#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1i7z n VAL 2 N 0.00 0.97 -4.21 5.09 0.31 -1.26 -4.85 118.33 114.37 1i7z n VAL 2 Ca 0.00 -0.24 -0.17 0.00 -0.01 0.00 0.00 64.34 63.92 1i7z n VAL 2 Cb 0.00 -2.00 -0.15 0.00 -0.91 0.00 0.00 33.84 30.79 1i7z n VAL 2 CO 0.00 0.00 0.00 -1.10 -1.32 0.00 0.00 176.83 174.41 1i7z s GLN 3 N -0.42 0.51 -0.20 5.55 -0.21 -1.26 -4.95 119.66 118.69 1i7z s GLN 3 Ca 0.64 -0.22 -0.03 0.00 0.02 0.00 0.00 55.36 55.78 1i7z s GLN 3 Cb -0.49 -0.50 -0.01 0.00 1.00 0.00 0.00 33.01 33.02 1i7z s GLN 3 CO 0.48 0.13 -0.08 -0.51 -2.12 0.00 0.00 175.29 173.19 1i7z s LEU 4 N -0.11 2.78 -0.24 2.90 1.43 -1.26 -1.75 118.68 122.43 1i7z s LEU 4 Ca 0.02 -0.41 -0.06 0.00 -1.03 0.00 0.00 54.13 52.65 1i7z s LEU 4 Cb -0.03 -1.69 -0.02 0.00 0.03 0.00 0.00 46.19 44.49 1i7z s LEU 4 CO -0.00 0.02 0.03 -1.58 0.23 0.00 0.00 176.35 175.04 1i7z s GLN 5 N 1.25 3.50 0.17 1.70 -0.44 0.58 -4.33 119.66 122.08 1i7z s GLN 5 Ca 0.03 -0.57 0.04 0.00 -2.50 0.00 0.00 55.36 52.36 1i7z s GLN 5 Cb -0.14 -3.21 -0.04 0.00 -1.64 0.00 0.00 33.01 27.98 1i7z s GLN 5 CO -0.03 -0.22 0.20 -0.65 0.50 0.00 0.00 175.29 175.10 1i7z s GLN 6 N 1.55 3.12 0.86 1.67 -0.21 -1.26 0.39 119.66 125.78 1i7z s GLN 6 Ca 0.06 -0.78 -0.11 0.00 0.02 0.00 0.00 55.36 54.54 1i7z s GLN 6 Cb -0.15 -2.76 0.11 0.00 1.00 0.00 0.00 33.01 31.20 1i7z s GLN 6 CO 0.01 0.49 1.09 -1.54 -2.12 0.00 0.00 175.29 173.22 1i7z s SER 7 N -3.25 3.84 0.99 5.90 1.04 -0.58 -4.99 113.70 116.65 1i7z s SER 7 Ca 0.32 1.48 -0.12 0.00 0.48 0.00 0.00 55.95 58.11 1i7z s SER 7 Cb -0.10 -2.18 0.18 0.00 0.10 0.00 0.00 66.02 64.02 1i7z s SER 7 CO 0.26 -2.41 1.10 -0.83 0.98 0.00 0.00 173.24 172.34 1i7z s GLY 8 N -3.53 1.56 0.71 7.32 0.00 -1.26 -4.62 107.32 107.51 1i7z s GLY 8 Ca 0.62 -0.41 -0.16 0.00 0.00 0.00 0.00 44.72 44.77 1i7z s GLY 8 CO 0.56 0.20 0.79 -1.55 0.00 0.00 0.00 173.10 173.10 1i7z n PRO 9 N -4.11 0.44 -4.27 2.90 -0.04 -1.26 -4.70 135.00 123.96 1i7z n PRO 9 Ca 0.05 0.20 -0.17 0.00 -0.04 0.00 0.00 63.50 63.55 1i7z n PRO 9 Cb 0.58 -2.05 -0.10 0.00 -0.04 0.00 0.00 33.50 31.88 1i7z n PRO 9 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1i7z s GLU 10 N -3.05 1.10 -0.06 0.54 0.41 0.80 -4.96 118.70 113.48 1i7z s GLU 10 Ca 0.70 -1.39 -0.01 0.00 -0.41 0.00 0.00 54.97 53.86 1i7z s GLU 10 Cb -0.35 -0.85 0.03 0.00 -1.78 0.00 0.00 34.13 31.18 1i7z s GLU 10 CO 0.53 0.14 0.01 -1.17 -0.49 0.00 0.00 175.26 174.28 1i7z s LEU 11 N -2.91 0.57 0.08 1.80 2.96 -1.26 -1.56 118.68 118.37 1i7z s LEU 11 Ca 0.15 -0.05 0.02 0.00 -0.22 0.00 0.00 54.13 54.02 1i7z s LEU 11 Cb -0.01 -0.38 -0.04 0.00 0.50 0.00 0.00 46.19 46.26 1i7z s LEU 11 CO 0.03 -0.19 -0.07 -0.54 -1.32 0.00 0.00 176.35 174.26 1i7z s LYS 12 N 1.91 0.71 0.19 1.98 -0.14 0.10 -4.99 119.74 119.51 1i7z s LYS 12 Ca 0.04 -1.13 -0.07 0.00 -1.36 0.00 0.00 55.97 53.45 1i7z s LYS 12 Cb -0.12 -0.21 -0.06 0.00 -1.68 0.00 0.00 37.83 35.76 1i7z s LYS 12 CO -0.04 -0.00 0.46 0.15 -0.76 0.00 0.00 175.35 175.16 1i7z s LYS 13 N -3.06 3.71 0.29 1.68 1.02 -1.25 -0.71 119.74 121.42 1i7z s LYS 13 Ca 0.04 0.09 -0.29 0.00 0.02 0.00 0.00 55.97 55.83 1i7z s LYS 13 Cb 0.00 -2.75 -0.13 0.00 -0.52 0.00 0.00 37.83 34.43 1i7z s LYS 13 CO -0.03 0.39 1.18 -2.30 -0.92 0.00 0.00 175.35 173.67 1i7z n PRO 14 N -0.05 1.71 0.00 -1.68 -0.02 -1.26 -1.29 135.00 132.40 1i7z n PRO 14 Ca -0.01 0.60 0.00 0.00 -2.02 0.00 0.00 63.50 62.07 1i7z n PRO 14 Cb 0.52 -2.10 0.00 0.00 -0.02 0.00 0.00 33.50 31.90 1i7z n PRO 14 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1i7z n GLY 15 N 1.29 3.31 3.95 -1.23 0.00 0.86 -4.86 105.19 108.51 1i7z n GLY 15 Ca 0.09 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.83 1i7z n GLY 15 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1i7z s GLU 16 N -0.72 0.90 0.12 1.61 2.02 -0.41 -3.75 118.70 118.48 1i7z s GLU 16 Ca 0.00 -0.67 0.10 0.00 0.02 0.00 0.00 54.97 54.42 1i7z s GLU 16 Cb 0.00 -2.00 -0.04 0.00 0.10 0.00 0.00 34.13 32.19 1i7z s GLU 16 CO 0.00 -2.15 -0.24 0.95 0.02 0.00 0.00 175.26 173.84 1i7z s THR 17 N -3.67 2.03 0.05 3.63 -4.23 -1.26 0.16 115.64 112.35 1i7z s THR 17 Ca 0.72 -1.69 0.05 0.00 -1.18 0.00 0.00 61.69 59.59 1i7z s THR 17 Cb -0.04 -1.82 -0.02 0.00 1.34 0.00 0.00 72.50 71.95 1i7z s THR 17 CO 0.50 0.01 -0.14 0.54 -0.54 0.00 0.00 174.62 174.99 1i7z s VAL 18 N -1.16 1.14 -0.17 2.29 0.11 -1.26 -5.01 120.40 116.35 1i7z s VAL 18 Ca 0.11 -1.14 -0.04 0.00 -2.93 0.00 0.00 61.98 57.98 1i7z s VAL 18 Cb -0.10 -1.06 0.06 0.00 -1.53 0.00 0.00 36.38 33.75 1i7z s VAL 18 CO 0.05 -0.08 0.08 -0.75 -3.33 0.00 0.00 175.10 171.07 1i7z s LYS 19 N -1.39 0.18 0.16 1.54 2.20 -1.26 -4.26 119.74 116.90 1i7z s LYS 19 Ca 0.00 -0.13 0.04 0.00 -0.36 0.00 0.00 55.97 55.53 1i7z s LYS 19 Cb -0.09 -1.83 -0.04 0.00 -1.51 0.00 0.00 37.83 34.37 1i7z s LYS 19 CO 0.02 -0.65 0.17 0.96 -0.36 0.00 0.00 175.35 175.49 1i7z s ILE 20 N 2.08 4.69 0.24 5.43 -4.36 -0.73 -4.93 121.20 123.61 1i7z s ILE 20 Ca 0.02 -0.97 0.11 0.00 -0.26 0.00 0.00 60.65 59.54 1i7z s ILE 20 Cb -0.16 -3.39 -0.05 0.00 1.25 0.00 0.00 42.46 40.11 1i7z s ILE 20 CO -0.09 -0.09 -0.20 -0.94 0.24 0.00 0.00 174.94 173.86 1i7z s SER 21 N -3.10 3.31 -0.07 4.36 1.04 -1.26 -1.56 113.70 116.41 1i7z s SER 21 Ca 0.32 -0.98 -0.02 0.00 0.48 0.00 0.00 55.95 55.75 1i7z s SER 21 Cb -0.10 -0.25 0.03 0.00 0.10 0.00 0.00 66.02 65.80 1i7z s SER 21 CO 0.25 0.02 0.04 0.00 0.98 0.00 0.00 173.24 174.52 1i7z s LYS 23 N 2.07 3.15 0.34 0.00 2.20 0.16 -1.06 119.74 126.59 1i7z s LYS 23 Ca 0.05 -0.46 0.01 0.00 -0.36 0.00 0.00 55.97 55.21 1i7z s LYS 23 Cb -0.13 -2.80 -0.03 0.00 -1.51 0.00 0.00 37.83 33.36 1i7z s LYS 23 CO -0.05 0.57 0.53 0.99 -0.36 0.00 0.00 175.35 177.03 1i7z s THR 24 N -0.52 5.03 0.41 3.43 2.01 -1.05 -0.31 115.64 124.64 1i7z s THR 24 Ca 0.09 -0.56 0.08 0.00 0.31 0.00 0.00 61.69 61.60 1i7z s THR 24 Cb -0.12 -3.82 -0.01 0.00 0.01 0.00 0.00 72.50 68.56 1i7z s THR 24 CO 0.02 -0.50 0.44 -0.44 -0.69 0.00 0.00 174.62 173.45 1i7z s SER 25 N -4.04 5.27 0.00 3.53 0.01 -0.72 -4.93 113.70 112.82 1i7z s SER 25 Ca 0.40 -0.62 0.00 0.00 1.31 0.00 0.00 55.95 57.04 1i7z s SER 25 Cb -0.10 -0.63 0.00 0.00 0.21 0.00 0.00 66.02 65.50 1i7z s SER 25 CO 0.35 -0.67 0.00 0.61 0.41 0.00 0.00 173.24 173.94 1i7z n GLY 26 N -1.64 -1.68 0.17 3.44 0.00 -1.26 -4.48 105.19 99.75 1i7z n GLY 26 Ca 0.05 -1.53 -0.18 0.00 0.00 0.00 0.00 46.02 44.35 1i7z n GLY 26 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1i7z h TYR 27 N 0.00 0.83 -2.34 1.61 5.03 -2.03 -3.49 116.97 116.58 1i7z h TYR 27 Ca 0.00 -0.43 -0.02 0.00 2.58 0.00 0.00 58.73 60.86 1i7z h TYR 27 Cb 0.00 -0.10 0.00 0.00 1.55 0.00 0.00 36.73 38.18 1i7z h TYR 27 CO 0.00 1.26 0.08 -1.13 -1.32 0.00 0.00 178.16 177.04 1i7z n SER 28 N -4.06 -0.71 -4.78 -2.11 3.41 -1.26 -5.04 113.62 99.08 1i7z n SER 28 Ca -0.10 -1.51 -0.30 0.00 -0.26 0.00 0.00 58.87 56.70 1i7z n SER 28 Cb 0.75 1.19 0.10 0.00 -0.26 0.00 0.00 64.21 65.99 1i7z n SER 28 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 1i7z s PHE 29 N -6.64 2.68 0.89 7.33 0.40 -1.26 -4.87 117.98 116.51 1i7z s PHE 29 Ca 0.05 1.17 -0.10 0.00 -0.60 0.00 0.00 56.93 57.46 1i7z s PHE 29 Cb -0.01 -3.14 0.19 0.00 0.51 0.00 0.00 43.02 40.56 1i7z s PHE 29 CO 0.04 -1.96 1.21 0.95 0.70 0.00 0.00 175.22 176.17 1i7z s THR 30 N -3.10 2.01 0.17 0.64 -4.23 -1.26 -4.98 115.64 104.89 1i7z s THR 30 Ca 0.62 -0.26 0.19 0.00 -1.18 0.00 0.00 61.69 61.06 1i7z s THR 30 Cb -0.15 -2.75 0.14 0.00 1.34 0.00 0.00 72.50 71.08 1i7z s THR 30 CO 0.55 0.00 1.74 0.78 -0.54 0.00 0.00 174.62 177.15 1i7z h ASN 31 N -1.26 0.00 0.40 3.99 2.35 -1.96 -3.29 115.58 115.81 1i7z h ASN 31 Ca -0.40 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.35 1i7z h ASN 31 Cb 1.24 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.61 1i7z h ASN 31 CO 0.35 0.36 -0.03 -1.22 -1.65 0.00 0.00 177.43 175.24 1i7z n TYR 32 N -3.53 0.00 -4.13 1.19 4.01 -1.26 -4.79 117.16 108.65 1i7z n TYR 32 Ca -0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.74 1i7z n TYR 32 Cb 0.50 -0.20 0.00 0.00 -0.31 0.00 0.00 39.34 39.33 1i7z n TYR 32 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1i7z n GLY 33 N 1.23 -1.54 3.21 2.72 0.00 -1.24 -4.89 105.19 104.68 1i7z n GLY 33 Ca 0.16 -1.31 -0.29 0.00 0.00 0.00 0.00 46.02 44.58 1i7z n GLY 33 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1i7z s MET 34 N 0.00 2.28 0.04 1.61 -1.94 -0.70 -4.53 119.30 116.05 1i7z s MET 34 Ca 0.00 -0.79 0.03 0.00 -1.71 0.00 0.00 55.69 53.22 1i7z s MET 34 Cb 0.00 -1.93 -0.04 0.00 2.01 0.00 0.00 34.83 34.87 1i7z s MET 34 CO 0.00 0.31 0.01 -0.80 -0.01 0.00 0.00 175.02 174.53 1i7z s ASN 35 N -0.05 5.14 -0.10 3.03 0.01 0.13 -0.77 114.94 122.34 1i7z s ASN 35 Ca -0.05 -0.06 0.04 0.00 -0.71 0.00 0.00 52.86 52.08 1i7z s ASN 35 Cb -0.13 -1.31 0.00 0.00 0.41 0.00 0.00 41.25 40.21 1i7z s ASN 35 CO 0.03 0.24 -0.23 0.26 -1.51 0.00 0.00 177.10 175.89 1i7z s TRP 36 N -1.19 2.50 -0.04 2.20 0.52 -0.97 -0.59 118.94 121.37 1i7z s TRP 36 Ca 0.23 -1.02 0.04 0.00 0.02 0.00 0.00 56.10 55.37 1i7z s TRP 36 Cb -0.12 -1.68 -0.01 0.00 -1.15 0.00 0.00 33.47 30.52 1i7z s TRP 36 CO 0.14 -0.41 -0.17 0.08 0.02 0.00 0.00 176.95 176.61 1i7z s VAL 37 N 0.35 1.39 -0.10 4.03 1.01 0.09 -0.95 120.40 126.22 1i7z s VAL 37 Ca -0.18 -0.71 -0.03 0.00 0.00 0.00 0.00 61.98 61.06 1i7z s VAL 37 Cb -0.18 -1.19 -0.03 0.00 0.00 0.00 0.00 36.38 34.98 1i7z s VAL 37 CO 0.09 0.40 0.02 -0.75 0.00 0.00 0.00 175.10 174.86 1i7z s LYS 38 N -0.05 3.11 -0.24 2.72 2.20 0.25 -0.11 119.74 127.62 1i7z s LYS 38 Ca -0.02 -0.37 -0.04 0.00 -0.36 0.00 0.00 55.97 55.19 1i7z s LYS 38 Cb -0.10 -2.87 0.09 0.00 -1.51 0.00 0.00 37.83 33.44 1i7z s LYS 38 CO 0.01 0.69 0.16 -1.14 -0.36 0.00 0.00 175.35 174.71 1i7z s GLN 39 N -0.82 0.17 0.54 4.03 0.74 -0.61 -0.79 119.66 122.91 1i7z s GLN 39 Ca 0.13 -0.19 -0.18 0.00 0.05 0.00 0.00 55.36 55.17 1i7z s GLN 39 Cb -0.12 -1.30 -0.06 0.00 1.10 0.00 0.00 33.01 32.64 1i7z s GLN 39 CO 0.02 -0.84 1.03 0.00 -0.55 0.00 0.00 175.29 174.96 1i7z s ALA 40 N 2.20 2.85 -0.17 1.58 0.00 -1.26 -1.29 121.76 125.67 1i7z s ALA 40 Ca 0.07 0.42 -0.40 0.00 0.00 0.00 0.00 51.96 52.05 1i7z s ALA 40 Cb -0.16 -3.21 -0.17 0.00 0.00 0.00 0.00 23.12 19.58 1i7z s ALA 40 CO -0.23 -0.51 1.57 -2.30 0.00 0.00 0.00 175.76 174.29 1i7z n PRO 41 N -1.55 0.99 -0.84 0.00 -0.02 -1.26 -0.14 135.00 132.18 1i7z n PRO 41 Ca 0.08 0.36 0.00 0.00 -2.02 0.00 0.00 63.50 61.93 1i7z n PRO 41 Cb 0.53 -2.01 0.00 0.00 -0.02 0.00 0.00 33.50 32.00 1i7z n PRO 41 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1i7z n GLY 42 N 3.51 0.38 2.58 -1.23 0.00 -1.26 -4.99 105.19 104.17 1i7z n GLY 42 Ca 0.24 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.12 1i7z n GLY 42 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1i7z n LYS 43 N -1.56 0.79 -2.64 1.61 4.76 0.81 -5.13 118.16 116.80 1i7z n LYS 43 Ca 0.00 -2.12 -0.22 0.00 -2.87 0.00 0.00 58.31 53.10 1i7z n LYS 43 Cb 0.11 -0.06 0.07 0.00 -1.84 0.00 0.00 35.03 33.30 1i7z n LYS 43 CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 1i7z s GLY 44 N -3.64 1.79 0.20 0.72 0.00 -1.26 -4.70 107.32 100.42 1i7z s GLY 44 Ca 0.36 -1.55 -0.30 0.00 0.00 0.00 0.00 44.72 43.23 1i7z s GLY 44 CO 0.23 -1.13 1.14 1.08 0.00 0.00 0.00 173.10 174.42 1i7z s LEU 45 N -4.93 4.48 -0.18 0.66 1.43 -1.26 -4.45 118.68 114.44 1i7z s LEU 45 Ca 0.62 2.18 -0.01 0.00 -1.03 0.00 0.00 54.13 55.88 1i7z s LEU 45 Cb -0.08 -3.61 0.05 0.00 0.03 0.00 0.00 46.19 42.58 1i7z s LEU 45 CO 0.41 -0.27 -0.02 -0.75 0.23 0.00 0.00 176.35 175.95 1i7z s LYS 46 N -0.50 1.12 0.14 1.70 2.36 0.02 -4.98 119.74 119.61 1i7z s LYS 46 Ca 0.50 -0.49 -0.31 0.00 -2.55 0.00 0.00 55.97 53.11 1i7z s LYS 46 Cb -0.31 -2.02 -0.09 0.00 -1.05 0.00 0.00 37.83 34.36 1i7z s LYS 46 CO 0.37 -0.51 1.48 -0.46 1.55 0.00 0.00 175.35 177.78 1i7z s TRP 47 N 1.71 3.13 -0.14 4.03 -0.00 -1.26 -0.59 118.94 125.81 1i7z s TRP 47 Ca -0.00 0.78 0.16 0.00 -0.00 0.00 0.00 56.10 57.04 1i7z s TRP 47 Cb -0.16 -3.81 -0.24 0.00 -0.00 0.00 0.00 33.47 29.26 1i7z s TRP 47 CO -0.07 -2.93 0.29 -1.33 -0.00 0.00 0.00 176.95 172.90 1i7z n MET 48 N 4.02 0.67 -1.68 5.86 2.81 -0.12 -4.78 117.12 123.89 1i7z n MET 48 Ca 0.13 0.09 0.00 0.00 -1.81 0.00 0.00 57.70 56.11 1i7z n MET 48 Cb 0.40 -1.61 0.00 0.00 -0.71 0.00 0.00 33.22 31.30 1i7z n MET 48 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1i7z n GLY 49 N 1.67 0.07 3.36 3.03 0.00 -1.24 -0.96 105.19 111.12 1i7z n GLY 49 Ca -0.27 -1.61 -0.10 0.00 0.00 0.00 0.00 46.02 44.04 1i7z n GLY 49 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 1i7z s TRP 50 N -2.53 -0.18 -0.07 1.61 -2.14 -0.15 -2.30 118.94 113.17 1i7z s TRP 50 Ca 0.00 -0.14 0.04 0.00 2.66 0.00 0.00 56.10 58.66 1i7z s TRP 50 Cb 0.00 0.29 0.00 0.00 -3.10 0.00 0.00 33.47 30.66 1i7z s TRP 50 CO 0.00 -0.76 -0.18 -1.50 -2.66 0.00 0.00 176.95 171.85 1i7z s ILE 51 N -3.82 1.56 -0.06 0.66 2.07 0.05 -0.25 121.20 121.41 1i7z s ILE 51 Ca 0.05 -0.75 -0.28 0.00 -1.41 0.00 0.00 60.65 58.25 1i7z s ILE 51 Cb 0.01 -1.36 -0.02 0.00 0.13 0.00 0.00 42.46 41.22 1i7z s ILE 51 CO -0.10 0.45 0.92 0.21 -1.91 0.00 0.00 174.94 174.51 1i7z s ASN 52 N 0.30 7.22 0.30 4.50 3.04 -0.38 -1.72 114.94 128.19 1i7z s ASN 52 Ca -0.11 1.48 0.18 0.00 0.04 0.00 0.00 52.86 54.44 1i7z s ASN 52 Cb -0.15 -2.52 0.12 0.00 -1.54 0.00 0.00 41.25 37.15 1i7z s ASN 52 CO 0.05 -0.31 1.42 0.71 -3.04 0.00 0.00 177.10 175.93 1i7z h THR 52 N 4.93 0.57 0.24 -5.21 1.35 -1.89 0.49 112.91 113.39 1i7z h THR 52 Ca -0.37 -1.83 -0.01 0.00 -0.55 0.00 0.00 66.41 63.65 1i7z h THR 52 Cb 1.18 2.24 0.00 0.00 -1.73 0.00 0.00 68.15 69.85 1i7z h THR 52 CO 0.79 0.32 -0.11 1.88 -0.25 0.00 0.00 175.52 178.15 1i7z h TYR 53 N 0.00 -0.29 0.00 4.73 0.99 -1.91 -3.35 116.97 117.14 1i7z h TYR 53 Ca -0.02 -0.01 -0.02 0.00 2.00 0.00 0.00 58.73 60.68 1i7z h TYR 53 Cb 1.28 0.10 -0.00 0.00 1.00 0.00 0.00 36.73 39.11 1i7z h TYR 53 CO 0.00 -0.18 -0.76 1.79 -0.00 0.00 0.00 178.16 179.00 1i7z h THR 54 N -0.40 0.10 0.00 -2.88 1.35 -2.00 -3.47 112.91 105.60 1i7z h THR 54 Ca -0.03 -1.17 0.00 0.00 -0.55 0.00 0.00 66.41 64.66 1i7z h THR 54 Cb 0.24 1.73 0.00 0.00 -1.73 0.00 0.00 68.15 68.39 1i7z h THR 54 CO 0.05 0.06 0.00 0.61 -0.25 0.00 0.00 175.52 175.99 1i7z n GLY 55 N 1.18 0.83 3.68 5.82 0.00 0.17 -5.00 105.19 111.88 1i7z n GLY 55 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1i7z n GLY 55 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1i7z s GLU 56 N -0.06 4.35 0.22 1.61 2.12 -1.21 -4.65 118.70 121.09 1i7z s GLU 56 Ca 0.00 1.60 -0.10 0.00 0.36 0.00 0.00 54.97 56.83 1i7z s GLU 56 Cb 0.00 -3.58 -0.07 0.00 0.26 0.00 0.00 34.13 30.74 1i7z s GLU 56 CO 0.00 -0.45 0.55 -1.25 -0.54 0.00 0.00 175.26 173.57 1i7z s PRO 57 N 2.32 3.82 -0.08 4.30 0.04 -1.26 -1.25 135.00 142.88 1i7z s PRO 57 Ca 0.54 0.29 0.01 0.00 0.04 0.00 0.00 61.00 61.88 1i7z s PRO 57 Cb -0.23 -2.67 0.02 0.00 0.04 0.00 0.00 34.50 31.66 1i7z s PRO 57 CO 0.20 0.33 -0.09 0.99 0.04 0.00 0.00 177.00 178.47 1i7z s THR 58 N -1.79 0.97 -0.14 1.26 2.01 0.65 -4.99 115.64 113.61 1i7z s THR 58 Ca 0.47 -0.33 -0.05 0.00 0.31 0.00 0.00 61.69 62.09 1i7z s THR 58 Cb -0.11 -0.95 -0.03 0.00 0.01 0.00 0.00 72.50 71.41 1i7z s THR 58 CO 0.21 0.34 0.02 -0.31 -0.69 0.00 0.00 174.62 174.18 1i7z s TYR 59 N 1.15 3.17 0.77 4.92 1.51 -1.26 -0.98 117.35 126.63 1i7z s TYR 59 Ca -0.06 0.03 -0.14 0.00 -1.01 0.00 0.00 57.07 55.89 1i7z s TYR 59 Cb -0.14 -1.94 0.06 0.00 -0.11 0.00 0.00 41.96 39.82 1i7z s TYR 59 CO -0.02 0.23 1.19 0.00 -1.11 0.00 0.00 175.55 175.84 1i7z s ALA 60 N -0.10 2.00 0.32 3.71 0.00 -0.14 -4.87 121.76 122.68 1i7z s ALA 60 Ca 0.05 0.80 0.09 0.00 0.00 0.00 0.00 51.96 52.90 1i7z s ALA 60 Cb -0.12 -3.46 0.91 0.00 0.00 0.00 0.00 23.12 20.45 1i7z s ALA 60 CO 0.02 -2.04 1.68 -0.44 0.00 0.00 0.00 175.76 174.97 1i7z h ASP 61 N -0.63 0.41 -0.08 0.00 3.32 -1.93 -0.80 116.42 116.71 1i7z h ASP 61 Ca -0.47 0.18 0.00 0.00 0.02 0.00 0.00 57.03 56.76 1i7z h ASP 61 Cb 1.29 0.14 0.00 0.00 0.22 0.00 0.00 39.33 40.98 1i7z h ASP 61 CO 0.48 -0.07 0.00 0.47 -1.72 0.00 0.00 179.24 178.40 1i7z n ASP 62 N -5.05 0.43 -2.71 6.45 8.00 -1.26 -3.93 116.55 118.48 1i7z n ASP 62 Ca 0.27 -2.00 -0.04 0.00 0.71 0.00 0.00 54.79 53.73 1i7z n ASP 62 Cb 0.82 -0.06 0.04 0.00 -0.02 0.00 0.00 41.12 41.91 1i7z n ASP 62 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 1i7z n PHE 63 N -0.27 1.48 -4.11 1.24 3.01 -0.31 -5.06 117.46 113.45 1i7z n PHE 63 Ca 0.03 -2.20 -0.35 0.00 1.01 0.00 0.00 57.45 55.94 1i7z n PHE 63 Cb 0.07 -0.25 -0.10 0.00 -0.01 0.00 0.00 39.48 39.19 1i7z n PHE 63 CO 0.00 0.00 0.00 1.03 1.01 0.00 0.00 176.76 178.80 1i7z s ARG 64 N -3.74 3.71 0.00 -1.08 0.52 -1.25 -4.33 118.95 112.78 1i7z s ARG 64 Ca 0.31 -0.35 0.00 0.00 -0.52 0.00 0.00 55.73 55.16 1i7z s ARG 64 Cb 0.34 -3.10 0.00 0.00 0.52 0.00 0.00 34.95 32.71 1i7z s ARG 64 CO -0.03 0.40 0.00 0.41 0.02 0.00 0.00 175.30 176.10 1i7z n GLY 65 N 3.12 2.51 0.18 -3.53 0.00 -1.26 -4.81 105.19 101.40 1i7z n GLY 65 Ca -0.17 -0.77 0.11 0.00 0.00 0.00 0.00 46.02 45.19 1i7z n GLY 65 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1i7z n ARG 66 N 0.00 0.50 -4.31 1.61 1.74 -1.26 -4.96 116.66 109.98 1i7z n ARG 66 Ca 0.00 -0.37 -0.32 0.00 -0.77 0.00 0.00 57.85 56.39 1i7z n ARG 66 Cb 0.00 -1.49 -0.09 0.00 -1.02 0.00 0.00 32.46 29.86 1i7z n ARG 66 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 1i7z s PHE 67 N -2.76 2.96 -0.05 -1.55 0.40 -1.26 -1.10 117.98 114.62 1i7z s PHE 67 Ca 0.15 -0.01 -0.02 0.00 -0.60 0.00 0.00 56.93 56.45 1i7z s PHE 67 Cb 0.18 -1.60 0.04 0.00 0.51 0.00 0.00 43.02 42.14 1i7z s PHE 67 CO 0.68 0.43 0.10 0.00 0.70 0.00 0.00 175.22 177.14 1i7z s ALA 68 N -1.12 -0.10 -0.17 5.36 0.00 0.33 -4.95 121.76 121.12 1i7z s ALA 68 Ca 0.20 0.51 -0.07 0.00 0.00 0.00 0.00 51.96 52.60 1i7z s ALA 68 Cb -0.11 -0.44 -0.04 0.00 0.00 0.00 0.00 23.12 22.53 1i7z s ALA 68 CO 0.11 -0.21 0.09 -0.06 0.00 0.00 0.00 175.76 175.69 1i7z s PHE 69 N 1.33 3.34 0.16 0.00 0.08 -1.26 -0.77 117.98 120.87 1i7z s PHE 69 Ca -0.07 0.23 -0.03 0.00 0.12 0.00 0.00 56.93 57.18 1i7z s PHE 69 Cb -0.12 -2.05 -0.03 0.00 -0.57 0.00 0.00 43.02 40.25 1i7z s PHE 69 CO -0.05 0.32 0.14 -1.54 -0.10 0.00 0.00 175.22 173.99 1i7z s SER 70 N 0.02 0.19 0.01 1.36 1.04 -0.65 -4.79 113.70 110.88 1i7z s SER 70 Ca 0.07 -1.18 0.01 0.00 0.48 0.00 0.00 55.95 55.33 1i7z s SER 70 Cb -0.12 0.36 -0.01 0.00 0.10 0.00 0.00 66.02 66.35 1i7z s SER 70 CO 0.00 -0.81 -0.03 -0.76 0.98 0.00 0.00 173.24 172.62 1i7z s LEU 71 N -3.06 2.12 -0.40 2.42 1.43 -1.26 -0.41 118.68 119.53 1i7z s LEU 71 Ca 0.27 -0.27 0.03 0.00 -1.03 0.00 0.00 54.13 53.13 1i7z s LEU 71 Cb 0.06 -0.05 0.11 0.00 0.03 0.00 0.00 46.19 46.34 1i7z s LEU 71 CO 0.05 -0.12 0.12 0.00 0.23 0.00 0.00 176.35 176.63 1i7z s ALA 72 N -0.72 3.03 0.10 4.21 0.00 0.34 -4.99 121.76 123.73 1i7z s ALA 72 Ca -0.06 -2.75 -0.20 0.00 0.00 0.00 0.00 51.96 48.95 1i7z s ALA 72 Cb -0.05 -2.06 -0.09 0.00 0.00 0.00 0.00 23.12 20.92 1i7z s ALA 72 CO -0.00 -1.79 1.69 1.15 0.00 0.00 0.00 175.76 176.81 1i7z h THR 73 N 6.28 1.11 -1.01 0.00 2.02 -1.97 -1.05 112.91 118.29 1i7z h THR 73 Ca -0.05 -0.30 0.27 0.00 0.77 0.00 0.00 66.41 67.09 1i7z h THR 73 Cb 0.99 0.98 -0.07 0.00 -1.74 0.00 0.00 68.15 68.31 1i7z h THR 73 CO 0.58 0.10 0.69 0.77 0.37 0.00 0.00 175.52 178.03 1i7z h SER 74 N 0.18 0.24 -0.23 4.18 4.64 -1.96 0.49 113.55 121.10 1i7z h SER 74 Ca 0.06 0.04 0.00 0.00 -0.47 0.00 0.00 61.79 61.42 1i7z h SER 74 Cb 0.08 -0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.17 1i7z h SER 74 CO -0.01 0.06 0.00 0.00 -0.87 0.00 0.00 176.83 176.01 1i7z n ALA 75 N -2.60 2.41 -3.54 5.18 0.00 -0.98 -4.99 120.51 115.99 1i7z n ALA 75 Ca 0.23 -0.86 -0.25 0.00 0.00 0.00 0.00 53.44 52.56 1i7z n ALA 75 Cb 0.94 -0.70 0.04 0.00 0.00 0.00 0.00 19.45 19.73 1i7z n ALA 75 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1i7z n SER 76 N 1.17 -5.83 -3.76 0.00 7.64 0.16 -4.84 113.62 108.17 1i7z n SER 76 Ca 0.15 -0.86 -0.13 0.00 1.01 0.00 0.00 58.87 59.04 1i7z n SER 76 Cb 0.52 -3.83 -0.11 0.00 -1.01 0.00 0.00 64.21 59.78 1i7z n SER 76 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1i7z s THR 77 N -3.37 0.00 0.10 0.44 2.01 -0.82 -2.54 115.64 111.45 1i7z s THR 77 Ca 0.40 -0.04 0.05 0.00 0.31 0.00 0.00 61.69 62.41 1i7z s THR 77 Cb -0.12 -0.48 -0.04 0.00 0.01 0.00 0.00 72.50 71.87 1i7z s THR 77 CO 0.83 -0.02 -0.01 0.00 -0.69 0.00 0.00 174.62 174.73 1i7z s ALA 78 N 0.06 3.26 0.03 7.40 0.00 -0.23 -0.51 121.76 131.77 1i7z s ALA 78 Ca -0.01 -1.14 0.05 0.00 0.00 0.00 0.00 51.96 50.85 1i7z s ALA 78 Cb -0.03 -1.15 -0.02 0.00 0.00 0.00 0.00 23.12 21.92 1i7z s ALA 78 CO 0.01 0.68 -0.14 0.71 0.00 0.00 0.00 175.76 177.02 1i7z s TYR 79 N -1.33 1.21 -0.25 0.00 2.02 0.45 -1.01 117.35 118.43 1i7z s TYR 79 Ca 0.25 -0.33 0.03 0.00 -0.37 0.00 0.00 57.07 56.66 1i7z s TYR 79 Cb -0.11 -0.73 0.06 0.00 -0.40 0.00 0.00 41.96 40.77 1i7z s TYR 79 CO 0.18 0.02 -0.12 -1.17 -1.57 0.00 0.00 175.55 172.90 1i7z s LEU 80 N -0.97 3.36 0.00 -1.29 0.20 -0.60 -1.64 118.68 117.74 1i7z s LEU 80 Ca 0.02 -1.35 0.03 0.00 0.69 0.00 0.00 54.13 53.52 1i7z s LEU 80 Cb -0.07 -1.54 0.03 0.00 -0.43 0.00 0.00 46.19 44.17 1i7z s LEU 80 CO 0.01 -0.18 0.25 1.67 -0.29 0.00 0.00 176.35 177.81 1i7z n GLN 81 N 4.44 1.02 -3.87 1.98 7.27 0.05 -1.77 117.38 126.50 1i7z n GLN 81 Ca -0.14 -1.68 -0.07 0.00 0.07 0.00 0.00 57.00 55.18 1i7z n GLN 81 Cb 0.43 0.12 -0.02 0.00 2.41 0.00 0.00 30.24 33.17 1i7z n GLN 81 CO 0.00 0.00 0.00 0.96 0.07 0.00 0.00 177.06 178.09 1i7z s ILE 82 N -1.23 0.00 -0.98 1.69 -4.36 -0.26 -0.51 121.20 115.55 1i7z s ILE 82 Ca 0.19 -1.04 -0.22 0.00 -0.26 0.00 0.00 60.65 59.32 1i7z s ILE 82 Cb -0.01 -2.02 0.03 0.00 1.25 0.00 0.00 42.46 41.71 1i7z s ILE 82 CO 0.12 -0.00 0.59 -3.20 0.24 0.00 0.00 174.94 172.69 1i7z n ASN 82 N -0.45 -3.88 -4.72 4.36 4.05 -1.06 -4.78 115.26 108.78 1i7z n ASN 82 Ca -0.04 -1.09 -0.42 0.00 0.45 0.00 0.00 54.58 53.48 1i7z n ASN 82 Cb 0.59 -1.42 -0.00 0.00 1.23 0.00 0.00 39.78 40.18 1i7z n ASN 82 CO 0.00 0.00 0.00 0.18 -3.05 0.00 0.00 177.26 174.39 1i7z n LEU 82 N -3.95 3.95 -4.38 1.20 4.77 0.12 -4.50 117.00 114.21 1i7z n LEU 82 Ca -0.16 1.20 -0.22 0.00 -0.03 0.00 0.00 56.01 56.79 1i7z n LEU 82 Cb 0.54 -1.52 -0.11 0.00 -2.33 0.00 0.00 43.42 40.00 1i7z n LEU 82 CO 0.64 -0.33 -0.48 -0.54 -1.33 0.00 0.00 177.39 175.35 1i7z s LYS 83 N -1.99 1.43 0.41 3.23 1.02 -1.26 -0.10 119.74 122.47 1i7z s LYS 83 Ca 0.56 -1.56 0.16 0.00 0.02 0.00 0.00 55.97 55.15 1i7z s LYS 83 Cb -0.54 -1.48 1.03 0.00 -0.52 0.00 0.00 37.83 36.32 1i7z s LYS 83 CO 0.62 0.29 1.86 -0.91 -0.92 0.00 0.00 175.35 176.29 1i7z h ASN 84 N 2.86 0.45 0.15 2.83 2.35 -1.96 0.37 115.58 122.62 1i7z h ASN 84 Ca -0.41 0.04 -0.00 0.00 -0.55 0.00 0.00 56.30 55.38 1i7z h ASN 84 Cb 1.22 -0.04 -0.00 0.00 0.05 0.00 0.00 38.32 39.55 1i7z h ASN 84 CO 0.55 0.19 -0.01 -0.33 -1.65 0.00 0.00 177.43 176.18 1i7z h GLU 85 N 0.46 0.00 0.00 0.81 3.07 -1.96 -1.21 114.58 115.76 1i7z h GLU 85 Ca 0.46 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.32 1i7z h GLU 85 Cb 1.07 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.98 1i7z h GLU 85 CO -0.19 0.01 0.00 -0.25 -1.40 0.00 0.00 179.01 177.19 1i7z n ASP 86 N -3.33 0.00 -4.60 1.42 8.00 0.12 -4.73 116.55 113.43 1i7z n ASP 86 Ca -0.02 -0.76 -0.43 0.00 0.71 0.00 0.00 54.79 54.28 1i7z n ASP 86 Cb 0.12 -0.04 -0.02 0.00 -0.02 0.00 0.00 41.12 41.15 1i7z n ASP 86 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1i7z s THR 87 N -2.09 3.64 -0.01 -3.53 2.01 -0.46 -4.85 115.64 110.35 1i7z s THR 87 Ca 0.40 0.65 -0.25 0.00 0.31 0.00 0.00 61.69 62.80 1i7z s THR 87 Cb 0.19 -3.84 0.08 0.00 0.01 0.00 0.00 72.50 68.94 1i7z s THR 87 CO 0.34 -0.53 1.14 0.00 -0.69 0.00 0.00 174.62 174.88 1i7z n ALA 88 N 9.65 -3.20 -2.80 7.40 0.00 -0.68 -4.44 120.51 126.44 1i7z n ALA 88 Ca 0.20 -0.74 -0.36 0.00 0.00 0.00 0.00 53.44 52.55 1i7z n ALA 88 Cb 0.47 0.16 -0.07 0.00 0.00 0.00 0.00 19.45 20.01 1i7z n ALA 88 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1i7z s THR 89 N -2.03 5.44 -0.26 0.00 2.01 -0.41 -1.31 115.64 119.08 1i7z s THR 89 Ca 0.27 0.23 -0.04 0.00 0.31 0.00 0.00 61.69 62.45 1i7z s THR 89 Cb -0.01 -3.45 0.01 0.00 0.01 0.00 0.00 72.50 69.06 1i7z s THR 89 CO -0.00 0.53 0.00 -0.31 -0.69 0.00 0.00 174.62 174.15 1i7z s TYR 90 N -0.34 3.07 0.06 4.92 2.02 -0.51 -1.57 117.35 125.00 1i7z s TYR 90 Ca 0.12 -1.11 -0.07 0.00 -0.37 0.00 0.00 57.07 55.65 1i7z s TYR 90 Cb -0.12 -2.15 -0.05 0.00 -0.40 0.00 0.00 41.96 39.24 1i7z s TYR 90 CO 0.02 -0.60 0.32 -0.06 -1.57 0.00 0.00 175.55 173.66 1i7z s PHE 91 N 1.45 3.55 -0.06 2.71 0.40 0.84 -1.42 117.98 125.45 1i7z s PHE 91 Ca 0.03 0.60 0.02 0.00 -0.60 0.00 0.00 56.93 56.98 1i7z s PHE 91 Cb -0.16 -2.02 -0.03 0.00 0.51 0.00 0.00 43.02 41.32 1i7z s PHE 91 CO -0.01 0.55 -0.10 0.00 0.70 0.00 0.00 175.22 176.35 1i7z s GLU 93 N -0.76 0.71 0.25 0.00 -6.30 0.24 -0.76 118.70 112.08 1i7z s GLU 93 Ca 0.12 -0.52 -0.21 0.00 -2.50 0.00 0.00 54.97 51.85 1i7z s GLU 93 Cb -0.11 0.30 0.03 0.00 0.00 0.00 0.00 34.13 34.35 1i7z s GLU 93 CO 0.01 -0.21 0.68 -0.08 0.02 0.00 0.00 175.26 175.68 1i7z s THR 94 N -2.32 0.00 0.10 -1.70 -1.32 -0.57 0.17 115.64 110.00 1i7z s THR 94 Ca -0.07 -0.82 -0.19 0.00 -1.21 0.00 0.00 61.69 59.40 1i7z s THR 94 Cb -0.02 -1.81 0.05 0.00 -1.51 0.00 0.00 72.50 69.21 1i7z s THR 94 CO -0.02 -0.00 0.47 -0.72 -2.21 0.00 0.00 174.62 172.14 1i7z s TYR 95 N -3.89 -0.34 0.00 9.09 -0.85 -1.26 -0.53 117.35 119.57 1i7z s TYR 95 Ca 0.09 0.17 0.00 0.00 -0.52 0.00 0.00 57.07 56.82 1i7z s TYR 95 Cb -0.05 0.34 0.00 0.00 0.38 0.00 0.00 41.96 42.63 1i7z s TYR 95 CO 0.03 -0.70 0.67 -0.40 -1.52 0.00 0.00 175.55 173.63 1i7z n ASP 96 N 0.00 1.28 0.00 -0.18 5.68 -0.70 -4.38 116.55 118.26 1i7z n ASP 96 Ca -0.17 -1.42 0.00 0.00 -0.50 0.00 0.00 54.79 52.70 1i7z n ASP 96 Cb 0.63 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.61 1i7z n ASP 96 CO 0.00 0.00 0.00 -1.54 -1.33 0.00 0.00 177.20 174.33 1i7z n SER 97 N -0.21 0.00 0.26 -1.12 3.41 -1.25 -4.91 113.62 109.80 1i7z n SER 97 Ca 0.00 0.00 0.10 0.00 -0.26 0.00 0.00 58.87 58.71 1i7z n SER 97 Cb 0.15 0.00 0.69 0.00 -0.26 0.00 0.00 64.21 64.80 1i7z n SER 97 CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 175.04 174.23 1i7z h PRO 98 N 0.00 0.00 -0.02 4.33 0.11 -2.04 -2.32 132.00 132.06 1i7z h PRO 98 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 1i7z h PRO 98 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.11 1i7z h PRO 98 CO 0.00 0.04 -0.07 1.28 -0.21 0.00 0.00 178.00 179.04 1i7z n LEU 99 N -4.27 2.59 -3.92 2.35 4.77 -1.26 -4.72 117.00 112.54 1i7z n LEU 99 Ca -0.03 -0.96 -0.29 0.00 -0.03 0.00 0.00 56.01 54.70 1i7z n LEU 99 Cb 0.12 0.00 -0.11 0.00 -2.33 0.00 0.00 43.42 41.10 1i7z n LEU 99 CO 0.33 0.45 0.03 0.61 -1.33 0.00 0.00 177.39 177.48 1i7z n GLY 100 N 1.20 4.07 3.50 -0.72 0.00 -0.87 -5.05 105.19 107.32 1i7z n GLY 100 Ca 0.12 -2.60 -0.36 0.00 0.00 0.00 0.00 46.02 43.18 1i7z n GLY 100 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1i7z s ASP 101 N -1.31 5.23 -0.13 1.61 3.68 -1.26 -1.71 116.67 122.78 1i7z s ASP 101 Ca 0.26 -0.12 0.02 0.00 2.13 0.00 0.00 52.55 54.84 1i7z s ASP 101 Cb -0.04 -1.92 0.01 0.00 -1.45 0.00 0.00 42.92 39.53 1i7z s ASP 101 CO -0.16 0.05 -0.18 -0.31 0.13 0.00 0.00 175.17 174.69 1i7z s TYR 102 N 1.12 2.33 -0.02 -5.34 1.51 0.31 -5.02 117.35 112.24 1i7z s TYR 102 Ca 0.04 -1.15 0.08 0.00 -1.01 0.00 0.00 57.07 55.02 1i7z s TYR 102 Cb -0.14 -1.63 -0.02 0.00 -0.11 0.00 0.00 41.96 40.06 1i7z s TYR 102 CO 0.03 -0.56 -0.25 -1.58 -1.11 0.00 0.00 175.55 172.08 1i7z s TRP 103 N 0.94 2.31 0.81 2.71 0.52 -1.26 -1.51 118.94 123.44 1i7z s TRP 103 Ca -0.06 -0.47 -0.11 0.00 0.02 0.00 0.00 56.10 55.48 1i7z s TRP 103 Cb -0.15 -1.49 0.08 0.00 -1.15 0.00 0.00 33.47 30.76 1i7z s TRP 103 CO -0.02 -0.06 1.09 0.20 0.02 0.00 0.00 176.95 178.17 1i7z s GLY 104 N -0.54 1.63 0.01 0.98 0.00 0.06 -4.65 107.32 104.81 1i7z s GLY 104 Ca 0.08 -0.07 0.18 0.00 0.00 0.00 0.00 44.72 44.91 1i7z s GLY 104 CO -0.00 0.35 1.58 -1.06 0.00 0.00 0.00 173.10 173.97 1i7z n GLN 105 N -3.53 0.01 0.00 2.90 6.02 -1.26 -4.66 117.38 116.86 1i7z n GLN 105 Ca 0.07 0.20 0.00 0.00 -0.01 0.00 0.00 57.00 57.26 1i7z n GLN 105 Cb 0.55 -1.52 0.00 0.00 1.02 0.00 0.00 30.24 30.30 1i7z n GLN 105 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1i7z n GLY 106 N 0.36 0.74 3.24 1.08 0.00 -1.26 -5.01 105.19 104.35 1i7z n GLY 106 Ca 0.04 -1.45 -0.35 0.00 0.00 0.00 0.00 46.02 44.26 1i7z n GLY 106 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1i7z s THR 107 N -1.18 3.22 0.02 2.61 2.01 -0.51 -4.89 115.64 116.92 1i7z s THR 107 Ca 0.00 -0.94 -0.30 0.00 0.31 0.00 0.00 61.69 60.76 1i7z s THR 107 Cb 0.00 -2.65 -0.06 0.00 0.01 0.00 0.00 72.50 69.80 1i7z s THR 107 CO 0.00 0.15 1.44 -0.89 -0.69 0.00 0.00 174.62 174.63 1i7z s THR 108 N 1.38 3.58 -0.11 -0.82 2.01 -1.26 -1.42 115.64 118.99 1i7z s THR 108 Ca 0.01 0.99 0.01 0.00 0.31 0.00 0.00 61.69 63.00 1i7z s THR 108 Cb -0.17 -3.63 0.02 0.00 0.01 0.00 0.00 72.50 68.73 1i7z s THR 108 CO -0.02 0.00 -0.11 -0.69 -0.69 0.00 0.00 174.62 173.11 1i7z s VAL 109 N 2.37 1.26 -0.11 3.82 1.01 -0.43 -0.14 120.40 128.18 1i7z s VAL 109 Ca 0.65 -0.47 0.02 0.00 0.00 0.00 0.00 61.98 62.19 1i7z s VAL 109 Cb -0.33 -1.20 -0.01 0.00 0.00 0.00 0.00 36.38 34.83 1i7z s VAL 109 CO 0.28 0.40 -0.16 -0.89 0.00 0.00 0.00 175.10 174.72 1i7z s THR 110 N 1.35 2.76 -0.28 3.92 2.01 -0.60 -1.69 115.64 123.12 1i7z s THR 110 Ca -0.00 -0.78 -0.04 0.00 0.31 0.00 0.00 61.69 61.18 1i7z s THR 110 Cb -0.14 -2.12 0.02 0.00 0.01 0.00 0.00 72.50 70.27 1i7z s THR 110 CO -0.06 0.54 0.02 -0.69 -0.69 0.00 0.00 174.62 173.74 1i7z s VAL 111 N 0.18 3.44 0.14 3.82 1.01 -1.26 -0.72 120.40 127.02 1i7z s VAL 111 Ca -0.10 -0.88 -0.25 0.00 0.00 0.00 0.00 61.98 60.76 1i7z s VAL 111 Cb -0.16 -2.78 0.06 0.00 0.00 0.00 0.00 36.38 33.51 1i7z s VAL 111 CO 0.06 0.12 0.84 -0.55 0.00 0.00 0.00 175.10 175.57 1i7z s SER 112 N 1.41 -0.30 0.08 3.32 0.15 0.11 -4.73 113.70 113.75 1i7z s SER 112 Ca 0.01 -0.29 0.23 0.00 0.70 0.00 0.00 55.95 56.59 1i7z s SER 112 Cb -0.17 0.53 -0.06 0.00 -1.71 0.00 0.00 66.02 64.61 1i7z s SER 112 CO -0.01 -0.94 0.90 -1.54 1.20 0.00 0.00 173.24 172.86 1i7z n SER 113 N -0.40 0.55 -4.73 5.45 3.41 -1.26 -3.77 113.62 112.86 1i7z n SER 113 Ca -0.08 0.01 -0.40 0.00 -0.26 0.00 0.00 58.87 58.15 1i7z n SER 113 Cb 0.61 0.97 0.03 0.00 -0.26 0.00 0.00 64.21 65.55 1i7z n SER 113 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1i7z n ALA 114 N -2.04 1.59 -2.32 7.33 0.00 -1.26 -4.99 120.51 118.81 1i7z n ALA 114 Ca -0.00 0.21 -0.30 0.00 0.00 0.00 0.00 53.44 53.34 1i7z n ALA 114 Cb 0.50 -2.33 -0.04 0.00 0.00 0.00 0.00 19.45 17.59 1i7z n ALA 114 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1i7z s SER 115 N -0.66 6.54 0.29 0.00 0.01 -1.26 -5.01 113.70 113.61 1i7z s SER 115 Ca 0.65 0.99 -0.29 0.00 1.31 0.00 0.00 55.95 58.60 1i7z s SER 115 Cb -0.46 -2.26 -0.10 0.00 0.21 0.00 0.00 66.02 63.41 1i7z s SER 115 CO 0.55 -0.27 1.38 -0.89 0.41 0.00 0.00 173.24 174.41 1i7z s THR 116 N -2.17 2.67 -0.19 1.44 2.01 -1.26 -4.76 115.64 113.38 1i7z s THR 116 Ca 0.49 0.62 -0.08 0.00 0.31 0.00 0.00 61.69 63.02 1i7z s THR 116 Cb -0.11 -3.39 0.08 0.00 0.01 0.00 0.00 72.50 69.09 1i7z s THR 116 CO 0.28 0.12 0.43 -0.75 -0.69 0.00 0.00 174.62 174.01 1i7z s LYS 117 N -1.08 0.37 0.73 4.92 2.20 0.21 -4.95 119.74 122.14 1i7z s LYS 117 Ca 0.54 0.95 -0.14 0.00 -0.36 0.00 0.00 55.97 56.96 1i7z s LYS 117 Cb -0.41 0.18 0.04 0.00 -1.51 0.00 0.00 37.83 36.13 1i7z s LYS 117 CO 0.48 -0.21 1.16 0.20 -0.36 0.00 0.00 175.35 176.62 1i7z s GLY 118 N 2.07 2.14 0.67 5.54 0.00 -1.26 -1.47 107.32 115.01 1i7z s GLY 118 Ca -0.05 0.67 -0.04 0.00 0.00 0.00 0.00 44.72 45.30 1i7z s GLY 118 CO -0.13 1.06 0.96 2.56 0.00 0.00 0.00 173.10 177.54 1i7z s PRO 119 N -4.15 2.16 -0.06 2.90 0.04 -1.26 -4.53 135.00 130.11 1i7z s PRO 119 Ca 0.70 -0.51 0.05 0.00 0.04 0.00 0.00 61.00 61.28 1i7z s PRO 119 Cb -0.24 -2.26 -0.01 0.00 0.04 0.00 0.00 34.50 32.02 1i7z s PRO 119 CO 0.46 -1.17 -0.22 -1.12 0.04 0.00 0.00 177.00 174.99 1i7z s SER 120 N -4.53 3.31 -0.23 6.66 0.01 -0.41 -4.96 113.70 113.54 1i7z s SER 120 Ca 0.61 -0.44 -0.04 0.00 1.31 0.00 0.00 55.95 57.38 1i7z s SER 120 Cb -0.10 -0.85 -0.01 0.00 0.21 0.00 0.00 66.02 65.27 1i7z s SER 120 CO 0.43 0.26 -0.02 -0.69 0.41 0.00 0.00 173.24 173.63 1i7z s VAL 121 N -0.26 3.51 0.16 3.43 1.01 -1.26 -1.14 120.40 125.84 1i7z s VAL 121 Ca -0.00 -0.48 0.08 0.00 0.00 0.00 0.00 61.98 61.59 1i7z s VAL 121 Cb -0.13 -2.62 -0.04 0.00 0.00 0.00 0.00 36.38 33.59 1i7z s VAL 121 CO 0.03 0.39 -0.10 -0.36 0.00 0.00 0.00 175.10 175.05 1i7z s PHE 122 N 1.49 2.65 0.16 5.22 0.40 -0.49 -4.95 117.98 122.46 1i7z s PHE 122 Ca 0.06 -0.21 -0.22 0.00 -0.60 0.00 0.00 56.93 55.95 1i7z s PHE 122 Cb -0.15 -1.33 -0.08 0.00 0.51 0.00 0.00 43.02 41.98 1i7z s PHE 122 CO -0.02 0.48 0.71 -1.25 0.70 0.00 0.00 175.22 175.83 1i7z s PRO 123 N -2.62 4.38 -0.63 0.24 0.04 -1.26 -1.12 135.00 134.03 1i7z s PRO 123 Ca 0.23 0.96 -0.06 0.00 0.04 0.00 0.00 61.00 62.17 1i7z s PRO 123 Cb -0.09 -3.14 0.16 0.00 0.04 0.00 0.00 34.50 31.47 1i7z s PRO 123 CO 0.14 0.54 0.48 -0.51 0.04 0.00 0.00 177.00 177.69 1i7z s LEU 124 N -1.39 5.63 0.17 -3.56 1.43 0.82 -4.86 118.68 116.92 1i7z s LEU 124 Ca 0.36 -2.62 -0.22 0.00 -1.03 0.00 0.00 54.13 50.63 1i7z s LEU 124 Cb -0.20 -1.95 -0.08 0.00 0.03 0.00 0.00 46.19 43.99 1i7z s LEU 124 CO 0.23 -0.47 0.71 0.00 0.23 0.00 0.00 176.35 177.04 1i7z s ALA 125 N 0.29 3.47 0.51 4.21 0.00 -1.26 -0.67 121.76 128.31 1i7z s ALA 125 Ca 0.15 0.21 -0.19 0.00 0.00 0.00 0.00 51.96 52.12 1i7z s ALA 125 Cb -0.19 -2.83 -0.08 0.00 0.00 0.00 0.00 23.12 20.02 1i7z s ALA 125 CO -0.04 0.33 1.03 -1.25 0.00 0.00 0.00 175.76 175.83 1i7z s PRO 126 N -1.47 3.74 0.00 0.00 0.04 -1.25 -4.86 135.00 131.19 1i7z s PRO 126 Ca 0.37 1.29 0.00 0.00 0.04 0.00 0.00 61.00 62.70 1i7z s PRO 126 Cb -0.20 -2.09 0.00 0.00 0.04 0.00 0.00 34.50 32.25 1i7z s PRO 126 CO 0.23 -0.47 0.00 -1.13 0.04 0.00 0.00 177.00 175.66 1i7z n SER 127 N -1.19 0.00 0.15 6.66 3.41 -1.26 -3.93 113.62 117.45 1i7z n SER 127 Ca 0.09 0.00 0.02 0.00 -0.26 0.00 0.00 58.87 58.72 1i7z n SER 127 Cb 0.53 0.00 0.17 0.00 -0.26 0.00 0.00 64.21 64.64 1i7z n SER 127 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 1i7z h SER 128 N 0.00 0.00 0.94 4.04 4.64 -1.96 -2.35 113.55 118.86 1i7z h SER 128 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1i7z h SER 128 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1i7z h SER 128 CO 0.00 0.54 0.00 0.29 -0.87 0.00 0.00 176.83 176.79 1i7z n LYS 129 N -3.47 0.18 -2.47 4.77 4.76 -1.26 -3.16 118.16 117.52 1i7z n LYS 129 Ca 0.00 0.31 -0.24 0.00 -2.87 0.00 0.00 58.31 55.51 1i7z n LYS 129 Cb 0.65 -1.78 0.01 0.00 -1.84 0.00 0.00 35.03 32.06 1i7z n LYS 129 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 1i7z n SER 130 N -2.10 4.31 -3.58 4.39 2.88 -0.89 -5.00 113.62 113.63 1i7z n SER 130 Ca 0.04 -3.58 -0.22 0.00 -1.33 0.00 0.00 58.87 53.78 1i7z n SER 130 Cb 0.29 -0.46 -0.16 0.00 -0.75 0.00 0.00 64.21 63.14 1i7z n SER 130 CO 0.00 0.00 0.00 -0.89 -1.23 0.00 0.00 175.04 172.92 1i7z s THR 133 N -5.15 -0.19 -1.23 2.46 2.01 -1.19 -2.55 115.64 109.80 1i7z s THR 133 Ca 0.46 -0.03 -0.05 0.00 0.31 0.00 0.00 61.69 62.38 1i7z s THR 133 Cb 0.41 -0.54 0.19 0.00 0.01 0.00 0.00 72.50 72.57 1i7z s THR 133 CO -0.14 -0.16 2.13 -0.24 -0.69 0.00 0.00 174.62 175.52 1i7z n SER 134 N 5.30 7.46 0.00 3.53 2.88 0.64 -4.88 113.62 128.55 1i7z n SER 134 Ca -0.06 -3.30 0.00 0.00 -1.33 0.00 0.00 58.87 54.18 1i7z n SER 134 Cb 0.49 -1.32 0.00 0.00 -0.75 0.00 0.00 64.21 62.64 1i7z n SER 134 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1i7z n GLY 135 N 1.34 2.16 0.00 0.46 0.00 -1.26 -3.27 105.19 104.62 1i7z n GLY 135 Ca 0.54 -0.09 0.10 0.00 0.00 0.00 0.00 46.02 46.56 1i7z n GLY 135 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1i7z n GLY 136 N 0.00 -0.88 3.87 -0.02 0.00 -1.26 -4.92 105.19 101.98 1i7z n GLY 136 Ca 0.00 -0.54 -0.36 0.00 0.00 0.00 0.00 46.02 45.12 1i7z n GLY 136 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1i7z s THR 137 N -3.00 5.36 0.01 2.61 2.01 -1.20 -0.62 115.64 120.80 1i7z s THR 137 Ca 0.04 0.31 0.05 0.00 0.31 0.00 0.00 61.69 62.40 1i7z s THR 137 Cb 0.14 -3.51 -0.02 0.00 0.01 0.00 0.00 72.50 69.13 1i7z s THR 137 CO 0.82 0.53 -0.17 0.00 -0.69 0.00 0.00 174.62 175.12 1i7z s ALA 138 N -1.12 1.39 0.07 7.40 0.00 0.10 -0.26 121.76 129.34 1i7z s ALA 138 Ca 0.21 -0.78 0.05 0.00 0.00 0.00 0.00 51.96 51.43 1i7z s ALA 138 Cb -0.13 -0.31 -0.04 0.00 0.00 0.00 0.00 23.12 22.64 1i7z s ALA 138 CO 0.10 0.32 -0.05 0.00 0.00 0.00 0.00 175.76 176.13 1i7z s ALA 139 N -0.54 3.12 0.13 0.00 0.00 -1.06 -0.50 121.76 122.91 1i7z s ALA 139 Ca 0.06 -1.13 -0.22 0.00 0.00 0.00 0.00 51.96 50.67 1i7z s ALA 139 Cb -0.07 -1.08 0.06 0.00 0.00 0.00 0.00 23.12 22.03 1i7z s ALA 139 CO 0.00 0.66 0.55 -0.48 0.00 0.00 0.00 175.76 176.50 1i7z s LEU 140 N -2.04 -0.32 0.00 0.00 0.05 -0.81 -3.95 118.68 111.60 1i7z s LEU 140 Ca 0.22 -0.02 -0.04 0.00 0.05 0.00 0.00 54.13 54.34 1i7z s LEU 140 Cb -0.11 2.39 0.02 0.00 -2.05 0.00 0.00 46.19 46.43 1i7z s LEU 140 CO 0.14 -0.91 0.21 0.61 -0.55 0.00 0.00 176.35 175.85 1i7z n GLY 141 N -0.21 0.84 3.14 -3.48 0.00 0.16 -0.95 105.19 104.69 1i7z n GLY 141 Ca -0.17 -0.91 -0.26 0.00 0.00 0.00 0.00 46.02 44.68 1i7z n GLY 141 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i7z s LEU 143 N -0.05 4.00 -0.72 0.00 2.96 -0.27 -0.90 118.68 123.70 1i7z s LEU 143 Ca -0.02 -0.40 -0.14 0.00 -0.22 0.00 0.00 54.13 53.36 1i7z s LEU 143 Cb -0.11 -2.01 0.19 0.00 0.50 0.00 0.00 46.19 44.76 1i7z s LEU 143 CO 0.02 -0.15 0.65 -0.69 -1.32 0.00 0.00 176.35 174.86 1i7z s VAL 144 N 1.64 5.32 0.14 1.68 1.01 0.23 -1.40 120.40 129.01 1i7z s VAL 144 Ca 0.05 -2.19 0.03 0.00 0.00 0.00 0.00 61.98 59.87 1i7z s VAL 144 Cb -0.17 -4.33 -0.04 0.00 0.00 0.00 0.00 36.38 31.84 1i7z s VAL 144 CO 0.07 -0.96 0.22 -0.75 0.00 0.00 0.00 175.10 173.67 1i7z s LYS 145 N 0.61 3.24 -0.83 2.72 2.20 -0.29 -0.76 119.74 126.63 1i7z s LYS 145 Ca 0.13 -0.67 -0.02 0.00 -0.36 0.00 0.00 55.97 55.05 1i7z s LYS 145 Cb -0.17 -2.86 0.00 0.00 -1.51 0.00 0.00 37.83 33.29 1i7z s LYS 145 CO -0.05 0.52 0.64 -0.25 -0.36 0.00 0.00 175.35 175.85 1i7z n ASP 146 N -0.33 -5.59 -4.29 1.43 8.00 -0.38 -1.29 116.55 114.09 1i7z n ASP 146 Ca -0.07 -0.76 -0.16 0.00 0.71 0.00 0.00 54.79 54.51 1i7z n ASP 146 Cb 0.54 -2.66 -0.10 0.00 -0.02 0.00 0.00 41.12 38.88 1i7z n ASP 146 CO 0.00 0.00 0.00 -0.72 -0.39 0.00 0.00 177.20 176.09 1i7z s TYR 147 N -3.03 1.43 -0.28 1.24 -0.85 -0.96 -4.26 117.35 110.64 1i7z s TYR 147 Ca 0.04 -0.87 -0.22 0.00 -0.52 0.00 0.00 57.07 55.49 1i7z s TYR 147 Cb -0.02 -0.79 0.11 0.00 0.38 0.00 0.00 41.96 41.64 1i7z s TYR 147 CO 0.86 -0.01 0.93 0.12 -1.52 0.00 0.00 175.55 175.93 1i7z s PHE 148 N -3.41 -0.61 0.00 -3.49 5.36 -0.54 -0.98 117.98 114.31 1i7z s PHE 148 Ca 0.24 1.39 0.00 0.00 -0.96 0.00 0.00 56.93 57.60 1i7z s PHE 148 Cb 0.05 0.37 0.00 0.00 -0.34 0.00 0.00 43.02 43.10 1i7z s PHE 148 CO 0.05 -0.30 0.00 -0.35 -1.46 0.00 0.00 175.22 173.17 1i7z n PRO 149 N 2.81 1.62 -1.51 10.12 -0.04 -1.26 -0.62 135.00 146.12 1i7z n PRO 149 Ca -0.15 0.00 -0.30 0.00 -0.04 0.00 0.00 63.50 63.01 1i7z n PRO 149 Cb 0.56 0.00 0.09 0.00 -0.04 0.00 0.00 33.50 34.12 1i7z n PRO 149 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1i7z s GLU 150 N -0.36 2.07 0.41 0.54 0.41 -1.26 -4.76 118.70 115.75 1i7z s GLU 150 Ca 0.00 0.70 0.08 0.00 -0.41 0.00 0.00 54.97 55.34 1i7z s GLU 150 Cb 0.00 -1.91 -0.01 0.00 -1.78 0.00 0.00 34.13 30.43 1i7z s GLU 150 CO 0.00 -1.64 0.42 -1.25 -0.49 0.00 0.00 175.26 172.30 1i7z s PRO 151 N -5.11 2.65 -0.01 0.39 0.04 -1.26 -4.90 135.00 126.79 1i7z s PRO 151 Ca 0.61 -1.42 0.04 0.00 0.04 0.00 0.00 61.00 60.27 1i7z s PRO 151 Cb -0.15 -2.50 -0.01 0.00 0.04 0.00 0.00 34.50 31.88 1i7z s PRO 151 CO 0.55 -0.17 -0.13 0.54 0.04 0.00 0.00 177.00 177.82 1i7z s VAL 152 N -2.41 1.03 -0.07 -0.36 0.11 -1.26 -4.58 120.40 112.86 1i7z s VAL 152 Ca 0.49 -0.55 0.01 0.00 -2.93 0.00 0.00 61.98 59.00 1i7z s VAL 152 Cb -0.05 -0.86 -0.03 0.00 -1.53 0.00 0.00 36.38 33.90 1i7z s VAL 152 CO 0.29 0.29 -0.08 0.42 -3.33 0.00 0.00 175.10 172.70 1i7z s THR 153 N -0.25 3.64 -0.03 5.04 -4.23 -0.55 -4.97 115.64 114.28 1i7z s THR 153 Ca 0.04 -0.50 0.04 0.00 -1.18 0.00 0.00 61.69 60.08 1i7z s THR 153 Cb -0.06 -2.48 -0.00 0.00 1.34 0.00 0.00 72.50 71.30 1i7z s THR 153 CO -0.00 0.60 -0.14 -0.69 -0.54 0.00 0.00 174.62 173.85 1i7z s VAL 154 N -0.80 1.16 0.09 2.29 1.01 -1.26 -1.20 120.40 121.69 1i7z s VAL 154 Ca 0.12 -0.58 -0.01 0.00 0.00 0.00 0.00 61.98 61.52 1i7z s VAL 154 Cb -0.11 -1.01 -0.04 0.00 0.00 0.00 0.00 36.38 35.22 1i7z s VAL 154 CO 0.01 0.34 0.00 -0.94 0.00 0.00 0.00 175.10 174.52 1i7z s SER 156 N 0.06 0.52 -0.09 3.32 1.04 -0.19 -4.95 113.70 113.40 1i7z s SER 156 Ca -0.03 -1.09 0.03 0.00 0.48 0.00 0.00 55.95 55.35 1i7z s SER 156 Cb -0.10 0.22 -0.01 0.00 0.10 0.00 0.00 66.02 66.24 1i7z s SER 156 CO 0.01 -0.63 -0.21 0.26 0.98 0.00 0.00 173.24 173.65 1i7z s TRP 157 N -3.93 2.60 -1.40 5.02 0.52 -1.26 0.93 118.94 121.43 1i7z s TRP 157 Ca 0.15 -0.82 -0.03 0.00 0.02 0.00 0.00 56.10 55.41 1i7z s TRP 157 Cb 0.07 -1.71 0.00 0.00 -1.15 0.00 0.00 33.47 30.68 1i7z s TRP 157 CO -0.04 -0.29 0.40 0.09 0.02 0.00 0.00 176.95 177.13 1i7z n ASN 162 N 3.32 -0.67 -2.08 2.95 3.02 0.94 -0.94 115.26 121.80 1i7z n ASN 162 Ca -0.18 -1.05 -0.15 0.00 -0.03 0.00 0.00 54.58 53.16 1i7z n ASN 162 Cb 0.53 -2.84 -0.03 0.00 -0.61 0.00 0.00 39.78 36.83 1i7z n ASN 162 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1i7z n SER 163 N -2.92 -4.27 0.00 6.41 7.64 -1.26 -2.04 113.62 117.18 1i7z n SER 163 Ca -0.29 0.21 0.00 0.00 1.01 0.00 0.00 58.87 59.80 1i7z n SER 163 Cb 0.68 -3.71 0.00 0.00 -1.01 0.00 0.00 64.21 60.17 1i7z n SER 163 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1i7z n GLY 164 N -0.66 2.94 0.30 0.23 0.00 -0.11 -4.94 105.19 102.94 1i7z n GLY 164 Ca -0.17 0.00 0.19 0.00 0.00 0.00 0.00 46.02 46.04 1i7z n GLY 164 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i7z h ALA 165 N 0.00 1.01 -3.26 4.61 0.00 -1.37 -3.40 119.26 116.84 1i7z h ALA 165 Ca 0.00 -0.00 -0.68 0.00 0.00 0.00 0.00 54.91 54.22 1i7z h ALA 165 Cb 0.00 -0.00 -0.30 0.00 0.00 0.00 0.00 17.79 17.49 1i7z h ALA 165 CO 0.00 0.01 -0.67 -1.17 0.00 0.00 0.00 179.25 177.42 1i7z s LEU 166 N -6.20 3.83 0.00 0.00 2.96 -1.05 -4.88 118.68 113.34 1i7z s LEU 166 Ca -0.01 -1.03 0.00 0.00 -0.22 0.00 0.00 54.13 52.87 1i7z s LEU 166 Cb 0.10 -1.77 0.00 0.00 0.50 0.00 0.00 46.19 45.02 1i7z s LEU 166 CO 0.51 -0.23 0.00 0.35 -1.32 0.00 0.00 176.35 175.65 1i7z n THR 167 N 4.73 0.00 -2.20 3.68 -2.24 -1.26 -4.11 114.28 112.88 1i7z n THR 167 Ca -0.14 0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.22 1i7z n THR 167 Cb 0.45 -0.57 -0.03 0.00 -2.10 0.00 0.00 70.33 68.08 1i7z n THR 167 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1i7z s SER 168 N -2.29 6.85 0.00 3.42 0.15 -1.26 -2.51 113.70 118.06 1i7z s SER 168 Ca 0.00 2.30 0.00 0.00 0.70 0.00 0.00 55.95 58.95 1i7z s SER 168 Cb 0.00 -2.59 0.00 0.00 -1.71 0.00 0.00 66.02 61.72 1i7z s SER 168 CO 0.00 -0.63 0.00 0.61 1.20 0.00 0.00 173.24 174.42 1i7z n GLY 169 N 3.41 0.57 3.75 9.45 0.00 -1.26 -4.79 105.19 116.31 1i7z n GLY 169 Ca 0.11 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.75 1i7z n GLY 169 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1i7z s VAL 171 N -2.13 5.18 -0.20 1.61 1.01 -1.04 -1.96 120.40 122.87 1i7z s VAL 171 Ca 0.00 0.82 -0.02 0.00 0.00 0.00 0.00 61.98 62.78 1i7z s VAL 171 Cb 0.00 -3.74 0.06 0.00 0.00 0.00 0.00 36.38 32.70 1i7z s VAL 171 CO 0.00 0.40 0.01 -1.00 0.00 0.00 0.00 175.10 174.51 1i7z s HIS 172 N 0.17 1.36 -0.45 5.22 3.76 0.78 -4.98 115.29 121.14 1i7z s HIS 172 Ca 0.23 -1.05 -0.09 0.00 -0.15 0.00 0.00 55.06 54.00 1i7z s HIS 172 Cb -0.15 -1.16 0.10 0.00 1.11 0.00 0.00 32.58 32.48 1i7z s HIS 172 CO 0.09 -0.64 0.31 0.99 -0.85 0.00 0.00 174.74 174.64 1i7z s THR 173 N 1.75 4.25 0.65 1.30 2.01 -1.26 -0.94 115.64 123.39 1i7z s THR 173 Ca -0.02 -1.59 -0.16 0.00 0.31 0.00 0.00 61.69 60.23 1i7z s THR 173 Cb -0.17 -3.71 -0.01 0.00 0.01 0.00 0.00 72.50 68.62 1i7z s THR 173 CO -0.07 -0.65 1.15 -0.36 -0.69 0.00 0.00 174.62 173.99 1i7z s PHE 174 N 1.40 2.47 0.32 4.92 0.08 -0.97 -4.99 117.98 121.20 1i7z s PHE 174 Ca 0.04 1.56 -0.29 0.00 0.12 0.00 0.00 56.93 58.36 1i7z s PHE 174 Cb -0.25 -3.30 -0.10 0.00 -0.57 0.00 0.00 43.02 38.80 1i7z s PHE 174 CO 0.01 -1.94 1.20 -2.14 -0.10 0.00 0.00 175.22 172.25 1i7z s PRO 175 N -3.81 4.45 0.87 0.24 0.02 -1.26 -4.56 135.00 130.96 1i7z s PRO 175 Ca 0.71 2.01 -0.10 0.00 0.02 0.00 0.00 61.00 63.63 1i7z s PRO 175 Cb -0.24 -3.09 0.12 0.00 0.02 0.00 0.00 34.50 31.31 1i7z s PRO 175 CO 0.39 -0.02 1.13 0.00 -0.33 0.00 0.00 177.00 178.16 1i7z s ALA 176 N -1.17 1.72 -0.04 -1.55 0.00 -1.26 -4.85 121.76 114.61 1i7z s ALA 176 Ca 0.48 0.50 0.04 0.00 0.00 0.00 0.00 51.96 52.97 1i7z s ALA 176 Cb -0.36 -3.40 -0.00 0.00 0.00 0.00 0.00 23.12 19.37 1i7z s ALA 176 CO 0.47 -2.45 -0.15 0.14 0.00 0.00 0.00 175.76 173.76 1i7z s VAL 177 N -2.72 1.26 -0.28 0.00 -7.23 -0.48 -4.93 120.40 106.02 1i7z s VAL 177 Ca 0.65 -0.62 -0.29 0.00 -1.81 0.00 0.00 61.98 59.91 1i7z s VAL 177 Cb -0.21 -1.09 0.01 0.00 0.56 0.00 0.00 36.38 35.65 1i7z s VAL 177 CO 0.57 0.37 1.15 -0.22 -0.31 0.00 0.00 175.10 176.66 1i7z s LEU 178 N 0.10 3.97 0.51 1.32 2.96 -1.26 -2.36 118.68 123.91 1i7z s LEU 178 Ca -0.04 1.21 -0.17 0.00 -0.22 0.00 0.00 54.13 54.91 1i7z s LEU 178 Cb -0.11 -3.54 -0.08 0.00 0.50 0.00 0.00 46.19 42.96 1i7z s LEU 178 CO 0.02 -0.89 0.99 -1.10 -1.32 0.00 0.00 176.35 174.04 1i7z s GLN 179 N 3.71 3.94 0.44 1.98 -0.21 0.86 -4.91 119.66 125.47 1i7z s GLN 179 Ca 0.49 1.01 0.16 0.00 0.02 0.00 0.00 55.36 57.04 1i7z s GLN 179 Cb -0.15 -2.13 0.86 0.00 1.00 0.00 0.00 33.01 32.59 1i7z s GLN 179 CO 0.16 -0.28 1.41 0.66 -2.12 0.00 0.00 175.29 175.12 1i7z h SER 180 N 1.04 0.00 0.17 5.90 4.64 -1.95 0.52 113.55 123.87 1i7z h SER 180 Ca -0.47 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.85 1i7z h SER 180 Cb 1.19 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.28 1i7z h SER 180 CO 0.61 0.00 -0.05 -1.54 -0.87 0.00 0.00 176.83 174.98 1i7z n SER 182 N -2.29 0.57 0.00 4.97 3.41 -1.26 -4.90 113.62 114.12 1i7z n SER 182 Ca -0.01 -0.91 0.00 0.00 -0.26 0.00 0.00 58.87 57.69 1i7z n SER 182 Cb 0.42 -0.04 0.00 0.00 -0.26 0.00 0.00 64.21 64.33 1i7z n SER 182 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1i7z n GLY 183 N 1.17 0.52 3.38 5.00 0.00 0.18 -5.05 105.19 110.39 1i7z n GLY 183 Ca 0.18 -0.56 -0.28 0.00 0.00 0.00 0.00 46.02 45.36 1i7z n GLY 183 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1i7z s LEU 184 N 0.00 2.32 0.46 0.99 1.43 -1.23 -4.91 118.68 117.74 1i7z s LEU 184 Ca 0.00 -0.74 -0.04 0.00 -1.03 0.00 0.00 54.13 52.32 1i7z s LEU 184 Cb 0.00 -1.18 -0.03 0.00 0.03 0.00 0.00 46.19 45.02 1i7z s LEU 184 CO 0.00 0.16 0.74 -0.31 0.23 0.00 0.00 176.35 177.18 1i7z s TYR 185 N -1.08 3.48 -0.16 0.29 1.51 -0.15 -0.10 117.35 121.14 1i7z s TYR 185 Ca 0.13 0.64 -0.11 0.00 -1.01 0.00 0.00 57.07 56.72 1i7z s TYR 185 Cb -0.10 -2.27 0.05 0.00 -0.11 0.00 0.00 41.96 39.53 1i7z s TYR 185 CO 0.06 -0.27 0.40 0.45 -1.11 0.00 0.00 175.55 175.07 1i7z s SER 186 N -4.13 -0.46 -0.06 2.29 0.15 -1.00 -1.25 113.70 109.24 1i7z s SER 186 Ca 0.47 0.84 -0.05 0.00 0.70 0.00 0.00 55.95 57.90 1i7z s SER 186 Cb -0.10 0.77 0.02 0.00 -1.71 0.00 0.00 66.02 64.99 1i7z s SER 186 CO 0.42 -0.17 0.16 -0.22 1.20 0.00 0.00 173.24 174.63 1i7z s LEU 187 N 0.94 1.32 0.08 3.45 0.20 0.06 -1.38 118.68 123.35 1i7z s LEU 187 Ca -0.06 0.32 0.05 0.00 0.69 0.00 0.00 54.13 55.14 1i7z s LEU 187 Cb -0.06 0.54 -0.04 0.00 -0.43 0.00 0.00 46.19 46.20 1i7z s LEU 187 CO -0.07 -0.06 -0.04 -0.94 -0.29 0.00 0.00 176.35 174.95 1i7z s SER 188 N 0.18 4.80 -0.11 3.68 1.04 -1.26 0.75 113.70 122.79 1i7z s SER 188 Ca -0.01 -0.23 -0.02 0.00 0.48 0.00 0.00 55.95 56.18 1i7z s SER 188 Cb -0.02 -1.09 0.04 0.00 0.10 0.00 0.00 66.02 65.05 1i7z s SER 188 CO -0.00 0.19 0.01 -0.55 0.98 0.00 0.00 173.24 173.87 1i7z s SER 189 N -2.15 1.99 0.41 7.02 0.15 -0.07 -2.30 113.70 118.74 1i7z s SER 189 Ca 0.23 -0.31 0.07 0.00 0.70 0.00 0.00 55.95 56.65 1i7z s SER 189 Cb -0.11 -0.50 -0.08 0.00 -1.71 0.00 0.00 66.02 63.62 1i7z s SER 189 CO 0.15 -0.22 0.02 0.68 1.20 0.00 0.00 173.24 175.07 1i7z s VAL 190 N 1.93 2.02 -0.20 4.45 -7.23 -0.12 -0.74 120.40 120.51 1i7z s VAL 190 Ca 0.03 -1.99 -0.21 0.00 -1.81 0.00 0.00 61.98 58.00 1i7z s VAL 190 Cb -0.14 -2.99 0.06 0.00 0.56 0.00 0.00 36.38 33.87 1i7z s VAL 190 CO -0.06 -0.01 0.59 0.54 -0.31 0.00 0.00 175.10 175.85 1i7z s VAL 191 N -2.70 0.00 -0.03 1.32 0.11 -0.13 -0.16 120.40 118.82 1i7z s VAL 191 Ca 0.35 -0.02 -0.02 0.00 -2.93 0.00 0.00 61.98 59.37 1i7z s VAL 191 Cb 0.09 -0.83 -0.04 0.00 -1.53 0.00 0.00 36.38 34.08 1i7z s VAL 191 CO 0.18 -0.01 0.09 0.42 -3.33 0.00 0.00 175.10 172.46 1i7z s THR 192 N 0.15 4.88 0.27 5.04 -4.23 -0.83 -1.93 115.64 118.99 1i7z s THR 192 Ca -0.01 -0.27 -0.09 0.00 -1.18 0.00 0.00 61.69 60.14 1i7z s THR 192 Cb -0.04 -3.20 -0.01 0.00 1.34 0.00 0.00 72.50 70.59 1i7z s THR 192 CO 0.02 0.42 0.43 0.68 -0.54 0.00 0.00 174.62 175.63 1i7z s VAL 193 N -1.15 0.00 0.01 2.29 -7.23 0.34 -4.75 120.40 109.90 1i7z s VAL 193 Ca 0.21 -1.53 -0.30 0.00 -1.81 0.00 0.00 61.98 58.55 1i7z s VAL 193 Cb -0.12 -2.37 -0.06 0.00 0.56 0.00 0.00 36.38 34.39 1i7z s VAL 193 CO 0.12 0.00 1.47 -2.84 -0.31 0.00 0.00 175.10 173.54 1i7z s PRO 194 N -3.77 4.26 0.52 4.82 0.02 -1.26 0.01 135.00 139.59 1i7z s PRO 194 Ca 0.27 2.05 0.18 0.00 0.02 0.00 0.00 61.00 63.52 1i7z s PRO 194 Cb 0.00 -3.61 1.30 0.00 0.02 0.00 0.00 34.50 32.22 1i7z s PRO 194 CO 0.12 -0.63 2.11 0.66 -0.33 0.00 0.00 177.00 178.93 1i7z h SER 195 N 8.05 0.01 0.78 2.53 4.64 -1.15 0.43 113.55 128.83 1i7z h SER 195 Ca -0.39 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.93 1i7z h SER 195 Cb 1.18 -0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.27 1i7z h SER 195 CO 0.91 0.00 0.00 0.77 -0.87 0.00 0.00 176.83 177.65 1i7z h SER 196 N 0.01 0.00 0.87 4.97 4.64 -1.89 -2.05 113.55 120.09 1i7z h SER 196 Ca 0.07 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.39 1i7z h SER 196 Cb 0.28 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.37 1i7z h SER 196 CO -0.00 0.00 -0.41 -1.54 -0.87 0.00 0.00 176.83 174.00 1i7z n SER 197 N -2.68 0.56 -0.24 4.97 3.41 0.15 -4.11 113.62 115.67 1i7z n SER 197 Ca 0.01 0.14 0.11 0.00 -0.26 0.00 0.00 58.87 58.86 1i7z n SER 197 Cb 0.24 -0.04 0.38 0.00 -0.26 0.00 0.00 64.21 64.53 1i7z n SER 197 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 1i7z h LEU 198 N 0.00 0.65 -0.75 1.04 3.38 -1.33 -1.84 115.31 116.46 1i7z h LEU 198 Ca 0.00 0.03 -0.12 0.00 0.09 0.00 0.00 57.88 57.87 1i7z h LEU 198 Cb 0.64 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.28 1i7z h LEU 198 CO 0.00 0.35 -0.40 1.23 0.09 0.00 0.00 178.44 179.71 1i7z h GLY 199 N 0.70 0.52 -0.01 0.83 0.00 -1.78 -3.37 103.07 99.96 1i7z h GLY 199 Ca 0.41 -0.51 0.00 0.00 0.00 0.00 0.00 47.33 47.23 1i7z h GLY 199 CO -0.17 0.46 -0.43 -1.30 0.00 0.00 0.00 176.54 175.10 1i7z n THR 200 N -4.03 0.00 -4.49 4.70 -2.24 -1.00 -5.00 114.28 102.22 1i7z n THR 200 Ca -0.02 -0.29 -0.34 0.00 -2.27 0.00 0.00 64.05 61.14 1i7z n THR 200 Cb 0.50 1.00 -0.12 0.00 -2.10 0.00 0.00 70.33 69.61 1i7z n THR 200 CO 0.00 0.00 0.00 -1.58 -0.57 0.00 0.00 175.07 172.92 1i7z s GLN 203 N -1.86 3.51 0.23 -0.78 2.00 -0.73 -5.10 119.66 116.94 1i7z s GLN 203 Ca 0.04 -0.54 -0.30 0.00 -2.00 0.00 0.00 55.36 52.55 1i7z s GLN 203 Cb 0.07 -2.83 -0.09 0.00 0.80 0.00 0.00 33.01 30.96 1i7z s GLN 203 CO 0.38 0.30 0.95 0.99 -0.50 0.00 0.00 175.29 177.41 1i7z s THR 205 N 0.19 4.08 -0.18 -0.34 2.01 -1.26 -4.82 115.64 115.31 1i7z s THR 205 Ca -0.03 2.05 -0.00 0.00 0.31 0.00 0.00 61.69 64.02 1i7z s THR 205 Cb -0.14 -4.30 0.05 0.00 0.01 0.00 0.00 72.50 68.11 1i7z s THR 205 CO 0.03 0.47 -0.05 -0.31 -0.69 0.00 0.00 174.62 174.07 1i7z s TYR 206 N -1.05 1.83 -0.07 4.92 2.02 -1.26 -4.97 117.35 118.76 1i7z s TYR 206 Ca 0.42 -1.22 0.02 0.00 -0.37 0.00 0.00 57.07 55.92 1i7z s TYR 206 Cb -0.26 -1.37 0.02 0.00 -0.40 0.00 0.00 41.96 39.95 1i7z s TYR 206 CO 0.32 -0.65 -0.12 0.42 -1.57 0.00 0.00 175.55 173.96 1i7z s ILE 207 N 1.59 1.12 -0.05 2.71 1.01 -1.26 -0.94 121.20 125.39 1i7z s ILE 207 Ca -0.01 -0.45 -0.11 0.00 0.00 0.00 0.00 60.65 60.09 1i7z s ILE 207 Cb -0.16 -1.05 -0.05 0.00 0.01 0.00 0.00 42.46 41.22 1i7z s ILE 207 CO -0.08 0.36 0.29 0.00 0.00 0.00 0.00 174.94 175.51 1i7z s ASN 209 N -1.12 4.62 -0.10 0.00 -0.87 0.26 -0.85 114.94 116.89 1i7z s ASN 209 Ca 0.21 -0.92 -0.01 0.00 -1.57 0.00 0.00 52.86 50.57 1i7z s ASN 209 Cb -0.14 -1.72 -0.03 0.00 -0.02 0.00 0.00 41.25 39.33 1i7z s ASN 209 CO 0.10 -0.17 -0.04 -0.69 -2.57 0.00 0.00 177.10 173.72 1i7z s VAL 210 N 1.35 3.89 -0.04 1.60 1.01 0.94 -1.02 120.40 128.14 1i7z s VAL 210 Ca -0.00 -0.39 0.00 0.00 0.00 0.00 0.00 61.98 61.58 1i7z s VAL 210 Cb -0.17 -2.63 0.03 0.00 0.00 0.00 0.00 36.38 33.60 1i7z s VAL 210 CO -0.02 0.57 -0.01 0.21 0.00 0.00 0.00 175.10 175.85 1i7z s ASN 211 N -0.52 0.71 -0.49 3.32 3.04 -0.34 -0.83 114.94 119.83 1i7z s ASN 211 Ca 0.08 -0.05 0.03 0.00 0.04 0.00 0.00 52.86 52.96 1i7z s ASN 211 Cb -0.12 -0.29 0.14 0.00 -1.54 0.00 0.00 41.25 39.44 1i7z s ASN 211 CO 0.02 -0.11 0.28 -2.28 -3.04 0.00 0.00 177.10 171.98 1i7z s HIS 212 N 1.16 2.39 0.35 0.43 5.65 0.80 -1.48 115.29 124.59 1i7z s HIS 212 Ca -0.08 -2.70 0.08 0.00 0.25 0.00 0.00 55.06 52.61 1i7z s HIS 212 Cb -0.13 -2.13 0.80 0.00 -1.18 0.00 0.00 32.58 29.93 1i7z s HIS 212 CO -0.02 -0.75 1.87 0.87 -0.65 0.00 0.00 174.74 176.07 1i7z h LYS 213 N 6.43 0.69 -0.63 2.88 1.57 -1.81 -1.10 116.57 124.61 1i7z h LYS 213 Ca 0.01 -0.04 0.13 0.00 -1.87 0.00 0.00 60.65 58.88 1i7z h LYS 213 Cb 0.90 -0.16 -0.04 0.00 0.08 0.00 0.00 32.23 33.01 1i7z h LYS 213 CO 0.55 0.46 0.43 -1.35 -0.57 0.00 0.00 179.45 178.97 1i7z h PRO 214 N 0.71 0.28 -0.23 3.15 0.11 -1.91 -2.07 132.00 132.05 1i7z h PRO 214 Ca 0.44 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.54 1i7z h PRO 214 Cb 0.68 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 31.72 1i7z h PRO 214 CO -0.20 0.19 0.00 -1.13 -0.21 0.00 0.00 178.00 176.65 1i7z n SER 215 N -4.45 2.55 -3.47 -2.05 3.41 -0.80 -4.94 113.62 103.87 1i7z n SER 215 Ca 0.11 -1.90 -0.25 0.00 -0.26 0.00 0.00 58.87 56.57 1i7z n SER 215 Cb 0.49 -0.15 0.05 0.00 -0.26 0.00 0.00 64.21 64.34 1i7z n SER 215 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1i7z n ASN 216 N 0.30 -5.77 -4.58 4.04 3.02 -0.53 -4.86 115.26 106.88 1i7z n ASN 216 Ca 0.08 -0.50 -0.38 0.00 -0.03 0.00 0.00 54.58 53.75 1i7z n ASN 216 Cb 0.36 -4.61 -0.11 0.00 -0.61 0.00 0.00 39.78 34.81 1i7z n ASN 216 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1i7z s THR 217 N -3.24 5.25 -0.20 3.41 2.01 -0.54 -4.97 115.64 117.36 1i7z s THR 217 Ca 0.50 0.14 0.00 0.00 0.31 0.00 0.00 61.69 62.65 1i7z s THR 217 Cb -0.23 -3.50 0.05 0.00 0.01 0.00 0.00 72.50 68.82 1i7z s THR 217 CO 0.62 0.25 -0.07 -0.54 -0.69 0.00 0.00 174.62 174.19 1i7z s LYS 218 N 1.75 1.75 0.01 4.92 1.02 -1.26 -0.14 119.74 127.79 1i7z s LYS 218 Ca 0.07 -0.81 0.06 0.00 0.02 0.00 0.00 55.97 55.30 1i7z s LYS 218 Cb -0.16 -2.38 -0.02 0.00 -0.52 0.00 0.00 37.83 34.75 1i7z s LYS 218 CO 0.11 -0.49 -0.18 0.08 -0.92 0.00 0.00 175.35 173.94 1i7z s VAL 219 N 1.45 1.45 -0.14 3.17 1.01 -0.01 -5.01 120.40 122.32 1i7z s VAL 219 Ca -0.02 -0.92 0.01 0.00 0.00 0.00 0.00 61.98 61.05 1i7z s VAL 219 Cb -0.17 -1.24 0.02 0.00 0.00 0.00 0.00 36.38 34.99 1i7z s VAL 219 CO -0.07 0.30 -0.18 -1.81 0.00 0.00 0.00 175.10 173.34 1i7z s ASP 220 N -0.72 2.86 -0.18 3.32 1.01 -1.26 -0.04 116.67 121.66 1i7z s ASP 220 Ca 0.06 -0.55 0.01 0.00 0.71 0.00 0.00 52.55 52.79 1i7z s ASP 220 Cb -0.08 -1.31 0.03 0.00 1.01 0.00 0.00 42.92 42.58 1i7z s ASP 220 CO 0.00 0.01 -0.15 -0.75 0.21 0.00 0.00 175.17 174.49 1i7z s LYS 221 N 1.12 2.50 0.06 8.23 2.47 -0.02 -4.95 119.74 129.14 1i7z s LYS 221 Ca -0.01 -0.81 -0.28 0.00 -1.56 0.00 0.00 55.97 53.31 1i7z s LYS 221 Cb -0.14 -2.43 -0.05 0.00 -1.46 0.00 0.00 37.83 33.75 1i7z s LYS 221 CO -0.06 -0.30 0.90 0.21 0.16 0.00 0.00 175.35 176.25 1i7z s LYS 222 N 1.35 4.60 -0.10 4.03 2.20 -1.26 -1.02 119.74 129.54 1i7z s LYS 222 Ca 0.02 1.31 0.03 0.00 -0.36 0.00 0.00 55.97 56.97 1i7z s LYS 222 Cb -0.14 -3.40 0.01 0.00 -1.51 0.00 0.00 37.83 32.79 1i7z s LYS 222 CO -0.10 0.16 -0.20 0.08 -0.36 0.00 0.00 175.35 174.93 1i7z s VAL 223 N 0.26 1.79 0.23 4.02 1.01 -0.12 -4.99 120.40 122.59 1i7z s VAL 223 Ca 0.45 -0.84 -0.05 0.00 0.00 0.00 0.00 61.98 61.54 1i7z s VAL 223 Cb -0.22 -1.58 -0.03 0.00 0.00 0.00 0.00 36.38 34.56 1i7z s VAL 223 CO 0.27 0.50 0.27 -1.83 0.00 0.00 0.00 175.10 174.31 1i7z s GLU 224 N 0.63 1.37 0.24 2.72 -1.05 -1.26 -4.44 118.70 116.91 1i7z s GLU 224 Ca -0.13 -1.52 -0.31 0.00 -0.15 0.00 0.00 54.97 52.86 1i7z s GLU 224 Cb -0.16 0.35 -0.13 0.00 -0.44 0.00 0.00 34.13 33.75 1i7z s GLU 224 CO 0.04 -0.51 1.52 -2.30 0.95 0.00 0.00 175.26 174.96 1i7z n PRO 225 N -0.33 2.32 0.41 -4.83 -0.02 -1.26 -4.42 135.00 126.87 1i7z n PRO 225 Ca 0.01 0.83 -0.19 0.00 -2.02 0.00 0.00 63.50 62.13 1i7z n PRO 225 Cb 0.64 -2.56 -0.10 0.00 -0.02 0.00 0.00 33.50 31.47 1i7z n PRO 225 CO 0.00 0.00 0.00 1.57 1.98 0.00 0.00 175.50 179.05 1i7z h LYS 226 N 4.84 -1.11 -0.04 -0.52 2.10 -1.90 -3.29 116.57 116.65 1i7z h LYS 226 Ca -0.45 0.08 0.00 0.00 -2.00 0.00 0.00 60.65 58.28 1i7z h LYS 226 Cb 1.25 0.25 -0.00 0.00 -0.90 0.00 0.00 32.23 32.83 1i7z h LYS 226 CO 0.80 -0.74 -0.02 0.45 -2.00 0.00 0.00 179.45 177.94 1i7z n SER 227 N -5.46 -0.04 0.00 7.07 2.88 -1.26 -5.19 113.62 111.61 1i7z n SER 227 Ca -0.14 0.44 0.00 0.00 -1.33 0.00 0.00 58.87 57.84 1i7z n SER 227 Cb 0.48 -0.19 0.00 0.00 -0.75 0.00 0.00 64.21 63.75 1i7z n SER 227 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81