#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1jgl s ILE 2 N 0.00 4.78 0.11 2.12 1.01 -1.26 -4.95 121.20 123.01 1jgl s ILE 2 Ca 0.00 -0.03 0.03 0.00 0.00 0.00 0.00 60.65 60.65 1jgl s ILE 2 Cb 0.00 -3.17 -0.04 0.00 0.01 0.00 0.00 42.46 39.26 1jgl s ILE 2 CO 0.00 0.43 0.14 -1.10 0.00 0.00 0.00 174.94 174.41 1jgl s GLN 3 N 0.61 3.05 -0.15 2.79 -1.52 -1.26 -4.49 119.66 118.69 1jgl s GLN 3 Ca 0.04 -0.69 -0.01 0.00 -1.95 0.00 0.00 55.36 52.75 1jgl s GLN 3 Cb -0.13 -2.78 -0.01 0.00 -0.22 0.00 0.00 33.01 29.87 1jgl s GLN 3 CO 0.01 0.54 -0.12 -1.64 -0.25 0.00 0.00 175.29 173.84 1jgl s MET 4 N -2.72 3.36 -0.35 2.91 -1.94 -1.26 -1.45 119.30 117.86 1jgl s MET 4 Ca 0.31 -0.68 -0.09 0.00 -1.71 0.00 0.00 55.69 53.52 1jgl s MET 4 Cb -0.12 -2.69 0.03 0.00 2.01 0.00 0.00 34.83 34.06 1jgl s MET 4 CO 0.24 0.12 0.15 0.99 -0.01 0.00 0.00 175.02 176.51 1jgl s THR 5 N 0.59 4.24 -0.11 2.05 2.01 0.13 -4.26 115.64 120.30 1jgl s THR 5 Ca -0.07 -0.88 -0.04 0.00 0.31 0.00 0.00 61.69 61.01 1jgl s THR 5 Cb -0.15 -3.34 -0.04 0.00 0.01 0.00 0.00 72.50 68.98 1jgl s THR 5 CO 0.03 -0.14 0.06 -1.58 -0.69 0.00 0.00 174.62 172.30 1jgl s GLN 6 N 1.50 3.25 0.01 4.92 0.74 -1.26 -1.15 119.66 127.67 1jgl s GLN 6 Ca 0.01 -0.29 -0.17 0.00 0.05 0.00 0.00 55.36 54.96 1jgl s GLN 6 Cb -0.19 -2.98 0.03 0.00 1.10 0.00 0.00 33.01 30.97 1jgl s GLN 6 CO 0.05 0.70 0.37 -1.54 -0.55 0.00 0.00 175.29 174.31 1jgl s SER 7 N -0.83 -0.25 0.68 6.67 1.04 -0.28 -4.46 113.70 116.27 1jgl s SER 7 Ca 0.13 0.07 -0.08 0.00 0.48 0.00 0.00 55.95 56.55 1jgl s SER 7 Cb -0.12 0.37 0.04 0.00 0.10 0.00 0.00 66.02 66.41 1jgl s SER 7 CO 0.03 -0.55 1.01 -2.16 0.98 0.00 0.00 173.24 172.54 1jgl s PRO 8 N -1.85 2.53 0.23 4.02 0.04 -1.26 -1.15 135.00 137.55 1jgl s PRO 8 Ca -0.10 -0.01 0.00 0.00 0.04 0.00 0.00 61.00 60.94 1jgl s PRO 8 Cb -0.03 -2.16 0.24 0.00 0.04 0.00 0.00 34.50 32.60 1jgl s PRO 8 CO 0.02 -1.06 1.59 0.00 0.04 0.00 0.00 177.00 177.59 1jgl h ALA 9 N -0.52 0.87 -3.83 8.56 0.00 -1.78 -3.40 119.26 119.16 1jgl h ALA 9 Ca -0.45 -0.46 -0.40 0.00 0.00 0.00 0.00 54.91 53.60 1jgl h ALA 9 Cb 1.29 -0.10 -0.26 0.00 0.00 0.00 0.00 17.79 18.72 1jgl h ALA 9 CO 0.62 0.65 -0.78 -1.12 0.00 0.00 0.00 179.25 178.62 1jgl s SER 10 N -6.87 1.29 -0.06 0.00 0.01 -1.26 -0.06 113.70 106.75 1jgl s SER 10 Ca -0.07 -0.32 -0.07 0.00 1.31 0.00 0.00 55.95 56.80 1jgl s SER 10 Cb 0.12 -0.10 0.02 0.00 0.21 0.00 0.00 66.02 66.27 1jgl s SER 10 CO 0.82 0.05 0.18 -0.22 0.41 0.00 0.00 173.24 174.47 1jgl s LEU 11 N -0.73 1.33 -0.05 2.44 2.96 0.68 -4.89 118.68 120.42 1jgl s LEU 11 Ca 0.01 0.27 0.05 0.00 -0.22 0.00 0.00 54.13 54.24 1jgl s LEU 11 Cb -0.06 0.65 -0.01 0.00 0.50 0.00 0.00 46.19 47.28 1jgl s LEU 11 CO 0.00 -0.12 -0.20 -0.55 -1.32 0.00 0.00 176.35 174.17 1jgl s SER 12 N -0.17 2.44 0.22 3.68 0.15 -1.26 -0.79 113.70 117.97 1jgl s SER 12 Ca -0.03 -0.40 -0.23 0.00 0.70 0.00 0.00 55.95 56.00 1jgl s SER 12 Cb -0.02 -0.65 0.04 0.00 -1.71 0.00 0.00 66.02 63.68 1jgl s SER 12 CO 0.01 0.19 0.85 0.00 1.20 0.00 0.00 173.24 175.48 1jgl s ALA 13 N -0.05 -1.43 0.28 5.45 0.00 -0.71 -4.87 121.76 120.43 1jgl s ALA 13 Ca -0.03 -0.11 0.11 0.00 0.00 0.00 0.00 51.96 51.92 1jgl s ALA 13 Cb -0.12 0.74 -0.05 0.00 0.00 0.00 0.00 23.12 23.70 1jgl s ALA 13 CO 0.02 -1.04 -0.11 -1.12 0.00 0.00 0.00 175.76 173.51 1jgl s SER 14 N -2.95 3.99 0.24 0.00 0.01 -1.26 -0.61 113.70 113.12 1jgl s SER 14 Ca 0.12 -0.88 -0.31 0.00 1.31 0.00 0.00 55.95 56.19 1jgl s SER 14 Cb -0.04 -0.52 -0.14 0.00 0.21 0.00 0.00 66.02 65.53 1jgl s SER 14 CO 0.05 0.01 1.26 0.52 0.41 0.00 0.00 173.24 175.49 1jgl n VAL 15 N -0.74 1.25 0.00 3.43 0.31 -1.26 -1.62 118.33 119.70 1jgl n VAL 15 Ca -0.06 -0.31 0.00 0.00 -0.01 0.00 0.00 64.34 63.96 1jgl n VAL 15 Cb 0.60 -1.25 0.00 0.00 -0.91 0.00 0.00 33.84 32.28 1jgl n VAL 15 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1jgl n GLY 16 N 1.78 3.27 3.93 2.92 0.00 -0.44 -4.86 105.19 111.80 1jgl n GLY 16 Ca 0.11 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.87 1jgl n GLY 16 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1jgl s GLU 17 N -0.57 2.03 -0.02 1.61 2.02 -0.64 -3.85 118.70 119.29 1jgl s GLU 17 Ca 0.00 -0.29 0.06 0.00 0.02 0.00 0.00 54.97 54.76 1jgl s GLU 17 Cb 0.00 -2.14 -0.02 0.00 0.10 0.00 0.00 34.13 32.07 1jgl s GLU 17 CO 0.00 -1.36 -0.20 0.99 0.02 0.00 0.00 175.26 174.70 1jgl s THR 18 N -3.31 2.54 0.11 3.63 2.01 -1.26 -0.93 115.64 118.43 1jgl s THR 18 Ca 0.62 -0.99 0.03 0.00 0.31 0.00 0.00 61.69 61.65 1jgl s THR 18 Cb -0.10 -1.96 -0.04 0.00 0.01 0.00 0.00 72.50 70.41 1jgl s THR 18 CO 0.46 0.54 -0.08 0.68 -0.69 0.00 0.00 174.62 175.52 1jgl s VAL 19 N -0.71 0.88 -0.05 3.82 -7.23 0.05 -4.98 120.40 112.18 1jgl s VAL 19 Ca 0.11 -1.89 0.02 0.00 -1.81 0.00 0.00 61.98 58.41 1jgl s VAL 19 Cb -0.10 -1.64 0.01 0.00 0.56 0.00 0.00 36.38 35.22 1jgl s VAL 19 CO 0.01 -0.76 -0.09 -0.89 -0.31 0.00 0.00 175.10 173.06 1jgl s THR 20 N -3.23 0.83 -0.09 5.32 2.01 -1.26 -1.24 115.64 117.98 1jgl s THR 20 Ca 0.11 -0.32 0.02 0.00 0.31 0.00 0.00 61.69 61.82 1jgl s THR 20 Cb 0.02 -0.78 -0.02 0.00 0.01 0.00 0.00 72.50 71.74 1jgl s THR 20 CO -0.02 0.28 -0.17 -0.63 -0.69 0.00 0.00 174.62 173.39 1jgl s ILE 21 N 0.65 2.78 0.15 1.82 1.01 -0.05 -4.72 121.20 122.85 1jgl s ILE 21 Ca -0.11 -0.79 0.11 0.00 0.00 0.00 0.00 60.65 59.86 1jgl s ILE 21 Cb -0.14 -2.11 -0.04 0.00 0.01 0.00 0.00 42.46 40.18 1jgl s ILE 21 CO 0.02 0.55 -0.25 0.42 0.00 0.00 0.00 174.94 175.69 1jgl s THR 22 N -0.04 2.21 -0.02 2.92 -4.23 -0.30 0.38 115.64 116.55 1jgl s THR 22 Ca -0.04 -1.85 0.01 0.00 -1.18 0.00 0.00 61.69 58.63 1jgl s THR 22 Cb -0.14 -1.99 0.01 0.00 1.34 0.00 0.00 72.50 71.72 1jgl s THR 22 CO 0.04 -0.03 -0.04 0.00 -0.54 0.00 0.00 174.62 174.05 1jgl s ARG 24 N 0.32 2.23 0.13 0.00 3.52 -0.30 -1.46 118.95 123.40 1jgl s ARG 24 Ca -0.03 -0.64 -0.11 0.00 -0.13 0.00 0.00 55.73 54.82 1jgl s ARG 24 Cb -0.07 -1.78 -0.06 0.00 -1.56 0.00 0.00 34.95 31.47 1jgl s ARG 24 CO -0.00 0.14 0.47 0.00 -0.81 0.00 0.00 175.30 175.09 1jgl s ALA 25 N 0.40 3.65 -1.46 6.12 0.00 0.71 -0.69 121.76 130.50 1jgl s ALA 25 Ca -0.14 -0.30 0.23 0.00 0.00 0.00 0.00 51.96 51.76 1jgl s ALA 25 Cb -0.16 -2.37 1.17 0.00 0.00 0.00 0.00 23.12 21.77 1jgl s ALA 25 CO 0.05 0.53 1.76 -1.13 0.00 0.00 0.00 175.76 176.97 1jgl n SER 26 N 0.60 0.00 -3.56 0.00 3.41 -0.53 -4.78 113.62 108.76 1jgl n SER 26 Ca -0.05 -0.08 -0.14 0.00 -0.26 0.00 0.00 58.87 58.34 1jgl n SER 26 Cb 0.52 -0.27 -0.05 0.00 -0.26 0.00 0.00 64.21 64.15 1jgl n SER 26 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 1jgl s GLY 27 N -2.54 -0.45 -0.07 5.00 0.00 -1.26 -4.96 107.32 103.04 1jgl s GLY 27 Ca 0.22 0.67 -0.35 0.00 0.00 0.00 0.00 44.72 45.26 1jgl s GLY 27 CO 0.35 0.36 1.81 -2.01 0.00 0.00 0.00 173.10 173.61 1jgl n ASN 28 N 0.43 3.23 -0.70 1.64 2.85 -1.26 -4.73 115.26 116.73 1jgl n ASN 28 Ca -0.18 1.00 0.06 0.00 -0.11 0.00 0.00 54.58 55.35 1jgl n ASN 28 Cb 0.60 -1.35 0.17 0.00 1.24 0.00 0.00 39.78 40.44 1jgl n ASN 28 CO 0.00 0.00 0.00 2.30 -2.11 0.00 0.00 177.26 177.45 1jgl n ILE 29 N 4.77 1.13 -4.29 -1.44 -5.35 -0.88 -5.00 119.36 108.29 1jgl n ILE 29 Ca 0.22 -1.08 -0.31 0.00 -0.27 0.00 0.00 62.75 61.31 1jgl n ILE 29 Cb 0.27 0.43 -0.09 0.00 -1.74 0.00 0.00 39.64 38.51 1jgl n ILE 29 CO 0.00 0.00 0.00 1.41 -1.76 0.00 0.00 176.55 176.20 1jgl n HIS 30 N 0.47 -1.29 -0.94 4.28 8.25 -1.25 -0.98 115.22 123.76 1jgl n HIS 30 Ca 0.13 0.60 0.00 0.00 -0.26 0.00 0.00 57.72 58.19 1jgl n HIS 30 Cb 0.48 -2.86 0.00 0.00 1.12 0.00 0.00 29.99 28.73 1jgl n HIS 30 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1jgl n ASN 31 N -2.87 -3.08 -3.70 0.41 3.02 -1.26 -4.93 115.26 102.85 1jgl n ASN 31 Ca -0.32 0.00 -0.42 0.00 -0.03 0.00 0.00 54.58 53.81 1jgl n ASN 31 Cb 0.70 -1.60 -0.00 0.00 -0.61 0.00 0.00 39.78 38.26 1jgl n ASN 31 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 1jgl n TYR 32 N -2.40 3.15 -4.36 3.10 4.02 -0.16 -2.16 117.16 118.35 1jgl n TYR 32 Ca 0.00 -2.92 -0.19 0.00 -0.01 0.00 0.00 57.90 54.78 1jgl n TYR 32 Cb 0.16 -2.32 -0.15 0.00 -0.02 0.00 0.00 39.34 37.01 1jgl n TYR 32 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 176.86 174.68 1jgl s LEU 33 N 0.95 2.00 0.19 7.72 2.96 -1.26 -0.60 118.68 130.63 1jgl s LEU 33 Ca 0.48 -0.16 0.11 0.00 -0.22 0.00 0.00 54.13 54.34 1jgl s LEU 33 Cb 0.13 -0.46 -0.04 0.00 0.50 0.00 0.00 46.19 46.32 1jgl s LEU 33 CO -0.06 0.11 -0.23 0.00 -1.32 0.00 0.00 176.35 174.85 1jgl s ALA 34 N -0.18 2.46 -0.08 5.97 0.00 0.10 -0.85 121.76 129.18 1jgl s ALA 34 Ca 0.03 -1.62 0.04 0.00 0.00 0.00 0.00 51.96 50.41 1jgl s ALA 34 Cb -0.04 -0.31 0.00 0.00 0.00 0.00 0.00 23.12 22.77 1jgl s ALA 34 CO -0.00 0.41 -0.21 -1.58 0.00 0.00 0.00 175.76 174.37 1jgl s TRP 35 N -1.71 2.24 0.16 0.00 0.52 0.14 -0.71 118.94 119.59 1jgl s TRP 35 Ca 0.20 -0.86 0.11 0.00 0.02 0.00 0.00 56.10 55.57 1jgl s TRP 35 Cb -0.08 -1.52 -0.04 0.00 -1.15 0.00 0.00 33.47 30.69 1jgl s TRP 35 CO 0.09 -0.35 -0.24 0.71 0.02 0.00 0.00 176.95 177.19 1jgl s TYR 36 N 0.33 2.22 -0.06 -1.98 1.51 0.67 -0.67 117.35 119.36 1jgl s TYR 36 Ca -0.15 -0.38 0.06 0.00 -1.01 0.00 0.00 57.07 55.58 1jgl s TYR 36 Cb -0.17 -1.14 -0.01 0.00 -0.11 0.00 0.00 41.96 40.54 1jgl s TYR 36 CO 0.07 0.41 -0.24 -1.14 -1.11 0.00 0.00 175.55 173.53 1jgl s GLN 37 N -2.42 2.57 -0.06 -0.62 0.74 -0.41 -1.38 119.66 118.07 1jgl s GLN 37 Ca 0.17 -0.88 0.01 0.00 0.05 0.00 0.00 55.36 54.72 1jgl s GLN 37 Cb -0.09 -2.13 0.02 0.00 1.10 0.00 0.00 33.01 31.91 1jgl s GLN 37 CO 0.08 0.33 -0.08 -1.14 -0.55 0.00 0.00 175.29 173.93 1jgl s GLN 38 N -0.06 1.31 -0.10 1.67 0.74 0.10 -0.46 119.66 122.86 1jgl s GLN 38 Ca -0.06 -0.26 -0.05 0.00 0.05 0.00 0.00 55.36 55.04 1jgl s GLN 38 Cb -0.14 -1.20 -0.04 0.00 1.10 0.00 0.00 33.01 32.72 1jgl s GLN 38 CO 0.04 -0.07 0.11 0.15 -0.55 0.00 0.00 175.29 174.98 1jgl s LYS 39 N 0.95 3.33 0.00 1.67 -0.14 -1.26 -1.56 119.74 122.72 1jgl s LYS 39 Ca -0.10 -0.21 0.00 0.00 -1.36 0.00 0.00 55.97 54.30 1jgl s LYS 39 Cb -0.15 -3.09 0.00 0.00 -1.68 0.00 0.00 37.83 32.92 1jgl s LYS 39 CO 0.00 0.75 0.00 0.00 -0.76 0.00 0.00 175.35 175.35 1jgl n GLN 40 N 1.92 0.00 0.00 1.68 10.64 -1.26 0.13 117.38 130.49 1jgl n GLN 40 Ca -0.19 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 54.98 1jgl n GLN 40 Cb 0.54 0.00 0.00 0.00 -0.86 0.00 0.00 30.24 29.92 1jgl n GLN 40 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 1jgl n GLY 41 N -0.15 1.62 3.35 2.61 0.00 -1.26 -4.98 105.19 106.38 1jgl n GLY 41 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 1jgl n GLY 41 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1jgl n LYS 42 N -1.62 -3.24 -1.77 1.61 4.76 0.12 -4.90 118.16 113.12 1jgl n LYS 42 Ca 0.00 -0.94 -0.41 0.00 -2.87 0.00 0.00 58.31 54.09 1jgl n LYS 42 Cb 0.00 -2.01 -0.01 0.00 -1.84 0.00 0.00 35.03 31.17 1jgl n LYS 42 CO 0.00 0.00 0.00 -1.12 -1.37 0.00 0.00 177.40 174.91 1jgl s SER 43 N -2.51 6.36 0.67 4.39 0.01 -1.26 -4.59 113.70 116.77 1jgl s SER 43 Ca 0.66 2.97 -0.16 0.00 1.31 0.00 0.00 55.95 60.72 1jgl s SER 43 Cb -0.20 -2.64 0.01 0.00 0.21 0.00 0.00 66.02 63.41 1jgl s SER 43 CO 0.62 -0.92 1.18 -2.84 0.41 0.00 0.00 173.24 171.69 1jgl s PRO 44 N -0.60 2.54 -0.07 12.44 0.02 -1.26 -4.70 135.00 143.37 1jgl s PRO 44 Ca 0.63 1.68 0.03 0.00 0.02 0.00 0.00 61.00 63.36 1jgl s PRO 44 Cb -0.48 -1.89 0.01 0.00 0.02 0.00 0.00 34.50 32.16 1jgl s PRO 44 CO 0.49 -1.51 -0.16 -0.65 -0.33 0.00 0.00 177.00 174.84 1jgl s GLN 45 N -3.80 2.01 0.25 5.54 -0.21 0.39 -4.94 119.66 118.91 1jgl s GLN 45 Ca 0.73 -0.57 -0.30 0.00 0.02 0.00 0.00 55.36 55.24 1jgl s GLN 45 Cb -0.27 -1.64 -0.10 0.00 1.00 0.00 0.00 33.01 32.00 1jgl s GLN 45 CO 0.41 0.13 1.32 -1.17 -2.12 0.00 0.00 175.29 173.85 1jgl s LEU 46 N 0.40 4.42 -0.09 2.90 2.96 -1.26 -1.29 118.68 126.72 1jgl s LEU 46 Ca -0.12 2.53 -0.06 0.00 -0.22 0.00 0.00 54.13 56.25 1jgl s LEU 46 Cb -0.15 -3.63 -0.04 0.00 0.50 0.00 0.00 46.19 42.87 1jgl s LEU 46 CO 0.04 -0.53 -0.14 0.18 -1.32 0.00 0.00 176.35 174.58 1jgl n LEU 47 N 1.93 0.94 -3.88 -0.68 4.77 0.16 -4.74 117.00 115.50 1jgl n LEU 47 Ca 0.04 0.16 -0.11 0.00 -0.03 0.00 0.00 56.01 56.06 1jgl n LEU 47 Cb 0.42 -0.37 -0.12 0.00 -2.33 0.00 0.00 43.42 41.02 1jgl n LEU 47 CO 0.58 0.04 -0.26 -0.69 -1.33 0.00 0.00 177.39 175.73 1jgl s VAL 48 N -2.24 0.05 0.05 4.08 1.01 -1.16 -1.38 120.40 120.80 1jgl s VAL 48 Ca -0.15 -0.38 0.00 0.00 0.00 0.00 0.00 61.98 61.45 1jgl s VAL 48 Cb 0.05 -0.23 -0.04 0.00 0.00 0.00 0.00 36.38 36.16 1jgl s VAL 48 CO 0.19 -0.21 -0.04 -0.72 0.00 0.00 0.00 175.10 174.32 1jgl s TYR 49 N -0.66 0.56 -1.31 5.22 -0.85 -0.27 0.28 117.35 120.33 1jgl s TYR 49 Ca -0.07 -0.88 -0.05 0.00 -0.52 0.00 0.00 57.07 55.55 1jgl s TYR 49 Cb -0.05 -0.38 0.01 0.00 0.38 0.00 0.00 41.96 41.92 1jgl s TYR 49 CO 0.00 -0.26 0.72 0.09 -1.52 0.00 0.00 175.55 174.58 1jgl n ASN 50 N 0.50 -5.71 0.00 -0.18 3.02 -0.28 -1.63 115.26 110.99 1jgl n ASN 50 Ca -0.16 -0.33 0.00 0.00 -0.03 0.00 0.00 54.58 54.05 1jgl n ASN 50 Cb 0.59 -4.46 0.00 0.00 -0.61 0.00 0.00 39.78 35.30 1jgl n ASN 50 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1jgl n ALA 51 N -3.85 0.00 -0.88 5.41 0.00 -0.03 -4.22 120.51 116.95 1jgl n ALA 51 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.38 1jgl n ALA 51 Cb 0.59 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.04 1jgl n ALA 51 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 1jgl n LYS 52 N 0.00 0.02 -3.28 0.00 2.85 -1.22 -3.04 118.16 113.49 1jgl n LYS 52 Ca 0.00 -0.23 -0.39 0.00 -1.05 0.00 0.00 58.31 56.64 1jgl n LYS 52 Cb 0.00 -0.56 -0.07 0.00 -0.65 0.00 0.00 35.03 33.75 1jgl n LYS 52 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 177.40 178.34 1jgl s THR 53 N -0.04 5.12 0.17 0.58 2.01 -0.64 -4.69 115.64 118.15 1jgl s THR 53 Ca 0.00 0.84 -0.30 0.00 0.31 0.00 0.00 61.69 62.54 1jgl s THR 53 Cb 0.00 -3.80 -0.08 0.00 0.01 0.00 0.00 72.50 68.63 1jgl s THR 53 CO 0.00 0.15 1.14 -0.76 -0.69 0.00 0.00 174.62 174.46 1jgl s LEU 54 N 1.87 4.47 0.74 4.42 1.43 -1.26 -1.11 118.68 129.24 1jgl s LEU 54 Ca 0.21 2.14 -0.11 0.00 -1.03 0.00 0.00 54.13 55.33 1jgl s LEU 54 Cb -0.15 -3.60 0.04 0.00 0.03 0.00 0.00 46.19 42.50 1jgl s LEU 54 CO 0.09 -0.29 1.09 0.00 0.23 0.00 0.00 176.35 177.47 1jgl s ALA 55 N -0.12 2.58 0.29 4.21 0.00 -0.48 -4.94 121.76 123.30 1jgl s ALA 55 Ca 0.51 -0.20 -0.29 0.00 0.00 0.00 0.00 51.96 51.98 1jgl s ALA 55 Cb -0.30 -3.09 -0.13 0.00 0.00 0.00 0.00 23.12 19.59 1jgl s ALA 55 CO 0.35 -1.40 1.22 -0.25 0.00 0.00 0.00 175.76 175.69 1jgl n ASP 56 N -3.21 2.21 0.00 0.00 8.00 -1.26 -2.06 116.55 120.23 1jgl n ASP 56 Ca 0.07 1.18 0.00 0.00 0.71 0.00 0.00 54.79 56.75 1jgl n ASP 56 Cb 0.56 -1.39 0.00 0.00 -0.02 0.00 0.00 41.12 40.27 1jgl n ASP 56 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1jgl n GLY 57 N 1.32 0.60 3.65 0.44 0.00 -1.26 -4.98 105.19 104.96 1jgl n GLY 57 Ca 0.09 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.68 1jgl n GLY 57 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1jgl s VAL 58 N -2.79 4.65 0.32 1.61 1.01 -0.87 -4.99 120.40 119.34 1jgl s VAL 58 Ca 0.00 1.81 -0.27 0.00 0.00 0.00 0.00 61.98 63.52 1jgl s VAL 58 Cb 0.00 -4.31 -0.14 0.00 0.00 0.00 0.00 36.38 31.94 1jgl s VAL 58 CO 0.00 -0.27 0.91 -2.65 0.00 0.00 0.00 175.10 173.09 1jgl n PRO 59 N 6.45 1.14 0.00 2.72 -0.02 -1.26 -4.84 135.00 139.19 1jgl n PRO 59 Ca 0.11 0.40 0.08 0.00 -2.02 0.00 0.00 63.50 62.06 1jgl n PRO 59 Cb 0.47 -1.75 0.40 0.00 -0.02 0.00 0.00 33.50 32.60 1jgl n PRO 59 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1jgl n SER 60 N 1.20 0.00 0.00 2.55 3.41 -1.26 -2.10 113.62 117.41 1jgl n SER 60 Ca 0.10 -0.08 0.12 0.00 -0.26 0.00 0.00 58.87 58.76 1jgl n SER 60 Cb 0.33 -0.21 0.60 0.00 -0.26 0.00 0.00 64.21 64.67 1jgl n SER 60 CO 0.00 0.00 0.00 -2.11 -0.16 0.00 0.00 175.04 172.77 1jgl n ARG 61 N -1.21 0.34 -3.74 4.33 1.85 -1.26 -4.61 116.66 112.36 1jgl n ARG 61 Ca 0.08 0.06 -0.37 0.00 -1.00 0.00 0.00 57.85 56.63 1jgl n ARG 61 Cb 0.10 -1.50 -0.07 0.00 -1.05 0.00 0.00 32.46 29.95 1jgl n ARG 61 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 1jgl s PHE 62 N -2.57 3.55 -0.20 2.89 0.08 -0.89 -2.28 117.98 118.56 1jgl s PHE 62 Ca 0.23 0.56 -0.16 0.00 0.12 0.00 0.00 56.93 57.67 1jgl s PHE 62 Cb 0.16 -2.10 0.06 0.00 -0.57 0.00 0.00 43.02 40.56 1jgl s PHE 62 CO 0.37 0.55 0.53 -1.54 -0.10 0.00 0.00 175.22 175.02 1jgl s SER 63 N -0.49 -0.60 0.14 1.36 1.04 -0.40 -4.99 113.70 109.77 1jgl s SER 63 Ca 0.15 1.10 0.07 0.00 0.48 0.00 0.00 55.95 57.74 1jgl s SER 63 Cb -0.13 1.07 -0.04 0.00 0.10 0.00 0.00 66.02 67.02 1jgl s SER 63 CO 0.04 -0.19 -0.01 -0.83 0.98 0.00 0.00 173.24 173.23 1jgl s GLY 64 N 0.69 1.79 0.38 7.32 0.00 -1.26 0.39 107.32 116.62 1jgl s GLY 64 Ca -0.03 -1.28 -0.08 0.00 0.00 0.00 0.00 44.72 43.33 1jgl s GLY 64 CO -0.05 -1.28 0.64 -1.35 0.00 0.00 0.00 173.10 171.06 1jgl s SER 65 N -2.69 0.58 0.00 1.64 1.04 -0.46 -4.40 113.70 109.42 1jgl s SER 65 Ca 0.26 -1.39 0.00 0.00 0.48 0.00 0.00 55.95 55.30 1jgl s SER 65 Cb -0.10 0.77 0.00 0.00 0.10 0.00 0.00 66.02 66.79 1jgl s SER 65 CO 0.18 -1.53 0.00 0.61 0.98 0.00 0.00 173.24 173.48 1jgl n GLY 66 N -0.57 0.84 3.68 7.32 0.00 -1.26 -1.76 105.19 113.44 1jgl n GLY 66 Ca -0.04 -2.26 -0.03 0.00 0.00 0.00 0.00 46.02 43.70 1jgl n GLY 66 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1jgl s SER 67 N 0.00 -0.16 1.60 1.61 1.04 -0.34 -4.94 113.70 112.50 1jgl s SER 67 Ca 0.00 -0.25 0.00 0.00 0.48 0.00 0.00 55.95 56.18 1jgl s SER 67 Cb 0.00 0.36 0.00 0.00 0.10 0.00 0.00 66.02 66.48 1jgl s SER 67 CO 0.00 -0.65 0.00 0.61 0.98 0.00 0.00 173.24 174.18 1jgl n GLY 68 N -0.43 1.22 0.11 7.32 0.00 -1.26 -1.96 105.19 110.19 1jgl n GLY 68 Ca -0.07 0.32 0.02 0.00 0.00 0.00 0.00 46.02 46.30 1jgl n GLY 68 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1jgl n THR 69 N 0.00 0.00 -4.67 2.61 -2.24 -1.26 -2.08 114.28 106.64 1jgl n THR 69 Ca 0.00 -0.46 -0.33 0.00 -2.27 0.00 0.00 64.05 60.99 1jgl n THR 69 Cb 0.00 1.06 -0.16 0.00 -2.10 0.00 0.00 70.33 69.12 1jgl n THR 69 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 1jgl s GLN 70 N -0.76 3.07 0.16 -0.78 -0.21 -0.83 -0.21 119.66 120.09 1jgl s GLN 70 Ca 0.04 -0.83 -0.00 0.00 0.02 0.00 0.00 55.36 54.58 1jgl s GLN 70 Cb 0.03 -2.47 -0.04 0.00 1.00 0.00 0.00 33.01 31.53 1jgl s GLN 70 CO 0.10 0.00 0.05 0.71 -2.12 0.00 0.00 175.29 174.03 1jgl s TYR 71 N 0.79 1.02 -0.01 0.91 1.51 -0.53 -1.20 117.35 119.83 1jgl s TYR 71 Ca -0.07 -1.18 -0.29 0.00 -1.01 0.00 0.00 57.07 54.51 1jgl s TYR 71 Cb -0.16 -0.57 0.08 0.00 -0.11 0.00 0.00 41.96 41.20 1jgl s TYR 71 CO -0.01 -0.43 0.70 -1.54 -1.11 0.00 0.00 175.55 173.15 1jgl s SER 72 N -3.11 -0.61 -0.16 2.29 1.04 -0.72 -1.16 113.70 111.27 1jgl s SER 72 Ca 0.26 0.53 -0.02 0.00 0.48 0.00 0.00 55.95 57.19 1jgl s SER 72 Cb 0.07 0.53 -0.02 0.00 0.10 0.00 0.00 66.02 66.70 1jgl s SER 72 CO 0.04 -0.66 -0.07 -0.22 0.98 0.00 0.00 173.24 173.30 1jgl s LEU 73 N -1.54 2.96 -0.12 2.42 2.96 0.16 -1.35 118.68 124.17 1jgl s LEU 73 Ca -0.07 -0.27 -0.01 0.00 -0.22 0.00 0.00 54.13 53.55 1jgl s LEU 73 Cb -0.00 -1.71 -0.03 0.00 0.50 0.00 0.00 46.19 44.96 1jgl s LEU 73 CO 0.04 0.12 -0.07 -0.75 -1.32 0.00 0.00 176.35 174.38 1jgl s LYS 74 N 0.63 3.30 -0.24 1.98 2.20 0.16 -0.87 119.74 126.90 1jgl s LYS 74 Ca -0.04 -0.56 0.01 0.00 -0.36 0.00 0.00 55.97 55.01 1jgl s LYS 74 Cb -0.15 -2.75 0.06 0.00 -1.51 0.00 0.00 37.83 33.49 1jgl s LYS 74 CO 0.03 0.39 -0.04 0.42 -0.36 0.00 0.00 175.35 175.78 1jgl s ILE 75 N -0.05 1.49 0.13 5.43 1.01 -0.37 -1.27 121.20 127.56 1jgl s ILE 75 Ca 0.00 -1.22 0.04 0.00 0.00 0.00 0.00 60.65 59.47 1jgl s ILE 75 Cb -0.13 -1.78 -0.04 0.00 0.01 0.00 0.00 42.46 40.52 1jgl s ILE 75 CO 0.03 -0.13 0.14 0.54 0.00 0.00 0.00 174.94 175.51 1jgl s ASN 76 N 1.41 5.65 -1.05 3.58 2.20 -0.96 -0.77 114.94 125.00 1jgl s ASN 76 Ca -0.05 -0.04 -0.15 0.00 -0.94 0.00 0.00 52.86 51.69 1jgl s ASN 76 Cb -0.19 -1.53 -0.01 0.00 -2.00 0.00 0.00 41.25 37.52 1jgl s ASN 76 CO -0.07 0.10 0.78 -1.20 -2.94 0.00 0.00 177.10 173.78 1jgl n SER 77 N -0.08 -5.78 -4.59 3.54 7.64 -0.55 -4.84 113.62 108.95 1jgl n SER 77 Ca -0.08 -0.86 -0.44 0.00 1.01 0.00 0.00 58.87 58.50 1jgl n SER 77 Cb 0.53 -3.69 -0.01 0.00 -1.01 0.00 0.00 64.21 60.03 1jgl n SER 77 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1jgl n LEU 78 N -3.61 1.90 -4.69 -3.43 4.77 -0.11 -4.48 117.00 107.35 1jgl n LEU 78 Ca -0.10 1.15 -0.24 0.00 -0.03 0.00 0.00 56.01 56.79 1jgl n LEU 78 Cb 0.59 -1.30 -0.07 0.00 -2.33 0.00 0.00 43.42 40.32 1jgl n LEU 78 CO 0.64 -1.43 -0.30 -1.10 -1.33 0.00 0.00 177.39 173.87 1jgl s GLN 79 N -1.63 2.47 0.53 3.23 -1.52 -1.26 -1.32 119.66 120.16 1jgl s GLN 79 Ca 0.59 -1.21 0.22 0.00 -1.95 0.00 0.00 55.36 53.01 1jgl s GLN 79 Cb -0.67 -2.33 1.37 0.00 -0.22 0.00 0.00 33.01 31.16 1jgl s GLN 79 CO 0.60 0.41 2.07 -1.00 -0.25 0.00 0.00 175.29 177.12 1jgl h PRO 80 N 2.17 0.00 0.00 2.91 0.13 -2.00 -0.32 132.00 134.89 1jgl h PRO 80 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 1jgl h PRO 80 Cb 1.23 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.36 1jgl h PRO 80 CO 0.59 0.00 0.00 -0.85 -0.23 0.00 0.00 178.00 177.51 1jgl n GLU 81 N -4.39 0.60 0.06 0.86 0.00 -1.26 -3.16 120.64 113.34 1jgl n GLU 81 Ca 0.04 0.02 0.13 0.00 0.00 0.00 0.00 57.16 57.35 1jgl n GLU 81 Cb 0.37 -1.50 0.42 0.00 0.00 0.00 0.00 31.44 30.73 1jgl n GLU 81 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 1jgl n ASP 82 N -1.16 0.54 -4.73 -1.84 10.43 -0.13 -4.84 116.55 114.83 1jgl n ASP 82 Ca 0.16 0.41 -0.41 0.00 2.57 0.00 0.00 54.79 57.53 1jgl n ASP 82 Cb 0.16 -0.47 -0.04 0.00 1.84 0.00 0.00 41.12 42.60 1jgl n ASP 82 CO 0.00 0.00 0.00 -0.36 -1.07 0.00 0.00 177.20 175.77 1jgl s PHE 83 N -3.07 3.75 -4.40 1.24 0.40 -1.19 -4.88 117.98 109.83 1jgl s PHE 83 Ca 0.11 1.69 0.00 0.00 -0.60 0.00 0.00 56.93 58.12 1jgl s PHE 83 Cb 0.15 -3.01 0.00 0.00 0.51 0.00 0.00 43.02 40.67 1jgl s PHE 83 CO 0.61 0.17 0.00 0.41 0.70 0.00 0.00 175.22 177.10 1jgl n GLY 84 N 2.47 -0.53 3.54 4.36 0.00 -0.80 -4.93 105.19 109.30 1jgl n GLY 84 Ca 0.02 -0.73 -0.32 0.00 0.00 0.00 0.00 46.02 44.98 1jgl n GLY 84 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1jgl s THR 85 N -3.95 3.39 0.05 2.61 2.01 -0.60 -0.22 115.64 118.93 1jgl s THR 85 Ca 0.00 -0.78 0.09 0.00 0.31 0.00 0.00 61.69 61.31 1jgl s THR 85 Cb 0.00 -2.42 -0.03 0.00 0.01 0.00 0.00 72.50 70.06 1jgl s THR 85 CO 0.00 0.47 -0.24 -0.31 -0.69 0.00 0.00 174.62 173.85 1jgl s TYR 86 N -0.89 2.40 -0.00 4.92 1.51 0.05 0.01 117.35 125.35 1jgl s TYR 86 Ca 0.15 -0.36 -0.00 0.00 -1.01 0.00 0.00 57.07 55.85 1jgl s TYR 86 Cb -0.11 -1.40 -0.00 0.00 -0.11 0.00 0.00 41.96 40.34 1jgl s TYR 86 CO 0.04 0.19 0.01 0.71 -1.11 0.00 0.00 175.55 175.39 1jgl s TYR 87 N -0.88 0.02 0.18 2.71 1.51 -0.48 -0.52 117.35 119.89 1jgl s TYR 87 Ca 0.13 -0.04 0.04 0.00 -1.01 0.00 0.00 57.07 56.19 1jgl s TYR 87 Cb -0.10 -0.02 -0.03 0.00 -0.11 0.00 0.00 41.96 41.70 1jgl s TYR 87 CO 0.04 -0.03 0.28 0.00 -1.11 0.00 0.00 175.55 174.73 1jgl s HIS 89 N -1.84 -0.52 0.34 0.00 2.46 0.12 -0.34 115.29 115.50 1jgl s HIS 89 Ca 0.34 0.65 -0.09 0.00 0.47 0.00 0.00 55.06 56.42 1jgl s HIS 89 Cb -0.10 -0.13 -0.06 0.00 -0.13 0.00 0.00 32.58 32.15 1jgl s HIS 89 CO 0.28 -0.59 0.68 -3.38 -2.47 0.00 0.00 174.74 169.26 1jgl s HIS 90 N 2.44 3.45 -0.26 3.88 -3.43 -0.86 -0.72 115.29 119.79 1jgl s HIS 90 Ca 0.07 0.93 0.22 0.00 -0.80 0.00 0.00 55.06 55.49 1jgl s HIS 90 Cb -0.15 -2.34 0.49 0.00 -1.43 0.00 0.00 32.58 29.16 1jgl s HIS 90 CO -0.13 0.04 1.16 1.97 -2.00 0.00 0.00 174.74 175.79 1jgl n PHE 91 N -0.93 0.82 0.12 0.38 -1.74 0.23 -3.66 117.46 112.68 1jgl n PHE 91 Ca 0.01 -2.02 -0.24 0.00 -0.56 0.00 0.00 57.45 54.64 1jgl n PHE 91 Cb 0.54 -0.01 -0.16 0.00 1.52 0.00 0.00 39.48 41.37 1jgl n PHE 91 CO 0.00 0.00 0.00 2.35 -0.56 0.00 0.00 176.76 178.55 1jgl h TRP 92 N 2.35 0.85 -2.89 2.97 2.91 -1.84 -3.48 115.95 116.83 1jgl h TRP 92 Ca -0.18 -0.62 -0.11 0.00 1.13 0.00 0.00 58.89 59.11 1jgl h TRP 92 Cb 1.30 -0.03 -0.20 0.00 -0.51 0.00 0.00 29.16 29.71 1jgl h TRP 92 CO 0.42 1.51 -0.21 -1.54 -1.03 0.00 0.00 178.44 177.59 1jgl s SER 93 N -7.41 -0.25 0.29 2.65 1.04 -1.26 -5.13 113.70 103.63 1jgl s SER 93 Ca -0.11 0.17 -0.29 0.00 0.48 0.00 0.00 55.95 56.20 1jgl s SER 93 Cb 0.03 0.34 -0.10 0.00 0.10 0.00 0.00 66.02 66.40 1jgl s SER 93 CO 0.91 -0.47 1.21 -0.89 0.98 0.00 0.00 173.24 174.98 1jgl s THR 94 N -1.32 3.12 0.26 2.02 2.01 -1.26 -3.61 115.64 116.86 1jgl s THR 94 Ca -0.13 1.10 -0.20 0.00 0.31 0.00 0.00 61.69 62.77 1jgl s THR 94 Cb -0.04 -3.70 -0.09 0.00 0.01 0.00 0.00 72.50 68.68 1jgl s THR 94 CO 0.05 0.25 0.78 -2.16 -0.69 0.00 0.00 174.62 172.85 1jgl s PRO 95 N -1.47 4.29 -1.00 4.92 0.04 -1.26 -4.72 135.00 135.80 1jgl s PRO 95 Ca 0.48 0.95 -0.23 0.00 0.04 0.00 0.00 61.00 62.23 1jgl s PRO 95 Cb -0.36 -2.78 0.03 0.00 0.04 0.00 0.00 34.50 31.43 1jgl s PRO 95 CO 0.46 0.32 1.56 -1.58 0.04 0.00 0.00 177.00 177.81 1jgl s TRP 96 N -1.63 2.37 0.35 0.56 0.51 -1.24 -4.65 118.94 115.22 1jgl s TRP 96 Ca 0.47 -0.52 -0.18 0.00 -2.12 0.00 0.00 56.10 53.75 1jgl s TRP 96 Cb -0.16 -4.56 -0.10 0.00 -0.81 0.00 0.00 33.47 27.85 1jgl s TRP 96 CO 0.21 -1.90 0.81 0.95 -0.51 0.00 0.00 176.95 176.51 1jgl s THR 97 N 6.10 4.56 0.26 2.01 -4.23 -1.24 -4.79 115.64 118.31 1jgl s THR 97 Ca 0.51 1.18 0.01 0.00 -1.18 0.00 0.00 61.69 62.22 1jgl s THR 97 Cb -0.01 -3.64 -0.04 0.00 1.34 0.00 0.00 72.50 70.15 1jgl s THR 97 CO -0.08 -0.18 0.44 -0.36 -0.54 0.00 0.00 174.62 173.89 1jgl s PHE 98 N -2.00 3.48 0.70 3.99 0.40 -1.26 -2.04 117.98 121.26 1jgl s PHE 98 Ca 0.56 0.23 -0.11 0.00 -0.60 0.00 0.00 56.93 57.01 1jgl s PHE 98 Cb -0.11 -1.78 0.02 0.00 0.51 0.00 0.00 43.02 41.67 1jgl s PHE 98 CO 0.17 0.31 1.08 0.20 0.70 0.00 0.00 175.22 177.67 1jgl s GLY 99 N -3.72 1.62 0.17 4.36 0.00 0.54 -4.45 107.32 105.84 1jgl s GLY 99 Ca 0.38 -0.45 0.19 0.00 0.00 0.00 0.00 44.72 44.84 1jgl s GLY 99 CO 0.31 -0.08 1.60 0.61 0.00 0.00 0.00 173.10 175.54 1jgl n GLY 100 N -2.99 -1.12 0.00 0.20 0.00 -1.26 -4.67 105.19 95.35 1jgl n GLY 100 Ca 0.07 0.05 0.00 0.00 0.00 0.00 0.00 46.02 46.14 1jgl n GLY 100 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1jgl n GLY 101 N -0.19 1.67 2.94 -0.02 0.00 -1.26 -5.04 105.19 103.29 1jgl n GLY 101 Ca 0.02 -1.80 -0.25 0.00 0.00 0.00 0.00 46.02 44.00 1jgl n GLY 101 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1jgl s THR 102 N -2.74 0.96 -0.35 2.61 2.01 0.32 -4.46 115.64 113.98 1jgl s THR 102 Ca 0.00 -0.31 -0.17 0.00 0.31 0.00 0.00 61.69 61.52 1jgl s THR 102 Cb 0.00 -0.95 -0.00 0.00 0.01 0.00 0.00 72.50 71.56 1jgl s THR 102 CO 0.00 0.34 0.47 -0.75 -0.69 0.00 0.00 174.62 173.98 1jgl s LYS 103 N 1.23 3.56 -0.34 4.92 2.20 0.92 -0.77 119.74 131.45 1jgl s LYS 103 Ca -0.04 -0.28 -0.10 0.00 -0.36 0.00 0.00 55.97 55.18 1jgl s LYS 103 Cb -0.14 -3.82 0.01 0.00 -1.51 0.00 0.00 37.83 32.37 1jgl s LYS 103 CO -0.03 -0.63 0.18 -1.17 -0.36 0.00 0.00 175.35 173.35 1jgl s LEU 104 N 2.27 4.42 0.30 5.43 2.96 0.70 -0.23 118.68 134.52 1jgl s LEU 104 Ca 0.16 -0.74 0.10 0.00 -0.22 0.00 0.00 54.13 53.43 1jgl s LEU 104 Cb -0.16 -2.02 -0.05 0.00 0.50 0.00 0.00 46.19 44.46 1jgl s LEU 104 CO 0.13 -0.29 -0.06 -1.61 -1.32 0.00 0.00 176.35 173.20 1jgl s GLU 105 N 1.59 2.04 0.04 1.98 2.02 0.03 -1.90 118.70 124.50 1jgl s GLU 105 Ca 0.03 -1.64 -0.30 0.00 0.02 0.00 0.00 54.97 53.09 1jgl s GLU 105 Cb -0.18 -1.96 -0.05 0.00 0.10 0.00 0.00 34.13 32.04 1jgl s GLU 105 CO 0.07 0.28 1.06 0.08 0.02 0.00 0.00 175.26 176.77 1jgl s VAL 106 N -2.45 4.47 -0.18 2.63 1.01 -1.26 -1.75 120.40 122.88 1jgl s VAL 106 Ca 0.32 1.82 -0.17 0.00 0.00 0.00 0.00 61.98 63.95 1jgl s VAL 106 Cb -0.04 -4.17 -0.04 0.00 0.00 0.00 0.00 36.38 32.14 1jgl s VAL 106 CO 0.18 0.17 0.45 -0.75 0.00 0.00 0.00 175.10 175.14 1jgl s LYS 107 N 0.83 4.21 0.31 2.72 2.20 0.21 -4.79 119.74 125.45 1jgl s LYS 107 Ca 0.54 0.31 -0.00 0.00 -0.36 0.00 0.00 55.97 56.45 1jgl s LYS 107 Cb -0.25 -3.52 -0.01 0.00 -1.51 0.00 0.00 37.83 32.54 1jgl s LYS 107 CO 0.29 -0.02 0.38 -0.98 -0.36 0.00 0.00 175.35 174.66 1jgl s ARG 108 N 1.24 1.75 0.51 4.03 1.70 -1.26 -4.62 118.95 122.30 1jgl s ARG 108 Ca 0.22 -1.77 -0.21 0.00 -0.47 0.00 0.00 55.73 53.50 1jgl s ARG 108 Cb -0.15 0.39 -0.06 0.00 -0.57 0.00 0.00 34.95 34.56 1jgl s ARG 108 CO 0.09 -0.69 1.16 0.00 -1.08 0.00 0.00 175.30 174.78 1jgl s ALA 109 N -3.38 2.82 0.62 7.88 0.00 -1.26 -4.94 121.76 123.51 1jgl s ALA 109 Ca 0.34 0.92 -0.18 0.00 0.00 0.00 0.00 51.96 53.03 1jgl s ALA 109 Cb 0.01 -3.39 -0.03 0.00 0.00 0.00 0.00 23.12 19.71 1jgl s ALA 109 CO 0.20 -0.77 1.12 -0.25 0.00 0.00 0.00 175.76 176.06 1jgl n ASP 110 N -0.92 1.41 -3.70 0.00 8.00 -1.26 -4.80 116.55 115.29 1jgl n ASP 110 Ca 0.10 0.82 -0.12 0.00 0.71 0.00 0.00 54.79 56.30 1jgl n ASP 110 Cb 0.49 -1.47 -0.12 0.00 -0.02 0.00 0.00 41.12 40.00 1jgl n ASP 110 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1jgl s ALA 111 N -1.45 -0.76 0.42 2.24 0.00 0.14 -4.90 121.76 117.45 1jgl s ALA 111 Ca 0.78 1.19 -0.23 0.00 0.00 0.00 0.00 51.96 53.71 1jgl s ALA 111 Cb -0.40 -0.86 -0.09 0.00 0.00 0.00 0.00 23.12 21.77 1jgl s ALA 111 CO 0.44 -0.36 1.05 0.00 0.00 0.00 0.00 175.76 176.90 1jgl s ALA 112 N 1.65 3.04 0.63 0.00 0.00 -1.26 -1.14 121.76 124.69 1jgl s ALA 112 Ca -0.07 0.69 -0.16 0.00 0.00 0.00 0.00 51.96 52.42 1jgl s ALA 112 Cb -0.10 -3.27 -0.02 0.00 0.00 0.00 0.00 23.12 19.73 1jgl s ALA 112 CO -0.10 -0.25 1.11 -1.25 0.00 0.00 0.00 175.76 175.28 1jgl s PRO 113 N -2.65 2.94 -0.33 0.00 0.04 -1.26 -4.55 135.00 129.20 1jgl s PRO 113 Ca 0.60 1.44 -0.12 0.00 0.04 0.00 0.00 61.00 62.96 1jgl s PRO 113 Cb -0.21 -1.97 -0.02 0.00 0.04 0.00 0.00 34.50 32.35 1jgl s PRO 113 CO 0.26 -1.14 0.21 0.99 0.04 0.00 0.00 177.00 177.35 1jgl s THR 114 N -2.20 5.04 -0.11 1.26 2.01 -0.25 -4.88 115.64 116.50 1jgl s THR 114 Ca 0.68 -0.27 -0.14 0.00 0.31 0.00 0.00 61.69 62.27 1jgl s THR 114 Cb -0.21 -3.57 -0.05 0.00 0.01 0.00 0.00 72.50 68.68 1jgl s THR 114 CO 0.38 0.03 0.35 -0.69 -0.69 0.00 0.00 174.62 174.00 1jgl s VAL 115 N 1.68 5.23 -0.04 3.82 1.01 -1.26 -1.70 120.40 129.14 1jgl s VAL 115 Ca 0.06 0.68 0.01 0.00 0.00 0.00 0.00 61.98 62.73 1jgl s VAL 115 Cb -0.17 -3.67 0.02 0.00 0.00 0.00 0.00 36.38 32.56 1jgl s VAL 115 CO 0.09 0.44 -0.05 -0.44 0.00 0.00 0.00 175.10 175.13 1jgl s SER 116 N 0.02 0.99 0.00 3.32 0.01 -0.58 -4.90 113.70 112.56 1jgl s SER 116 Ca 0.20 -0.14 0.06 0.00 1.31 0.00 0.00 55.95 57.38 1jgl s SER 116 Cb -0.14 -0.46 -0.03 0.00 0.21 0.00 0.00 66.02 65.60 1jgl s SER 116 CO 0.07 -0.03 -0.18 -0.51 0.41 0.00 0.00 173.24 173.00 1jgl s ILE 117 N 0.79 2.80 -0.09 1.44 2.07 -1.26 -0.50 121.20 126.44 1jgl s ILE 117 Ca -0.11 -1.02 -0.00 0.00 -1.41 0.00 0.00 60.65 58.11 1jgl s ILE 117 Cb -0.14 -2.13 0.02 0.00 0.13 0.00 0.00 42.46 40.35 1jgl s ILE 117 CO 0.01 0.45 -0.06 -0.36 -1.91 0.00 0.00 174.94 173.06 1jgl s PHE 118 N -0.82 1.24 0.84 3.50 0.08 0.17 -4.99 117.98 117.99 1jgl s PHE 118 Ca 0.13 -0.54 -0.11 0.00 0.12 0.00 0.00 56.93 56.53 1jgl s PHE 118 Cb -0.10 -1.07 0.10 0.00 -0.57 0.00 0.00 43.02 41.38 1jgl s PHE 118 CO 0.03 -0.41 1.09 -2.14 -0.10 0.00 0.00 175.22 173.69 1jgl s PRO 119 N 1.54 1.68 0.68 0.24 0.02 -1.26 -1.69 135.00 136.20 1jgl s PRO 119 Ca 0.01 0.87 -0.17 0.00 0.02 0.00 0.00 61.00 61.72 1jgl s PRO 119 Cb -0.13 -1.85 0.00 0.00 0.02 0.00 0.00 34.50 32.54 1jgl s PRO 119 CO -0.05 -1.96 1.26 -2.30 -0.33 0.00 0.00 177.00 173.62 1jgl n PRO 120 N -3.70 0.94 -1.86 5.54 -0.02 -1.23 -4.80 135.00 129.87 1jgl n PRO 120 Ca 0.07 0.38 -0.31 0.00 -2.02 0.00 0.00 63.50 61.63 1jgl n PRO 120 Cb 0.55 -2.50 0.03 0.00 -0.02 0.00 0.00 33.50 31.55 1jgl n PRO 120 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 1jgl s SER 121 N -1.50 5.86 0.21 2.55 1.04 -1.26 -4.91 113.70 115.68 1jgl s SER 121 Ca 0.81 1.31 -0.05 0.00 0.48 0.00 0.00 55.95 58.50 1jgl s SER 121 Cb -0.37 -2.25 0.17 0.00 0.10 0.00 0.00 66.02 63.67 1jgl s SER 121 CO 0.42 -1.10 1.62 0.77 0.98 0.00 0.00 173.24 175.94 1jgl h SER 122 N -0.48 0.81 0.17 7.02 4.64 -1.98 -1.44 113.55 122.28 1jgl h SER 122 Ca -0.44 -0.29 -0.00 0.00 -0.47 0.00 0.00 61.79 60.58 1jgl h SER 122 Cb 1.22 -0.22 -0.01 0.00 -0.31 0.00 0.00 62.40 63.08 1jgl h SER 122 CO 0.62 1.01 -0.14 -0.08 -0.87 0.00 0.00 176.83 177.37 1jgl h GLU 123 N 0.70 -0.31 -0.67 4.77 4.81 -1.99 0.28 114.58 122.17 1jgl h GLU 123 Ca 0.10 0.02 -0.05 0.00 -0.13 0.00 0.00 59.36 59.30 1jgl h GLU 123 Cb 0.74 0.07 -0.03 0.00 0.63 0.00 0.00 28.75 30.16 1jgl h GLU 123 CO 0.06 -0.21 0.22 0.37 -0.73 0.00 0.00 179.01 178.72 1jgl h GLN 124 N -0.32 1.01 -0.92 1.92 4.15 -1.84 -2.30 115.11 116.81 1jgl h GLN 124 Ca -0.01 -0.20 -0.00 0.00 0.77 0.00 0.00 58.65 59.21 1jgl h GLN 124 Cb 0.29 -0.16 -0.04 0.00 0.21 0.00 0.00 27.48 27.78 1jgl h GLN 124 CO -0.01 0.86 0.56 -0.07 -1.93 0.00 0.00 178.83 178.23 1jgl h LEU 125 N 0.98 1.09 -1.62 -2.39 4.07 -0.90 -1.04 115.31 115.50 1jgl h LEU 125 Ca 0.22 -0.06 -0.04 0.00 0.08 0.00 0.00 57.88 58.07 1jgl h LEU 125 Cb 0.26 -0.28 -0.01 0.00 1.08 0.00 0.00 40.66 41.72 1jgl h LEU 125 CO -0.01 0.84 -0.21 0.74 -1.08 0.00 0.00 178.44 178.72 1jgl h THR 126 N 1.26 1.01 -0.03 0.22 2.02 -0.47 -1.21 112.91 115.70 1jgl h THR 126 Ca 0.33 -0.74 0.00 0.00 0.77 0.00 0.00 66.41 66.76 1jgl h THR 126 Cb -0.06 1.42 0.00 0.00 -1.74 0.00 0.00 68.15 67.77 1jgl h THR 126 CO -0.06 0.20 0.00 -1.54 0.37 0.00 0.00 175.52 174.49 1jgl n SER 127 N -4.09 0.81 0.00 4.18 3.41 -0.49 -4.90 113.62 112.54 1jgl n SER 127 Ca -0.02 -1.36 0.00 0.00 -0.26 0.00 0.00 58.87 57.23 1jgl n SER 127 Cb 0.28 -0.02 0.00 0.00 -0.26 0.00 0.00 64.21 64.21 1jgl n SER 127 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1jgl n GLY 128 N 1.05 0.69 3.67 5.00 0.00 -0.46 -5.07 105.19 110.06 1jgl n GLY 128 Ca 0.19 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.98 1jgl n GLY 128 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1jgl s GLY 129 N -1.42 1.69 -0.31 -0.02 0.00 -0.64 -1.93 107.32 104.70 1jgl s GLY 129 Ca 0.00 -1.67 -0.00 0.00 0.00 0.00 0.00 44.72 43.04 1jgl s GLY 129 CO 0.00 -1.71 0.27 0.00 0.00 0.00 0.00 173.10 171.66 1jgl s ALA 130 N -2.33 -0.16 -0.22 3.20 0.00 0.30 -2.96 121.76 119.59 1jgl s ALA 130 Ca 0.32 -0.68 -0.08 0.00 0.00 0.00 0.00 51.96 51.53 1jgl s ALA 130 Cb -0.06 -1.75 -0.04 0.00 0.00 0.00 0.00 23.12 21.27 1jgl s ALA 130 CO 0.21 -1.80 0.08 -1.12 0.00 0.00 0.00 175.76 173.13 1jgl s SER 131 N 2.07 5.48 -0.23 0.00 0.01 -1.26 0.11 113.70 119.88 1jgl s SER 131 Ca 0.11 -0.05 -0.09 0.00 1.31 0.00 0.00 55.95 57.23 1jgl s SER 131 Cb -0.15 -1.97 -0.04 0.00 0.21 0.00 0.00 66.02 64.07 1jgl s SER 131 CO -0.27 0.06 0.12 -0.69 0.41 0.00 0.00 173.24 172.87 1jgl s VAL 132 N 1.08 4.97 -0.06 3.43 1.01 0.25 -3.54 120.40 127.55 1jgl s VAL 132 Ca 0.05 0.04 0.00 0.00 0.00 0.00 0.00 61.98 62.07 1jgl s VAL 132 Cb -0.14 -3.31 -0.03 0.00 0.00 0.00 0.00 36.38 32.90 1jgl s VAL 132 CO 0.03 0.36 -0.04 -0.69 0.00 0.00 0.00 175.10 174.77 1jgl s VAL 133 N 1.06 3.96 -0.06 2.92 1.01 -0.68 -1.27 120.40 127.34 1jgl s VAL 133 Ca 0.06 -0.44 0.01 0.00 0.00 0.00 0.00 61.98 61.61 1jgl s VAL 133 Cb -0.14 -2.66 0.02 0.00 0.00 0.00 0.00 36.38 33.60 1jgl s VAL 133 CO 0.04 0.55 -0.08 0.00 0.00 0.00 0.00 175.10 175.61 1jgl s PHE 135 N 0.90 3.05 -0.47 0.00 0.08 0.34 -0.22 117.98 121.67 1jgl s PHE 135 Ca -0.11 -0.08 0.03 0.00 0.12 0.00 0.00 56.93 56.89 1jgl s PHE 135 Cb -0.15 -1.86 0.12 0.00 -0.57 0.00 0.00 43.02 40.57 1jgl s PHE 135 CO 0.01 0.19 0.22 -0.51 -0.10 0.00 0.00 175.22 175.02 1jgl s LEU 136 N -0.23 4.02 0.09 -0.37 1.02 0.95 -1.53 118.68 122.62 1jgl s LEU 136 Ca 0.04 -2.76 -0.02 0.00 0.02 0.00 0.00 54.13 51.41 1jgl s LEU 136 Cb -0.13 -1.50 -0.05 0.00 0.02 0.00 0.00 46.19 44.54 1jgl s LEU 136 CO 0.02 -0.27 0.28 0.20 0.02 0.00 0.00 176.35 176.60 1jgl s ASN 137 N 0.09 6.42 -1.03 2.29 0.01 -0.69 -0.17 114.94 121.86 1jgl s ASN 137 Ca 0.16 0.42 -0.17 0.00 -0.71 0.00 0.00 52.86 52.55 1jgl s ASN 137 Cb -0.24 -2.02 0.01 0.00 0.41 0.00 0.00 41.25 39.41 1jgl s ASN 137 CO -0.02 0.13 0.69 0.59 -1.51 0.00 0.00 177.10 176.98 1jgl n ASN 138 N 0.29 -5.01 -4.60 -1.22 4.13 -0.78 -1.09 115.26 106.98 1jgl n ASN 138 Ca -0.05 -1.02 -0.27 0.00 1.68 0.00 0.00 54.58 54.93 1jgl n ASN 138 Cb 0.51 -2.43 -0.10 0.00 -1.54 0.00 0.00 39.78 36.22 1jgl n ASN 138 CO 0.00 0.00 0.00 0.72 0.28 0.00 0.00 177.26 178.26 1jgl s PHE 139 N -3.29 2.48 -0.28 3.10 -0.71 -0.10 -4.60 117.98 114.58 1jgl s PHE 139 Ca 0.29 -0.58 -0.21 0.00 -1.04 0.00 0.00 56.93 55.39 1jgl s PHE 139 Cb -0.14 -1.61 0.11 0.00 -1.21 0.00 0.00 43.02 40.17 1jgl s PHE 139 CO 0.90 0.49 0.89 -0.47 -1.34 0.00 0.00 175.22 175.69 1jgl s TYR 140 N -2.65 -0.67 1.07 3.49 5.04 -0.29 0.29 117.35 123.63 1jgl s TYR 140 Ca 0.34 1.49 -0.15 0.00 -2.44 0.00 0.00 57.07 56.32 1jgl s TYR 140 Cb 0.06 0.39 0.22 0.00 0.35 0.00 0.00 41.96 42.98 1jgl s TYR 140 CO 0.18 -0.33 1.10 -1.25 -1.34 0.00 0.00 175.55 173.91 1jgl s PRO 141 N 0.76 -0.15 0.53 4.97 0.04 -1.26 0.24 135.00 140.13 1jgl s PRO 141 Ca -0.03 0.30 0.27 0.00 0.04 0.00 0.00 61.00 61.58 1jgl s PRO 141 Cb -0.05 -1.69 1.47 0.00 0.04 0.00 0.00 34.50 34.27 1jgl s PRO 141 CO -0.09 -3.07 2.09 1.57 0.04 0.00 0.00 177.00 177.54 1jgl h LYS 142 N -2.13 0.00 -6.51 4.56 2.10 -1.98 -3.44 116.57 109.17 1jgl h LYS 142 Ca -0.52 0.00 -0.53 0.00 -2.00 0.00 0.00 60.65 57.60 1jgl h LYS 142 Cb 1.32 0.00 0.02 0.00 -0.90 0.00 0.00 32.23 32.67 1jgl h LYS 142 CO 0.51 0.11 0.83 -0.51 -2.00 0.00 0.00 179.45 178.38 1jgl s ASP 143 N -6.22 6.74 0.05 7.07 1.01 -1.26 -4.98 116.67 119.07 1jgl s ASP 143 Ca -0.03 2.38 -0.27 0.00 0.71 0.00 0.00 52.55 55.34 1jgl s ASP 143 Cb 0.14 -2.58 0.08 0.00 1.01 0.00 0.00 42.92 41.56 1jgl s ASP 143 CO 0.59 -0.74 0.69 -0.51 0.21 0.00 0.00 175.17 175.41 1jgl s ILE 144 N 1.61 0.00 0.03 0.77 2.07 -1.26 -4.67 121.20 119.75 1jgl s ILE 144 Ca 0.67 0.00 0.04 0.00 -1.41 0.00 0.00 60.65 59.95 1jgl s ILE 144 Cb -0.38 -1.00 -0.02 0.00 0.13 0.00 0.00 42.46 41.19 1jgl s ILE 144 CO 0.30 0.00 -0.12 0.20 -1.91 0.00 0.00 174.94 173.41 1jgl s ASN 145 N -2.08 1.41 -0.03 4.50 0.01 -0.74 -4.98 114.94 113.03 1jgl s ASN 145 Ca -0.03 -0.42 0.07 0.00 -0.71 0.00 0.00 52.86 51.78 1jgl s ASN 145 Cb -0.01 -0.08 -0.02 0.00 0.41 0.00 0.00 41.25 41.55 1jgl s ASN 145 CO -0.04 0.01 -0.26 -0.69 -1.51 0.00 0.00 177.10 174.61 1jgl s VAL 146 N -0.82 2.06 -0.05 1.60 1.01 -1.26 -0.53 120.40 122.41 1jgl s VAL 146 Ca -0.00 -1.09 0.00 0.00 0.00 0.00 0.00 61.98 60.89 1jgl s VAL 146 Cb -0.07 -1.72 0.02 0.00 0.00 0.00 0.00 36.38 34.61 1jgl s VAL 146 CO 0.01 0.58 -0.03 -0.75 0.00 0.00 0.00 175.10 174.90 1jgl s LYS 147 N -0.49 0.76 0.04 2.72 2.20 0.45 -4.98 119.74 120.45 1jgl s LYS 147 Ca 0.06 -0.05 -0.04 0.00 -0.36 0.00 0.00 55.97 55.59 1jgl s LYS 147 Cb -0.11 -0.86 -0.05 0.00 -1.51 0.00 0.00 37.83 35.30 1jgl s LYS 147 CO 0.00 -0.14 0.25 -1.58 -0.36 0.00 0.00 175.35 173.53 1jgl s TRP 148 N 1.17 3.54 -0.01 4.03 0.52 -1.26 -0.63 118.94 126.29 1jgl s TRP 148 Ca -0.07 0.45 0.00 0.00 0.02 0.00 0.00 56.10 56.50 1jgl s TRP 148 Cb -0.14 -1.90 0.02 0.00 -1.15 0.00 0.00 33.47 30.30 1jgl s TRP 148 CO -0.01 0.58 0.00 0.15 0.02 0.00 0.00 176.95 177.69 1jgl s LYS 149 N -2.13 0.12 -0.13 4.98 1.02 -0.08 -1.63 119.74 121.89 1jgl s LYS 149 Ca 0.32 0.06 0.01 0.00 0.02 0.00 0.00 55.97 56.37 1jgl s LYS 149 Cb -0.13 -0.26 0.02 0.00 -0.52 0.00 0.00 37.83 36.94 1jgl s LYS 149 CO 0.21 -0.08 -0.15 0.42 -0.92 0.00 0.00 175.35 174.83 1jgl s ILE 150 N 0.60 1.55 -1.52 2.17 1.01 0.52 -0.22 121.20 125.31 1jgl s ILE 150 Ca -0.05 -0.64 -0.09 0.00 0.00 0.00 0.00 60.65 59.86 1jgl s ILE 150 Cb -0.08 -1.44 0.07 0.00 0.01 0.00 0.00 42.46 41.02 1jgl s ILE 150 CO -0.01 0.45 0.72 0.47 0.00 0.00 0.00 174.94 176.57 1jgl n ASP 151 N 4.52 -2.57 0.00 3.58 8.00 0.11 -0.95 116.55 129.23 1jgl n ASP 151 Ca -0.18 -0.92 0.00 0.00 0.71 0.00 0.00 54.79 54.40 1jgl n ASP 151 Cb 0.51 -3.34 0.00 0.00 -0.02 0.00 0.00 41.12 38.26 1jgl n ASP 151 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1jgl n GLY 152 N -1.68 1.99 3.70 0.44 0.00 -1.26 -5.00 105.19 103.38 1jgl n GLY 152 Ca -0.10 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.57 1jgl n GLY 152 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1jgl s SER 153 N -3.40 5.50 0.21 1.61 0.01 -0.13 -5.03 113.70 112.47 1jgl s SER 153 Ca 0.00 0.18 -0.30 0.00 1.31 0.00 0.00 55.95 57.14 1jgl s SER 153 Cb 0.00 -1.69 -0.09 0.00 0.21 0.00 0.00 66.02 64.45 1jgl s SER 153 CO 0.00 0.34 1.37 -0.70 0.41 0.00 0.00 173.24 174.66 1jgl s GLU 154 N -0.62 4.33 -0.12 12.44 2.12 -1.26 -0.36 118.70 135.24 1jgl s GLU 154 Ca 0.11 2.16 0.00 0.00 0.36 0.00 0.00 54.97 57.60 1jgl s GLU 154 Cb -0.12 -3.16 -0.02 0.00 0.26 0.00 0.00 34.13 31.09 1jgl s GLU 154 CO 0.02 -0.33 -0.12 0.50 -0.54 0.00 0.00 175.26 174.79 1jgl s ARG 155 N -0.12 3.25 -0.05 4.30 6.06 -0.65 -4.89 118.95 126.86 1jgl s ARG 155 Ca 0.58 -0.67 0.03 0.00 -2.50 0.00 0.00 55.73 53.18 1jgl s ARG 155 Cb -0.39 -2.62 -0.05 0.00 0.06 0.00 0.00 34.95 31.96 1jgl s ARG 155 CO 0.39 0.30 -0.00 1.04 -2.50 0.00 0.00 175.30 174.53 1jgl n GLN 156 N 3.29 2.32 -2.99 5.12 6.02 -1.26 -4.31 117.38 125.57 1jgl n GLN 156 Ca -0.18 0.01 -0.34 0.00 -0.01 0.00 0.00 57.00 56.48 1jgl n GLN 156 Cb 0.53 -1.12 -0.06 0.00 1.02 0.00 0.00 30.24 30.60 1jgl n GLN 156 CO 0.00 0.00 0.00 -0.80 -1.01 0.00 0.00 177.06 175.25 1jgl s ASN 157 N -3.87 6.96 0.00 1.08 0.01 -1.26 -3.92 114.94 113.94 1jgl s ASN 157 Ca -0.04 1.50 0.00 0.00 -0.71 0.00 0.00 52.86 53.62 1jgl s ASN 157 Cb 0.02 -2.46 0.00 0.00 0.41 0.00 0.00 41.25 39.22 1jgl s ASN 157 CO 0.17 -0.18 0.00 0.61 -1.51 0.00 0.00 177.10 176.19 1jgl n GLY 158 N -0.08 0.75 3.59 0.66 0.00 -1.26 -4.88 105.19 103.97 1jgl n GLY 158 Ca 0.03 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.68 1jgl n GLY 158 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1jgl s VAL 159 N -2.62 5.16 -0.04 1.61 1.01 -1.25 -1.09 120.40 123.16 1jgl s VAL 159 Ca 0.00 0.11 0.07 0.00 0.00 0.00 0.00 61.98 62.16 1jgl s VAL 159 Cb 0.00 -3.43 -0.02 0.00 0.00 0.00 0.00 36.38 32.93 1jgl s VAL 159 CO 0.00 0.29 -0.24 -0.76 0.00 0.00 0.00 175.10 174.39 1jgl s LEU 160 N 1.52 2.13 0.15 3.92 1.43 -0.29 -4.97 118.68 122.57 1jgl s LEU 160 Ca 0.07 -0.47 0.09 0.00 -1.03 0.00 0.00 54.13 52.80 1jgl s LEU 160 Cb -0.15 -1.38 -0.04 0.00 0.03 0.00 0.00 46.19 44.65 1jgl s LEU 160 CO 0.08 0.28 -0.21 0.20 0.23 0.00 0.00 176.35 176.93 1jgl s ASN 161 N -0.38 2.85 0.01 2.29 0.01 -1.26 -1.00 114.94 117.45 1jgl s ASN 161 Ca 0.03 -0.81 -0.02 0.00 -0.71 0.00 0.00 52.86 51.35 1jgl s ASN 161 Cb -0.12 -0.18 -0.01 0.00 0.41 0.00 0.00 41.25 41.35 1jgl s ASN 161 CO 0.02 0.03 0.02 -0.55 -1.51 0.00 0.00 177.10 175.11 1jgl s SER 162 N -2.45 0.11 -0.04 -1.22 0.15 -0.67 -5.00 113.70 104.57 1jgl s SER 162 Ca 0.14 -0.25 0.03 0.00 0.70 0.00 0.00 55.95 56.57 1jgl s SER 162 Cb -0.07 0.11 0.01 0.00 -1.71 0.00 0.00 66.02 64.36 1jgl s SER 162 CO 0.07 -0.22 -0.11 0.26 1.20 0.00 0.00 173.24 174.44 1jgl s TRP 163 N -0.95 1.21 0.73 3.44 0.51 -1.26 -1.15 118.94 121.47 1jgl s TRP 163 Ca -0.10 -0.36 -0.11 0.00 -2.12 0.00 0.00 56.10 53.40 1jgl s TRP 163 Cb -0.06 -0.87 0.04 0.00 -0.81 0.00 0.00 33.47 31.76 1jgl s TRP 163 CO -0.00 -0.17 1.11 0.95 -0.51 0.00 0.00 176.95 178.32 1jgl s THR 164 N 0.38 2.98 0.66 2.01 -4.23 -0.62 -5.02 115.64 111.81 1jgl s THR 164 Ca -0.08 0.27 -0.06 0.00 -1.18 0.00 0.00 61.69 60.64 1jgl s THR 164 Cb -0.12 -3.31 0.04 0.00 1.34 0.00 0.00 72.50 70.45 1jgl s THR 164 CO 0.02 -0.40 0.97 -1.81 -0.54 0.00 0.00 174.62 172.86 1jgl s ASP 165 N -4.43 5.15 0.22 3.99 1.01 -1.26 -4.58 116.67 116.76 1jgl s ASP 165 Ca 0.59 0.57 -0.31 0.00 0.71 0.00 0.00 52.55 54.11 1jgl s ASP 165 Cb -0.11 -1.36 -0.14 0.00 1.01 0.00 0.00 42.92 42.32 1jgl s ASP 165 CO 0.50 -1.37 1.29 1.67 0.21 0.00 0.00 175.17 177.47 1jgl n GLN 166 N -2.78 1.69 -2.33 8.23 7.27 -1.26 -4.79 117.38 123.40 1jgl n GLN 166 Ca 0.07 0.60 -0.42 0.00 0.07 0.00 0.00 57.00 57.31 1jgl n GLN 166 Cb 0.59 -2.18 -0.03 0.00 2.41 0.00 0.00 30.24 31.03 1jgl n GLN 166 CO 0.00 0.00 0.00 0.34 0.07 0.00 0.00 177.06 177.47 1jgl s ASP 167 N 0.11 6.98 0.29 1.69 -1.08 0.13 -4.90 116.67 119.87 1jgl s ASP 167 Ca 0.69 2.08 0.23 0.00 -0.52 0.00 0.00 52.55 55.02 1jgl s ASP 167 Cb -0.72 -2.57 1.06 0.00 -1.46 0.00 0.00 42.92 39.23 1jgl s ASP 167 CO 0.52 -0.57 1.69 -1.54 0.52 0.00 0.00 175.17 175.78 1jgl n SER 168 N 4.35 0.62 -0.11 -0.34 3.41 -1.26 -0.67 113.62 119.63 1jgl n SER 168 Ca 0.11 0.71 -0.25 0.00 -0.26 0.00 0.00 58.87 59.18 1jgl n SER 168 Cb 0.45 -0.82 -0.11 0.00 -0.26 0.00 0.00 64.21 63.47 1jgl n SER 168 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1jgl n LYS 169 N -2.25 0.61 -0.02 4.33 5.02 -1.26 -4.70 118.16 119.90 1jgl n LYS 169 Ca 0.01 0.35 0.02 0.00 -2.02 0.00 0.00 58.31 56.66 1jgl n LYS 169 Cb 0.14 -1.60 0.02 0.00 -0.02 0.00 0.00 35.03 33.58 1jgl n LYS 169 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 1jgl n ASP 170 N -4.08 1.59 -1.57 4.39 5.68 -1.23 -5.00 116.55 116.33 1jgl n ASP 170 Ca -0.44 -1.40 -0.19 0.00 -0.50 0.00 0.00 54.79 52.26 1jgl n ASP 170 Cb 0.86 -0.02 -0.07 0.00 -1.14 0.00 0.00 41.12 40.74 1jgl n ASP 170 CO 0.00 0.00 0.00 -1.20 -1.33 0.00 0.00 177.20 174.67 1jgl n SER 171 N 0.09 -5.35 -4.94 -1.12 7.64 0.16 -4.97 113.62 105.12 1jgl n SER 171 Ca 0.03 0.42 -0.20 0.00 1.01 0.00 0.00 58.87 60.12 1jgl n SER 171 Cb 0.15 -4.54 0.06 0.00 -1.01 0.00 0.00 64.21 58.88 1jgl n SER 171 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 1jgl s THR 172 N -2.75 2.33 0.34 0.44 -4.23 -1.26 -4.64 115.64 105.87 1jgl s THR 172 Ca 0.00 -0.89 0.10 0.00 -1.18 0.00 0.00 61.69 59.72 1jgl s THR 172 Cb 0.00 -2.44 -0.06 0.00 1.34 0.00 0.00 72.50 71.34 1jgl s THR 172 CO 0.00 0.00 -0.10 -0.31 -0.54 0.00 0.00 174.62 173.67 1jgl s TYR 173 N -2.73 2.40 0.02 3.99 2.02 0.14 -0.70 117.35 122.50 1jgl s TYR 173 Ca 0.61 -0.47 -0.08 0.00 -0.37 0.00 0.00 57.07 56.76 1jgl s TYR 173 Cb -0.07 -1.34 0.00 0.00 -0.40 0.00 0.00 41.96 40.15 1jgl s TYR 173 CO 0.39 0.59 0.15 -1.12 -1.57 0.00 0.00 175.55 174.00 1jgl s SER 174 N -3.61 0.04 -0.00 2.29 0.01 -1.26 -0.92 113.70 110.25 1jgl s SER 174 Ca 0.32 -0.28 -0.02 0.00 1.31 0.00 0.00 55.95 57.29 1jgl s SER 174 Cb 0.01 0.23 -0.00 0.00 0.21 0.00 0.00 66.02 66.47 1jgl s SER 174 CO 0.17 -0.44 0.03 -0.32 0.41 0.00 0.00 173.24 173.09 1jgl s MET 175 N -1.84 0.16 -0.03 12.44 1.75 0.76 -1.58 119.30 130.95 1jgl s MET 175 Ca -0.11 -0.16 0.07 0.00 -1.25 0.00 0.00 55.69 54.24 1jgl s MET 175 Cb -0.05 0.06 -0.02 0.00 2.84 0.00 0.00 34.83 37.66 1jgl s MET 175 CO -0.00 -0.03 -0.25 -1.54 -0.65 0.00 0.00 175.02 172.55 1jgl s SER 176 N -0.50 3.11 -0.10 1.11 1.04 -0.30 -0.04 113.70 118.02 1jgl s SER 176 Ca -0.06 -0.47 0.00 0.00 0.48 0.00 0.00 55.95 55.91 1jgl s SER 176 Cb -0.04 -0.54 0.02 0.00 0.10 0.00 0.00 66.02 65.57 1jgl s SER 176 CO -0.00 0.30 -0.09 -0.55 0.98 0.00 0.00 173.24 173.87 1jgl s SER 177 N -0.46 2.08 -0.15 7.02 0.15 0.70 -1.68 113.70 121.37 1jgl s SER 177 Ca 0.05 -0.31 0.02 0.00 0.70 0.00 0.00 55.95 56.41 1jgl s SER 177 Cb -0.11 -0.84 0.01 0.00 -1.71 0.00 0.00 66.02 63.36 1jgl s SER 177 CO 0.01 -0.08 -0.20 -0.89 1.20 0.00 0.00 173.24 173.28 1jgl s THR 178 N 1.44 2.22 -0.32 6.45 2.01 -0.17 -0.74 115.64 126.53 1jgl s THR 178 Ca 0.00 -0.92 -0.09 0.00 0.31 0.00 0.00 61.69 60.99 1jgl s THR 178 Cb -0.13 -1.91 0.00 0.00 0.01 0.00 0.00 72.50 70.47 1jgl s THR 178 CO -0.05 0.54 0.15 -0.22 -0.69 0.00 0.00 174.62 174.34 1jgl s LEU 179 N 0.90 4.18 -0.22 4.42 2.96 -0.40 -1.14 118.68 129.37 1jgl s LEU 179 Ca -0.05 -0.66 -0.10 0.00 -0.22 0.00 0.00 54.13 53.10 1jgl s LEU 179 Cb -0.15 -1.98 -0.05 0.00 0.50 0.00 0.00 46.19 44.51 1jgl s LEU 179 CO -0.03 -0.23 0.14 -0.89 -1.32 0.00 0.00 176.35 174.02 1jgl s THR 180 N 1.58 5.36 0.24 3.68 2.01 -0.25 -0.58 115.64 127.68 1jgl s THR 180 Ca 0.04 0.18 0.03 0.00 0.31 0.00 0.00 61.69 62.24 1jgl s THR 180 Cb -0.18 -3.48 -0.05 0.00 0.01 0.00 0.00 72.50 68.81 1jgl s THR 180 CO 0.06 0.39 0.03 -0.76 -0.69 0.00 0.00 174.62 173.65 1jgl s LEU 181 N 0.75 2.02 0.66 4.42 1.43 0.12 -4.77 118.68 123.30 1jgl s LEU 181 Ca 0.08 -1.27 -0.08 0.00 -1.03 0.00 0.00 54.13 51.82 1jgl s LEU 181 Cb -0.12 -0.16 0.02 0.00 0.03 0.00 0.00 46.19 45.96 1jgl s LEU 181 CO 0.02 -0.59 1.00 0.42 0.23 0.00 0.00 176.35 177.42 1jgl s THR 182 N -3.54 3.34 0.19 5.49 -4.23 -1.26 -0.53 115.64 115.09 1jgl s THR 182 Ca 0.31 0.13 -0.10 0.00 -1.18 0.00 0.00 61.69 60.86 1jgl s THR 182 Cb 0.07 -3.38 0.12 0.00 1.34 0.00 0.00 72.50 70.64 1jgl s THR 182 CO 0.10 -0.44 1.75 0.50 -0.54 0.00 0.00 174.62 175.99 1jgl h LYS 183 N -0.44 1.05 -0.19 3.99 3.64 -1.64 -0.68 116.57 122.31 1jgl h LYS 183 Ca -0.45 -0.20 -0.02 0.00 -1.27 0.00 0.00 60.65 58.71 1jgl h LYS 183 Cb 1.27 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 32.91 1jgl h LYS 183 CO 0.62 0.88 0.03 -0.44 -2.27 0.00 0.00 179.45 178.26 1jgl h ASP 184 N 1.00 0.30 -0.20 4.20 3.32 -1.94 -1.80 116.42 121.31 1jgl h ASP 184 Ca 0.23 -0.27 0.03 0.00 0.02 0.00 0.00 57.03 57.05 1jgl h ASP 184 Cb 0.22 -0.08 -0.03 0.00 0.22 0.00 0.00 39.33 39.66 1jgl h ASP 184 CO -0.02 0.49 -0.01 -0.08 -1.72 0.00 0.00 179.24 177.90 1jgl h GLU 185 N 0.10 0.05 -0.63 3.56 4.57 -1.90 -2.42 114.58 117.90 1jgl h GLU 185 Ca 0.06 -0.00 -0.00 0.00 -1.18 0.00 0.00 59.36 58.23 1jgl h GLU 185 Cb 0.32 -0.01 -0.03 0.00 -0.16 0.00 0.00 28.75 28.87 1jgl h GLU 185 CO 0.00 0.03 0.39 -0.92 -1.18 0.00 0.00 179.01 177.34 1jgl h TYR 186 N 0.05 0.82 -0.00 0.92 5.03 -1.03 -2.25 116.97 120.50 1jgl h TYR 186 Ca 0.09 0.01 0.00 0.00 2.58 0.00 0.00 58.73 61.41 1jgl h TYR 186 Cb 0.12 -0.27 0.00 0.00 1.55 0.00 0.00 36.73 38.13 1jgl h TYR 186 CO -0.18 0.54 -0.02 0.39 -1.32 0.00 0.00 178.16 177.57 1jgl n GLU 187 N -4.42 1.07 0.00 1.82 1.02 -0.68 -3.21 120.64 116.24 1jgl n GLU 187 Ca 0.06 -0.27 0.13 0.00 -0.02 0.00 0.00 57.16 57.07 1jgl n GLU 187 Cb 0.06 -1.49 0.48 0.00 -0.02 0.00 0.00 31.44 30.47 1jgl n GLU 187 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1jgl n ARG 188 N -0.73 0.23 -4.32 3.49 1.74 -0.85 -4.89 116.66 111.33 1jgl n ARG 188 Ca 0.21 -0.08 -0.17 0.00 -0.77 0.00 0.00 57.85 57.03 1jgl n ARG 188 Cb 0.20 -1.50 -0.10 0.00 -1.02 0.00 0.00 32.46 30.04 1jgl n ARG 188 CO 0.00 0.00 0.00 -1.01 -1.52 0.00 0.00 177.63 175.10 1jgl s HIS 189 N -2.83 1.58 -0.12 -1.55 3.76 -1.20 -5.10 115.29 109.83 1jgl s HIS 189 Ca 0.18 -0.65 -0.14 0.00 -0.15 0.00 0.00 55.06 54.30 1jgl s HIS 189 Cb 0.19 -0.76 -0.05 0.00 1.11 0.00 0.00 32.58 33.07 1jgl s HIS 189 CO 0.57 0.26 -0.27 -1.71 -0.85 0.00 0.00 174.74 172.74 1jgl n ASN 190 N -0.33 1.74 -4.71 1.40 4.05 -1.26 -4.75 115.26 111.40 1jgl n ASN 190 Ca -0.08 0.28 -0.37 0.00 0.45 0.00 0.00 54.58 54.86 1jgl n ASN 190 Cb 0.61 -0.65 -0.07 0.00 1.23 0.00 0.00 39.78 40.90 1jgl n ASN 190 CO 0.00 0.00 0.00 -0.94 -3.05 0.00 0.00 177.26 173.27 1jgl s SER 191 N -5.90 6.48 -0.14 1.20 1.04 -1.26 0.23 113.70 115.34 1jgl s SER 191 Ca -0.22 0.57 0.02 0.00 0.48 0.00 0.00 55.95 56.79 1jgl s SER 191 Cb 0.03 -2.22 0.00 0.00 0.10 0.00 0.00 66.02 63.93 1jgl s SER 191 CO 0.33 0.02 -0.19 -0.31 0.98 0.00 0.00 173.24 174.07 1jgl s TYR 192 N 0.80 2.71 -0.03 5.02 1.51 -0.21 -0.71 117.35 126.44 1jgl s TYR 192 Ca 0.19 -1.15 0.03 0.00 -1.01 0.00 0.00 57.07 55.13 1jgl s TYR 192 Cb -0.14 -1.84 0.00 0.00 -0.11 0.00 0.00 41.96 39.87 1jgl s TYR 192 CO 0.07 -0.51 -0.11 0.99 -1.11 0.00 0.00 175.55 174.87 1jgl s THR 193 N 0.75 0.98 -0.20 -0.71 2.01 0.69 -1.34 115.64 117.81 1jgl s THR 193 Ca -0.08 -0.46 -0.04 0.00 0.31 0.00 0.00 61.69 61.43 1jgl s THR 193 Cb -0.16 -0.86 -0.02 0.00 0.01 0.00 0.00 72.50 71.48 1jgl s THR 193 CO 0.00 0.30 -0.04 0.00 -0.69 0.00 0.00 174.62 174.19 1jgl s GLU 195 N 1.09 2.43 -0.01 0.00 2.02 0.19 -1.95 118.70 122.48 1jgl s GLU 195 Ca 0.01 -0.64 -0.01 0.00 0.02 0.00 0.00 54.97 54.35 1jgl s GLU 195 Cb -0.15 -2.01 -0.04 0.00 0.10 0.00 0.00 34.13 32.04 1jgl s GLU 195 CO 0.00 -0.02 0.12 0.00 0.02 0.00 0.00 175.26 175.37 1jgl s ALA 196 N 0.86 3.71 -0.20 5.21 0.00 -0.14 -0.41 121.76 130.80 1jgl s ALA 196 Ca -0.09 -0.83 0.01 0.00 0.00 0.00 0.00 51.96 51.05 1jgl s ALA 196 Cb -0.15 -1.69 0.03 0.00 0.00 0.00 0.00 23.12 21.30 1jgl s ALA 196 CO -0.00 0.71 -0.16 0.99 0.00 0.00 0.00 175.76 177.29 1jgl s THR 197 N -1.23 2.22 0.05 0.00 2.01 0.32 -1.27 115.64 117.74 1jgl s THR 197 Ca 0.24 -1.05 -0.01 0.00 0.31 0.00 0.00 61.69 61.18 1jgl s THR 197 Cb -0.12 -2.03 -0.04 0.00 0.01 0.00 0.00 72.50 70.32 1jgl s THR 197 CO 0.15 0.40 -0.03 -2.28 -0.69 0.00 0.00 174.62 172.17 1jgl s HIS 198 N 1.27 0.53 -0.21 4.92 5.04 -1.26 -1.79 115.29 123.79 1jgl s HIS 198 Ca 0.02 -0.99 0.27 0.00 -1.54 0.00 0.00 55.06 52.82 1jgl s HIS 198 Cb -0.15 -0.38 1.22 0.00 0.04 0.00 0.00 32.58 33.31 1jgl s HIS 198 CO -0.10 -0.33 1.81 1.57 -2.34 0.00 0.00 174.74 175.34 1jgl h LYS 199 N 3.31 0.00 0.00 2.88 2.10 -1.95 -2.66 116.57 120.25 1jgl h LYS 199 Ca -0.34 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.31 1jgl h LYS 199 Cb 1.15 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.48 1jgl h LYS 199 CO 0.63 0.00 0.00 0.25 -2.00 0.00 0.00 179.45 178.33 1jgl n THR 200 N -2.47 0.17 -3.64 0.07 -2.24 -1.26 -4.75 114.28 100.17 1jgl n THR 200 Ca 0.01 0.04 -0.14 0.00 -2.27 0.00 0.00 64.05 61.69 1jgl n THR 200 Cb 0.19 -0.72 -0.07 0.00 -2.10 0.00 0.00 70.33 67.63 1jgl n THR 200 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1jgl s SER 201 N -2.25 -0.68 0.00 3.42 0.15 -1.00 -4.97 113.70 108.36 1jgl s SER 201 Ca 0.26 1.25 0.29 0.00 0.70 0.00 0.00 55.95 58.45 1jgl s SER 201 Cb 0.14 1.25 1.28 0.00 -1.71 0.00 0.00 66.02 66.99 1jgl s SER 201 CO 0.27 -0.28 1.88 0.35 1.20 0.00 0.00 173.24 176.66 1jgl n THR 202 N 2.50 0.00 -4.36 6.45 -2.24 -1.26 -4.48 114.28 110.89 1jgl n THR 202 Ca -0.15 -0.16 -0.24 0.00 -2.27 0.00 0.00 64.05 61.23 1jgl n THR 202 Cb 0.56 0.17 -0.09 0.00 -2.10 0.00 0.00 70.33 68.87 1jgl n THR 202 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1jgl s SER 203 N -2.07 4.10 0.52 3.42 0.01 -1.26 -5.10 113.70 113.32 1jgl s SER 203 Ca 0.39 -0.77 -0.21 0.00 1.31 0.00 0.00 55.95 56.67 1jgl s SER 203 Cb 0.21 -0.60 -0.06 0.00 0.21 0.00 0.00 66.02 65.78 1jgl s SER 203 CO 0.37 0.04 1.19 -2.84 0.41 0.00 0.00 173.24 172.41 1jgl s PRO 204 N -3.37 3.43 -0.35 12.44 0.02 -1.26 -4.79 135.00 141.11 1jgl s PRO 204 Ca 0.29 1.80 -0.10 0.00 0.02 0.00 0.00 61.00 63.02 1jgl s PRO 204 Cb -0.07 -2.20 0.02 0.00 0.02 0.00 0.00 34.50 32.28 1jgl s PRO 204 CO 0.17 -0.83 0.17 0.42 -0.33 0.00 0.00 177.00 176.60 1jgl s ILE 205 N -1.58 4.38 0.37 2.83 1.01 -0.40 -4.92 121.20 122.89 1jgl s ILE 205 Ca 0.69 -0.85 0.08 0.00 0.00 0.00 0.00 60.65 60.58 1jgl s ILE 205 Cb -0.29 -3.41 -0.07 0.00 0.01 0.00 0.00 42.46 38.70 1jgl s ILE 205 CO 0.34 -0.17 -0.05 0.68 0.00 0.00 0.00 174.94 175.74 1jgl s VAL 206 N 1.53 2.14 -0.23 2.92 -7.23 -1.26 -0.96 120.40 117.30 1jgl s VAL 206 Ca 0.02 -2.13 -0.14 0.00 -1.81 0.00 0.00 61.98 57.92 1jgl s VAL 206 Cb -0.19 -2.78 0.07 0.00 0.56 0.00 0.00 36.38 34.04 1jgl s VAL 206 CO 0.06 -0.12 0.57 -0.75 -0.31 0.00 0.00 175.10 174.54 1jgl s LYS 207 N -3.65 0.59 0.34 4.82 2.47 -0.82 -4.95 119.74 118.52 1jgl s LYS 207 Ca 0.33 0.99 -0.01 0.00 -1.56 0.00 0.00 55.97 55.73 1jgl s LYS 207 Cb 0.05 0.11 -0.00 0.00 -1.46 0.00 0.00 37.83 36.53 1jgl s LYS 207 CO 0.17 -0.14 0.44 -1.54 0.16 0.00 0.00 175.35 174.44 1jgl s SER 208 N 1.33 0.99 0.05 1.43 1.04 -1.26 -0.89 113.70 116.39 1jgl s SER 208 Ca -0.08 -1.51 -0.27 0.00 0.48 0.00 0.00 55.95 54.57 1jgl s SER 208 Cb -0.06 0.64 0.08 0.00 0.10 0.00 0.00 66.02 66.78 1jgl s SER 208 CO -0.14 -1.26 0.69 0.72 0.98 0.00 0.00 173.24 174.24 1jgl s PHE 209 N -3.14 -0.54 -0.15 5.02 -0.12 -0.45 -4.99 117.98 113.61 1jgl s PHE 209 Ca 0.32 0.58 -0.04 0.00 -0.05 0.00 0.00 56.93 57.74 1jgl s PHE 209 Cb 0.00 0.50 -0.03 0.00 -0.63 0.00 0.00 43.02 42.86 1jgl s PHE 209 CO 0.21 -0.70 -0.02 -0.80 -0.05 0.00 0.00 175.22 173.86 1jgl s ASN 210 N -2.12 4.97 0.65 1.98 0.01 -1.26 -1.04 114.94 118.13 1jgl s ASN 210 Ca -0.02 -0.07 0.30 0.00 -0.71 0.00 0.00 52.86 52.36 1jgl s ASN 210 Cb -0.01 -1.77 1.65 0.00 0.41 0.00 0.00 41.25 41.53 1jgl s ASN 210 CO -0.04 0.19 1.95 -0.09 -1.51 0.00 0.00 177.10 177.60 1jgl h ARG 211 N 6.52 0.00 -3.75 -0.60 2.43 -0.52 -3.22 114.38 115.25 1jgl h ARG 211 Ca -0.34 0.00 -0.77 0.00 -0.81 0.00 0.00 59.98 58.06 1jgl h ARG 211 Cb 1.19 0.00 -0.28 0.00 -0.42 0.00 0.00 29.97 30.45 1jgl h ARG 211 CO 0.63 0.00 0.00 1.21 -1.51 0.00 0.00 179.97 180.30 1jgl s ASN 212 N -4.69 6.42 0.00 -3.80 2.47 -1.26 -5.13 114.94 108.94 1jgl s ASN 212 Ca -0.04 -2.79 0.00 0.00 0.42 0.00 0.00 52.86 50.45 1jgl s ASN 212 Cb 0.10 -2.12 0.00 0.00 -1.45 0.00 0.00 41.25 37.78 1jgl s ASN 212 CO 0.34 -0.51 0.00 -0.62 -3.72 0.00 0.00 177.10 172.60