#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jfg s ASP 2 N 0.00 2.57 -0.02 0.00 -1.08 -1.26 -5.00 116.67 111.88 2jfg s ASP 2 Ca 0.00 -0.46 0.10 0.00 -0.52 0.00 0.00 52.55 51.67 2jfg s ASP 2 Cb 0.00 -1.17 0.28 0.00 -1.46 0.00 0.00 42.92 40.57 2jfg s ASP 2 CO 0.00 0.06 1.23 -1.22 0.52 0.00 0.00 175.17 175.75 2jfg n TYR 3 N 4.00 0.43 -1.88 -5.34 4.01 -1.26 -5.01 117.16 112.10 2jfg n TYR 3 Ca -0.20 -0.56 -0.42 0.00 -0.16 0.00 0.00 57.90 56.57 2jfg n TYR 3 Cb 0.52 -0.07 -0.03 0.00 -0.31 0.00 0.00 39.34 39.45 2jfg n TYR 3 CO 0.00 0.00 0.00 -0.65 -0.46 0.00 0.00 176.86 175.75 2jfg s GLN 4 N -1.26 4.19 0.00 -0.72 -1.52 -1.26 -2.03 119.66 117.06 2jfg s GLN 4 Ca 0.22 2.43 0.00 0.00 -1.95 0.00 0.00 55.36 56.05 2jfg s GLN 4 Cb 0.13 -3.13 0.00 0.00 -0.22 0.00 0.00 33.01 29.78 2jfg s GLN 4 CO 0.12 -0.65 0.00 0.41 -0.25 0.00 0.00 175.29 174.92 2jfg n GLY 5 N 3.81 0.45 3.84 3.09 0.00 -1.26 -5.00 105.19 110.13 2jfg n GLY 5 Ca 0.14 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.83 2jfg n GLY 5 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jfg s LYS 6 N -0.59 4.06 -0.54 1.61 -0.14 -0.86 -5.02 119.74 118.25 2jfg s LYS 6 Ca 0.00 0.74 -0.22 0.00 -1.36 0.00 0.00 55.97 55.12 2jfg s LYS 6 Cb 0.00 -2.46 0.05 0.00 -1.68 0.00 0.00 37.83 33.74 2jfg s LYS 6 CO 0.00 0.16 0.85 1.21 -0.76 0.00 0.00 175.35 176.81 2jfg s ASN 7 N -2.20 6.29 -0.18 2.83 3.84 -1.26 -4.91 114.94 119.36 2jfg s ASN 7 Ca 0.54 -0.56 -0.04 0.00 0.21 0.00 0.00 52.86 53.00 2jfg s ASN 7 Cb -0.11 -2.39 -0.02 0.00 -0.55 0.00 0.00 41.25 38.18 2jfg s ASN 7 CO 0.17 -1.14 -0.03 -0.69 -2.79 0.00 0.00 177.10 172.63 2jfg s VAL 8 N 3.55 3.79 -0.14 -5.21 1.01 -1.26 -0.03 120.40 122.11 2jfg s VAL 8 Ca 0.25 -0.38 0.02 0.00 0.00 0.00 0.00 61.98 61.87 2jfg s VAL 8 Cb -0.15 -2.69 0.00 0.00 0.00 0.00 0.00 36.38 33.54 2jfg s VAL 8 CO 0.16 0.45 -0.20 -0.69 0.00 0.00 0.00 175.10 174.83 2jfg s VAL 9 N 0.81 2.31 -0.18 2.92 1.01 -0.34 -1.40 120.40 125.54 2jfg s VAL 9 Ca -0.01 -0.90 -0.07 0.00 0.00 0.00 0.00 61.98 61.00 2jfg s VAL 9 Cb -0.14 -1.94 -0.04 0.00 0.00 0.00 0.00 36.38 34.25 2jfg s VAL 9 CO 0.02 0.54 0.07 -0.63 0.00 0.00 0.00 175.10 175.10 2jfg s ILE 10 N 0.74 4.88 -0.25 2.22 1.01 0.63 0.16 121.20 130.59 2jfg s ILE 10 Ca -0.08 -0.00 -0.09 0.00 0.00 0.00 0.00 60.65 60.48 2jfg s ILE 10 Cb -0.16 -3.19 -0.04 0.00 0.01 0.00 0.00 42.46 39.08 2jfg s ILE 10 CO 0.00 0.47 0.11 -0.63 0.00 0.00 0.00 174.94 174.90 2jfg s ILE 11 N 0.23 4.74 0.00 2.92 1.01 0.58 -0.96 121.20 129.71 2jfg s ILE 11 Ca 0.05 -0.03 0.00 0.00 0.00 0.00 0.00 60.65 60.67 2jfg s ILE 11 Cb -0.12 -3.22 0.00 0.00 0.01 0.00 0.00 42.46 39.12 2jfg s ILE 11 CO 0.00 0.32 0.00 0.61 0.00 0.00 0.00 174.94 175.87 2jfg n GLY 12 N 4.81 3.03 2.48 6.18 0.00 0.14 -0.91 105.19 120.93 2jfg n GLY 12 Ca -0.15 -1.15 -0.30 0.00 0.00 0.00 0.00 46.02 44.42 2jfg n GLY 12 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2jfg n LEU 13 N 0.00 5.57 0.00 0.99 7.94 -1.26 -3.79 117.00 126.46 2jfg n LEU 13 Ca 0.00 -4.99 0.00 0.00 -1.11 0.00 0.00 56.01 49.91 2jfg n LEU 13 Cb 0.00 -0.61 0.00 0.00 0.53 0.00 0.00 43.42 43.34 2jfg n LEU 13 CO 0.00 2.06 0.00 0.61 -1.11 0.00 0.00 177.39 178.95 2jfg n GLY 14 N -0.56 3.51 0.24 -3.96 0.00 -1.26 -0.76 105.19 102.41 2jfg n GLY 14 Ca 0.45 -1.93 -0.06 0.00 0.00 0.00 0.00 46.02 44.47 2jfg n GLY 14 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2jfg h LEU 15 N 0.00 0.70 -0.01 0.99 3.38 -1.99 -1.54 115.31 116.84 2jfg h LEU 15 Ca 0.00 -0.04 -0.00 0.00 0.09 0.00 0.00 57.88 57.93 2jfg h LEU 15 Cb 0.00 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 40.57 2jfg h LEU 15 CO 0.00 0.53 0.00 0.74 0.09 0.00 0.00 178.44 179.81 2jfg h THR 16 N 0.80 1.17 -0.50 0.22 2.02 -1.95 -2.12 112.91 112.55 2jfg h THR 16 Ca 0.22 -0.51 0.04 0.00 0.77 0.00 0.00 66.41 66.92 2jfg h THR 16 Cb -0.05 1.50 -0.04 0.00 -1.74 0.00 0.00 68.15 67.82 2jfg h THR 16 CO -0.04 0.14 0.27 1.23 0.37 0.00 0.00 175.52 177.48 2jfg h GLY 17 N -0.20 0.71 1.00 2.16 0.00 -1.61 -0.47 103.07 104.66 2jfg h GLY 17 Ca 0.00 -0.19 0.01 0.00 0.00 0.00 0.00 47.33 47.16 2jfg h GLY 17 CO -0.00 0.13 0.54 1.41 0.00 0.00 0.00 176.54 178.62 2jfg h LEU 18 N 0.52 0.93 -1.24 3.11 3.38 -1.25 -0.16 115.31 120.60 2jfg h LEU 18 Ca 0.22 -0.02 -0.02 0.00 0.09 0.00 0.00 57.88 58.14 2jfg h LEU 18 Cb 0.11 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.60 2jfg h LEU 18 CO -0.14 0.68 0.23 0.77 0.09 0.00 0.00 178.44 180.06 2jfg h SER 19 N 1.10 0.68 -0.29 -0.43 4.64 -0.71 -1.76 113.55 116.78 2jfg h SER 19 Ca 0.30 -0.07 -0.15 0.00 -0.47 0.00 0.00 61.79 61.39 2jfg h SER 19 Cb -0.12 -0.17 -0.01 0.00 -0.31 0.00 0.00 62.40 61.79 2jfg h SER 19 CO -0.07 0.60 -0.39 0.00 -0.87 0.00 0.00 176.83 176.10 2jfg h VAL 21 N 0.69 0.95 -0.72 0.00 2.07 -0.69 -1.39 116.25 117.17 2jfg h VAL 21 Ca 0.06 -0.10 -0.07 0.00 0.82 0.00 0.00 66.70 67.41 2jfg h VAL 21 Cb 0.97 0.62 -0.03 0.00 -1.52 0.00 0.00 31.29 31.33 2jfg h VAL 21 CO 0.09 0.05 0.19 0.44 0.02 0.00 0.00 177.57 178.36 2jfg h ASP 22 N 0.30 1.08 -0.13 0.57 3.32 -1.23 -1.84 116.42 118.49 2jfg h ASP 22 Ca 0.14 -0.23 0.02 0.00 0.02 0.00 0.00 57.03 56.98 2jfg h ASP 22 Cb 0.08 -0.28 -0.02 0.00 0.22 0.00 0.00 39.33 39.33 2jfg h ASP 22 CO -0.12 1.02 0.01 0.15 -1.72 0.00 0.00 179.24 178.58 2jfg h PHE 23 N 1.08 0.01 -0.22 4.55 3.57 -0.96 -1.53 116.94 123.44 2jfg h PHE 23 Ca 0.23 0.01 -0.08 0.00 3.53 0.00 0.00 57.97 61.66 2jfg h PHE 23 Cb 0.36 0.02 -0.00 0.00 2.79 0.00 0.00 35.95 39.11 2jfg h PHE 23 CO 0.03 -0.01 -0.16 0.74 -2.23 0.00 0.00 178.31 176.68 2jfg h PHE 24 N 0.06 0.59 -0.96 0.41 0.04 -1.13 -3.10 116.94 112.85 2jfg h PHE 24 Ca 0.06 -0.16 0.09 0.00 2.80 0.00 0.00 57.97 60.76 2jfg h PHE 24 Cb 0.07 -0.13 -0.07 0.00 2.20 0.00 0.00 35.95 38.01 2jfg h PHE 24 CO -0.14 0.81 0.60 -0.07 -0.60 0.00 0.00 178.31 178.92 2jfg h LEU 25 N 0.19 0.91 -1.30 1.54 3.38 -1.00 -0.78 115.31 118.26 2jfg h LEU 25 Ca 0.04 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.04 2jfg h LEU 25 Cb 0.69 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 41.28 2jfg h LEU 25 CO 0.04 0.54 0.00 0.00 0.09 0.00 0.00 178.44 179.11 2jfg h ALA 26 N 1.48 1.00 -0.27 1.53 0.00 -1.21 -1.91 119.26 119.88 2jfg h ALA 26 Ca 0.44 0.00 -0.04 0.00 0.00 0.00 0.00 54.91 55.32 2jfg h ALA 26 Cb 0.32 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 2jfg h ALA 26 CO -0.22 0.00 -0.00 2.89 0.00 0.00 0.00 179.25 181.92 2jfg n ARG 27 N -2.58 2.68 -2.11 0.00 1.85 -0.40 -4.97 116.66 111.13 2jfg n ARG 27 Ca 0.00 -2.89 -0.05 0.00 -1.00 0.00 0.00 57.85 53.91 2jfg n ARG 27 Cb 0.20 -1.84 -0.00 0.00 -1.05 0.00 0.00 32.46 29.77 2jfg n ARG 27 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2jfg n GLY 28 N -0.65 0.17 3.08 2.89 0.00 -0.72 -4.92 105.19 105.03 2jfg n GLY 28 Ca 0.24 -0.67 -0.30 0.00 0.00 0.00 0.00 46.02 45.29 2jfg n GLY 28 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2jfg s VAL 29 N -2.27 1.65 -0.45 1.61 1.01 -0.58 -4.86 120.40 116.51 2jfg s VAL 29 Ca 0.00 -0.73 -0.20 0.00 0.00 0.00 0.00 61.98 61.06 2jfg s VAL 29 Cb -0.00 -1.50 0.03 0.00 0.00 0.00 0.00 36.38 34.91 2jfg s VAL 29 CO 0.00 0.47 0.59 -0.89 0.00 0.00 0.00 175.10 175.28 2jfg s THR 30 N 1.04 4.89 0.64 3.92 2.01 -1.26 -2.46 115.64 124.42 2jfg s THR 30 Ca -0.05 -0.12 -0.05 0.00 0.31 0.00 0.00 61.69 61.79 2jfg s THR 30 Cb -0.15 -4.19 0.04 0.00 0.01 0.00 0.00 72.50 68.21 2jfg s THR 30 CO -0.03 -0.61 0.94 -2.16 -0.69 0.00 0.00 174.62 172.07 2jfg s PRO 31 N 2.64 2.46 0.11 4.92 0.04 -1.26 -4.70 135.00 139.21 2jfg s PRO 31 Ca 0.19 -0.28 0.07 0.00 0.04 0.00 0.00 61.00 61.02 2jfg s PRO 31 Cb -0.16 -2.26 -0.04 0.00 0.04 0.00 0.00 34.50 32.09 2jfg s PRO 31 CO 0.16 -0.99 -0.10 1.03 0.04 0.00 0.00 177.00 177.15 2jfg s ARG 32 N -5.08 2.13 -0.02 4.56 0.52 -0.49 -4.38 118.95 116.17 2jfg s ARG 32 Ca 0.58 -1.05 0.04 0.00 -0.52 0.00 0.00 55.73 54.78 2jfg s ARG 32 Cb -0.11 -2.30 -0.00 0.00 0.52 0.00 0.00 34.95 33.06 2jfg s ARG 32 CO 0.44 0.50 -0.13 0.54 0.02 0.00 0.00 175.30 176.66 2jfg s VAL 33 N -1.27 1.08 0.13 3.52 0.11 -0.67 -0.27 120.40 123.04 2jfg s VAL 33 Ca 0.22 -0.55 0.04 0.00 -2.93 0.00 0.00 61.98 58.76 2jfg s VAL 33 Cb -0.11 -0.92 -0.04 0.00 -1.53 0.00 0.00 36.38 33.78 2jfg s VAL 33 CO 0.14 0.31 -0.10 0.00 -3.33 0.00 0.00 175.10 172.13 2jfg s MET 34 N -0.07 1.01 -0.18 1.54 0.23 -0.13 -1.02 119.30 120.67 2jfg s MET 34 Ca 0.00 -1.41 -0.19 0.00 -1.03 0.00 0.00 55.69 53.06 2jfg s MET 34 Cb -0.08 -0.54 0.05 0.00 -1.53 0.00 0.00 34.83 32.73 2jfg s MET 34 CO 0.00 0.06 0.54 0.34 -2.03 0.00 0.00 175.02 173.93 2jfg s ASP 35 N -3.10 -0.55 0.43 -1.18 -1.08 -0.49 0.26 116.67 110.96 2jfg s ASP 35 Ca 0.15 1.02 0.23 0.00 -0.52 0.00 0.00 52.55 53.44 2jfg s ASP 35 Cb 0.03 1.03 0.89 0.00 -1.46 0.00 0.00 42.92 43.42 2jfg s ASP 35 CO -0.00 -0.23 1.82 0.71 0.52 0.00 0.00 175.17 177.99 2jfg h THR 36 N 4.19 0.58 -3.75 1.71 1.35 -1.88 -1.80 112.91 113.31 2jfg h THR 36 Ca -0.28 -1.16 -0.52 0.00 -0.55 0.00 0.00 66.41 63.90 2jfg h THR 36 Cb 1.17 1.78 0.06 0.00 -1.73 0.00 0.00 68.15 69.43 2jfg h THR 36 CO 0.19 0.23 0.66 -0.13 -0.25 0.00 0.00 175.52 176.22 2jfg s ARG 37 N -3.65 4.34 0.12 4.72 0.52 -1.26 -3.05 118.95 120.70 2jfg s ARG 37 Ca 0.00 2.22 -0.15 0.00 -0.52 0.00 0.00 55.73 57.28 2jfg s ARG 37 Cb 0.10 -3.09 -0.03 0.00 0.52 0.00 0.00 34.95 32.46 2jfg s ARG 37 CO 0.64 -0.23 1.55 1.98 0.02 0.00 0.00 175.30 179.26 2jfg h MET 38 N 3.84 0.71 -2.52 3.54 1.85 -1.87 -1.62 114.93 118.86 2jfg h MET 38 Ca -0.48 -0.24 -0.60 0.00 -0.61 0.00 0.00 59.70 57.77 2jfg h MET 38 Cb 1.22 -0.06 -0.40 0.00 0.43 0.00 0.00 31.60 32.80 2jfg h MET 38 CO 0.69 0.82 -0.79 2.41 -0.40 0.00 0.00 176.91 179.63 2jfg n THR 39 N -4.43 0.49 -1.55 -0.77 -1.04 -1.26 -4.44 114.28 101.29 2jfg n THR 39 Ca -0.01 -4.34 -0.32 0.00 -2.04 0.00 0.00 64.05 57.33 2jfg n THR 39 Cb 0.31 -1.97 0.07 0.00 -1.82 0.00 0.00 70.33 66.92 2jfg n THR 39 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 2jfg s PRO 40 N -1.13 2.54 0.52 -2.82 0.04 -1.26 -4.92 135.00 127.96 2jfg s PRO 40 Ca 0.32 1.34 0.25 0.00 0.04 0.00 0.00 61.00 62.95 2jfg s PRO 40 Cb 0.05 -1.92 1.45 0.00 0.04 0.00 0.00 34.50 34.12 2jfg s PRO 40 CO -0.14 -1.45 2.10 -1.00 0.04 0.00 0.00 177.00 176.55 2jfg h PRO 41 N -0.42 0.00 -0.01 0.56 0.13 -1.98 -2.73 132.00 127.55 2jfg h PRO 41 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 2jfg h PRO 41 Cb 1.24 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.37 2jfg h PRO 41 CO 0.53 0.10 -0.06 0.41 -0.23 0.00 0.00 178.00 178.75 2jfg n GLY 42 N -0.93 -0.62 0.19 1.56 0.00 0.06 -4.39 105.19 101.06 2jfg n GLY 42 Ca -0.02 -0.32 -0.04 0.00 0.00 0.00 0.00 46.02 45.63 2jfg n GLY 42 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2jfg h LEU 43 N 1.06 0.25 -1.25 0.99 5.85 -1.67 -1.75 115.31 118.79 2jfg h LEU 43 Ca 0.00 0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.76 2jfg h LEU 43 Cb 0.33 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.36 2jfg h LEU 43 CO 0.00 0.18 0.00 0.44 -0.34 0.00 0.00 178.44 178.72 2jfg h ASP 44 N 0.40 0.00 0.15 1.25 5.19 -1.83 -3.05 116.42 118.52 2jfg h ASP 44 Ca 0.21 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.62 2jfg h ASP 44 Cb 0.17 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.68 2jfg h ASP 44 CO -0.18 0.00 -0.37 0.29 -3.12 0.00 0.00 179.24 175.85 2jfg n LYS 45 N -2.87 0.91 -2.47 3.56 5.02 -0.68 -4.95 118.16 116.67 2jfg n LYS 45 Ca 0.01 -0.63 -0.41 0.00 -2.02 0.00 0.00 58.31 55.26 2jfg n LYS 45 Cb 0.29 -1.49 -0.04 0.00 -0.02 0.00 0.00 35.03 33.77 2jfg n LYS 45 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 2jfg s LEU 46 N -2.53 4.48 0.36 -0.35 2.96 -1.07 -4.98 118.68 117.55 2jfg s LEU 46 Ca 0.21 2.15 -0.27 0.00 -0.22 0.00 0.00 54.13 55.99 2jfg s LEU 46 Cb 0.19 -3.61 -0.12 0.00 0.50 0.00 0.00 46.19 43.15 2jfg s LEU 46 CO 0.56 -0.26 1.27 -2.65 -1.32 0.00 0.00 176.35 173.94 2jfg n PRO 47 N 2.32 2.04 0.28 0.98 -0.02 -1.26 -4.88 135.00 134.46 2jfg n PRO 47 Ca 0.03 0.72 0.16 0.00 -2.02 0.00 0.00 63.50 62.38 2jfg n PRO 47 Cb 0.46 -2.31 0.83 0.00 -0.02 0.00 0.00 33.50 32.46 2jfg n PRO 47 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 2jfg h GLU 48 N 2.41 0.00 0.00 -0.52 5.08 -1.98 -2.19 114.58 117.37 2jfg h GLU 48 Ca -0.46 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.90 2jfg h GLU 48 Cb 1.29 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.54 2jfg h GLU 48 CO 0.62 0.07 0.00 0.00 -1.00 0.00 0.00 179.01 178.70 2jfg n ALA 49 N -2.21 2.02 -2.67 3.43 0.00 -1.26 -4.80 120.51 115.01 2jfg n ALA 49 Ca -0.02 -0.04 -0.38 0.00 0.00 0.00 0.00 53.44 53.01 2jfg n ALA 49 Cb 0.21 -1.39 -0.08 0.00 0.00 0.00 0.00 19.45 18.19 2jfg n ALA 49 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2jfg s VAL 50 N -3.08 5.21 0.25 0.00 1.01 -0.83 -5.05 120.40 117.92 2jfg s VAL 50 Ca 0.10 0.66 -0.30 0.00 0.00 0.00 0.00 61.98 62.44 2jfg s VAL 50 Cb 0.13 -3.71 -0.10 0.00 0.00 0.00 0.00 36.38 32.71 2jfg s VAL 50 CO 0.45 0.26 1.36 -1.61 0.00 0.00 0.00 175.10 175.56 2jfg s GLU 51 N 1.25 4.34 0.08 2.72 2.02 -1.26 -4.95 118.70 122.91 2jfg s GLU 51 Ca 0.18 2.18 0.04 0.00 0.02 0.00 0.00 54.97 57.39 2jfg s GLU 51 Cb -0.15 -3.13 -0.03 0.00 0.10 0.00 0.00 34.13 30.92 2jfg s GLU 51 CO 0.08 -0.29 -0.10 -0.98 0.02 0.00 0.00 175.26 173.98 2jfg s ARG 52 N -0.61 0.79 -0.06 1.61 3.03 -1.26 -1.66 118.95 120.79 2jfg s ARG 52 Ca 0.56 -1.06 -0.02 0.00 2.03 0.00 0.00 55.73 57.23 2jfg s ARG 52 Cb -0.39 -0.53 0.04 0.00 -1.03 0.00 0.00 34.95 33.04 2jfg s ARG 52 CO 0.43 0.09 0.09 -1.58 -1.13 0.00 0.00 175.30 173.21 2jfg s HIS 53 N -2.10 -0.01 0.32 5.89 2.46 -0.19 -4.98 115.29 116.68 2jfg s HIS 53 Ca 0.02 0.35 0.09 0.00 0.47 0.00 0.00 55.06 55.99 2jfg s HIS 53 Cb -0.05 -0.42 -0.06 0.00 -0.13 0.00 0.00 32.58 31.92 2jfg s HIS 53 CO 0.00 -0.22 -0.09 0.95 -2.47 0.00 0.00 174.74 172.91 2jfg s THR 54 N 2.21 2.04 0.00 0.89 -4.23 -1.26 -1.39 115.64 113.90 2jfg s THR 54 Ca 0.04 -2.19 0.00 0.00 -1.18 0.00 0.00 61.69 58.36 2jfg s THR 54 Cb -0.12 -2.56 0.00 0.00 1.34 0.00 0.00 72.50 71.16 2jfg s THR 54 CO -0.04 -0.25 0.00 0.61 -0.54 0.00 0.00 174.62 174.40 2jfg n GLY 55 N -0.71 1.09 3.58 3.99 0.00 -0.61 -4.88 105.19 107.65 2jfg n GLY 55 Ca -0.05 0.00 0.02 0.00 0.00 0.00 0.00 46.02 45.99 2jfg n GLY 55 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2jfg s SER 56 N -2.86 -0.03 0.11 1.61 1.04 -1.16 -4.78 113.70 107.63 2jfg s SER 56 Ca 0.00 -0.05 -0.21 0.00 0.48 0.00 0.00 55.95 56.16 2jfg s SER 56 Cb 0.00 0.07 -0.07 0.00 0.10 0.00 0.00 66.02 66.12 2jfg s SER 56 CO 0.00 -0.13 0.64 -0.76 0.98 0.00 0.00 173.24 173.98 2jfg s LEU 57 N -2.90 4.54 -0.44 2.42 1.43 -1.26 -4.09 118.68 118.38 2jfg s LEU 57 Ca 0.14 1.39 -0.20 0.00 -1.03 0.00 0.00 54.13 54.43 2jfg s LEU 57 Cb 0.06 -3.06 0.03 0.00 0.03 0.00 0.00 46.19 43.24 2jfg s LEU 57 CO -0.05 0.24 0.61 0.21 0.23 0.00 0.00 176.35 177.59 2jfg s ASN 58 N -1.16 6.29 0.28 2.29 3.84 -1.26 -4.95 114.94 120.28 2jfg s ASN 58 Ca 0.32 -0.43 0.07 0.00 0.21 0.00 0.00 52.86 53.03 2jfg s ASN 58 Cb -0.21 -2.30 0.40 0.00 -0.55 0.00 0.00 41.25 38.60 2jfg s ASN 58 CO 0.21 -0.76 1.66 0.44 -2.79 0.00 0.00 177.10 175.87 2jfg h ASP 59 N 8.86 0.20 -0.82 -4.21 3.32 -1.97 -1.54 116.42 120.26 2jfg h ASP 59 Ca -0.26 -0.09 0.01 0.00 0.02 0.00 0.00 57.03 56.71 2jfg h ASP 59 Cb 1.10 -0.06 -0.04 0.00 0.22 0.00 0.00 39.33 40.55 2jfg h ASP 59 CO 0.88 0.66 0.54 -0.33 -1.72 0.00 0.00 179.24 179.27 2jfg h GLU 60 N 0.15 1.06 -0.12 3.56 5.08 -1.99 -1.00 114.58 121.32 2jfg h GLU 60 Ca 0.01 -0.06 -0.18 0.00 -1.00 0.00 0.00 59.36 58.12 2jfg h GLU 60 Cb 0.93 -0.24 0.01 0.00 0.50 0.00 0.00 28.75 29.95 2jfg h GLU 60 CO 0.07 0.70 -0.62 -1.49 -1.00 0.00 0.00 179.01 176.68 2jfg h TRP 61 N 1.09 0.86 -0.28 4.33 4.06 -1.89 -2.92 115.95 121.20 2jfg h TRP 61 Ca 0.31 -0.38 -0.02 0.00 2.06 0.00 0.00 58.89 60.86 2jfg h TRP 61 Cb -0.10 -0.13 -0.01 0.00 -1.00 0.00 0.00 29.16 27.91 2jfg h TRP 61 CO -0.02 1.18 0.11 -0.07 -3.56 0.00 0.00 178.44 176.09 2jfg h LEU 62 N 0.30 0.39 -0.53 -4.49 3.38 -1.18 -2.44 115.31 110.74 2jfg h LEU 62 Ca -0.04 -0.16 0.00 0.00 0.09 0.00 0.00 57.88 57.76 2jfg h LEU 62 Cb 1.25 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.90 2jfg h LEU 62 CO 0.13 0.45 0.00 0.24 0.09 0.00 0.00 178.44 179.34 2jfg h MET 63 N 0.30 0.00 0.00 1.13 2.86 -1.26 -2.43 114.93 115.53 2jfg h MET 63 Ca 0.09 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.73 2jfg h MET 63 Cb 0.18 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.84 2jfg h MET 63 CO -0.01 0.00 -0.77 0.00 1.06 0.00 0.00 176.91 177.19 2jfg n ALA 64 N -1.80 3.44 -1.78 6.32 0.00 -1.08 -4.99 120.51 120.64 2jfg n ALA 64 Ca 0.03 -0.37 -0.36 0.00 0.00 0.00 0.00 53.44 52.75 2jfg n ALA 64 Cb 0.30 -1.05 -0.01 0.00 0.00 0.00 0.00 19.45 18.69 2jfg n ALA 64 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jfg s ALA 65 N -3.11 2.85 -0.05 0.00 0.00 -0.92 -4.88 121.76 115.65 2jfg s ALA 65 Ca 0.07 0.82 0.13 0.00 0.00 0.00 0.00 51.96 52.98 2jfg s ALA 65 Cb 0.15 -3.35 -0.23 0.00 0.00 0.00 0.00 23.12 19.69 2jfg s ALA 65 CO 0.76 -0.62 0.63 -0.25 0.00 0.00 0.00 175.76 176.27 2jfg n ASP 66 N -0.87 0.83 -3.74 0.00 8.00 0.96 -4.90 116.55 116.83 2jfg n ASP 66 Ca 0.09 0.39 -0.13 0.00 0.71 0.00 0.00 54.79 55.85 2jfg n ASP 66 Cb 0.50 -0.01 -0.14 0.00 -0.02 0.00 0.00 41.12 41.46 2jfg n ASP 66 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 2jfg s LEU 67 N -6.06 0.62 -0.20 0.64 2.96 -0.97 -4.17 118.68 111.50 2jfg s LEU 67 Ca -0.05 0.40 -0.05 0.00 -0.22 0.00 0.00 54.13 54.21 2jfg s LEU 67 Cb 0.08 0.54 -0.02 0.00 0.50 0.00 0.00 46.19 47.29 2jfg s LEU 67 CO 0.82 -0.15 0.00 -0.63 -1.32 0.00 0.00 176.35 175.08 2jfg s ILE 68 N 1.15 3.98 -0.37 6.68 1.01 -0.11 -1.20 121.20 132.34 2jfg s ILE 68 Ca -0.09 -0.30 -0.07 0.00 0.00 0.00 0.00 60.65 60.19 2jfg s ILE 68 Cb -0.10 -2.80 0.06 0.00 0.01 0.00 0.00 42.46 39.62 2jfg s ILE 68 CO -0.07 0.43 0.17 -0.69 0.00 0.00 0.00 174.94 174.78 2jfg s VAL 69 N 1.00 3.96 -0.26 2.92 1.01 0.12 -1.17 120.40 127.98 2jfg s VAL 69 Ca 0.02 -1.26 -0.13 0.00 0.00 0.00 0.00 61.98 60.61 2jfg s VAL 69 Cb -0.14 -3.33 -0.04 0.00 0.00 0.00 0.00 36.38 32.87 2jfg s VAL 69 CO 0.02 -0.32 0.29 0.00 0.00 0.00 0.00 175.10 175.08 2jfg s ALA 70 N 1.40 3.56 0.73 5.51 0.00 0.82 -0.31 121.76 133.47 2jfg s ALA 70 Ca 0.01 -0.88 -0.16 0.00 0.00 0.00 0.00 51.96 50.93 2jfg s ALA 70 Cb -0.21 -2.57 0.03 0.00 0.00 0.00 0.00 23.12 20.38 2jfg s ALA 70 CO 0.02 -0.51 1.26 -1.12 0.00 0.00 0.00 175.76 175.41 2jfg s SER 71 N 1.52 4.09 0.60 0.00 0.01 -0.09 -4.29 113.70 115.55 2jfg s SER 71 Ca 0.12 2.51 0.40 0.00 1.31 0.00 0.00 55.95 60.29 2jfg s SER 71 Cb -0.15 -2.61 2.08 0.00 0.21 0.00 0.00 66.02 65.55 2jfg s SER 71 CO 0.09 -2.34 2.22 1.55 0.41 0.00 0.00 173.24 175.17 2jfg h PRO 72 N -0.16 0.00 -0.00 12.44 0.13 -1.89 -2.70 132.00 139.83 2jfg h PRO 72 Ca -0.49 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 2jfg h PRO 72 Cb 1.32 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.45 2jfg h PRO 72 CO 0.50 0.00 -0.01 0.41 -0.23 0.00 0.00 178.00 178.67 2jfg n GLY 73 N -0.84 -1.14 3.59 1.56 0.00 -1.26 -4.70 105.19 102.39 2jfg n GLY 73 Ca -0.02 -0.18 -0.34 0.00 0.00 0.00 0.00 46.02 45.48 2jfg n GLY 73 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2jfg s ILE 74 N -2.37 4.25 0.19 -0.61 1.10 -1.02 -5.09 121.20 117.65 2jfg s ILE 74 Ca 0.35 -0.24 -0.30 0.00 -0.51 0.00 0.00 60.65 59.95 2jfg s ILE 74 Cb 0.21 -2.85 -0.08 0.00 0.15 0.00 0.00 42.46 39.89 2jfg s ILE 74 CO 0.43 0.52 1.08 0.00 -2.11 0.00 0.00 174.94 174.86 2jfg s ALA 75 N -0.01 3.37 0.58 1.50 0.00 -1.26 -4.90 121.76 121.04 2jfg s ALA 75 Ca 0.03 0.80 0.27 0.00 0.00 0.00 0.00 51.96 53.06 2jfg s ALA 75 Cb -0.13 -3.34 1.66 0.00 0.00 0.00 0.00 23.12 21.31 2jfg s ALA 75 CO 0.02 -0.17 2.15 -0.07 0.00 0.00 0.00 175.76 177.70 2jfg h LEU 76 N 4.89 0.00 0.00 0.00 3.38 -1.96 -1.38 115.31 120.24 2jfg h LEU 76 Ca -0.45 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.52 2jfg h LEU 76 Cb 1.21 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.96 2jfg h LEU 76 CO 0.71 0.00 0.00 0.00 0.09 0.00 0.00 178.44 179.24 2jfg n ALA 77 N -2.37 2.45 -1.66 1.53 0.00 -1.26 -3.11 120.51 116.10 2jfg n ALA 77 Ca -0.00 -0.15 -0.46 0.00 0.00 0.00 0.00 53.44 52.83 2jfg n ALA 77 Cb 0.23 -1.47 -0.04 0.00 0.00 0.00 0.00 19.45 18.17 2jfg n ALA 77 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.50 179.08 2jfg n HIS 78 N -1.22 2.22 -0.33 0.00 -0.00 -0.52 -4.71 115.22 110.66 2jfg n HIS 78 Ca 0.15 0.30 0.19 0.00 -0.00 0.00 0.00 57.72 58.36 2jfg n HIS 78 Cb 0.20 -2.53 0.43 0.00 -0.00 0.00 0.00 29.99 28.10 2jfg n HIS 78 CO 0.00 0.00 0.00 -1.35 -0.00 0.00 0.00 176.34 174.99 2jfg h PRO 79 N 5.77 0.52 -0.33 1.57 0.11 -1.90 0.24 132.00 137.96 2jfg h PRO 79 Ca -0.45 -0.03 -0.17 0.00 0.11 0.00 0.00 66.00 65.46 2jfg h PRO 79 Cb 1.26 -0.12 -0.00 0.00 0.11 0.00 0.00 31.00 32.25 2jfg h PRO 79 CO 0.88 0.34 -0.44 0.77 -0.21 0.00 0.00 178.00 179.33 2jfg h SER 80 N 0.53 0.94 0.35 -2.05 0.02 -1.94 -1.32 113.55 110.08 2jfg h SER 80 Ca 0.59 -0.46 -0.24 0.00 -0.84 0.00 0.00 61.79 60.84 2jfg h SER 80 Cb 1.25 -0.27 0.01 0.00 0.14 0.00 0.00 62.40 63.53 2jfg h SER 80 CO -0.34 1.24 -1.02 0.25 -1.14 0.00 0.00 176.83 175.82 2jfg h LEU 81 N 0.69 0.56 -0.84 5.07 5.85 -1.42 -2.61 115.31 122.62 2jfg h LEU 81 Ca 0.04 -0.48 -0.05 0.00 0.84 0.00 0.00 57.88 58.24 2jfg h LEU 81 Cb 1.03 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 41.86 2jfg h LEU 81 CO 0.10 1.29 0.28 -1.28 -0.34 0.00 0.00 178.44 178.49 2jfg h SER 82 N 0.22 1.05 -0.92 1.25 0.87 -0.54 -1.77 113.55 113.70 2jfg h SER 82 Ca -0.10 -0.17 -0.01 0.00 -1.23 0.00 0.00 61.79 60.28 2jfg h SER 82 Cb 1.67 -0.27 -0.04 0.00 -0.44 0.00 0.00 62.40 63.31 2jfg h SER 82 CO 0.18 0.94 0.53 0.00 -0.53 0.00 0.00 176.83 177.95 2jfg h ALA 83 N 1.20 1.18 -0.64 6.23 0.00 -1.17 -0.36 119.26 125.70 2jfg h ALA 83 Ca 0.25 -0.12 -0.08 0.00 0.00 0.00 0.00 54.91 54.96 2jfg h ALA 83 Cb 0.24 -0.37 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 2jfg h ALA 83 CO -0.02 0.67 0.09 0.00 0.00 0.00 0.00 179.25 179.99 2jfg h ALA 84 N 1.29 0.86 -0.64 0.00 0.00 -1.13 -2.01 119.26 117.63 2jfg h ALA 84 Ca 0.33 -0.27 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 2jfg h ALA 84 Cb -0.01 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.51 2jfg h ALA 84 CO -0.06 0.63 0.34 0.00 0.00 0.00 0.00 179.25 180.17 2jfg h ALA 85 N 1.03 0.82 -0.35 0.00 0.00 -0.94 -1.88 119.26 117.94 2jfg h ALA 85 Ca 0.19 -0.11 0.03 0.00 0.00 0.00 0.00 54.91 55.02 2jfg h ALA 85 Cb 0.45 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 2jfg h ALA 85 CO 0.01 0.34 0.23 -0.44 0.00 0.00 0.00 179.25 179.40 2jfg h ASP 86 N 0.87 0.31 0.19 0.00 3.32 -0.73 -0.55 116.42 119.84 2jfg h ASP 86 Ca 0.22 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.27 2jfg h ASP 86 Cb 0.05 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 39.53 2jfg h ASP 86 CO -0.04 0.22 -0.00 0.00 -1.72 0.00 0.00 179.24 177.70 2jfg n ALA 87 N -2.51 2.62 -0.92 3.45 0.00 -0.79 -4.91 120.51 117.46 2jfg n ALA 87 Ca 0.03 -0.18 0.00 0.00 0.00 0.00 0.00 53.44 53.29 2jfg n ALA 87 Cb 0.15 -1.51 0.00 0.00 0.00 0.00 0.00 19.45 18.09 2jfg n ALA 87 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2jfg n GLY 88 N 1.10 0.46 3.71 0.00 0.00 -0.21 -5.02 105.19 105.21 2jfg n GLY 88 Ca 0.21 -0.79 -0.41 0.00 0.00 0.00 0.00 46.02 45.03 2jfg n GLY 88 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2jfg s ILE 89 N -2.00 4.92 0.13 -0.61 1.01 -0.74 -4.98 121.20 118.93 2jfg s ILE 89 Ca 0.00 1.82 -0.31 0.00 0.00 0.00 0.00 60.65 62.16 2jfg s ILE 89 Cb 0.00 -4.21 -0.09 0.00 0.01 0.00 0.00 42.46 38.16 2jfg s ILE 89 CO 0.00 0.17 1.59 -0.70 0.00 0.00 0.00 174.94 176.00 2jfg s GLU 90 N 1.08 4.21 -0.12 2.79 2.12 -1.26 -4.42 118.70 123.10 2jfg s GLU 90 Ca 0.46 2.34 0.02 0.00 0.36 0.00 0.00 54.97 58.15 2jfg s GLU 90 Cb -0.19 -3.30 0.01 0.00 0.26 0.00 0.00 34.13 30.91 2jfg s GLU 90 CO 0.23 -0.64 -0.19 0.42 -0.54 0.00 0.00 175.26 174.54 2jfg s ILE 91 N 1.61 1.77 0.22 -3.70 1.01 -1.26 -0.93 121.20 119.92 2jfg s ILE 91 Ca 0.71 -0.81 0.01 0.00 0.00 0.00 0.00 60.65 60.56 2jfg s ILE 91 Cb -0.42 -1.58 -0.05 0.00 0.01 0.00 0.00 42.46 40.42 2jfg s ILE 91 CO 0.31 0.49 0.07 0.68 0.00 0.00 0.00 174.94 176.50 2jfg s VAL 92 N 0.84 0.54 0.40 2.92 -7.23 -0.31 -4.96 120.40 112.59 2jfg s VAL 92 Ca -0.08 -1.99 0.02 0.00 -1.81 0.00 0.00 61.98 58.11 2jfg s VAL 92 Cb -0.16 -2.44 0.02 0.00 0.56 0.00 0.00 36.38 34.36 2jfg s VAL 92 CO -0.00 -0.17 0.14 0.61 -0.31 0.00 0.00 175.10 175.37 2jfg n GLY 93 N -0.37 3.32 0.28 2.32 0.00 -1.13 -0.13 105.19 109.48 2jfg n GLY 93 Ca -0.02 -2.30 0.01 0.00 0.00 0.00 0.00 46.02 43.71 2jfg n GLY 93 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 2jfg h ASP 94 N 0.73 0.48 -0.55 1.61 2.03 -1.93 -2.12 116.42 116.68 2jfg h ASP 94 Ca -0.29 -0.07 -0.10 0.00 -0.73 0.00 0.00 57.03 55.84 2jfg h ASP 94 Cb 0.96 -0.12 -0.02 0.00 -0.83 0.00 0.00 39.33 39.32 2jfg h ASP 94 CO 0.48 0.50 -0.03 0.40 -1.03 0.00 0.00 179.24 179.55 2jfg h ILE 95 N 0.51 1.26 -0.20 4.15 1.08 -1.93 -0.15 117.51 122.23 2jfg h ILE 95 Ca 0.12 -1.17 0.01 0.00 -0.39 0.00 0.00 64.86 63.42 2jfg h ILE 95 Cb 0.23 0.86 -0.01 0.00 -3.07 0.00 0.00 36.82 34.83 2jfg h ILE 95 CO 0.00 0.42 0.12 -0.08 -0.69 0.00 0.00 178.15 177.92 2jfg h GLU 96 N 0.92 0.24 -0.80 2.37 4.57 -1.68 -0.33 114.58 119.87 2jfg h GLU 96 Ca 0.16 -0.01 0.10 0.00 -1.18 0.00 0.00 59.36 58.43 2jfg h GLU 96 Cb 0.58 -0.05 -0.08 0.00 -0.16 0.00 0.00 28.75 29.04 2jfg h GLU 96 CO 0.03 0.16 0.43 -0.07 -1.18 0.00 0.00 179.01 178.39 2jfg h LEU 97 N 0.25 0.59 -0.11 1.64 3.38 -1.06 -2.17 115.31 117.83 2jfg h LEU 97 Ca 0.07 0.06 -0.00 0.00 0.09 0.00 0.00 57.88 58.10 2jfg h LEU 97 Cb -0.01 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 40.68 2jfg h LEU 97 CO -0.03 0.32 0.05 0.15 0.09 0.00 0.00 178.44 179.03 2jfg h PHE 98 N 0.71 0.16 -0.47 1.13 3.57 -0.61 -2.96 116.94 118.46 2jfg h PHE 98 Ca 0.40 -0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.89 2jfg h PHE 98 Cb 0.42 -0.05 -0.02 0.00 2.79 0.00 0.00 35.95 39.08 2jfg h PHE 98 CO -0.08 0.22 0.31 0.00 -2.23 0.00 0.00 178.31 176.53 2jfg h ARG 100 N 0.64 0.00 0.00 0.00 3.08 -1.24 -3.26 114.38 113.59 2jfg h ARG 100 Ca 0.17 0.00 -0.07 0.00 0.07 0.00 0.00 59.98 60.15 2jfg h ARG 100 Cb -0.07 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 29.97 2jfg h ARG 100 CO -0.04 0.00 -1.42 0.39 -1.07 0.00 0.00 179.97 177.83 2jfg n GLU 101 N -2.70 1.75 -1.84 0.04 -0.58 -0.23 -4.28 120.64 112.80 2jfg n GLU 101 Ca 0.00 -0.03 -0.41 0.00 -0.42 0.00 0.00 57.16 56.30 2jfg n GLU 101 Cb 0.20 -1.18 -0.01 0.00 -0.57 0.00 0.00 31.44 29.88 2jfg n GLU 101 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2jfg s ALA 102 N -2.32 3.66 -0.13 0.62 0.00 0.40 -4.93 121.76 119.06 2jfg s ALA 102 Ca -0.03 1.52 0.15 0.00 0.00 0.00 0.00 51.96 53.59 2jfg s ALA 102 Cb 0.03 -3.61 0.36 0.00 0.00 0.00 0.00 23.12 19.90 2jfg s ALA 102 CO 0.30 -0.95 1.17 1.04 0.00 0.00 0.00 175.76 177.32 2jfg n GLN 103 N 1.55 1.04 -4.15 0.00 1.13 -1.26 -5.00 117.38 110.70 2jfg n GLN 103 Ca 0.05 -2.67 -0.11 0.00 -1.94 0.00 0.00 57.00 52.33 2jfg n GLN 103 Cb 0.39 -1.14 -0.10 0.00 0.11 0.00 0.00 30.24 29.49 2jfg n GLN 103 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2jfg s ALA 104 N -2.17 0.90 0.60 -1.58 0.00 -1.26 -5.00 121.76 113.24 2jfg s ALA 104 Ca 0.32 -1.22 -0.20 0.00 0.00 0.00 0.00 51.96 50.87 2jfg s ALA 104 Cb 0.32 0.13 -0.03 0.00 0.00 0.00 0.00 23.12 23.54 2jfg s ALA 104 CO -0.06 -0.18 1.27 -2.30 0.00 0.00 0.00 175.76 174.48 2jfg n PRO 105 N 0.31 1.30 -4.90 0.00 -0.02 -1.26 -4.67 135.00 125.76 2jfg n PRO 105 Ca -0.15 0.49 -0.33 0.00 -2.02 0.00 0.00 63.50 61.50 2jfg n PRO 105 Cb 0.59 -2.49 -0.16 0.00 -0.02 0.00 0.00 33.50 31.43 2jfg n PRO 105 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 2jfg s ILE 106 N -1.36 2.57 -0.19 4.25 1.01 -1.26 -1.00 121.20 125.22 2jfg s ILE 106 Ca 0.77 -0.83 -0.12 0.00 0.00 0.00 0.00 60.65 60.48 2jfg s ILE 106 Cb -0.40 -2.04 -0.05 0.00 0.01 0.00 0.00 42.46 39.98 2jfg s ILE 106 CO 0.45 0.54 0.20 -0.69 0.00 0.00 0.00 174.94 175.43 2jfg s VAL 107 N 0.45 5.37 -0.07 2.92 1.01 0.06 -0.65 120.40 129.48 2jfg s VAL 107 Ca -0.13 0.33 0.03 0.00 0.00 0.00 0.00 61.98 62.21 2jfg s VAL 107 Cb -0.17 -3.54 0.01 0.00 0.00 0.00 0.00 36.38 32.69 2jfg s VAL 107 CO 0.06 0.41 -0.15 0.00 0.00 0.00 0.00 175.10 175.42 2jfg s ALA 108 N 0.47 1.46 -0.11 5.51 0.00 -0.46 -0.78 121.76 127.84 2jfg s ALA 108 Ca 0.11 -0.53 -0.00 0.00 0.00 0.00 0.00 51.96 51.54 2jfg s ALA 108 Cb -0.12 -0.62 0.02 0.00 0.00 0.00 0.00 23.12 22.41 2jfg s ALA 108 CO 0.01 0.15 -0.08 0.42 0.00 0.00 0.00 175.76 176.26 2jfg s ILE 109 N 0.59 1.02 0.31 0.00 1.01 -0.26 -1.61 121.20 122.26 2jfg s ILE 109 Ca -0.16 -0.29 0.02 0.00 0.00 0.00 0.00 60.65 60.23 2jfg s ILE 109 Cb -0.16 -1.04 -0.01 0.00 0.01 0.00 0.00 42.46 41.26 2jfg s ILE 109 CO 0.05 0.37 0.08 1.07 0.00 0.00 0.00 174.94 176.50 2jfg n THR 110 N 4.91 0.00 0.00 2.92 5.66 -0.27 -0.46 114.28 127.04 2jfg n THR 110 Ca -0.13 -1.69 0.00 0.00 -3.05 0.00 0.00 64.05 59.19 2jfg n THR 110 Cb 0.50 0.54 0.00 0.00 -1.55 0.00 0.00 70.33 69.82 2jfg n THR 110 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2jfg n GLY 111 N 0.26 3.96 0.16 1.09 0.00 -1.26 -0.84 105.19 108.56 2jfg n GLY 111 Ca -0.07 -1.60 0.03 0.00 0.00 0.00 0.00 46.02 44.38 2jfg n GLY 111 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2jfg h SER 112 N 0.00 0.00 -4.86 1.61 0.02 -1.64 -3.45 113.55 105.23 2jfg h SER 112 Ca 0.00 0.00 -0.09 0.00 -0.84 0.00 0.00 61.79 60.86 2jfg h SER 112 Cb 0.00 0.00 -0.20 0.00 0.14 0.00 0.00 62.40 62.34 2jfg h SER 112 CO 0.00 0.48 -0.07 0.20 -1.14 0.00 0.00 176.83 176.30 2jfg s ASN 113 N -6.49 -0.42 0.00 3.07 -0.87 -1.26 -4.89 114.94 104.08 2jfg s ASN 113 Ca 0.01 0.45 0.00 0.00 -1.57 0.00 0.00 52.86 51.76 2jfg s ASN 113 Cb 0.10 0.49 0.00 0.00 -0.02 0.00 0.00 41.25 41.82 2jfg s ASN 113 CO 0.72 -0.48 0.00 0.61 -2.57 0.00 0.00 177.10 175.38 2jfg n GLY 114 N 1.32 0.58 0.20 0.66 0.00 -1.26 -4.70 105.19 101.99 2jfg n GLY 114 Ca -0.20 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.71 2jfg n GLY 114 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2jfg h LYS 115 N 4.03 -0.26 -0.45 1.61 1.57 -1.89 -1.12 116.57 120.07 2jfg h LYS 115 Ca 0.00 0.02 -0.09 0.00 -1.87 0.00 0.00 60.65 58.70 2jfg h LYS 115 Cb 0.00 0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.35 2jfg h LYS 115 CO 0.00 -0.18 -0.10 0.77 -0.57 0.00 0.00 179.45 179.37 2jfg h SER 116 N -0.27 0.79 0.26 0.86 0.02 -1.95 0.90 113.55 114.15 2jfg h SER 116 Ca 0.05 -0.24 -0.01 0.00 -0.84 0.00 0.00 61.79 60.75 2jfg h SER 116 Cb 0.33 -0.21 0.00 0.00 0.14 0.00 0.00 62.40 62.66 2jfg h SER 116 CO -0.14 0.92 -0.12 0.74 -1.14 0.00 0.00 176.83 177.08 2jfg h THR 117 N 0.72 0.76 -0.42 -2.27 2.02 -1.93 -0.20 112.91 111.60 2jfg h THR 117 Ca 0.12 -0.08 -0.02 0.00 0.77 0.00 0.00 66.41 67.21 2jfg h THR 117 Cb 0.59 0.81 -0.02 0.00 -1.74 0.00 0.00 68.15 67.79 2jfg h THR 117 CO 0.04 0.02 0.20 0.58 0.37 0.00 0.00 175.52 176.73 2jfg h VAL 118 N -0.39 1.18 -0.42 3.16 2.07 -1.04 -0.45 116.25 120.37 2jfg h VAL 118 Ca -0.04 -0.51 0.07 0.00 0.82 0.00 0.00 66.70 67.04 2jfg h VAL 118 Cb 0.30 0.74 -0.06 0.00 -1.52 0.00 0.00 31.29 30.74 2jfg h VAL 118 CO 0.06 0.19 0.09 0.74 0.02 0.00 0.00 177.57 178.67 2jfg h THR 119 N 0.54 0.78 -0.44 2.57 2.02 -0.77 -0.63 112.91 116.99 2jfg h THR 119 Ca 0.15 -0.08 -0.11 0.00 0.77 0.00 0.00 66.41 67.14 2jfg h THR 119 Cb 0.12 0.54 -0.02 0.00 -1.74 0.00 0.00 68.15 67.06 2jfg h THR 119 CO -0.02 0.04 -0.18 0.74 0.37 0.00 0.00 175.52 176.48 2jfg h THR 120 N 0.22 1.27 -0.18 3.16 2.02 -0.84 -1.74 112.91 116.82 2jfg h THR 120 Ca 0.20 -1.29 -0.00 0.00 0.77 0.00 0.00 66.41 66.09 2jfg h THR 120 Cb 0.25 1.11 -0.01 0.00 -1.74 0.00 0.00 68.15 67.76 2jfg h THR 120 CO -0.26 0.44 0.10 -0.07 0.37 0.00 0.00 175.52 176.09 2jfg h LEU 121 N 0.75 0.22 -0.97 2.58 3.38 -0.65 0.48 115.31 121.10 2jfg h LEU 121 Ca 0.11 -0.08 -0.01 0.00 0.09 0.00 0.00 57.88 57.99 2jfg h LEU 121 Cb 0.70 -0.06 -0.04 0.00 0.09 0.00 0.00 40.66 41.35 2jfg h LEU 121 CO 0.05 0.24 0.56 0.58 0.09 0.00 0.00 178.44 179.96 2jfg h VAL 122 N 0.19 1.26 -0.59 1.22 2.07 -0.99 0.37 116.25 119.78 2jfg h VAL 122 Ca 0.06 -0.57 0.04 0.00 0.82 0.00 0.00 66.70 67.05 2jfg h VAL 122 Cb 0.06 -0.05 -0.04 0.00 -1.52 0.00 0.00 31.29 29.74 2jfg h VAL 122 CO -0.01 0.27 0.34 1.23 0.02 0.00 0.00 177.57 179.43 2jfg h GLY 123 N 1.29 0.84 1.43 2.17 0.00 -0.77 -1.00 103.07 107.02 2jfg h GLY 123 Ca 0.33 -0.25 -0.09 0.00 0.00 0.00 0.00 47.33 47.32 2jfg h GLY 123 CO -0.06 0.20 -0.13 0.83 0.00 0.00 0.00 176.54 177.37 2jfg h GLU 124 N 0.67 0.68 -0.71 4.80 4.39 -0.12 -0.71 114.58 123.58 2jfg h GLU 124 Ca 0.25 -0.22 -0.03 0.00 0.34 0.00 0.00 59.36 59.69 2jfg h GLU 124 Cb 0.07 -0.06 -0.03 0.00 -0.10 0.00 0.00 28.75 28.63 2jfg h GLU 124 CO -0.12 0.79 0.33 0.52 -1.16 0.00 0.00 179.01 179.37 2jfg h MET 125 N 0.62 1.03 -0.19 2.33 2.86 -0.50 -0.55 114.93 120.52 2jfg h MET 125 Ca 0.10 -0.16 -0.02 0.00 -2.06 0.00 0.00 59.70 57.57 2jfg h MET 125 Cb 0.58 -0.18 -0.01 0.00 0.06 0.00 0.00 31.60 32.05 2jfg h MET 125 CO 0.04 0.82 0.04 0.00 1.06 0.00 0.00 176.91 178.86 2jfg h ALA 126 N 1.16 0.25 -0.76 6.32 0.00 -0.80 -2.78 119.26 122.64 2jfg h ALA 126 Ca 0.24 -0.16 0.05 0.00 0.00 0.00 0.00 54.91 55.04 2jfg h ALA 126 Cb 0.13 -0.07 -0.05 0.00 0.00 0.00 0.00 17.79 17.80 2jfg h ALA 126 CO -0.03 -0.10 0.47 0.87 0.00 0.00 0.00 179.25 180.46 2jfg h LYS 127 N 0.11 0.86 0.00 0.00 1.57 -1.00 -1.36 116.57 116.74 2jfg h LYS 127 Ca 0.06 -0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 58.77 2jfg h LYS 127 Cb 0.29 -0.19 -0.00 0.00 0.08 0.00 0.00 32.23 32.41 2jfg h LYS 127 CO 0.00 0.57 -0.07 0.00 -0.57 0.00 0.00 179.45 179.38 2jfg h ALA 128 N 1.35 1.47 -0.01 3.86 0.00 -1.01 -0.60 119.26 124.32 2jfg h ALA 128 Ca 0.32 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.17 2jfg h ALA 128 Cb 0.09 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.87 2jfg h ALA 128 CO -0.14 0.09 -0.09 0.00 0.00 0.00 0.00 179.25 179.10 2jfg n ALA 129 N -2.34 2.76 -1.34 0.00 0.00 -0.61 -4.90 120.51 114.08 2jfg n ALA 129 Ca -0.02 -0.34 -0.03 0.00 0.00 0.00 0.00 53.44 53.05 2jfg n ALA 129 Cb 0.16 -1.27 -0.01 0.00 0.00 0.00 0.00 19.45 18.33 2jfg n ALA 129 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2jfg n GLY 130 N 1.22 0.51 3.76 0.00 0.00 -0.23 -5.03 105.19 105.43 2jfg n GLY 130 Ca 0.17 -0.90 -0.39 0.00 0.00 0.00 0.00 46.02 44.90 2jfg n GLY 130 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2jfg s VAL 131 N -2.12 4.90 -0.47 1.61 1.01 -0.61 -5.01 120.40 119.70 2jfg s VAL 131 Ca 0.00 1.25 -0.28 0.00 0.00 0.00 0.00 61.98 62.95 2jfg s VAL 131 Cb 0.00 -3.93 -0.00 0.00 0.00 0.00 0.00 36.38 32.44 2jfg s VAL 131 CO 0.00 0.42 1.62 0.21 0.00 0.00 0.00 175.10 177.35 2jfg s ASN 132 N -0.23 5.93 0.03 3.32 3.84 -1.26 -4.20 114.94 122.37 2jfg s ASN 132 Ca 0.31 0.71 0.09 0.00 0.21 0.00 0.00 52.86 54.17 2jfg s ASN 132 Cb -0.18 -2.54 -0.03 0.00 -0.55 0.00 0.00 41.25 37.95 2jfg s ASN 132 CO 0.17 -1.79 -0.25 0.54 -2.79 0.00 0.00 177.10 172.98 2jfg s VAL 133 N 6.78 2.20 -0.16 -5.21 0.11 -1.26 -0.64 120.40 122.22 2jfg s VAL 133 Ca 0.65 -1.29 -0.01 0.00 -2.93 0.00 0.00 61.98 58.40 2jfg s VAL 133 Cb -0.15 -1.84 -0.01 0.00 -1.53 0.00 0.00 36.38 32.85 2jfg s VAL 133 CO 0.28 0.42 -0.12 -0.83 -3.33 0.00 0.00 175.10 171.52 2jfg s GLY 134 N -1.10 1.54 -0.15 6.54 0.00 -0.39 -5.00 107.32 108.76 2jfg s GLY 134 Ca 0.12 -1.00 0.02 0.00 0.00 0.00 0.00 44.72 43.85 2jfg s GLY 134 CO 0.02 0.02 -0.21 0.14 0.00 0.00 0.00 173.10 173.07 2jfg s VAL 135 N 0.75 2.06 0.00 1.40 1.01 -1.26 -0.40 120.40 123.96 2jfg s VAL 135 Ca -0.05 -0.96 0.00 0.00 0.00 0.00 0.00 61.98 60.97 2jfg s VAL 135 Cb -0.15 -1.83 0.00 0.00 0.00 0.00 0.00 36.38 34.40 2jfg s VAL 135 CO 0.01 0.55 0.00 0.61 0.00 0.00 0.00 175.10 176.27 2jfg n GLY 136 N 4.25 1.62 0.13 4.51 0.00 -0.82 -4.85 105.19 110.03 2jfg n GLY 136 Ca -0.20 -0.74 0.00 0.00 0.00 0.00 0.00 46.02 45.07 2jfg n GLY 136 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jfg n GLY 137 N 0.00 0.97 0.32 -0.02 0.00 0.44 -1.29 105.19 105.62 2jfg n GLY 137 Ca 0.00 -1.64 0.20 0.00 0.00 0.00 0.00 46.02 44.59 2jfg n GLY 137 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 2jfg h ASN 138 N 0.16 0.00 -0.09 1.61 -1.24 -0.99 -1.20 115.58 113.83 2jfg h ASN 138 Ca 0.00 0.00 0.03 0.00 0.71 0.00 0.00 56.30 57.04 2jfg h ASN 138 Cb 0.00 0.00 -0.00 0.00 0.73 0.00 0.00 38.32 39.05 2jfg h ASN 138 CO 0.00 0.01 0.21 -0.29 -1.29 0.00 0.00 177.43 176.06 2jfg h ILE 139 N 0.00 0.20 0.00 2.57 2.10 -1.79 -3.46 117.51 117.13 2jfg h ILE 139 Ca -0.00 0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.94 2jfg h ILE 139 Cb 0.06 0.81 0.00 0.00 -1.09 0.00 0.00 36.82 36.60 2jfg h ILE 139 CO 0.00 0.00 0.00 0.61 -1.08 0.00 0.00 178.15 177.68 2jfg n GLY 140 N -1.27 0.93 3.28 8.18 0.00 -0.45 -5.09 105.19 110.77 2jfg n GLY 140 Ca -0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.60 2jfg n GLY 140 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2jfg s LEU 141 N 0.00 5.40 0.15 0.99 2.96 -1.23 -4.99 118.68 121.96 2jfg s LEU 141 Ca 0.00 -1.57 -0.34 0.00 -0.22 0.00 0.00 54.13 52.00 2jfg s LEU 141 Cb 0.00 -2.04 -0.15 0.00 0.50 0.00 0.00 46.19 44.50 2jfg s LEU 141 CO 0.00 -0.61 1.41 -2.65 -1.32 0.00 0.00 176.35 173.19 2jfg n PRO 142 N 4.98 1.66 -0.34 0.98 -0.02 -1.26 -0.42 135.00 140.59 2jfg n PRO 142 Ca -0.10 0.60 0.12 0.00 -2.02 0.00 0.00 63.50 62.09 2jfg n PRO 142 Cb 0.42 -2.27 0.33 0.00 -0.02 0.00 0.00 33.50 31.96 2jfg n PRO 142 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2jfg h ALA 143 N 4.84 1.71 -0.02 3.55 0.00 -1.90 -0.50 119.26 126.94 2jfg h ALA 143 Ca -0.46 0.05 0.01 0.00 0.00 0.00 0.00 54.91 54.51 2jfg h ALA 143 Cb 1.30 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.97 2jfg h ALA 143 CO 0.80 -0.02 0.02 -0.07 0.00 0.00 0.00 179.25 179.98 2jfg h LEU 144 N 0.78 0.00 0.00 0.00 3.38 -1.88 -0.58 115.31 117.02 2jfg h LEU 144 Ca 0.53 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.50 2jfg h LEU 144 Cb 0.80 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.55 2jfg h LEU 144 CO -0.31 0.00 0.00 0.23 0.09 0.00 0.00 178.44 178.45 2jfg n MET 145 N -3.94 0.01 0.17 1.13 2.81 -0.19 -2.86 117.12 114.23 2jfg n MET 145 Ca -0.03 0.18 0.10 0.00 -1.81 0.00 0.00 57.70 56.14 2jfg n MET 145 Cb 0.11 -1.50 0.09 0.00 -0.71 0.00 0.00 33.22 31.20 2jfg n MET 145 CO 0.00 0.00 0.00 -0.07 1.51 0.00 0.00 175.97 177.41 2jfg h LEU 146 N 0.00 0.00 -9.34 4.03 3.38 -1.22 -3.47 115.31 108.69 2jfg h LEU 146 Ca 0.00 0.00 -0.60 0.00 0.09 0.00 0.00 57.88 57.37 2jfg h LEU 146 Cb 0.32 0.00 0.03 0.00 0.09 0.00 0.00 40.66 41.09 2jfg h LEU 146 CO 0.00 0.11 1.07 0.18 0.09 0.00 0.00 178.44 179.89 2jfg n LEU 147 N -2.99 3.51 -3.62 1.67 4.77 -1.14 -4.94 117.00 114.26 2jfg n LEU 147 Ca 0.02 0.98 -0.01 0.00 -0.03 0.00 0.00 56.01 56.97 2jfg n LEU 147 Cb 0.59 -1.41 -0.04 0.00 -2.33 0.00 0.00 43.42 40.23 2jfg n LEU 147 CO 0.37 -0.05 0.26 -0.62 -1.33 0.00 0.00 177.39 176.02 2jfg s ASP 148 N 3.51 -1.16 0.03 -1.43 -1.08 -1.26 -5.04 116.67 110.25 2jfg s ASP 148 Ca 0.89 1.54 0.11 0.00 -0.52 0.00 0.00 52.55 54.57 2jfg s ASP 148 Cb -0.65 2.30 0.47 0.00 -1.46 0.00 0.00 42.92 43.58 2jfg s ASP 148 CO 0.47 -0.22 1.34 -0.90 0.52 0.00 0.00 175.17 176.38 2jfg n ASP 149 N 5.45 0.06 -0.13 -0.34 5.75 -1.26 -0.75 116.55 125.34 2jfg n ASP 149 Ca -0.11 0.52 0.12 0.00 -0.01 0.00 0.00 54.79 55.31 2jfg n ASP 149 Cb 0.49 -0.53 0.25 0.00 -1.03 0.00 0.00 41.12 40.30 2jfg n ASP 149 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 2jfg n GLU 150 N -1.58 0.41 -2.14 0.11 1.02 -1.26 -4.92 120.64 112.28 2jfg n GLU 150 Ca 0.02 -0.26 -0.41 0.00 -0.02 0.00 0.00 57.16 56.49 2jfg n GLU 150 Cb 0.12 -1.49 -0.02 0.00 -0.02 0.00 0.00 31.44 30.02 2jfg n GLU 150 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2jfg n GLU 152 N 1.58 2.08 -3.64 0.00 1.02 0.19 -4.62 120.64 117.26 2jfg n GLU 152 Ca 0.03 -0.03 -0.10 0.00 -0.02 0.00 0.00 57.16 57.04 2jfg n GLU 152 Cb 0.42 -1.18 -0.07 0.00 -0.02 0.00 0.00 31.44 30.59 2jfg n GLU 152 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 2jfg s LEU 153 N -2.93 -0.80 -0.07 -4.62 2.96 -1.10 -4.29 118.68 107.83 2jfg s LEU 153 Ca 0.03 1.41 0.01 0.00 -0.22 0.00 0.00 54.13 55.36 2jfg s LEU 153 Cb 0.10 2.37 -0.03 0.00 0.50 0.00 0.00 46.19 49.13 2jfg s LEU 153 CO 0.56 -0.23 -0.09 -0.31 -1.32 0.00 0.00 176.35 174.95 2jfg s TYR 154 N 0.93 2.87 -0.21 5.38 2.02 -0.17 -1.26 117.35 126.92 2jfg s TYR 154 Ca -0.04 -0.10 0.01 0.00 -0.37 0.00 0.00 57.07 56.57 2jfg s TYR 154 Cb -0.05 -1.72 0.03 0.00 -0.40 0.00 0.00 41.96 39.82 2jfg s TYR 154 CO -0.09 0.22 -0.16 0.08 -1.57 0.00 0.00 175.55 174.03 2jfg s VAL 155 N -0.61 2.16 -0.17 0.71 1.01 0.47 -0.76 120.40 123.21 2jfg s VAL 155 Ca 0.09 -1.13 -0.01 0.00 0.00 0.00 0.00 61.98 60.93 2jfg s VAL 155 Cb -0.12 -2.02 -0.00 0.00 0.00 0.00 0.00 36.38 34.24 2jfg s VAL 155 CO 0.02 0.36 -0.12 -0.76 0.00 0.00 0.00 175.10 174.59 2jfg s LEU 156 N 1.24 2.60 -0.11 3.92 1.43 0.04 -1.94 118.68 125.86 2jfg s LEU 156 Ca 0.01 -0.44 -0.26 0.00 -1.03 0.00 0.00 54.13 52.40 2jfg s LEU 156 Cb -0.15 -1.61 -0.02 0.00 0.03 0.00 0.00 46.19 44.43 2jfg s LEU 156 CO -0.10 0.06 0.85 -0.70 0.23 0.00 0.00 176.35 176.69 2jfg s GLU 157 N 0.98 4.39 -0.05 1.70 2.12 -0.41 -1.10 118.70 126.33 2jfg s GLU 157 Ca -0.02 1.11 0.05 0.00 0.36 0.00 0.00 54.97 56.47 2jfg s GLU 157 Cb -0.15 -3.52 -0.01 0.00 0.26 0.00 0.00 34.13 30.71 2jfg s GLU 157 CO -0.02 -0.20 -0.21 -0.51 -0.54 0.00 0.00 175.26 173.78 2jfg s LEU 158 N 1.66 1.99 0.48 2.70 1.43 0.39 -0.34 118.68 126.99 2jfg s LEU 158 Ca 0.42 -0.43 -0.03 0.00 -1.03 0.00 0.00 54.13 53.06 2jfg s LEU 158 Cb -0.18 -1.17 -0.01 0.00 0.03 0.00 0.00 46.19 44.86 2jfg s LEU 158 CO 0.17 0.19 0.74 -0.94 0.23 0.00 0.00 176.35 176.75 2jfg s SER 159 N -0.04 5.95 0.31 2.29 1.04 -1.26 -4.20 113.70 117.79 2jfg s SER 159 Ca -0.04 0.59 0.03 0.00 0.48 0.00 0.00 55.95 57.00 2jfg s SER 159 Cb -0.13 -1.83 0.60 0.00 0.10 0.00 0.00 66.02 64.76 2jfg s SER 159 CO 0.03 -0.71 1.90 0.77 0.98 0.00 0.00 173.24 176.22 2jfg h SER 160 N 0.25 0.84 -0.34 7.02 4.64 -1.93 -1.41 113.55 122.62 2jfg h SER 160 Ca -0.47 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 2jfg h SER 160 Cb 1.24 -0.16 -0.02 0.00 -0.31 0.00 0.00 62.40 63.15 2jfg h SER 160 CO 0.60 0.52 0.22 -0.26 -0.87 0.00 0.00 176.83 177.04 2jfg h PHE 161 N 0.94 0.43 -0.72 4.77 0.04 -1.94 -1.53 116.94 118.93 2jfg h PHE 161 Ca 0.40 0.01 -0.06 0.00 2.80 0.00 0.00 57.97 61.12 2jfg h PHE 161 Cb 0.31 -0.14 -0.03 0.00 2.20 0.00 0.00 35.95 38.28 2jfg h PHE 161 CO -0.00 0.28 0.21 1.96 -0.60 0.00 0.00 178.31 180.16 2jfg h GLN 162 N 0.45 1.12 -0.59 1.51 4.20 -1.77 -2.81 115.11 117.22 2jfg h GLN 162 Ca 0.12 -0.25 -0.00 0.00 0.06 0.00 0.00 58.65 58.58 2jfg h GLN 162 Cb -0.04 -0.16 -0.03 0.00 0.30 0.00 0.00 27.48 27.55 2jfg h GLN 162 CO -0.03 0.96 0.36 -0.07 -0.67 0.00 0.00 178.83 179.39 2jfg h LEU 163 N 1.06 0.70 -1.66 1.46 3.38 -0.92 -2.64 115.31 116.70 2jfg h LEU 163 Ca 0.23 -0.04 0.11 0.00 0.09 0.00 0.00 57.88 58.27 2jfg h LEU 163 Cb 0.32 -0.18 -0.04 0.00 0.09 0.00 0.00 40.66 40.86 2jfg h LEU 163 CO -0.01 0.54 0.41 -0.33 0.09 0.00 0.00 178.44 179.15 2jfg h GLU 164 N 0.82 0.36 -0.53 1.13 5.08 -1.01 -1.75 114.58 118.68 2jfg h GLU 164 Ca 0.21 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.55 2jfg h GLU 164 Cb -0.03 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.14 2jfg h GLU 164 CO -0.04 0.24 0.00 0.25 -1.00 0.00 0.00 179.01 178.46 2jfg n THR 165 N -4.47 1.65 -4.70 1.13 -2.24 -1.00 -4.94 114.28 99.71 2jfg n THR 165 Ca 0.10 -1.25 -0.33 0.00 -2.27 0.00 0.00 64.05 60.31 2jfg n THR 165 Cb 0.41 0.18 -0.15 0.00 -2.10 0.00 0.00 70.33 68.68 2jfg n THR 165 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 2jfg s THR 166 N -1.74 2.98 0.00 4.28 2.01 -0.66 -2.83 115.64 119.68 2jfg s THR 166 Ca 0.43 -0.68 0.00 0.00 0.31 0.00 0.00 61.69 61.75 2jfg s THR 166 Cb 0.28 -2.25 0.00 0.00 0.01 0.00 0.00 72.50 70.53 2jfg s THR 166 CO 0.21 0.52 0.00 -1.54 -0.69 0.00 0.00 174.62 173.12 2jfg n SER 167 N 3.68 2.49 -1.15 3.53 3.41 -1.26 -4.82 113.62 119.50 2jfg n SER 167 Ca -0.18 -0.09 0.08 0.00 -0.26 0.00 0.00 58.87 58.42 2jfg n SER 167 Cb 0.52 0.67 0.28 0.00 -0.26 0.00 0.00 64.21 65.42 2jfg n SER 167 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2jfg n SER 168 N -0.92 4.08 -4.68 4.04 7.64 -1.26 -4.96 113.62 117.56 2jfg n SER 168 Ca 0.00 -2.52 -0.43 0.00 1.01 0.00 0.00 58.87 56.93 2jfg n SER 168 Cb 0.00 -0.48 -0.02 0.00 -1.01 0.00 0.00 64.21 62.69 2jfg n SER 168 CO 0.00 0.00 0.00 -0.22 -3.01 0.00 0.00 175.04 171.81 2jfg s LEU 169 N -1.96 4.21 -0.56 -3.43 2.96 -1.26 -4.80 118.68 113.83 2jfg s LEU 169 Ca 0.41 1.55 0.05 0.00 -0.22 0.00 0.00 54.13 55.93 2jfg s LEU 169 Cb 0.28 -3.55 0.19 0.00 0.50 0.00 0.00 46.19 43.61 2jfg s LEU 169 CO 0.17 -0.56 0.47 0.00 -1.32 0.00 0.00 176.35 175.11 2jfg n GLN 170 N 5.54 1.19 -2.13 1.98 6.02 -1.26 -4.64 117.38 124.07 2jfg n GLN 170 Ca 0.10 -3.90 -0.39 0.00 -0.01 0.00 0.00 57.00 52.81 2jfg n GLN 170 Cb 0.47 -1.95 -0.01 0.00 1.02 0.00 0.00 30.24 29.77 2jfg n GLN 170 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2jfg s ALA 171 N -0.98 3.14 0.35 -1.58 0.00 -1.26 -4.74 121.76 116.70 2jfg s ALA 171 Ca 0.31 1.12 0.08 0.00 0.00 0.00 0.00 51.96 53.46 2jfg s ALA 171 Cb 0.03 -3.45 0.65 0.00 0.00 0.00 0.00 23.12 20.35 2jfg s ALA 171 CO -0.16 -0.76 1.83 -0.24 0.00 0.00 0.00 175.76 176.44 2jfg h VAL 172 N 2.24 1.23 -2.51 0.00 3.04 -1.24 0.79 116.25 119.79 2jfg h VAL 172 Ca -0.49 -1.05 -0.09 0.00 -1.01 0.00 0.00 66.70 64.06 2jfg h VAL 172 Cb 1.25 1.35 -0.24 0.00 -2.01 0.00 0.00 31.29 31.64 2jfg h VAL 172 CO 0.62 0.32 -0.19 0.00 -1.01 0.00 0.00 177.57 177.31 2jfg s ALA 173 N -4.54 -1.23 0.02 3.17 0.00 -1.23 -2.58 121.76 115.36 2jfg s ALA 173 Ca -0.05 1.60 0.02 0.00 0.00 0.00 0.00 51.96 53.53 2jfg s ALA 173 Cb 0.15 -0.95 -0.02 0.00 0.00 0.00 0.00 23.12 22.30 2jfg s ALA 173 CO 0.75 -0.27 -0.06 0.00 0.00 0.00 0.00 175.76 176.18 2jfg s ALA 174 N 0.99 0.44 0.03 0.00 0.00 -0.59 -1.35 121.76 121.27 2jfg s ALA 174 Ca -0.06 -0.51 0.02 0.00 0.00 0.00 0.00 51.96 51.41 2jfg s ALA 174 Cb -0.06 -0.00 -0.02 0.00 0.00 0.00 0.00 23.12 23.04 2jfg s ALA 174 CO -0.09 0.01 -0.07 -0.08 0.00 0.00 0.00 175.76 175.53 2jfg s THR 175 N -0.86 0.51 -0.30 0.00 -1.32 -0.63 -0.53 115.64 112.51 2jfg s THR 175 Ca -0.06 -0.76 -0.09 0.00 -1.21 0.00 0.00 61.69 59.57 2jfg s THR 175 Cb -0.07 -0.53 -0.00 0.00 -1.51 0.00 0.00 72.50 70.39 2jfg s THR 175 CO 0.00 -0.18 0.13 -0.63 -2.21 0.00 0.00 174.62 171.73 2jfg s ILE 176 N -0.90 4.43 0.22 5.08 1.01 -1.24 -1.11 121.20 128.69 2jfg s ILE 176 Ca -0.05 -0.48 -0.00 0.00 0.00 0.00 0.00 60.65 60.11 2jfg s ILE 176 Cb -0.07 -3.26 -0.02 0.00 0.01 0.00 0.00 42.46 39.12 2jfg s ILE 176 CO 0.00 0.08 1.57 -0.07 0.00 0.00 0.00 174.94 176.52 2jfg h LEU 177 N 8.32 0.52 -7.00 2.97 3.38 -1.31 -3.38 115.31 118.80 2jfg h LEU 177 Ca -0.32 -0.25 0.24 0.00 0.09 0.00 0.00 57.88 57.63 2jfg h LEU 177 Cb 1.14 -0.15 -0.20 0.00 0.09 0.00 0.00 40.66 41.55 2jfg h LEU 177 CO 0.61 0.92 0.80 0.54 0.09 0.00 0.00 178.44 181.40 2jfg s ASN 178 N -6.89 -0.15 -0.23 -0.43 2.20 -1.26 -4.67 114.94 103.52 2jfg s ASN 178 Ca -0.07 0.03 -0.01 0.00 -0.94 0.00 0.00 52.86 51.87 2jfg s ASN 178 Cb 0.12 0.15 0.07 0.00 -2.00 0.00 0.00 41.25 39.58 2jfg s ASN 178 CO 0.82 -0.23 0.01 -0.69 -2.94 0.00 0.00 177.10 174.08 2jfg s VAL 179 N -2.20 0.95 0.13 3.54 1.01 -1.26 -1.65 120.40 120.92 2jfg s VAL 179 Ca 0.08 -0.93 0.05 0.00 0.00 0.00 0.00 61.98 61.19 2jfg s VAL 179 Cb -0.01 -1.41 -0.04 0.00 0.00 0.00 0.00 36.38 34.93 2jfg s VAL 179 CO -0.05 -0.24 -0.11 0.42 0.00 0.00 0.00 175.10 175.12 2jfg s THR 180 N 1.65 1.17 -0.11 3.92 -4.23 -1.26 -4.97 115.64 111.80 2jfg s THR 180 Ca -0.01 -1.83 -0.38 0.00 -1.18 0.00 0.00 61.69 58.29 2jfg s THR 180 Cb -0.18 -1.60 -0.15 0.00 1.34 0.00 0.00 72.50 71.91 2jfg s THR 180 CO -0.10 -0.58 1.61 1.21 -0.54 0.00 0.00 174.62 176.23 2jfg n GLU 181 N 0.26 1.31 -3.49 3.99 2.13 -1.26 -4.86 120.64 118.72 2jfg n GLU 181 Ca -0.14 0.48 -0.12 0.00 0.66 0.00 0.00 57.16 58.04 2jfg n GLU 181 Cb 0.59 -2.17 -0.03 0.00 0.27 0.00 0.00 31.44 30.10 2jfg n GLU 181 CO 0.00 0.00 0.00 0.34 -0.41 0.00 0.00 177.13 177.06 2jfg s ASP 182 N 2.43 -0.47 -1.84 4.31 2.15 -1.26 -4.50 116.67 117.49 2jfg s ASP 182 Ca 0.92 -0.04 0.00 0.00 0.43 0.00 0.00 52.55 53.86 2jfg s ASP 182 Cb -0.97 0.55 0.00 0.00 -0.30 0.00 0.00 42.92 42.20 2jfg s ASP 182 CO 0.56 -0.90 0.00 1.41 -0.17 0.00 0.00 175.17 176.07 2jfg n HIS 183 N -0.21 -0.89 0.27 -5.34 8.25 -1.26 -4.86 115.22 111.19 2jfg n HIS 183 Ca -0.17 0.00 0.12 0.00 -0.26 0.00 0.00 57.72 57.41 2jfg n HIS 183 Cb 0.64 -3.91 0.78 0.00 1.12 0.00 0.00 29.99 28.61 2jfg n HIS 183 CO 0.00 0.00 0.00 0.52 0.64 0.00 0.00 176.34 177.50 2jfg h MET 184 N 0.00 0.00 0.00 -0.41 2.86 -1.85 0.66 114.93 116.19 2jfg h MET 184 Ca -0.49 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.15 2jfg h MET 184 Cb 1.37 0.00 0.00 0.00 0.06 0.00 0.00 31.60 33.03 2jfg h MET 184 CO 0.59 0.05 0.00 0.38 1.06 0.00 0.00 176.91 178.99 2jfg h ASP 185 N 0.00 0.00 -0.01 1.22 2.03 -1.79 -2.30 116.42 115.56 2jfg h ASP 185 Ca -0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 2jfg h ASP 185 Cb 0.12 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.62 2jfg h ASP 185 CO 0.01 0.00 -0.29 0.54 -1.03 0.00 0.00 179.24 178.47 2jfg n ARG 186 N -2.76 1.96 -3.62 4.15 5.12 0.20 -4.83 116.66 116.89 2jfg n ARG 186 Ca -0.02 -0.65 -0.27 0.00 -1.93 0.00 0.00 57.85 54.97 2jfg n ARG 186 Cb 0.06 -1.17 -0.11 0.00 -1.16 0.00 0.00 32.46 30.08 2jfg n ARG 186 CO 0.00 0.00 0.00 0.66 -1.93 0.00 0.00 177.63 176.36 2jfg n TYR 187 N -0.27 1.05 0.77 -1.55 4.01 -0.87 -4.96 117.16 115.35 2jfg n TYR 187 Ca 0.05 -3.78 0.08 0.00 -0.16 0.00 0.00 57.90 54.09 2jfg n TYR 187 Cb 0.26 -0.16 0.41 0.00 -0.31 0.00 0.00 39.34 39.54 2jfg n TYR 187 CO 0.00 0.00 0.00 -0.35 -0.46 0.00 0.00 176.86 176.05 2jfg n PRO 188 N 2.38 0.23 -0.86 -0.72 -0.04 -1.26 -0.81 135.00 133.92 2jfg n PRO 188 Ca 0.25 0.13 0.07 0.00 -0.04 0.00 0.00 63.50 63.91 2jfg n PRO 188 Cb 0.42 -1.50 0.39 0.00 -0.04 0.00 0.00 33.50 32.77 2jfg n PRO 188 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 2jfg n PHE 189 N -1.29 1.98 -4.48 0.54 3.01 -1.26 -5.06 117.46 110.89 2jfg n PHE 189 Ca 0.08 -0.76 0.00 0.00 1.01 0.00 0.00 57.45 57.77 2jfg n PHE 189 Cb 0.13 -0.50 0.00 0.00 -0.01 0.00 0.00 39.48 39.10 2jfg n PHE 189 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2jfg n GLY 190 N 0.47 -0.29 0.33 1.37 0.00 0.01 -3.78 105.19 103.30 2jfg n GLY 190 Ca 0.28 -1.07 0.02 0.00 0.00 0.00 0.00 46.02 45.25 2jfg n GLY 190 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2jfg h LEU 191 N 0.00 0.86 -1.27 0.99 5.85 -1.97 -1.38 115.31 118.39 2jfg h LEU 191 Ca 0.00 0.02 -0.07 0.00 0.84 0.00 0.00 57.88 58.67 2jfg h LEU 191 Cb 0.00 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 40.86 2jfg h LEU 191 CO 0.00 0.54 -0.34 1.56 -0.34 0.00 0.00 178.44 179.86 2jfg h GLN 192 N 0.98 0.00 -0.29 1.25 1.08 -1.99 0.03 115.11 116.18 2jfg h GLN 192 Ca 0.39 0.00 -0.10 0.00 -1.45 0.00 0.00 58.65 57.50 2jfg h GLN 192 Cb 0.21 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.64 2jfg h GLN 192 CO -0.19 0.34 -0.21 0.37 -0.95 0.00 0.00 178.83 178.19 2jfg h GLN 193 N 0.00 0.65 -0.22 1.46 4.15 -1.36 -0.87 115.11 118.93 2jfg h GLN 193 Ca -0.00 -0.31 0.01 0.00 0.77 0.00 0.00 58.65 59.12 2jfg h GLN 193 Cb 0.68 -0.00 -0.02 0.00 0.21 0.00 0.00 27.48 28.35 2jfg h GLN 193 CO 0.04 0.91 0.11 -0.92 -1.93 0.00 0.00 178.83 177.04 2jfg h TYR 194 N 0.40 0.20 -0.68 3.99 3.20 -1.13 -2.40 116.97 120.55 2jfg h TYR 194 Ca 0.06 0.01 0.03 0.00 3.14 0.00 0.00 58.73 61.96 2jfg h TYR 194 Cb 0.75 -0.06 -0.04 0.00 1.54 0.00 0.00 36.73 38.92 2jfg h TYR 194 CO 0.07 0.11 0.42 -0.09 -1.64 0.00 0.00 178.16 177.03 2jfg h ARG 195 N 0.23 0.80 -0.97 1.82 2.43 -0.96 -2.42 114.38 115.31 2jfg h ARG 195 Ca 0.09 -0.05 0.06 0.00 -0.81 0.00 0.00 59.98 59.27 2jfg h ARG 195 Cb 0.02 -0.18 -0.06 0.00 -0.42 0.00 0.00 29.97 29.32 2jfg h ARG 195 CO -0.06 0.53 0.63 0.00 -1.51 0.00 0.00 179.97 179.56 2jfg h ALA 196 N 1.29 1.44 0.00 2.80 0.00 -0.83 0.70 119.26 124.65 2jfg h ALA 196 Ca 0.27 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.15 2jfg h ALA 196 Cb 0.01 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 17.51 2jfg h ALA 196 CO -0.10 0.42 0.00 0.00 0.00 0.00 0.00 179.25 179.57 2jfg n ALA 197 N -2.38 1.29 0.00 0.00 0.00 -0.91 -3.17 120.51 115.34 2jfg n ALA 197 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.59 2jfg n ALA 197 Cb 0.18 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.63 2jfg n ALA 197 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2jfg n LEU 199 N 0.67 0.00 0.27 0.00 4.77 0.24 -4.39 117.00 118.56 2jfg n LEU 199 Ca 0.00 0.00 0.18 0.00 -0.03 0.00 0.00 56.01 56.16 2jfg n LEU 199 Cb 0.02 0.00 0.94 0.00 -2.33 0.00 0.00 43.42 42.05 2jfg n LEU 199 CO 0.00 0.00 1.15 0.03 -1.33 0.00 0.00 177.39 177.24 2jfg h ARG 200 N 0.00 0.00 0.00 3.23 3.08 -1.83 -2.56 114.38 116.31 2jfg h ARG 200 Ca 0.00 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.02 2jfg h ARG 200 Cb 0.00 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.05 2jfg h ARG 200 CO 0.00 0.00 -0.13 0.97 -1.07 0.00 0.00 179.97 179.74 2jfg h ILE 201 N 0.00 0.73 0.00 2.04 2.10 -1.92 -2.37 117.51 118.09 2jfg h ILE 201 Ca 0.04 -0.54 0.00 0.00 1.08 0.00 0.00 64.86 65.44 2jfg h ILE 201 Cb 0.29 1.33 0.00 0.00 -1.09 0.00 0.00 36.82 37.34 2jfg h ILE 201 CO -0.00 0.13 -0.19 -1.22 -1.08 0.00 0.00 178.15 175.79 2jfg n TYR 202 N -3.84 0.62 -1.88 2.19 4.01 -0.96 -4.63 117.16 112.67 2jfg n TYR 202 Ca -0.02 0.18 -0.42 0.00 -0.16 0.00 0.00 57.90 57.48 2jfg n TYR 202 Cb 0.23 -0.75 -0.03 0.00 -0.31 0.00 0.00 39.34 38.48 2jfg n TYR 202 CO 0.00 0.00 0.00 -1.21 -0.46 0.00 0.00 176.86 175.19 2jfg s GLU 203 N -3.09 4.18 -1.57 -0.72 2.02 -0.89 -1.88 118.70 116.74 2jfg s GLU 203 Ca 0.10 2.37 0.00 0.00 0.02 0.00 0.00 54.97 57.46 2jfg s GLU 203 Cb 0.14 -3.80 0.00 0.00 0.10 0.00 0.00 34.13 30.57 2jfg s GLU 203 CO 0.62 -0.81 0.00 0.09 0.02 0.00 0.00 175.26 175.18 2jfg n ASN 204 N 6.34 -5.48 -4.75 -0.19 3.02 -1.26 -4.58 115.26 108.36 2jfg n ASN 204 Ca 0.17 0.37 -0.40 0.00 -0.03 0.00 0.00 54.58 54.68 2jfg n ASN 204 Cb 0.41 -4.28 -0.04 0.00 -0.61 0.00 0.00 39.78 35.26 2jfg n ASN 204 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2jfg s ALA 205 N -2.32 3.40 0.10 5.41 0.00 -0.79 -4.02 121.76 123.55 2jfg s ALA 205 Ca 0.00 0.86 -0.17 0.00 0.00 0.00 0.00 51.96 52.65 2jfg s ALA 205 Cb 0.00 -3.32 -0.06 0.00 0.00 0.00 0.00 23.12 19.74 2jfg s ALA 205 CO 0.00 -0.14 1.54 -0.22 0.00 0.00 0.00 175.76 176.94 2jfg h LYS 206 N 4.08 0.56 -4.75 0.00 3.64 -0.96 -3.44 116.57 115.71 2jfg h LYS 206 Ca -0.46 -0.18 -0.48 0.00 -1.27 0.00 0.00 60.65 58.26 2jfg h LYS 206 Cb 1.21 -0.05 -0.31 0.00 -0.41 0.00 0.00 32.23 32.67 2jfg h LYS 206 CO 0.68 0.70 -0.80 0.08 -2.27 0.00 0.00 179.45 177.84 2jfg s VAL 207 N -4.97 1.00 -0.16 2.00 1.01 -1.07 -4.80 120.40 113.41 2jfg s VAL 207 Ca -0.13 -0.46 -0.05 0.00 0.00 0.00 0.00 61.98 61.34 2jfg s VAL 207 Cb 0.09 -0.88 -0.03 0.00 0.00 0.00 0.00 36.38 35.55 2jfg s VAL 207 CO 0.77 0.30 -0.01 0.00 0.00 0.00 0.00 175.10 176.17 2jfg s VAL 209 N 0.29 4.01 0.25 0.00 1.01 0.31 -0.75 120.40 125.52 2jfg s VAL 209 Ca -0.01 -0.69 0.10 0.00 0.00 0.00 0.00 61.98 61.37 2jfg s VAL 209 Cb -0.13 -3.08 -0.04 0.00 0.00 0.00 0.00 36.38 33.13 2jfg s VAL 209 CO 0.02 0.06 -0.05 0.68 0.00 0.00 0.00 175.10 175.81 2jfg s VAL 210 N 1.50 3.26 -0.40 2.92 -7.23 0.25 -3.64 120.40 117.08 2jfg s VAL 210 Ca 0.03 -1.92 -0.20 0.00 -1.81 0.00 0.00 61.98 58.07 2jfg s VAL 210 Cb -0.17 -2.71 0.01 0.00 0.56 0.00 0.00 36.38 34.07 2jfg s VAL 210 CO 0.03 -0.32 0.63 0.21 -0.31 0.00 0.00 175.10 175.34 2jfg s ASN 211 N -3.45 6.36 0.60 4.85 3.84 -1.26 -0.81 114.94 125.07 2jfg s ASN 211 Ca 0.30 -0.13 0.35 0.00 0.21 0.00 0.00 52.86 53.59 2jfg s ASN 211 Cb -0.07 -2.32 1.95 0.00 -0.55 0.00 0.00 41.25 40.26 2jfg s ASN 211 CO 0.18 -0.68 2.24 0.00 -2.79 0.00 0.00 177.10 176.05 2jfg h ALA 212 N 8.68 1.22 -0.18 1.71 0.00 -0.81 -1.71 119.26 128.18 2jfg h ALA 212 Ca -0.26 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.63 2jfg h ALA 212 Cb 1.10 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.89 2jfg h ALA 212 CO 0.86 0.03 0.00 -0.25 0.00 0.00 0.00 179.25 179.89 2jfg n ASP 213 N -3.44 2.40 -3.49 0.00 8.00 -1.26 -4.73 116.55 114.03 2jfg n ASP 213 Ca -0.02 -1.81 -0.28 0.00 0.71 0.00 0.00 54.79 53.38 2jfg n ASP 213 Cb 0.13 -0.11 -0.13 0.00 -0.02 0.00 0.00 41.12 40.99 2jfg n ASP 213 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2jfg s ASP 214 N -1.70 3.14 0.57 -2.24 -1.08 -0.64 -5.01 116.67 109.71 2jfg s ASP 214 Ca 0.34 -1.75 0.27 0.00 -0.52 0.00 0.00 52.55 50.90 2jfg s ASP 214 Cb 0.20 -0.33 1.53 0.00 -1.46 0.00 0.00 42.92 42.87 2jfg s ASP 214 CO 0.30 -0.37 2.03 0.00 0.52 0.00 0.00 175.17 177.65 2jfg h ALA 215 N 7.65 2.07 0.00 3.66 0.00 -1.85 -0.95 119.26 129.84 2jfg h ALA 215 Ca -0.06 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.84 2jfg h ALA 215 Cb 0.99 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.81 2jfg h ALA 215 CO 0.34 -0.46 0.00 -0.07 0.00 0.00 0.00 179.25 179.06 2jfg h LEU 216 N 0.00 0.00 -0.03 0.00 3.38 -1.93 -2.42 115.31 114.32 2jfg h LEU 216 Ca 0.15 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.12 2jfg h LEU 216 Cb 0.74 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.49 2jfg h LEU 216 CO -0.00 0.00 -0.02 0.35 0.09 0.00 0.00 178.44 178.86 2jfg n THR 217 N -2.37 0.00 -3.28 0.22 -2.24 -0.36 -4.84 114.28 101.41 2jfg n THR 217 Ca 0.02 -0.01 -0.35 0.00 -2.27 0.00 0.00 64.05 61.45 2jfg n THR 217 Cb 0.25 -0.44 -0.06 0.00 -2.10 0.00 0.00 70.33 67.98 2jfg n THR 217 CO 0.00 0.00 0.00 -0.04 -0.57 0.00 0.00 175.07 174.46 2jfg s MET 218 N -2.62 4.02 0.67 -0.78 -1.94 -0.91 -4.71 119.30 113.03 2jfg s MET 218 Ca 0.27 0.57 -0.17 0.00 -1.71 0.00 0.00 55.69 54.65 2jfg s MET 218 Cb 0.20 -2.81 -0.03 0.00 2.01 0.00 0.00 34.83 34.19 2jfg s MET 218 CO 0.48 0.39 0.79 -2.30 -0.01 0.00 0.00 175.02 174.37 2jfg n PRO 219 N 0.50 0.56 0.04 2.03 -0.02 -1.26 -4.85 135.00 131.99 2jfg n PRO 219 Ca -0.03 0.24 -0.03 0.00 -2.02 0.00 0.00 63.50 61.66 2jfg n PRO 219 Cb 0.52 -2.03 0.21 0.00 -0.02 0.00 0.00 33.50 32.17 2jfg n PRO 219 CO 0.00 0.00 0.00 0.82 1.98 0.00 0.00 175.50 178.30 2jfg h ILE 220 N -0.01 1.27 0.00 4.25 2.04 -1.96 0.12 117.51 123.22 2jfg h ILE 220 Ca -0.47 -1.32 0.00 0.00 1.00 0.00 0.00 64.86 64.07 2jfg h ILE 220 Cb 1.36 1.43 0.00 0.00 -0.74 0.00 0.00 36.82 38.87 2jfg h ILE 220 CO 0.47 0.41 0.00 0.54 0.00 0.00 0.00 178.15 179.57 2jfg n ARG 221 N -4.10 0.53 0.00 2.37 1.74 -1.26 -4.98 116.66 110.96 2jfg n ARG 221 Ca -0.01 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.07 2jfg n ARG 221 Cb 0.42 -1.17 0.00 0.00 -1.02 0.00 0.00 32.46 30.69 2jfg n ARG 221 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2jfg n GLY 222 N 0.04 -1.26 3.77 -0.13 0.00 0.42 -4.87 105.19 103.16 2jfg n GLY 222 Ca 0.04 -1.59 -0.41 0.00 0.00 0.00 0.00 46.02 44.07 2jfg n GLY 222 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jfg s ALA 223 N -1.34 3.60 0.00 4.61 0.00 -1.26 -4.39 121.76 122.98 2jfg s ALA 223 Ca 0.00 1.50 0.00 0.00 0.00 0.00 0.00 51.96 53.46 2jfg s ALA 223 Cb 0.00 -3.59 0.00 0.00 0.00 0.00 0.00 23.12 19.53 2jfg s ALA 223 CO 0.00 -0.95 0.00 -0.40 0.00 0.00 0.00 175.76 174.41 2jfg n ASP 224 N 1.06 1.96 0.01 0.00 3.85 -1.26 -5.02 116.55 117.15 2jfg n ASP 224 Ca 0.03 -0.73 0.07 0.00 -0.71 0.00 0.00 54.79 53.44 2jfg n ASP 224 Cb 0.39 0.00 0.29 0.00 -1.35 0.00 0.00 41.12 40.45 2jfg n ASP 224 CO 0.00 0.00 0.00 -0.62 -1.01 0.00 0.00 177.20 175.57 2jfg n GLU 225 N -0.01 0.02 0.00 0.11 1.02 -1.26 -1.90 120.64 118.61 2jfg n GLU 225 Ca 0.00 0.30 0.13 0.00 -0.02 0.00 0.00 57.16 57.57 2jfg n GLU 225 Cb 0.00 -1.53 0.41 0.00 -0.02 0.00 0.00 31.44 30.30 2jfg n GLU 225 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 2jfg n ARG 226 N -1.56 0.48 -3.51 3.49 1.74 -1.26 -4.94 116.66 111.10 2jfg n ARG 226 Ca 0.03 -0.25 -0.42 0.00 -0.77 0.00 0.00 57.85 56.44 2jfg n ARG 226 Cb 0.15 -1.49 -0.06 0.00 -1.02 0.00 0.00 32.46 30.04 2jfg n ARG 226 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2jfg s VAL 228 N 0.34 4.54 0.10 0.00 1.01 0.07 -4.88 120.40 121.59 2jfg s VAL 228 Ca 0.15 1.72 0.08 0.00 0.00 0.00 0.00 61.98 63.92 2jfg s VAL 228 Cb -0.17 -4.15 -0.04 0.00 0.00 0.00 0.00 36.38 32.02 2jfg s VAL 228 CO -0.05 0.43 -0.13 -0.94 0.00 0.00 0.00 175.10 174.41 2jfg s SER 229 N -0.53 4.23 0.19 3.32 1.04 -1.26 -0.58 113.70 120.10 2jfg s SER 229 Ca 0.38 -0.43 0.09 0.00 0.48 0.00 0.00 55.95 56.47 2jfg s SER 229 Cb -0.22 -0.75 -0.04 0.00 0.10 0.00 0.00 66.02 65.11 2jfg s SER 229 CO 0.25 0.18 -0.18 0.72 0.98 0.00 0.00 173.24 175.19 2jfg s PHE 230 N -1.18 1.91 -0.01 5.02 -0.71 0.01 -1.18 117.98 121.85 2jfg s PHE 230 Ca 0.20 -0.46 -0.14 0.00 -1.04 0.00 0.00 56.93 55.49 2jfg s PHE 230 Cb -0.11 -0.93 0.05 0.00 -1.21 0.00 0.00 43.02 40.82 2jfg s PHE 230 CO 0.12 0.40 0.62 0.41 -1.34 0.00 0.00 175.22 175.43 2jfg n GLY 231 N 0.09 0.45 0.03 1.99 0.00 -0.23 -0.09 105.19 107.43 2jfg n GLY 231 Ca -0.11 -0.94 -0.01 0.00 0.00 0.00 0.00 46.02 44.96 2jfg n GLY 231 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2jfg h VAL 232 N 1.49 0.00 0.00 1.61 2.07 -1.93 -3.23 116.25 116.26 2jfg h VAL 232 Ca -0.10 -0.50 0.00 0.00 0.82 0.00 0.00 66.70 66.91 2jfg h VAL 232 Cb 0.57 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.34 2jfg h VAL 232 CO 0.15 0.00 -1.12 0.59 0.02 0.00 0.00 177.57 177.21 2jfg n ASN 233 N -3.42 0.87 -4.06 0.57 3.02 -1.26 -1.17 115.26 109.81 2jfg n ASN 233 Ca -0.01 -0.87 -0.10 0.00 -0.03 0.00 0.00 54.58 53.57 2jfg n ASN 233 Cb 0.05 1.13 -0.09 0.00 -0.61 0.00 0.00 39.78 40.26 2jfg n ASN 233 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2jfg s MET 234 N -3.06 1.03 0.00 3.52 0.23 -1.26 -4.95 119.30 114.81 2jfg s MET 234 Ca 0.06 -1.31 0.00 0.00 -1.03 0.00 0.00 55.69 53.41 2jfg s MET 234 Cb 0.16 0.31 0.00 0.00 -1.53 0.00 0.00 34.83 33.76 2jfg s MET 234 CO 0.87 -0.34 0.00 0.41 -2.03 0.00 0.00 175.02 173.94 2jfg n GLY 235 N -0.15 3.30 0.33 3.16 0.00 -1.26 -2.88 105.19 107.69 2jfg n GLY 235 Ca -0.06 -1.94 -0.02 0.00 0.00 0.00 0.00 46.02 44.00 2jfg n GLY 235 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2jfg h ASP 236 N 0.00 0.92 -3.46 1.61 3.32 -1.66 -3.38 116.42 113.77 2jfg h ASP 236 Ca 0.00 -0.01 -0.65 0.00 0.02 0.00 0.00 57.03 56.40 2jfg h ASP 236 Cb 0.00 -0.21 -0.24 0.00 0.22 0.00 0.00 39.33 39.10 2jfg h ASP 236 CO 0.00 0.63 -0.67 -0.31 -1.72 0.00 0.00 179.24 177.17 2jfg s TYR 237 N -6.10 3.03 0.36 4.55 1.51 -0.33 -0.41 117.35 119.96 2jfg s TYR 237 Ca -0.13 -0.55 -0.05 0.00 -1.01 0.00 0.00 57.07 55.34 2jfg s TYR 237 Cb 0.17 -2.11 0.01 0.00 -0.11 0.00 0.00 41.96 39.93 2jfg s TYR 237 CO 0.79 -0.32 0.55 -3.38 -1.11 0.00 0.00 175.55 172.08 2jfg s HIS 238 N 1.18 0.89 0.13 2.71 -3.43 -0.60 -1.06 115.29 115.11 2jfg s HIS 238 Ca 0.03 -1.21 0.04 0.00 -0.80 0.00 0.00 55.06 53.12 2jfg s HIS 238 Cb -0.14 0.11 -0.04 0.00 -1.43 0.00 0.00 32.58 31.08 2jfg s HIS 238 CO 0.01 -1.24 0.13 -0.51 -2.00 0.00 0.00 174.74 171.13 2jfg s LEU 239 N -3.21 3.86 -0.26 5.38 1.43 -0.32 -0.45 118.68 125.11 2jfg s LEU 239 Ca 0.27 -0.06 0.03 0.00 -1.03 0.00 0.00 54.13 53.35 2jfg s LEU 239 Cb -0.02 -2.49 0.06 0.00 0.03 0.00 0.00 46.19 43.77 2jfg s LEU 239 CO 0.19 0.11 -0.11 0.21 0.23 0.00 0.00 176.35 176.98 2jfg s ASN 240 N -2.85 4.36 -0.46 2.29 3.04 -0.46 -4.66 114.94 116.20 2jfg s ASN 240 Ca 0.31 -1.36 -0.09 0.00 0.04 0.00 0.00 52.86 51.76 2jfg s ASN 240 Cb -0.11 -1.52 0.11 0.00 -1.54 0.00 0.00 41.25 38.19 2jfg s ASN 240 CO 0.23 -0.19 0.32 -1.00 -3.04 0.00 0.00 177.10 173.42 2jfg s HIS 241 N 1.13 3.42 -0.08 0.43 3.76 -1.26 -1.56 115.29 121.13 2jfg s HIS 241 Ca -0.08 -1.84 -0.03 0.00 -0.15 0.00 0.00 55.06 52.95 2jfg s HIS 241 Cb -0.20 -3.37 0.04 0.00 1.11 0.00 0.00 32.58 30.17 2jfg s HIS 241 CO -0.05 -0.96 0.17 1.14 -0.85 0.00 0.00 174.74 174.19 2jfg s GLN 242 N 1.36 0.11 -1.21 1.40 -2.07 -0.76 -4.96 119.66 113.53 2jfg s GLN 242 Ca 0.05 0.45 -0.04 0.00 -1.82 0.00 0.00 55.36 53.99 2jfg s GLN 242 Cb -0.25 -0.17 0.00 0.00 -1.09 0.00 0.00 33.01 31.50 2jfg s GLN 242 CO -0.00 -0.19 1.03 0.00 -1.32 0.00 0.00 175.29 174.81 2jfg n GLN 243 N 4.39 -6.91 -1.05 9.60 10.64 -1.26 -2.13 117.38 130.67 2jfg n GLN 243 Ca -0.23 0.79 -0.02 0.00 -1.83 0.00 0.00 57.00 55.72 2jfg n GLN 243 Cb 0.52 -5.68 -0.01 0.00 -0.86 0.00 0.00 30.24 24.21 2jfg n GLN 243 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 2jfg n GLY 244 N -1.54 0.39 3.36 2.61 0.00 -1.26 -4.99 105.19 103.76 2jfg n GLY 244 Ca -0.13 -0.08 -0.30 0.00 0.00 0.00 0.00 46.02 45.51 2jfg n GLY 244 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2jfg s GLU 245 N -1.30 1.84 -0.04 1.61 2.12 -0.90 -5.13 118.70 116.89 2jfg s GLU 245 Ca 0.00 -1.09 0.04 0.00 0.36 0.00 0.00 54.97 54.27 2jfg s GLU 245 Cb 0.00 -2.00 -0.00 0.00 0.26 0.00 0.00 34.13 32.39 2jfg s GLU 245 CO 0.00 0.52 -0.16 0.99 -0.54 0.00 0.00 175.26 176.06 2jfg s THR 246 N -0.81 1.37 0.05 -1.70 2.01 -1.26 -1.83 115.64 113.47 2jfg s THR 246 Ca 0.12 -0.68 0.09 0.00 0.31 0.00 0.00 61.69 61.53 2jfg s THR 246 Cb -0.10 -1.18 -0.03 0.00 0.01 0.00 0.00 72.50 71.20 2jfg s THR 246 CO 0.02 0.40 -0.25 0.26 -0.69 0.00 0.00 174.62 174.36 2jfg s TRP 247 N 0.10 2.21 0.04 4.92 0.52 -0.60 -1.34 118.94 124.79 2jfg s TRP 247 Ca -0.05 -0.40 -0.28 0.00 0.02 0.00 0.00 56.10 55.39 2jfg s TRP 247 Cb -0.12 -1.32 -0.05 0.00 -1.15 0.00 0.00 33.47 30.84 2jfg s TRP 247 CO 0.02 0.13 0.90 -0.51 0.02 0.00 0.00 176.95 177.51 2jfg s LEU 248 N -1.26 4.43 0.10 2.99 1.43 0.32 -1.36 118.68 125.33 2jfg s LEU 248 Ca 0.11 1.62 0.06 0.00 -1.03 0.00 0.00 54.13 54.89 2jfg s LEU 248 Cb -0.10 -3.46 -0.03 0.00 0.03 0.00 0.00 46.19 42.63 2jfg s LEU 248 CO 0.02 -0.12 -0.16 -0.13 0.23 0.00 0.00 176.35 176.19 2jfg s ARG 249 N 0.42 0.98 -0.15 1.70 0.52 0.40 -0.96 118.95 121.85 2jfg s ARG 249 Ca 0.46 -1.10 -0.01 0.00 -0.52 0.00 0.00 55.73 54.56 2jfg s ARG 249 Cb -0.21 -1.03 0.04 0.00 0.52 0.00 0.00 34.95 34.26 2jfg s ARG 249 CO 0.27 0.23 -0.03 0.08 0.02 0.00 0.00 175.30 175.86 2jfg s VAL 250 N -1.47 0.88 -1.36 3.52 1.01 -0.07 -1.55 120.40 121.35 2jfg s VAL 250 Ca 0.04 -0.47 -0.05 0.00 0.00 0.00 0.00 61.98 61.50 2jfg s VAL 250 Cb -0.09 -1.10 0.00 0.00 0.00 0.00 0.00 36.38 35.19 2jfg s VAL 250 CO 0.03 0.10 0.46 0.29 0.00 0.00 0.00 175.10 175.99 2jfg n LYS 251 N 4.95 -2.76 -0.22 2.72 5.02 0.45 -1.66 118.16 126.66 2jfg n LYS 251 Ca -0.11 0.38 0.00 0.00 -2.02 0.00 0.00 58.31 56.57 2jfg n LYS 251 Cb 0.48 -4.34 0.00 0.00 -0.02 0.00 0.00 35.03 31.15 2jfg n LYS 251 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2jfg n GLY 252 N -1.97 2.31 3.70 0.72 0.00 -1.26 -5.01 105.19 103.67 2jfg n GLY 252 Ca -0.27 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.39 2jfg n GLY 252 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2jfg s GLU 253 N -0.09 4.15 0.22 1.61 2.12 -0.67 -5.07 118.70 120.97 2jfg s GLU 253 Ca 0.00 -0.18 -0.31 0.00 0.36 0.00 0.00 54.97 54.84 2jfg s GLU 253 Cb 0.00 -3.48 -0.10 0.00 0.26 0.00 0.00 34.13 30.81 2jfg s GLU 253 CO 0.00 0.17 1.50 0.15 -0.54 0.00 0.00 175.26 176.53 2jfg s LYS 254 N 0.73 4.24 0.00 4.30 1.02 -1.26 -0.89 119.74 127.88 2jfg s LYS 254 Ca 0.09 2.34 0.00 0.00 0.02 0.00 0.00 55.97 58.42 2jfg s LYS 254 Cb -0.12 -3.12 0.00 0.00 -0.52 0.00 0.00 37.83 34.06 2jfg s LYS 254 CO 0.02 -0.50 0.00 1.33 -0.92 0.00 0.00 175.35 175.28 2jfg n VAL 255 N 2.94 0.00 -3.64 3.17 0.24 -0.14 -4.92 118.33 115.99 2jfg n VAL 255 Ca 0.09 0.00 -0.06 0.00 -2.04 0.00 0.00 64.34 62.34 2jfg n VAL 255 Cb 0.39 -0.18 -0.06 0.00 -1.47 0.00 0.00 33.84 32.52 2jfg n VAL 255 CO 0.00 0.00 0.00 -0.22 -2.14 0.00 0.00 176.83 174.47 2jfg s LEU 256 N -3.23 -0.95 -0.26 1.34 2.96 -1.12 -4.99 118.68 112.42 2jfg s LEU 256 Ca 0.00 1.48 -0.27 0.00 -0.22 0.00 0.00 54.13 55.12 2jfg s LEU 256 Cb 0.00 2.34 0.01 0.00 0.50 0.00 0.00 46.19 49.03 2jfg s LEU 256 CO 0.00 -0.23 0.96 0.21 -1.32 0.00 0.00 176.35 175.97 2jfg s ASN 257 N 1.83 6.95 0.07 3.68 3.84 -1.26 -0.52 114.94 129.53 2jfg s ASN 257 Ca -0.09 1.15 0.09 0.00 0.21 0.00 0.00 52.86 54.22 2jfg s ASN 257 Cb -0.06 -2.50 0.42 0.00 -0.55 0.00 0.00 41.25 38.56 2jfg s ASN 257 CO -0.20 -0.65 1.28 1.33 -2.79 0.00 0.00 177.10 176.07 2jfg n VAL 258 N 5.41 1.50 0.29 -5.21 0.24 -0.45 -1.34 118.33 118.77 2jfg n VAL 258 Ca 0.09 0.44 0.17 0.00 -2.04 0.00 0.00 64.34 63.01 2jfg n VAL 258 Cb 0.47 -1.37 0.97 0.00 -1.47 0.00 0.00 33.84 32.44 2jfg n VAL 258 CO 0.00 0.00 0.00 0.07 -2.14 0.00 0.00 176.83 174.76 2jfg h LYS 259 N 0.00 0.00 0.00 7.34 2.10 -1.92 -0.76 116.57 123.33 2jfg h LYS 259 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 2jfg h LYS 259 Cb 0.10 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.43 2jfg h LYS 259 CO 0.00 0.00 0.00 0.93 -2.00 0.00 0.00 179.45 178.38 2jfg h GLU 260 N 0.00 0.00 -7.05 0.07 4.39 -1.62 -3.45 114.58 106.91 2jfg h GLU 260 Ca 0.01 0.00 -0.45 0.00 0.34 0.00 0.00 59.36 59.26 2jfg h GLU 260 Cb 0.10 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 28.74 2jfg h GLU 260 CO -0.00 0.00 0.36 -1.64 -1.16 0.00 0.00 179.01 176.57 2jfg s MET 261 N -3.26 4.11 0.11 2.33 -1.94 -0.29 -4.46 119.30 115.90 2jfg s MET 261 Ca 0.07 1.22 0.14 0.00 -1.71 0.00 0.00 55.69 55.41 2jfg s MET 261 Cb 0.08 -2.20 -0.11 0.00 2.01 0.00 0.00 34.83 34.61 2jfg s MET 261 CO 0.61 -0.14 1.05 0.87 -0.01 0.00 0.00 175.02 177.40 2jfg h LYS 262 N 1.89 0.00 -7.18 2.03 1.79 -1.76 -3.46 116.57 109.87 2jfg h LYS 262 Ca -0.49 0.00 -0.48 0.00 -2.18 0.00 0.00 60.65 57.50 2jfg h LYS 262 Cb 1.19 0.00 0.03 0.00 -1.58 0.00 0.00 32.23 31.88 2jfg h LYS 262 CO 0.61 0.52 0.38 -0.51 -1.08 0.00 0.00 179.45 179.37 2jfg s LEU 263 N -6.20 3.60 0.27 2.94 1.43 -1.26 -4.99 118.68 114.45 2jfg s LEU 263 Ca -0.01 1.69 0.02 0.00 -1.03 0.00 0.00 54.13 54.80 2jfg s LEU 263 Cb 0.08 -4.52 -0.04 0.00 0.03 0.00 0.00 46.19 41.75 2jfg s LEU 263 CO 0.80 -0.81 0.18 -0.94 0.23 0.00 0.00 176.35 175.81 2jfg s SER 264 N -2.88 0.98 0.00 2.29 1.04 -1.26 -4.98 113.70 108.89 2jfg s SER 264 Ca 0.61 -1.54 0.00 0.00 0.48 0.00 0.00 55.95 55.51 2jfg s SER 264 Cb -0.13 0.42 0.00 0.00 0.10 0.00 0.00 66.02 66.42 2jfg s SER 264 CO 0.32 -0.91 0.00 0.61 0.98 0.00 0.00 173.24 174.24 2jfg n GLY 265 N -0.46 0.55 0.30 7.32 0.00 -1.26 -4.45 105.19 107.20 2jfg n GLY 265 Ca 0.03 -1.43 0.06 0.00 0.00 0.00 0.00 46.02 44.67 2jfg n GLY 265 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 2jfg h GLN 266 N 0.00 0.64 0.00 1.61 4.15 -1.98 -0.40 115.11 119.13 2jfg h GLN 266 Ca 0.00 -0.04 -0.05 0.00 0.77 0.00 0.00 58.65 59.33 2jfg h GLN 266 Cb 0.00 -0.14 -0.01 0.00 0.21 0.00 0.00 27.48 27.54 2jfg h GLN 266 CO 0.00 0.42 -0.25 1.12 -1.93 0.00 0.00 178.83 178.19 2jfg h HIS 267 N 0.65 0.00 0.00 3.99 2.07 -1.96 -0.28 115.15 119.63 2jfg h HIS 267 Ca 0.44 0.00 -0.17 0.00 -2.85 0.00 0.00 60.37 57.79 2jfg h HIS 267 Cb 0.57 0.00 -0.02 0.00 2.57 0.00 0.00 27.41 30.52 2jfg h HIS 267 CO -0.09 0.25 -0.79 -0.91 -3.07 0.00 0.00 177.93 173.32 2jfg h ASN 268 N 0.00 0.00 -0.44 3.10 2.35 -1.32 -0.10 115.58 119.18 2jfg h ASN 268 Ca -0.00 0.00 -0.15 0.00 -0.55 0.00 0.00 56.30 55.60 2jfg h ASN 268 Cb 0.48 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.84 2jfg h ASN 268 CO 0.03 0.79 -0.29 1.88 -1.65 0.00 0.00 177.43 178.19 2jfg h TYR 269 N 0.00 1.14 -0.12 1.19 0.05 -0.52 -0.55 116.97 118.16 2jfg h TYR 269 Ca -0.01 -0.31 -0.12 0.00 0.05 0.00 0.00 58.73 58.35 2jfg h TYR 269 Cb 1.45 -0.25 -0.01 0.00 1.01 0.00 0.00 36.73 38.92 2jfg h TYR 269 CO 0.00 1.14 -0.44 1.79 -1.05 0.00 0.00 178.16 179.60 2jfg h THR 270 N 0.82 1.32 -0.77 -2.88 1.35 -1.07 -1.59 112.91 110.09 2jfg h THR 270 Ca 0.09 -1.61 0.07 0.00 -0.55 0.00 0.00 66.41 64.41 2jfg h THR 270 Cb 0.88 1.71 -0.06 0.00 -1.73 0.00 0.00 68.15 68.95 2jfg h THR 270 CO 0.08 0.48 0.45 0.78 -0.25 0.00 0.00 175.52 177.06 2jfg h ASN 271 N 0.24 0.67 -0.74 5.36 2.35 -0.81 -0.38 115.58 122.28 2jfg h ASN 271 Ca 0.02 0.03 -0.03 0.00 -0.55 0.00 0.00 56.30 55.77 2jfg h ASN 271 Cb 0.88 -0.10 -0.03 0.00 0.05 0.00 0.00 38.32 39.12 2jfg h ASN 271 CO 0.07 0.41 0.35 0.00 -1.65 0.00 0.00 177.43 176.62 2jfg h ALA 272 N 1.40 0.95 -0.38 -0.83 0.00 -0.70 -0.74 119.26 118.95 2jfg h ALA 272 Ca 0.35 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 55.11 2jfg h ALA 272 Cb 0.24 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 2jfg h ALA 272 CO -0.20 0.51 0.23 -0.07 0.00 0.00 0.00 179.25 179.73 2jfg h LEU 273 N 1.03 0.45 -0.47 0.00 3.38 -0.74 -0.39 115.31 118.57 2jfg h LEU 273 Ca 0.25 -0.04 -0.03 0.00 0.09 0.00 0.00 57.88 58.15 2jfg h LEU 273 Cb 0.12 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.73 2jfg h LEU 273 CO -0.03 0.36 0.19 0.00 0.09 0.00 0.00 178.44 179.05 2jfg h ALA 274 N 1.11 0.60 -0.34 1.53 0.00 -0.73 0.48 119.26 121.91 2jfg h ALA 274 Ca 0.14 -0.15 0.04 0.00 0.00 0.00 0.00 54.91 54.94 2jfg h ALA 274 Cb -0.01 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.56 2jfg h ALA 274 CO -0.03 0.21 0.13 0.00 0.00 0.00 0.00 179.25 179.56 2jfg h ALA 275 N 1.03 0.40 -0.61 0.00 0.00 -0.96 -0.44 119.26 118.69 2jfg h ALA 275 Ca 0.16 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.09 2jfg h ALA 275 Cb 0.19 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.95 2jfg h ALA 275 CO -0.01 -0.26 0.35 1.25 0.00 0.00 0.00 179.25 180.57 2jfg h LEU 276 N 0.28 0.75 -0.73 0.00 5.85 -0.72 0.04 115.31 120.79 2jfg h LEU 276 Ca 0.15 -0.08 0.03 0.00 0.84 0.00 0.00 57.88 58.82 2jfg h LEU 276 Cb 0.11 -0.19 -0.05 0.00 0.37 0.00 0.00 40.66 40.90 2jfg h LEU 276 CO -0.14 0.62 0.46 0.00 -0.34 0.00 0.00 178.44 179.04 2jfg h ALA 277 N 1.17 0.96 -0.41 1.25 0.00 -0.57 0.55 119.26 122.20 2jfg h ALA 277 Ca 0.22 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 55.04 2jfg h ALA 277 Cb 0.02 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 2jfg h ALA 277 CO -0.04 0.25 0.03 -0.07 0.00 0.00 0.00 179.25 179.42 2jfg h LEU 278 N 0.90 0.69 -0.55 0.00 3.38 -0.76 -1.83 115.31 117.15 2jfg h LEU 278 Ca 0.29 -0.29 -0.03 0.00 0.09 0.00 0.00 57.88 57.95 2jfg h LEU 278 Cb 0.02 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.56 2jfg h LEU 278 CO -0.11 0.81 0.24 0.00 0.09 0.00 0.00 178.44 179.47 2jfg h ALA 279 N 0.91 0.71 -0.44 1.53 0.00 -0.67 -0.64 119.26 120.65 2jfg h ALA 279 Ca 0.12 -0.14 0.01 0.00 0.00 0.00 0.00 54.91 54.90 2jfg h ALA 279 Cb 0.44 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.99 2jfg h ALA 279 CO 0.02 0.30 0.28 -0.44 0.00 0.00 0.00 179.25 179.40 2jfg h ASP 280 N 0.74 0.47 0.13 0.00 3.32 -0.86 -1.27 116.42 118.95 2jfg h ASP 280 Ca 0.19 -0.01 -0.06 0.00 0.02 0.00 0.00 57.03 57.17 2jfg h ASP 280 Cb 0.16 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 39.59 2jfg h ASP 280 CO -0.02 0.34 -0.22 0.00 -1.72 0.00 0.00 179.24 177.62 2jfg h ALA 281 N 1.18 1.45 -0.00 3.45 0.00 -1.00 -1.64 119.26 122.70 2jfg h ALA 281 Ca 0.17 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.83 2jfg h ALA 281 Cb -0.03 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.68 2jfg h ALA 281 CO -0.06 0.39 -0.01 0.00 0.00 0.00 0.00 179.25 179.57 2jfg n ALA 282 N -2.49 2.54 -0.75 0.00 0.00 -0.28 -4.88 120.51 114.65 2jfg n ALA 282 Ca -0.01 -0.16 0.00 0.00 0.00 0.00 0.00 53.44 53.27 2jfg n ALA 282 Cb 0.32 -1.48 0.00 0.00 0.00 0.00 0.00 19.45 18.29 2jfg n ALA 282 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2jfg n GLY 283 N 1.24 0.57 3.76 0.00 0.00 -0.62 -5.04 105.19 105.11 2jfg n GLY 283 Ca 0.16 -0.46 -0.39 0.00 0.00 0.00 0.00 46.02 45.32 2jfg n GLY 283 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2jfg s LEU 284 N 0.00 4.46 0.24 0.99 1.43 -0.54 -4.96 118.68 120.30 2jfg s LEU 284 Ca 0.00 2.22 -0.31 0.00 -1.03 0.00 0.00 54.13 55.01 2jfg s LEU 284 Cb 0.00 -3.75 -0.12 0.00 0.03 0.00 0.00 46.19 42.35 2jfg s LEU 284 CO 0.00 -0.22 1.64 -2.65 0.23 0.00 0.00 176.35 175.35 2jfg n PRO 285 N 0.90 2.65 -0.27 1.29 -0.02 -1.26 -4.55 135.00 133.74 2jfg n PRO 285 Ca 0.00 0.95 -0.02 0.00 -2.02 0.00 0.00 63.50 62.42 2jfg n PRO 285 Cb 0.46 -2.76 0.10 0.00 -0.02 0.00 0.00 33.50 31.29 2jfg n PRO 285 CO 0.00 0.00 0.00 -0.09 1.98 0.00 0.00 175.50 177.39 2jfg h ARG 286 N 5.76 0.85 -0.04 -0.52 9.65 -1.96 -2.46 114.38 125.66 2jfg h ARG 286 Ca -0.45 -0.05 0.01 0.00 -1.10 0.00 0.00 59.98 58.39 2jfg h ARG 286 Cb 1.22 -0.19 -0.01 0.00 -1.39 0.00 0.00 29.97 29.60 2jfg h ARG 286 CO 0.87 0.56 -0.03 0.00 2.80 0.00 0.00 179.97 184.17 2jfg h ALA 287 N 1.35 0.00 -0.06 2.80 0.00 -2.00 -1.02 119.26 120.33 2jfg h ALA 287 Ca 0.32 0.02 -0.09 0.00 0.00 0.00 0.00 54.91 55.16 2jfg h ALA 287 Cb 0.10 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 2jfg h ALA 287 CO -0.15 -0.51 -0.38 0.66 0.00 0.00 0.00 179.25 178.87 2jfg h SER 288 N -0.04 0.13 -0.53 0.00 4.64 -1.89 -2.35 113.55 113.51 2jfg h SER 288 Ca 0.03 -0.05 -0.05 0.00 -0.47 0.00 0.00 61.79 61.25 2jfg h SER 288 Cb 0.08 -0.04 -0.02 0.00 -0.31 0.00 0.00 62.40 62.11 2jfg h SER 288 CO -0.07 0.51 0.13 0.28 -0.87 0.00 0.00 176.83 176.82 2jfg h SER 289 N 0.11 0.80 -0.49 4.97 0.02 -1.01 -1.64 113.55 116.31 2jfg h SER 289 Ca 0.01 -0.23 -0.08 0.00 -0.84 0.00 0.00 61.79 60.65 2jfg h SER 289 Cb 0.73 -0.21 -0.02 0.00 0.14 0.00 0.00 62.40 63.04 2jfg h SER 289 CO 0.06 0.82 0.02 -0.07 -1.14 0.00 0.00 176.83 176.52 2jfg h LEU 290 N 0.74 0.88 -0.88 5.07 3.38 -1.05 -2.55 115.31 120.90 2jfg h LEU 290 Ca 0.17 -0.22 -0.00 0.00 0.09 0.00 0.00 57.88 57.91 2jfg h LEU 290 Cb 0.33 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 40.81 2jfg h LEU 290 CO 0.00 0.93 0.54 0.11 0.09 0.00 0.00 178.44 180.11 2jfg h LYS 291 N 0.85 1.19 -0.35 1.13 1.57 -1.20 -2.50 116.57 117.26 2jfg h LYS 291 Ca 0.16 -0.10 -0.03 0.00 -1.87 0.00 0.00 60.65 58.81 2jfg h LYS 291 Cb 0.47 -0.25 -0.02 0.00 0.08 0.00 0.00 32.23 32.51 2jfg h LYS 291 CO 0.02 0.82 0.07 0.00 -0.57 0.00 0.00 179.45 179.80 2jfg h ALA 292 N 1.30 1.47 0.00 3.86 0.00 -0.90 -1.05 119.26 123.93 2jfg h ALA 292 Ca 0.32 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 55.06 2jfg h ALA 292 Cb -0.07 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.57 2jfg h ALA 292 CO -0.06 0.39 -0.08 -0.07 0.00 0.00 0.00 179.25 179.43 2jfg h LEU 293 N 0.51 0.00 0.00 0.00 3.38 -1.12 -2.50 115.31 115.58 2jfg h LEU 293 Ca 0.12 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.09 2jfg h LEU 293 Cb 0.22 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.97 2jfg h LEU 293 CO -0.00 0.08 -1.12 0.35 0.09 0.00 0.00 178.44 177.83 2jfg n THR 294 N -3.71 0.38 0.02 0.22 -2.24 -0.43 -4.29 114.28 104.23 2jfg n THR 294 Ca -0.02 -0.43 0.03 0.00 -2.27 0.00 0.00 64.05 61.35 2jfg n THR 294 Cb 0.18 -0.12 -0.10 0.00 -2.10 0.00 0.00 70.33 68.19 2jfg n THR 294 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 2jfg n THR 295 N -2.37 0.88 -2.06 4.28 -2.24 -1.02 -4.41 114.28 107.34 2jfg n THR 295 Ca 0.00 -0.65 -0.42 0.00 -2.27 0.00 0.00 64.05 60.71 2jfg n THR 295 Cb 0.51 -0.48 -0.03 0.00 -2.10 0.00 0.00 70.33 68.23 2jfg n THR 295 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 2jfg s PHE 296 N -3.06 2.57 -1.20 4.78 5.36 -0.97 -4.92 117.98 120.54 2jfg s PHE 296 Ca -0.05 0.52 0.23 0.00 -0.96 0.00 0.00 56.93 56.67 2jfg s PHE 296 Cb 0.10 -3.84 0.07 0.00 -0.34 0.00 0.00 43.02 39.01 2jfg s PHE 296 CO 0.83 -3.27 1.11 0.25 -1.46 0.00 0.00 175.22 172.68 2jfg n THR 297 N 4.76 0.00 0.00 0.12 -2.24 -1.26 -4.24 114.28 111.42 2jfg n THR 297 Ca 0.15 -0.04 0.00 0.00 -2.27 0.00 0.00 64.05 61.88 2jfg n THR 297 Cb 0.42 0.79 0.00 0.00 -2.10 0.00 0.00 70.33 69.44 2jfg n THR 297 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2jfg n GLY 298 N 1.48 2.00 3.67 3.38 0.00 -1.26 -4.81 105.19 109.65 2jfg n GLY 298 Ca 0.06 -2.03 -0.30 0.00 0.00 0.00 0.00 46.02 43.74 2jfg n GLY 298 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2jfg s LEU 299 N 0.00 3.42 0.61 0.99 1.43 -1.26 -5.09 118.68 118.77 2jfg s LEU 299 Ca 0.00 -0.19 -0.20 0.00 -1.03 0.00 0.00 54.13 52.72 2jfg s LEU 299 Cb 0.00 -2.14 -0.03 0.00 0.03 0.00 0.00 46.19 44.05 2jfg s LEU 299 CO 0.00 0.18 1.31 -0.81 0.23 0.00 0.00 176.35 177.26 2jfg n PRO 300 N 0.64 1.35 -0.90 1.29 -0.04 -1.26 -2.50 135.00 133.58 2jfg n PRO 300 Ca -0.11 0.51 0.00 0.00 -0.04 0.00 0.00 63.50 63.86 2jfg n PRO 300 Cb 0.52 -2.54 0.00 0.00 -0.04 0.00 0.00 33.50 31.44 2jfg n PRO 300 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 2jfg n HIS 301 N -1.55 0.00 -3.78 0.54 8.25 -1.26 -4.95 115.22 112.47 2jfg n HIS 301 Ca 0.14 0.00 -0.36 0.00 -0.26 0.00 0.00 57.72 57.24 2jfg n HIS 301 Cb 0.47 -0.33 -0.11 0.00 1.12 0.00 0.00 29.99 31.14 2jfg n HIS 301 CO 0.00 0.00 0.00 1.03 0.64 0.00 0.00 176.34 178.01 2jfg s ARG 302 N -0.23 2.13 -1.42 -0.41 3.00 -1.04 -1.28 118.95 119.70 2jfg s ARG 302 Ca 0.00 -2.08 -0.13 0.00 0.00 0.00 0.00 55.73 53.53 2jfg s ARG 302 Cb 0.00 -3.59 0.02 0.00 0.00 0.00 0.00 34.95 31.38 2jfg s ARG 302 CO 0.00 -1.10 0.27 0.34 0.00 0.00 0.00 175.30 174.82 2jfg n PHE 303 N 4.16 -1.33 -3.33 -0.53 7.35 -1.19 -4.68 117.46 117.91 2jfg n PHE 303 Ca 0.02 0.42 -0.39 0.00 -0.76 0.00 0.00 57.45 56.74 2jfg n PHE 303 Cb 0.40 -2.86 -0.08 0.00 0.35 0.00 0.00 39.48 37.29 2jfg n PHE 303 CO 0.00 0.00 0.00 -2.00 -0.76 0.00 0.00 176.76 174.00 2jfg s GLU 304 N -7.35 4.07 -0.46 -4.13 2.12 -0.36 -4.88 118.70 107.71 2jfg s GLU 304 Ca 0.18 0.18 -0.29 0.00 0.36 0.00 0.00 54.97 55.40 2jfg s GLU 304 Cb -0.10 -3.63 0.01 0.00 0.26 0.00 0.00 34.13 30.68 2jfg s GLU 304 CO 0.98 -0.25 1.39 0.08 -0.54 0.00 0.00 175.26 176.93 2jfg s VAL 305 N 1.98 3.89 -0.26 3.70 1.01 -1.26 -0.02 120.40 129.44 2jfg s VAL 305 Ca 0.18 0.87 0.22 0.00 0.00 0.00 0.00 61.98 63.26 2jfg s VAL 305 Cb -0.15 -4.30 -0.13 0.00 0.00 0.00 0.00 36.38 31.79 2jfg s VAL 305 CO 0.09 -0.90 0.87 1.33 0.00 0.00 0.00 175.10 176.49 2jfg n VAL 306 N 7.01 0.33 -3.65 2.92 0.24 -0.37 -4.88 118.33 119.94 2jfg n VAL 306 Ca 0.15 -0.47 -0.05 0.00 -2.04 0.00 0.00 64.34 61.93 2jfg n VAL 306 Cb 0.48 -0.12 -0.06 0.00 -1.47 0.00 0.00 33.84 32.68 2jfg n VAL 306 CO 0.00 0.00 0.00 -0.22 -2.14 0.00 0.00 176.83 174.47 2jfg s LEU 307 N -4.79 -0.99 -0.26 1.34 2.96 -1.19 -4.95 118.68 110.80 2jfg s LEU 307 Ca -0.02 1.51 0.02 0.00 -0.22 0.00 0.00 54.13 55.42 2jfg s LEU 307 Cb 0.12 2.30 0.07 0.00 0.50 0.00 0.00 46.19 49.18 2jfg s LEU 307 CO 0.83 -0.23 -0.04 -0.70 -1.32 0.00 0.00 176.35 174.89 2jfg s GLU 308 N 2.12 1.70 -0.20 1.98 2.12 -1.26 -0.33 118.70 124.83 2jfg s GLU 308 Ca -0.08 -1.23 -0.19 0.00 0.36 0.00 0.00 54.97 53.83 2jfg s GLU 308 Cb -0.08 -2.72 0.05 0.00 0.26 0.00 0.00 34.13 31.64 2jfg s GLU 308 CO -0.19 -0.67 0.55 -1.58 -0.54 0.00 0.00 175.26 172.83 2jfg s HIS 309 N 1.26 -0.60 -1.32 5.30 2.46 -0.65 -4.91 115.29 116.83 2jfg s HIS 309 Ca -0.03 1.43 -0.04 0.00 0.47 0.00 0.00 55.06 56.89 2jfg s HIS 309 Cb -0.19 0.21 0.02 0.00 -0.13 0.00 0.00 32.58 32.49 2jfg s HIS 309 CO -0.07 -0.30 0.29 0.09 -2.47 0.00 0.00 174.74 172.27 2jfg n ASN 310 N 2.68 -4.55 0.00 9.88 3.02 -1.26 -1.56 115.26 123.47 2jfg n ASN 310 Ca -0.14 -0.12 0.00 0.00 -0.03 0.00 0.00 54.58 54.29 2jfg n ASN 310 Cb 0.56 -3.77 0.00 0.00 -0.61 0.00 0.00 39.78 35.96 2jfg n ASN 310 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2jfg n GLY 311 N -1.10 0.68 3.24 7.41 0.00 -1.26 -4.41 105.19 109.74 2jfg n GLY 311 Ca -0.11 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.59 2jfg n GLY 311 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2jfg s VAL 312 N -2.46 2.13 -0.21 1.61 1.01 -0.60 0.10 120.40 121.98 2jfg s VAL 312 Ca 0.00 -1.00 -0.14 0.00 0.00 0.00 0.00 61.98 60.84 2jfg s VAL 312 Cb 0.00 -1.81 -0.04 0.00 0.00 0.00 0.00 36.38 34.53 2jfg s VAL 312 CO 0.00 0.56 0.31 -0.13 0.00 0.00 0.00 175.10 175.84 2jfg s ARG 313 N 0.27 4.15 -0.27 2.72 0.52 -1.14 -1.64 118.95 123.55 2jfg s ARG 313 Ca -0.16 0.03 -0.08 0.00 -0.52 0.00 0.00 55.73 55.00 2jfg s ARG 313 Cb -0.17 -3.53 -0.02 0.00 0.52 0.00 0.00 34.95 31.75 2jfg s ARG 313 CO 0.08 0.03 0.10 -1.58 0.02 0.00 0.00 175.30 173.94 2jfg s TRP 314 N 1.13 3.12 -0.19 -0.53 0.52 0.55 -0.81 118.94 122.74 2jfg s TRP 314 Ca 0.15 -0.50 -0.00 0.00 0.02 0.00 0.00 56.10 55.77 2jfg s TRP 314 Cb -0.14 -2.28 0.01 0.00 -1.15 0.00 0.00 33.47 29.91 2jfg s TRP 314 CO 0.06 -0.40 -0.17 0.42 0.02 0.00 0.00 176.95 176.89 2jfg s ILE 315 N 1.61 2.35 -0.62 2.03 1.01 0.67 -1.23 121.20 127.01 2jfg s ILE 315 Ca 0.05 -0.84 -0.20 0.00 0.00 0.00 0.00 60.65 59.66 2jfg s ILE 315 Cb -0.16 -2.01 0.09 0.00 0.01 0.00 0.00 42.46 40.39 2jfg s ILE 315 CO 0.05 0.51 0.82 0.21 0.00 0.00 0.00 174.94 176.53 2jfg s ASN 316 N 1.31 6.18 -0.49 3.58 2.47 0.97 -1.25 114.94 127.71 2jfg s ASN 316 Ca 0.05 -1.25 0.04 0.00 0.42 0.00 0.00 52.86 52.12 2jfg s ASN 316 Cb -0.13 -2.35 0.42 0.00 -1.45 0.00 0.00 41.25 37.74 2jfg s ASN 316 CO -0.10 -1.26 1.41 -0.67 -3.72 0.00 0.00 177.10 172.75 2jfg n ASP 317 N 6.94 5.64 0.24 -4.21 2.03 0.87 -1.23 116.55 126.82 2jfg n ASP 317 Ca -0.07 -3.76 0.16 0.00 0.52 0.00 0.00 54.79 51.64 2jfg n ASP 317 Cb 0.44 -0.59 0.85 0.00 -0.72 0.00 0.00 41.12 41.10 2jfg n ASP 317 CO 0.00 0.00 0.00 -1.28 -1.92 0.00 0.00 177.20 174.00 2jfg h SER 318 N 2.45 0.00 0.16 1.67 0.87 -1.49 -0.49 113.55 116.72 2jfg h SER 318 Ca 0.41 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.97 2jfg h SER 318 Cb 0.95 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.91 2jfg h SER 318 CO 1.02 0.00 0.00 1.17 -0.53 0.00 0.00 176.83 178.49 2jfg n LYS 319 N -3.85 0.54 -2.55 2.24 3.00 -0.40 -4.39 118.16 112.75 2jfg n LYS 319 Ca -0.00 0.03 -0.41 0.00 -0.00 0.00 0.00 58.31 57.93 2jfg n LYS 319 Cb 0.23 -1.50 -0.02 0.00 0.00 0.00 0.00 35.03 33.74 2jfg n LYS 319 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2jfg s ALA 320 N -2.23 2.89 -1.58 3.14 0.00 -0.19 -4.72 121.76 119.06 2jfg s ALA 320 Ca 0.28 -2.47 0.18 0.00 0.00 0.00 0.00 51.96 49.95 2jfg s ALA 320 Cb 0.15 -4.57 0.48 0.00 0.00 0.00 0.00 23.12 19.17 2jfg s ALA 320 CO 0.29 -3.55 1.39 0.25 0.00 0.00 0.00 175.76 174.14 2jfg n THR 321 N 6.75 0.93 -4.06 0.00 -2.24 -1.26 -0.86 114.28 113.54 2jfg n THR 321 Ca 0.39 -0.96 -0.12 0.00 -2.27 0.00 0.00 64.05 61.09 2jfg n THR 321 Cb 0.49 0.56 -0.05 0.00 -2.10 0.00 0.00 70.33 69.23 2jfg n THR 321 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2jfg s ASN 322 N -1.04 0.37 0.21 3.42 2.20 -1.24 -3.58 114.94 115.28 2jfg s ASN 322 Ca 0.37 -1.23 -0.09 0.00 -0.94 0.00 0.00 52.86 50.97 2jfg s ASN 322 Cb 0.19 0.60 0.15 0.00 -2.00 0.00 0.00 41.25 40.19 2jfg s ASN 322 CO 0.26 -1.18 1.80 0.58 -2.94 0.00 0.00 177.10 175.61 2jfg h VAL 323 N 2.24 1.24 -1.00 3.54 2.07 -1.79 -2.81 116.25 119.74 2jfg h VAL 323 Ca -0.28 -0.69 0.04 0.00 0.82 0.00 0.00 66.70 66.59 2jfg h VAL 323 Cb 1.25 0.28 -0.06 0.00 -1.52 0.00 0.00 31.29 31.24 2jfg h VAL 323 CO 0.39 0.29 0.65 1.23 0.02 0.00 0.00 177.57 180.16 2jfg h GLY 324 N 1.08 1.48 1.35 2.17 0.00 -1.94 0.97 103.07 108.17 2jfg h GLY 324 Ca 0.26 -0.49 -0.24 0.00 0.00 0.00 0.00 47.33 46.86 2jfg h GLY 324 CO -0.03 0.41 -0.93 1.48 0.00 0.00 0.00 176.54 177.46 2jfg h SER 325 N 1.24 0.76 -0.67 0.19 4.64 -1.86 -1.39 113.55 116.46 2jfg h SER 325 Ca 0.41 -0.58 -0.07 0.00 -0.47 0.00 0.00 61.79 61.08 2jfg h SER 325 Cb 0.04 -0.23 -0.03 0.00 -0.31 0.00 0.00 62.40 61.87 2jfg h SER 325 CO -0.14 1.37 0.14 0.74 -0.87 0.00 0.00 176.83 178.07 2jfg h THR 326 N 0.36 1.26 -0.73 2.95 2.02 -1.26 -2.14 112.91 115.38 2jfg h THR 326 Ca -0.09 -1.00 0.09 0.00 0.77 0.00 0.00 66.41 66.18 2jfg h THR 326 Cb 1.57 0.61 -0.07 0.00 -1.74 0.00 0.00 68.15 68.52 2jfg h THR 326 CO 0.18 0.38 0.37 -0.08 0.37 0.00 0.00 175.52 176.74 2jfg h GLU 327 N 1.02 0.62 -0.21 6.66 4.81 -0.72 -1.13 114.58 125.62 2jfg h GLU 327 Ca 0.21 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 59.39 2jfg h GLU 327 Cb 0.40 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 29.63 2jfg h GLU 327 CO 0.01 0.41 0.08 0.00 -0.73 0.00 0.00 179.01 178.78 2jfg h ALA 328 N 1.43 1.75 -0.26 2.92 0.00 -0.64 0.15 119.26 124.61 2jfg h ALA 328 Ca 0.36 -0.06 -0.18 0.00 0.00 0.00 0.00 54.91 55.02 2jfg h ALA 328 Cb 0.36 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.06 2jfg h ALA 328 CO -0.26 0.20 -0.56 0.00 0.00 0.00 0.00 179.25 178.63 2jfg h ALA 329 N 1.80 0.50 0.04 0.00 0.00 -0.65 -3.36 119.26 117.59 2jfg h ALA 329 Ca 0.07 -0.52 -0.27 0.00 0.00 0.00 0.00 54.91 54.19 2jfg h ALA 329 Cb 0.06 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 2jfg h ALA 329 CO -0.01 0.68 -1.46 -0.07 0.00 0.00 0.00 179.25 178.40 2jfg h LEU 330 N 0.62 0.12 -8.95 0.00 3.38 -0.65 -3.40 115.31 106.43 2jfg h LEU 330 Ca 0.01 -0.18 -0.57 0.00 0.09 0.00 0.00 57.88 57.23 2jfg h LEU 330 Cb 1.16 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 41.85 2jfg h LEU 330 CO 0.12 1.15 1.25 0.21 0.09 0.00 0.00 178.44 181.26 2jfg s ASN 331 N -6.54 6.02 -0.34 -0.43 2.47 0.48 -1.81 114.94 114.79 2jfg s ASN 331 Ca -0.05 1.51 0.00 0.00 0.42 0.00 0.00 52.86 54.74 2jfg s ASN 331 Cb 0.08 -2.53 0.00 0.00 -1.45 0.00 0.00 41.25 37.36 2jfg s ASN 331 CO 0.83 -1.57 0.00 0.61 -3.72 0.00 0.00 177.10 173.25 2jfg n GLY 332 N 5.20 0.63 3.72 1.21 0.00 -1.26 -4.98 105.19 109.71 2jfg n GLY 332 Ca 0.22 -0.67 -0.42 0.00 0.00 0.00 0.00 46.02 45.16 2jfg n GLY 332 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2jfg s LEU 333 N -0.72 4.38 -0.26 0.99 2.96 -0.75 -5.00 118.68 120.28 2jfg s LEU 333 Ca 0.00 2.30 -0.11 0.00 -0.22 0.00 0.00 54.13 56.10 2jfg s LEU 333 Cb 0.00 -3.59 -0.05 0.00 0.50 0.00 0.00 46.19 43.05 2jfg s LEU 333 CO 0.00 -0.61 0.17 -2.28 -1.32 0.00 0.00 176.35 172.31 2jfg s HIS 334 N 0.92 3.26 -0.06 5.38 5.65 -1.26 -5.06 115.29 124.12 2jfg s HIS 334 Ca 0.62 0.15 0.00 0.00 0.25 0.00 0.00 55.06 56.09 2jfg s HIS 334 Cb -0.36 -2.32 0.02 0.00 -1.18 0.00 0.00 32.58 28.74 2jfg s HIS 334 CO 0.31 -0.06 -0.03 0.08 -0.65 0.00 0.00 174.74 174.39 2jfg s VAL 335 N 1.42 0.55 0.15 0.89 1.01 -1.26 -5.05 120.40 118.11 2jfg s VAL 335 Ca 0.07 -0.07 -0.10 0.00 0.00 0.00 0.00 61.98 61.88 2jfg s VAL 335 Cb -0.15 -0.62 -0.02 0.00 0.00 0.00 0.00 36.38 35.60 2jfg s VAL 335 CO 0.08 0.26 1.52 0.44 0.00 0.00 0.00 175.10 177.39 2jfg h ASP 336 N 7.67 1.02 0.00 3.32 3.32 -1.92 -3.45 116.42 126.38 2jfg h ASP 336 Ca -0.31 -0.42 0.00 0.00 0.02 0.00 0.00 57.03 56.32 2jfg h ASP 336 Cb 1.14 -0.28 0.00 0.00 0.22 0.00 0.00 39.33 40.41 2jfg h ASP 336 CO 0.39 1.23 0.00 0.61 -1.72 0.00 0.00 179.24 179.75 2jfg n GLY 337 N -0.01 0.95 3.80 2.75 0.00 -0.22 -4.98 105.19 107.48 2jfg n GLY 337 Ca -0.01 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.65 2jfg n GLY 337 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2jfg s THR 338 N 3.15 5.20 -0.23 2.61 2.01 -1.26 -4.86 115.64 122.25 2jfg s THR 338 Ca 0.00 0.10 -0.21 0.00 0.31 0.00 0.00 61.69 61.89 2jfg s THR 338 Cb 0.00 -3.27 -0.02 0.00 0.01 0.00 0.00 72.50 69.22 2jfg s THR 338 CO 0.00 0.58 0.64 -0.22 -0.69 0.00 0.00 174.62 174.93 2jfg s LEU 339 N -0.67 4.09 -0.44 4.42 2.96 0.15 -1.52 118.68 127.67 2jfg s LEU 339 Ca 0.12 0.77 -0.14 0.00 -0.22 0.00 0.00 54.13 54.67 2jfg s LEU 339 Cb -0.12 -2.88 0.06 0.00 0.50 0.00 0.00 46.19 43.75 2jfg s LEU 339 CO 0.02 -0.35 0.33 -1.00 -1.32 0.00 0.00 176.35 174.04 2jfg s HIS 340 N 2.33 3.26 -0.21 5.38 3.76 0.34 -0.77 115.29 129.39 2jfg s HIS 340 Ca 0.27 -1.02 -0.06 0.00 -0.15 0.00 0.00 55.06 54.10 2jfg s HIS 340 Cb -0.16 -2.98 -0.03 0.00 1.11 0.00 0.00 32.58 30.53 2jfg s HIS 340 CO 0.09 -0.77 0.02 -1.17 -0.85 0.00 0.00 174.74 172.06 2jfg s LEU 341 N 1.59 3.35 -0.26 0.89 2.96 0.16 -0.77 118.68 126.60 2jfg s LEU 341 Ca 0.04 -0.17 -0.13 0.00 -0.22 0.00 0.00 54.13 53.64 2jfg s LEU 341 Cb -0.23 -1.86 -0.04 0.00 0.50 0.00 0.00 46.19 44.56 2jfg s LEU 341 CO 0.06 0.06 0.30 -0.76 -1.32 0.00 0.00 176.35 174.68 2jfg s LEU 342 N 1.04 4.05 0.04 -0.68 1.43 -0.15 -1.15 118.68 123.26 2jfg s LEU 342 Ca 0.03 0.20 0.06 0.00 -1.03 0.00 0.00 54.13 53.39 2jfg s LEU 342 Cb -0.14 -2.30 -0.02 0.00 0.03 0.00 0.00 46.19 43.75 2jfg s LEU 342 CO 0.02 -0.10 -0.17 -0.76 0.23 0.00 0.00 176.35 175.56 2jfg s LEU 343 N 1.78 2.17 0.00 1.79 1.43 -0.77 -2.83 118.68 122.25 2jfg s LEU 343 Ca 0.12 -0.49 0.00 0.00 -1.03 0.00 0.00 54.13 52.73 2jfg s LEU 343 Cb -0.15 -0.78 0.00 0.00 0.03 0.00 0.00 46.19 45.29 2jfg s LEU 343 CO 0.09 0.09 0.00 0.61 0.23 0.00 0.00 176.35 177.38 2jfg n GLY 344 N 1.86 1.83 0.00 -3.19 0.00 -0.83 -1.06 105.19 103.80 2jfg n GLY 344 Ca -0.18 -1.86 0.00 0.00 0.00 0.00 0.00 46.02 43.99 2jfg n GLY 344 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jfg n GLY 345 N -1.98 0.21 3.51 -0.02 0.00 -0.74 -4.50 105.19 101.66 2jfg n GLY 345 Ca 0.00 -1.98 -0.43 0.00 0.00 0.00 0.00 46.02 43.62 2jfg n GLY 345 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2jfg s ASP 346 N -4.00 6.29 0.00 1.61 2.15 -0.35 -1.24 116.67 121.13 2jfg s ASP 346 Ca 0.00 -0.50 0.22 0.00 0.43 0.00 0.00 52.55 52.70 2jfg s ASP 346 Cb 0.00 -2.44 0.95 0.00 -0.30 0.00 0.00 42.92 41.12 2jfg s ASP 346 CO 0.00 -1.33 1.70 0.61 -0.17 0.00 0.00 175.17 175.98 2jfg n GLY 347 N 5.19 -1.24 2.76 2.66 0.00 -1.26 -0.87 105.19 112.42 2jfg n GLY 347 Ca 0.01 -0.08 -0.20 0.00 0.00 0.00 0.00 46.02 45.75 2jfg n GLY 347 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2jfg n LYS 348 N -1.49 -3.11 -1.39 1.61 5.02 -1.26 -1.19 118.16 116.35 2jfg n LYS 348 Ca 0.06 0.79 -0.12 0.00 -2.02 0.00 0.00 58.31 57.02 2jfg n LYS 348 Cb 0.25 -5.51 -0.05 0.00 -0.02 0.00 0.00 35.03 29.70 2jfg n LYS 348 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 2jfg n SER 349 N -2.17 -4.42 -4.77 4.39 7.64 -1.26 -2.33 113.62 110.71 2jfg n SER 349 Ca -0.14 0.28 -0.36 0.00 1.01 0.00 0.00 58.87 59.66 2jfg n SER 349 Cb 0.63 -3.01 0.01 0.00 -1.01 0.00 0.00 64.21 60.83 2jfg n SER 349 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2jfg s ALA 350 N -2.45 2.72 -0.37 -0.43 0.00 -0.33 -4.88 121.76 116.01 2jfg s ALA 350 Ca 0.00 0.90 -0.24 0.00 0.00 0.00 0.00 51.96 52.62 2jfg s ALA 350 Cb 0.00 -3.39 0.01 0.00 0.00 0.00 0.00 23.12 19.74 2jfg s ALA 350 CO 0.00 -0.85 0.81 0.34 0.00 0.00 0.00 175.76 176.06 2jfg s ASP 351 N -1.63 6.56 0.00 0.00 2.15 -1.26 -4.94 116.67 117.55 2jfg s ASP 351 Ca 0.72 0.35 0.28 0.00 0.43 0.00 0.00 52.55 54.33 2jfg s ASP 351 Cb -0.27 -2.41 1.15 0.00 -0.30 0.00 0.00 42.92 41.10 2jfg s ASP 351 CO 0.30 -0.77 1.83 0.49 -0.17 0.00 0.00 175.17 176.85 2jfg n PHE 352 N 6.52 0.00 -0.00 -5.34 3.72 -1.26 -4.40 117.46 116.70 2jfg n PHE 352 Ca 0.04 0.00 0.11 0.00 -0.05 0.00 0.00 57.45 57.54 2jfg n PHE 352 Cb 0.48 -0.28 0.53 0.00 -0.94 0.00 0.00 39.48 39.27 2jfg n PHE 352 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 2jfg h SER 353 N 0.27 0.28 0.00 4.37 4.64 -1.97 -1.22 113.55 119.93 2jfg h SER 353 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2jfg h SER 353 Cb 0.41 -0.06 0.00 0.00 -0.31 0.00 0.00 62.40 62.44 2jfg h SER 353 CO 0.00 0.18 0.13 -0.65 -0.87 0.00 0.00 176.83 175.62 2jfg h PRO 354 N 0.32 0.00 0.00 4.77 0.11 -2.01 -1.12 132.00 134.07 2jfg h PRO 354 Ca 0.20 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 66.29 2jfg h PRO 354 Cb 0.39 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.50 2jfg h PRO 354 CO -0.05 0.00 -0.11 -0.07 -0.21 0.00 0.00 178.00 177.57 2jfg h LEU 355 N 0.00 0.00 -1.48 2.35 3.38 -1.56 -3.35 115.31 114.64 2jfg h LEU 355 Ca 0.00 0.00 0.06 0.00 0.09 0.00 0.00 57.88 58.03 2jfg h LEU 355 Cb 0.25 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.97 2jfg h LEU 355 CO 0.00 0.11 0.41 0.00 0.09 0.00 0.00 178.44 179.05 2jfg h ALA 356 N 1.89 1.77 0.00 1.53 0.00 -1.37 -1.86 119.26 121.22 2jfg h ALA 356 Ca -0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2jfg h ALA 356 Cb 1.01 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.64 2jfg h ALA 356 CO 0.01 0.14 0.00 0.07 0.00 0.00 0.00 179.25 179.47 2jfg h ARG 357 N 0.64 0.00 -0.02 0.00 0.11 -1.77 -2.03 114.38 111.32 2jfg h ARG 357 Ca 0.27 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.35 2jfg h ARG 357 Cb 0.24 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.32 2jfg h ARG 357 CO -0.08 0.00 -0.27 0.66 0.10 0.00 0.00 179.97 180.38 2jfg n TYR 358 N -2.45 0.00 -0.58 4.08 4.01 -0.70 -4.46 117.16 117.06 2jfg n TYR 358 Ca 0.00 0.00 0.07 0.00 -0.16 0.00 0.00 57.90 57.81 2jfg n TYR 358 Cb 0.18 -0.03 0.20 0.00 -0.31 0.00 0.00 39.34 39.38 2jfg n TYR 358 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 2jfg n LEU 359 N 0.08 3.39 -4.88 7.72 4.77 -0.76 -4.99 117.00 122.32 2jfg n LEU 359 Ca 0.12 -2.50 -0.30 0.00 -0.03 0.00 0.00 56.01 53.30 2jfg n LEU 359 Cb 0.45 -0.38 0.05 0.00 -2.33 0.00 0.00 43.42 41.21 2jfg n LEU 359 CO 0.24 0.70 0.75 0.20 -1.33 0.00 0.00 177.39 177.95 2jfg s ASN 360 N -1.46 5.30 0.00 -1.43 0.01 -1.26 -4.89 114.94 111.21 2jfg s ASN 360 Ca 0.32 1.11 0.00 0.00 -0.71 0.00 0.00 52.86 53.58 2jfg s ASN 360 Cb 0.23 -1.87 0.00 0.00 0.41 0.00 0.00 41.25 40.02 2jfg s ASN 360 CO 0.12 -1.43 0.00 0.61 -1.51 0.00 0.00 177.10 174.89 2jfg n GLY 361 N -2.98 0.57 0.56 0.66 0.00 -1.26 -4.70 105.19 98.03 2jfg n GLY 361 Ca 0.07 -2.04 0.14 0.00 0.00 0.00 0.00 46.02 44.19 2jfg n GLY 361 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2jfg n ASP 362 N -0.11 1.75 -0.98 1.61 8.00 -1.26 -4.36 116.55 121.20 2jfg n ASP 362 Ca 0.00 -1.57 -0.02 0.00 0.71 0.00 0.00 54.79 53.91 2jfg n ASP 362 Cb 0.00 0.01 0.18 0.00 -0.02 0.00 0.00 41.12 41.28 2jfg n ASP 362 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 2jfg n ASN 363 N 0.36 2.48 -3.93 -2.24 3.02 -1.26 -4.98 115.26 108.71 2jfg n ASN 363 Ca 0.18 -3.86 -0.21 0.00 -0.03 0.00 0.00 54.58 50.66 2jfg n ASN 363 Cb 0.40 -0.53 -0.16 0.00 -0.61 0.00 0.00 39.78 38.87 2jfg n ASN 363 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2jfg s VAL 364 N -3.48 0.66 -0.03 2.41 1.01 -1.26 -0.67 120.40 119.04 2jfg s VAL 364 Ca 0.42 -0.21 0.03 0.00 0.00 0.00 0.00 61.98 62.21 2jfg s VAL 364 Cb 0.39 -0.65 0.00 0.00 0.00 0.00 0.00 36.38 36.12 2jfg s VAL 364 CO -0.04 0.25 -0.11 -0.13 0.00 0.00 0.00 175.10 175.07 2jfg s ARG 365 N 0.75 1.11 -0.09 2.72 1.81 0.05 -4.89 118.95 120.41 2jfg s ARG 365 Ca -0.11 -0.37 -0.01 0.00 -1.72 0.00 0.00 55.73 53.52 2jfg s ARG 365 Cb -0.14 -1.02 -0.03 0.00 -0.45 0.00 0.00 34.95 33.31 2jfg s ARG 365 CO 0.01 0.15 -0.04 -0.51 -0.68 0.00 0.00 175.30 174.22 2jfg s LEU 366 N 0.14 3.32 -0.28 2.53 1.43 -0.37 -0.67 118.68 124.78 2jfg s LEU 366 Ca -0.03 0.02 -0.00 0.00 -1.03 0.00 0.00 54.13 53.08 2jfg s LEU 366 Cb -0.09 -1.75 0.08 0.00 0.03 0.00 0.00 46.19 44.47 2jfg s LEU 366 CO 0.01 0.33 0.05 -0.31 0.23 0.00 0.00 176.35 176.66 2jfg s TYR 367 N -0.63 1.93 -0.11 0.29 1.51 -0.30 -1.08 117.35 118.95 2jfg s TYR 367 Ca 0.10 -1.70 -0.01 0.00 -1.01 0.00 0.00 57.07 54.44 2jfg s TYR 367 Cb -0.12 -1.68 -0.03 0.00 -0.11 0.00 0.00 41.96 40.02 2jfg s TYR 367 CO 0.02 -0.81 -0.05 0.00 -1.11 0.00 0.00 175.55 173.59 2jfg s PHE 369 N -0.32 1.21 0.00 0.00 -0.71 -0.23 -0.97 117.98 116.96 2jfg s PHE 369 Ca 0.05 -1.36 0.00 0.00 -1.04 0.00 0.00 56.93 54.58 2jfg s PHE 369 Cb -0.12 -0.26 0.00 0.00 -1.21 0.00 0.00 43.02 41.42 2jfg s PHE 369 CO 0.02 -1.03 0.00 0.41 -1.34 0.00 0.00 175.22 173.29 2jfg n GLY 370 N -0.55 -1.64 0.19 1.99 0.00 -0.00 -1.79 105.19 103.39 2jfg n GLY 370 Ca 0.02 -1.29 -0.03 0.00 0.00 0.00 0.00 46.02 44.73 2jfg n GLY 370 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2jfg h ARG 371 N 0.00 0.12 -0.53 1.61 2.43 -1.86 -2.08 114.38 114.08 2jfg h ARG 371 Ca 0.00 -0.01 -0.09 0.00 -0.81 0.00 0.00 59.98 59.07 2jfg h ARG 371 Cb 0.00 -0.03 -0.05 0.00 -0.42 0.00 0.00 29.97 29.47 2jfg h ARG 371 CO 0.00 0.08 0.09 -0.25 -1.51 0.00 0.00 179.97 178.38 2jfg n ASP 372 N -5.21 4.66 -0.29 -3.80 8.00 -0.37 -4.66 116.55 114.88 2jfg n ASP 372 Ca 0.04 -3.13 0.11 0.00 0.71 0.00 0.00 54.79 52.52 2jfg n ASP 372 Cb 0.24 -0.67 0.26 0.00 -0.02 0.00 0.00 41.12 40.94 2jfg n ASP 372 CO 0.00 0.00 0.00 1.23 -0.39 0.00 0.00 177.20 178.04 2jfg h GLY 373 N 2.68 1.32 1.30 0.44 0.00 -1.26 -2.13 103.07 105.41 2jfg h GLY 373 Ca 0.11 -0.08 -0.07 0.00 0.00 0.00 0.00 47.33 47.29 2jfg h GLY 373 CO 0.50 -0.28 0.06 0.00 0.00 0.00 0.00 176.54 176.82 2jfg h ALA 374 N 1.70 1.09 -0.43 3.60 0.00 -1.83 -0.96 119.26 122.43 2jfg h ALA 374 Ca 0.51 -0.25 -0.06 0.00 0.00 0.00 0.00 54.91 55.11 2jfg h ALA 374 Cb 0.97 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.52 2jfg h ALA 374 CO -0.56 0.58 0.03 0.37 0.00 0.00 0.00 179.25 179.66 2jfg h GLN 375 N 0.82 0.68 -0.10 0.00 4.15 -1.76 -1.86 115.11 117.03 2jfg h GLN 375 Ca 0.17 -0.16 -0.16 0.00 0.77 0.00 0.00 58.65 59.27 2jfg h GLN 375 Cb 0.41 -0.09 0.01 0.00 0.21 0.00 0.00 27.48 28.01 2jfg h GLN 375 CO 0.01 0.68 -0.56 -0.07 -1.93 0.00 0.00 178.83 176.96 2jfg h LEU 376 N 0.65 0.66 -1.70 -2.39 3.38 -1.18 -3.14 115.31 111.59 2jfg h LEU 376 Ca 0.13 -0.65 0.03 0.00 0.09 0.00 0.00 57.88 57.49 2jfg h LEU 376 Cb 0.37 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.90 2jfg h LEU 376 CO 0.01 1.21 0.26 0.00 0.09 0.00 0.00 178.44 180.01 2jfg h ALA 377 N 0.47 1.87 0.00 1.53 0.00 -1.05 -1.90 119.26 120.19 2jfg h ALA 377 Ca -0.04 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.85 2jfg h ALA 377 Cb 1.21 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.89 2jfg h ALA 377 CO 0.12 0.07 0.00 0.00 0.00 0.00 0.00 179.25 179.44 2jfg n ALA 378 N -2.51 1.32 -0.23 0.00 0.00 -0.71 -2.50 120.51 115.88 2jfg n ALA 378 Ca 0.04 -0.02 -0.04 0.00 0.00 0.00 0.00 53.44 53.42 2jfg n ALA 378 Cb 0.17 -1.11 0.14 0.00 0.00 0.00 0.00 19.45 18.65 2jfg n ALA 378 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 2jfg h LEU 379 N 0.00 0.95 -5.19 0.00 3.38 -1.44 -3.39 115.31 109.62 2jfg h LEU 379 Ca 0.00 -0.13 -0.11 0.00 0.09 0.00 0.00 57.88 57.73 2jfg h LEU 379 Cb 0.12 -0.25 -0.17 0.00 0.09 0.00 0.00 40.66 40.46 2jfg h LEU 379 CO 0.00 0.84 -0.45 -0.60 0.09 0.00 0.00 178.44 178.32 2jfg s ARG 380 N -5.50 0.95 0.40 1.13 3.52 -1.07 -4.93 118.95 113.45 2jfg s ARG 380 Ca -0.11 -0.83 0.14 0.00 -0.13 0.00 0.00 55.73 54.80 2jfg s ARG 380 Cb 0.16 -0.02 0.99 0.00 -1.56 0.00 0.00 34.95 34.52 2jfg s ARG 380 CO 0.82 -1.20 1.88 -1.35 -0.81 0.00 0.00 175.30 174.64 2jfg h PRO 381 N 5.32 0.49 0.00 5.12 0.11 -1.70 -2.34 132.00 138.99 2jfg h PRO 381 Ca 0.05 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.13 2jfg h PRO 381 Cb 1.13 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.13 2jfg h PRO 381 CO 0.02 0.32 0.00 1.05 -0.21 0.00 0.00 178.00 179.18 2jfg h GLU 382 N 0.50 0.00 -0.02 1.05 9.09 -1.97 -2.50 114.58 120.73 2jfg h GLU 382 Ca 0.43 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.84 2jfg h GLU 382 Cb 0.91 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.01 2jfg h GLU 382 CO -0.17 0.00 0.00 1.33 0.05 0.00 0.00 179.01 180.22 2jfg n VAL 383 N -2.65 1.28 -4.55 -1.06 0.24 -0.89 -5.06 118.33 105.64 2jfg n VAL 383 Ca -0.00 -1.38 -0.31 0.00 -2.04 0.00 0.00 64.34 60.61 2jfg n VAL 383 Cb 0.15 0.28 -0.12 0.00 -1.47 0.00 0.00 33.84 32.68 2jfg n VAL 383 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2jfg s ALA 384 N -1.57 2.79 0.06 2.33 0.00 -0.94 -1.24 121.76 123.19 2jfg s ALA 384 Ca 0.11 -1.12 0.09 0.00 0.00 0.00 0.00 51.96 51.03 2jfg s ALA 384 Cb 0.09 -0.91 -0.03 0.00 0.00 0.00 0.00 23.12 22.27 2jfg s ALA 384 CO 0.02 0.59 -0.23 -1.21 0.00 0.00 0.00 175.76 174.93 2jfg s GLU 385 N -1.48 1.49 -0.06 0.00 0.41 -0.25 -4.96 118.70 113.85 2jfg s GLU 385 Ca 0.16 -1.08 0.05 0.00 -0.41 0.00 0.00 54.97 53.69 2jfg s GLU 385 Cb -0.11 -1.69 -0.01 0.00 -1.78 0.00 0.00 34.13 30.54 2jfg s GLU 385 CO 0.07 0.43 -0.23 -1.14 -0.49 0.00 0.00 175.26 173.90 2jfg s GLN 386 N -1.41 2.44 0.27 1.61 0.74 -1.26 -0.29 119.66 121.76 2jfg s GLN 386 Ca 0.10 -0.82 0.03 0.00 0.05 0.00 0.00 55.36 54.72 2jfg s GLN 386 Cb -0.09 -2.03 -0.06 0.00 1.10 0.00 0.00 33.01 31.93 2jfg s GLN 386 CO 0.03 0.30 0.04 0.95 -0.55 0.00 0.00 175.29 176.06 2jfg s THR 387 N -0.00 1.01 0.00 -0.34 -4.23 -0.14 -4.96 115.64 106.98 2jfg s THR 387 Ca -0.07 -2.02 -0.25 0.00 -1.18 0.00 0.00 61.69 58.18 2jfg s THR 387 Cb -0.14 -2.57 -0.19 0.00 1.34 0.00 0.00 72.50 70.95 2jfg s THR 387 CO 0.04 -0.14 1.33 -0.08 -0.54 0.00 0.00 174.62 175.23 2jfg h GLU 388 N 2.32 0.07 -6.05 3.99 4.81 -1.94 -3.32 114.58 114.47 2jfg h GLU 388 Ca -0.39 -0.03 -0.58 0.00 -0.13 0.00 0.00 59.36 58.22 2jfg h GLU 388 Cb 1.24 -0.00 -0.14 0.00 0.63 0.00 0.00 28.75 30.47 2jfg h GLU 388 CO 0.66 0.49 -0.74 0.95 -0.73 0.00 0.00 179.01 179.63 2jfg s THR 389 N -4.45 2.30 0.22 0.32 -4.23 -1.26 -0.82 115.64 107.72 2jfg s THR 389 Ca -0.15 -2.35 -0.08 0.00 -1.18 0.00 0.00 61.69 57.93 2jfg s THR 389 Cb 0.03 -2.30 0.18 0.00 1.34 0.00 0.00 72.50 71.75 2jfg s THR 389 CO 0.69 -0.41 1.84 -0.03 -0.54 0.00 0.00 174.62 176.17 2jfg h MET 390 N 2.29 1.17 -0.58 3.99 4.05 -1.95 -2.14 114.93 121.76 2jfg h MET 390 Ca -0.40 -0.14 0.02 0.00 -0.28 0.00 0.00 59.70 58.90 2jfg h MET 390 Cb 1.25 -0.23 -0.03 0.00 -0.80 0.00 0.00 31.60 31.79 2jfg h MET 390 CO 0.62 0.86 0.36 1.49 0.23 0.00 0.00 176.91 180.47 2jfg h GLU 391 N 1.16 0.70 -0.89 0.39 4.81 -1.98 0.87 114.58 119.65 2jfg h GLU 391 Ca 0.29 -0.04 -0.02 0.00 -0.13 0.00 0.00 59.36 59.46 2jfg h GLU 391 Cb 0.03 -0.16 -0.04 0.00 0.63 0.00 0.00 28.75 29.21 2jfg h GLU 391 CO -0.05 0.46 0.49 1.96 -0.73 0.00 0.00 179.01 181.15 2jfg h GLN 392 N 0.72 1.24 -0.55 1.92 4.20 -1.92 -0.91 115.11 119.81 2jfg h GLN 392 Ca 0.22 -0.14 -0.05 0.00 0.06 0.00 0.00 58.65 58.74 2jfg h GLN 392 Cb -0.02 -0.24 -0.02 0.00 0.30 0.00 0.00 27.48 27.50 2jfg h GLN 392 CO -0.08 0.90 0.14 0.00 -0.67 0.00 0.00 178.83 179.12 2jfg h ALA 393 N 1.29 0.73 -0.64 3.87 0.00 -0.71 -1.08 119.26 122.72 2jfg h ALA 393 Ca 0.31 -0.21 -0.06 0.00 0.00 0.00 0.00 54.91 54.95 2jfg h ALA 393 Cb 0.02 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.57 2jfg h ALA 393 CO -0.05 0.42 0.15 0.52 0.00 0.00 0.00 179.25 180.29 2jfg h MET 394 N 0.78 1.02 0.00 0.00 2.86 -0.50 -0.80 114.93 118.28 2jfg h MET 394 Ca 0.17 -0.25 -0.09 0.00 -2.06 0.00 0.00 59.70 57.48 2jfg h MET 394 Cb 0.33 -0.13 -0.01 0.00 0.06 0.00 0.00 31.60 31.84 2jfg h MET 394 CO 0.00 0.92 -0.41 0.00 1.06 0.00 0.00 176.91 178.48 2jfg h ARG 395 N 0.94 0.00 -0.18 1.72 3.08 -1.00 -1.69 114.38 117.25 2jfg h ARG 395 Ca 0.20 0.00 -0.18 0.00 0.07 0.00 0.00 59.98 60.07 2jfg h ARG 395 Cb 0.36 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.42 2jfg h ARG 395 CO 0.00 0.41 -0.58 1.25 -1.07 0.00 0.00 179.97 179.99 2jfg h LEU 396 N 0.00 0.81 -0.03 3.04 5.85 -0.89 -3.36 115.31 120.73 2jfg h LEU 396 Ca -0.00 -0.60 -0.23 0.00 0.84 0.00 0.00 57.88 57.89 2jfg h LEU 396 Cb 0.91 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 41.69 2jfg h LEU 396 CO 0.05 1.27 -1.05 0.17 -0.34 0.00 0.00 178.44 178.54 2jfg h LEU 397 N 0.40 0.20 -0.53 2.25 8.10 -1.02 -3.38 115.31 121.32 2jfg h LEU 397 Ca -0.02 -0.20 0.06 0.00 0.11 0.00 0.00 57.88 57.82 2jfg h LEU 397 Cb 1.20 -0.06 -0.05 0.00 -0.44 0.00 0.00 40.66 41.31 2jfg h LEU 397 CO 0.12 1.12 0.25 0.00 -4.11 0.00 0.00 178.44 175.82 2jfg h ALA 398 N 0.86 0.68 -0.00 0.17 0.00 -1.45 -0.28 119.26 119.23 2jfg h ALA 398 Ca -0.06 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2jfg h ALA 398 Cb 1.77 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 19.52 2jfg h ALA 398 CO 0.16 -0.11 0.03 -1.35 0.00 0.00 0.00 179.25 177.97 2jfg h PRO 399 N 0.48 0.00 -0.00 0.00 0.11 -1.77 -2.14 132.00 128.68 2jfg h PRO 399 Ca 0.24 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.35 2jfg h PRO 399 Cb 0.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.30 2jfg h PRO 399 CO -0.19 0.00 -0.47 0.54 -0.21 0.00 0.00 178.00 177.67 2jfg n ARG 400 N -3.21 0.17 -2.31 1.05 1.74 -0.12 -4.92 116.66 109.05 2jfg n ARG 400 Ca -0.03 -0.10 -0.41 0.00 -0.77 0.00 0.00 57.85 56.54 2jfg n ARG 400 Cb 0.10 -1.50 -0.03 0.00 -1.02 0.00 0.00 32.46 30.01 2jfg n ARG 400 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2jfg s VAL 401 N -2.90 3.50 0.18 1.55 1.01 -0.81 -5.04 120.40 117.91 2jfg s VAL 401 Ca 0.14 1.20 0.10 0.00 0.00 0.00 0.00 61.98 63.42 2jfg s VAL 401 Cb 0.18 -3.77 -0.04 0.00 0.00 0.00 0.00 36.38 32.75 2jfg s VAL 401 CO 0.67 0.16 -0.21 -1.10 0.00 0.00 0.00 175.10 174.62 2jfg s GLN 402 N 0.16 1.42 0.19 2.72 -1.52 -1.26 -5.07 119.66 116.29 2jfg s GLN 402 Ca 0.56 -1.48 -0.33 0.00 -1.95 0.00 0.00 55.36 52.16 2jfg s GLN 402 Cb -0.34 -1.62 -0.14 0.00 -0.22 0.00 0.00 33.01 30.69 2jfg s GLN 402 CO 0.35 0.34 1.44 -2.30 -0.25 0.00 0.00 175.29 174.87 2jfg n PRO 403 N 0.24 1.88 0.00 2.91 -0.02 -1.26 -0.95 135.00 137.80 2jfg n PRO 403 Ca -0.12 0.67 0.00 0.00 -2.02 0.00 0.00 63.50 62.03 2jfg n PRO 403 Cb 0.57 -2.35 0.00 0.00 -0.02 0.00 0.00 33.50 31.69 2jfg n PRO 403 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2jfg n GLY 404 N 2.64 1.82 3.82 -1.23 0.00 0.12 -4.79 105.19 107.56 2jfg n GLY 404 Ca 0.15 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.86 2jfg n GLY 404 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2jfg s ASP 405 N -1.53 5.10 -0.04 1.61 1.11 -0.13 -1.06 116.67 121.72 2jfg s ASP 405 Ca 0.00 1.42 0.04 0.00 0.18 0.00 0.00 52.55 54.19 2jfg s ASP 405 Cb 0.00 -2.24 -0.00 0.00 1.07 0.00 0.00 42.92 41.74 2jfg s ASP 405 CO 0.00 -1.60 -0.18 -0.32 1.18 0.00 0.00 175.17 174.25 2jfg s MET 406 N -5.14 1.84 -0.27 8.23 -2.45 -0.57 -2.88 119.30 118.06 2jfg s MET 406 Ca 0.59 -0.63 -0.06 0.00 -1.25 0.00 0.00 55.69 54.34 2jfg s MET 406 Cb -0.14 -1.60 -0.00 0.00 1.25 0.00 0.00 34.83 34.35 2jfg s MET 406 CO 0.54 0.25 0.05 0.08 1.05 0.00 0.00 175.02 176.99 2jfg s VAL 407 N 0.02 3.88 -0.20 10.11 1.01 0.01 -0.50 120.40 134.74 2jfg s VAL 407 Ca -0.04 -0.53 0.01 0.00 0.00 0.00 0.00 61.98 61.42 2jfg s VAL 407 Cb -0.12 -2.91 0.04 0.00 0.00 0.00 0.00 36.38 33.40 2jfg s VAL 407 CO 0.02 0.22 -0.12 -0.22 0.00 0.00 0.00 175.10 175.01 2jfg s LEU 408 N 1.52 2.28 -0.67 3.92 2.96 0.05 -0.24 118.68 128.50 2jfg s LEU 408 Ca 0.04 -0.86 -0.23 0.00 -0.22 0.00 0.00 54.13 52.86 2jfg s LEU 408 Cb -0.16 -1.27 0.06 0.00 0.50 0.00 0.00 46.19 45.33 2jfg s LEU 408 CO 0.01 -0.13 1.01 -0.22 -1.32 0.00 0.00 176.35 175.71 2jfg s LEU 409 N 1.38 4.21 -0.41 -0.68 2.96 -0.38 -0.98 118.68 124.77 2jfg s LEU 409 Ca -0.01 -0.91 0.05 0.00 -0.22 0.00 0.00 54.13 53.05 2jfg s LEU 409 Cb -0.16 -2.44 0.20 0.00 0.50 0.00 0.00 46.19 44.29 2jfg s LEU 409 CO -0.09 -1.50 0.40 -0.24 -1.32 0.00 0.00 176.35 173.61 2jfg n SER 410 N 7.95 -0.19 0.15 3.68 2.88 -1.13 -0.09 113.62 126.87 2jfg n SER 410 Ca -0.03 -2.49 0.13 0.00 -1.33 0.00 0.00 58.87 55.15 2jfg n SER 410 Cb 0.46 -0.58 0.43 0.00 -0.75 0.00 0.00 64.21 63.77 2jfg n SER 410 CO 0.00 0.00 0.00 1.55 -1.23 0.00 0.00 175.04 175.36 2jfg h PRO 411 N 5.10 0.00 -0.24 -1.46 0.13 -1.60 -3.44 132.00 130.50 2jfg h PRO 411 Ca 0.20 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 65.23 2jfg h PRO 411 Cb 0.90 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 31.99 2jfg h PRO 411 CO 0.41 0.00 -0.09 0.00 -0.23 0.00 0.00 178.00 178.08 2jfg n ALA 412 N -1.86 -0.08 -2.60 -0.56 0.00 -0.03 -1.96 120.51 113.42 2jfg n ALA 412 Ca 0.04 0.08 -0.09 0.00 0.00 0.00 0.00 53.44 53.47 2jfg n ALA 412 Cb 0.37 -1.08 -0.09 0.00 0.00 0.00 0.00 19.45 18.64 2jfg n ALA 412 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jfg s ALA 414 N -2.91 2.10 -1.22 0.00 0.00 -0.05 -4.36 121.76 115.32 2jfg s ALA 414 Ca -0.02 -0.22 0.14 0.00 0.00 0.00 0.00 51.96 51.86 2jfg s ALA 414 Cb 0.01 -3.11 -0.02 0.00 0.00 0.00 0.00 23.12 20.00 2jfg s ALA 414 CO -0.06 -1.87 0.76 -1.13 0.00 0.00 0.00 175.76 173.46 2jfg n SER 415 N -3.53 1.40 0.03 0.00 3.41 -1.26 -1.21 113.62 112.45 2jfg n SER 415 Ca 0.07 -1.20 0.10 0.00 -0.26 0.00 0.00 58.87 57.58 2jfg n SER 415 Cb 0.56 0.53 0.44 0.00 -0.26 0.00 0.00 64.21 65.48 2jfg n SER 415 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2jfg n LEU 416 N -0.29 0.16 0.23 1.04 4.77 -1.26 -0.50 117.00 121.15 2jfg n LEU 416 Ca 0.05 0.53 0.07 0.00 -0.03 0.00 0.00 56.01 56.63 2jfg n LEU 416 Cb 0.29 -0.49 0.56 0.00 -2.33 0.00 0.00 43.42 41.44 2jfg n LEU 416 CO 0.19 -0.21 0.92 -2.24 -1.33 0.00 0.00 177.39 174.72 2jfg h ASP 417 N 0.00 0.00 0.00 -1.43 2.03 -1.96 -3.37 116.42 111.69 2jfg h ASP 417 Ca 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 2jfg h ASP 417 Cb 0.38 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.88 2jfg h ASP 417 CO 0.00 0.17 -0.18 0.00 -1.03 0.00 0.00 179.24 178.19 2jfg n GLN 418 N -4.15 3.22 -4.38 4.15 6.02 -0.86 -5.01 117.38 116.36 2jfg n GLN 418 Ca -0.02 0.00 -0.21 0.00 -0.01 0.00 0.00 57.00 56.75 2jfg n GLN 418 Cb 0.24 -0.44 -0.10 0.00 1.02 0.00 0.00 30.24 30.96 2jfg n GLN 418 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 177.06 175.99 2jfg s PHE 419 N -0.53 1.95 0.23 1.08 0.08 0.34 -5.04 117.98 116.09 2jfg s PHE 419 Ca 0.00 -0.46 -0.06 0.00 0.12 0.00 0.00 56.93 56.53 2jfg s PHE 419 Cb 0.00 -0.90 0.22 0.00 -0.57 0.00 0.00 43.02 41.77 2jfg s PHE 419 CO 0.00 0.47 1.81 -0.22 -0.10 0.00 0.00 175.22 177.18 2jfg h LYS 420 N 2.67 1.14 -2.34 0.44 3.64 -1.90 -3.37 116.57 116.86 2jfg h LYS 420 Ca -0.40 -0.19 0.18 0.00 -1.27 0.00 0.00 60.65 58.97 2jfg h LYS 420 Cb 1.23 -0.19 -0.07 0.00 -0.41 0.00 0.00 32.23 32.79 2jfg h LYS 420 CO 0.58 0.91 0.55 0.54 -2.27 0.00 0.00 179.45 179.76 2jfg s ASN 421 N -6.38 -0.10 0.51 4.20 2.20 -1.26 -4.95 114.94 109.17 2jfg s ASN 421 Ca -0.12 -0.49 0.29 0.00 -0.94 0.00 0.00 52.86 51.60 2jfg s ASN 421 Cb 0.16 0.47 1.28 0.00 -2.00 0.00 0.00 41.25 41.16 2jfg s ASN 421 CO 0.83 -0.89 1.97 2.19 -2.94 0.00 0.00 177.10 178.26 2jfg h PHE 422 N 2.00 0.00 -0.46 1.54 -5.15 -1.92 -2.32 116.94 110.63 2jfg h PHE 422 Ca -0.26 0.00 -0.07 0.00 -0.20 0.00 0.00 57.97 57.44 2jfg h PHE 422 Cb 1.22 0.00 -0.02 0.00 0.22 0.00 0.00 35.95 37.38 2jfg h PHE 422 CO 0.74 0.12 0.02 0.93 -2.00 0.00 0.00 178.31 178.12 2jfg h GLU 423 N 0.00 0.79 -0.69 6.09 3.07 -1.96 -0.60 114.58 121.28 2jfg h GLU 423 Ca -0.00 -0.24 -0.03 0.00 -0.50 0.00 0.00 59.36 58.59 2jfg h GLU 423 Cb 0.53 -0.08 -0.03 0.00 -0.84 0.00 0.00 28.75 28.33 2jfg h GLU 423 CO 0.01 0.84 0.32 0.37 -1.40 0.00 0.00 179.01 179.16 2jfg h GLN 424 N 0.65 1.01 -0.30 2.33 4.15 -1.82 0.19 115.11 121.31 2jfg h GLN 424 Ca 0.13 -0.15 0.02 0.00 0.77 0.00 0.00 58.65 59.42 2jfg h GLN 424 Cb 0.47 -0.18 -0.02 0.00 0.21 0.00 0.00 27.48 27.95 2jfg h GLN 424 CO 0.02 0.80 0.16 -0.09 -1.93 0.00 0.00 178.83 177.79 2jfg h ARG 425 N 0.97 0.32 -0.58 1.69 2.43 -1.29 -0.53 114.38 117.39 2jfg h ARG 425 Ca 0.24 -0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.38 2jfg h ARG 425 Cb 0.13 -0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 29.58 2jfg h ARG 425 CO -0.03 0.21 0.33 0.78 -1.51 0.00 0.00 179.97 179.75 2jfg h GLY 426 N 0.33 0.86 1.09 2.80 0.00 -0.64 -1.74 103.07 105.77 2jfg h GLY 426 Ca 0.12 -0.38 -0.09 0.00 0.00 0.00 0.00 47.33 46.98 2jfg h GLY 426 CO -0.07 0.37 0.02 3.43 0.00 0.00 0.00 176.54 180.29 2jfg h ASN 427 N 0.79 1.06 -0.45 0.19 2.35 -0.47 -0.90 115.58 118.15 2jfg h ASN 427 Ca 0.21 -0.29 -0.07 0.00 -0.55 0.00 0.00 56.30 55.60 2jfg h ASN 427 Cb 0.02 -0.28 -0.02 0.00 0.05 0.00 0.00 38.32 38.09 2jfg h ASN 427 CO -0.04 1.09 0.01 -0.33 -1.65 0.00 0.00 177.43 176.51 2jfg h GLU 428 N 1.00 0.78 -0.46 0.81 5.08 -1.00 -1.28 114.58 119.50 2jfg h GLU 428 Ca 0.18 -0.25 0.06 0.00 -1.00 0.00 0.00 59.36 58.36 2jfg h GLU 428 Cb 0.53 -0.07 -0.05 0.00 0.50 0.00 0.00 28.75 29.66 2jfg h GLU 428 CO 0.03 0.84 0.16 0.35 -1.00 0.00 0.00 179.01 179.38 2jfg h PHE 429 N 0.63 0.27 -0.66 4.33 3.57 -1.15 -0.98 116.94 122.95 2jfg h PHE 429 Ca 0.13 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.63 2jfg h PHE 429 Cb 0.49 -0.05 -0.03 0.00 2.79 0.00 0.00 35.95 39.14 2jfg h PHE 429 CO 0.04 0.09 0.35 0.00 -2.23 0.00 0.00 178.31 176.55 2jfg h ALA 430 N 1.31 0.85 -0.27 2.41 0.00 -0.85 0.25 119.26 122.96 2jfg h ALA 430 Ca 0.22 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 2jfg h ALA 430 Cb 0.23 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 2jfg h ALA 430 CO -0.23 0.38 0.13 -0.09 0.00 0.00 0.00 179.25 179.44 2jfg h ARG 431 N 0.91 0.39 -0.47 0.00 2.43 -1.01 -1.52 114.38 115.09 2jfg h ARG 431 Ca 0.23 -0.06 -0.09 0.00 -0.81 0.00 0.00 59.98 59.26 2jfg h ARG 431 Cb 0.07 -0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 29.53 2jfg h ARG 431 CO -0.03 0.37 -0.06 -0.07 -1.51 0.00 0.00 179.97 178.66 2jfg h LEU 432 N 0.31 0.81 -0.80 3.80 3.38 -0.86 -2.20 115.31 119.75 2jfg h LEU 432 Ca 0.09 -0.23 0.00 0.00 0.09 0.00 0.00 57.88 57.84 2jfg h LEU 432 Cb 0.11 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 40.60 2jfg h LEU 432 CO -0.01 0.91 0.51 0.00 0.09 0.00 0.00 178.44 179.94 2jfg h ALA 433 N 1.17 1.01 -0.33 1.53 0.00 -0.28 -0.19 119.26 122.17 2jfg h ALA 433 Ca 0.13 -0.07 -0.09 0.00 0.00 0.00 0.00 54.91 54.88 2jfg h ALA 433 Cb 0.55 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 2jfg h ALA 433 CO 0.03 0.45 -0.18 0.87 0.00 0.00 0.00 179.25 180.42 2jfg h LYS 434 N 1.09 0.60 0.03 0.00 1.57 -1.03 0.14 116.57 118.96 2jfg h LYS 434 Ca 0.29 -0.21 -0.00 0.00 -1.87 0.00 0.00 60.65 58.86 2jfg h LYS 434 Cb -0.09 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.17 2jfg h LYS 434 CO -0.06 0.75 -0.01 1.49 -0.57 0.00 0.00 179.45 181.04 2jfg h GLU 435 N 0.54 -0.04 0.00 3.15 4.81 -1.14 -3.35 114.58 118.56 2jfg h GLU 435 Ca 0.09 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.32 2jfg h GLU 435 Cb 0.61 0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.00 2jfg h GLU 435 CO 0.04 0.42 -0.67 -0.07 -0.73 0.00 0.00 179.01 178.00 2jfg h LEU 436 N -0.51 0.00 -2.55 1.64 3.38 -0.98 -3.32 115.31 112.97 2jfg h LEU 436 Ca -0.00 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 57.90 2jfg h LEU 436 Cb 0.48 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.23 2jfg h LEU 436 CO 0.01 0.03 0.00 0.61 0.09 0.00 0.00 178.44 179.18 2jfg n GLY 437 N 1.22 2.20 3.08 0.83 0.00 0.48 -4.89 105.19 108.10 2jfg n GLY 437 Ca 0.02 -0.73 -0.17 0.00 0.00 0.00 0.00 46.02 45.14 2jfg n GLY 437 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2jfg s SER 438 N -0.95 1.20 0.43 1.61 0.01 -1.25 -4.78 113.70 109.97 2jfg s SER 438 Ca 0.45 -0.39 -0.24 0.00 1.31 0.00 0.00 55.95 57.08 2jfg s SER 438 Cb 0.25 -0.06 -0.08 0.00 0.21 0.00 0.00 66.02 66.34 2jfg s SER 438 CO 0.27 -0.02 1.19 -1.00 0.41 0.00 0.00 173.24 174.10 2jfg s HIS 439 N -0.80 2.92 0.00 2.43 0.09 -1.26 -4.96 115.29 113.70 2jfg s HIS 439 Ca -0.01 1.52 0.00 0.00 -0.00 0.00 0.00 55.06 56.57 2jfg s HIS 439 Cb -0.07 -3.44 0.00 0.00 -0.00 0.00 0.00 32.58 29.07 2jfg s HIS 439 CO 0.01 -1.56 0.00 1.58 -0.00 0.00 0.00 174.74 174.77