#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1iqw s ILE 2 N 0.00 4.31 -0.04 2.12 1.01 -1.26 -4.97 121.20 122.36 1iqw s ILE 2 Ca 0.00 1.53 -0.13 0.00 0.00 0.00 0.00 60.65 62.05 1iqw s ILE 2 Cb 0.00 -4.16 -0.05 0.00 0.01 0.00 0.00 42.46 38.26 1iqw s ILE 2 CO 0.00 -0.33 0.33 -0.69 0.00 0.00 0.00 174.94 174.26 1iqw s VAL 3 N 3.83 5.18 -0.10 2.92 1.01 -1.26 -4.76 120.40 127.22 1iqw s VAL 3 Ca 0.53 0.66 -0.02 0.00 0.00 0.00 0.00 61.98 63.15 1iqw s VAL 3 Cb -0.18 -3.63 -0.03 0.00 0.00 0.00 0.00 36.38 32.55 1iqw s VAL 3 CO 0.17 0.57 -0.02 -0.76 0.00 0.00 0.00 175.10 175.06 1iqw s LEU 4 N -0.92 3.41 -0.11 3.92 1.43 -1.26 0.15 118.68 125.30 1iqw s LEU 4 Ca 0.21 0.03 0.01 0.00 -1.03 0.00 0.00 54.13 53.35 1iqw s LEU 4 Cb -0.15 -1.78 0.02 0.00 0.03 0.00 0.00 46.19 44.30 1iqw s LEU 4 CO 0.10 0.31 -0.12 -0.89 0.23 0.00 0.00 176.35 175.98 1iqw s THR 5 N -0.49 1.28 -0.14 5.49 2.01 0.11 -4.26 115.64 119.64 1iqw s THR 5 Ca 0.08 -0.49 -0.05 0.00 0.31 0.00 0.00 61.69 61.54 1iqw s THR 5 Cb -0.12 -1.21 -0.04 0.00 0.01 0.00 0.00 72.50 71.15 1iqw s THR 5 CO 0.02 0.40 0.04 -1.10 -0.69 0.00 0.00 174.62 173.29 1iqw s GLN 6 N 1.24 3.54 -0.03 4.92 -0.21 -1.26 0.18 119.66 128.05 1iqw s GLN 6 Ca -0.03 -0.37 0.02 0.00 0.02 0.00 0.00 55.36 55.01 1iqw s GLN 6 Cb -0.14 -3.03 0.01 0.00 1.00 0.00 0.00 33.01 30.85 1iqw s GLN 6 CO -0.04 0.47 -0.07 -1.54 -2.12 0.00 0.00 175.29 171.99 1iqw s SER 7 N -0.21 1.02 0.12 5.90 1.04 -1.00 -4.42 113.70 116.15 1iqw s SER 7 Ca 0.07 -0.15 0.00 0.00 0.48 0.00 0.00 55.95 56.34 1iqw s SER 7 Cb -0.12 -0.33 0.00 0.00 0.10 0.00 0.00 66.02 65.67 1iqw s SER 7 CO 0.02 0.03 0.00 -0.81 0.98 0.00 0.00 173.24 173.45 1iqw n PRO 8 N 3.48 1.47 0.03 4.02 -0.04 -1.26 -2.53 135.00 140.16 1iqw n PRO 8 Ca -0.20 0.00 0.06 0.00 -0.04 0.00 0.00 63.50 63.32 1iqw n PRO 8 Cb 0.54 0.00 -0.10 0.00 -0.04 0.00 0.00 33.50 33.90 1iqw n PRO 8 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1iqw n ALA 9 N -3.00 2.37 -2.97 0.55 0.00 -1.26 -4.57 120.51 111.62 1iqw n ALA 9 Ca 0.00 -0.53 -0.11 0.00 0.00 0.00 0.00 53.44 52.81 1iqw n ALA 9 Cb 0.00 -0.85 -0.12 0.00 0.00 0.00 0.00 19.45 18.48 1iqw n ALA 9 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1iqw s SER 10 N -5.19 0.06 -0.10 0.00 0.15 -1.26 -0.46 113.70 106.90 1iqw s SER 10 Ca -0.05 -0.15 -0.09 0.00 0.70 0.00 0.00 55.95 56.36 1iqw s SER 10 Cb 0.10 0.12 0.03 0.00 -1.71 0.00 0.00 66.02 64.56 1iqw s SER 10 CO 0.84 -0.17 0.27 -0.22 1.20 0.00 0.00 173.24 175.16 1iqw s LEU 11 N -0.71 0.94 -0.15 3.45 2.96 0.53 -4.91 118.68 120.80 1iqw s LEU 11 Ca -0.08 0.54 0.01 0.00 -0.22 0.00 0.00 54.13 54.38 1iqw s LEU 11 Cb -0.05 0.91 0.02 0.00 0.50 0.00 0.00 46.19 47.57 1iqw s LEU 11 CO -0.00 -0.10 -0.17 0.00 -1.32 0.00 0.00 176.35 174.76 1iqw s ALA 12 N 0.21 2.00 0.08 5.97 0.00 -1.26 0.99 121.76 129.75 1iqw s ALA 12 Ca -0.01 -0.97 0.05 0.00 0.00 0.00 0.00 51.96 51.03 1iqw s ALA 12 Cb -0.02 -1.03 -0.03 0.00 0.00 0.00 0.00 23.12 22.04 1iqw s ALA 12 CO -0.00 -0.25 -0.14 0.08 0.00 0.00 0.00 175.76 175.44 1iqw s VAL 13 N 1.23 1.13 0.24 0.00 1.01 0.16 -4.90 120.40 119.27 1iqw s VAL 13 Ca 0.01 -1.36 -0.17 0.00 0.00 0.00 0.00 61.98 60.46 1iqw s VAL 13 Cb -0.14 -1.13 -0.08 0.00 0.00 0.00 0.00 36.38 35.03 1iqw s VAL 13 CO -0.08 -0.25 0.69 -0.44 0.00 0.00 0.00 175.10 175.01 1iqw s SER 14 N -1.84 6.92 0.20 3.32 0.01 -1.26 0.96 113.70 122.02 1iqw s SER 14 Ca -0.01 1.30 -0.32 0.00 1.31 0.00 0.00 55.95 58.23 1iqw s SER 14 Cb -0.09 -2.37 -0.15 0.00 0.21 0.00 0.00 66.02 63.62 1iqw s SER 14 CO 0.02 -0.02 1.28 0.18 0.41 0.00 0.00 173.24 175.11 1iqw n LEU 15 N 0.41 2.29 0.00 2.44 4.77 -1.21 -0.94 117.00 124.76 1iqw n LEU 15 Ca -0.01 1.14 0.00 0.00 -0.03 0.00 0.00 56.01 57.11 1iqw n LEU 15 Cb 0.52 -1.32 0.00 0.00 -2.33 0.00 0.00 43.42 40.29 1iqw n LEU 15 CO 0.43 -0.91 0.00 0.61 -1.33 0.00 0.00 177.39 176.19 1iqw n GLY 16 N 2.10 1.65 4.00 -0.72 0.00 -0.70 -4.96 105.19 106.56 1iqw n GLY 16 Ca 0.13 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.92 1iqw n GLY 16 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1iqw s GLN 17 N -0.21 1.62 -0.19 1.61 -1.52 -0.11 -4.58 119.66 116.28 1iqw s GLN 17 Ca 0.00 -1.24 -0.09 0.00 -1.95 0.00 0.00 55.36 52.08 1iqw s GLN 17 Cb 0.00 -2.35 -0.05 0.00 -0.22 0.00 0.00 33.01 30.39 1iqw s GLN 17 CO 0.00 -1.49 0.10 0.50 -0.25 0.00 0.00 175.29 174.16 1iqw s ARG 18 N -5.14 4.06 -0.15 2.91 3.52 -1.26 -1.09 118.95 121.81 1iqw s ARG 18 Ca 0.67 -0.26 -0.03 0.00 -0.13 0.00 0.00 55.73 55.98 1iqw s ARG 18 Cb -0.04 -3.32 -0.02 0.00 -1.56 0.00 0.00 34.95 30.00 1iqw s ARG 18 CO 0.44 0.32 -0.07 0.00 -0.81 0.00 0.00 175.30 175.19 1iqw s ALA 19 N 0.28 2.88 -0.16 6.12 0.00 0.17 -4.98 121.76 126.06 1iqw s ALA 19 Ca 0.07 -0.85 0.01 0.00 0.00 0.00 0.00 51.96 51.19 1iqw s ALA 19 Cb -0.12 -1.45 0.02 0.00 0.00 0.00 0.00 23.12 21.57 1iqw s ALA 19 CO -0.01 0.21 -0.18 0.99 0.00 0.00 0.00 175.76 176.78 1iqw s THR 20 N 0.38 1.85 -0.20 0.00 2.01 -1.26 -1.38 115.64 117.04 1iqw s THR 20 Ca -0.06 -0.81 -0.03 0.00 0.31 0.00 0.00 61.69 61.09 1iqw s THR 20 Cb -0.15 -1.69 -0.01 0.00 0.01 0.00 0.00 72.50 70.66 1iqw s THR 20 CO 0.04 0.51 -0.05 -0.63 -0.69 0.00 0.00 174.62 173.79 1iqw s ILE 21 N 1.30 3.43 0.12 1.82 1.01 0.09 -4.88 121.20 124.09 1iqw s ILE 21 Ca 0.03 -0.49 -0.07 0.00 0.00 0.00 0.00 60.65 60.13 1iqw s ILE 21 Cb -0.13 -2.54 -0.06 0.00 0.01 0.00 0.00 42.46 39.74 1iqw s ILE 21 CO -0.10 0.44 0.39 -0.55 0.00 0.00 0.00 174.94 175.12 1iqw s SER 22 N 1.16 6.54 -0.07 3.58 0.15 -1.05 -0.34 113.70 123.68 1iqw s SER 22 Ca 0.02 0.67 -0.03 0.00 0.70 0.00 0.00 55.95 57.31 1iqw s SER 22 Cb -0.14 -2.12 0.04 0.00 -1.71 0.00 0.00 66.02 62.08 1iqw s SER 22 CO -0.01 0.09 0.12 0.00 1.20 0.00 0.00 173.24 174.64 1iqw s LYS 24 N 1.99 3.50 0.11 0.00 2.47 0.13 -1.74 119.74 126.19 1iqw s LYS 24 Ca 0.01 -0.60 -0.11 0.00 -1.56 0.00 0.00 55.97 53.71 1iqw s LYS 24 Cb -0.12 -2.86 -0.06 0.00 -1.46 0.00 0.00 37.83 33.32 1iqw s LYS 24 CO -0.05 0.09 0.45 0.00 0.16 0.00 0.00 175.35 176.00 1iqw s ALA 25 N 0.72 3.68 0.26 3.13 0.00 -0.40 0.08 121.76 129.23 1iqw s ALA 25 Ca -0.03 -0.32 0.09 0.00 0.00 0.00 0.00 51.96 51.70 1iqw s ALA 25 Cb -0.15 -2.34 0.31 0.00 0.00 0.00 0.00 23.12 20.95 1iqw s ALA 25 CO 0.02 0.54 1.59 0.66 0.00 0.00 0.00 175.76 178.57 1iqw h SER 26 N 3.53 0.03 -5.21 0.00 4.64 -0.61 -3.46 113.55 112.47 1iqw h SER 26 Ca -0.49 -0.02 -0.12 0.00 -0.47 0.00 0.00 61.79 60.69 1iqw h SER 26 Cb 1.19 -0.01 -0.15 0.00 -0.31 0.00 0.00 62.40 63.11 1iqw h SER 26 CO 0.67 0.67 -0.65 -1.10 -0.87 0.00 0.00 176.83 175.54 1iqw s GLN 27 N -3.58 0.60 0.17 4.77 1.11 -1.26 -4.95 119.66 116.53 1iqw s GLN 27 Ca -0.02 -1.14 -0.33 0.00 0.01 0.00 0.00 55.36 53.88 1iqw s GLN 27 Cb 0.12 0.21 -0.14 0.00 -1.01 0.00 0.00 33.01 32.19 1iqw s GLN 27 CO 0.77 -0.12 1.49 0.45 0.01 0.00 0.00 175.29 177.89 1iqw n SER 28 N 0.23 2.76 -1.04 5.90 2.88 -1.26 -4.77 113.62 118.32 1iqw n SER 28 Ca -0.15 1.11 0.03 0.00 -1.33 0.00 0.00 58.87 58.53 1iqw n SER 28 Cb 0.61 -1.39 0.24 0.00 -0.75 0.00 0.00 64.21 62.92 1iqw n SER 28 CO 0.00 0.00 0.00 1.33 -1.23 0.00 0.00 175.04 175.14 1iqw n VAL 29 N 2.83 2.42 -3.06 2.46 0.24 -0.73 -5.00 118.33 117.48 1iqw n VAL 29 Ca 0.16 -2.14 -0.28 0.00 -2.04 0.00 0.00 64.34 60.04 1iqw n VAL 29 Cb 0.28 -0.29 -0.02 0.00 -1.47 0.00 0.00 33.84 32.35 1iqw n VAL 29 CO 0.00 0.00 0.00 -1.81 -2.14 0.00 0.00 176.83 172.88 1iqw s ASP 30 N -2.08 6.38 -0.30 -1.34 1.11 -1.26 -1.92 116.67 117.26 1iqw s ASP 30 Ca 0.44 0.79 -0.12 0.00 0.18 0.00 0.00 52.55 53.85 1iqw s ASP 30 Cb 0.37 -2.18 0.18 0.00 1.07 0.00 0.00 42.92 42.35 1iqw s ASP 30 CO 0.06 -0.36 0.97 -0.47 1.18 0.00 0.00 175.17 176.55 1iqw s TYR 31 N -2.37 -0.73 -1.31 4.23 5.04 -0.75 -4.96 117.35 116.51 1iqw s TYR 31 Ca 0.45 0.87 -0.04 0.00 -2.44 0.00 0.00 57.07 55.91 1iqw s TYR 31 Cb -0.10 0.29 0.01 0.00 0.35 0.00 0.00 41.96 42.51 1iqw s TYR 31 CO 0.36 -0.39 0.92 -3.47 -1.34 0.00 0.00 175.55 171.63 1iqw n ASP 32 N 5.36 -2.87 -0.79 4.32 -0.08 -1.26 -1.29 116.55 119.94 1iqw n ASP 32 Ca -0.06 -0.70 -0.10 0.00 -1.51 0.00 0.00 54.79 52.41 1iqw n ASP 32 Cb 0.53 -4.55 -0.04 0.00 2.34 0.00 0.00 41.12 39.40 1iqw n ASP 32 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1iqw n GLY 33 N -1.52 1.05 3.17 0.27 0.00 -1.26 -4.96 105.19 101.95 1iqw n GLY 33 Ca -0.19 -0.11 -0.34 0.00 0.00 0.00 0.00 46.02 45.38 1iqw n GLY 33 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1iqw s ASP 34 N -2.48 4.32 -0.21 1.61 1.01 -0.41 -5.09 116.67 115.42 1iqw s ASP 34 Ca 0.00 -0.97 -0.22 0.00 0.71 0.00 0.00 52.55 52.07 1iqw s ASP 34 Cb 0.00 -1.64 -0.02 0.00 1.01 0.00 0.00 42.92 42.27 1iqw s ASP 34 CO 0.00 -0.14 0.70 -0.44 0.21 0.00 0.00 175.17 175.49 1iqw s SER 35 N 1.28 6.73 -0.42 0.27 0.01 -1.26 -1.80 113.70 118.51 1iqw s SER 35 Ca -0.01 0.89 -0.05 0.00 1.31 0.00 0.00 55.95 58.09 1iqw s SER 35 Cb -0.17 -2.38 -0.03 0.00 0.21 0.00 0.00 66.02 63.65 1iqw s SER 35 CO -0.05 -0.36 2.99 -1.22 0.41 0.00 0.00 173.24 175.01 1iqw n TYR 36 N 5.40 1.25 -3.98 2.43 0.53 -0.81 -3.28 117.16 118.70 1iqw n TYR 36 Ca 0.01 -1.91 -0.35 0.00 -1.02 0.00 0.00 57.90 54.63 1iqw n TYR 36 Cb 0.49 -1.50 -0.12 0.00 -1.03 0.00 0.00 39.34 37.18 1iqw n TYR 36 CO 0.00 0.00 0.00 1.41 -1.02 0.00 0.00 176.86 177.25 1iqw s MET 37 N -0.84 3.76 0.20 -0.72 1.75 -1.26 -1.38 119.30 120.81 1iqw s MET 37 Ca 0.61 -0.45 0.10 0.00 -1.25 0.00 0.00 55.69 54.70 1iqw s MET 37 Cb 0.35 -3.20 -0.04 0.00 2.84 0.00 0.00 34.83 34.78 1iqw s MET 37 CO -0.15 0.05 -0.12 -0.80 -0.65 0.00 0.00 175.02 173.35 1iqw s ASN 38 N 0.94 4.08 -0.04 1.11 0.01 0.18 0.96 114.94 122.18 1iqw s ASN 38 Ca 0.03 -0.67 0.03 0.00 -0.71 0.00 0.00 52.86 51.54 1iqw s ASN 38 Cb -0.14 -0.62 0.00 0.00 0.41 0.00 0.00 41.25 40.91 1iqw s ASN 38 CO 0.02 0.09 -0.12 0.26 -1.51 0.00 0.00 177.10 175.85 1iqw s TRP 39 N -1.83 1.22 0.16 2.20 0.52 0.15 -0.55 118.94 120.81 1iqw s TRP 39 Ca 0.25 -0.34 0.08 0.00 0.02 0.00 0.00 56.10 56.11 1iqw s TRP 39 Cb -0.08 -0.86 -0.04 0.00 -1.15 0.00 0.00 33.47 31.34 1iqw s TRP 39 CO 0.15 -0.14 -0.16 0.71 0.02 0.00 0.00 176.95 177.52 1iqw s TYR 40 N 0.23 1.68 -0.03 -1.98 1.51 -0.21 -0.85 117.35 117.70 1iqw s TYR 40 Ca -0.05 -0.51 0.08 0.00 -1.01 0.00 0.00 57.07 55.57 1iqw s TYR 40 Cb -0.10 -0.84 -0.02 0.00 -0.11 0.00 0.00 41.96 40.89 1iqw s TYR 40 CO 0.01 0.28 -0.25 -1.14 -1.11 0.00 0.00 175.55 173.33 1iqw s GLN 41 N -2.89 2.15 -0.08 -0.62 0.74 0.10 -1.54 119.66 117.52 1iqw s GLN 41 Ca 0.15 -0.91 -0.02 0.00 0.05 0.00 0.00 55.36 54.62 1iqw s GLN 41 Cb -0.05 -2.03 0.04 0.00 1.10 0.00 0.00 33.01 32.07 1iqw s GLN 41 CO 0.05 0.52 0.03 -1.14 -0.55 0.00 0.00 175.29 174.21 1iqw s GLN 42 N -0.52 0.32 0.15 1.67 0.74 0.28 0.79 119.66 123.09 1iqw s GLN 42 Ca 0.08 0.13 -0.03 0.00 0.05 0.00 0.00 55.36 55.59 1iqw s GLN 42 Cb -0.11 -1.02 -0.05 0.00 1.10 0.00 0.00 33.01 32.94 1iqw s GLN 42 CO -0.00 -0.38 0.35 0.15 -0.55 0.00 0.00 175.29 174.86 1iqw s LYS 43 N 2.05 3.55 0.26 1.67 1.02 -1.26 -1.89 119.74 125.13 1iqw s LYS 43 Ca 0.04 -0.23 -0.29 0.00 0.02 0.00 0.00 55.97 55.51 1iqw s LYS 43 Cb -0.13 -2.88 -0.15 0.00 -0.52 0.00 0.00 37.83 34.16 1iqw s LYS 43 CO -0.05 0.47 1.03 -0.35 -0.92 0.00 0.00 175.35 175.52 1iqw n PRO 44 N -0.13 1.26 -1.82 -1.68 -0.04 -1.26 -1.73 135.00 129.60 1iqw n PRO 44 Ca -0.04 0.44 -0.18 0.00 -0.04 0.00 0.00 63.50 63.69 1iqw n PRO 44 Cb 0.52 -1.83 -0.05 0.00 -0.04 0.00 0.00 33.50 32.10 1iqw n PRO 44 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1iqw n GLY 45 N 1.46 0.96 3.05 0.55 0.00 -1.26 -4.99 105.19 104.96 1iqw n GLY 45 Ca 0.11 -0.17 -0.10 0.00 0.00 0.00 0.00 46.02 45.86 1iqw n GLY 45 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1iqw s GLN 46 N -4.00 0.49 0.66 1.61 -0.21 -0.70 -5.15 119.66 112.36 1iqw s GLN 46 Ca 0.00 -0.83 -0.12 0.00 0.02 0.00 0.00 55.36 54.42 1iqw s GLN 46 Cb 0.00 -0.04 -0.01 0.00 1.00 0.00 0.00 33.01 33.96 1iqw s GLN 46 CO 0.00 -0.02 1.06 -1.25 -2.12 0.00 0.00 175.29 172.95 1iqw s PRO 47 N -2.15 3.07 0.72 2.91 0.04 -1.26 -4.57 135.00 133.75 1iqw s PRO 47 Ca -0.07 1.02 -0.16 0.00 0.04 0.00 0.00 61.00 61.82 1iqw s PRO 47 Cb -0.05 -2.01 0.03 0.00 0.04 0.00 0.00 34.50 32.51 1iqw s PRO 47 CO -0.02 -1.00 1.25 -2.14 0.04 0.00 0.00 177.00 175.12 1iqw s PRO 48 N -4.78 2.17 -0.05 0.56 0.02 -1.26 -4.69 135.00 126.97 1iqw s PRO 48 Ca 0.59 1.90 0.06 0.00 0.02 0.00 0.00 61.00 63.58 1iqw s PRO 48 Cb -0.14 -1.82 -0.01 0.00 0.02 0.00 0.00 34.50 32.54 1iqw s PRO 48 CO 0.50 -1.84 -0.24 0.21 -0.33 0.00 0.00 177.00 175.29 1iqw s LYS 49 N -3.73 2.36 0.02 5.54 2.20 0.24 -4.92 119.74 121.45 1iqw s LYS 49 Ca 0.78 -0.86 -0.30 0.00 -0.36 0.00 0.00 55.97 55.22 1iqw s LYS 49 Cb -0.33 -2.04 -0.04 0.00 -1.51 0.00 0.00 37.83 33.91 1iqw s LYS 49 CO 0.44 0.39 1.05 -1.17 -0.36 0.00 0.00 175.35 175.70 1iqw s LEU 50 N -0.21 4.37 -0.11 5.43 2.96 -1.26 0.01 118.68 129.87 1iqw s LEU 50 Ca -0.01 1.77 -0.10 0.00 -0.22 0.00 0.00 54.13 55.56 1iqw s LEU 50 Cb -0.13 -3.57 -0.05 0.00 0.50 0.00 0.00 46.19 42.94 1iqw s LEU 50 CO 0.03 -0.32 -0.22 0.18 -1.32 0.00 0.00 176.35 174.69 1iqw n LEU 51 N 3.90 1.49 -3.95 -0.68 4.77 -0.03 -4.83 117.00 117.67 1iqw n LEU 51 Ca 0.07 0.24 -0.15 0.00 -0.03 0.00 0.00 56.01 56.14 1iqw n LEU 51 Cb 0.50 -0.56 -0.14 0.00 -2.33 0.00 0.00 43.42 40.88 1iqw n LEU 51 CO 0.53 -0.19 -0.39 -0.63 -1.33 0.00 0.00 177.39 175.38 1iqw s ILE 52 N -2.48 0.33 0.19 -0.08 1.01 -1.15 -1.23 121.20 117.78 1iqw s ILE 52 Ca -0.20 -0.25 0.08 0.00 0.00 0.00 0.00 60.65 60.28 1iqw s ILE 52 Cb 0.05 -0.30 -0.04 0.00 0.01 0.00 0.00 42.46 42.18 1iqw s ILE 52 CO 0.28 0.05 -0.16 -0.72 0.00 0.00 0.00 174.94 174.39 1iqw s TYR 53 N -0.21 1.77 -1.42 3.97 1.13 -0.23 -0.68 117.35 121.69 1iqw s TYR 53 Ca 0.00 -0.51 -0.07 0.00 -1.41 0.00 0.00 57.07 55.08 1iqw s TYR 53 Cb -0.02 -0.85 0.04 0.00 -1.10 0.00 0.00 41.96 40.03 1iqw s TYR 53 CO -0.00 0.36 0.58 0.00 -2.51 0.00 0.00 175.55 173.97 1iqw n ALA 54 N -0.07 -1.03 0.00 9.51 0.00 -1.11 -1.63 120.51 126.18 1iqw n ALA 54 Ca -0.10 0.19 0.00 0.00 0.00 0.00 0.00 53.44 53.53 1iqw n ALA 54 Cb 0.59 -3.43 0.00 0.00 0.00 0.00 0.00 19.45 16.61 1iqw n ALA 54 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1iqw n ALA 55 N -3.60 0.00 -0.83 0.00 0.00 0.27 -4.35 120.51 112.00 1iqw n ALA 55 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.38 1iqw n ALA 55 Cb 0.58 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.03 1iqw n ALA 55 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1iqw n SER 56 N 1.74 0.53 -4.57 0.00 3.41 -1.22 -3.67 113.62 109.84 1iqw n SER 56 Ca 0.00 -1.35 -0.41 0.00 -0.26 0.00 0.00 58.87 56.85 1iqw n SER 56 Cb 0.00 -0.02 -0.08 0.00 -0.26 0.00 0.00 64.21 63.85 1iqw n SER 56 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 1iqw s ASN 57 N -0.37 6.30 -0.16 4.04 0.01 -0.64 -4.74 114.94 119.37 1iqw s ASN 57 Ca 0.01 0.03 -0.29 0.00 -0.71 0.00 0.00 52.86 51.89 1iqw s ASN 57 Cb 0.01 -2.25 -0.01 0.00 0.41 0.00 0.00 41.25 39.40 1iqw s ASN 57 CO 0.00 -0.41 1.15 -0.22 -1.51 0.00 0.00 177.10 176.11 1iqw s LEU 58 N 2.30 4.18 0.51 0.60 2.96 -1.26 -1.07 118.68 126.90 1iqw s LEU 58 Ca 0.18 1.59 -0.22 0.00 -0.22 0.00 0.00 54.13 55.46 1iqw s LEU 58 Cb -0.16 -3.54 -0.06 0.00 0.50 0.00 0.00 46.19 42.93 1iqw s LEU 58 CO 0.12 -0.66 1.24 -0.70 -1.32 0.00 0.00 176.35 175.03 1iqw s GLU 59 N 3.00 3.40 0.35 1.98 2.56 -0.37 -4.92 118.70 124.70 1iqw s GLU 59 Ca 0.51 1.95 -0.29 0.00 0.00 0.00 0.00 54.97 57.14 1iqw s GLU 59 Cb -0.20 -2.27 -0.11 0.00 2.00 0.00 0.00 34.13 33.55 1iqw s GLU 59 CO 0.13 -0.89 1.47 -1.13 -0.56 0.00 0.00 175.26 174.29 1iqw n SER 60 N -0.87 3.61 0.00 -1.70 3.41 -1.26 -2.20 113.62 114.61 1iqw n SER 60 Ca 0.09 1.21 0.00 0.00 -0.26 0.00 0.00 58.87 59.91 1iqw n SER 60 Cb 0.47 -1.59 0.00 0.00 -0.26 0.00 0.00 64.21 62.83 1iqw n SER 60 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1iqw n GLY 61 N 0.89 1.11 3.71 5.00 0.00 -1.26 -5.04 105.19 109.60 1iqw n GLY 61 Ca 0.04 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.68 1iqw n GLY 61 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1iqw s ILE 62 N -2.54 5.20 0.31 -0.61 -1.09 -0.93 -5.04 121.20 116.49 1iqw s ILE 62 Ca 0.00 0.85 -0.29 0.00 -2.23 0.00 0.00 60.65 58.98 1iqw s ILE 62 Cb 0.00 -3.78 -0.13 0.00 -1.58 0.00 0.00 42.46 36.97 1iqw s ILE 62 CO 0.00 0.30 1.29 -2.65 -1.23 0.00 0.00 174.94 172.65 1iqw n PRO 63 N 3.95 2.01 0.00 2.79 -0.02 -1.26 -4.86 135.00 137.60 1iqw n PRO 63 Ca -0.08 0.71 0.03 0.00 -2.02 0.00 0.00 63.50 62.14 1iqw n PRO 63 Cb 0.51 -2.28 0.14 0.00 -0.02 0.00 0.00 33.50 31.85 1iqw n PRO 63 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1iqw n ALA 64 N 0.76 1.49 0.77 3.55 0.00 -1.26 -2.06 120.51 123.76 1iqw n ALA 64 Ca 0.07 -0.03 0.11 0.00 0.00 0.00 0.00 53.44 53.59 1iqw n ALA 64 Cb 0.34 -1.09 0.47 0.00 0.00 0.00 0.00 19.45 19.17 1iqw n ALA 64 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.50 180.39 1iqw n ARG 65 N -1.25 0.02 -3.67 0.00 1.85 -1.26 -4.66 116.66 107.69 1iqw n ARG 65 Ca 0.03 0.12 -0.37 0.00 -1.00 0.00 0.00 57.85 56.63 1iqw n ARG 65 Cb 0.04 -1.50 -0.07 0.00 -1.05 0.00 0.00 32.46 29.89 1iqw n ARG 65 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 1iqw s PHE 66 N -2.98 3.56 0.01 2.89 0.08 -0.87 -1.77 117.98 118.90 1iqw s PHE 66 Ca 0.11 0.63 -0.17 0.00 0.12 0.00 0.00 56.93 57.62 1iqw s PHE 66 Cb 0.14 -2.17 0.03 0.00 -0.57 0.00 0.00 43.02 40.45 1iqw s PHE 66 CO 0.40 0.50 0.37 -1.54 -0.10 0.00 0.00 175.22 174.85 1iqw s SER 67 N -0.39 -0.24 0.05 1.36 1.04 -0.22 -4.99 113.70 110.31 1iqw s SER 67 Ca 0.17 0.04 0.05 0.00 0.48 0.00 0.00 55.95 56.69 1iqw s SER 67 Cb -0.13 0.37 -0.02 0.00 0.10 0.00 0.00 66.02 66.34 1iqw s SER 67 CO 0.05 -0.56 -0.15 -0.83 0.98 0.00 0.00 173.24 172.73 1iqw s GLY 68 N -1.69 0.86 0.22 7.32 0.00 -1.26 -0.03 107.32 112.74 1iqw s GLY 68 Ca -0.09 -0.91 -0.08 0.00 0.00 0.00 0.00 44.72 43.64 1iqw s GLY 68 CO 0.01 -0.90 0.34 -1.35 0.00 0.00 0.00 173.10 171.20 1iqw s SER 69 N -1.35 0.00 0.00 1.64 1.04 -0.88 -4.32 113.70 109.84 1iqw s SER 69 Ca 0.01 -1.09 0.00 0.00 0.48 0.00 0.00 55.95 55.35 1iqw s SER 69 Cb -0.09 0.50 0.00 0.00 0.10 0.00 0.00 66.02 66.54 1iqw s SER 69 CO 0.02 -1.02 0.00 0.61 0.98 0.00 0.00 173.24 173.83 1iqw n GLY 70 N -0.33 2.64 3.54 7.32 0.00 -1.26 -1.96 105.19 115.14 1iqw n GLY 70 Ca -0.01 -2.09 -0.07 0.00 0.00 0.00 0.00 46.02 43.85 1iqw n GLY 70 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1iqw s SER 71 N 0.00 -0.29 0.04 1.61 1.04 -0.92 -4.94 113.70 110.24 1iqw s SER 71 Ca 0.00 0.06 0.00 0.00 0.48 0.00 0.00 55.95 56.49 1iqw s SER 71 Cb 0.00 0.29 0.00 0.00 0.10 0.00 0.00 66.02 66.41 1iqw s SER 71 CO 0.00 -0.45 0.00 0.61 0.98 0.00 0.00 173.24 174.38 1iqw n GLY 72 N -0.04 2.05 0.00 7.32 0.00 -1.26 -3.08 105.19 110.17 1iqw n GLY 72 Ca -0.06 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 45.90 1iqw n GLY 72 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1iqw n THR 73 N 0.00 0.00 -4.26 2.61 -2.24 -1.26 -1.78 114.28 107.34 1iqw n THR 73 Ca 0.00 -0.23 -0.34 0.00 -2.27 0.00 0.00 64.05 61.22 1iqw n THR 73 Cb 0.00 1.45 -0.15 0.00 -2.10 0.00 0.00 70.33 69.53 1iqw n THR 73 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1iqw s ASP 74 N -0.08 3.88 0.04 3.42 1.01 -1.18 -1.27 116.67 122.49 1iqw s ASP 74 Ca 0.00 -0.44 0.02 0.00 0.71 0.00 0.00 52.55 52.83 1iqw s ASP 74 Cb 0.00 -1.62 -0.02 0.00 1.01 0.00 0.00 42.92 42.28 1iqw s ASP 74 CO 0.00 0.05 -0.07 -0.36 0.21 0.00 0.00 175.17 175.00 1iqw s PHE 75 N 1.06 0.58 0.02 4.23 0.40 -0.71 -2.15 117.98 121.40 1iqw s PHE 75 Ca -0.00 -0.50 -0.01 0.00 -0.60 0.00 0.00 56.93 55.82 1iqw s PHE 75 Cb -0.15 -0.35 -0.02 0.00 0.51 0.00 0.00 43.02 43.01 1iqw s PHE 75 CO -0.03 -0.10 -0.02 0.95 0.70 0.00 0.00 175.22 176.72 1iqw s THR 76 N -1.37 0.11 -0.11 0.64 -4.23 -0.83 -0.63 115.64 109.21 1iqw s THR 76 Ca -0.11 -0.90 0.02 0.00 -1.18 0.00 0.00 61.69 59.52 1iqw s THR 76 Cb -0.10 -0.28 -0.01 0.00 1.34 0.00 0.00 72.50 73.45 1iqw s THR 76 CO 0.00 -0.49 -0.17 -0.22 -0.54 0.00 0.00 174.62 173.20 1iqw s LEU 77 N -1.46 2.48 -0.05 4.79 2.96 0.54 -2.07 118.68 125.87 1iqw s LEU 77 Ca -0.16 -0.41 0.06 0.00 -0.22 0.00 0.00 54.13 53.40 1iqw s LEU 77 Cb -0.10 -1.53 -0.02 0.00 0.50 0.00 0.00 46.19 45.04 1iqw s LEU 77 CO -0.01 0.17 -0.24 0.20 -1.32 0.00 0.00 176.35 175.16 1iqw s ASN 78 N 0.29 3.22 -0.15 3.68 -0.87 0.96 -0.73 114.94 121.34 1iqw s ASN 78 Ca -0.13 -0.45 -0.00 0.00 -1.57 0.00 0.00 52.86 50.71 1iqw s ASN 78 Cb -0.16 -0.73 0.03 0.00 -0.02 0.00 0.00 41.25 40.37 1iqw s ASN 78 CO 0.07 0.28 -0.08 -0.63 -2.57 0.00 0.00 177.10 174.16 1iqw s ILE 79 N -0.34 1.22 -0.29 0.60 1.01 -0.48 -1.06 121.20 121.87 1iqw s ILE 79 Ca 0.02 -0.58 -0.03 0.00 0.00 0.00 0.00 60.65 60.05 1iqw s ILE 79 Cb -0.12 -1.30 0.17 0.00 0.01 0.00 0.00 42.46 41.22 1iqw s ILE 79 CO 0.02 0.25 0.59 -2.28 0.00 0.00 0.00 174.94 173.51 1iqw s HIS 80 N 1.60 -1.46 0.21 3.97 2.46 -0.73 -0.65 115.29 120.69 1iqw s HIS 80 Ca 0.02 1.78 -0.14 0.00 0.47 0.00 0.00 55.06 57.18 1iqw s HIS 80 Cb -0.14 0.57 -0.08 0.00 -0.13 0.00 0.00 32.58 32.80 1iqw s HIS 80 CO -0.08 -0.81 0.62 -1.25 -2.47 0.00 0.00 174.74 170.75 1iqw s PRO 81 N 2.83 4.00 0.36 2.88 0.04 -1.26 -4.67 135.00 139.18 1iqw s PRO 81 Ca 0.14 0.55 -0.27 0.00 0.04 0.00 0.00 61.00 61.46 1iqw s PRO 81 Cb -0.14 -2.77 -0.09 0.00 0.04 0.00 0.00 34.50 31.53 1iqw s PRO 81 CO -0.20 0.37 1.16 0.08 0.04 0.00 0.00 177.00 178.45 1iqw s VAL 82 N -1.64 3.24 0.45 -0.36 1.01 -0.25 -4.82 120.40 118.04 1iqw s VAL 82 Ca 0.44 1.11 0.04 0.00 0.00 0.00 0.00 61.98 63.57 1iqw s VAL 82 Cb -0.14 -3.65 -0.04 0.00 0.00 0.00 0.00 36.38 32.55 1iqw s VAL 82 CO 0.20 0.16 0.02 -1.61 0.00 0.00 0.00 175.10 173.86 1iqw s GLU 83 N -2.04 2.06 0.09 2.72 0.41 -1.26 -1.72 118.70 118.96 1iqw s GLU 83 Ca 0.53 -2.25 -0.19 0.00 -0.41 0.00 0.00 54.97 52.65 1iqw s GLU 83 Cb -0.31 -1.47 -0.08 0.00 -1.78 0.00 0.00 34.13 30.48 1iqw s GLU 83 CO 0.40 -0.24 1.55 1.05 -0.49 0.00 0.00 175.26 177.52 1iqw h GLU 84 N 1.58 0.41 0.00 1.61 9.09 -1.95 -2.53 114.58 122.79 1iqw h GLU 84 Ca -0.43 -0.12 0.00 0.00 0.05 0.00 0.00 59.36 58.86 1iqw h GLU 84 Cb 1.28 -0.04 0.00 0.00 -1.65 0.00 0.00 28.75 28.34 1iqw h GLU 84 CO 0.75 0.55 0.00 -0.85 0.05 0.00 0.00 179.01 179.52 1iqw n GLU 85 N -4.68 0.03 -0.01 1.06 0.28 -1.00 -1.63 120.64 114.69 1iqw n GLU 85 Ca -0.04 0.28 0.13 0.00 -0.16 0.00 0.00 57.16 57.38 1iqw n GLU 85 Cb 0.21 -1.50 0.63 0.00 1.43 0.00 0.00 31.44 32.22 1iqw n GLU 85 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 1iqw n ASP 86 N -1.30 0.84 -4.64 -1.84 8.00 -0.95 -4.79 116.55 111.86 1iqw n ASP 86 Ca 0.01 -1.37 -0.43 0.00 0.71 0.00 0.00 54.79 53.71 1iqw n ASP 86 Cb 0.02 -0.02 -0.02 0.00 -0.02 0.00 0.00 41.12 41.08 1iqw n ASP 86 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1iqw s ALA 87 N -1.96 3.39 -0.01 2.24 0.00 -0.65 -4.86 121.76 119.91 1iqw s ALA 87 Ca 0.39 0.49 -0.06 0.00 0.00 0.00 0.00 51.96 52.78 1iqw s ALA 87 Cb 0.19 -3.79 0.02 0.00 0.00 0.00 0.00 23.12 19.54 1iqw s ALA 87 CO 0.32 -1.74 0.27 0.00 0.00 0.00 0.00 175.76 174.61 1iqw n ALA 88 N 7.89 -0.77 -2.58 0.00 0.00 -1.20 -4.91 120.51 118.94 1iqw n ALA 88 Ca 0.17 -0.15 -0.33 0.00 0.00 0.00 0.00 53.44 53.13 1iqw n ALA 88 Cb 0.45 0.01 -0.13 0.00 0.00 0.00 0.00 19.45 19.79 1iqw n ALA 88 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1iqw s THR 89 N -2.07 3.29 -0.04 0.00 2.01 -0.79 -0.58 115.64 117.45 1iqw s THR 89 Ca 0.06 -0.63 0.07 0.00 0.31 0.00 0.00 61.69 61.50 1iqw s THR 89 Cb -0.00 -2.32 -0.01 0.00 0.01 0.00 0.00 72.50 70.17 1iqw s THR 89 CO -0.00 0.58 -0.25 -0.31 -0.69 0.00 0.00 174.62 173.95 1iqw s TYR 90 N -0.62 2.41 0.00 4.92 1.51 -0.05 -0.56 117.35 124.97 1iqw s TYR 90 Ca 0.09 -0.60 0.06 0.00 -1.01 0.00 0.00 57.07 55.61 1iqw s TYR 90 Cb -0.11 -1.57 -0.02 0.00 -0.11 0.00 0.00 41.96 40.15 1iqw s TYR 90 CO 0.01 -0.14 -0.18 0.71 -1.11 0.00 0.00 175.55 174.85 1iqw s TYR 91 N -0.34 1.58 0.20 2.71 1.51 -0.59 -1.07 117.35 121.35 1iqw s TYR 91 Ca 0.02 -0.32 0.04 0.00 -1.01 0.00 0.00 57.07 55.81 1iqw s TYR 91 Cb -0.12 -0.99 -0.03 0.00 -0.11 0.00 0.00 41.96 40.70 1iqw s TYR 91 CO 0.02 0.00 0.30 0.00 -1.11 0.00 0.00 175.55 174.76 1iqw s GLN 93 N -3.65 0.44 0.02 0.00 -0.44 0.29 -1.08 119.66 115.24 1iqw s GLN 93 Ca 0.34 0.69 0.00 0.00 -2.50 0.00 0.00 55.36 53.89 1iqw s GLN 93 Cb -0.10 0.10 -0.04 0.00 -1.64 0.00 0.00 33.01 31.33 1iqw s GLN 93 CO 0.28 -0.11 0.09 1.14 0.50 0.00 0.00 175.29 177.18 1iqw s GLN 94 N 0.85 3.04 -0.13 1.67 1.03 -0.85 0.49 119.66 125.76 1iqw s GLN 94 Ca -0.05 -0.53 0.19 0.00 0.04 0.00 0.00 55.36 55.01 1iqw s GLN 94 Cb -0.06 -2.84 0.44 0.00 0.03 0.00 0.00 33.01 30.58 1iqw s GLN 94 CO -0.07 0.63 1.18 0.43 -2.54 0.00 0.00 175.29 174.93 1iqw n SER 95 N 0.98 1.64 0.02 12.60 7.64 -0.48 -3.65 113.62 132.38 1iqw n SER 95 Ca -0.12 -2.84 -0.21 0.00 1.01 0.00 0.00 58.87 56.72 1iqw n SER 95 Cb 0.52 -0.41 -0.14 0.00 -1.01 0.00 0.00 64.21 63.18 1iqw n SER 95 CO 0.00 0.00 0.00 -1.13 -3.01 0.00 0.00 175.04 170.90 1iqw h ASN 96 N 1.26 0.39 -3.79 6.43 -0.73 -1.86 -3.49 115.58 113.80 1iqw h ASN 96 Ca -0.09 -0.89 -0.52 0.00 1.87 0.00 0.00 56.30 56.68 1iqw h ASN 96 Cb 1.48 -0.13 -0.13 0.00 0.27 0.00 0.00 38.32 39.81 1iqw h ASN 96 CO 0.13 1.50 -0.52 -0.70 -0.37 0.00 0.00 177.43 177.46 1iqw s GLU 97 N -2.44 1.84 -0.08 6.67 2.12 -1.26 -5.12 118.70 120.43 1iqw s GLU 97 Ca -0.18 -2.10 -0.01 0.00 0.36 0.00 0.00 54.97 53.04 1iqw s GLU 97 Cb 0.03 -0.41 -0.03 0.00 0.26 0.00 0.00 34.13 33.98 1iqw s GLU 97 CO 0.78 -0.48 0.00 -0.51 -0.54 0.00 0.00 175.26 174.51 1iqw s ASP 98 N -3.53 5.21 0.74 -1.70 -0.00 -1.26 -3.77 116.67 112.36 1iqw s ASP 98 Ca 0.29 0.13 -0.12 0.00 -0.00 0.00 0.00 52.55 52.85 1iqw s ASP 98 Cb 0.03 -1.46 0.03 0.00 -0.00 0.00 0.00 42.92 41.53 1iqw s ASP 98 CO 0.17 0.37 1.11 -2.16 -0.00 0.00 0.00 175.17 174.66 1iqw s PRO 99 N -0.94 2.58 0.28 8.23 0.04 -1.26 -4.84 135.00 139.09 1iqw s PRO 99 Ca 0.14 0.41 -0.29 0.00 0.04 0.00 0.00 61.00 61.29 1iqw s PRO 99 Cb -0.11 -1.99 -0.09 0.00 0.04 0.00 0.00 34.50 32.34 1iqw s PRO 99 CO 0.03 -1.22 1.06 1.03 0.04 0.00 0.00 177.00 177.94 1iqw s ARG 100 N -5.38 4.66 0.08 4.56 0.52 -1.25 -4.78 118.95 117.36 1iqw s ARG 100 Ca 0.59 1.72 0.03 0.00 -0.52 0.00 0.00 55.73 57.55 1iqw s ARG 100 Cb -0.11 -3.17 -0.03 0.00 0.52 0.00 0.00 34.95 32.15 1iqw s ARG 100 CO 0.51 0.26 -0.09 0.95 0.02 0.00 0.00 175.30 176.96 1iqw s THR 101 N -1.19 0.75 0.24 0.02 -4.23 -1.24 -5.04 115.64 104.95 1iqw s THR 101 Ca 0.44 -1.49 0.11 0.00 -1.18 0.00 0.00 61.69 59.57 1iqw s THR 101 Cb -0.30 -1.15 -0.05 0.00 1.34 0.00 0.00 72.50 72.34 1iqw s THR 101 CO 0.38 -0.55 -0.14 -0.36 -0.54 0.00 0.00 174.62 173.41 1iqw s PHE 102 N -2.28 2.46 0.66 3.99 0.40 -1.26 -2.01 117.98 119.94 1iqw s PHE 102 Ca 0.01 -0.29 -0.07 0.00 -0.60 0.00 0.00 56.93 55.98 1iqw s PHE 102 Cb -0.04 -1.12 0.03 0.00 0.51 0.00 0.00 43.02 42.40 1iqw s PHE 102 CO -0.01 0.62 0.99 0.20 0.70 0.00 0.00 175.22 177.72 1iqw s GLY 103 N -3.27 1.63 0.59 4.36 0.00 -0.24 -4.54 107.32 105.86 1iqw s GLY 103 Ca 0.28 -0.70 0.30 0.00 0.00 0.00 0.00 44.72 44.60 1iqw s GLY 103 CO 0.15 -0.35 2.25 -1.33 0.00 0.00 0.00 173.10 173.82 1iqw h GLY 104 N -0.45 0.00 0.00 0.20 0.00 -1.90 -3.43 103.07 97.48 1iqw h GLY 104 Ca -0.45 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.88 1iqw h GLY 104 CO 0.61 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.76 1iqw n GLY 105 N -1.25 2.15 2.85 4.60 0.00 -1.26 -5.04 105.19 107.24 1iqw n GLY 105 Ca -0.03 -1.78 -0.23 0.00 0.00 0.00 0.00 46.02 43.99 1iqw n GLY 105 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1iqw s THR 106 N -2.28 0.57 -0.18 2.61 2.01 -0.23 -4.63 115.64 113.51 1iqw s THR 106 Ca 0.00 -0.05 -0.22 0.00 0.31 0.00 0.00 61.69 61.73 1iqw s THR 106 Cb 0.00 -0.64 -0.02 0.00 0.01 0.00 0.00 72.50 71.84 1iqw s THR 106 CO 0.00 0.27 0.66 -0.75 -0.69 0.00 0.00 174.62 174.11 1iqw s LYS 107 N 1.50 4.24 -0.18 4.92 2.20 0.40 -0.88 119.74 131.94 1iqw s LYS 107 Ca -0.02 0.69 -0.08 0.00 -0.36 0.00 0.00 55.97 56.21 1iqw s LYS 107 Cb -0.13 -3.56 -0.04 0.00 -1.51 0.00 0.00 37.83 32.58 1iqw s LYS 107 CO -0.03 -0.22 0.07 -1.17 -0.36 0.00 0.00 175.35 173.64 1iqw s LEU 108 N 1.82 3.85 0.02 5.43 2.96 0.25 -0.34 118.68 132.67 1iqw s LEU 108 Ca 0.31 0.09 0.08 0.00 -0.22 0.00 0.00 54.13 54.39 1iqw s LEU 108 Cb -0.16 -1.97 -0.03 0.00 0.50 0.00 0.00 46.19 44.53 1iqw s LEU 108 CO 0.11 0.17 -0.25 -0.70 -1.32 0.00 0.00 176.35 174.37 1iqw s GLU 109 N 0.37 1.97 -0.13 1.98 2.12 0.28 -3.21 118.70 122.07 1iqw s GLU 109 Ca 0.03 -1.02 -0.14 0.00 0.36 0.00 0.00 54.97 54.21 1iqw s GLU 109 Cb -0.12 -2.04 -0.05 0.00 0.26 0.00 0.00 34.13 32.18 1iqw s GLU 109 CO -0.00 0.54 0.32 0.42 -0.54 0.00 0.00 175.26 176.00 1iqw s ILE 110 N -0.74 5.27 -0.21 -3.70 -1.09 -1.26 -0.67 121.20 118.80 1iqw s ILE 110 Ca 0.11 0.61 -0.15 0.00 -2.23 0.00 0.00 60.65 58.99 1iqw s ILE 110 Cb -0.10 -3.65 -0.04 0.00 -1.58 0.00 0.00 42.46 37.09 1iqw s ILE 110 CO 0.01 0.42 0.37 -0.54 -1.23 0.00 0.00 174.94 173.97 1iqw s LYS 111 N 0.21 4.15 0.00 2.79 1.02 0.27 -4.87 119.74 123.31 1iqw s LYS 111 Ca 0.18 0.14 0.00 0.00 0.02 0.00 0.00 55.97 56.32 1iqw s LYS 111 Cb -0.14 -3.55 0.00 0.00 -0.52 0.00 0.00 37.83 33.63 1iqw s LYS 111 CO 0.06 -0.05 0.00 2.89 -0.92 0.00 0.00 175.35 177.33 1iqw n ARG 112 N 4.52 0.82 -2.87 1.68 1.85 -1.26 -3.33 116.66 118.08 1iqw n ARG 112 Ca -0.09 0.00 -0.34 0.00 -1.00 0.00 0.00 57.85 56.42 1iqw n ARG 112 Cb 0.51 0.00 -0.07 0.00 -1.05 0.00 0.00 32.46 31.85 1iqw n ARG 112 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1iqw s ALA 113 N -2.00 3.14 0.52 2.89 0.00 -1.26 -4.99 121.76 120.06 1iqw s ALA 113 Ca 0.00 0.37 -0.20 0.00 0.00 0.00 0.00 51.96 52.13 1iqw s ALA 113 Cb 0.00 -3.09 -0.09 0.00 0.00 0.00 0.00 23.12 19.95 1iqw s ALA 113 CO 0.00 0.18 0.76 -0.25 0.00 0.00 0.00 175.76 176.44 1iqw n ASP 114 N -0.24 -0.01 -3.68 0.00 10.43 -1.26 -4.83 116.55 116.96 1iqw n ASP 114 Ca 0.05 0.85 -0.14 0.00 2.57 0.00 0.00 54.79 58.11 1iqw n ASP 114 Cb 0.53 -1.26 -0.14 0.00 1.84 0.00 0.00 41.12 42.08 1iqw n ASP 114 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 1iqw s ALA 115 N -1.53 -0.40 0.38 2.24 0.00 0.04 -4.90 121.76 117.58 1iqw s ALA 115 Ca 0.69 0.80 -0.25 0.00 0.00 0.00 0.00 51.96 53.20 1iqw s ALA 115 Cb -0.48 -0.83 -0.09 0.00 0.00 0.00 0.00 23.12 21.71 1iqw s ALA 115 CO 0.53 -0.49 1.03 0.00 0.00 0.00 0.00 175.76 176.83 1iqw s ALA 116 N 2.05 3.13 0.55 0.00 0.00 -1.26 -1.29 121.76 124.93 1iqw s ALA 116 Ca -0.01 0.66 -0.17 0.00 0.00 0.00 0.00 51.96 52.44 1iqw s ALA 116 Cb -0.12 -3.25 -0.06 0.00 0.00 0.00 0.00 23.12 19.69 1iqw s ALA 116 CO -0.07 -0.12 1.04 -1.25 0.00 0.00 0.00 175.76 175.36 1iqw s PRO 117 N -2.39 3.54 -0.29 0.00 0.04 -1.26 -4.62 135.00 130.03 1iqw s PRO 117 Ca 0.56 1.23 -0.10 0.00 0.04 0.00 0.00 61.00 62.73 1iqw s PRO 117 Cb -0.21 -2.06 -0.03 0.00 0.04 0.00 0.00 34.50 32.23 1iqw s PRO 117 CO 0.27 -0.63 0.17 0.99 0.04 0.00 0.00 177.00 177.84 1iqw s THR 118 N -2.31 4.96 -0.17 1.26 2.01 -0.72 -4.90 115.64 115.77 1iqw s THR 118 Ca 0.64 -0.09 -0.07 0.00 0.31 0.00 0.00 61.69 62.49 1iqw s THR 118 Cb -0.16 -3.42 -0.04 0.00 0.01 0.00 0.00 72.50 68.90 1iqw s THR 118 CO 0.31 0.18 0.05 -0.69 -0.69 0.00 0.00 174.62 173.78 1iqw s VAL 119 N 1.69 4.73 -0.04 3.82 1.01 -1.26 -1.51 120.40 128.85 1iqw s VAL 119 Ca 0.06 -0.06 0.04 0.00 0.00 0.00 0.00 61.98 62.03 1iqw s VAL 119 Cb -0.16 -3.12 -0.00 0.00 0.00 0.00 0.00 36.38 33.10 1iqw s VAL 119 CO 0.08 0.48 -0.16 -0.44 0.00 0.00 0.00 175.10 175.06 1iqw s SER 120 N 0.20 2.05 -0.05 3.32 0.01 -0.67 -4.97 113.70 113.57 1iqw s SER 120 Ca 0.04 -0.33 0.06 0.00 1.31 0.00 0.00 55.95 57.03 1iqw s SER 120 Cb -0.12 -0.49 -0.01 0.00 0.21 0.00 0.00 66.02 65.60 1iqw s SER 120 CO 0.01 0.16 -0.24 -0.51 0.41 0.00 0.00 173.24 173.06 1iqw s ILE 121 N -0.04 1.98 -0.09 1.44 2.07 -1.26 -0.63 121.20 124.67 1iqw s ILE 121 Ca -0.01 -1.04 0.03 0.00 -1.41 0.00 0.00 60.65 58.22 1iqw s ILE 121 Cb -0.10 -1.68 0.01 0.00 0.13 0.00 0.00 42.46 40.82 1iqw s ILE 121 CO 0.01 0.55 -0.17 -0.36 -1.91 0.00 0.00 174.94 173.07 1iqw s PHE 122 N -0.21 1.96 0.80 3.50 0.40 0.89 -5.01 117.98 120.31 1iqw s PHE 122 Ca -0.02 -0.80 -0.12 0.00 -0.60 0.00 0.00 56.93 55.40 1iqw s PHE 122 Cb -0.13 -1.37 0.07 0.00 0.51 0.00 0.00 43.02 42.10 1iqw s PHE 122 CO 0.03 -0.37 1.16 -1.25 0.70 0.00 0.00 175.22 175.49 1iqw s PRO 123 N 0.60 2.09 0.74 0.24 0.05 -1.26 -1.88 135.00 135.58 1iqw s PRO 123 Ca -0.15 0.19 -0.14 0.00 0.05 0.00 0.00 61.00 60.95 1iqw s PRO 123 Cb -0.16 -1.96 0.05 0.00 0.05 0.00 0.00 34.50 32.47 1iqw s PRO 123 CO 0.05 -1.52 1.19 -2.14 0.05 0.00 0.00 177.00 174.63 1iqw s PRO 124 N -5.52 2.10 0.25 0.56 0.02 -1.24 -4.84 135.00 126.33 1iqw s PRO 124 Ca 0.61 1.71 -0.16 0.00 0.02 0.00 0.00 61.00 63.18 1iqw s PRO 124 Cb -0.11 -1.83 -0.08 0.00 0.02 0.00 0.00 34.50 32.49 1iqw s PRO 124 CO 0.50 -1.85 0.68 -1.54 -0.33 0.00 0.00 177.00 174.45 1iqw s SER 125 N -2.15 6.86 0.34 2.53 1.04 -1.26 -4.96 113.70 116.09 1iqw s SER 125 Ca 0.73 1.25 0.06 0.00 0.48 0.00 0.00 55.95 58.47 1iqw s SER 125 Cb -0.28 -2.36 0.72 0.00 0.10 0.00 0.00 66.02 64.21 1iqw s SER 125 CO 0.46 -0.06 1.89 0.77 0.98 0.00 0.00 173.24 177.29 1iqw h SER 126 N 2.88 0.73 -0.20 7.02 4.64 -2.00 -0.96 113.55 125.67 1iqw h SER 126 Ca -0.48 0.03 0.03 0.00 -0.47 0.00 0.00 61.79 60.90 1iqw h SER 126 Cb 1.18 -0.12 -0.03 0.00 -0.31 0.00 0.00 62.40 63.12 1iqw h SER 126 CO 0.66 0.42 -0.01 -0.33 -0.87 0.00 0.00 176.83 176.70 1iqw h GLU 127 N 0.80 0.05 -0.79 4.77 3.07 -2.01 -2.46 114.58 118.01 1iqw h GLU 127 Ca 0.41 -0.00 -0.04 0.00 -0.50 0.00 0.00 59.36 59.23 1iqw h GLU 127 Cb 0.49 -0.01 -0.04 0.00 -0.84 0.00 0.00 28.75 28.36 1iqw h GLU 127 CO -0.18 0.04 0.36 0.37 -1.40 0.00 0.00 179.01 178.20 1iqw h GLN 128 N 0.06 1.16 -0.66 2.33 4.15 -1.54 -3.02 115.11 117.58 1iqw h GLN 128 Ca 0.09 -0.19 0.03 0.00 0.77 0.00 0.00 58.65 59.36 1iqw h GLN 128 Cb 0.12 -0.20 -0.04 0.00 0.21 0.00 0.00 27.48 27.57 1iqw h GLN 128 CO -0.16 0.91 0.44 -0.07 -1.93 0.00 0.00 178.83 178.02 1iqw h LEU 129 N 1.13 0.69 -2.23 -2.39 3.38 -0.92 -1.24 115.31 113.73 1iqw h LEU 129 Ca 0.27 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.23 1iqw h LEU 129 Cb 0.16 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 40.75 1iqw h LEU 129 CO -0.03 0.47 -0.02 0.71 0.09 0.00 0.00 178.44 179.67 1iqw h THR 130 N 0.80 0.73 -0.00 0.22 1.35 -1.34 -1.24 112.91 113.43 1iqw h THR 130 Ca 0.26 -0.06 0.00 0.00 -0.55 0.00 0.00 66.41 66.06 1iqw h THR 130 Cb 0.06 1.04 0.00 0.00 -1.73 0.00 0.00 68.15 67.52 1iqw h THR 130 CO -0.07 0.02 -0.02 -1.54 -0.25 0.00 0.00 175.52 173.66 1iqw n SER 131 N -4.11 0.28 0.00 5.36 3.41 -0.47 -4.92 113.62 113.17 1iqw n SER 131 Ca -0.03 -0.88 0.00 0.00 -0.26 0.00 0.00 58.87 57.70 1iqw n SER 131 Cb 0.10 -0.05 0.00 0.00 -0.26 0.00 0.00 64.21 64.00 1iqw n SER 131 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1iqw n GLY 132 N 1.11 1.02 3.61 5.00 0.00 -0.47 -5.05 105.19 110.41 1iqw n GLY 132 Ca 0.20 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.98 1iqw n GLY 132 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1iqw s GLY 133 N -1.68 2.05 -0.11 -0.02 0.00 -1.25 -0.92 107.32 105.39 1iqw s GLY 133 Ca 0.00 -1.95 -0.04 0.00 0.00 0.00 0.00 44.72 42.72 1iqw s GLY 133 CO 0.00 -1.92 0.22 0.00 0.00 0.00 0.00 173.10 171.41 1iqw s ALA 134 N -2.52 -0.44 -0.15 3.20 0.00 0.91 -3.81 121.76 118.96 1iqw s ALA 134 Ca 0.34 0.84 0.02 0.00 0.00 0.00 0.00 51.96 53.15 1iqw s ALA 134 Cb -0.00 -0.84 0.02 0.00 0.00 0.00 0.00 23.12 22.29 1iqw s ALA 134 CO 0.19 -0.49 -0.19 -1.12 0.00 0.00 0.00 175.76 174.15 1iqw s SER 135 N 2.03 2.94 -0.18 0.00 0.01 -1.26 0.01 113.70 117.25 1iqw s SER 135 Ca -0.02 -0.57 -0.08 0.00 1.31 0.00 0.00 55.95 56.60 1iqw s SER 135 Cb -0.12 -1.35 -0.04 0.00 0.21 0.00 0.00 66.02 64.72 1iqw s SER 135 CO -0.08 0.03 0.09 -0.69 0.41 0.00 0.00 173.24 173.00 1iqw s VAL 136 N 1.07 5.04 -0.02 3.43 1.01 0.33 -3.73 120.40 127.53 1iqw s VAL 136 Ca -0.02 0.05 0.08 0.00 0.00 0.00 0.00 61.98 62.09 1iqw s VAL 136 Cb -0.14 -3.27 -0.02 0.00 0.00 0.00 0.00 36.38 32.95 1iqw s VAL 136 CO -0.06 0.47 -0.25 -0.69 0.00 0.00 0.00 175.10 174.57 1iqw s VAL 137 N 0.20 1.94 -0.08 2.92 1.01 -0.79 -0.60 120.40 125.00 1iqw s VAL 137 Ca 0.06 -1.05 0.03 0.00 0.00 0.00 0.00 61.98 61.02 1iqw s VAL 137 Cb -0.12 -1.61 0.01 0.00 0.00 0.00 0.00 36.38 34.66 1iqw s VAL 137 CO -0.00 0.55 -0.16 0.00 0.00 0.00 0.00 175.10 175.48 1iqw s PHE 139 N 0.59 3.11 -0.46 0.00 2.99 0.20 -1.63 117.98 122.77 1iqw s PHE 139 Ca -0.15 -0.06 0.02 0.00 0.00 0.00 0.00 56.93 56.74 1iqw s PHE 139 Cb -0.16 -1.92 0.12 0.00 0.00 0.00 0.00 43.02 41.06 1iqw s PHE 139 CO 0.05 0.18 0.21 -0.51 -0.00 0.00 0.00 175.22 175.14 1iqw s LEU 140 N -0.08 4.68 0.07 -0.37 1.43 0.42 -1.68 118.68 123.14 1iqw s LEU 140 Ca 0.03 -2.61 -0.03 0.00 -1.03 0.00 0.00 54.13 50.49 1iqw s LEU 140 Cb -0.13 -1.68 -0.05 0.00 0.03 0.00 0.00 46.19 44.36 1iqw s LEU 140 CO 0.02 -0.33 0.27 0.20 0.23 0.00 0.00 176.35 176.74 1iqw s ASN 141 N 0.44 6.42 -0.79 2.29 0.02 -0.57 -0.90 114.94 121.85 1iqw s ASN 141 Ca 0.14 0.42 -0.03 0.00 -1.02 0.00 0.00 52.86 52.38 1iqw s ASN 141 Cb -0.23 -2.03 0.00 0.00 0.02 0.00 0.00 41.25 39.02 1iqw s ASN 141 CO -0.04 0.15 0.62 0.59 0.02 0.00 0.00 177.10 178.45 1iqw n ASN 142 N 0.42 -5.24 -4.40 -1.22 4.13 -0.91 -1.75 115.26 106.29 1iqw n ASN 142 Ca -0.06 -0.80 -0.20 0.00 1.68 0.00 0.00 54.58 55.20 1iqw n ASN 142 Cb 0.52 -2.10 -0.10 0.00 -1.54 0.00 0.00 39.78 36.55 1iqw n ASN 142 CO 0.00 0.00 0.00 0.72 0.28 0.00 0.00 177.26 178.26 1iqw s PHE 143 N -2.89 1.81 -0.27 3.10 -0.12 0.25 -4.51 117.98 115.35 1iqw s PHE 143 Ca 0.03 -0.87 -0.22 0.00 -0.05 0.00 0.00 56.93 55.82 1iqw s PHE 143 Cb -0.00 -1.09 0.08 0.00 -0.63 0.00 0.00 43.02 41.37 1iqw s PHE 143 CO 0.88 0.07 0.73 -0.47 -0.05 0.00 0.00 175.22 176.38 1iqw s TYR 144 N -3.26 -0.85 1.11 3.49 5.04 -0.41 -0.20 117.35 122.26 1iqw s TYR 144 Ca 0.31 1.93 -0.17 0.00 -2.44 0.00 0.00 57.07 56.71 1iqw s TYR 144 Cb 0.06 0.39 0.24 0.00 0.35 0.00 0.00 41.96 43.01 1iqw s TYR 144 CO 0.12 -0.42 1.12 -1.25 -1.34 0.00 0.00 175.55 173.79 1iqw s PRO 145 N 0.79 -0.48 0.05 4.97 0.04 -1.26 -0.78 135.00 138.33 1iqw s PRO 145 Ca -0.03 0.09 0.17 0.00 0.04 0.00 0.00 61.00 61.27 1iqw s PRO 145 Cb -0.05 -1.67 0.73 0.00 0.04 0.00 0.00 34.50 33.55 1iqw s PRO 145 CO -0.06 -3.25 1.55 0.36 0.04 0.00 0.00 177.00 175.63 1iqw n LYS 146 N -4.46 0.04 -2.02 4.56 2.85 -1.26 -4.74 118.16 113.13 1iqw n LYS 146 Ca 0.10 0.27 -0.43 0.00 -1.05 0.00 0.00 58.31 57.20 1iqw n LYS 146 Cb 0.59 -1.57 -0.03 0.00 -0.65 0.00 0.00 35.03 33.37 1iqw n LYS 146 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 177.40 176.84 1iqw s ASP 147 N -3.26 6.44 0.01 -5.58 1.01 -1.26 -4.94 116.67 109.09 1iqw s ASP 147 Ca 0.07 1.94 -0.28 0.00 0.71 0.00 0.00 52.55 54.99 1iqw s ASP 147 Cb 0.10 -2.53 0.09 0.00 1.01 0.00 0.00 42.92 41.59 1iqw s ASP 147 CO 0.31 -1.16 0.79 -0.51 0.21 0.00 0.00 175.17 174.82 1iqw s ILE 148 N 4.90 0.00 -0.01 0.77 2.07 -1.26 -4.59 121.20 123.08 1iqw s ILE 148 Ca 0.75 0.00 -0.12 0.00 -1.41 0.00 0.00 60.65 59.87 1iqw s ILE 148 Cb -0.30 -1.00 0.01 0.00 0.13 0.00 0.00 42.46 41.31 1iqw s ILE 148 CO 0.30 0.00 0.24 0.54 -1.91 0.00 0.00 174.94 174.12 1iqw s ASN 149 N -2.18 -0.11 0.03 4.50 2.20 -1.11 -4.99 114.94 113.27 1iqw s ASN 149 Ca 0.01 -0.03 0.08 0.00 -0.94 0.00 0.00 52.86 51.97 1iqw s ASN 149 Cb -0.01 0.27 -0.02 0.00 -2.00 0.00 0.00 41.25 39.49 1iqw s ASN 149 CO -0.06 -0.42 -0.23 -0.69 -2.94 0.00 0.00 177.10 172.76 1iqw s VAL 150 N -1.35 1.83 -0.02 3.54 1.01 -1.26 -1.12 120.40 123.03 1iqw s VAL 150 Ca -0.14 -1.18 0.06 0.00 0.00 0.00 0.00 61.98 60.72 1iqw s VAL 150 Cb -0.06 -1.56 -0.01 0.00 0.00 0.00 0.00 36.38 34.74 1iqw s VAL 150 CO 0.03 0.34 -0.19 -0.54 0.00 0.00 0.00 175.10 174.75 1iqw s LYS 151 N -0.99 1.60 -0.18 2.72 3.01 -0.78 -4.99 119.74 120.14 1iqw s LYS 151 Ca 0.09 -0.68 -0.04 0.00 -1.01 0.00 0.00 55.97 54.33 1iqw s LYS 151 Cb -0.09 -1.52 -0.03 0.00 -1.01 0.00 0.00 37.83 35.18 1iqw s LYS 151 CO 0.01 0.39 -0.02 -1.58 0.51 0.00 0.00 175.35 174.67 1iqw s TRP 152 N -0.39 3.04 -0.16 3.18 0.52 -1.26 -1.60 118.94 122.28 1iqw s TRP 152 Ca 0.06 -0.35 0.01 0.00 0.02 0.00 0.00 56.10 55.84 1iqw s TRP 152 Cb -0.08 -2.02 0.01 0.00 -1.15 0.00 0.00 33.47 30.23 1iqw s TRP 152 CO -0.00 -0.11 -0.19 0.15 0.02 0.00 0.00 176.95 176.81 1iqw s LYS 153 N 0.63 3.07 -0.24 4.98 3.01 0.54 -0.23 119.74 131.50 1iqw s LYS 153 Ca -0.01 -0.81 -0.04 0.00 -1.01 0.00 0.00 55.97 54.10 1iqw s LYS 153 Cb -0.14 -2.55 0.00 0.00 -1.01 0.00 0.00 37.83 34.13 1iqw s LYS 153 CO 0.02 -0.08 -0.02 0.42 0.51 0.00 0.00 175.35 176.20 1iqw s ILE 154 N 1.01 3.37 -1.34 2.17 1.01 0.27 -0.24 121.20 127.44 1iqw s ILE 154 Ca -0.02 -0.67 -0.00 0.00 0.00 0.00 0.00 60.65 59.96 1iqw s ILE 154 Cb -0.15 -2.62 0.00 0.00 0.01 0.00 0.00 42.46 39.71 1iqw s ILE 154 CO -0.05 0.29 0.63 0.47 0.00 0.00 0.00 174.94 176.28 1iqw n ASP 155 N 4.78 -0.99 0.00 3.58 8.00 0.12 -0.73 116.55 131.30 1iqw n ASP 155 Ca -0.17 -0.87 0.00 0.00 0.71 0.00 0.00 54.79 54.46 1iqw n ASP 155 Cb 0.49 -3.80 0.00 0.00 -0.02 0.00 0.00 41.12 37.79 1iqw n ASP 155 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1iqw n GLY 156 N -1.68 1.77 3.73 0.44 0.00 -1.26 -4.99 105.19 103.20 1iqw n GLY 156 Ca -0.30 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.37 1iqw n GLY 156 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1iqw s SER 157 N -3.23 5.79 0.29 1.61 0.15 0.09 -5.00 113.70 113.40 1iqw s SER 157 Ca 0.00 0.23 -0.29 0.00 0.70 0.00 0.00 55.95 56.58 1iqw s SER 157 Cb 0.00 -1.87 -0.10 0.00 -1.71 0.00 0.00 66.02 62.34 1iqw s SER 157 CO 0.00 0.30 1.21 -0.70 1.20 0.00 0.00 173.24 175.25 1iqw s GLU 158 N -0.40 4.49 -0.01 5.44 2.12 -1.26 0.95 118.70 130.02 1iqw s GLU 158 Ca 0.10 2.01 0.05 0.00 0.36 0.00 0.00 54.97 57.49 1iqw s GLU 158 Cb -0.12 -3.14 -0.01 0.00 0.26 0.00 0.00 34.13 31.12 1iqw s GLU 158 CO 0.02 -0.01 -0.16 0.50 -0.54 0.00 0.00 175.26 175.07 1iqw s ARG 159 N -1.46 1.27 0.00 4.30 6.06 0.68 -4.89 118.95 124.91 1iqw s ARG 159 Ca 0.48 -0.56 0.00 0.00 -2.50 0.00 0.00 55.73 53.14 1iqw s ARG 159 Cb -0.36 -1.22 0.00 0.00 0.06 0.00 0.00 34.95 33.43 1iqw s ARG 159 CO 0.46 0.34 0.00 0.00 -2.50 0.00 0.00 175.30 173.60 1iqw n GLN 160 N 2.69 2.86 -2.88 5.12 10.64 -1.26 -4.07 117.38 130.47 1iqw n GLN 160 Ca -0.14 0.00 -0.41 0.00 -1.83 0.00 0.00 57.00 54.62 1iqw n GLN 160 Cb 0.55 -0.87 -0.04 0.00 -0.86 0.00 0.00 30.24 29.02 1iqw n GLN 160 CO 0.00 0.00 0.00 -0.80 -1.83 0.00 0.00 177.06 174.43 1iqw s ASN 161 N -2.49 7.27 0.00 2.61 0.01 -1.26 -3.80 114.94 117.29 1iqw s ASN 161 Ca 0.00 1.53 0.00 0.00 -0.71 0.00 0.00 52.86 53.68 1iqw s ASN 161 Cb 0.00 -2.51 0.00 0.00 0.41 0.00 0.00 41.25 39.15 1iqw s ASN 161 CO 0.00 -0.09 0.00 0.61 -1.51 0.00 0.00 177.10 176.11 1iqw n GLY 162 N 2.59 1.00 3.33 0.66 0.00 -1.26 -4.84 105.19 106.67 1iqw n GLY 162 Ca 0.01 -0.42 -0.35 0.00 0.00 0.00 0.00 46.02 45.26 1iqw n GLY 162 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1iqw s VAL 163 N -2.00 3.48 -0.21 1.61 1.01 -1.25 -0.98 120.40 122.07 1iqw s VAL 163 Ca 0.00 -0.46 -0.02 0.00 0.00 0.00 0.00 61.98 61.50 1iqw s VAL 163 Cb 0.00 -2.59 -0.00 0.00 0.00 0.00 0.00 36.38 33.79 1iqw s VAL 163 CO 0.00 0.42 -0.09 -0.76 0.00 0.00 0.00 175.10 174.67 1iqw s LEU 164 N 1.46 2.68 -0.03 3.92 1.43 -0.37 -4.95 118.68 122.81 1iqw s LEU 164 Ca 0.05 -0.46 0.03 0.00 -1.03 0.00 0.00 54.13 52.73 1iqw s LEU 164 Cb -0.14 -1.66 -0.03 0.00 0.03 0.00 0.00 46.19 44.39 1iqw s LEU 164 CO -0.02 -0.01 -0.11 0.20 0.23 0.00 0.00 176.35 176.64 1iqw s ASN 165 N 1.38 4.28 -0.09 2.29 0.01 -1.26 -1.29 114.94 120.27 1iqw s ASN 165 Ca 0.05 -0.17 -0.04 0.00 -0.71 0.00 0.00 52.86 51.99 1iqw s ASN 165 Cb -0.14 -0.95 0.05 0.00 0.41 0.00 0.00 41.25 40.62 1iqw s ASN 165 CO -0.06 0.32 0.20 -0.55 -1.51 0.00 0.00 177.10 175.51 1iqw s SER 166 N -0.99 0.01 0.16 -1.22 0.15 -0.47 -4.99 113.70 106.34 1iqw s SER 166 Ca 0.13 0.43 0.03 0.00 0.70 0.00 0.00 55.95 57.24 1iqw s SER 166 Cb -0.11 0.35 -0.03 0.00 -1.71 0.00 0.00 66.02 64.52 1iqw s SER 166 CO 0.03 -0.18 0.29 0.26 1.20 0.00 0.00 173.24 174.83 1iqw s TRP 167 N 1.53 3.47 0.50 3.44 0.51 -1.26 -0.99 118.94 126.13 1iqw s TRP 167 Ca -0.06 0.10 0.06 0.00 -2.12 0.00 0.00 56.10 54.07 1iqw s TRP 167 Cb -0.11 -1.65 0.03 0.00 -0.81 0.00 0.00 33.47 30.93 1iqw s TRP 167 CO -0.07 0.51 0.68 0.95 -0.51 0.00 0.00 176.95 178.51 1iqw s THR 168 N -1.77 2.74 0.72 2.01 -4.23 -0.21 -4.97 115.64 109.93 1iqw s THR 168 Ca 0.34 -0.88 -0.08 0.00 -1.18 0.00 0.00 61.69 59.90 1iqw s THR 168 Cb -0.11 -2.86 0.06 0.00 1.34 0.00 0.00 72.50 70.94 1iqw s THR 168 CO 0.28 0.00 1.04 -1.81 -0.54 0.00 0.00 174.62 173.59 1iqw s ASP 169 N -4.44 4.80 0.31 3.99 1.01 -1.26 -4.63 116.67 116.46 1iqw s ASP 169 Ca 0.57 0.53 -0.29 0.00 0.71 0.00 0.00 52.55 54.07 1iqw s ASP 169 Cb -0.09 -1.17 -0.12 0.00 1.01 0.00 0.00 42.92 42.55 1iqw s ASP 169 CO 0.36 -1.62 1.44 1.67 0.21 0.00 0.00 175.17 177.22 1iqw n GLN 170 N -2.97 2.35 -1.95 8.23 7.27 -1.26 -4.75 117.38 124.29 1iqw n GLN 170 Ca 0.08 0.83 -0.37 0.00 0.07 0.00 0.00 57.00 57.61 1iqw n GLN 170 Cb 0.60 -2.51 0.03 0.00 2.41 0.00 0.00 30.24 30.77 1iqw n GLN 170 CO 0.00 0.00 0.00 0.34 0.07 0.00 0.00 177.06 177.47 1iqw s ASP 171 N 0.09 5.37 0.29 1.69 2.15 0.15 -4.90 116.67 121.52 1iqw s ASP 171 Ca 0.61 2.54 0.24 0.00 0.43 0.00 0.00 52.55 56.37 1iqw s ASP 171 Cb -0.55 -2.62 0.42 0.00 -0.30 0.00 0.00 42.92 39.87 1iqw s ASP 171 CO 0.56 -1.48 1.52 0.28 -0.17 0.00 0.00 175.17 175.88 1iqw h SER 172 N 1.33 0.00 0.00 -0.34 0.02 -1.90 -2.54 113.55 110.11 1iqw h SER 172 Ca -0.50 -0.03 0.00 0.00 -0.84 0.00 0.00 61.79 60.41 1iqw h SER 172 Cb 1.29 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.83 1iqw h SER 172 CO 0.57 0.02 -0.03 2.29 -1.14 0.00 0.00 176.83 178.54 1iqw n LYS 173 N -2.64 5.71 -0.05 3.45 2.85 -1.26 -2.37 118.16 123.84 1iqw n LYS 173 Ca 0.04 0.00 -0.07 0.00 -1.05 0.00 0.00 58.31 57.23 1iqw n LYS 173 Cb 0.49 -0.43 -0.06 0.00 -0.65 0.00 0.00 35.03 34.38 1iqw n LYS 173 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 177.40 173.88 1iqw n ASP 174 N -0.85 3.02 -0.13 -5.58 2.03 -1.26 -4.99 116.55 108.79 1iqw n ASP 174 Ca 0.00 -0.04 -0.02 0.00 0.52 0.00 0.00 54.79 55.25 1iqw n ASP 174 Cb 0.00 0.12 -0.01 0.00 -0.72 0.00 0.00 41.12 40.51 1iqw n ASP 174 CO 0.00 0.00 0.00 -1.20 -1.92 0.00 0.00 177.20 174.08 1iqw n SER 175 N -2.66 -3.81 -4.97 1.67 7.64 -0.96 -4.97 113.62 105.56 1iqw n SER 175 Ca -0.18 0.04 -0.19 0.00 1.01 0.00 0.00 58.87 59.55 1iqw n SER 175 Cb 0.74 -1.47 0.04 0.00 -1.01 0.00 0.00 64.21 62.51 1iqw n SER 175 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 1iqw s THR 176 N -1.86 2.66 0.36 0.44 -4.23 -1.26 -4.65 115.64 107.10 1iqw s THR 176 Ca 0.00 -0.87 0.09 0.00 -1.18 0.00 0.00 61.69 59.73 1iqw s THR 176 Cb 0.00 -2.79 -0.07 0.00 1.34 0.00 0.00 72.50 70.98 1iqw s THR 176 CO 0.00 0.00 -0.07 -0.31 -0.54 0.00 0.00 174.62 173.70 1iqw s TYR 177 N -2.60 2.43 0.06 3.99 1.51 0.72 -0.67 117.35 122.79 1iqw s TYR 177 Ca 0.58 -0.54 -0.05 0.00 -1.01 0.00 0.00 57.07 56.05 1iqw s TYR 177 Cb -0.09 -1.48 -0.02 0.00 -0.11 0.00 0.00 41.96 40.27 1iqw s TYR 177 CO 0.37 0.55 0.09 -1.12 -1.11 0.00 0.00 175.55 174.33 1iqw s SER 178 N -3.63 0.25 0.04 2.29 0.01 -1.26 -0.58 113.70 110.81 1iqw s SER 178 Ca 0.33 -0.72 -0.23 0.00 1.31 0.00 0.00 55.95 56.64 1iqw s SER 178 Cb 0.04 0.26 0.05 0.00 0.21 0.00 0.00 66.02 66.59 1iqw s SER 178 CO 0.17 -0.62 0.54 0.00 0.41 0.00 0.00 173.24 173.74 1iqw s MET 179 N -3.46 1.04 -0.03 12.44 0.23 -0.08 -1.04 119.30 128.40 1iqw s MET 179 Ca 0.02 -0.18 0.02 0.00 -1.03 0.00 0.00 55.69 54.52 1iqw s MET 179 Cb 0.04 0.48 0.01 0.00 -1.53 0.00 0.00 34.83 33.82 1iqw s MET 179 CO -0.09 -0.37 -0.10 -1.54 -2.03 0.00 0.00 175.02 170.89 1iqw s SER 180 N -1.90 1.32 -0.14 -1.18 1.04 -0.16 -0.44 113.70 112.23 1iqw s SER 180 Ca -0.06 -0.21 -0.01 0.00 0.48 0.00 0.00 55.95 56.16 1iqw s SER 180 Cb -0.01 -0.41 -0.01 0.00 0.10 0.00 0.00 66.02 65.69 1iqw s SER 180 CO -0.01 0.06 -0.12 -0.55 0.98 0.00 0.00 173.24 173.60 1iqw s SER 181 N 0.29 4.05 -0.14 7.02 0.15 -0.65 -1.37 113.70 123.05 1iqw s SER 181 Ca -0.05 -0.34 0.02 0.00 0.70 0.00 0.00 55.95 56.28 1iqw s SER 181 Cb -0.10 -1.63 0.01 0.00 -1.71 0.00 0.00 66.02 62.59 1iqw s SER 181 CO 0.01 0.14 -0.19 -0.89 1.20 0.00 0.00 173.24 173.50 1iqw s THR 182 N 0.52 1.88 -0.27 6.45 2.01 -0.41 -1.23 115.64 124.60 1iqw s THR 182 Ca -0.08 -0.86 -0.06 0.00 0.31 0.00 0.00 61.69 60.99 1iqw s THR 182 Cb -0.16 -1.69 -0.00 0.00 0.01 0.00 0.00 72.50 70.66 1iqw s THR 182 CO 0.04 0.51 0.05 -0.22 -0.69 0.00 0.00 174.62 174.31 1iqw s LEU 183 N 0.98 3.54 -0.16 4.42 2.96 0.23 -1.24 118.68 129.42 1iqw s LEU 183 Ca -0.04 -0.52 -0.03 0.00 -0.22 0.00 0.00 54.13 53.32 1iqw s LEU 183 Cb -0.15 -1.86 -0.02 0.00 0.50 0.00 0.00 46.19 44.66 1iqw s LEU 183 CO -0.04 -0.12 -0.06 -0.89 -1.32 0.00 0.00 176.35 173.92 1iqw s THR 184 N 1.52 3.55 0.27 3.68 2.01 -0.15 -0.52 115.64 126.01 1iqw s THR 184 Ca 0.04 -0.47 0.02 0.00 0.31 0.00 0.00 61.69 61.59 1iqw s THR 184 Cb -0.16 -2.55 -0.05 0.00 0.01 0.00 0.00 72.50 69.74 1iqw s THR 184 CO 0.02 0.49 0.08 -0.76 -0.69 0.00 0.00 174.62 173.75 1iqw s LEU 185 N 0.60 1.84 0.61 4.42 1.43 0.10 -4.74 118.68 122.94 1iqw s LEU 185 Ca -0.04 -1.37 -0.10 0.00 -1.03 0.00 0.00 54.13 51.59 1iqw s LEU 185 Cb -0.15 -0.12 -0.04 0.00 0.03 0.00 0.00 46.19 45.92 1iqw s LEU 185 CO 0.03 -0.68 1.01 0.42 0.23 0.00 0.00 176.35 177.36 1iqw s THR 186 N -3.59 4.66 0.36 5.49 -4.23 -1.26 -0.06 115.64 116.99 1iqw s THR 186 Ca 0.36 0.77 0.06 0.00 -1.18 0.00 0.00 61.69 61.71 1iqw s THR 186 Cb 0.08 -3.84 0.30 0.00 1.34 0.00 0.00 72.50 70.37 1iqw s THR 186 CO 0.14 -1.08 1.94 0.50 -0.54 0.00 0.00 174.62 175.57 1iqw h LYS 187 N -0.28 0.74 -0.12 3.99 3.64 -1.27 -2.15 116.57 121.12 1iqw h LYS 187 Ca -0.44 -0.04 -0.13 0.00 -1.27 0.00 0.00 60.65 58.76 1iqw h LYS 187 Cb 1.20 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 32.84 1iqw h LYS 187 CO 0.62 0.49 -0.51 -0.44 -2.27 0.00 0.00 179.45 177.34 1iqw h ASP 188 N 0.76 0.35 -0.06 4.20 5.19 -1.93 -2.00 116.42 122.94 1iqw h ASP 188 Ca 0.35 -0.18 -0.02 0.00 -0.62 0.00 0.00 57.03 56.56 1iqw h ASP 188 Cb 0.36 -0.10 -0.00 0.00 0.18 0.00 0.00 39.33 39.76 1iqw h ASP 188 CO -0.13 0.81 -0.03 -0.08 -3.12 0.00 0.00 179.24 176.69 1iqw h GLU 189 N 0.25 0.12 -0.76 3.56 4.81 -1.81 -3.06 114.58 117.71 1iqw h GLU 189 Ca 0.01 -0.05 0.03 0.00 -0.13 0.00 0.00 59.36 59.21 1iqw h GLU 189 Cb 0.99 -0.00 -0.04 0.00 0.63 0.00 0.00 28.75 30.33 1iqw h GLU 189 CO 0.08 0.50 0.50 -0.92 -0.73 0.00 0.00 179.01 178.44 1iqw h TYR 190 N -0.26 0.91 0.00 0.92 3.20 -1.36 -2.62 116.97 117.76 1iqw h TYR 190 Ca 0.01 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.91 1iqw h TYR 190 Cb 0.46 -0.31 0.00 0.00 1.54 0.00 0.00 36.73 38.43 1iqw h TYR 190 CO 0.07 0.54 0.00 0.39 -1.64 0.00 0.00 178.16 177.52 1iqw n GLU 191 N -4.44 0.18 0.02 1.82 1.02 -0.76 -3.23 120.64 115.24 1iqw n GLU 191 Ca 0.09 0.02 0.11 0.00 -0.02 0.00 0.00 57.16 57.36 1iqw n GLU 191 Cb 0.09 -1.50 0.01 0.00 -0.02 0.00 0.00 31.44 30.02 1iqw n GLU 191 CO 0.00 0.00 0.00 2.89 1.18 0.00 0.00 177.13 181.20 1iqw n ARG 192 N -1.41 0.26 -4.22 3.49 1.85 -0.99 -4.92 116.66 110.72 1iqw n ARG 192 Ca 0.10 -0.01 -0.22 0.00 -1.00 0.00 0.00 57.85 56.71 1iqw n ARG 192 Cb 0.28 -1.57 -0.06 0.00 -1.05 0.00 0.00 32.46 30.06 1iqw n ARG 192 CO 0.00 0.00 0.00 -1.01 -0.01 0.00 0.00 177.63 176.61 1iqw s HIS 193 N -3.18 2.87 0.00 2.89 3.76 -1.20 -5.06 115.29 115.37 1iqw s HIS 193 Ca 0.04 -0.18 0.00 0.00 -0.15 0.00 0.00 55.06 54.77 1iqw s HIS 193 Cb 0.15 -1.29 0.00 0.00 1.11 0.00 0.00 32.58 32.55 1iqw s HIS 193 CO 0.81 0.58 0.00 -1.71 -0.85 0.00 0.00 174.74 173.56 1iqw n ASN 194 N -1.02 4.55 -4.46 1.40 2.85 -1.26 -4.80 115.26 112.53 1iqw n ASN 194 Ca -0.07 0.00 -0.38 0.00 -0.11 0.00 0.00 54.58 54.02 1iqw n ASN 194 Cb 0.59 0.33 -0.12 0.00 1.24 0.00 0.00 39.78 41.81 1iqw n ASN 194 CO 0.00 0.00 0.00 -0.55 -2.11 0.00 0.00 177.26 174.60 1iqw s SER 195 N -3.29 5.54 -0.21 1.20 0.15 -1.26 -0.18 113.70 115.64 1iqw s SER 195 Ca 0.00 -0.42 -0.02 0.00 0.70 0.00 0.00 55.95 56.21 1iqw s SER 195 Cb 0.00 -2.00 0.00 0.00 -1.71 0.00 0.00 66.02 62.31 1iqw s SER 195 CO 0.00 -0.15 -0.08 -0.31 1.20 0.00 0.00 173.24 173.89 1iqw s TYR 196 N 1.63 2.92 0.04 3.44 1.51 -0.76 0.12 117.35 126.25 1iqw s TYR 196 Ca 0.05 -1.17 0.05 0.00 -1.01 0.00 0.00 57.07 54.99 1iqw s TYR 196 Cb -0.17 -2.05 -0.02 0.00 -0.11 0.00 0.00 41.96 39.61 1iqw s TYR 196 CO 0.06 -0.63 -0.15 0.99 -1.11 0.00 0.00 175.55 174.71 1iqw s THR 197 N 1.42 1.21 -0.10 -0.71 2.01 0.66 -1.89 115.64 118.24 1iqw s THR 197 Ca 0.05 -1.01 -0.01 0.00 0.31 0.00 0.00 61.69 61.03 1iqw s THR 197 Cb -0.14 -1.08 0.03 0.00 0.01 0.00 0.00 72.50 71.32 1iqw s THR 197 CO -0.06 0.06 -0.02 0.00 -0.69 0.00 0.00 174.62 173.91 1iqw s GLU 199 N 1.87 3.06 -0.05 0.00 -1.05 -0.63 -2.13 118.70 119.77 1iqw s GLU 199 Ca 0.04 -0.86 -0.04 0.00 -0.15 0.00 0.00 54.97 53.97 1iqw s GLU 199 Cb -0.13 -2.33 -0.04 0.00 -0.44 0.00 0.00 34.13 31.19 1iqw s GLU 199 CO -0.06 0.20 0.15 0.00 0.95 0.00 0.00 175.26 176.50 1iqw s ALA 200 N 0.30 3.87 -0.28 -0.84 0.00 0.76 -1.86 121.76 123.72 1iqw s ALA 200 Ca -0.17 -0.74 -0.01 0.00 0.00 0.00 0.00 51.96 51.04 1iqw s ALA 200 Cb -0.17 -1.87 0.04 0.00 0.00 0.00 0.00 23.12 21.12 1iqw s ALA 200 CO 0.08 0.70 -0.03 0.99 0.00 0.00 0.00 175.76 177.50 1iqw s THR 201 N -1.21 2.88 0.06 0.00 2.01 -0.28 -1.22 115.64 117.89 1iqw s THR 201 Ca 0.23 -1.28 0.04 0.00 0.31 0.00 0.00 61.69 60.99 1iqw s THR 201 Cb -0.12 -2.59 -0.03 0.00 0.01 0.00 0.00 72.50 69.77 1iqw s THR 201 CO 0.13 0.01 -0.11 -2.28 -0.69 0.00 0.00 174.62 171.67 1iqw s HIS 202 N 1.27 1.01 0.60 4.92 2.46 -1.26 -2.77 115.29 121.51 1iqw s HIS 202 Ca -0.04 -0.50 0.36 0.00 0.47 0.00 0.00 55.06 55.36 1iqw s HIS 202 Cb -0.19 -0.57 2.05 0.00 -0.13 0.00 0.00 32.58 33.74 1iqw s HIS 202 CO -0.03 0.00 2.29 1.57 -2.47 0.00 0.00 174.74 176.11 1iqw h LYS 203 N 4.28 0.00 -0.01 2.88 2.10 -1.95 -2.38 116.57 121.49 1iqw h LYS 203 Ca -0.39 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.26 1iqw h LYS 203 Cb 1.19 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.52 1iqw h LYS 203 CO 0.42 0.01 0.00 0.25 -2.00 0.00 0.00 179.45 178.12 1iqw n THR 204 N -3.51 0.00 -3.69 0.07 -2.24 -1.26 -4.69 114.28 98.95 1iqw n THR 204 Ca -0.03 0.00 -0.13 0.00 -2.27 0.00 0.00 64.05 61.63 1iqw n THR 204 Cb 0.09 -0.16 -0.09 0.00 -2.10 0.00 0.00 70.33 68.07 1iqw n THR 204 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1iqw s SER 205 N -1.29 -0.56 0.09 3.42 0.15 -0.90 -5.00 113.70 109.62 1iqw s SER 205 Ca 0.00 1.05 -0.05 0.00 0.70 0.00 0.00 55.95 57.65 1iqw s SER 205 Cb 0.00 1.03 -0.23 0.00 -1.71 0.00 0.00 66.02 65.11 1iqw s SER 205 CO 0.00 -0.18 1.18 0.74 1.20 0.00 0.00 173.24 176.18 1iqw h THR 206 N 4.53 1.46 -3.39 6.45 2.02 -1.84 -3.43 112.91 118.71 1iqw h THR 206 Ca -0.29 -2.88 -0.65 0.00 0.77 0.00 0.00 66.41 63.35 1iqw h THR 206 Cb 1.18 2.81 -0.13 0.00 -1.74 0.00 0.00 68.15 70.27 1iqw h THR 206 CO 0.20 0.85 -0.68 -0.94 0.37 0.00 0.00 175.52 175.31 1iqw s SER 207 N -7.15 4.90 0.78 4.18 1.04 -1.26 -5.09 113.70 111.10 1iqw s SER 207 Ca -0.05 -0.21 -0.15 0.00 0.48 0.00 0.00 55.95 56.02 1iqw s SER 207 Cb 0.07 -1.13 0.01 0.00 0.10 0.00 0.00 66.02 65.07 1iqw s SER 207 CO 0.88 0.18 0.77 -2.65 0.98 0.00 0.00 173.24 173.41 1iqw n PRO 208 N 0.64 0.24 -3.53 4.02 -0.02 -1.26 -4.94 135.00 130.14 1iqw n PRO 208 Ca -0.11 0.14 -0.39 0.00 -2.02 0.00 0.00 63.50 61.11 1iqw n PRO 208 Cb 0.52 -2.07 -0.10 0.00 -0.02 0.00 0.00 33.50 31.83 1iqw n PRO 208 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1iqw s ILE 209 N -2.01 5.27 -0.04 4.25 1.01 -0.36 -4.91 121.20 124.42 1iqw s ILE 209 Ca 0.68 0.18 0.00 0.00 0.00 0.00 0.00 60.65 61.51 1iqw s ILE 209 Cb -0.31 -3.61 -0.03 0.00 0.01 0.00 0.00 42.46 38.51 1iqw s ILE 209 CO 0.56 0.17 -0.01 -0.69 0.00 0.00 0.00 174.94 174.96 1iqw s VAL 210 N 1.83 4.12 -0.12 2.92 1.01 -1.26 -0.17 120.40 128.73 1iqw s VAL 210 Ca 0.09 -0.48 -0.05 0.00 0.00 0.00 0.00 61.98 61.53 1iqw s VAL 210 Cb -0.16 -2.78 0.06 0.00 0.00 0.00 0.00 36.38 33.49 1iqw s VAL 210 CO 0.11 0.48 0.27 -0.75 0.00 0.00 0.00 175.10 175.20 1iqw s LYS 211 N -1.24 0.19 0.29 2.72 2.47 -0.91 -5.01 119.74 118.26 1iqw s LYS 211 Ca 0.16 0.66 -0.08 0.00 -1.56 0.00 0.00 55.97 55.16 1iqw s LYS 211 Cb -0.11 -0.06 -0.00 0.00 -1.46 0.00 0.00 37.83 36.19 1iqw s LYS 211 CO 0.06 -0.22 0.47 -1.54 0.16 0.00 0.00 175.35 174.28 1iqw s SER 212 N 1.85 0.35 0.11 1.43 1.04 -1.26 -1.49 113.70 115.73 1iqw s SER 212 Ca -0.04 -1.21 -0.14 0.00 0.48 0.00 0.00 55.95 55.03 1iqw s SER 212 Cb -0.11 0.62 0.03 0.00 0.10 0.00 0.00 66.02 66.65 1iqw s SER 212 CO -0.09 -1.22 0.35 0.72 0.98 0.00 0.00 173.24 173.98 1iqw s PHE 213 N -3.52 -0.12 -0.10 5.02 -0.12 -0.79 -5.02 117.98 113.33 1iqw s PHE 213 Ca 0.27 -0.20 0.03 0.00 -0.05 0.00 0.00 56.93 56.98 1iqw s PHE 213 Cb -0.00 0.17 -0.01 0.00 -0.63 0.00 0.00 43.02 42.56 1iqw s PHE 213 CO 0.14 -0.65 -0.21 -0.80 -0.05 0.00 0.00 175.22 173.65 1iqw s ASN 214 N -2.74 3.32 0.00 1.98 0.01 -1.26 -1.82 114.94 114.44 1iqw s ASN 214 Ca 0.03 -0.49 0.00 0.00 -0.71 0.00 0.00 52.86 51.68 1iqw s ASN 214 Cb 0.02 -1.37 0.00 0.00 0.41 0.00 0.00 41.25 40.32 1iqw s ASN 214 CO -0.11 0.18 0.45 0.54 -1.51 0.00 0.00 177.10 176.65