.32 0.91 -0.18 0.00 0.25 0.00 0.00 55.06 56.37 1n7g s HIS 118 Cb 0.20 -2.88 -0.02 0.00 -1.18 0.00 0.00 32.58 28.70 1n7g s HIS 118 CO 0.43 -0.31 1.78 0.28 -0.65 0.00 0.00 174.74 176.27 1n7g h VAL 119 N 5.37 1.09 -0.67 0.89 2.07 -2.00 -2.12 116.25 120.88 1n7g h VAL 119 Ca -0.27 -0.19 -0.02 0.00 0.82 0.00 0.00 66.70 67.05 1n7g h VAL 119 Cb 1.12 0.65 -0.03 0.00 -1.52 0.00 0.00 31.29 31.51 1n7g h VAL 119 CO 0.79 0.09 0.35 0.00 0.02 0.00 0.00 177.57 178.82 1n7g h ALA 120 N 1.10 0.87 -0.23 1.67 0.00 -1.99 -2.37 119.26 118.30 1n7g h ALA 120 Ca 0.11 -0.12 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 1n7g h ALA 120 Cb -0.03 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.48 1n7g h ALA 120 CO -0.02 0.41 0.01 0.28 0.00 0.00 0.00 179.25 179.92 1n7g h VAL 121 N 0.93 1.14 0.00 0.00 2.07 -1.93 -2.45 116.25 116.01 1n7g h VAL 121 Ca 0.23 -0.55 -0.01 0.00 0.82 0.00 0.00 66.70 67.20 1n7g h VAL 121 Cb 0.08 0.96 -0.00 0.00 -1.52 0.00 0.00 31.29 30.81 1n7g h VAL 121 CO -0.03 0.19 -0.04 0.77 0.02 0.00 0.00 177.57 178.47 1n7g h SER 122 N 0.33 0.00 0.74 0.57 4.64 -0.83 -0.06 113.55 118.96 1n7g h SER 122 Ca 0.08 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.31 1n7g h SER 122 Cb 0.22 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.29 1n7g h SER 122 CO 0.00 0.04 -0.44 -0.26 -0.87 0.00 0.00 176.83 175.31 1n7g h PHE 123 N 0.00 0.00 0.05 4.77 -1.00 -1.47 -1.71 116.94 117.58 1n7g h PHE 123 Ca -0.00 0.00 -0.28 0.00 2.81 0.00 0.00 57.97 60.50 1n7g h PHE 123 Cb 0.09 0.00 -0.03 0.00 3.61 0.00 0.00 35.95 39.62 1n7g h PHE 123 CO 0.00 0.44 -1.49 0.93 -1.61 0.00 0.00 178.31 176.58 1n7g h GLU 124 N 0.00 0.10 -2.11 1.51 5.08 -1.15 -3.39 114.58 114.63 1n7g h GLU 124 Ca -0.00 -0.18 -0.56 0.00 -1.00 0.00 0.00 59.36 57.62 1n7g h GLU 124 Cb 0.93 0.07 -0.41 0.00 0.50 0.00 0.00 28.75 29.84 1n7g h GLU 124 CO 0.06 0.88 -0.89 0.44 -1.00 0.00 0.00 179.01 178.50 1n7g n ILE 125 N -3.29 1.00 -0.15 3.13 -5.35 -0.51 -4.95 119.36 109.25 1n7g n ILE 125 Ca -0.13 -4.78 -0.09 0.00 -0.27 0.00 0.00 62.75 57.48 1n7g n ILE 125 Cb 1.02 -1.54 0.00 0.00 -1.74 0.00 0.00 39.64 37.38 1n7g n ILE 125 CO 0.00 0.00 0.00 1.55 -1.76 0.00 0.00 176.55 176.34 1n7g h PRO 126 N 3.65 0.63 0.18 6.28 0.13 -1.52 -2.03 132.00 139.32 1n7g h PRO 126 Ca 0.12 -0.10 -0.01 0.00 -0.87 0.00 0.00 66.00 65.15 1n7g h PRO 126 Cb 0.76 -0.11 0.00 0.00 0.13 0.00 0.00 31.00 31.78 1n7g h PRO 126 CO 0.64 0.55 -0.09 -0.44 -0.23 0.00 0.00 178.00 178.43 1n7g h ASP 127 N 0.56 -0.23 -0.45 1.44 3.32 -1.92 0.78 116.42 119.92 1n7g h ASP 127 Ca 0.15 0.01 -0.00 0.00 0.02 0.00 0.00 57.03 57.21 1n7g h ASP 127 Cb 0.13 0.06 -0.02 0.00 0.22 0.00 0.00 39.33 39.72 1n7g h ASP 127 CO -0.02 -0.16 0.27 0.22 -1.72 0.00 0.00 179.24 177.84 1n7g h TYR 128 N -0.26 0.60 -0.44 4.55 3.20 -1.97 -1.36 116.97 121.29 1n7g h TYR 128 Ca -0.02 -0.00 0.05 0.00 3.14 0.00 0.00 58.73 61.90 1n7g h TYR 128 Cb 0.20 -0.20 -0.05 0.00 1.54 0.00 0.00 36.73 38.23 1n7g h TYR 128 CO -0.07 0.42 0.17 1.15 -1.64 0.00 0.00 178.16 178.19 1n7g h THR 129 N 0.60 0.89 -0.62 1.81 2.02 -1.13 -1.82 112.91 114.66 1n7g h THR 129 Ca 0.16 -0.12 -0.04 0.00 0.77 0.00 0.00 66.41 67.18 1n7g h THR 129 Cb -0.00 0.50 -0.03 0.00 -1.74 0.00 0.00 68.15 66.88 1n7g h THR 129 CO -0.03 0.06 0.24 0.00 0.37 0.00 0.00 175.52 176.16 1n7g h ALA 130 N 1.28 0.81 -0.30 6.16 0.00 -0.57 0.25 119.26 126.89 1n7g h ALA 130 Ca 0.20 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 1n7g h ALA 130 Cb 0.18 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 1n7g h ALA 130 CO -0.19 0.43 0.13 0.22 0.00 0.00 0.00 179.25 179.84 1n7g h ASP 131 N 0.87 0.37 0.03 0.00 3.58 -0.78 0.21 116.42 120.69 1n7g h ASP 131 Ca 0.21 -0.03 -0.25 0.00 0.42 0.00 0.00 57.03 57.38 1n7g h ASP 131 Cb 0.22 -0.09 -0.03 0.00 1.72 0.00 0.00 39.33 41.15 1n7g h ASP 131 CO -0.02 0.33 -1.35 0.58 -2.88 0.00 0.00 179.24 175.90 1n7g h VAL 132 N 0.41 0.90 0.04 2.25 2.07 -0.95 0.19 116.25 121.17 1n7g h VAL 132 Ca 0.11 -2.22 -0.24 0.00 0.82 0.00 0.00 66.70 65.16 1n7g h VAL 132 Cb 0.07 2.34 0.01 0.00 -1.52 0.00 0.00 31.29 32.18 1n7g h VAL 132 CO -0.01 0.44 -1.04 0.58 0.02 0.00 0.00 177.57 177.56 1n7g h VAL 133 N -0.78 1.41 0.00 2.57 2.07 -0.53 -3.13 116.25 117.86 1n7g h VAL 133 Ca -0.35 -2.58 0.00 0.00 0.82 0.00 0.00 66.70 64.59 1n7g h VAL 133 Cb 1.44 2.56 0.00 0.00 -1.52 0.00 0.00 31.29 33.78 1n7g h VAL 133 CO -0.14 0.77 0.00 0.00 0.02 0.00 0.00 177.57 178.22 1n7g n ALA 134 N -2.55 0.00 0.00 1.67 0.00 0.00 -4.13 120.51 115.50 1n7g n ALA 134 Ca -0.08 -0.14 0.03 0.00 0.00 0.00 0.00 53.44 53.25 1n7g n ALA 134 Cb 0.89 0.00 0.40 0.00 0.00 0.00 0.00 19.45 20.74 1n7g n ALA 134 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 1n7g h THR 135 N 0.00 1.12 -0.91 0.00 2.02 -1.50 -2.05 112.91 111.60 1n7g h THR 135 Ca 0.00 -0.30 0.01 0.00 0.77 0.00 0.00 66.41 66.89 1n7g h THR 135 Cb 0.00 0.59 -0.05 0.00 -1.74 0.00 0.00 68.15 66.95 1n7g h THR 135 CO 0.00 0.13 0.60 1.23 0.37 0.00 0.00 175.52 177.85 1n7g h GLY 136 N 0.61 1.28 1.50 2.16 0.00 -0.55 0.27 103.07 108.34 1n7g h GLY 136 Ca 0.14 -0.47 -0.08 0.00 0.00 0.00 0.00 47.33 46.92 1n7g h GLY 136 CO -0.02 0.45 -0.14 0.00 0.00 0.00 0.00 176.54 176.82 1n7g h ALA 137 N 1.34 1.12 -0.40 3.60 0.00 -1.42 -2.28 119.26 121.22 1n7g h ALA 137 Ca 0.34 -0.30 -0.15 0.00 0.00 0.00 0.00 54.91 54.79 1n7g h ALA 137 Cb -0.12 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.52 1n7g h ALA 137 CO -0.08 0.55 -0.35 1.25 0.00 0.00 0.00 179.25 180.62 1n7g h LEU 138 N 0.55 0.98 -0.77 0.00 5.85 -0.76 -1.59 115.31 119.57 1n7g h LEU 138 Ca 0.09 -0.43 0.02 0.00 0.84 0.00 0.00 57.88 58.40 1n7g h LEU 138 Cb 0.56 -0.27 -0.04 0.00 0.37 0.00 0.00 40.66 41.28 1n7g h LEU 138 CO 0.04 1.22 0.50 0.03 -0.34 0.00 0.00 178.44 179.89 1n7g h ARG 139 N 0.77 0.96 0.07 1.25 3.08 -0.17 0.35 114.38 120.69 1n7g h ARG 139 Ca 0.07 -0.06 -0.00 0.00 0.07 0.00 0.00 59.98 60.06 1n7g h ARG 139 Cb 0.93 -0.22 0.00 0.00 0.08 0.00 0.00 29.97 30.77 1n7g h ARG 139 CO 0.09 0.64 -0.04 1.25 -1.07 0.00 0.00 179.97 180.84 1n7g h LEU 140 N 0.99 -0.08 -0.43 3.04 5.85 -1.28 -0.02 115.31 123.38 1n7g h LEU 140 Ca 0.30 -0.28 0.09 0.00 0.84 0.00 0.00 57.88 58.83 1n7g h LEU 140 Cb -0.05 0.02 -0.08 0.00 0.37 0.00 0.00 40.66 40.92 1n7g h LEU 140 CO -0.09 0.23 -0.13 -0.07 -0.34 0.00 0.00 178.44 178.05 1n7g h LEU 141 N -0.41 -0.46 -1.29 2.25 3.38 -1.05 0.16 115.31 117.88 1n7g h LEU 141 Ca -0.01 0.14 -0.07 0.00 0.09 0.00 0.00 57.88 58.03 1n7g h LEU 141 Cb 0.35 0.29 -0.01 0.00 0.09 0.00 0.00 40.66 41.38 1n7g h LEU 141 CO 0.02 -0.16 -0.27 -0.08 0.09 0.00 0.00 178.44 178.03 1n7g h GLU 142 N -0.03 0.13 -0.25 1.13 4.57 -0.84 -0.04 114.58 119.25 1n7g h GLU 142 Ca 0.21 -0.04 -0.18 0.00 -1.18 0.00 0.00 59.36 58.17 1n7g h GLU 142 Cb 0.34 -0.01 -0.00 0.00 -0.16 0.00 0.00 28.75 28.92 1n7g h GLU 142 CO -0.46 0.40 -0.55 0.00 -1.18 0.00 0.00 179.01 177.21 1n7g h ALA 143 N 1.61 0.55 -0.32 2.92 0.00 0.40 -1.71 119.26 122.72 1n7g h ALA 143 Ca 0.02 -0.52 -0.16 0.00 0.00 0.00 0.00 54.91 54.25 1n7g h ALA 143 Cb 0.55 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 1n7g h ALA 143 CO 0.04 0.69 -0.45 0.28 0.00 0.00 0.00 179.25 179.81 1n7g h VAL 144 N 0.58 1.28 -0.08 0.00 2.07 -0.26 -1.93 116.25 117.91 1n7g h VAL 144 Ca 0.01 -1.63 -0.01 0.00 0.82 0.00 0.00 66.70 65.89 1n7g h VAL 144 Cb 1.14 1.51 -0.00 0.00 -1.52 0.00 0.00 31.29 32.42 1n7g h VAL 144 CO 0.12 0.53 0.01 -0.09 0.02 0.00 0.00 177.57 178.16 1n7g h ARG 145 N 0.66 0.13 -0.79 1.57 2.43 -0.97 -1.68 114.38 115.72 1n7g h ARG 145 Ca 0.04 -0.03 0.03 0.00 -0.81 0.00 0.00 59.98 59.21 1n7g h ARG 145 Cb 1.03 -0.01 -0.04 0.00 -0.42 0.00 0.00 29.97 30.52 1n7g h ARG 145 CO 0.10 0.35 0.52 0.77 -1.51 0.00 0.00 179.97 180.20 1n7g h SER 146 N -0.12 0.85 0.23 -3.80 0.02 -1.31 -2.03 113.55 107.40 1n7g h SER 146 Ca 0.02 -0.01 -0.01 0.00 -0.84 0.00 0.00 61.79 60.95 1n7g h SER 146 Cb 0.29 -0.20 0.00 0.00 0.14 0.00 0.00 62.40 62.63 1n7g h SER 146 CO 0.00 0.59 -0.11 -0.74 -1.14 0.00 0.00 176.83 175.44 1n7g h HIS 147 N 1.00 -0.29 -0.47 3.45 -0.00 -1.17 -1.01 115.15 116.66 1n7g h HIS 147 Ca 0.31 -0.01 0.03 0.00 -0.00 0.00 0.00 60.37 60.70 1n7g h HIS 147 Cb 0.01 0.09 -0.03 0.00 -0.00 0.00 0.00 27.41 27.49 1n7g h HIS 147 CO -0.00 0.01 0.31 1.79 -0.00 0.00 0.00 177.93 180.04 1n7g h THR 148 N -0.58 1.05 0.07 6.26 1.35 -1.08 -0.21 112.91 119.78 1n7g h THR 148 Ca -0.03 -0.18 -0.19 0.00 -0.55 0.00 0.00 66.41 65.46 1n7g h THR 148 Cb 0.42 0.47 0.02 0.00 -1.73 0.00 0.00 68.15 67.33 1n7g h THR 148 CO 0.05 0.10 -0.77 0.40 -0.25 0.00 0.00 175.52 175.05 1n7g h ILE 149 N 0.53 1.44 0.00 6.82 1.08 -1.34 0.34 117.51 126.39 1n7g h ILE 149 Ca 0.19 -2.30 -0.10 0.00 -0.39 0.00 0.00 64.86 62.26 1n7g h ILE 149 Cb 0.09 2.84 -0.01 0.00 -3.07 0.00 0.00 36.82 36.67 1n7g h ILE 149 CO -0.05 0.67 -0.46 -0.78 -0.69 0.00 0.00 178.15 176.84 1n7g h ASP 150 N -0.15 0.00 -0.00 1.72 3.58 -0.91 -3.27 116.42 117.38 1n7g h ASP 150 Ca -0.12 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.33 1n7g h ASP 150 Cb 1.52 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.57 1n7g h ASP 150 CO 0.15 0.46 -0.37 -1.54 -2.88 0.00 0.00 179.24 175.05 1n7g n SER 151 N -3.95 0.54 -0.01 2.28 3.41 -0.11 -5.00 113.62 110.77 1n7g n SER 151 Ca -0.02 -0.77 -0.00 0.00 -0.26 0.00 0.00 58.87 57.82 1n7g n SER 151 Cb 0.48 0.90 -0.00 0.00 -0.26 0.00 0.00 64.21 65.34 1n7g n SER 151 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1n7g n GLY 152 N 1.14 0.36 3.92 5.00 0.00 0.12 -5.01 105.19 110.71 1n7g n GLY 152 Ca 0.02 -0.02 -0.28 0.00 0.00 0.00 0.00 46.02 45.75 1n7g n GLY 152 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1n7g s ARG 153 N -0.66 1.88 -0.04 1.61 0.52 -1.08 -4.98 118.95 116.20 1n7g s ARG 153 Ca 0.00 -0.15 0.07 0.00 -0.52 0.00 0.00 55.73 55.13 1n7g s ARG 153 Cb 0.00 -2.04 -0.01 0.00 0.52 0.00 0.00 34.95 33.42 1n7g s ARG 153 CO 0.00 -1.56 -0.25 0.99 0.02 0.00 0.00 175.30 174.50 1n7g s THR 154 N -3.47 2.02 -0.01 0.02 2.01 -1.26 -4.54 115.64 110.40 1n7g s THR 154 Ca 0.63 -1.07 0.01 0.00 0.31 0.00 0.00 61.69 61.57 1n7g s THR 154 Cb -0.10 -1.69 0.00 0.00 0.01 0.00 0.00 72.50 70.72 1n7g s THR 154 CO 0.48 0.57 -0.04 -0.69 -0.69 0.00 0.00 174.62 174.24 1n7g s VAL 155 N -0.37 0.36 -0.17 3.82 1.01 -1.26 -4.71 120.40 119.08 1n7g s VAL 155 Ca 0.03 -0.17 -0.07 0.00 0.00 0.00 0.00 61.98 61.77 1n7g s VAL 155 Cb -0.12 -0.32 -0.04 0.00 0.00 0.00 0.00 36.38 35.90 1n7g s VAL 155 CO 0.01 0.11 0.08 -0.54 0.00 0.00 0.00 175.10 174.77 1n7g s LYS 156 N 0.05 3.85 -0.06 2.72 1.02 -0.25 -4.24 119.74 122.84 1n7g s LYS 156 Ca -0.00 -0.29 0.05 0.00 0.02 0.00 0.00 55.97 55.75 1n7g s LYS 156 Cb -0.04 -3.22 -0.02 0.00 -0.52 0.00 0.00 37.83 34.04 1n7g s LYS 156 CO -0.00 0.40 -0.20 -0.47 -0.92 0.00 0.00 175.35 174.16 1n7g s TYR 157 N 0.03 2.56 -0.09 3.18 5.04 0.20 -0.37 117.35 127.89 1n7g s TYR 157 Ca 0.07 -0.46 0.04 0.00 -2.44 0.00 0.00 57.07 54.28 1n7g s TYR 157 Cb -0.12 -1.62 0.00 0.00 0.35 0.00 0.00 41.96 40.57 1n7g s TYR 157 CO 0.00 -0.04 -0.23 -0.47 -1.34 0.00 0.00 175.55 173.48 1n7g s TYR 158 N -0.39 2.39 -0.17 4.97 5.04 0.63 -0.34 117.35 129.48 1n7g s TYR 158 Ca 0.03 -0.94 -0.02 0.00 -2.44 0.00 0.00 57.07 53.70 1n7g s TYR 158 Cb -0.12 -1.61 -0.01 0.00 0.35 0.00 0.00 41.96 40.57 1n7g s TYR 158 CO 0.02 -0.37 -0.07 -1.14 -1.34 0.00 0.00 175.55 172.64 1n7g s GLN 159 N 0.31 3.45 -1.08 4.97 2.00 -0.19 -1.02 119.66 128.10 1n7g s GLN 159 Ca -0.16 -0.62 -0.22 0.00 -2.00 0.00 0.00 55.36 52.35 1n7g s GLN 159 Cb -0.17 -2.85 -0.02 0.00 0.80 0.00 0.00 33.01 30.77 1n7g s GLN 159 CO 0.08 0.05 1.80 0.00 -0.50 0.00 0.00 175.29 176.71 1n7g s ALA 160 N 0.82 2.23 0.80 1.58 0.00 -1.01 -1.64 121.76 124.55 1n7g s ALA 160 Ca -0.02 -2.11 -0.12 0.00 0.00 0.00 0.00 51.96 49.71 1n7g s ALA 160 Cb -0.15 -4.60 0.07 0.00 0.00 0.00 0.00 23.12 18.44 1n7g s ALA 160 CO 0.01 -4.39 1.13 0.20 0.00 0.00 0.00 175.76 172.71 1n7g s GLY 161 N 6.24 1.60 0.01 0.00 0.00 0.14 -4.96 107.32 110.36 1n7g s GLY 161 Ca 0.61 -0.46 0.00 0.00 0.00 0.00 0.00 44.72 44.87 1n7g s GLY 161 CO 0.03 -0.00 -0.02 -0.45 0.00 0.00 0.00 173.10 172.66 1n7g s SER 162 N -4.29 0.16 0.57 1.64 0.15 -1.26 -2.76 113.70 107.91 1n7g s SER 162 Ca 0.61 -0.32 0.38 0.00 0.70 0.00 0.00 55.95 57.32 1n7g s SER 162 Cb -0.12 0.06 1.94 0.00 -1.71 0.00 0.00 66.02 66.19 1n7g s SER 162 CO 0.52 -0.19 2.14 0.77 1.20 0.00 0.00 173.24 177.68 1n7g h SER 163 N 5.19 0.00 0.01 5.45 4.64 -1.35 -1.10 113.55 126.40 1n7g h SER 163 Ca -0.29 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.03 1n7g h SER 163 Cb 1.21 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.30 1n7g h SER 163 CO 0.45 0.00 -0.00 -0.08 -0.87 0.00 0.00 176.83 176.32 1n7g h GLU 164 N 0.00 0.00 -0.15 4.77 4.57 -1.95 -1.27 114.58 120.55 1n7g h GLU 164 Ca 0.00 0.00 -0.06 0.00 -1.18 0.00 0.00 59.36 58.12 1n7g h GLU 164 Cb 0.13 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.70 1n7g h GLU 164 CO 0.00 0.00 -0.19 0.52 -1.18 0.00 0.00 179.01 178.16 1n7g h MET 165 N 0.00 0.25 0.00 1.92 2.86 -1.46 -2.24 114.93 116.26 1n7g h MET 165 Ca -0.00 -0.07 -0.05 0.00 -2.06 0.00 0.00 59.70 57.52 1n7g h MET 165 Cb 0.01 -0.03 -0.01 0.00 0.06 0.00 0.00 31.60 31.63 1n7g h MET 165 CO 0.00 0.45 -0.25 0.74 1.06 0.00 0.00 176.91 178.91 1n7g h PHE 166 N 0.24 0.00 0.00 -0.22 -1.00 -1.43 -2.62 116.94 111.90 1n7g h PHE 166 Ca 0.04 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.82 1n7g h PHE 166 Cb 0.48 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.04 1n7g h PHE 166 CO 0.01 0.25 0.00 0.41 -1.61 0.00 0.00 178.31 177.37 1n7g n GLY 167 N -0.64 3.89 0.09 -1.45 0.00 -0.84 -1.45 105.19 104.79 1n7g n GLY 167 Ca -0.02 0.20 0.14 0.00 0.00 0.00 0.00 46.02 46.34 1n7g n GLY 167 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1n7g n SER 168 N 7.40 0.41 -4.70 1.61 3.41 -1.04 -4.69 113.62 116.02 1n7g n SER 168 Ca 0.00 -0.44 -0.44 0.00 -0.26 0.00 0.00 58.87 57.73 1n7g n SER 168 Cb 0.00 -0.10 -0.04 0.00 -0.26 0.00 0.00 64.21 63.82 1n7g n SER 168 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 1n7g n THR 169 N -1.05 0.00 -1.81 6.66 -1.04 -0.53 -4.90 114.28 111.62 1n7g n THR 169 Ca 0.13 -0.00 -0.39 0.00 -2.04 0.00 0.00 64.05 61.75 1n7g n THR 169 Cb 0.28 -1.78 0.02 0.00 -1.82 0.00 0.00 70.33 67.03 1n7g n THR 169 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 1n7g s PRO 170 N 1.05 3.54 0.73 -2.82 0.04 -1.26 -4.96 135.00 131.32 1n7g s PRO 170 Ca 0.77 2.35 -0.12 0.00 0.04 0.00 0.00 61.00 64.05 1n7g s PRO 170 Cb -0.58 -2.55 0.03 0.00 0.04 0.00 0.00 34.50 31.44 1n7g s PRO 170 CO 0.35 -0.91 1.11 -1.25 0.04 0.00 0.00 177.00 176.33 1n7g s PRO 171 N -2.57 2.62 0.37 0.56 0.04 -1.26 -4.50 135.00 130.26 1n7g s PRO 171 Ca 0.64 0.46 -0.24 0.00 0.04 0.00 0.00 61.00 61.90 1n7g s PRO 171 Cb -0.42 -1.99 -0.10 0.00 0.04 0.00 0.00 34.50 32.02 1n7g s PRO 171 CO 0.53 -1.21 0.96 -1.25 0.04 0.00 0.00 177.00 176.08 1n7g s PRO 172 N -5.34 4.39 -0.17 0.56 0.04 -1.26 -5.06 135.00 128.16 1n7g s PRO 172 Ca 0.59 1.28 -0.07 0.00 0.04 0.00 0.00 61.00 62.84 1n7g s PRO 172 Cb -0.12 -2.54 -0.04 0.00 0.04 0.00 0.00 34.50 31.84 1n7g s PRO 172 CO 0.52 0.11 0.06 -0.65 0.04 0.00 0.00 177.00 177.08 1n7g s GLN 173 N -2.52 3.89 0.24 4.56 1.11 0.07 -4.86 119.66 122.13 1n7g s GLN 173 Ca 0.56 -0.33 0.00 0.00 0.01 0.00 0.00 55.36 55.60 1n7g s GLN 173 Cb -0.16 -3.19 -0.00 0.00 -1.01 0.00 0.00 33.01 28.65 1n7g s GLN 173 CO 0.20 0.34 0.01 -1.13 0.01 0.00 0.00 175.29 174.72 1n7g n SER 174 N 3.33 2.50 0.29 5.90 3.41 -1.26 -1.49 113.62 126.30 1n7g n SER 174 Ca -0.17 -2.06 0.18 0.00 -0.26 0.00 0.00 58.87 56.57 1n7g n SER 174 Cb 0.52 0.20 0.98 0.00 -0.26 0.00 0.00 64.21 65.65 1n7g n SER 174 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 1n7g h GLU 175 N 0.00 0.00 -0.23 4.33 3.07 -1.93 -1.48 114.58 118.34 1n7g h GLU 175 Ca -0.20 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.66 1n7g h GLU 175 Cb 0.60 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.51 1n7g h GLU 175 CO 0.32 0.00 0.00 0.25 -1.40 0.00 0.00 179.01 178.18 1n7g n THR 176 N -3.48 0.29 -2.46 1.13 -2.24 -1.26 -4.94 114.28 101.31 1n7g n THR 176 Ca -0.01 -0.64 -0.42 0.00 -2.27 0.00 0.00 64.05 60.70 1n7g n THR 176 Cb 0.19 1.20 -0.03 0.00 -2.10 0.00 0.00 70.33 69.60 1n7g n THR 176 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1n7g s THR 177 N -1.68 4.17 0.64 4.28 2.01 -0.56 -5.00 115.64 119.50 1n7g s THR 177 Ca 0.34 1.55 -0.18 0.00 0.31 0.00 0.00 61.69 63.71 1n7g s THR 177 Cb 0.21 -3.99 -0.01 0.00 0.01 0.00 0.00 72.50 68.72 1n7g s THR 177 CO 0.31 0.11 1.24 -2.16 -0.69 0.00 0.00 174.62 173.43 1n7g s PRO 178 N 1.12 2.63 0.27 4.92 0.04 -1.26 -4.90 135.00 137.82 1n7g s PRO 178 Ca 0.58 1.91 -0.09 0.00 0.04 0.00 0.00 61.00 63.43 1n7g s PRO 178 Cb -0.28 -1.88 -0.07 0.00 0.04 0.00 0.00 34.50 32.32 1n7g s PRO 178 CO 0.29 -1.49 0.59 -0.06 0.04 0.00 0.00 177.00 176.37 1n7g s PHE 179 N -1.59 3.43 -0.47 0.56 0.08 -1.26 -4.72 117.98 114.01 1n7g s PHE 179 Ca 0.79 0.89 0.06 0.00 0.12 0.00 0.00 56.93 58.79 1n7g s PHE 179 Cb -0.33 -2.28 0.26 0.00 -0.57 0.00 0.00 43.02 40.09 1n7g s PHE 179 CO 0.38 0.19 0.89 1.58 -0.10 0.00 0.00 175.22 178.17 1n7g n HIS 180 N -0.43 -2.95 -1.63 0.36 -0.00 -0.99 -4.98 115.22 104.60 1n7g n HIS 180 Ca 0.01 -2.01 -0.44 0.00 0.46 0.00 0.00 57.72 55.74 1n7g n HIS 180 Cb 0.53 1.38 -0.01 0.00 -0.12 0.00 0.00 29.99 31.76 1n7g n HIS 180 CO 0.00 0.00 0.00 -0.35 0.46 0.00 0.00 176.34 176.45 1n7g n PRO 181 N 1.38 1.64 -0.20 1.57 -0.04 -1.20 -2.49 135.00 135.67 1n7g n PRO 181 Ca 0.10 0.58 0.06 0.00 -0.04 0.00 0.00 63.50 64.19 1n7g n PRO 181 Cb 0.63 -2.03 0.15 0.00 -0.04 0.00 0.00 33.50 32.21 1n7g n PRO 181 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1n7g n ARG 182 N 0.64 2.81 -3.73 0.54 5.12 -1.26 -4.87 116.66 115.91 1n7g n ARG 182 Ca 0.08 -2.17 -0.09 0.00 -1.93 0.00 0.00 57.85 53.73 1n7g n ARG 182 Cb 0.34 -1.37 -0.03 0.00 -1.16 0.00 0.00 32.46 30.24 1n7g n ARG 182 CO 0.00 0.00 0.00 -1.54 -1.93 0.00 0.00 177.63 174.16 1n7g s SER 183 N -1.33 -0.30 0.29 0.55 1.04 -1.26 -4.43 113.70 108.26 1n7g s SER 183 Ca 0.24 -0.46 -0.01 0.00 0.48 0.00 0.00 55.95 56.20 1n7g s SER 183 Cb 0.16 0.62 0.44 0.00 0.10 0.00 0.00 66.02 67.34 1n7g s SER 183 CO 0.11 -1.12 1.87 -0.65 0.98 0.00 0.00 173.24 174.43 1n7g h PRO 184 N 2.12 0.86 0.27 4.02 0.11 -1.89 -1.25 132.00 136.24 1n7g h PRO 184 Ca -0.27 -0.14 -0.01 0.00 0.11 0.00 0.00 66.00 65.69 1n7g h PRO 184 Cb 1.27 -0.15 -0.00 0.00 0.11 0.00 0.00 31.00 32.22 1n7g h PRO 184 CO 0.34 0.72 -0.16 -0.92 -0.21 0.00 0.00 178.00 177.76 1n7g h TYR 185 N 0.85 -0.42 -0.55 0.65 3.20 -1.87 0.03 116.97 118.86 1n7g h TYR 185 Ca 0.20 -0.01 0.01 0.00 3.14 0.00 0.00 58.73 62.08 1n7g h TYR 185 Cb 0.18 0.15 -0.03 0.00 1.54 0.00 0.00 36.73 38.57 1n7g h TYR 185 CO 0.01 -0.26 0.35 0.00 -1.64 0.00 0.00 178.16 176.63 1n7g h ALA 186 N 0.30 0.70 -0.20 1.82 0.00 -1.80 0.10 119.26 120.18 1n7g h ALA 186 Ca -0.03 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.81 1n7g h ALA 186 Cb 0.34 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 1n7g h ALA 186 CO 0.03 0.11 -0.04 0.00 0.00 0.00 0.00 179.25 179.35 1n7g h ALA 187 N 1.21 1.57 -0.02 0.00 0.00 -1.09 -0.90 119.26 120.03 1n7g h ALA 187 Ca 0.21 -0.16 -0.17 0.00 0.00 0.00 0.00 54.91 54.79 1n7g h ALA 187 Cb -0.06 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 1n7g h ALA 187 CO -0.06 0.32 -0.73 0.77 0.00 0.00 0.00 179.25 179.55 1n7g h SER 188 N 0.28 0.20 -0.33 0.00 0.02 0.10 -2.52 113.55 111.29 1n7g h SER 188 Ca 0.06 -0.13 -0.15 0.00 -0.84 0.00 0.00 61.79 60.73 1n7g h SER 188 Cb 0.27 -0.06 -0.01 0.00 0.14 0.00 0.00 62.40 62.74 1n7g h SER 188 CO 0.01 0.86 -0.35 0.11 -1.14 0.00 0.00 176.83 176.32 1n7g h LYS 189 N 0.11 0.87 -0.88 3.45 1.79 0.10 -1.09 116.57 120.92 1n7g h LYS 189 Ca -0.02 -0.44 -0.00 0.00 -2.18 0.00 0.00 60.65 58.01 1n7g h LYS 189 Cb 1.29 0.00 -0.04 0.00 -1.58 0.00 0.00 32.23 31.90 1n7g h LYS 189 CO 0.11 1.08 0.54 0.00 -1.08 0.00 0.00 179.45 180.10 1n7g h ALA 191 N 1.29 0.51 -0.63 0.00 0.00 -1.20 0.32 119.26 119.54 1n7g h ALA 191 Ca 0.32 -0.15 -0.04 0.00 0.00 0.00 0.00 54.91 55.04 1n7g h ALA 191 Cb -0.07 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.54 1n7g h ALA 191 CO -0.06 0.13 0.25 0.00 0.00 0.00 0.00 179.25 179.57 1n7g h ALA 192 N 0.98 1.26 -0.44 0.00 0.00 -0.60 0.57 119.26 121.03 1n7g h ALA 192 Ca 0.13 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 1n7g h ALA 192 Cb 0.23 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 1n7g h ALA 192 CO -0.01 0.55 0.24 1.25 0.00 0.00 0.00 179.25 181.28 1n7g h HIS 193 N 0.90 0.61 -0.04 0.00 2.76 0.25 -1.90 115.15 117.75 1n7g h HIS 193 Ca 0.21 -0.02 -0.14 0.00 -2.20 0.00 0.00 60.37 58.22 1n7g h HIS 193 Cb 0.18 -0.19 -0.01 0.00 1.55 0.00 0.00 27.41 28.93 1n7g h HIS 193 CO 0.01 0.47 -0.63 -1.49 -1.30 0.00 0.00 177.93 174.99 1n7g h TRP 194 N 0.58 0.18 -0.47 5.26 -0.00 -0.37 -1.51 115.95 119.62 1n7g h TRP 194 Ca 0.16 -0.07 -0.08 0.00 -0.00 0.00 0.00 58.89 58.90 1n7g h TRP 194 Cb 0.06 -0.03 -0.02 0.00 -0.00 0.00 0.00 29.16 29.18 1n7g h TRP 194 CO -0.02 0.73 -0.00 1.88 -0.00 0.00 0.00 178.44 181.03 1n7g h TYR 195 N 0.10 0.91 0.18 0.49 0.99 -0.72 -1.22 116.97 117.70 1n7g h TYR 195 Ca -0.01 -0.16 -0.01 0.00 2.00 0.00 0.00 58.73 60.56 1n7g h TYR 195 Cb 1.13 -0.24 0.00 0.00 1.00 0.00 0.00 36.73 38.63 1n7g h TYR 195 CO 0.01 0.87 -0.09 1.15 -0.00 0.00 0.00 178.16 180.10 1n7g h THR 196 N 0.68 0.90 -1.01 -2.88 2.02 -1.26 -1.19 112.91 110.18 1n7g h THR 196 Ca 0.13 -0.37 0.09 0.00 0.77 0.00 0.00 66.41 67.03 1n7g h THR 196 Cb 0.51 1.13 -0.08 0.00 -1.74 0.00 0.00 68.15 67.97 1n7g h THR 196 CO 0.02 0.09 0.64 0.58 0.37 0.00 0.00 175.52 177.22 1n7g h VAL 197 N -0.42 1.01 -0.59 3.16 2.07 -1.24 -2.18 116.25 118.06 1n7g h VAL 197 Ca -0.02 -0.38 -0.05 0.00 0.82 0.00 0.00 66.70 67.07 1n7g h VAL 197 Cb 0.32 -0.18 -0.02 0.00 -1.52 0.00 0.00 31.29 29.89 1n7g h VAL 197 CO 0.04 0.20 0.17 -1.13 0.02 0.00 0.00 177.57 176.87 1n7g h ASN 198 N 1.10 0.87 0.73 0.57 -0.00 -0.93 -0.89 115.58 117.03 1n7g h ASN 198 Ca 0.46 -0.21 -0.04 0.00 -0.00 0.00 0.00 56.30 56.51 1n7g h ASN 198 Cb 0.31 -0.23 -0.01 0.00 -0.00 0.00 0.00 38.32 38.39 1n7g h ASN 198 CO -0.21 0.85 -0.19 1.88 -0.00 0.00 0.00 177.43 179.76 1n7g h TYR 199 N 0.84 0.00 -0.00 0.67 -1.99 -0.66 0.37 116.97 116.20 1n7g h TYR 199 Ca 0.19 0.00 -0.02 0.00 2.00 0.00 0.00 58.73 60.90 1n7g h TYR 199 Cb 0.30 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.03 1n7g h TYR 199 CO 0.02 0.19 -0.06 -0.09 -0.00 0.00 0.00 178.16 178.22 1n7g h ARG 200 N 0.00 0.04 -0.17 4.88 2.43 -0.98 -2.39 114.38 118.20 1n7g h ARG 200 Ca -0.00 -0.05 -0.18 0.00 -0.81 0.00 0.00 59.98 58.95 1n7g h ARG 200 Cb 0.61 0.01 -0.00 0.00 -0.42 0.00 0.00 29.97 30.17 1n7g h ARG 200 CO 0.02 0.83 -0.62 0.93 -1.51 0.00 0.00 179.97 179.62 1n7g h GLU 201 N -0.72 0.58 0.12 0.20 5.08 -1.01 -0.89 114.58 117.93 1n7g h GLU 201 Ca -0.01 -0.40 -0.30 0.00 -1.00 0.00 0.00 59.36 57.65 1n7g h GLU 201 Cb 0.85 0.06 -0.01 0.00 0.50 0.00 0.00 28.75 30.15 1n7g h GLU 201 CO 0.01 1.02 -1.48 0.00 -1.00 0.00 0.00 179.01 177.56 1n7g h ALA 202 N 0.89 0.25 -0.00 3.43 0.00 -0.39 -3.40 119.26 120.04 1n7g h ALA 202 Ca -0.01 -1.07 0.00 0.00 0.00 0.00 0.00 54.91 53.83 1n7g h ALA 202 Cb 1.19 0.23 0.00 0.00 0.00 0.00 0.00 17.79 19.21 1n7g h ALA 202 CO 0.12 1.12 -0.06 0.66 0.00 0.00 0.00 179.25 181.09 1n7g n TYR 203 N -3.46 0.00 -1.05 0.00 4.02 -0.91 -4.99 117.16 110.76 1n7g n TYR 203 Ca -0.15 0.00 -0.02 0.00 -0.01 0.00 0.00 57.90 57.72 1n7g n TYR 203 Cb 1.04 0.00 -0.01 0.00 -0.02 0.00 0.00 39.34 40.35 1n7g n TYR 203 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1n7g n GLY 204 N 0.54 0.54 3.74 2.72 0.00 -0.34 -4.99 105.19 107.40 1n7g n GLY 204 Ca 0.02 -0.57 -0.41 0.00 0.00 0.00 0.00 46.02 45.05 1n7g n GLY 204 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1n7g s LEU 205 N -0.41 4.39 -1.12 0.99 2.96 -1.13 -4.88 118.68 119.48 1n7g s LEU 205 Ca 0.00 2.61 -0.22 0.00 -0.22 0.00 0.00 54.13 56.31 1n7g s LEU 205 Cb 0.00 -3.62 0.02 0.00 0.50 0.00 0.00 46.19 43.09 1n7g s LEU 205 CO 0.00 -0.69 1.70 0.12 -1.32 0.00 0.00 176.35 176.16 1n7g s PHE 206 N 0.17 2.40 -0.09 5.38 2.19 -1.26 -4.27 117.98 122.50 1n7g s PHE 206 Ca 0.60 -0.65 0.04 0.00 0.33 0.00 0.00 56.93 57.25 1n7g s PHE 206 Cb -0.41 -4.50 0.00 0.00 -1.31 0.00 0.00 43.02 36.80 1n7g s PHE 206 CO 0.41 -1.75 -0.22 0.00 1.83 0.00 0.00 175.22 175.49 1n7g s ALA 207 N 6.52 2.01 0.11 11.12 0.00 -1.26 0.60 121.76 140.87 1n7g s ALA 207 Ca 0.56 -0.87 0.10 0.00 0.00 0.00 0.00 51.96 51.75 1n7g s ALA 207 Cb 0.00 -0.77 -0.04 0.00 0.00 0.00 0.00 23.12 22.31 1n7g s ALA 207 CO 0.01 0.26 -0.23 0.00 0.00 0.00 0.00 175.76 175.80 1n7g s ASN 209 N -2.02 4.50 -0.43 0.00 0.01 -1.18 -1.03 114.94 114.79 1n7g s ASN 209 Ca 0.16 -0.52 -0.19 0.00 -0.71 0.00 0.00 52.86 51.59 1n7g s ASN 209 Cb -0.10 -1.76 0.02 0.00 0.41 0.00 0.00 41.25 39.82 1n7g s ASN 209 CO 0.08 -0.07 0.57 -0.83 -1.51 0.00 0.00 177.10 175.33 1n7g s GLY 210 N 1.46 1.78 -1.20 0.66 0.00 -0.65 -1.91 107.32 107.47 1n7g s GLY 210 Ca 0.04 -1.33 -0.13 0.00 0.00 0.00 0.00 44.72 43.30 1n7g s GLY 210 CO -0.02 1.39 1.41 1.39 0.00 0.00 0.00 173.10 177.27 1n7g n ILE 211 N 5.69 4.33 -3.11 0.90 5.41 0.77 0.27 119.36 133.63 1n7g n ILE 211 Ca -0.04 -4.84 -0.38 0.00 1.00 0.00 0.00 62.75 58.49 1n7g n ILE 211 Cb 0.48 -2.48 -0.06 0.00 -0.71 0.00 0.00 39.64 36.87 1n7g n ILE 211 CO 0.00 0.00 0.00 -0.76 0.00 0.00 0.00 176.55 175.79 1n7g s LEU 212 N 0.95 4.50 0.55 1.39 1.02 -1.11 -1.95 118.68 124.02 1n7g s LEU 212 Ca 0.41 1.46 0.01 0.00 0.02 0.00 0.00 54.13 56.02 1n7g s LEU 212 Cb -0.03 -3.27 0.03 0.00 0.02 0.00 0.00 46.19 42.94 1n7g s LEU 212 CO -0.01 0.17 0.77 -0.36 0.02 0.00 0.00 176.35 176.95 1n7g s PHE 213 N -1.26 2.90 -0.15 0.29 0.40 -0.80 -1.03 117.98 118.33 1n7g s PHE 213 Ca 0.36 0.03 -0.41 0.00 -0.60 0.00 0.00 56.93 56.31 1n7g s PHE 213 Cb -0.20 -2.73 -0.19 0.00 0.51 0.00 0.00 43.02 40.41 1n7g s PHE 213 CO 0.23 -0.85 1.32 0.09 0.70 0.00 0.00 175.22 176.71 1n7g n ASN 214 N -2.34 0.81 -3.92 1.36 4.13 -1.19 -4.79 115.26 109.32 1n7g n ASN 214 Ca 0.07 1.15 -0.20 0.00 1.68 0.00 0.00 54.58 57.28 1n7g n ASN 214 Cb 0.59 -0.97 -0.16 0.00 -1.54 0.00 0.00 39.78 37.70 1n7g n ASN 214 CO 0.00 0.00 0.00 -1.38 0.28 0.00 0.00 177.26 176.16 1n7g s HIS 215 N 1.23 0.84 0.51 3.10 -3.43 -1.26 -1.06 115.29 115.23 1n7g s HIS 215 Ca 0.94 -0.24 0.04 0.00 -0.80 0.00 0.00 55.06 55.00 1n7g s HIS 215 Cb -1.26 -0.70 0.00 0.00 -1.43 0.00 0.00 32.58 29.19 1n7g s HIS 215 CO 0.63 -0.18 0.18 -1.21 -2.00 0.00 0.00 174.74 172.16 1n7g s GLU 216 N 0.75 2.22 -0.06 -0.38 0.41 0.32 -4.61 118.70 117.35 1n7g s GLU 216 Ca -0.11 -2.19 -0.31 0.00 -0.41 0.00 0.00 54.97 51.96 1n7g s GLU 216 Cb -0.14 -1.81 0.11 0.00 -1.78 0.00 0.00 34.13 30.52 1n7g s GLU 216 CO 0.01 -0.43 1.35 -1.54 -0.49 0.00 0.00 175.26 174.15 1n7g s SER 217 N -4.04 -0.01 0.00 -0.19 1.04 -1.26 -1.40 113.70 107.84 1n7g s SER 217 Ca 0.21 -0.09 0.17 0.00 0.48 0.00 0.00 55.95 56.72 1n7g s SER 217 Cb 0.00 0.07 0.84 0.00 0.10 0.00 0.00 66.02 67.04 1n7g s SER 217 CO 0.13 -0.14 1.49 -2.65 0.98 0.00 0.00 173.24 173.04 1n7g n PRO 218 N -0.76 0.24 -0.16 4.02 -0.02 -1.26 -2.08 135.00 134.98 1n7g n PRO 218 Ca -0.01 0.13 0.08 0.00 -2.02 0.00 0.00 63.50 61.68 1n7g n PRO 218 Cb 0.60 -1.50 0.17 0.00 -0.02 0.00 0.00 33.50 32.75 1n7g n PRO 218 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1n7g n ARG 219 N -1.29 2.21 -1.82 -0.52 1.74 -1.26 -4.98 116.66 110.74 1n7g n ARG 219 Ca 0.08 -1.99 -0.39 0.00 -0.77 0.00 0.00 57.85 54.77 1n7g n ARG 219 Cb 0.13 -1.37 0.02 0.00 -1.02 0.00 0.00 32.46 30.22 1n7g n ARG 219 CO 0.00 0.00 0.00 0.50 -1.52 0.00 0.00 177.63 176.61 1n7g s ARG 220 N -1.17 3.59 0.25 5.56 6.06 -0.88 -4.59 118.95 127.78 1n7g s ARG 220 Ca 0.29 2.36 -0.31 0.00 -2.50 0.00 0.00 55.73 55.56 1n7g s ARG 220 Cb 0.17 -2.58 -0.13 0.00 0.06 0.00 0.00 34.95 32.47 1n7g s ARG 220 CO 0.23 -0.87 1.46 0.41 -2.50 0.00 0.00 175.30 174.03 1n7g n GLY 221 N 0.61 0.94 0.09 8.12 0.00 -1.26 -4.85 105.19 108.83 1n7g n GLY 221 Ca 0.06 0.50 0.08 0.00 0.00 0.00 0.00 46.02 46.65 1n7g n GLY 221 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1n7g n GLU 222 N 2.15 0.09 0.00 1.61 1.02 -1.26 -2.02 120.64 122.23 1n7g n GLU 222 Ca 0.11 0.49 0.13 0.00 -0.02 0.00 0.00 57.16 57.87 1n7g n GLU 222 Cb 0.33 -1.74 0.43 0.00 -0.02 0.00 0.00 31.44 30.44 1n7g n GLU 222 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1n7g n ASN 223 N -1.93 1.18 -4.84 1.62 5.03 -1.26 -3.33 115.26 111.73 1n7g n ASN 223 Ca 0.01 -1.09 -0.36 0.00 0.87 0.00 0.00 54.58 54.01 1n7g n ASN 223 Cb 0.09 0.08 -0.06 0.00 -1.02 0.00 0.00 39.78 38.88 1n7g n ASN 223 CO 0.00 0.00 0.00 -0.36 -1.83 0.00 0.00 177.26 175.07 1n7g s PHE 224 N -2.33 3.63 0.25 3.10 0.40 -0.86 -4.91 117.98 117.26 1n7g s PHE 224 Ca 0.29 1.03 -0.05 0.00 -0.60 0.00 0.00 56.93 57.60 1n7g s PHE 224 Cb 0.20 -2.34 0.48 0.00 0.51 0.00 0.00 43.02 41.86 1n7g s PHE 224 CO 0.45 0.47 1.64 -0.24 0.70 0.00 0.00 175.22 178.25 1n7g h VAL 225 N 2.93 0.36 -0.11 -0.44 3.04 -1.88 0.84 116.25 120.99 1n7g h VAL 225 Ca -0.49 -0.05 -0.00 0.00 -1.01 0.00 0.00 66.70 65.15 1n7g h VAL 225 Cb 1.20 0.21 -0.00 0.00 -2.01 0.00 0.00 31.29 30.68 1n7g h VAL 225 CO 0.65 0.02 0.05 0.71 -1.01 0.00 0.00 177.57 178.00 1n7g h THR 226 N 0.13 1.13 -0.36 3.17 1.35 -1.94 -1.20 112.91 115.18 1n7g h THR 226 Ca 0.43 -0.37 -0.14 0.00 -0.55 0.00 0.00 66.41 65.79 1n7g h THR 226 Cb 0.78 1.17 -0.01 0.00 -1.73 0.00 0.00 68.15 68.37 1n7g h THR 226 CO -0.65 0.11 -0.30 -0.09 -0.25 0.00 0.00 175.52 174.34 1n7g h ARG 227 N 0.04 0.84 -0.84 4.72 9.65 -1.73 -2.17 114.38 124.89 1n7g h ARG 227 Ca 0.04 -0.42 0.10 0.00 -1.10 0.00 0.00 59.98 58.59 1n7g h ARG 227 Cb 0.13 0.01 -0.06 0.00 -1.39 0.00 0.00 29.97 28.66 1n7g h ARG 227 CO -0.00 1.06 0.55 -0.22 2.80 0.00 0.00 179.97 184.16 1n7g h LYS 228 N 0.64 0.79 0.18 0.20 3.64 -0.73 0.08 116.57 121.36 1n7g h LYS 228 Ca 0.06 -0.05 -0.01 0.00 -1.27 0.00 0.00 60.65 59.39 1n7g h LYS 228 Cb 0.88 -0.18 0.00 0.00 -0.41 0.00 0.00 32.23 32.53 1n7g h LYS 228 CO 0.08 0.52 -0.08 0.82 -2.27 0.00 0.00 179.45 178.52 1n7g h ILE 229 N 0.81 0.79 0.00 2.00 2.04 -0.97 -2.52 117.51 119.65 1n7g h ILE 229 Ca 0.39 -1.09 -0.03 0.00 1.00 0.00 0.00 64.86 65.12 1n7g h ILE 229 Cb 0.42 1.32 -0.00 0.00 -0.74 0.00 0.00 36.82 37.82 1n7g h ILE 229 CO -0.16 0.20 -0.16 0.71 0.00 0.00 0.00 178.15 178.75 1n7g h THR 230 N -0.88 1.10 -0.10 -0.27 1.35 -1.24 0.37 112.91 113.25 1n7g h THR 230 Ca -0.02 -0.55 -0.04 0.00 -0.55 0.00 0.00 66.41 65.25 1n7g h THR 230 Cb 0.51 1.30 -0.00 0.00 -1.73 0.00 0.00 68.15 68.23 1n7g h THR 230 CO 0.04 0.16 -0.10 -0.09 -0.25 0.00 0.00 175.52 175.28 1n7g h ARG 231 N 0.00 0.24 -0.58 4.72 9.65 -1.06 -1.63 114.38 125.72 1n7g h ARG 231 Ca -0.00 -0.13 -0.08 0.00 -1.10 0.00 0.00 59.98 58.67 1n7g h ARG 231 Cb 0.28 0.00 -0.02 0.00 -1.39 0.00 0.00 29.97 28.85 1n7g h ARG 231 CO 0.02 0.66 0.04 0.00 2.80 0.00 0.00 179.97 183.49 1n7g h ALA 232 N 0.58 0.77 0.09 2.80 0.00 -0.96 -2.66 119.26 119.88 1n7g h ALA 232 Ca 0.02 -0.28 0.01 0.00 0.00 0.00 0.00 54.91 54.65 1n7g h ALA 232 Cb 0.61 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.17 1n7g h ALA 232 CO 0.02 0.57 -0.14 1.25 0.00 0.00 0.00 179.25 180.96 1n7g h LEU 233 N 0.88 -0.37 -0.93 0.00 5.85 -0.26 -0.84 115.31 119.65 1n7g h LEU 233 Ca 0.17 0.04 0.14 0.00 0.84 0.00 0.00 57.88 59.07 1n7g h LEU 233 Cb 0.49 0.14 -0.09 0.00 0.37 0.00 0.00 40.66 41.57 1n7g h LEU 233 CO 0.02 -0.20 0.54 1.23 -0.34 0.00 0.00 178.44 179.69 1n7g h GLY 234 N -0.28 1.54 1.09 3.75 0.00 -1.20 0.44 103.07 108.41 1n7g h GLY 234 Ca 0.02 -0.34 -0.11 0.00 0.00 0.00 0.00 47.33 46.89 1n7g h GLY 234 CO -0.07 0.06 -0.11 3.21 0.00 0.00 0.00 176.54 179.63 1n7g h ARG 235 N 0.81 1.01 -0.64 4.80 3.08 -1.09 -2.96 114.38 119.39 1n7g h ARG 235 Ca 0.49 -0.38 -0.04 0.00 0.07 0.00 0.00 59.98 60.12 1n7g h ARG 235 Cb 0.59 -0.06 -0.03 0.00 0.08 0.00 0.00 29.97 30.55 1n7g h ARG 235 CO -0.31 1.06 0.24 0.82 -1.07 0.00 0.00 179.97 180.71 1n7g h ILE 236 N 0.89 1.24 0.00 2.04 2.04 0.13 0.23 117.51 124.08 1n7g h ILE 236 Ca 0.14 -0.77 -0.00 0.00 1.00 0.00 0.00 64.86 65.22 1n7g h ILE 236 Cb 0.68 0.55 -0.00 0.00 -0.74 0.00 0.00 36.82 37.30 1n7g h ILE 236 CO 0.05 0.30 -0.02 0.50 0.00 0.00 0.00 178.15 178.98 1n7g h LYS 237 N 0.90 0.00 -0.48 2.37 1.63 -0.85 -1.67 116.57 118.48 1n7g h LYS 237 Ca 0.21 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 60.01 1n7g h LYS 237 Cb 0.23 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 31.86 1n7g h LYS 237 CO -0.01 0.02 0.00 1.33 -3.45 0.00 0.00 179.45 177.34 1n7g n VAL 238 N -4.46 0.74 -1.52 2.00 0.24 -0.97 -4.98 118.33 109.38 1n7g n VAL 238 Ca -0.03 -0.87 -0.05 0.00 -2.04 0.00 0.00 64.34 61.35 1n7g n VAL 238 Cb 0.11 0.74 -0.01 0.00 -1.47 0.00 0.00 33.84 33.20 1n7g n VAL 238 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1n7g n GLY 239 N 1.30 0.52 0.01 7.63 0.00 -0.58 -4.93 105.19 109.15 1n7g n GLY 239 Ca 0.19 -0.78 0.11 0.00 0.00 0.00 0.00 46.02 45.53 1n7g n GLY 239 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1n7g n LEU 240 N -0.61 0.63 -3.91 0.99 4.77 0.70 -4.95 117.00 114.62 1n7g n LEU 240 Ca -0.05 -0.22 -0.09 0.00 -0.03 0.00 0.00 56.01 55.61 1n7g n LEU 240 Cb 0.31 -0.04 -0.09 0.00 -2.33 0.00 0.00 43.42 41.28 1n7g n LEU 240 CO 0.07 0.13 -0.18 -1.58 -1.33 0.00 0.00 177.39 174.50 1n7g s GLN 241 N -3.18 0.66 0.00 3.23 0.74 -1.19 -4.94 119.66 114.98 1n7g s GLN 241 Ca 0.03 -0.80 0.00 0.00 0.05 0.00 0.00 55.36 54.64 1n7g s GLN 241 Cb 0.15 0.26 0.00 0.00 1.10 0.00 0.00 33.01 34.52 1n7g s GLN 241 CO 0.85 -0.18 0.00 0.25 -0.55 0.00 0.00 175.29 175.67 1n7g n THR 242 N 0.55 0.00 -4.93 -0.34 -2.24 -1.26 -4.01 114.28 102.06 1n7g n THR 242 Ca -0.18 0.00 -0.26 0.00 -2.27 0.00 0.00 64.05 61.34 1n7g n THR 242 Cb 0.59 -0.12 -0.15 0.00 -2.10 0.00 0.00 70.33 68.55 1n7g n THR 242 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1n7g s LYS 243 N -1.20 1.55 -0.12 -0.78 3.01 -1.26 -4.62 119.74 116.32 1n7g s LYS 243 Ca 0.00 -0.69 0.02 0.00 -1.01 0.00 0.00 55.97 54.29 1n7g s LYS 243 Cb 0.00 -1.50 0.01 0.00 -1.01 0.00 0.00 37.83 35.33 1n7g s LYS 243 CO 0.00 0.41 -0.16 -1.17 0.51 0.00 0.00 175.35 174.94 1n7g s LEU 244 N -0.45 1.78 -0.20 3.17 2.96 -0.49 -5.01 118.68 120.44 1n7g s LEU 244 Ca 0.07 -0.46 -0.08 0.00 -0.22 0.00 0.00 54.13 53.44 1n7g s LEU 244 Cb -0.07 -1.15 -0.04 0.00 0.50 0.00 0.00 46.19 45.42 1n7g s LEU 244 CO -0.01 0.02 0.07 -0.36 -1.32 0.00 0.00 176.35 174.75 1n7g s PHE 245 N 1.02 3.24 0.34 5.38 0.40 -1.26 -0.30 117.98 126.80 1n7g s PHE 245 Ca -0.05 0.04 0.04 0.00 -0.60 0.00 0.00 56.93 56.35 1n7g s PHE 245 Cb -0.15 -2.12 -0.03 0.00 0.51 0.00 0.00 43.02 41.23 1n7g s PHE 245 CO -0.03 0.09 0.15 -0.51 0.70 0.00 0.00 175.22 175.63 1n7g s LEU 246 N 0.57 1.81 0.00 -0.37 1.43 -0.29 -4.96 118.68 116.88 1n7g s LEU 246 Ca 0.04 -1.60 0.00 0.00 -1.03 0.00 0.00 54.13 51.54 1n7g s LEU 246 Cb -0.13 0.10 0.00 0.00 0.03 0.00 0.00 46.19 46.19 1n7g s LEU 246 CO 0.01 -0.90 0.00 0.61 0.23 0.00 0.00 176.35 176.30 1n7g n GLY 247 N -0.69 0.80 3.58 -3.19 0.00 -1.26 -1.50 105.19 102.93 1n7g n GLY 247 Ca -0.01 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.58 1n7g n GLY 247 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1n7g s ASN 248 N 0.05 6.53 0.17 1.61 2.47 -1.26 -4.82 114.94 119.70 1n7g s ASN 248 Ca 0.00 0.24 0.25 0.00 0.42 0.00 0.00 52.86 53.77 1n7g s ASN 248 Cb 0.00 -2.52 0.49 0.00 -1.45 0.00 0.00 41.25 37.76 1n7g s ASN 248 CO 0.00 -1.28 1.48 -0.07 -3.72 0.00 0.00 177.10 173.51 1n7g h LEU 249 N 11.29 0.00 0.00 3.21 3.38 -1.96 -3.33 115.31 127.90 1n7g h LEU 249 Ca -0.24 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 57.61 1n7g h LEU 249 Cb 1.06 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.81 1n7g h LEU 249 CO 1.12 0.06 -0.19 0.00 0.09 0.00 0.00 178.44 179.53 1n7g n GLN 250 N -2.24 0.02 -1.93 1.13 6.02 -1.26 -1.74 117.38 117.38 1n7g n GLN 250 Ca 0.04 0.01 -0.41 0.00 -0.01 0.00 0.00 57.00 56.63 1n7g n GLN 250 Cb 0.45 -1.52 -0.01 0.00 1.02 0.00 0.00 30.24 30.17 1n7g n GLN 250 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1n7g s ALA 251 N -3.01 3.58 -0.06 -1.58 0.00 -1.25 -4.76 121.76 114.67 1n7g s ALA 251 Ca 0.13 1.44 0.03 0.00 0.00 0.00 0.00 51.96 53.56 1n7g s ALA 251 Cb 0.18 -3.57 -0.03 0.00 0.00 0.00 0.00 23.12 19.71 1n7g s ALA 251 CO 0.60 -0.88 -0.12 0.45 0.00 0.00 0.00 175.76 175.81 1n7g s SER 252 N -0.10 4.17 0.06 0.00 0.15 -0.25 -1.75 113.70 115.98 1n7g s SER 252 Ca 0.54 -0.17 0.00 0.00 0.70 0.00 0.00 55.95 57.02 1n7g s SER 252 Cb -0.44 -1.00 -0.04 0.00 -1.71 0.00 0.00 66.02 62.84 1n7g s SER 252 CO 0.55 0.33 -0.05 -0.13 1.20 0.00 0.00 173.24 175.15 1n7g s ARG 253 N -0.64 0.62 -0.48 5.44 1.81 0.12 -2.11 118.95 123.72 1n7g s ARG 253 Ca 0.09 -1.10 -0.16 0.00 -1.72 0.00 0.00 55.73 52.85 1n7g s ARG 253 Cb -0.11 -0.00 0.08 0.00 -0.45 0.00 0.00 34.95 34.47 1n7g s ARG 253 CO 0.01 -0.05 0.41 0.34 -0.68 0.00 0.00 175.30 175.33 1n7g s ASP 254 N -2.56 6.15 -0.31 0.23 3.68 -0.87 -0.91 116.67 122.08 1n7g s ASP 254 Ca 0.03 -1.36 -0.10 0.00 2.13 0.00 0.00 52.55 53.24 1n7g s ASP 254 Cb 0.02 -2.19 -0.01 0.00 -1.45 0.00 0.00 42.92 39.29 1n7g s ASP 254 CO -0.06 -0.68 0.17 0.26 0.13 0.00 0.00 175.17 175.00 1n7g s TRP 255 N 1.67 3.19 0.38 -5.34 0.51 -1.26 -3.17 118.94 114.92 1n7g s TRP 255 Ca 0.04 -0.43 0.03 0.00 -2.12 0.00 0.00 56.10 53.62 1n7g s TRP 255 Cb -0.25 -2.38 0.03 0.00 -0.81 0.00 0.00 33.47 30.06 1n7g s TRP 255 CO 0.06 -0.41 0.22 0.41 -0.51 0.00 0.00 176.95 176.73 1n7g n GLY 256 N 5.01 3.05 3.54 0.98 0.00 -0.22 -4.63 105.19 112.92 1n7g n GLY 256 Ca -0.14 -2.28 -0.36 0.00 0.00 0.00 0.00 46.02 43.24 1n7g n GLY 256 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1n7g s PHE 257 N -2.02 3.17 0.41 1.61 5.36 -1.26 -0.52 117.98 124.73 1n7g s PHE 257 Ca 0.17 -0.13 0.19 0.00 -0.96 0.00 0.00 56.93 56.19 1n7g s PHE 257 Cb -0.01 -2.23 1.12 0.00 -0.34 0.00 0.00 43.02 41.55 1n7g s PHE 257 CO 0.11 -0.16 1.80 0.00 -1.46 0.00 0.00 175.22 175.50 1n7g h ALA 258 N 7.83 2.26 -0.72 11.12 0.00 -1.49 0.21 119.26 138.47 1n7g h ALA 258 Ca -0.37 0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.58 1n7g h ALA 258 Cb 1.18 0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.95 1n7g h ALA 258 CO 0.61 -0.63 0.45 0.78 0.00 0.00 0.00 179.25 180.45 1n7g h GLY 259 N 0.38 1.03 0.86 0.00 0.00 -1.94 -1.98 103.07 101.43 1n7g h GLY 259 Ca 0.56 -0.41 -0.12 0.00 0.00 0.00 0.00 47.33 47.35 1n7g h GLY 259 CO -0.25 0.40 -0.38 -0.55 0.00 0.00 0.00 176.54 175.76 1n7g h ASP 260 N 0.99 0.59 -0.61 0.19 3.45 -1.01 -3.34 116.42 116.68 1n7g h ASP 260 Ca 0.26 -0.58 -0.05 0.00 0.43 0.00 0.00 57.03 57.08 1n7g h ASP 260 Cb -0.06 -0.17 -0.03 0.00 -0.56 0.00 0.00 39.33 38.51 1n7g h ASP 260 CO -0.05 1.07 0.19 1.88 -1.57 0.00 0.00 179.24 180.75 1n7g h TYR 261 N 0.14 1.02 -0.03 4.55 -1.99 -1.07 -2.74 116.97 116.86 1n7g h TYR 261 Ca -0.01 -0.09 0.01 0.00 2.00 0.00 0.00 58.73 60.64 1n7g h TYR 261 Cb 1.00 -0.30 -0.00 0.00 2.00 0.00 0.00 36.73 39.43 1n7g h TYR 261 CO 0.10 0.82 0.02 -0.39 -0.00 0.00 0.00 178.16 178.72 1n7g h VAL 262 N 0.95 0.80 -0.47 -2.88 -1.51 -1.49 0.11 116.25 111.76 1n7g h VAL 262 Ca 0.21 0.00 -0.08 0.00 -1.23 0.00 0.00 66.70 65.59 1n7g h VAL 262 Cb 0.29 0.98 -0.02 0.00 -2.13 0.00 0.00 31.29 30.41 1n7g h VAL 262 CO -0.01 0.00 -0.05 -0.33 -1.23 0.00 0.00 177.57 175.95 1n7g h GLU 263 N 0.00 0.82 -0.30 5.19 3.07 -1.63 -2.67 114.58 119.05 1n7g h GLU 263 Ca 0.01 -0.25 -0.09 0.00 -0.50 0.00 0.00 59.36 58.54 1n7g h GLU 263 Cb 0.06 -0.08 -0.02 0.00 -0.84 0.00 0.00 28.75 27.87 1n7g h GLU 263 CO -0.00 0.85 -0.18 0.00 -1.40 0.00 0.00 179.01 178.29 1n7g h ALA 264 N 1.19 1.14 -0.60 3.43 0.00 -1.04 -0.63 119.26 122.75 1n7g h ALA 264 Ca 0.14 -0.31 -0.02 0.00 0.00 0.00 0.00 54.91 54.71 1n7g h ALA 264 Cb 0.53 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.15 1n7g h ALA 264 CO 0.03 0.54 0.28 0.52 0.00 0.00 0.00 179.25 180.62 1n7g h MET 265 N 0.49 0.87 -0.18 0.00 2.86 -1.14 -1.81 114.93 116.02 1n7g h MET 265 Ca 0.08 -0.13 -0.02 0.00 -2.06 0.00 0.00 59.70 57.57 1n7g h MET 265 Cb 0.58 -0.15 -0.01 0.00 0.06 0.00 0.00 31.60 32.08 1n7g h MET 265 CO 0.04 0.71 0.05 2.35 1.06 0.00 0.00 176.91 181.11 1n7g h TRP 266 N 0.82 0.30 -0.36 -0.22 7.01 -1.20 -3.15 115.95 119.15 1n7g h TRP 266 Ca 0.21 -0.03 0.06 0.00 2.11 0.00 0.00 58.89 61.23 1n7g h TRP 266 Cb 0.13 -0.08 -0.06 0.00 -2.10 0.00 0.00 29.16 27.05 1n7g h TRP 266 CO 0.00 0.41 0.02 -0.07 -2.79 0.00 0.00 178.44 176.01 1n7g h LEU 267 N 0.10 -0.10 -0.87 0.65 3.38 -0.88 -2.13 115.31 115.45 1n7g h LEU 267 Ca 0.06 0.08 0.22 0.00 0.09 0.00 0.00 57.88 58.32 1n7g h LEU 267 Cb 0.26 0.13 -0.13 0.00 0.09 0.00 0.00 40.66 41.01 1n7g h LEU 267 CO 0.00 -0.02 0.31 0.24 0.09 0.00 0.00 178.44 179.07 1n7g h MET 268 N 0.13 0.31 0.00 1.13 2.86 -1.29 0.24 114.93 118.30 1n7g h MET 268 Ca 0.18 -0.02 0.00 0.00 -2.06 0.00 0.00 59.70 57.80 1n7g h MET 268 Cb 0.23 -0.07 0.00 0.00 0.06 0.00 0.00 31.60 31.82 1n7g h MET 268 CO -0.28 0.20 0.00 1.28 1.06 0.00 0.00 176.91 179.18 1n7g n LEU 269 N -5.12 0.00 0.02 1.22 4.32 -0.82 -3.17 117.00 113.46 1n7g n LEU 269 Ca 0.21 0.31 0.11 0.00 -0.02 0.00 0.00 56.01 56.62 1n7g n LEU 269 Cb 0.64 -0.31 0.01 0.00 -1.62 0.00 0.00 43.42 42.14 1n7g n LEU 269 CO 0.11 -0.04 -0.04 0.00 -1.22 0.00 0.00 177.39 176.20 1n7g n GLN 270 N -1.31 0.29 -0.80 3.23 1.13 0.83 -4.96 117.38 115.80 1n7g n GLN 270 Ca 0.12 -0.01 -0.29 0.00 -1.94 0.00 0.00 57.00 54.87 1n7g n GLN 270 Cb 0.22 -1.58 0.19 0.00 0.11 0.00 0.00 30.24 29.18 1n7g n GLN 270 CO 0.00 0.00 0.00 -0.65 -1.44 0.00 0.00 177.06 174.97 1n7g s GLN 271 N -3.20 0.29 0.16 -1.09 -1.52 -1.15 -4.95 119.66 108.21 1n7g s GLN 271 Ca 0.03 1.03 -0.10 0.00 -1.95 0.00 0.00 55.36 54.37 1n7g s GLN 271 Cb 0.14 -1.68 0.02 0.00 -0.22 0.00 0.00 33.01 31.27 1n7g s GLN 271 CO 0.81 -2.96 1.56 1.05 -0.25 0.00 0.00 175.29 175.49 1n7g h GLU 272 N -2.08 0.99 -5.58 2.91 4.11 -1.92 -3.45 114.58 109.56 1n7g h GLU 272 Ca -0.53 -0.42 -0.47 0.00 0.07 0.00 0.00 59.36 58.01 1n7g h GLU 272 Cb 1.30 -0.03 -0.23 0.00 0.50 0.00 0.00 28.75 30.28 1n7g h GLU 272 CO 0.49 1.10 -0.80 0.15 0.07 0.00 0.00 179.01 180.02 1n7g s LYS 273 N -4.68 1.00 0.66 1.06 1.02 -1.26 -5.14 119.74 112.40 1n7g s LYS 273 Ca -0.11 -0.91 -0.16 0.00 0.02 0.00 0.00 55.97 54.81 1n7g s LYS 273 Cb 0.12 -1.06 0.00 0.00 -0.52 0.00 0.00 37.83 36.37 1n7g s LYS 273 CO 0.87 0.25 1.15 -1.25 -0.92 0.00 0.00 175.35 175.45 1n7g s PRO 274 N -1.45 2.68 0.09 -1.68 0.04 -1.26 -5.04 135.00 128.38 1n7g s PRO 274 Ca 0.02 1.55 -0.26 0.00 0.04 0.00 0.00 61.00 62.36 1n7g s PRO 274 Cb -0.09 -1.92 0.09 0.00 0.04 0.00 0.00 34.50 32.62 1n7g s PRO 274 CO 0.02 -1.37 1.14 0.34 0.04 0.00 0.00 177.00 177.17 1n7g s ASP 275 N -2.26 -0.04 -0.08 6.66 3.68 -1.26 -5.01 116.67 118.37 1n7g s ASP 275 Ca 0.70 -0.40 0.01 0.00 2.13 0.00 0.00 52.55 55.00 1n7g s ASP 275 Cb -0.24 0.34 -0.03 0.00 -1.45 0.00 0.00 42.92 41.54 1n7g s ASP 275 CO 0.40 -0.65 -0.09 -1.81 0.13 0.00 0.00 175.17 173.14 1n7g s ASP 276 N -3.34 4.42 0.01 -0.34 1.01 -1.26 -3.12 116.67 114.03 1n7g s ASP 276 Ca 0.21 -0.12 0.01 0.00 0.71 0.00 0.00 52.55 53.36 1n7g s ASP 276 Cb -0.00 -1.19 -0.01 0.00 1.01 0.00 0.00 42.92 42.73 1n7g s ASP 276 CO 0.01 0.32 -0.05 -0.31 0.21 0.00 0.00 175.17 175.35 1n7g s TYR 277 N -0.54 0.42 -0.04 4.23 1.51 -0.80 -4.97 117.35 117.16 1n7g s TYR 277 Ca 0.08 -0.16 -0.19 0.00 -1.01 0.00 0.00 57.07 55.78 1n7g s TYR 277 Cb -0.12 -0.27 -0.05 0.00 -0.11 0.00 0.00 41.96 41.42 1n7g s TYR 277 CO 0.02 -0.03 0.55 0.08 -1.11 0.00 0.00 175.55 175.06 1n7g s VAL 278 N -0.37 5.01 -0.21 0.71 1.01 -1.26 -0.16 120.40 125.13 1n7g s VAL 278 Ca -0.01 1.14 0.01 0.00 0.00 0.00 0.00 61.98 63.12 1n7g s VAL 278 Cb -0.03 -3.88 0.04 0.00 0.00 0.00 0.00 36.38 32.50 1n7g s VAL 278 CO -0.00 0.40 -0.13 -0.69 0.00 0.00 0.00 175.10 174.67 1n7g s VAL 279 N 0.02 1.88 0.36 2.92 1.01 -0.82 -4.45 120.40 121.31 1n7g s VAL 279 Ca 0.29 -1.13 -0.15 0.00 0.00 0.00 0.00 61.98 60.99 1n7g s VAL 279 Cb -0.17 -1.88 0.04 0.00 0.00 0.00 0.00 36.38 34.36 1n7g s VAL 279 CO 0.15 0.23 0.73 0.00 0.00 0.00 0.00 175.10 176.20 1n7g s ALA 280 N 1.30 -0.62 -0.71 5.51 0.00 -1.26 -1.91 121.76 124.07 1n7g s ALA 280 Ca -0.01 -0.77 0.22 0.00 0.00 0.00 0.00 51.96 51.39 1n7g s ALA 280 Cb -0.16 0.78 -0.16 0.00 0.00 0.00 0.00 23.12 23.58 1n7g s ALA 280 CO -0.09 -0.97 0.86 0.25 0.00 0.00 0.00 175.76 175.81 1n7g n THR 281 N -0.52 0.03 -1.08 0.00 -2.24 -1.26 -4.74 114.28 104.47 1n7g n THR 281 Ca -0.06 -0.16 -0.03 0.00 -2.27 0.00 0.00 64.05 61.53 1n7g n THR 281 Cb 0.60 0.58 -0.01 0.00 -2.10 0.00 0.00 70.33 69.40 1n7g n THR 281 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1n7g n GLU 282 N -1.76 -1.16 -4.94 -0.78 1.02 -1.25 -4.97 120.64 106.80 1n7g n GLU 282 Ca 0.02 0.44 -0.33 0.00 -0.02 0.00 0.00 57.16 57.27 1n7g n GLU 282 Cb 0.40 -4.39 -0.15 0.00 -0.02 0.00 0.00 31.44 27.28 1n7g n GLU 282 CO 0.00 0.00 0.00 -2.00 1.18 0.00 0.00 177.13 176.31 1n7g s GLU 283 N -1.61 3.26 0.08 3.49 2.12 -1.26 -4.86 118.70 119.92 1n7g s GLU 283 Ca 0.00 -0.76 0.07 0.00 0.36 0.00 0.00 54.97 54.64 1n7g s GLU 283 Cb 0.00 -2.51 -0.04 0.00 0.26 0.00 0.00 34.13 31.84 1n7g s GLU 283 CO 0.00 0.20 -0.12 0.20 -0.54 0.00 0.00 175.26 174.99 1n7g s GLY 284 N 0.36 1.73 -0.01 -1.50 0.00 -1.26 -4.07 107.32 102.58 1n7g s GLY 284 Ca -0.14 -1.23 -0.12 0.00 0.00 0.00 0.00 44.72 43.23 1n7g s GLY 284 CO 0.07 -1.17 0.25 0.30 0.00 0.00 0.00 173.10 172.54 1n7g s HIS 285 N -1.12 -0.10 0.66 1.90 3.76 -0.09 -4.92 115.29 115.37 1n7g s HIS 285 Ca 0.19 0.11 -0.07 0.00 -0.15 0.00 0.00 55.06 55.15 1n7g s HIS 285 Cb -0.11 0.05 0.04 0.00 1.11 0.00 0.00 32.58 33.66 1n7g s HIS 285 CO 0.11 -0.36 0.97 0.95 -0.85 0.00 0.00 174.74 175.56 1n7g s THR 286 N -1.41 2.89 0.31 1.30 -4.23 -1.26 0.16 115.64 113.39 1n7g s THR 286 Ca -0.14 -0.12 0.05 0.00 -1.18 0.00 0.00 61.69 60.30 1n7g s THR 286 Cb -0.06 -3.20 0.08 0.00 1.34 0.00 0.00 72.50 70.65 1n7g s THR 286 CO 0.03 -0.22 1.76 0.58 -0.54 0.00 0.00 174.62 176.23 1n7g h VAL 287 N -0.43 1.26 -0.81 2.29 2.07 -0.98 -2.72 116.25 116.94 1n7g h VAL 287 Ca -0.45 -1.25 -0.03 0.00 0.82 0.00 0.00 66.70 65.79 1n7g h VAL 287 Cb 1.29 1.43 -0.04 0.00 -1.52 0.00 0.00 31.29 32.46 1n7g h VAL 287 CO 0.61 0.39 0.39 -0.08 0.02 0.00 0.00 177.57 178.89 1n7g h GLU 288 N 0.31 1.16 -0.01 1.57 4.81 -1.63 -1.45 114.58 119.33 1n7g h GLU 288 Ca 0.04 -0.17 -0.07 0.00 -0.13 0.00 0.00 59.36 59.03 1n7g h GLU 288 Cb 0.66 -0.21 -0.01 0.00 0.63 0.00 0.00 28.75 29.82 1n7g h GLU 288 CO 0.05 0.90 -0.35 0.93 -0.73 0.00 0.00 179.01 179.81 1n7g h GLU 289 N 1.14 0.01 -0.63 1.92 5.08 -1.79 -0.20 114.58 120.11 1n7g h GLU 289 Ca 0.28 -0.00 -0.09 0.00 -1.00 0.00 0.00 59.36 58.54 1n7g h GLU 289 Cb 0.12 -0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.34 1n7g h GLU 289 CO -0.03 0.36 0.03 0.35 -1.00 0.00 0.00 179.01 178.71 1n7g h PHE 290 N 0.01 1.18 -0.26 4.33 3.57 -1.02 -1.25 116.94 123.50 1n7g h PHE 290 Ca -0.00 -0.19 -0.04 0.00 3.53 0.00 0.00 57.97 61.27 1n7g h PHE 290 Cb 0.62 -0.31 -0.01 0.00 2.79 0.00 0.00 35.95 39.04 1n7g h PHE 290 CO 0.00 1.02 0.03 -0.07 -2.23 0.00 0.00 178.31 177.06 1n7g h LEU 291 N 1.00 0.43 0.16 0.59 3.38 -0.45 -0.75 115.31 119.67 1n7g h LEU 291 Ca 0.18 -0.28 0.01 0.00 0.09 0.00 0.00 57.88 57.88 1n7g h LEU 291 Cb 0.53 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.15 1n7g h LEU 291 CO 0.03 0.60 -0.20 0.44 0.09 0.00 0.00 178.44 179.40 1n7g h ASP 292 N 0.24 -0.54 0.32 -0.43 3.32 -0.82 -1.33 116.42 117.19 1n7g h ASP 292 Ca 0.08 0.06 -0.02 0.00 0.02 0.00 0.00 57.03 57.17 1n7g h ASP 292 Cb 0.37 0.19 0.00 0.00 0.22 0.00 0.00 39.33 40.12 1n7g h ASP 292 CO 0.01 -0.29 -0.16 0.58 -1.72 0.00 0.00 179.24 177.66 1n7g h VAL 293 N -0.41 0.69 0.63 -1.35 2.07 -1.22 0.56 116.25 117.23 1n7g h VAL 293 Ca 0.01 -0.09 -0.03 0.00 0.82 0.00 0.00 66.70 67.42 1n7g h VAL 293 Cb 0.40 0.74 0.00 0.00 -1.52 0.00 0.00 31.29 30.91 1n7g h VAL 293 CO -0.07 0.02 -0.35 0.77 0.02 0.00 0.00 177.57 177.96 1n7g h SER 294 N -0.48 -0.85 -0.38 0.57 4.64 -1.09 -0.61 113.55 115.36 1n7g h SER 294 Ca -0.04 0.04 0.01 0.00 -0.47 0.00 0.00 61.79 61.33 1n7g h SER 294 Cb 0.36 0.23 -0.02 0.00 -0.31 0.00 0.00 62.40 62.66 1n7g h SER 294 CO 0.07 -0.56 0.22 -0.26 -0.87 0.00 0.00 176.83 175.44 1n7g h PHE 295 N -0.90 0.42 -0.63 4.77 -1.00 -1.34 -2.19 116.94 116.06 1n7g h PHE 295 Ca -0.09 0.01 0.10 0.00 2.81 0.00 0.00 57.97 60.81 1n7g h PHE 295 Cb 0.71 -0.14 -0.04 0.00 3.61 0.00 0.00 35.95 40.09 1n7g h PHE 295 CO 0.01 0.25 0.42 0.78 -1.61 0.00 0.00 178.31 178.16 1n7g h GLY 296 N 0.46 0.64 2.00 -1.45 0.00 -0.88 0.28 103.07 104.11 1n7g h GLY 296 Ca 0.15 -0.18 -0.00 0.00 0.00 0.00 0.00 47.33 47.29 1n7g h GLY 296 CO -0.06 0.11 -0.02 -1.82 0.00 0.00 0.00 176.54 174.74 1n7g h TYR 297 N 0.45 0.00 -0.42 5.60 3.20 -0.43 -1.33 116.97 124.03 1n7g h TYR 297 Ca 0.29 0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.16 1n7g h TYR 297 Cb 0.55 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.82 1n7g h TYR 297 CO -0.00 0.02 0.00 1.28 -1.64 0.00 0.00 178.16 177.82 1n7g n LEU 298 N -3.71 3.20 -1.69 2.82 4.77 0.03 -4.99 117.00 117.44 1n7g n LEU 298 Ca -0.03 -2.05 -0.10 0.00 -0.03 0.00 0.00 56.01 53.81 1n7g n LEU 298 Cb 0.11 -0.30 0.03 0.00 -2.33 0.00 0.00 43.42 40.93 1n7g n LEU 298 CO 0.27 0.78 0.09 0.61 -1.33 0.00 0.00 177.39 177.80 1n7g n GLY 299 N 0.70 0.33 3.25 -0.72 0.00 -0.50 -5.06 105.19 103.19 1n7g n GLY 299 Ca 0.15 -0.32 -0.15 0.00 0.00 0.00 0.00 46.02 45.69 1n7g n GLY 299 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1n7g s LEU 300 N -3.45 2.49 -0.42 0.99 1.43 -0.88 -5.00 118.68 113.83 1n7g s LEU 300 Ca 0.22 -0.94 -0.11 0.00 -1.03 0.00 0.00 54.13 52.26 1n7g s LEU 300 Cb -0.10 -0.42 0.06 0.00 0.03 0.00 0.00 46.19 45.77 1n7g s LEU 300 CO 0.27 -0.26 0.28 0.21 0.23 0.00 0.00 176.35 177.08 1n7g s ASN 301 N -2.93 5.81 0.57 2.29 3.84 -1.26 -3.46 114.94 119.79 1n7g s ASN 301 Ca 0.14 -1.31 0.28 0.00 0.21 0.00 0.00 52.86 52.18 1n7g s ASN 301 Cb -0.00 -2.05 1.50 0.00 -0.55 0.00 0.00 41.25 40.15 1n7g s ASN 301 CO 0.02 -0.52 1.98 4.11 -2.79 0.00 0.00 177.10 179.89 1n7g h TRP 302 N 8.51 0.00 0.00 0.43 5.08 -1.92 0.17 115.95 128.21 1n7g h TRP 302 Ca -0.25 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.72 1n7g h TRP 302 Cb 1.10 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.26 1n7g h TRP 302 CO 0.61 0.00 0.00 0.87 -1.28 0.00 0.00 178.44 178.64 1n7g h LYS 303 N 0.00 0.00 0.00 0.12 1.57 -1.92 0.50 116.57 116.84 1n7g h LYS 303 Ca 0.20 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.98 1n7g h LYS 303 Cb 0.98 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.29 1n7g h LYS 303 CO -0.00 0.00 -0.35 -0.44 -0.57 0.00 0.00 179.45 178.09 1n7g h ASP 304 N 0.00 0.00 0.00 0.86 3.32 -1.08 -3.39 116.42 116.13 1n7g h ASP 304 Ca 0.00 -0.06 0.00 0.00 0.02 0.00 0.00 57.03 56.99 1n7g h ASP 304 Cb 0.03 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.58 1n7g h ASP 304 CO 0.00 0.03 -0.98 -1.22 -1.72 0.00 0.00 179.24 175.34 1n7g n TYR 305 N -2.53 0.00 -2.30 4.55 4.02 -0.16 -5.00 117.16 115.74 1n7g n TYR 305 Ca 0.03 0.00 -0.40 0.00 -0.01 0.00 0.00 57.90 57.53 1n7g n TYR 305 Cb 0.48 0.00 -0.03 0.00 -0.02 0.00 0.00 39.34 39.77 1n7g n TYR 305 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 176.86 175.93 1n7g s VAL 306 N -1.98 3.13 0.02 -0.72 1.01 -0.01 -1.39 120.40 120.45 1n7g s VAL 306 Ca 0.00 1.09 -0.01 0.00 0.00 0.00 0.00 61.98 63.06 1n7g s VAL 306 Cb 0.00 -3.67 -0.02 0.00 0.00 0.00 0.00 36.38 32.70 1n7g s VAL 306 CO 0.00 0.22 -0.01 -1.61 0.00 0.00 0.00 175.10 173.69 1n7g s GLU 307 N -1.82 0.30 -0.16 2.72 2.02 0.59 -4.90 118.70 117.46 1n7g s GLU 307 Ca 0.50 -0.54 -0.07 0.00 0.02 0.00 0.00 54.97 54.88 1n7g s GLU 307 Cb -0.34 0.11 -0.04 0.00 0.10 0.00 0.00 34.13 33.96 1n7g s GLU 307 CO 0.44 -0.05 0.09 0.42 0.02 0.00 0.00 175.26 176.18 1n7g s ILE 308 N -1.33 5.04 -0.10 -1.63 -1.09 -1.26 -1.13 121.20 119.69 1n7g s ILE 308 Ca -0.15 0.05 0.00 0.00 -2.23 0.00 0.00 60.65 58.32 1n7g s ILE 308 Cb -0.09 -3.24 0.02 0.00 -1.58 0.00 0.00 42.46 37.58 1n7g s ILE 308 CO -0.01 0.52 -0.09 -0.62 -1.23 0.00 0.00 174.94 173.51 1n7g s ASP 309 N -0.18 2.10 0.62 3.58 3.68 -0.56 -4.94 116.67 120.98 1n7g s ASP 309 Ca 0.09 -0.31 0.30 0.00 2.13 0.00 0.00 52.55 54.75 1n7g s ASP 309 Cb -0.12 -0.86 1.64 0.00 -1.45 0.00 0.00 42.92 42.13 1n7g s ASP 309 CO 0.01 -0.08 1.98 0.06 0.13 0.00 0.00 175.17 177.28 1n7g h GLN 310 N 7.86 0.00 0.00 4.34 3.07 -1.97 -1.44 115.11 126.97 1n7g h GLN 310 Ca -0.31 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.43 1n7g h GLN 310 Cb 1.14 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.70 1n7g h GLN 310 CO 0.43 0.00 0.00 0.07 0.09 0.00 0.00 178.83 179.42 1n7g h ARG 311 N 0.00 0.00 -0.02 0.06 0.11 -1.95 -0.97 114.38 111.61 1n7g h ARG 311 Ca 0.09 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.17 1n7g h ARG 311 Cb 0.74 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.82 1n7g h ARG 311 CO -0.00 0.00 -0.15 0.66 0.10 0.00 0.00 179.97 180.57 1n7g n TYR 312 N -2.69 0.00 -3.01 4.08 0.53 -0.54 -4.89 117.16 110.64 1n7g n TYR 312 Ca -0.02 0.00 -0.36 0.00 -1.02 0.00 0.00 57.90 56.50 1n7g n TYR 312 Cb 0.09 -0.01 -0.06 0.00 -1.03 0.00 0.00 39.34 38.33 1n7g n TYR 312 CO 0.00 0.00 0.00 -0.06 -1.02 0.00 0.00 176.86 175.78 1n7g s PHE 313 N -2.18 3.67 0.10 -0.72 0.08 -0.37 -4.63 117.98 113.93 1n7g s PHE 313 Ca 0.27 1.51 0.01 0.00 0.12 0.00 0.00 56.93 58.84 1n7g s PHE 313 Cb 0.20 -2.71 -0.04 0.00 -0.57 0.00 0.00 43.02 39.90 1n7g s PHE 313 CO 0.40 0.31 0.23 1.03 -0.10 0.00 0.00 175.22 177.09 1n7g s ARG 314 N -1.96 3.39 0.27 0.44 0.52 -1.26 -5.01 118.95 115.34 1n7g s ARG 314 Ca 0.45 -0.52 -0.00 0.00 -0.52 0.00 0.00 55.73 55.13 1n7g s ARG 314 Cb -0.17 -2.98 0.59 0.00 0.52 0.00 0.00 34.95 32.90 1n7g s ARG 314 CO 0.22 0.57 1.72 -1.35 0.02 0.00 0.00 175.30 176.49 1n7g h PRO 315 N 2.73 0.46 -3.80 3.54 0.11 -1.97 -3.37 132.00 129.70 1n7g h PRO 315 Ca -0.46 -0.03 -0.44 0.00 0.11 0.00 0.00 66.00 65.18 1n7g h PRO 315 Cb 1.17 -0.10 -0.37 0.00 0.11 0.00 0.00 31.00 31.81 1n7g h PRO 315 CO 0.72 0.31 -0.77 0.00 -0.21 0.00 0.00 178.00 178.05 1n7g s ALA 316 N -5.95 0.73 0.23 -0.75 0.00 -1.26 -5.15 121.76 109.60 1n7g s ALA 316 Ca -0.12 -0.13 0.05 0.00 0.00 0.00 0.00 51.96 51.76 1n7g s ALA 316 Cb 0.23 -0.68 -0.03 0.00 0.00 0.00 0.00 23.12 22.63 1n7g s ALA 316 CO 0.77 -0.36 0.35 -2.00 0.00 0.00 0.00 175.76 174.52 1n7g s GLU 317 N 1.73 3.43 -0.39 0.00 2.56 -1.26 -4.76 118.70 120.01 1n7g s GLU 317 Ca 0.02 -0.76 -0.04 0.00 0.00 0.00 0.00 54.97 54.19 1n7g s GLU 317 Cb -0.13 -2.89 0.09 0.00 2.00 0.00 0.00 34.13 33.21 1n7g s GLU 317 CO -0.04 0.44 0.17 0.08 -0.56 0.00 0.00 175.26 175.34 1n7g s VAL 318 N -1.96 3.44 -0.01 3.70 1.01 -1.26 -4.82 120.40 120.50 1n7g s VAL 318 Ca 0.34 -1.75 -0.24 0.00 0.00 0.00 0.00 61.98 60.33 1n7g s VAL 318 Cb -0.09 -3.21 -0.15 0.00 0.00 0.00 0.00 36.38 32.92 1n7g s VAL 318 CO 0.29 -0.52 1.09 0.44 0.00 0.00 0.00 175.10 176.40 1n7g h ASP 319 N 8.12 -0.39 -3.19 3.32 3.45 -1.91 -3.44 116.42 122.38 1n7g h ASP 319 Ca -0.17 -0.17 -0.48 0.00 0.43 0.00 0.00 57.03 56.64 1n7g h ASP 319 Cb 1.06 0.10 -0.40 0.00 -0.56 0.00 0.00 39.33 39.53 1n7g h ASP 319 CO 0.67 0.02 -0.76 0.21 -1.57 0.00 0.00 179.24 177.82 1n7g s ASN 320 N -5.06 2.46 -0.19 6.45 3.84 -1.26 -1.10 114.94 120.09 1n7g s ASN 320 Ca -0.13 -0.61 -0.01 0.00 0.21 0.00 0.00 52.86 52.31 1n7g s ASN 320 Cb 0.02 -0.43 0.00 0.00 -0.55 0.00 0.00 41.25 40.29 1n7g s ASN 320 CO 0.49 -0.31 -0.12 -0.76 -2.79 0.00 0.00 177.10 173.61 1n7g s LEU 321 N 1.99 2.55 -0.19 3.21 1.43 -0.90 -4.32 118.68 122.45 1n7g s LEU 321 Ca 0.01 -0.48 -0.05 0.00 -1.03 0.00 0.00 54.13 52.58 1n7g s LEU 321 Cb -0.16 -1.61 0.10 0.00 0.03 0.00 0.00 46.19 44.55 1n7g s LEU 321 CO -0.08 0.03 0.33 -1.58 0.23 0.00 0.00 176.35 175.28 1n7g s GLN 322 N 1.18 0.26 0.50 1.70 0.74 -1.26 -2.05 119.66 120.72 1n7g s GLN 322 Ca 0.02 0.68 -0.03 0.00 0.05 0.00 0.00 55.36 56.08 1n7g s GLN 322 Cb -0.14 -0.23 -0.01 0.00 1.10 0.00 0.00 33.01 33.72 1n7g s GLN 322 CO -0.05 -0.43 0.77 0.20 -0.55 0.00 0.00 175.29 175.23 1n7g s GLY 323 N 2.49 1.54 -0.33 2.59 0.00 -1.26 -0.75 107.32 111.60 1n7g s GLY 323 Ca 0.05 -0.78 0.01 0.00 0.00 0.00 0.00 44.72 44.00 1n7g s GLY 323 CO -0.12 -0.58 0.04 -0.35 0.00 0.00 0.00 173.10 172.09 1n7g s ASP 324 N -4.21 4.84 -0.34 1.64 3.68 -0.55 -3.92 116.67 117.82 1n7g s ASP 324 Ca 0.49 -1.76 0.07 0.00 2.13 0.00 0.00 52.55 53.49 1n7g s ASP 324 Cb -0.10 -1.68 0.67 0.00 -1.45 0.00 0.00 42.92 40.36 1n7g s ASP 324 CO 0.42 -0.35 1.77 0.00 0.13 0.00 0.00 175.17 177.14 1n7g n ALA 325 N 4.46 4.75 -0.21 3.66 0.00 -1.26 -4.62 120.51 127.29 1n7g n ALA 325 Ca -0.05 -2.31 0.01 0.00 0.00 0.00 0.00 53.44 51.09 1n7g n ALA 325 Cb 0.42 -1.30 0.12 0.00 0.00 0.00 0.00 19.45 18.70 1n7g n ALA 325 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 1n7g h SER 326 N 1.95 0.11 -0.54 0.00 0.02 -1.94 -1.38 113.55 111.78 1n7g h SER 326 Ca 0.36 0.10 -0.04 0.00 -0.84 0.00 0.00 61.79 61.37 1n7g h SER 326 Cb 2.40 0.12 -0.03 0.00 0.14 0.00 0.00 62.40 65.02 1n7g h SER 326 CO 0.80 0.06 0.18 0.50 -1.14 0.00 0.00 176.83 177.24 1n7g h LYS 327 N 0.33 0.88 -0.21 3.45 3.64 -1.90 0.05 116.57 122.81 1n7g h LYS 327 Ca 0.33 -0.16 -0.08 0.00 -1.27 0.00 0.00 60.65 59.47 1n7g h LYS 327 Cb 0.48 -0.14 -0.00 0.00 -0.41 0.00 0.00 32.23 32.15 1n7g h LYS 327 CO -0.38 0.76 -0.17 0.00 -2.27 0.00 0.00 179.45 177.39 1n7g h ALA 328 N 1.35 0.30 0.15 5.00 0.00 -1.59 0.11 119.26 124.58 1n7g h ALA 328 Ca 0.19 -0.34 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 1n7g h ALA 328 Cb 0.25 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.97 1n7g h ALA 328 CO -0.01 0.21 -0.07 1.57 0.00 0.00 0.00 179.25 180.95 1n7g h LYS 329 N 0.17 -0.19 -0.41 0.00 -0.00 -1.06 0.39 116.57 115.47 1n7g h LYS 329 Ca 0.04 0.01 -0.16 0.00 -0.00 0.00 0.00 60.65 60.55 1n7g h LYS 329 Cb 0.70 0.04 -0.01 0.00 -0.00 0.00 0.00 32.23 32.96 1n7g h LYS 329 CO 0.04 -0.13 -0.35 1.05 -0.00 0.00 0.00 179.45 180.06 1n7g h GLU 330 N -0.20 0.96 0.08 0.07 4.11 -0.99 -0.14 114.58 118.46 1n7g h GLU 330 Ca -0.02 -0.49 -0.32 0.00 0.07 0.00 0.00 59.36 58.61 1n7g h GLU 330 Cb 0.16 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.39 1n7g h GLU 330 CO 0.03 1.15 -1.73 0.28 0.07 0.00 0.00 179.01 178.81 1n7g n VAL 331 N -4.07 1.69 0.66 -1.06 0.31 0.37 -4.38 118.33 111.85 1n7g n VAL 331 Ca -0.02 -0.42 0.11 0.00 -0.01 0.00 0.00 64.34 64.01 1n7g n VAL 331 Cb 0.53 -1.85 0.02 0.00 -0.91 0.00 0.00 33.84 31.62 1n7g n VAL 331 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 1n7g n LEU 332 N -3.85 0.63 0.00 7.52 4.77 0.12 -4.92 117.00 121.27 1n7g n LEU 332 Ca -0.32 -0.09 0.00 0.00 -0.03 0.00 0.00 56.01 55.56 1n7g n LEU 332 Cb 0.91 -0.09 0.00 0.00 -2.33 0.00 0.00 43.42 41.90 1n7g n LEU 332 CO 0.33 0.08 0.00 0.61 -1.33 0.00 0.00 177.39 177.09 1n7g n GLY 333 N 1.40 0.37 3.76 -0.72 0.00 -0.06 -4.96 105.19 104.98 1n7g n GLY 333 Ca 0.02 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.64 1n7g n GLY 333 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1n7g s TRP 334 N -1.88 3.38 -0.16 1.61 -0.00 -1.06 -4.87 118.94 115.95 1n7g s TRP 334 Ca 0.00 1.61 -0.13 0.00 -0.00 0.00 0.00 56.10 57.58 1n7g s TRP 334 Cb 0.00 -3.40 0.05 0.00 -0.00 0.00 0.00 33.47 30.11 1n7g s TRP 334 CO 0.00 -0.98 0.42 0.15 -0.00 0.00 0.00 176.95 176.53 1n7g s LYS 335 N -1.63 0.46 0.26 5.86 3.01 -1.26 -3.47 119.74 122.96 1n7g s LYS 335 Ca 0.47 0.64 -0.30 0.00 -1.01 0.00 0.00 55.97 55.77 1n7g s LYS 335 Cb -0.34 0.16 -0.09 0.00 -1.01 0.00 0.00 37.83 36.55 1n7g s LYS 335 CO 0.44 -0.09 1.28 -1.25 0.51 0.00 0.00 175.35 176.25 1n7g s PRO 336 N 0.55 4.41 -0.13 -1.68 0.04 -1.26 -4.93 135.00 132.00 1n7g s PRO 336 Ca -0.03 2.08 0.12 0.00 0.04 0.00 0.00 61.00 63.22 1n7g s PRO 336 Cb -0.04 -3.15 -0.24 0.00 0.04 0.00 0.00 34.50 31.11 1n7g s PRO 336 CO -0.03 -0.17 0.33 1.04 0.04 0.00 0.00 177.00 178.21 1n7g n GLN 337 N 1.76 0.67 -3.47 4.56 6.02 -1.26 -4.87 117.38 120.79 1n7g n GLN 337 Ca 0.03 0.16 -0.38 0.00 -0.01 0.00 0.00 57.00 56.81 1n7g n GLN 337 Cb 0.43 -1.66 -0.08 0.00 1.02 0.00 0.00 30.24 29.95 1n7g n GLN 337 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 1n7g s VAL 338 N -2.55 5.24 0.68 5.09 1.01 -1.26 -5.08 120.40 123.54 1n7g s VAL 338 Ca -0.11 0.55 -0.02 0.00 0.00 0.00 0.00 61.98 62.40 1n7g s VAL 338 Cb 0.07 -3.66 0.09 0.00 0.00 0.00 0.00 36.38 32.88 1n7g s VAL 338 CO 0.80 0.27 0.95 -0.83 0.00 0.00 0.00 175.10 176.30 1n7g s GLY 339 N 1.07 1.77 0.12 4.51 0.00 -1.26 -4.57 107.32 108.96 1n7g s GLY 339 Ca 0.16 -1.39 -0.30 0.00 0.00 0.00 0.00 44.72 43.18 1n7g s GLY 339 CO 0.07 -0.94 1.59 -2.75 0.00 0.00 0.00 173.10 171.07 1n7g h PHE 340 N -0.42 -1.16 -0.48 1.90 3.04 -1.98 -0.35 116.94 117.48 1n7g h PHE 340 Ca -0.40 0.03 0.05 0.00 3.98 0.00 0.00 57.97 61.63 1n7g h PHE 340 Cb 1.29 0.51 -0.05 0.00 2.56 0.00 0.00 35.95 40.25 1n7g h PHE 340 CO 0.04 -0.50 0.21 0.93 -2.02 0.00 0.00 178.31 176.97 1n7g h GLU 341 N -0.60 0.40 -0.43 1.11 5.08 -1.97 -0.13 114.58 118.04 1n7g h GLU 341 Ca 0.04 -0.02 -0.05 0.00 -1.00 0.00 0.00 59.36 58.32 1n7g h GLU 341 Cb 0.66 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.79 1n7g h GLU 341 CO -0.29 0.27 0.04 -0.22 -1.00 0.00 0.00 179.01 177.82 1n7g h LYS 342 N 0.42 0.68 -0.08 2.33 3.64 -1.91 -0.92 116.57 120.72 1n7g h LYS 342 Ca 0.22 -0.15 -0.02 0.00 -1.27 0.00 0.00 60.65 59.43 1n7g h LYS 342 Cb 0.17 -0.10 -0.00 0.00 -0.41 0.00 0.00 32.23 31.89 1n7g h LYS 342 CO -0.19 0.67 -0.01 1.25 -2.27 0.00 0.00 179.45 178.90 1n7g h LEU 343 N 0.65 0.15 -0.39 5.20 5.85 -0.33 -0.02 115.31 126.43 1n7g h LEU 343 Ca 0.14 -0.34 0.02 0.00 0.84 0.00 0.00 57.88 58.54 1n7g h LEU 343 Cb 0.34 -0.04 -0.03 0.00 0.37 0.00 0.00 40.66 41.30 1n7g h LEU 343 CO 0.01 0.45 0.23 0.58 -0.34 0.00 0.00 178.44 179.37 1n7g h VAL 344 N -0.15 1.04 -0.14 1.05 2.07 -0.85 -1.17 116.25 118.10 1n7g h VAL 344 Ca 0.02 -0.16 -0.07 0.00 0.82 0.00 0.00 66.70 67.31 1n7g h VAL 344 Cb 0.38 0.54 -0.01 0.00 -1.52 0.00 0.00 31.29 30.68 1n7g h VAL 344 CO 0.01 0.08 -0.25 0.11 0.02 0.00 0.00 177.57 177.54 1n7g h LYS 345 N 0.46 0.24 -0.43 1.57 1.57 -1.14 -1.14 116.57 117.71 1n7g h LYS 345 Ca 0.15 -0.08 -0.06 0.00 -1.87 0.00 0.00 60.65 58.79 1n7g h LYS 345 Cb 0.01 -0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.28 1n7g h LYS 345 CO -0.07 0.49 0.03 1.98 -0.57 0.00 0.00 179.45 181.30 1n7g h MET 346 N 0.22 0.74 -0.30 3.15 4.05 -0.34 -0.90 114.93 121.56 1n7g h MET 346 Ca 0.04 -0.22 -0.15 0.00 -0.28 0.00 0.00 59.70 59.08 1n7g h MET 346 Cb 0.57 -0.07 -0.01 0.00 -0.80 0.00 0.00 31.60 31.29 1n7g h MET 346 CO 0.04 0.80 -0.43 0.52 0.23 0.00 0.00 176.91 178.08 1n7g h MET 347 N 0.59 0.74 -0.38 0.39 2.86 -0.95 -2.50 114.93 115.68 1n7g h MET 347 Ca 0.13 -0.40 -0.06 0.00 -2.06 0.00 0.00 59.70 57.31 1n7g h MET 347 Cb 0.45 0.02 -0.01 0.00 0.06 0.00 0.00 31.60 32.11 1n7g h MET 347 CO 0.02 1.02 0.01 0.28 1.06 0.00 0.00 176.91 179.30 1n7g h VAL 348 N 0.60 1.26 -0.36 -2.22 2.07 -1.08 -1.22 116.25 115.30 1n7g h VAL 348 Ca 0.04 -0.97 0.01 0.00 0.82 0.00 0.00 66.70 66.60 1n7g h VAL 348 Cb 0.98 1.14 -0.02 0.00 -1.52 0.00 0.00 31.29 31.86 1n7g h VAL 348 CO 0.09 0.33 0.23 0.44 0.02 0.00 0.00 177.57 178.68 1n7g h ASP 349 N 0.49 0.38 -0.21 0.57 3.32 -1.13 0.61 116.42 120.45 1n7g h ASP 349 Ca 0.11 -0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.13 1n7g h ASP 349 Cb 0.45 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 39.90 1n7g h ASP 349 CO 0.02 0.28 0.04 -0.33 -1.72 0.00 0.00 179.24 177.53 1n7g h GLU 350 N 0.46 0.34 0.00 3.56 4.39 -1.37 -1.94 114.58 120.02 1n7g h GLU 350 Ca 0.14 -0.09 -0.00 0.00 0.34 0.00 0.00 59.36 59.75 1n7g h GLU 350 Cb -0.03 -0.04 -0.00 0.00 -0.10 0.00 0.00 28.75 28.58 1n7g h GLU 350 CO -0.05 0.47 -0.02 -0.44 -1.16 0.00 0.00 179.01 177.82 1n7g h ASP 351 N 0.15 0.00 -0.07 1.42 3.45 -1.12 -1.48 116.42 118.77 1n7g h ASP 351 Ca 0.07 0.00 -0.14 0.00 0.43 0.00 0.00 57.03 57.38 1n7g h ASP 351 Cb 0.29 0.00 0.01 0.00 -0.56 0.00 0.00 39.33 39.07 1n7g h ASP 351 CO 0.00 0.02 -0.52 0.25 -1.57 0.00 0.00 179.24 177.42 1n7g h LEU 352 N 0.00 0.57 -1.10 1.55 5.85 -0.66 -0.82 115.31 120.71 1n7g h LEU 352 Ca -0.00 -0.68 0.01 0.00 0.84 0.00 0.00 57.88 58.05 1n7g h LEU 352 Cb 0.60 -0.17 -0.05 0.00 0.37 0.00 0.00 40.66 41.42 1n7g h LEU 352 CO 0.00 1.17 0.60 -0.08 -0.34 0.00 0.00 178.44 179.79 1n7g h GLU 353 N 0.03 1.21 -0.13 1.25 4.57 -1.06 0.55 114.58 120.98 1n7g h GLU 353 Ca -0.05 -0.08 -0.01 0.00 -1.18 0.00 0.00 59.36 58.05 1n7g h GLU 353 Cb 1.19 -0.27 -0.01 0.00 -0.16 0.00 0.00 28.75 29.50 1n7g h GLU 353 CO 0.11 0.80 0.05 1.25 -1.18 0.00 0.00 179.01 180.04 1n7g h LEU 354 N 1.24 0.19 -0.89 1.64 5.85 -1.16 -0.61 115.31 121.58 1n7g h LEU 354 Ca 0.33 -0.18 0.01 0.00 0.84 0.00 0.00 57.88 58.89 1n7g h LEU 354 Cb -0.14 -0.05 -0.04 0.00 0.37 0.00 0.00 40.66 40.80 1n7g h LEU 354 CO -0.07 0.31 0.59 0.00 -0.34 0.00 0.00 178.44 178.93 1n7g h ALA 355 N 0.88 1.13 -0.51 1.25 0.00 -0.56 -1.37 119.26 120.08 1n7g h ALA 355 Ca 0.04 -0.06 -0.07 0.00 0.00 0.00 0.00 54.91 54.83 1n7g h ALA 355 Cb 0.19 -0.36 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 1n7g h ALA 355 CO -0.00 0.53 0.05 0.87 0.00 0.00 0.00 179.25 180.70 1n7g h LYS 356 N 1.20 0.82 -0.84 0.00 1.57 -0.66 0.13 116.57 118.79 1n7g h LYS 356 Ca 0.32 -0.20 -0.03 0.00 -1.87 0.00 0.00 60.65 58.88 1n7g h LYS 356 Cb -0.14 -0.10 -0.04 0.00 0.08 0.00 0.00 32.23 32.03 1n7g h LYS 356 CO -0.07 0.79 0.41 -0.09 -0.57 0.00 0.00 179.45 179.92 1n7g h ARG 357 N 0.77 1.21 -0.08 3.15 2.43 -0.23 -0.40 114.38 121.23 1n7g h ARG 357 Ca 0.16 -0.17 -0.14 0.00 -0.81 0.00 0.00 59.98 59.01 1n7g h ARG 357 Cb 0.40 -0.22 -0.01 0.00 -0.42 0.00 0.00 29.97 29.71 1n7g h ARG 357 CO 0.01 0.92 -0.58 0.93 -1.51 0.00 0.00 179.97 179.75 1n7g h GLU 358 N 1.20 0.25 -0.66 0.20 5.08 -0.66 -2.80 114.58 117.18 1n7g h GLU 358 Ca 0.29 -0.16 -0.04 0.00 -1.00 0.00 0.00 59.36 58.45 1n7g h GLU 358 Cb 0.11 0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.35 1n7g h GLU 358 CO -0.04 0.76 0.26 -0.22 -1.00 0.00 0.00 179.01 178.77 1n7g h LYS 359 N 0.19 0.99 -0.79 2.33 1.63 0.07 -1.44 116.57 119.54 1n7g h LYS 359 Ca -0.00 -0.18 -0.02 0.00 -0.85 0.00 0.00 60.65 59.60 1n7g h LYS 359 Cb 1.07 -0.16 -0.04 0.00 -0.60 0.00 0.00 32.23 32.50 1n7g h LYS 359 CO 0.09 0.83 0.43 0.28 -3.45 0.00 0.00 179.45 177.63 1n7g h VAL 360 N 0.93 1.24 -0.54 2.00 2.07 -0.91 0.60 116.25 121.65 1n7g h VAL 360 Ca 0.22 -0.61 -0.09 0.00 0.82 0.00 0.00 66.70 67.05 1n7g h VAL 360 Cb 0.21 0.19 -0.02 0.00 -1.52 0.00 0.00 31.29 30.15 1n7g h VAL 360 CO -0.02 0.27 -0.01 -0.07 0.02 0.00 0.00 177.57 177.77 1n7g h LEU 361 N 1.10 0.90 -0.16 2.57 3.38 -1.20 0.29 115.31 122.18 1n7g h LEU 361 Ca 0.28 -0.24 -0.04 0.00 0.09 0.00 0.00 57.88 57.97 1n7g h LEU 361 Cb 0.05 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.55 1n7g h LEU 361 CO -0.04 0.96 -0.04 0.58 0.09 0.00 0.00 178.44 179.99 1n7g h VAL 362 N 0.85 1.29 -0.76 1.22 2.07 -0.84 0.25 116.25 120.33 1n7g h VAL 362 Ca 0.16 -1.01 0.05 0.00 0.82 0.00 0.00 66.70 66.72 1n7g h VAL 362 Cb 0.51 1.62 -0.05 0.00 -1.52 0.00 0.00 31.29 31.85 1n7g h VAL 362 CO 0.03 0.30 0.47 0.44 0.02 0.00 0.00 177.57 178.82 1n7g h ASP 363 N 0.02 0.74 0.00 0.57 3.45 -0.68 -0.38 116.42 120.15 1n7g h ASP 363 Ca 0.04 0.01 0.00 0.00 0.43 0.00 0.00 57.03 57.51 1n7g h ASP 363 Cb 0.48 -0.15 0.00 0.00 -0.56 0.00 0.00 39.33 39.10 1n7g h ASP 363 CO 0.02 0.49 0.00 0.00 -1.57 0.00 0.00 179.24 178.18 1n7g n ALA 364 N -2.34 2.52 -1.04 3.45 0.00 0.07 -4.87 120.51 118.30 1n7g n ALA 364 Ca 0.10 -0.14 -0.02 0.00 0.00 0.00 0.00 53.44 53.38 1n7g n ALA 364 Cb 0.13 -1.37 -0.01 0.00 0.00 0.00 0.00 19.45 18.21 1n7g n ALA 364 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1n7g n GLY 365 N 0.69 0.47 0.08 0.00 0.00 -0.15 -4.90 105.19 101.38 1n7g n GLY 365 Ca 0.17 -0.17 -0.06 0.00 0.00 0.00 0.00 46.02 45.96 1n7g n GLY 365 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 1n7g h TYR 366 N 0.00 0.00 -3.48 1.61 -1.99 -0.76 -3.46 116.97 108.89 1n7g h TYR 366 Ca -0.03 0.00 -0.68 0.00 2.00 0.00 0.00 58.73 60.02 1n7g h TYR 366 Cb 0.35 0.00 -0.17 0.00 2.00 0.00 0.00 36.73 38.92 1n7g h TYR 366 CO 0.20 0.91 -0.66 1.41 -0.00 0.00 0.00 178.16 180.02 1n7g s MET 367 N -2.70 2.83 0.00 4.88 1.75 -0.49 -4.96 119.30 120.61 1n7g s MET 367 Ca -0.02 -0.51 0.30 0.00 -1.25 0.00 0.00 55.69 54.21 1n7g s MET 367 Cb 0.09 -2.68 1.50 0.00 2.84 0.00 0.00 34.83 36.58 1n7g s MET 367 CO 0.82 0.67 2.00 -0.40 -0.65 0.00 0.00 175.02 177.45