#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pg7 s VAL 2 N 0.00 3.89 0.01 6.31 1.01 -1.26 -3.89 120.40 126.47 1pg7 s VAL 2 Ca 0.00 1.58 -0.01 0.00 0.00 0.00 0.00 61.98 63.55 1pg7 s VAL 2 Cb 0.00 -4.01 -0.01 0.00 0.00 0.00 0.00 36.38 32.36 1pg7 s VAL 2 CO 0.00 0.25 -0.00 -1.10 0.00 0.00 0.00 175.10 174.24 1pg7 s GLN 3 N -0.13 0.24 -0.08 2.72 -0.21 -0.27 -4.98 119.66 116.95 1pg7 s GLN 3 Ca 0.51 -0.42 -0.02 0.00 0.02 0.00 0.00 55.36 55.44 1pg7 s GLN 3 Cb -0.29 0.09 0.04 0.00 1.00 0.00 0.00 33.01 33.84 1pg7 s GLN 3 CO 0.34 -0.04 0.05 -0.51 -2.12 0.00 0.00 175.29 173.01 1pg7 s LEU 4 N -1.06 0.37 -0.19 2.90 1.43 -1.26 -1.54 118.68 119.33 1pg7 s LEU 4 Ca -0.12 -0.13 0.01 0.00 -1.03 0.00 0.00 54.13 52.86 1pg7 s LEU 4 Cb -0.07 -0.27 0.03 0.00 0.03 0.00 0.00 46.19 45.90 1pg7 s LEU 4 CO -0.01 -0.25 -0.17 -0.69 0.23 0.00 0.00 176.35 175.46 1pg7 s VAL 5 N 2.09 1.97 0.09 -1.59 1.01 -0.42 -3.70 120.40 119.85 1pg7 s VAL 5 Ca 0.04 -1.00 0.00 0.00 0.00 0.00 0.00 61.98 61.02 1pg7 s VAL 5 Cb -0.13 -1.85 -0.04 0.00 0.00 0.00 0.00 36.38 34.36 1pg7 s VAL 5 CO -0.05 0.42 0.24 -1.61 0.00 0.00 0.00 175.10 174.10 1pg7 s GLU 6 N 1.30 3.46 0.21 2.72 2.02 -1.26 -0.46 118.70 126.69 1pg7 s GLU 6 Ca 0.03 -0.44 -0.15 0.00 0.02 0.00 0.00 54.97 54.42 1pg7 s GLU 6 Cb -0.14 -3.01 0.01 0.00 0.10 0.00 0.00 34.13 31.09 1pg7 s GLU 6 CO -0.11 0.58 0.49 -1.54 0.02 0.00 0.00 175.26 174.69 1pg7 s SER 7 N -2.66 -0.16 0.00 -0.19 1.04 -0.60 -4.89 113.70 106.25 1pg7 s SER 7 Ca 0.35 -0.69 0.00 0.00 0.48 0.00 0.00 55.95 56.10 1pg7 s SER 7 Cb -0.13 0.57 0.00 0.00 0.10 0.00 0.00 66.02 66.57 1pg7 s SER 7 CO 0.28 -1.08 0.00 0.61 0.98 0.00 0.00 173.24 174.03 1pg7 n GLY 8 N -0.34 1.20 3.71 7.32 0.00 -1.26 -0.64 105.19 115.17 1pg7 n GLY 8 Ca -0.07 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.65 1pg7 n GLY 8 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1pg7 s GLY 9 N -2.09 1.65 0.00 -0.02 0.00 -1.26 -4.67 107.32 100.93 1pg7 s GLY 9 Ca 0.00 0.25 0.00 0.00 0.00 0.00 0.00 44.72 44.97 1pg7 s GLY 9 CO 0.00 0.68 0.00 0.61 0.00 0.00 0.00 173.10 174.39 1pg7 n GLY 10 N -0.63 -0.75 3.70 0.20 0.00 -0.46 -4.96 105.19 102.29 1pg7 n GLY 10 Ca 0.09 -1.54 -0.42 0.00 0.00 0.00 0.00 46.02 44.15 1pg7 n GLY 10 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1pg7 s LEU 11 N 0.00 4.32 -0.01 0.99 2.96 -1.26 -2.14 118.68 123.53 1pg7 s LEU 11 Ca 0.00 1.76 0.03 0.00 -0.22 0.00 0.00 54.13 55.70 1pg7 s LEU 11 Cb 0.00 -3.57 -0.01 0.00 0.50 0.00 0.00 46.19 43.12 1pg7 s LEU 11 CO 0.00 -0.45 -0.11 -0.69 -1.32 0.00 0.00 176.35 173.79 1pg7 s VAL 12 N 1.61 0.86 0.50 1.68 1.01 0.04 -4.97 120.40 121.12 1pg7 s VAL 12 Ca 0.54 -0.45 -0.20 0.00 0.00 0.00 0.00 61.98 61.87 1pg7 s VAL 12 Cb -0.24 -0.73 -0.08 0.00 0.00 0.00 0.00 36.38 35.34 1pg7 s VAL 12 CO 0.24 0.25 1.05 -1.10 0.00 0.00 0.00 175.10 175.54 1pg7 s GLN 13 N -0.13 3.74 0.22 2.72 -1.52 -1.26 -1.40 119.66 122.02 1pg7 s GLN 13 Ca 0.02 1.37 -0.32 0.00 -1.95 0.00 0.00 55.36 54.48 1pg7 s GLN 13 Cb -0.06 -2.08 -0.12 0.00 -0.22 0.00 0.00 33.01 30.53 1pg7 s GLN 13 CO -0.00 -0.48 1.70 -2.30 -0.25 0.00 0.00 175.29 173.96 1pg7 n PRO 14 N -1.05 2.73 0.00 2.91 -0.02 -1.26 -1.02 135.00 137.29 1pg7 n PRO 14 Ca 0.09 0.98 0.00 0.00 -2.02 0.00 0.00 63.50 62.56 1pg7 n PRO 14 Cb 0.52 -2.82 0.00 0.00 -0.02 0.00 0.00 33.50 31.18 1pg7 n PRO 14 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1pg7 n GLY 15 N 3.73 0.88 0.00 -1.23 0.00 0.76 -4.92 105.19 104.41 1pg7 n GLY 15 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.17 1pg7 n GLY 15 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pg7 n GLY 16 N -2.00 -1.07 3.20 -0.02 0.00 -0.19 -3.75 105.19 101.36 1pg7 n GLY 16 Ca 0.00 -1.65 -0.14 0.00 0.00 0.00 0.00 46.02 44.23 1pg7 n GLY 16 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1pg7 s SER 17 N -1.02 1.53 0.05 1.61 1.04 -1.26 -1.77 113.70 113.87 1pg7 s SER 17 Ca 0.00 -0.92 0.08 0.00 0.48 0.00 0.00 55.95 55.59 1pg7 s SER 17 Cb 0.00 0.02 -0.03 0.00 0.10 0.00 0.00 66.02 66.11 1pg7 s SER 17 CO 0.00 -0.32 -0.23 -1.48 0.98 0.00 0.00 173.24 172.18 1pg7 s LEU 18 N -2.82 2.17 -0.31 2.42 0.05 -0.05 -4.99 118.68 115.14 1pg7 s LEU 18 Ca 0.11 -0.56 -0.01 0.00 0.05 0.00 0.00 54.13 53.71 1pg7 s LEU 18 Cb 0.01 -1.12 0.10 0.00 -2.05 0.00 0.00 46.19 43.13 1pg7 s LEU 18 CO -0.01 0.21 0.12 -0.13 -0.55 0.00 0.00 176.35 175.99 1pg7 s ARG 19 N -1.23 0.60 -0.05 1.48 3.00 -1.26 -1.78 118.95 119.71 1pg7 s ARG 19 Ca 0.10 -0.99 -0.10 0.00 0.00 0.00 0.00 55.73 54.73 1pg7 s ARG 19 Cb -0.09 -1.77 -0.05 0.00 0.00 0.00 0.00 34.95 33.04 1pg7 s ARG 19 CO 0.02 -1.01 0.27 -0.51 0.00 0.00 0.00 175.30 174.07 1pg7 s LEU 20 N 1.65 4.43 0.06 2.53 1.43 -0.17 -4.56 118.68 124.05 1pg7 s LEU 20 Ca 0.10 0.70 0.06 0.00 -1.03 0.00 0.00 54.13 53.97 1pg7 s LEU 20 Cb -0.18 -2.35 -0.04 0.00 0.03 0.00 0.00 46.19 43.65 1pg7 s LEU 20 CO -0.26 0.36 -0.11 -0.44 0.23 0.00 0.00 176.35 176.13 1pg7 s SER 21 N -1.11 4.34 -0.33 2.29 0.01 0.19 -1.84 113.70 117.25 1pg7 s SER 21 Ca 0.20 -0.32 -0.01 0.00 1.31 0.00 0.00 55.95 57.13 1pg7 s SER 21 Cb -0.14 -0.86 0.11 0.00 0.21 0.00 0.00 66.02 65.34 1pg7 s SER 21 CO 0.09 0.22 0.14 0.00 0.41 0.00 0.00 173.24 174.11 1pg7 s ALA 23 N 1.44 3.68 0.21 0.00 0.00 0.39 -1.41 121.76 126.08 1pg7 s ALA 23 Ca 0.12 0.14 -0.02 0.00 0.00 0.00 0.00 51.96 52.20 1pg7 s ALA 23 Cb -0.19 -3.51 -0.05 0.00 0.00 0.00 0.00 23.12 19.37 1pg7 s ALA 23 CO -0.20 -1.03 0.43 0.00 0.00 0.00 0.00 175.76 174.95 1pg7 s ALA 24 N 3.14 3.78 -0.06 0.00 0.00 -0.20 -1.30 121.76 127.11 1pg7 s ALA 24 Ca 0.43 -0.74 -0.13 0.00 0.00 0.00 0.00 51.96 51.53 1pg7 s ALA 24 Cb -0.15 -2.08 0.02 0.00 0.00 0.00 0.00 23.12 20.91 1pg7 s ALA 24 CO 0.06 0.42 0.30 -1.12 0.00 0.00 0.00 175.76 175.42 1pg7 s SER 25 N -3.08 -0.24 0.00 0.00 0.01 -0.59 -4.88 113.70 104.92 1pg7 s SER 25 Ca 0.40 0.31 0.00 0.00 1.31 0.00 0.00 55.95 57.97 1pg7 s SER 25 Cb -0.11 0.45 0.00 0.00 0.21 0.00 0.00 66.02 66.57 1pg7 s SER 25 CO 0.29 -0.29 0.00 0.61 0.41 0.00 0.00 173.24 174.25 1pg7 n GLY 26 N 2.01 0.61 3.74 3.44 0.00 -1.25 -1.11 105.19 112.62 1pg7 n GLY 26 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.85 1pg7 n GLY 26 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1pg7 s PHE 27 N -2.25 -0.03 -0.21 1.61 -0.71 -1.26 -4.54 117.98 110.59 1pg7 s PHE 27 Ca 0.00 -0.14 -0.02 0.00 -1.04 0.00 0.00 56.93 55.73 1pg7 s PHE 27 Cb 0.00 0.58 0.00 0.00 -1.21 0.00 0.00 43.02 42.39 1pg7 s PHE 27 CO 0.00 -0.44 -0.10 -0.80 -1.34 0.00 0.00 175.22 172.54 1pg7 s ASN 28 N -3.17 3.90 0.53 1.98 0.01 -1.26 -4.97 114.94 111.95 1pg7 s ASN 28 Ca 0.17 -0.48 0.25 0.00 -0.71 0.00 0.00 52.86 52.10 1pg7 s ASN 28 Cb 0.02 -1.65 1.39 0.00 0.41 0.00 0.00 41.25 41.42 1pg7 s ASN 28 CO -0.01 -0.01 1.99 0.16 -1.51 0.00 0.00 177.10 177.72 1pg7 h ILE 29 N 5.78 0.73 -0.58 0.60 -0.00 -1.92 -1.10 117.51 121.02 1pg7 h ILE 29 Ca -0.43 -0.01 0.17 0.00 -0.00 0.00 0.00 64.86 64.59 1pg7 h ILE 29 Cb 1.15 0.71 -0.02 0.00 -0.00 0.00 0.00 36.82 38.66 1pg7 h ILE 29 CO 0.61 0.00 0.42 0.50 -0.00 0.00 0.00 178.15 179.69 1pg7 h LYS 30 N 0.01 0.00 -0.20 0.16 3.64 -1.94 -1.66 116.57 116.59 1pg7 h LYS 30 Ca 0.26 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.64 1pg7 h LYS 30 Cb 1.04 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.86 1pg7 h LYS 30 CO -0.01 0.00 0.00 0.39 -2.27 0.00 0.00 179.45 177.56 1pg7 n GLU 31 N -4.32 2.36 -4.23 1.90 1.02 -0.42 -4.74 120.64 112.21 1pg7 n GLU 31 Ca 0.11 -2.01 -0.16 0.00 -0.02 0.00 0.00 57.16 55.07 1pg7 n GLU 31 Cb 0.66 -1.48 -0.11 0.00 -0.02 0.00 0.00 31.44 30.49 1pg7 n GLU 31 CO 0.00 0.00 0.00 0.71 1.18 0.00 0.00 177.13 179.02 1pg7 s TYR 32 N -1.76 1.31 -0.10 -0.32 1.51 -0.63 -4.98 117.35 112.38 1pg7 s TYR 32 Ca 0.34 -0.62 -0.30 0.00 -1.01 0.00 0.00 57.07 55.48 1pg7 s TYR 32 Cb 0.21 -0.68 -0.01 0.00 -0.11 0.00 0.00 41.96 41.37 1pg7 s TYR 32 CO 0.31 0.11 1.03 0.71 -1.11 0.00 0.00 175.55 176.60 1pg7 s TYR 33 N -2.49 3.48 -0.08 2.71 1.51 -1.26 -4.36 117.35 116.86 1pg7 s TYR 33 Ca 0.10 1.55 0.01 0.00 -1.01 0.00 0.00 57.07 57.72 1pg7 s TYR 33 Cb -0.03 -3.21 -0.03 0.00 -0.11 0.00 0.00 41.96 38.58 1pg7 s TYR 33 CO 0.02 -0.35 -0.08 -1.64 -1.11 0.00 0.00 175.55 172.39 1pg7 s MET 34 N 2.02 2.90 0.33 -0.62 -1.94 -1.15 -0.92 119.30 119.92 1pg7 s MET 34 Ca 0.49 -0.58 0.04 0.00 -1.71 0.00 0.00 55.69 53.93 1pg7 s MET 34 Cb -0.19 -2.60 -0.06 0.00 2.01 0.00 0.00 34.83 33.98 1pg7 s MET 34 CO 0.19 0.55 0.05 -1.01 -0.01 0.00 0.00 175.02 174.78 1pg7 s HIS 35 N -0.51 2.00 -0.04 -0.03 3.76 0.29 -0.96 115.29 119.79 1pg7 s HIS 35 Ca 0.07 -0.92 0.02 0.00 -0.15 0.00 0.00 55.06 54.08 1pg7 s HIS 35 Cb -0.12 -1.30 0.01 0.00 1.11 0.00 0.00 32.58 32.28 1pg7 s HIS 35 CO 0.02 0.06 -0.08 -1.58 -0.85 0.00 0.00 174.74 172.30 1pg7 s TRP 36 N -3.24 1.01 0.07 1.40 0.52 -0.64 -1.18 118.94 116.88 1pg7 s TRP 36 Ca 0.36 -0.30 0.05 0.00 0.02 0.00 0.00 56.10 56.23 1pg7 s TRP 36 Cb 0.08 -0.77 -0.03 0.00 -1.15 0.00 0.00 33.47 31.60 1pg7 s TRP 36 CO 0.15 -0.17 -0.14 0.08 0.02 0.00 0.00 176.95 176.89 1pg7 s VAL 37 N 0.54 1.10 0.09 4.03 1.01 0.31 -1.60 120.40 125.89 1pg7 s VAL 37 Ca -0.09 -1.29 0.00 0.00 0.00 0.00 0.00 61.98 60.60 1pg7 s VAL 37 Cb -0.12 -1.06 -0.04 0.00 0.00 0.00 0.00 36.38 35.15 1pg7 s VAL 37 CO 0.01 -0.22 -0.03 0.00 0.00 0.00 0.00 175.10 174.86 1pg7 s ARG 38 N -1.72 0.78 -0.20 2.72 1.70 -0.38 0.14 118.95 121.98 1pg7 s ARG 38 Ca -0.02 -1.32 -0.04 0.00 -0.47 0.00 0.00 55.73 53.88 1pg7 s ARG 38 Cb -0.10 0.00 0.10 0.00 -0.57 0.00 0.00 34.95 34.38 1pg7 s ARG 38 CO 0.02 -0.09 0.26 -1.14 -1.08 0.00 0.00 175.30 173.27 1pg7 s GLN 39 N -3.90 0.22 0.58 3.89 0.74 -0.10 -0.69 119.66 120.39 1pg7 s GLN 39 Ca 0.12 0.32 -0.18 0.00 0.05 0.00 0.00 55.36 55.68 1pg7 s GLN 39 Cb 0.07 -0.95 -0.04 0.00 1.10 0.00 0.00 33.01 33.19 1pg7 s GLN 39 CO -0.05 -0.62 1.10 0.00 -0.55 0.00 0.00 175.29 175.16 1pg7 s ALA 40 N 2.38 2.67 -0.28 1.58 0.00 -1.26 -0.70 121.76 126.15 1pg7 s ALA 40 Ca 0.08 0.63 -0.41 0.00 0.00 0.00 0.00 51.96 52.25 1pg7 s ALA 40 Cb -0.15 -3.31 -0.17 0.00 0.00 0.00 0.00 23.12 19.49 1pg7 s ALA 40 CO -0.12 -0.84 1.65 -2.30 0.00 0.00 0.00 175.76 174.14 1pg7 n PRO 41 N -1.69 0.85 -1.36 0.00 -0.02 -1.26 -1.02 135.00 130.49 1pg7 n PRO 41 Ca 0.10 0.31 -0.12 0.00 -2.02 0.00 0.00 63.50 61.77 1pg7 n PRO 41 Cb 0.52 -1.94 -0.05 0.00 -0.02 0.00 0.00 33.50 32.00 1pg7 n PRO 41 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1pg7 n GLY 42 N 3.89 1.28 2.88 -1.23 0.00 -1.26 -4.99 105.19 105.77 1pg7 n GLY 42 Ca 0.26 -0.20 -0.23 0.00 0.00 0.00 0.00 46.02 45.86 1pg7 n GLY 42 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1pg7 n LYS 43 N -1.93 0.95 -1.28 1.61 4.76 -0.19 -5.15 118.16 116.93 1pg7 n LYS 43 Ca -0.12 -2.76 -0.18 0.00 -2.87 0.00 0.00 58.31 52.37 1pg7 n LYS 43 Cb 0.50 0.51 0.13 0.00 -1.84 0.00 0.00 35.03 34.32 1pg7 n LYS 43 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1pg7 n GLY 44 N 0.07 -1.19 3.84 0.72 0.00 -1.26 -4.76 105.19 102.62 1pg7 n GLY 44 Ca -0.09 -1.72 -0.35 0.00 0.00 0.00 0.00 46.02 43.86 1pg7 n GLY 44 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1pg7 s LEU 45 N 0.00 4.34 -0.02 0.99 1.43 -1.26 -4.27 118.68 119.90 1pg7 s LEU 45 Ca 0.48 1.12 0.04 0.00 -1.03 0.00 0.00 54.13 54.74 1pg7 s LEU 45 Cb -0.01 -3.30 -0.01 0.00 0.03 0.00 0.00 46.19 42.90 1pg7 s LEU 45 CO 0.33 0.10 -0.13 -1.61 0.23 0.00 0.00 176.35 175.27 1pg7 s GLU 46 N -1.95 1.09 -0.06 1.70 2.02 0.13 -5.00 118.70 116.63 1pg7 s GLU 46 Ca 0.38 -0.45 -0.22 0.00 0.02 0.00 0.00 54.97 54.71 1pg7 s GLU 46 Cb -0.15 -1.03 -0.04 0.00 0.10 0.00 0.00 34.13 33.00 1pg7 s GLU 46 CO 0.19 0.25 0.63 -0.46 0.02 0.00 0.00 175.26 175.89 1pg7 s TRP 47 N -0.20 3.59 -0.21 1.61 -0.00 -1.26 -1.25 118.94 121.21 1pg7 s TRP 47 Ca 0.03 1.15 -0.16 0.00 -0.00 0.00 0.00 56.10 57.12 1pg7 s TRP 47 Cb -0.06 -2.70 -0.11 0.00 -0.00 0.00 0.00 33.47 30.60 1pg7 s TRP 47 CO -0.00 0.16 -0.18 0.28 -0.00 0.00 0.00 176.95 177.21 1pg7 n VAL 48 N 3.52 1.50 -1.04 5.86 0.31 -0.62 -4.66 118.33 123.21 1pg7 n VAL 48 Ca -0.04 -0.07 0.00 0.00 -0.01 0.00 0.00 64.34 64.22 1pg7 n VAL 48 Cb 0.51 -2.12 0.00 0.00 -0.91 0.00 0.00 33.84 31.32 1pg7 n VAL 48 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1pg7 n GLY 49 N 1.41 -1.43 3.20 2.92 0.00 -1.20 -1.51 105.19 108.59 1pg7 n GLY 49 Ca -0.31 -1.02 -0.10 0.00 0.00 0.00 0.00 46.02 44.59 1pg7 n GLY 49 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1pg7 s LEU 50 N 0.00 1.53 -0.13 0.99 0.05 -0.54 -1.63 118.68 118.96 1pg7 s LEU 50 Ca 0.00 -1.12 -0.00 0.00 0.05 0.00 0.00 54.13 53.06 1pg7 s LEU 50 Cb 0.00 0.56 0.03 0.00 -2.05 0.00 0.00 46.19 44.72 1pg7 s LEU 50 CO 0.00 -0.78 -0.08 -0.51 -0.55 0.00 0.00 176.35 174.43 1pg7 s ILE 51 N -4.03 1.12 0.03 1.48 2.07 -0.14 -2.29 121.20 119.45 1pg7 s ILE 51 Ca 0.22 -0.39 -0.30 0.00 -1.41 0.00 0.00 60.65 58.77 1pg7 s ILE 51 Cb 0.06 -1.15 -0.04 0.00 0.13 0.00 0.00 42.46 41.46 1pg7 s ILE 51 CO 0.01 0.35 1.07 -0.62 -1.91 0.00 0.00 174.94 173.85 1pg7 s ASP 52 N 1.66 7.25 0.28 4.50 -1.08 -0.16 -2.93 116.67 126.19 1pg7 s ASP 52 Ca 0.04 1.82 0.24 0.00 -0.52 0.00 0.00 52.55 54.13 1pg7 s ASP 52 Cb -0.13 -2.57 0.47 0.00 -1.46 0.00 0.00 42.92 39.23 1pg7 s ASP 52 CO -0.09 -0.35 1.56 1.55 0.52 0.00 0.00 175.17 178.37 1pg7 h PRO 52 N 6.76 0.00 -0.36 4.34 0.13 -1.85 -2.00 132.00 139.03 1pg7 h PRO 52 Ca -0.41 0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 64.60 1pg7 h PRO 52 Cb 1.22 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.33 1pg7 h PRO 52 CO 0.78 0.00 -0.27 0.93 -0.23 0.00 0.00 178.00 179.20 1pg7 h GLU 53 N 0.00 0.74 0.00 0.86 5.08 -1.93 -3.40 114.58 115.93 1pg7 h GLU 53 Ca 0.00 -0.32 0.00 0.00 -1.00 0.00 0.00 59.36 58.04 1pg7 h GLU 53 Cb 0.87 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.09 1pg7 h GLU 53 CO 0.00 0.93 0.00 0.00 -1.00 0.00 0.00 179.01 178.94 1pg7 n GLN 54 N -4.09 0.00 -0.48 2.33 0.00 -1.26 -5.04 117.38 108.83 1pg7 n GLN 54 Ca -0.00 -0.10 0.00 0.00 0.00 0.00 0.00 57.00 56.90 1pg7 n GLN 54 Cb 0.46 -0.34 0.00 0.00 0.00 0.00 0.00 30.24 30.36 1pg7 n GLN 54 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1pg7 n GLY 55 N 0.00 0.75 3.75 2.61 0.00 -0.75 -5.05 105.19 106.50 1pg7 n GLY 55 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.64 1pg7 n GLY 55 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1pg7 s ASN 56 N -2.23 5.09 -0.07 1.61 0.01 -1.25 -4.72 114.94 113.38 1pg7 s ASN 56 Ca 0.00 2.65 0.02 0.00 -0.71 0.00 0.00 52.86 54.81 1pg7 s ASN 56 Cb 0.00 -2.62 0.02 0.00 0.41 0.00 0.00 41.25 39.05 1pg7 s ASN 56 CO 0.00 -1.68 -0.11 0.42 -1.51 0.00 0.00 177.10 174.22 1pg7 s THR 57 N -1.38 1.12 -0.04 1.60 -4.23 -1.26 -0.99 115.64 110.46 1pg7 s THR 57 Ca 0.75 -0.45 0.05 0.00 -1.18 0.00 0.00 61.69 60.87 1pg7 s THR 57 Cb -0.38 -1.04 -0.01 0.00 1.34 0.00 0.00 72.50 72.42 1pg7 s THR 57 CO 0.42 0.36 -0.20 -0.63 -0.54 0.00 0.00 174.62 174.03 1pg7 s ILE 58 N 0.83 1.67 0.20 2.99 -1.09 -0.97 -5.00 121.20 119.83 1pg7 s ILE 58 Ca -0.11 -0.87 0.03 0.00 -2.23 0.00 0.00 60.65 57.47 1pg7 s ILE 58 Cb -0.15 -1.42 -0.05 0.00 -1.58 0.00 0.00 42.46 39.26 1pg7 s ILE 58 CO 0.02 0.47 -0.02 -0.31 -1.23 0.00 0.00 174.94 173.87 1pg7 s TYR 59 N -0.16 1.43 0.07 3.97 1.51 -1.26 -1.46 117.35 121.45 1pg7 s TYR 59 Ca -0.01 -0.91 -0.30 0.00 -1.01 0.00 0.00 57.07 54.84 1pg7 s TYR 59 Cb -0.11 -0.81 -0.06 0.00 -0.11 0.00 0.00 41.96 40.87 1pg7 s TYR 59 CO 0.02 -0.05 1.17 0.34 -1.11 0.00 0.00 175.55 175.92 1pg7 s ASP 60 N -3.25 7.13 0.56 2.29 -1.08 -0.57 -4.89 116.67 116.85 1pg7 s ASP 60 Ca 0.25 1.99 0.29 0.00 -0.52 0.00 0.00 52.55 54.56 1pg7 s ASP 60 Cb 0.05 -2.58 1.46 0.00 -1.46 0.00 0.00 42.92 40.39 1pg7 s ASP 60 CO 0.06 -0.42 1.93 -0.65 0.52 0.00 0.00 175.17 176.61 1pg7 h PRO 61 N 6.61 0.00 -1.04 4.34 0.11 -1.98 -2.19 132.00 137.85 1pg7 h PRO 61 Ca -0.42 0.00 0.28 0.00 0.11 0.00 0.00 66.00 65.98 1pg7 h PRO 61 Cb 1.21 0.00 -0.07 0.00 0.11 0.00 0.00 31.00 32.26 1pg7 h PRO 61 CO 0.80 0.00 0.72 0.87 -0.21 0.00 0.00 178.00 180.17 1pg7 h LYS 62 N 0.00 0.19 0.00 1.05 1.57 -1.98 0.24 116.57 117.63 1pg7 h LYS 62 Ca 0.29 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 59.06 1pg7 h LYS 62 Cb 1.28 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 33.54 1pg7 h LYS 62 CO -0.00 0.12 0.00 1.19 -0.57 0.00 0.00 179.45 180.19 1pg7 n PHE 63 N -4.41 0.00 -3.06 -1.35 3.72 -0.82 -4.97 117.46 106.58 1pg7 n PHE 63 Ca 0.23 0.00 -0.10 0.00 -0.05 0.00 0.00 57.45 57.54 1pg7 n PHE 63 Cb 0.99 -0.35 0.00 0.00 -0.94 0.00 0.00 39.48 39.19 1pg7 n PHE 63 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1pg7 n GLN 64 N -1.35 -0.57 -0.58 -1.08 10.64 0.84 -0.91 117.38 124.38 1pg7 n GLN 64 Ca 0.11 0.19 0.00 0.00 -1.83 0.00 0.00 57.00 55.48 1pg7 n GLN 64 Cb 0.25 -0.71 0.00 0.00 -0.86 0.00 0.00 30.24 28.92 1pg7 n GLN 64 CO 0.00 0.00 0.00 -0.25 -1.83 0.00 0.00 177.06 174.98 1pg7 n ASP 65 N -0.55 0.00 0.15 2.61 8.00 -1.26 -4.83 116.55 120.66 1pg7 n ASP 65 Ca -0.11 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.40 1pg7 n ASP 65 Cb 0.24 -1.38 0.19 0.00 -0.02 0.00 0.00 41.12 40.15 1pg7 n ASP 65 CO 0.00 0.00 0.00 0.03 -0.39 0.00 0.00 177.20 176.84 1pg7 h ARG 66 N 1.15 0.00 -5.51 -1.24 3.08 -1.38 -3.44 114.38 107.04 1pg7 h ARG 66 Ca 0.00 0.00 -0.64 0.00 0.07 0.00 0.00 59.98 59.41 1pg7 h ARG 66 Cb 0.00 0.00 -0.10 0.00 0.08 0.00 0.00 29.97 29.95 1pg7 h ARG 66 CO 0.00 0.57 -0.50 0.00 -1.07 0.00 0.00 179.97 178.97 1pg7 s ALA 67 N -3.49 3.74 -0.16 0.04 0.00 -1.26 -2.12 121.76 118.51 1pg7 s ALA 67 Ca -0.00 -0.68 -0.00 0.00 0.00 0.00 0.00 51.96 51.28 1pg7 s ALA 67 Cb 0.12 -2.00 0.04 0.00 0.00 0.00 0.00 23.12 21.28 1pg7 s ALA 67 CO 0.74 0.43 -0.06 0.99 0.00 0.00 0.00 175.76 177.86 1pg7 s THR 68 N -0.45 1.16 -0.15 0.00 2.01 0.75 -4.97 115.64 113.99 1pg7 s THR 68 Ca 0.12 -0.62 -0.08 0.00 0.31 0.00 0.00 61.69 61.41 1pg7 s THR 68 Cb -0.12 -1.30 -0.04 0.00 0.01 0.00 0.00 72.50 71.05 1pg7 s THR 68 CO 0.02 0.17 0.14 -0.63 -0.69 0.00 0.00 174.62 173.63 1pg7 s ILE 69 N 1.62 5.46 0.35 1.82 1.01 -1.26 -0.58 121.20 129.62 1pg7 s ILE 69 Ca 0.01 0.21 0.03 0.00 0.00 0.00 0.00 60.65 60.90 1pg7 s ILE 69 Cb -0.15 -3.43 -0.01 0.00 0.01 0.00 0.00 42.46 38.88 1pg7 s ILE 69 CO -0.08 0.55 0.40 -0.94 0.00 0.00 0.00 174.94 174.87 1pg7 s SER 70 N -0.46 1.41 -0.14 3.58 1.04 -0.78 -4.98 113.70 113.37 1pg7 s SER 70 Ca 0.12 -1.66 -0.29 0.00 0.48 0.00 0.00 55.95 54.60 1pg7 s SER 70 Cb -0.12 0.63 0.07 0.00 0.10 0.00 0.00 66.02 66.71 1pg7 s SER 70 CO 0.02 -1.22 0.71 0.00 0.98 0.00 0.00 173.24 173.72 1pg7 s ALA 71 N -3.11 -1.78 -0.28 5.32 0.00 -1.26 -0.09 121.76 120.55 1pg7 s ALA 71 Ca 0.36 1.60 0.03 0.00 0.00 0.00 0.00 51.96 53.94 1pg7 s ALA 71 Cb 0.01 -0.48 0.07 0.00 0.00 0.00 0.00 23.12 22.72 1pg7 s ALA 71 CO 0.25 -0.36 -0.04 0.34 0.00 0.00 0.00 175.76 175.96 1pg7 s ASP 72 N -0.59 4.38 0.24 0.00 -1.08 0.07 -5.00 116.67 114.70 1pg7 s ASP 72 Ca -0.06 -1.59 -0.05 0.00 -0.52 0.00 0.00 52.55 50.32 1pg7 s ASP 72 Cb -0.02 -1.45 0.33 0.00 -1.46 0.00 0.00 42.92 40.32 1pg7 s ASP 72 CO 0.06 -0.27 1.85 0.78 0.52 0.00 0.00 175.17 178.12 1pg7 h ASN 73 N 7.78 0.85 -0.01 -0.34 2.35 -1.96 0.85 115.58 125.09 1pg7 h ASN 73 Ca -0.14 0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.63 1pg7 h ASN 73 Cb 1.04 -0.16 -0.00 0.00 0.05 0.00 0.00 38.32 39.25 1pg7 h ASN 73 CO 0.47 0.55 0.01 0.77 -1.65 0.00 0.00 177.43 177.58 1pg7 h SER 74 N 0.99 0.00 -0.01 5.81 4.64 -1.95 -1.14 113.55 121.88 1pg7 h SER 74 Ca 0.37 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.69 1pg7 h SER 74 Cb 0.16 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.25 1pg7 h SER 74 CO -0.17 0.00 -0.41 0.29 -0.87 0.00 0.00 176.83 175.67 1pg7 n LYS 75 N -4.24 1.57 -3.74 4.77 5.02 -0.75 -4.97 118.16 115.82 1pg7 n LYS 75 Ca -0.03 -0.76 -0.28 0.00 -2.02 0.00 0.00 58.31 55.21 1pg7 n LYS 75 Cb 0.10 -1.32 0.02 0.00 -0.02 0.00 0.00 35.03 33.81 1pg7 n LYS 75 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 1pg7 n ASN 76 N -0.23 -4.69 -4.24 4.39 5.15 0.22 -4.71 115.26 111.15 1pg7 n ASN 76 Ca 0.07 -0.67 -0.26 0.00 -0.60 0.00 0.00 54.58 53.12 1pg7 n ASN 76 Cb 0.36 -3.77 -0.15 0.00 -0.53 0.00 0.00 39.78 35.69 1pg7 n ASN 76 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 1pg7 s THR 77 N -3.21 1.67 0.24 -0.44 2.01 -1.02 -1.03 115.64 113.85 1pg7 s THR 77 Ca 0.59 -1.09 0.08 0.00 0.31 0.00 0.00 61.69 61.58 1pg7 s THR 77 Cb -0.30 -1.43 -0.04 0.00 0.01 0.00 0.00 72.50 70.75 1pg7 s THR 77 CO 0.73 0.30 0.07 0.00 -0.69 0.00 0.00 174.62 175.03 1pg7 s ALA 78 N -0.68 3.34 0.06 7.40 0.00 -0.50 -0.75 121.76 130.63 1pg7 s ALA 78 Ca 0.08 -1.50 0.03 0.00 0.00 0.00 0.00 51.96 50.56 1pg7 s ALA 78 Cb -0.09 -1.03 -0.03 0.00 0.00 0.00 0.00 23.12 21.98 1pg7 s ALA 78 CO 0.01 0.31 -0.08 0.71 0.00 0.00 0.00 175.76 176.70 1pg7 s TYR 79 N -2.13 0.82 -0.07 0.00 2.02 0.87 -0.75 117.35 118.10 1pg7 s TYR 79 Ca 0.31 -0.60 -0.00 0.00 -0.37 0.00 0.00 57.07 56.41 1pg7 s TYR 79 Cb -0.08 -0.48 0.02 0.00 -0.40 0.00 0.00 41.96 41.03 1pg7 s TYR 79 CO 0.22 -0.07 -0.03 -1.17 -1.57 0.00 0.00 175.55 172.92 1pg7 s LEU 80 N -2.01 1.00 -0.07 -1.29 2.96 -0.76 -1.87 118.68 116.62 1pg7 s LEU 80 Ca -0.03 -0.14 0.05 0.00 -0.22 0.00 0.00 54.13 53.78 1pg7 s LEU 80 Cb -0.06 -0.52 -0.01 0.00 0.50 0.00 0.00 46.19 46.09 1pg7 s LEU 80 CO -0.01 -0.12 -0.22 -1.58 -1.32 0.00 0.00 176.35 173.11 1pg7 s GLN 81 N 1.49 2.75 -0.02 1.98 -0.44 0.25 -1.00 119.66 124.67 1pg7 s GLN 81 Ca -0.02 -0.84 0.00 0.00 -2.50 0.00 0.00 55.36 52.00 1pg7 s GLN 81 Cb -0.13 -2.28 0.03 0.00 -1.64 0.00 0.00 33.01 28.98 1pg7 s GLN 81 CO -0.03 0.36 0.02 1.41 0.50 0.00 0.00 175.29 177.55 1pg7 s MET 82 N -0.08 0.02 0.45 1.67 1.75 -0.73 -0.18 119.30 122.20 1pg7 s MET 82 Ca -0.05 0.15 0.07 0.00 -1.25 0.00 0.00 55.69 54.62 1pg7 s MET 82 Cb -0.14 -0.27 -0.00 0.00 2.84 0.00 0.00 34.83 37.25 1pg7 s MET 82 CO 0.04 -0.15 0.39 -0.80 -0.65 0.00 0.00 175.02 173.85 1pg7 s ASN 82 N 0.98 4.90 -1.42 1.11 0.02 -0.90 -0.87 114.94 118.76 1pg7 s ASN 82 Ca -0.08 -0.90 -0.07 0.00 -1.02 0.00 0.00 52.86 50.79 1pg7 s ASN 82 Cb -0.12 -0.29 0.01 0.00 0.02 0.00 0.00 41.25 40.87 1pg7 s ASN 82 CO -0.03 -0.79 0.31 -1.20 0.02 0.00 0.00 177.10 175.42 1pg7 n SER 82 N -1.61 -0.76 -4.77 -1.22 7.64 -0.96 -4.87 113.62 107.08 1pg7 n SER 82 Ca 0.03 -1.17 -0.41 0.00 1.01 0.00 0.00 58.87 58.33 1pg7 n SER 82 Cb 0.63 -2.25 -0.01 0.00 -1.01 0.00 0.00 64.21 61.56 1pg7 n SER 82 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1pg7 s LEU 82 N -7.18 4.39 0.37 -3.43 1.43 -0.73 -4.61 118.68 108.91 1pg7 s LEU 82 Ca 0.11 2.82 0.05 0.00 -1.03 0.00 0.00 54.13 56.09 1pg7 s LEU 82 Cb -0.06 -3.66 -0.07 0.00 0.03 0.00 0.00 46.19 42.44 1pg7 s LEU 82 CO 0.95 -0.66 0.04 0.00 0.23 0.00 0.00 176.35 176.90 1pg7 s ARG 83 N -1.88 1.80 0.32 1.70 1.70 -1.26 -0.17 118.95 121.16 1pg7 s ARG 83 Ca 0.50 -2.02 0.10 0.00 -0.47 0.00 0.00 55.73 53.85 1pg7 s ARG 83 Cb -0.42 -1.23 0.96 0.00 -0.57 0.00 0.00 34.95 33.69 1pg7 s ARG 83 CO 0.57 -0.13 1.66 0.00 -1.08 0.00 0.00 175.30 176.32 1pg7 h ALA 84 N 1.94 1.74 0.00 7.88 0.00 -1.96 0.53 119.26 129.38 1pg7 h ALA 84 Ca -0.42 0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.68 1pg7 h ALA 84 Cb 1.24 0.19 0.00 0.00 0.00 0.00 0.00 17.79 19.23 1pg7 h ALA 84 CO 0.75 -0.51 0.00 -0.85 0.00 0.00 0.00 179.25 178.63 1pg7 n GLU 85 N -5.09 0.21 0.00 0.00 0.28 -1.26 -1.83 120.64 112.94 1pg7 n GLU 85 Ca 0.28 0.15 0.12 0.00 -0.16 0.00 0.00 57.16 57.55 1pg7 n GLU 85 Cb 0.87 -1.50 0.22 0.00 1.43 0.00 0.00 31.44 32.46 1pg7 n GLU 85 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 1pg7 n ASP 86 N -1.29 0.99 -4.64 -1.84 8.00 0.18 -4.83 116.55 113.11 1pg7 n ASP 86 Ca 0.07 -0.78 -0.42 0.00 0.71 0.00 0.00 54.79 54.37 1pg7 n ASP 86 Cb 0.12 0.33 -0.03 0.00 -0.02 0.00 0.00 41.12 41.53 1pg7 n ASP 86 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1pg7 s THR 87 N -2.73 3.12 -0.07 -3.53 2.01 -0.76 -4.87 115.64 108.80 1pg7 s THR 87 Ca 0.17 0.13 -0.32 0.00 0.31 0.00 0.00 61.69 61.99 1pg7 s THR 87 Cb 0.18 -3.11 0.12 0.00 0.01 0.00 0.00 72.50 69.70 1pg7 s THR 87 CO 0.63 -0.04 1.21 0.00 -0.69 0.00 0.00 174.62 175.73 1pg7 s ALA 88 N 5.69 -2.10 -0.22 7.40 0.00 -0.55 -4.34 121.76 127.64 1pg7 s ALA 88 Ca 0.90 1.02 -0.22 0.00 0.00 0.00 0.00 51.96 53.65 1pg7 s ALA 88 Cb -0.37 0.20 -0.02 0.00 0.00 0.00 0.00 23.12 22.93 1pg7 s ALA 88 CO 0.38 -0.85 0.72 0.08 0.00 0.00 0.00 175.76 176.08 1pg7 s VAL 89 N -2.53 4.94 -0.20 0.00 1.01 0.12 -1.16 120.40 122.58 1pg7 s VAL 89 Ca 0.12 1.35 -0.09 0.00 0.00 0.00 0.00 61.98 63.36 1pg7 s VAL 89 Cb 0.02 -4.02 -0.05 0.00 0.00 0.00 0.00 36.38 32.33 1pg7 s VAL 89 CO -0.04 0.03 0.10 -0.31 0.00 0.00 0.00 175.10 174.88 1pg7 s TYR 90 N 2.34 3.32 0.16 5.22 1.51 0.99 -0.92 117.35 129.97 1pg7 s TYR 90 Ca 0.31 0.18 0.07 0.00 -1.01 0.00 0.00 57.07 56.63 1pg7 s TYR 90 Cb -0.16 -2.13 -0.04 0.00 -0.11 0.00 0.00 41.96 39.52 1pg7 s TYR 90 CO 0.09 0.19 -0.02 0.71 -1.11 0.00 0.00 175.55 175.42 1pg7 s TYR 91 N 0.46 2.83 -0.14 2.71 2.02 0.37 -1.48 117.35 124.13 1pg7 s TYR 91 Ca 0.06 -0.13 -0.01 0.00 -0.37 0.00 0.00 57.07 56.61 1pg7 s TYR 91 Cb -0.12 -1.39 -0.02 0.00 -0.40 0.00 0.00 41.96 40.03 1pg7 s TYR 91 CO -0.00 0.50 -0.11 0.00 -1.57 0.00 0.00 175.55 174.37 1pg7 s ALA 93 N 0.45 0.75 -0.01 0.00 0.00 -0.32 -1.66 121.76 120.97 1pg7 s ALA 93 Ca -0.08 -0.50 -0.13 0.00 0.00 0.00 0.00 51.96 51.25 1pg7 s ALA 93 Cb -0.15 -0.14 -0.05 0.00 0.00 0.00 0.00 23.12 22.77 1pg7 s ALA 93 CO 0.04 0.15 0.36 0.50 0.00 0.00 0.00 175.76 176.81 1pg7 s ARG 94 N -0.56 3.82 -0.11 0.00 3.52 -0.59 -0.55 118.95 124.48 1pg7 s ARG 94 Ca 0.01 0.30 -0.01 0.00 -0.13 0.00 0.00 55.73 55.90 1pg7 s ARG 94 Cb -0.05 -3.19 -0.03 0.00 -1.56 0.00 0.00 34.95 30.12 1pg7 s ARG 94 CO 0.00 0.69 -0.07 0.34 -0.81 0.00 0.00 175.30 175.46 1pg7 s ASP 95 N -1.14 4.57 -0.06 -2.12 -1.08 -0.10 -1.56 116.67 115.19 1pg7 s ASP 95 Ca 0.23 -0.12 -0.01 0.00 -0.52 0.00 0.00 52.55 52.13 1pg7 s ASP 95 Cb -0.16 -1.48 0.03 0.00 -1.46 0.00 0.00 42.92 39.85 1pg7 s ASP 95 CO 0.12 0.25 0.01 -0.89 0.52 0.00 0.00 175.17 175.19 1pg7 s THR 96 N -0.15 0.25 -1.41 1.71 2.01 -0.74 -4.12 115.64 113.19 1pg7 s THR 96 Ca 0.02 0.18 -0.07 0.00 0.31 0.00 0.00 61.69 62.13 1pg7 s THR 96 Cb -0.13 -0.42 0.04 0.00 0.01 0.00 0.00 72.50 72.00 1pg7 s THR 96 CO 0.03 0.23 0.54 0.00 -0.69 0.00 0.00 174.62 174.73 1pg7 n ALA 97 N 5.05 -1.02 -1.02 7.40 0.00 -1.26 -1.83 120.51 127.83 1pg7 n ALA 97 Ca -0.09 0.18 -0.01 0.00 0.00 0.00 0.00 53.44 53.53 1pg7 n ALA 97 Cb 0.50 -3.29 -0.00 0.00 0.00 0.00 0.00 19.45 16.66 1pg7 n ALA 97 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1pg7 n ALA 98 N -3.52 -0.01 -2.49 0.00 0.00 -1.26 -5.01 120.51 108.22 1pg7 n ALA 98 Ca -0.06 0.01 -0.26 0.00 0.00 0.00 0.00 53.44 53.12 1pg7 n ALA 98 Cb 0.58 -0.71 -0.10 0.00 0.00 0.00 0.00 19.45 19.21 1pg7 n ALA 98 CO 0.00 0.00 0.00 1.52 0.00 0.00 0.00 177.50 179.02 1pg7 s TYR 99 N -1.59 2.42 -0.44 0.00 -0.85 -0.76 -5.09 117.35 111.03 1pg7 s TYR 99 Ca 0.00 -0.30 -0.23 0.00 -0.52 0.00 0.00 57.07 56.01 1pg7 s TYR 99 Cb 0.00 -1.16 0.02 0.00 0.38 0.00 0.00 41.96 41.20 1pg7 s TYR 99 CO 0.00 0.54 0.80 -0.06 -1.52 0.00 0.00 175.55 175.32 1pg7 s PHE 100 N -1.85 2.99 -0.04 -3.49 0.08 -1.26 -1.80 117.98 112.61 1pg7 s PHE 100 Ca 0.24 0.23 0.13 0.00 0.12 0.00 0.00 56.93 57.65 1pg7 s PHE 100 Cb -0.08 -3.68 -0.18 0.00 -0.57 0.00 0.00 43.02 38.51 1pg7 s PHE 100 CO 0.13 -0.98 0.85 0.38 -0.10 0.00 0.00 175.22 175.51 1pg7 h ASP 101 N 8.94 0.00 -4.77 1.36 3.04 -1.61 -3.48 116.42 119.91 1pg7 h ASP 101 Ca -0.25 0.00 -0.25 0.00 -3.24 0.00 0.00 57.03 53.29 1pg7 h ASP 101 Cb 1.09 0.00 -0.20 0.00 -1.04 0.00 0.00 39.33 39.17 1pg7 h ASP 101 CO 0.96 0.86 -0.72 -0.31 -2.04 0.00 0.00 179.24 177.99 1pg7 s TYR 102 N -2.72 0.66 0.03 4.15 2.02 -1.25 -5.00 117.35 115.24 1pg7 s TYR 102 Ca -0.03 -0.58 0.01 0.00 -0.37 0.00 0.00 57.07 56.11 1pg7 s TYR 102 Cb 0.08 -0.40 -0.02 0.00 -0.40 0.00 0.00 41.96 41.22 1pg7 s TYR 102 CO 0.82 -0.11 -0.05 -1.58 -1.57 0.00 0.00 175.55 173.06 1pg7 s TRP 103 N -1.77 0.46 0.93 2.71 0.52 -1.26 -1.54 118.94 118.99 1pg7 s TRP 103 Ca -0.07 -0.57 -0.15 0.00 0.02 0.00 0.00 56.10 55.33 1pg7 s TRP 103 Cb -0.07 -0.30 0.17 0.00 -1.15 0.00 0.00 33.47 32.12 1pg7 s TRP 103 CO -0.01 -0.16 1.28 0.20 0.02 0.00 0.00 176.95 178.28 1pg7 s GLY 104 N -1.67 1.72 0.38 0.98 0.00 -0.67 -4.53 107.32 103.54 1pg7 s GLY 104 Ca -0.11 -1.04 0.18 0.00 0.00 0.00 0.00 44.72 43.75 1pg7 s GLY 104 CO -0.01 -0.34 1.78 0.06 0.00 0.00 0.00 173.10 174.59 1pg7 h GLN 105 N -1.54 0.00 0.00 2.90 -0.00 -1.92 -3.45 115.11 111.10 1pg7 h GLN 105 Ca -0.45 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.20 1pg7 h GLN 105 Cb 1.26 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.74 1pg7 h GLN 105 CO 0.45 0.37 0.00 0.41 -0.00 0.00 0.00 178.83 180.06 1pg7 n GLY 106 N -0.02 2.39 3.11 0.06 0.00 -1.26 -5.05 105.19 104.41 1pg7 n GLY 106 Ca -0.01 -1.48 -0.30 0.00 0.00 0.00 0.00 46.02 44.24 1pg7 n GLY 106 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1pg7 s THR 107 N -0.55 1.68 -0.12 2.61 -1.32 -0.55 -4.91 115.64 112.48 1pg7 s THR 107 Ca 0.00 -0.77 -0.27 0.00 -1.21 0.00 0.00 61.69 59.44 1pg7 s THR 107 Cb 0.00 -1.50 -0.02 0.00 -1.51 0.00 0.00 72.50 69.47 1pg7 s THR 107 CO 0.00 0.48 0.91 -0.22 -2.21 0.00 0.00 174.62 173.58 1pg7 s LEU 108 N 0.79 4.24 -0.24 9.08 2.96 -1.26 -0.00 118.68 134.23 1pg7 s LEU 108 Ca -0.10 1.37 -0.03 0.00 -0.22 0.00 0.00 54.13 55.16 1pg7 s LEU 108 Cb -0.16 -3.39 0.02 0.00 0.50 0.00 0.00 46.19 43.16 1pg7 s LEU 108 CO 0.01 -0.38 -0.05 -0.69 -1.32 0.00 0.00 176.35 173.91 1pg7 s VAL 109 N 1.87 3.05 -0.24 1.68 1.01 -0.31 -1.35 120.40 126.12 1pg7 s VAL 109 Ca 0.44 -0.85 -0.07 0.00 0.00 0.00 0.00 61.98 61.50 1pg7 s VAL 109 Cb -0.18 -2.50 -0.03 0.00 0.00 0.00 0.00 36.38 33.68 1pg7 s VAL 109 CO 0.17 0.27 0.05 -0.89 0.00 0.00 0.00 175.10 174.69 1pg7 s THR 110 N 1.38 4.21 -0.34 3.92 2.01 -0.91 -1.49 115.64 124.42 1pg7 s THR 110 Ca 0.02 -0.21 -0.09 0.00 0.31 0.00 0.00 61.69 61.72 1pg7 s THR 110 Cb -0.16 -2.96 0.02 0.00 0.01 0.00 0.00 72.50 69.41 1pg7 s THR 110 CO -0.04 0.36 0.16 -0.69 -0.69 0.00 0.00 174.62 173.72 1pg7 s VAL 111 N 1.48 4.37 -0.09 3.82 1.01 -1.26 -0.78 120.40 128.95 1pg7 s VAL 111 Ca 0.06 -0.76 -0.30 0.00 0.00 0.00 0.00 61.98 60.98 1pg7 s VAL 111 Cb -0.15 -3.36 0.10 0.00 0.00 0.00 0.00 36.38 32.97 1pg7 s VAL 111 CO 0.03 -0.10 0.85 -0.55 0.00 0.00 0.00 175.10 175.32 1pg7 s SER 112 N 1.54 -0.49 0.00 3.32 0.15 -0.50 -4.59 113.70 113.13 1pg7 s SER 112 Ca 0.02 0.47 0.24 0.00 0.70 0.00 0.00 55.95 57.37 1pg7 s SER 112 Cb -0.18 0.41 0.40 0.00 -1.71 0.00 0.00 66.02 64.94 1pg7 s SER 112 CO 0.05 -0.50 1.38 -1.54 1.20 0.00 0.00 173.24 173.84 1pg7 n SER 113 N 0.65 3.04 -4.75 5.45 3.41 -1.26 -4.16 113.62 116.00 1pg7 n SER 113 Ca -0.14 -1.95 -0.37 0.00 -0.26 0.00 0.00 58.87 56.15 1pg7 n SER 113 Cb 0.58 -0.13 0.03 0.00 -0.26 0.00 0.00 64.21 64.43 1pg7 n SER 113 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1pg7 s ALA 114 N -1.73 2.70 0.17 7.33 0.00 -1.26 -5.05 121.76 123.92 1pg7 s ALA 114 Ca 0.34 1.14 0.04 0.00 0.00 0.00 0.00 51.96 53.48 1pg7 s ALA 114 Cb 0.21 -3.49 -0.04 0.00 0.00 0.00 0.00 23.12 19.80 1pg7 s ALA 114 CO 0.31 -1.20 0.22 -1.12 0.00 0.00 0.00 175.76 173.97 1pg7 s SER 115 N -1.30 5.95 0.24 0.00 0.01 -1.26 -5.05 113.70 112.29 1pg7 s SER 115 Ca 0.73 0.01 -0.31 0.00 1.31 0.00 0.00 55.95 57.70 1pg7 s SER 115 Cb -0.35 -1.68 -0.11 0.00 0.21 0.00 0.00 66.02 64.09 1pg7 s SER 115 CO 0.39 0.04 1.62 -0.89 0.41 0.00 0.00 173.24 174.82 1pg7 s THR 116 N -1.79 2.18 -0.19 1.44 2.01 -1.26 -4.68 115.64 113.35 1pg7 s THR 116 Ca 0.33 0.14 -0.09 0.00 0.31 0.00 0.00 61.69 62.38 1pg7 s THR 116 Cb -0.10 -3.09 0.07 0.00 0.01 0.00 0.00 72.50 69.39 1pg7 s THR 116 CO 0.26 0.02 0.43 -0.75 -0.69 0.00 0.00 174.62 173.89 1pg7 s LYS 117 N 0.35 0.39 0.59 4.92 2.20 0.50 -4.96 119.74 123.73 1pg7 s LYS 117 Ca 0.68 0.91 -0.17 0.00 -0.36 0.00 0.00 55.97 57.03 1pg7 s LYS 117 Cb -0.47 0.12 -0.03 0.00 -1.51 0.00 0.00 37.83 35.93 1pg7 s LYS 117 CO 0.39 -0.19 1.09 0.20 -0.36 0.00 0.00 175.35 176.48 1pg7 s GLY 118 N 1.86 2.26 0.56 5.54 0.00 -1.26 -1.47 107.32 114.82 1pg7 s GLY 118 Ca -0.07 0.54 -0.14 0.00 0.00 0.00 0.00 44.72 45.05 1pg7 s GLY 118 CO -0.13 0.88 1.01 2.56 0.00 0.00 0.00 173.10 177.41 1pg7 s PRO 119 N -3.85 3.77 -0.14 2.90 0.04 -1.26 -4.62 135.00 131.83 1pg7 s PRO 119 Ca 0.67 0.88 -0.10 0.00 0.04 0.00 0.00 61.00 62.48 1pg7 s PRO 119 Cb -0.19 -2.11 -0.05 0.00 0.04 0.00 0.00 34.50 32.20 1pg7 s PRO 119 CO 0.35 -0.43 0.19 -1.12 0.04 0.00 0.00 177.00 176.04 1pg7 s SER 120 N -3.54 6.38 -0.25 6.66 0.01 -0.03 -4.91 113.70 118.02 1pg7 s SER 120 Ca 0.57 0.45 -0.02 0.00 1.31 0.00 0.00 55.95 58.26 1pg7 s SER 120 Cb -0.11 -2.12 0.03 0.00 0.21 0.00 0.00 66.02 64.03 1pg7 s SER 120 CO 0.41 0.26 -0.05 -0.69 0.41 0.00 0.00 173.24 173.58 1pg7 s VAL 121 N -0.28 2.92 0.04 3.43 1.01 -1.26 -0.76 120.40 125.50 1pg7 s VAL 121 Ca 0.14 -1.01 0.04 0.00 0.00 0.00 0.00 61.98 61.15 1pg7 s VAL 121 Cb -0.12 -2.48 -0.04 0.00 0.00 0.00 0.00 36.38 33.74 1pg7 s VAL 121 CO 0.03 0.19 -0.06 -0.36 0.00 0.00 0.00 175.10 174.90 1pg7 s PHE 122 N 1.33 2.87 0.41 5.22 0.08 -0.22 -4.93 117.98 122.75 1pg7 s PHE 122 Ca 0.00 -0.06 -0.23 0.00 0.12 0.00 0.00 56.93 56.76 1pg7 s PHE 122 Cb -0.17 -1.55 -0.09 0.00 -0.57 0.00 0.00 43.02 40.64 1pg7 s PHE 122 CO -0.04 0.41 1.03 -2.14 -0.10 0.00 0.00 175.22 174.37 1pg7 s PRO 123 N -1.77 4.13 -0.70 0.24 0.02 -1.26 -0.03 135.00 135.63 1pg7 s PRO 123 Ca 0.20 1.41 0.05 0.00 0.02 0.00 0.00 61.00 62.68 1pg7 s PRO 123 Cb -0.11 -2.42 0.17 0.00 0.02 0.00 0.00 34.50 32.15 1pg7 s PRO 123 CO 0.11 -0.15 0.49 -0.51 -0.33 0.00 0.00 177.00 176.61 1pg7 s LEU 124 N -2.84 4.75 0.42 -5.54 1.43 0.54 -4.81 118.68 112.63 1pg7 s LEU 124 Ca 0.60 -3.85 -0.24 0.00 -1.03 0.00 0.00 54.13 49.61 1pg7 s LEU 124 Cb -0.19 -1.61 -0.08 0.00 0.03 0.00 0.00 46.19 44.34 1pg7 s LEU 124 CO 0.24 -0.08 1.17 0.00 0.23 0.00 0.00 176.35 177.90 1pg7 s ALA 125 N -1.43 3.09 0.58 4.21 0.00 -1.26 -0.26 121.76 126.68 1pg7 s ALA 125 Ca 0.25 0.95 -0.19 0.00 0.00 0.00 0.00 51.96 52.97 1pg7 s ALA 125 Cb -0.04 -3.38 -0.05 0.00 0.00 0.00 0.00 23.12 19.65 1pg7 s ALA 125 CO -0.17 -0.57 1.04 -2.30 0.00 0.00 0.00 175.76 173.76 1pg7 n PRO 126 N -0.13 1.06 0.19 0.00 -0.02 -1.26 -4.93 135.00 129.91 1pg7 n PRO 126 Ca 0.05 0.40 0.04 0.00 -2.02 0.00 0.00 63.50 61.98 1pg7 n PRO 126 Cb 0.47 -2.23 0.38 0.00 -0.02 0.00 0.00 33.50 32.10 1pg7 n PRO 126 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 1pg7 h SER 127 N 0.72 0.00 -5.53 2.55 0.87 -1.96 -3.42 113.55 106.79 1pg7 h SER 127 Ca -0.48 0.00 -0.06 0.00 -1.23 0.00 0.00 61.79 60.01 1pg7 h SER 127 Cb 1.35 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.31 1pg7 h SER 127 CO 0.52 0.37 -0.26 -1.20 -0.53 0.00 0.00 176.83 175.73 1pg7 n SER 128 N -3.91 -7.47 -0.29 6.23 7.64 -1.26 -5.13 113.62 109.42 1pg7 n SER 128 Ca -0.02 -0.02 0.00 0.00 1.01 0.00 0.00 58.87 59.84 1pg7 n SER 128 Cb 0.43 -4.85 0.00 0.00 -1.01 0.00 0.00 64.21 58.77 1pg7 n SER 128 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1pg7 n GLY 133 N -1.37 0.00 0.95 0.23 0.00 -1.26 -5.23 105.19 98.51 1pg7 n GLY 133 Ca -0.01 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.08 1pg7 n GLY 133 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pg7 n GLY 134 N -1.52 1.39 3.15 -0.02 0.00 -1.26 -4.84 105.19 102.10 1pg7 n GLY 134 Ca 0.00 -0.51 -0.29 0.00 0.00 0.00 0.00 46.02 45.23 1pg7 n GLY 134 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1pg7 s THR 135 N -1.53 1.66 0.20 2.61 2.01 -1.26 -0.42 115.64 118.91 1pg7 s THR 135 Ca 0.31 -0.81 0.11 0.00 0.31 0.00 0.00 61.69 61.61 1pg7 s THR 135 Cb 0.18 -1.44 -0.04 0.00 0.01 0.00 0.00 72.50 71.20 1pg7 s THR 135 CO 0.19 0.47 -0.22 0.00 -0.69 0.00 0.00 174.62 174.37 1pg7 s ALA 136 N 0.30 2.45 -0.01 7.40 0.00 0.80 -4.79 121.76 127.91 1pg7 s ALA 136 Ca -0.12 -1.65 0.07 0.00 0.00 0.00 0.00 51.96 50.26 1pg7 s ALA 136 Cb -0.15 -0.28 -0.02 0.00 0.00 0.00 0.00 23.12 22.66 1pg7 s ALA 136 CO 0.05 0.36 -0.22 0.00 0.00 0.00 0.00 175.76 175.95 1pg7 s ALA 137 N -1.91 2.37 0.18 0.00 0.00 -1.26 -0.17 121.76 120.98 1pg7 s ALA 137 Ca 0.21 -1.12 -0.06 0.00 0.00 0.00 0.00 51.96 51.00 1pg7 s ALA 137 Cb -0.07 -0.68 -0.02 0.00 0.00 0.00 0.00 23.12 22.35 1pg7 s ALA 137 CO 0.10 0.54 0.23 -0.48 0.00 0.00 0.00 175.76 176.16 1pg7 s LEU 138 N -0.87 1.05 0.00 0.00 0.05 -0.09 -4.14 118.68 114.68 1pg7 s LEU 138 Ca 0.11 -1.09 0.00 0.00 0.05 0.00 0.00 54.13 53.20 1pg7 s LEU 138 Cb -0.10 0.89 0.00 0.00 -2.05 0.00 0.00 46.19 44.93 1pg7 s LEU 138 CO 0.01 -0.89 0.00 0.61 -0.55 0.00 0.00 176.35 175.53 1pg7 n GLY 139 N -0.24 0.69 2.89 -3.48 0.00 0.64 -0.69 105.19 105.00 1pg7 n GLY 139 Ca -0.03 -0.72 -0.16 0.00 0.00 0.00 0.00 46.02 45.11 1pg7 n GLY 139 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pg7 s LEU 141 N 0.35 4.76 -0.63 0.00 2.96 0.95 -1.44 118.68 125.63 1pg7 s LEU 141 Ca -0.03 -1.08 -0.18 0.00 -0.22 0.00 0.00 54.13 52.61 1pg7 s LEU 141 Cb -0.06 -2.01 0.12 0.00 0.50 0.00 0.00 46.19 44.74 1pg7 s LEU 141 CO -0.01 -0.41 0.71 -0.69 -1.32 0.00 0.00 176.35 174.64 1pg7 s VAL 142 N 1.52 4.93 0.08 1.68 1.01 0.14 -1.05 120.40 128.71 1pg7 s VAL 142 Ca 0.02 -1.22 0.06 0.00 0.00 0.00 0.00 61.98 60.83 1pg7 s VAL 142 Cb -0.20 -4.49 -0.04 0.00 0.00 0.00 0.00 36.38 31.66 1pg7 s VAL 142 CO 0.06 -1.11 -0.07 -0.75 0.00 0.00 0.00 175.10 173.23 1pg7 s LYS 143 N 2.34 2.32 -1.03 2.72 2.20 0.06 -0.84 119.74 127.50 1pg7 s LYS 143 Ca 0.12 -0.91 -0.08 0.00 -0.36 0.00 0.00 55.97 54.74 1pg7 s LYS 143 Cb -0.23 -2.40 -0.05 0.00 -1.51 0.00 0.00 37.83 33.64 1pg7 s LYS 143 CO 0.04 0.54 0.88 -0.25 -0.36 0.00 0.00 175.35 176.19 1pg7 n ASP 144 N 0.87 -6.53 -4.39 1.43 8.00 -0.61 -0.85 116.55 114.48 1pg7 n ASP 144 Ca -0.13 -0.70 -0.21 0.00 0.71 0.00 0.00 54.79 54.45 1pg7 n ASP 144 Cb 0.52 -4.88 -0.10 0.00 -0.02 0.00 0.00 41.12 36.64 1pg7 n ASP 144 CO 0.00 0.00 0.00 -0.72 -0.39 0.00 0.00 177.20 176.09 1pg7 s TYR 145 N -3.36 1.93 -0.28 1.24 1.13 -0.43 -4.31 117.35 113.27 1pg7 s TYR 145 Ca 0.42 -0.47 -0.20 0.00 -1.41 0.00 0.00 57.07 55.40 1pg7 s TYR 145 Cb -0.07 -0.88 0.10 0.00 -1.10 0.00 0.00 41.96 40.00 1pg7 s TYR 145 CO 0.76 0.48 0.83 0.12 -2.51 0.00 0.00 175.55 175.23 1pg7 s PHE 146 N -2.65 -0.78 0.00 -3.49 2.19 -0.54 0.62 117.98 113.33 1pg7 s PHE 146 Ca 0.24 1.68 0.00 0.00 0.33 0.00 0.00 56.93 59.18 1pg7 s PHE 146 Cb -0.03 0.43 0.00 0.00 -1.31 0.00 0.00 43.02 42.11 1pg7 s PHE 146 CO 0.10 -0.38 0.00 -0.35 1.83 0.00 0.00 175.22 176.41 1pg7 n PRO 147 N 3.40 1.30 -1.76 10.12 -0.04 -1.26 -0.37 135.00 146.38 1pg7 n PRO 147 Ca -0.17 0.00 -0.32 0.00 -0.04 0.00 0.00 63.50 62.97 1pg7 n PRO 147 Cb 0.57 0.00 0.04 0.00 -0.04 0.00 0.00 33.50 34.07 1pg7 n PRO 147 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1pg7 s GLU 148 N -1.06 3.01 0.25 0.54 2.02 -1.26 -4.77 118.70 117.43 1pg7 s GLU 148 Ca 0.00 1.14 0.02 0.00 0.02 0.00 0.00 54.97 56.15 1pg7 s GLU 148 Cb 0.00 -1.99 0.02 0.00 0.10 0.00 0.00 34.13 32.26 1pg7 s GLU 148 CO 0.00 -1.05 0.19 -0.35 0.02 0.00 0.00 175.26 174.07 1pg7 n PRO 149 N -2.61 1.12 -4.02 0.39 -0.04 -1.26 -5.02 135.00 123.55 1pg7 n PRO 149 Ca 0.09 -1.55 -0.16 0.00 -0.04 0.00 0.00 63.50 61.84 1pg7 n PRO 149 Cb 0.53 0.16 -0.15 0.00 -0.04 0.00 0.00 33.50 34.00 1pg7 n PRO 149 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1pg7 s VAL 150 N -1.21 0.25 -0.01 0.52 0.11 -1.26 -4.52 120.40 114.27 1pg7 s VAL 150 Ca 0.14 -0.06 -0.01 0.00 -2.93 0.00 0.00 61.98 59.13 1pg7 s VAL 150 Cb -0.01 -0.26 -0.04 0.00 -1.53 0.00 0.00 36.38 34.54 1pg7 s VAL 150 CO 0.09 0.11 0.08 0.42 -3.33 0.00 0.00 175.10 172.47 1pg7 s THR 151 N 0.38 4.74 -0.03 5.04 -4.23 -0.04 -4.95 115.64 116.54 1pg7 s THR 151 Ca -0.04 -0.39 0.02 0.00 -1.18 0.00 0.00 61.69 60.10 1pg7 s THR 151 Cb -0.07 -3.16 0.01 0.00 1.34 0.00 0.00 72.50 70.63 1pg7 s THR 151 CO -0.01 0.36 -0.08 -0.69 -0.54 0.00 0.00 174.62 173.67 1pg7 s VAL 152 N -1.18 0.71 0.11 2.29 1.01 -1.26 -1.53 120.40 120.55 1pg7 s VAL 152 Ca 0.22 -0.29 0.01 0.00 0.00 0.00 0.00 61.98 61.92 1pg7 s VAL 152 Cb -0.12 -0.66 -0.04 0.00 0.00 0.00 0.00 36.38 35.56 1pg7 s VAL 152 CO 0.13 0.24 -0.02 -0.44 0.00 0.00 0.00 175.10 175.01 1pg7 s SER 153 N 0.43 0.84 -0.05 3.32 0.01 -0.71 -4.95 113.70 112.60 1pg7 s SER 153 Ca -0.07 -1.08 0.05 0.00 1.31 0.00 0.00 55.95 56.17 1pg7 s SER 153 Cb -0.11 0.16 -0.01 0.00 0.21 0.00 0.00 66.02 66.28 1pg7 s SER 153 CO 0.01 -0.57 -0.21 0.26 0.41 0.00 0.00 173.24 173.14 1pg7 s TRP 154 N -3.78 2.05 -1.26 2.43 0.52 -1.26 0.74 118.94 118.38 1pg7 s TRP 154 Ca 0.16 -0.60 -0.09 0.00 0.02 0.00 0.00 56.10 55.59 1pg7 s TRP 154 Cb 0.07 -1.36 -0.01 0.00 -1.15 0.00 0.00 33.47 31.02 1pg7 s TRP 154 CO -0.03 -0.19 0.66 0.09 0.02 0.00 0.00 176.95 177.50 1pg7 n ASN 155 N 3.05 -2.83 0.00 2.95 5.03 0.90 -0.71 115.26 123.65 1pg7 n ASN 155 Ca -0.18 -0.95 0.00 0.00 0.87 0.00 0.00 54.58 54.32 1pg7 n ASN 155 Cb 0.52 -3.52 0.00 0.00 -1.02 0.00 0.00 39.78 35.77 1pg7 n ASN 155 CO 0.00 0.00 0.00 -1.20 -1.83 0.00 0.00 177.26 174.23 1pg7 n SER 156 N -2.88 0.00 0.00 6.41 7.64 -1.26 -0.71 113.62 122.81 1pg7 n SER 156 Ca -0.21 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.67 1pg7 n SER 156 Cb 0.64 -1.72 0.00 0.00 -1.01 0.00 0.00 64.21 62.12 1pg7 n SER 156 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1pg7 n GLY 157 N -2.00 1.00 0.17 0.23 0.00 0.12 -5.00 105.19 99.71 1pg7 n GLY 157 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1pg7 n GLY 157 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pg7 n ALA 158 N 0.00 2.20 -3.52 4.61 0.00 0.11 -4.50 120.51 119.41 1pg7 n ALA 158 Ca 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 53.44 53.25 1pg7 n ALA 158 Cb 0.00 -1.00 -0.14 0.00 0.00 0.00 0.00 19.45 18.31 1pg7 n ALA 158 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 1pg7 s LEU 159 N -0.65 -0.05 0.00 0.00 2.96 -1.15 -4.98 118.68 114.80 1pg7 s LEU 159 Ca 0.00 -0.22 0.00 0.00 -0.22 0.00 0.00 54.13 53.69 1pg7 s LEU 159 Cb 0.00 0.31 0.00 0.00 0.50 0.00 0.00 46.19 47.00 1pg7 s LEU 159 CO 0.00 -0.32 0.00 0.35 -1.32 0.00 0.00 176.35 175.06 1pg7 n THR 160 N 5.32 0.00 -2.05 3.68 -2.24 -1.26 -4.23 114.28 113.49 1pg7 n THR 160 Ca -0.06 0.00 -0.41 0.00 -2.27 0.00 0.00 64.05 61.31 1pg7 n THR 160 Cb 0.49 -0.59 -0.02 0.00 -2.10 0.00 0.00 70.33 68.11 1pg7 n THR 160 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1pg7 s SER 161 N -2.86 6.69 0.00 3.42 0.01 -1.26 -2.48 113.70 117.22 1pg7 s SER 161 Ca 0.00 2.68 0.00 0.00 1.31 0.00 0.00 55.95 59.94 1pg7 s SER 161 Cb 0.00 -2.63 0.00 0.00 0.21 0.00 0.00 66.02 63.60 1pg7 s SER 161 CO 0.00 -0.64 0.00 0.61 0.41 0.00 0.00 173.24 173.62 1pg7 n GLY 162 N 1.65 0.67 3.73 3.44 0.00 -1.26 -4.75 105.19 108.66 1pg7 n GLY 162 Ca 0.04 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.66 1pg7 n GLY 162 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1pg7 s VAL 163 N -2.91 4.90 -0.23 1.61 1.01 -1.04 -2.93 120.40 120.81 1pg7 s VAL 163 Ca 0.00 1.62 -0.02 0.00 0.00 0.00 0.00 61.98 63.59 1pg7 s VAL 163 Cb 0.00 -4.12 0.07 0.00 0.00 0.00 0.00 36.38 32.33 1pg7 s VAL 163 CO 0.00 0.28 0.04 -1.00 0.00 0.00 0.00 175.10 174.41 1pg7 s HIS 164 N 0.51 1.46 -0.48 5.22 3.76 -0.00 -5.01 115.29 120.75 1pg7 s HIS 164 Ca 0.40 -1.26 -0.13 0.00 -0.15 0.00 0.00 55.06 53.93 1pg7 s HIS 164 Cb -0.19 -1.31 0.10 0.00 1.11 0.00 0.00 32.58 32.29 1pg7 s HIS 164 CO 0.22 -0.71 0.38 0.99 -0.85 0.00 0.00 174.74 174.76 1pg7 s THR 165 N 1.71 4.74 0.67 1.30 2.01 -1.26 -0.95 115.64 123.85 1pg7 s THR 165 Ca 0.01 -1.44 -0.17 0.00 0.31 0.00 0.00 61.69 60.40 1pg7 s THR 165 Cb -0.17 -3.97 0.00 0.00 0.01 0.00 0.00 72.50 68.37 1pg7 s THR 165 CO -0.12 -0.69 1.20 -0.36 -0.69 0.00 0.00 174.62 173.96 1pg7 s PHE 166 N 1.51 2.24 0.52 4.92 0.08 -0.63 -4.99 117.98 121.63 1pg7 s PHE 166 Ca 0.04 1.55 -0.22 0.00 0.12 0.00 0.00 56.93 58.43 1pg7 s PHE 166 Cb -0.26 -3.46 -0.06 0.00 -0.57 0.00 0.00 43.02 38.67 1pg7 s PHE 166 CO 0.03 -2.40 1.24 -2.14 -0.10 0.00 0.00 175.22 171.85 1pg7 s PRO 167 N -3.67 3.38 0.65 0.24 0.02 -1.26 -4.56 135.00 129.78 1pg7 s PRO 167 Ca 0.75 1.93 -0.13 0.00 0.02 0.00 0.00 61.00 63.57 1pg7 s PRO 167 Cb -0.29 -2.24 -0.01 0.00 0.02 0.00 0.00 34.50 31.97 1pg7 s PRO 167 CO 0.40 -0.91 1.06 0.00 -0.33 0.00 0.00 177.00 177.22 1pg7 s ALA 168 N -1.48 2.70 0.09 -1.55 0.00 -1.26 -4.83 121.76 115.43 1pg7 s ALA 168 Ca 0.69 0.24 0.08 0.00 0.00 0.00 0.00 51.96 52.97 1pg7 s ALA 168 Cb -0.33 -3.20 -0.03 0.00 0.00 0.00 0.00 23.12 19.56 1pg7 s ALA 168 CO 0.38 -1.02 -0.20 0.14 0.00 0.00 0.00 175.76 175.06 1pg7 s VAL 169 N -2.75 1.65 -0.29 0.00 -7.23 -0.69 -4.97 120.40 106.12 1pg7 s VAL 169 Ca 0.61 -1.46 -0.20 0.00 -1.81 0.00 0.00 61.98 59.12 1pg7 s VAL 169 Cb -0.15 -1.49 -0.01 0.00 0.56 0.00 0.00 36.38 35.28 1pg7 s VAL 169 CO 0.46 -0.03 0.60 -0.22 -0.31 0.00 0.00 175.10 175.60 1pg7 s LEU 170 N -1.76 4.13 0.55 1.32 2.96 -1.26 -2.19 118.68 122.43 1pg7 s LEU 170 Ca 0.06 0.44 -0.08 0.00 -0.22 0.00 0.00 54.13 54.33 1pg7 s LEU 170 Cb -0.10 -2.77 -0.04 0.00 0.50 0.00 0.00 46.19 43.78 1pg7 s LEU 170 CO 0.04 -0.43 0.90 -1.10 -1.32 0.00 0.00 176.35 174.44 1pg7 s GLN 171 N 2.52 3.56 0.24 1.98 -0.21 -0.68 -4.94 119.66 122.14 1pg7 s GLN 171 Ca 0.24 0.46 0.15 0.00 0.02 0.00 0.00 55.36 56.22 1pg7 s GLN 171 Cb -0.15 -2.24 0.80 0.00 1.00 0.00 0.00 33.01 32.43 1pg7 s GLN 171 CO 0.11 -0.38 1.43 -1.13 -2.12 0.00 0.00 175.29 173.19 1pg7 n SER 172 N -2.49 0.38 0.04 5.90 3.41 -1.26 -0.71 113.62 118.90 1pg7 n SER 172 Ca 0.03 0.65 0.14 0.00 -0.26 0.00 0.00 58.87 59.43 1pg7 n SER 172 Cb 0.55 -0.69 0.51 0.00 -0.26 0.00 0.00 64.21 64.32 1pg7 n SER 172 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1pg7 n SER 173 N -2.02 0.36 0.00 4.04 3.41 -1.26 -4.90 113.62 113.24 1pg7 n SER 173 Ca -0.01 0.50 0.00 0.00 -0.26 0.00 0.00 58.87 59.10 1pg7 n SER 173 Cb 0.08 -0.59 0.00 0.00 -0.26 0.00 0.00 64.21 63.44 1pg7 n SER 173 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1pg7 n GLY 174 N 1.42 0.75 3.76 5.00 0.00 0.12 -4.99 105.19 111.25 1pg7 n GLY 174 Ca 0.06 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.82 1pg7 n GLY 174 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1pg7 s LEU 175 N 0.00 3.66 0.13 0.99 1.43 -1.26 -4.86 118.68 118.77 1pg7 s LEU 175 Ca 0.00 -0.21 -0.01 0.00 -1.03 0.00 0.00 54.13 52.88 1pg7 s LEU 175 Cb 0.00 -2.28 -0.04 0.00 0.03 0.00 0.00 46.19 43.90 1pg7 s LEU 175 CO 0.00 0.07 0.30 -0.31 0.23 0.00 0.00 176.35 176.64 1pg7 s TYR 176 N -1.77 3.49 0.02 0.29 2.02 0.20 -1.68 117.35 119.93 1pg7 s TYR 176 Ca 0.30 0.32 0.01 0.00 -0.37 0.00 0.00 57.07 57.33 1pg7 s TYR 176 Cb -0.10 -1.82 -0.02 0.00 -0.40 0.00 0.00 41.96 39.63 1pg7 s TYR 176 CO 0.22 0.49 -0.04 0.45 -1.57 0.00 0.00 175.55 175.10 1pg7 s SER 177 N -2.77 0.42 0.06 2.29 0.15 -0.93 -1.31 113.70 111.61 1pg7 s SER 177 Ca 0.37 -0.38 -0.22 0.00 0.70 0.00 0.00 55.95 56.42 1pg7 s SER 177 Cb -0.12 0.04 0.05 0.00 -1.71 0.00 0.00 66.02 64.28 1pg7 s SER 177 CO 0.28 -0.18 0.50 -0.22 1.20 0.00 0.00 173.24 174.82 1pg7 s LEU 178 N -1.09 -0.02 -0.00 3.45 0.20 -0.02 -1.71 118.68 119.49 1pg7 s LEU 178 Ca -0.09 0.12 0.03 0.00 0.69 0.00 0.00 54.13 54.88 1pg7 s LEU 178 Cb -0.07 2.09 -0.01 0.00 -0.43 0.00 0.00 46.19 47.76 1pg7 s LEU 178 CO -0.00 -0.73 -0.11 -0.55 -0.29 0.00 0.00 176.35 174.67 1pg7 s SER 179 N -2.05 1.28 -0.12 3.68 0.15 -1.26 0.27 113.70 115.65 1pg7 s SER 179 Ca -0.05 -0.23 0.01 0.00 0.70 0.00 0.00 55.95 56.38 1pg7 s SER 179 Cb -0.01 -0.13 0.02 0.00 -1.71 0.00 0.00 66.02 64.19 1pg7 s SER 179 CO -0.03 0.11 -0.13 -0.55 1.20 0.00 0.00 173.24 173.84 1pg7 s SER 180 N -0.39 2.40 0.34 5.45 0.15 -0.52 -1.60 113.70 119.52 1pg7 s SER 180 Ca 0.03 -0.41 0.10 0.00 0.70 0.00 0.00 55.95 56.38 1pg7 s SER 180 Cb -0.05 -1.04 -0.06 0.00 -1.71 0.00 0.00 66.02 63.16 1pg7 s SER 180 CO -0.00 -0.04 -0.11 0.68 1.20 0.00 0.00 173.24 174.97 1pg7 s VAL 181 N 1.28 2.27 -0.12 4.45 -7.23 -0.12 -1.26 120.40 119.66 1pg7 s VAL 181 Ca -0.01 -2.23 -0.12 0.00 -1.81 0.00 0.00 61.98 57.81 1pg7 s VAL 181 Cb -0.14 -2.60 0.03 0.00 0.56 0.00 0.00 36.38 34.23 1pg7 s VAL 181 CO -0.06 -0.23 0.33 0.54 -0.31 0.00 0.00 175.10 175.38 1pg7 s VAL 182 N -2.60 0.00 -0.18 1.32 0.11 0.13 -0.82 120.40 118.36 1pg7 s VAL 182 Ca 0.32 -0.01 -0.05 0.00 -2.93 0.00 0.00 61.98 59.31 1pg7 s VAL 182 Cb 0.02 -0.47 -0.03 0.00 -1.53 0.00 0.00 36.38 34.36 1pg7 s VAL 182 CO 0.16 -0.01 0.00 0.42 -3.33 0.00 0.00 175.10 172.35 1pg7 s THR 183 N 0.14 4.12 0.24 5.04 -4.23 -1.15 -0.91 115.64 118.89 1pg7 s THR 183 Ca -0.00 -0.27 0.03 0.00 -1.18 0.00 0.00 61.69 60.27 1pg7 s THR 183 Cb -0.02 -2.84 -0.05 0.00 1.34 0.00 0.00 72.50 70.92 1pg7 s THR 183 CO 0.01 0.46 0.03 0.68 -0.54 0.00 0.00 174.62 175.25 1pg7 s VAL 184 N 0.62 0.89 0.35 2.29 -7.23 0.76 -4.73 120.40 113.34 1pg7 s VAL 184 Ca -0.00 -2.01 -0.28 0.00 -1.81 0.00 0.00 61.98 57.87 1pg7 s VAL 184 Cb -0.14 -2.43 -0.10 0.00 0.56 0.00 0.00 36.38 34.27 1pg7 s VAL 184 CO 0.02 -0.24 1.36 -2.84 -0.31 0.00 0.00 175.10 173.09 1pg7 s PRO 185 N -3.91 4.25 0.52 4.82 0.02 -1.26 -0.14 135.00 139.30 1pg7 s PRO 185 Ca 0.31 2.31 0.27 0.00 0.02 0.00 0.00 61.00 63.91 1pg7 s PRO 185 Cb 0.07 -3.01 1.44 0.00 0.02 0.00 0.00 34.50 33.01 1pg7 s PRO 185 CO 0.10 -0.31 2.07 0.77 -0.33 0.00 0.00 177.00 179.30 1pg7 h SER 186 N 3.21 0.00 -0.02 2.53 0.02 -1.05 -3.00 113.55 115.24 1pg7 h SER 186 Ca -0.50 0.00 -0.10 0.00 -0.84 0.00 0.00 61.79 60.36 1pg7 h SER 186 Cb 1.23 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.76 1pg7 h SER 186 CO 0.65 0.12 -0.27 0.77 -1.14 0.00 0.00 176.83 176.95 1pg7 h SER 187 N 0.00 0.46 0.21 3.07 4.64 -1.91 -3.06 113.55 116.97 1pg7 h SER 187 Ca -0.00 -0.16 0.00 0.00 -0.47 0.00 0.00 61.79 61.16 1pg7 h SER 187 Cb 0.33 -0.13 0.00 0.00 -0.31 0.00 0.00 62.40 62.29 1pg7 h SER 187 CO 0.02 0.72 0.00 -1.54 -0.87 0.00 0.00 176.83 175.16 1pg7 n SER 188 N -4.11 0.00 -4.56 4.97 3.41 -1.13 -4.65 113.62 107.55 1pg7 n SER 188 Ca -0.01 -0.26 -0.30 0.00 -0.26 0.00 0.00 58.87 58.04 1pg7 n SER 188 Cb 0.41 -0.17 -0.04 0.00 -0.26 0.00 0.00 64.21 64.15 1pg7 n SER 188 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1pg7 s LEU 189 N -2.33 3.19 0.00 1.04 1.43 -1.16 -0.82 118.68 120.04 1pg7 s LEU 189 Ca 0.23 -0.16 0.00 0.00 -1.03 0.00 0.00 54.13 53.18 1pg7 s LEU 189 Cb 0.13 -2.54 0.00 0.00 0.03 0.00 0.00 46.19 43.81 1pg7 s LEU 189 CO 0.27 -2.74 0.00 0.61 0.23 0.00 0.00 176.35 174.72 1pg7 n GLY 190 N 6.41 3.36 0.08 -3.19 0.00 -1.26 -4.92 105.19 105.67 1pg7 n GLY 190 Ca 0.34 -0.73 -0.11 0.00 0.00 0.00 0.00 46.02 45.51 1pg7 n GLY 190 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1pg7 h THR 191 N 0.00 1.14 -2.86 2.61 2.02 -1.70 -3.42 112.91 110.70 1pg7 h THR 191 Ca 0.00 -0.43 -0.64 0.00 0.77 0.00 0.00 66.41 66.12 1pg7 h THR 191 Cb 0.00 1.24 -0.07 0.00 -1.74 0.00 0.00 68.15 67.58 1pg7 h THR 191 CO 0.00 0.13 -0.36 -1.58 0.37 0.00 0.00 175.52 174.08 1pg7 s GLN 192 N -5.57 3.72 -0.24 6.66 2.00 0.00 -5.09 119.66 121.16 1pg7 s GLN 192 Ca -0.14 0.10 -0.09 0.00 -2.00 0.00 0.00 55.36 53.23 1pg7 s GLN 192 Cb 0.06 -3.23 -0.04 0.00 0.80 0.00 0.00 33.01 30.60 1pg7 s GLN 192 CO 0.69 0.68 0.13 0.99 -0.50 0.00 0.00 175.29 177.28 1pg7 s THR 193 N -0.88 5.05 -0.21 -0.34 2.01 -1.26 -4.77 115.64 115.24 1pg7 s THR 193 Ca 0.18 0.07 -0.05 0.00 0.31 0.00 0.00 61.69 62.21 1pg7 s THR 193 Cb -0.14 -3.35 -0.02 0.00 0.01 0.00 0.00 72.50 69.00 1pg7 s THR 193 CO 0.08 0.35 0.00 -0.31 -0.69 0.00 0.00 174.62 174.05 1pg7 s TYR 194 N 1.15 3.03 -0.07 4.92 2.02 -1.26 -4.90 117.35 122.23 1pg7 s TYR 194 Ca 0.06 -0.55 0.02 0.00 -0.37 0.00 0.00 57.07 56.24 1pg7 s TYR 194 Cb -0.14 -2.11 0.01 0.00 -0.40 0.00 0.00 41.96 39.33 1pg7 s TYR 194 CO 0.05 -0.32 -0.12 0.42 -1.57 0.00 0.00 175.55 174.01 1pg7 s ILE 195 N 1.17 1.13 -0.18 2.71 1.01 -1.26 -1.75 121.20 124.04 1pg7 s ILE 195 Ca 0.03 -0.46 -0.11 0.00 0.00 0.00 0.00 60.65 60.11 1pg7 s ILE 195 Cb -0.14 -1.05 -0.05 0.00 0.01 0.00 0.00 42.46 41.22 1pg7 s ILE 195 CO 0.01 0.36 0.20 0.00 0.00 0.00 0.00 174.94 175.51 1pg7 s ASN 197 N 0.27 5.85 -0.12 0.00 -0.87 0.23 -2.37 114.94 117.93 1pg7 s ASN 197 Ca 0.12 -1.21 -0.05 0.00 -1.57 0.00 0.00 52.86 50.14 1pg7 s ASN 197 Cb -0.12 -2.07 -0.04 0.00 -0.02 0.00 0.00 41.25 39.00 1pg7 s ASN 197 CO 0.01 -0.50 0.09 -0.69 -2.57 0.00 0.00 177.10 173.43 1pg7 s VAL 198 N 1.55 5.03 -0.05 1.60 1.01 -0.31 -1.73 120.40 127.51 1pg7 s VAL 198 Ca 0.03 0.03 -0.02 0.00 0.00 0.00 0.00 61.98 62.02 1pg7 s VAL 198 Cb -0.22 -3.18 0.04 0.00 0.00 0.00 0.00 36.38 33.02 1pg7 s VAL 198 CO 0.06 0.59 0.09 0.21 0.00 0.00 0.00 175.10 176.05 1pg7 s ASN 199 N -0.79 0.37 -0.35 3.32 3.84 -0.58 -1.46 114.94 119.29 1pg7 s ASN 199 Ca 0.13 0.17 0.02 0.00 0.21 0.00 0.00 52.86 53.39 1pg7 s ASN 199 Cb -0.12 0.04 0.11 0.00 -0.55 0.00 0.00 41.25 40.73 1pg7 s ASN 199 CO 0.03 -0.18 0.10 -2.28 -2.79 0.00 0.00 177.10 171.98 1pg7 s HIS 200 N 1.55 2.78 0.19 0.43 5.65 -0.27 -0.86 115.29 124.76 1pg7 s HIS 200 Ca -0.04 -2.49 -0.12 0.00 0.25 0.00 0.00 55.06 52.66 1pg7 s HIS 200 Cb -0.12 -2.37 0.19 0.00 -1.18 0.00 0.00 32.58 29.10 1pg7 s HIS 200 CO -0.04 -0.89 1.78 0.87 -0.65 0.00 0.00 174.74 175.80 1pg7 h LYS 201 N 7.62 0.48 -0.09 2.88 1.79 -1.82 -1.62 116.57 125.81 1pg7 h LYS 201 Ca -0.08 -0.03 0.03 0.00 -2.18 0.00 0.00 60.65 58.39 1pg7 h LYS 201 Cb 1.00 -0.11 -0.00 0.00 -1.58 0.00 0.00 32.23 31.54 1pg7 h LYS 201 CO 0.51 0.32 0.19 -1.35 -1.08 0.00 0.00 179.45 178.04 1pg7 h PRO 202 N 0.49 0.00 -0.03 3.15 0.11 -1.92 -1.00 132.00 132.80 1pg7 h PRO 202 Ca 0.25 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.36 1pg7 h PRO 202 Cb 0.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.32 1pg7 h PRO 202 CO -0.20 0.00 0.00 -1.13 -0.21 0.00 0.00 178.00 176.46 1pg7 n SER 203 N -3.37 1.57 -3.82 -2.05 3.41 -1.17 -4.96 113.62 103.24 1pg7 n SER 203 Ca -0.00 -1.42 -0.23 0.00 -0.26 0.00 0.00 58.87 56.95 1pg7 n SER 203 Cb 0.28 -0.02 0.01 0.00 -0.26 0.00 0.00 64.21 64.22 1pg7 n SER 203 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1pg7 n ASN 204 N 0.00 -0.78 -4.53 4.04 3.02 -0.38 -4.88 115.26 111.75 1pg7 n ASN 204 Ca 0.02 -0.91 -0.36 0.00 -0.03 0.00 0.00 54.58 53.30 1pg7 n ASN 204 Cb 0.15 -3.59 -0.11 0.00 -0.61 0.00 0.00 39.78 35.61 1pg7 n ASN 204 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1pg7 s THR 205 N -3.80 4.61 -0.15 3.41 2.01 -0.67 -5.01 115.64 116.04 1pg7 s THR 205 Ca 0.01 -0.08 -0.01 0.00 0.31 0.00 0.00 61.69 61.92 1pg7 s THR 205 Cb -0.00 -3.13 0.04 0.00 0.01 0.00 0.00 72.50 69.41 1pg7 s THR 205 CO 0.85 0.37 -0.05 -0.75 -0.69 0.00 0.00 174.62 174.34 1pg7 s LYS 206 N 1.22 1.40 -0.02 4.92 2.20 -1.26 -1.11 119.74 127.08 1pg7 s LYS 206 Ca 0.05 -0.43 0.06 0.00 -0.36 0.00 0.00 55.97 55.29 1pg7 s LYS 206 Cb -0.14 -1.88 -0.01 0.00 -1.51 0.00 0.00 37.83 34.29 1pg7 s LYS 206 CO 0.04 -0.40 -0.19 0.08 -0.36 0.00 0.00 175.35 174.52 1pg7 s VAL 207 N 1.67 1.51 -0.33 4.02 1.01 -0.54 -5.02 120.40 122.72 1pg7 s VAL 207 Ca 0.02 -0.80 0.02 0.00 0.00 0.00 0.00 61.98 61.22 1pg7 s VAL 207 Cb -0.15 -1.26 0.10 0.00 0.00 0.00 0.00 36.38 35.07 1pg7 s VAL 207 CO -0.08 0.43 0.06 -1.81 0.00 0.00 0.00 175.10 173.71 1pg7 s ASP 208 N -0.34 4.49 -0.21 3.32 1.01 -1.26 -1.16 116.67 122.53 1pg7 s ASP 208 Ca 0.05 -1.96 -0.11 0.00 0.71 0.00 0.00 52.55 51.24 1pg7 s ASP 208 Cb -0.08 -1.35 -0.05 0.00 1.01 0.00 0.00 42.92 42.45 1pg7 s ASP 208 CO 0.00 -0.39 0.17 -0.75 0.21 0.00 0.00 175.17 174.41 1pg7 s LYS 209 N 1.16 4.15 -0.03 8.23 2.47 -1.00 -4.93 119.74 129.79 1pg7 s LYS 209 Ca 0.10 -0.20 -0.22 0.00 -1.56 0.00 0.00 55.97 54.10 1pg7 s LYS 209 Cb -0.18 -3.47 -0.05 0.00 -1.46 0.00 0.00 37.83 32.67 1pg7 s LYS 209 CO -0.14 0.19 0.66 0.21 0.16 0.00 0.00 175.35 176.42 1pg7 s LYS 210 N 0.67 4.40 -0.18 4.03 2.20 -1.26 -1.75 119.74 127.84 1pg7 s LYS 210 Ca 0.09 0.82 -0.03 0.00 -0.36 0.00 0.00 55.97 56.49 1pg7 s LYS 210 Cb -0.12 -3.40 -0.01 0.00 -1.51 0.00 0.00 37.83 32.79 1pg7 s LYS 210 CO 0.01 0.21 -0.07 0.08 -0.36 0.00 0.00 175.35 175.23 1pg7 s VAL 211 N 0.32 3.38 0.09 4.02 1.01 -0.72 -4.93 120.40 123.56 1pg7 s VAL 211 Ca 0.34 -0.51 -0.11 0.00 0.00 0.00 0.00 61.98 61.70 1pg7 s VAL 211 Cb -0.18 -2.49 0.01 0.00 0.00 0.00 0.00 36.38 33.71 1pg7 s VAL 211 CO 0.18 0.46 0.25 -1.83 0.00 0.00 0.00 175.10 174.16 1pg7 s GLU 212 N 0.96 0.87 0.00 2.72 -1.05 -1.26 -4.53 118.70 116.41 1pg7 s GLU 212 Ca -0.01 -0.82 0.13 0.00 -0.15 0.00 0.00 54.97 54.12 1pg7 s GLU 212 Cb -0.15 0.36 0.75 0.00 -0.44 0.00 0.00 34.13 34.66 1pg7 s GLU 212 CO 0.00 -0.29 1.18 -0.35 0.95 0.00 0.00 175.26 176.75