#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1jgw s LEU 2 N 0.00 2.15 0.59 0.00 1.43 -1.26 -4.61 118.68 116.99 1jgw s LEU 2 Ca 0.00 -0.46 -0.16 0.00 -1.03 0.00 0.00 54.13 52.48 1jgw s LEU 2 Cb 0.00 -0.76 -0.03 0.00 0.03 0.00 0.00 46.19 45.43 1jgw s LEU 2 CO 0.00 0.10 1.07 -0.76 0.23 0.00 0.00 176.35 176.99 1jgw s LEU 3 N -1.05 3.52 0.40 1.79 1.43 -1.26 -4.91 118.68 118.60 1jgw s LEU 3 Ca 0.04 1.89 0.16 0.00 -1.03 0.00 0.00 54.13 55.19 1jgw s LEU 3 Cb -0.08 -4.54 1.02 0.00 0.03 0.00 0.00 46.19 42.62 1jgw s LEU 3 CO 0.01 -1.23 1.84 0.77 0.23 0.00 0.00 176.35 177.96 1jgw h SER 4 N 0.50 0.48 -0.62 2.29 4.64 -2.07 -1.50 113.55 117.26 1jgw h SER 4 Ca -0.47 0.05 0.00 0.00 -0.47 0.00 0.00 61.79 60.90 1jgw h SER 4 Cb 1.23 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 63.28 1jgw h SER 4 CO 0.57 0.18 0.00 2.22 -0.87 0.00 0.00 176.83 178.93 1jgw n PHE 5 N -4.56 1.56 0.10 4.77 1.16 -1.26 -4.66 117.46 114.57 1jgw n PHE 5 Ca 0.20 -0.64 -0.18 0.00 -1.87 0.00 0.00 57.45 54.97 1jgw n PHE 5 Cb 0.69 -0.29 -0.14 0.00 -1.61 0.00 0.00 39.48 38.12 1jgw n PHE 5 CO 0.00 0.00 0.00 1.49 -1.87 0.00 0.00 176.76 176.38 1jgw h GLU 6 N 3.98 0.31 -0.71 3.97 4.81 -1.63 -3.40 114.58 121.91 1jgw h GLU 6 Ca 0.00 -0.54 0.16 0.00 -0.13 0.00 0.00 59.36 58.85 1jgw h GLU 6 Cb 1.53 0.20 -0.11 0.00 0.63 0.00 0.00 28.75 31.00 1jgw h GLU 6 CO 0.27 1.23 0.11 -0.09 -0.73 0.00 0.00 179.01 179.80 1jgw h ARG 7 N 0.09 0.20 -0.04 1.92 2.43 -1.83 -1.68 114.38 115.47 1jgw h ARG 7 Ca -0.20 -0.01 0.01 0.00 -0.81 0.00 0.00 59.98 58.97 1jgw h ARG 7 Cb 2.03 -0.05 -0.00 0.00 -0.42 0.00 0.00 29.97 31.53 1jgw h ARG 7 CO 0.20 0.13 0.13 1.57 -1.51 0.00 0.00 179.97 180.49 1jgw h LYS 8 N 0.21 0.00 0.00 0.20 2.10 -1.96 -2.19 116.57 114.93 1jgw h LYS 8 Ca 0.40 0.00 -0.13 0.00 -2.00 0.00 0.00 60.65 58.92 1jgw h LYS 8 Cb 0.68 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 31.99 1jgw h LYS 8 CO -0.54 0.00 -1.12 1.88 -2.00 0.00 0.00 179.45 177.67 1jgw h TYR 9 N 0.00 0.00 0.00 0.07 0.05 -1.57 -3.41 116.97 112.11 1jgw h TYR 9 Ca 0.02 0.00 -0.60 0.00 0.05 0.00 0.00 58.73 58.20 1jgw h TYR 9 Cb 0.27 0.00 0.02 0.00 1.01 0.00 0.00 36.73 38.03 1jgw h TYR 9 CO 0.00 0.47 2.84 0.54 -1.05 0.00 0.00 178.16 180.97 1jgw n ARG 10 N -2.94 2.34 -3.41 4.88 1.74 -0.83 -4.91 116.66 113.53 1jgw n ARG 10 Ca -0.05 -1.98 -0.19 0.00 -0.77 0.00 0.00 57.85 54.86 1jgw n ARG 10 Cb 0.77 -2.86 -0.00 0.00 -1.02 0.00 0.00 32.46 29.34 1jgw n ARG 10 CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 1jgw s VAL 11 N 3.68 3.80 0.72 1.55 -7.23 -1.26 -5.08 120.40 116.57 1jgw s VAL 11 Ca 0.52 -1.04 -0.11 0.00 -1.81 0.00 0.00 61.98 59.55 1jgw s VAL 11 Cb 0.14 -3.31 0.02 0.00 0.56 0.00 0.00 36.38 33.79 1jgw s VAL 11 CO -0.00 -0.13 1.07 -2.84 -0.31 0.00 0.00 175.10 172.89 1jgw s PRO 12 N -4.19 2.72 0.00 4.82 0.02 -1.26 -4.95 135.00 132.16 1jgw s PRO 12 Ca 0.47 1.02 0.00 0.00 0.02 0.00 0.00 61.00 62.51 1jgw s PRO 12 Cb -0.09 -1.96 0.00 0.00 0.02 0.00 0.00 34.50 32.47 1jgw s PRO 12 CO 0.31 -1.27 0.00 0.41 -0.33 0.00 0.00 177.00 176.12 1jgw n GLY 13 N -1.74 2.30 0.46 0.52 0.00 -1.26 -5.04 105.19 100.42 1jgw n GLY 13 Ca 0.08 -1.99 0.00 0.00 0.00 0.00 0.00 46.02 44.11 1jgw n GLY 13 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1jgw n GLY 14 N 0.71 3.08 3.76 -0.02 0.00 -1.26 -4.57 105.19 106.88 1jgw n GLY 14 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.64 1jgw n GLY 14 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1jgw s THR 15 N -2.69 2.49 -0.10 2.61 -4.23 -1.26 -4.70 115.64 107.76 1jgw s THR 15 Ca 0.00 0.37 -0.02 0.00 -1.18 0.00 0.00 61.69 60.87 1jgw s THR 15 Cb 0.00 -3.19 -0.25 0.00 1.34 0.00 0.00 72.50 70.40 1jgw s THR 15 CO 0.00 -0.00 0.42 0.18 -0.54 0.00 0.00 174.62 174.68 1jgw n LEU 16 N -0.78 2.19 -4.19 4.79 4.77 -1.26 -4.88 117.00 117.64 1jgw n LEU 16 Ca 0.09 0.25 -0.17 0.00 -0.03 0.00 0.00 56.01 56.15 1jgw n LEU 16 Cb 0.46 -0.79 -0.11 0.00 -2.33 0.00 0.00 43.42 40.65 1jgw n LEU 16 CO 0.51 0.74 -0.44 -0.69 -1.33 0.00 0.00 177.39 176.18 1jgw s VAL 17 N -2.57 1.09 0.00 4.08 1.01 -1.26 -4.84 120.40 117.91 1jgw s VAL 17 Ca -0.18 -1.51 0.00 0.00 0.00 0.00 0.00 61.98 60.29 1jgw s VAL 17 Cb 0.07 -1.26 0.00 0.00 0.00 0.00 0.00 36.38 35.19 1jgw s VAL 17 CO 0.78 -0.39 0.00 0.61 0.00 0.00 0.00 175.10 176.10 1jgw n GLY 18 N 0.86 0.34 7.00 4.51 0.00 -1.26 -4.56 105.19 112.08 1jgw n GLY 18 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.84 1jgw n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1jgw n GLY 19 N -1.65 2.33 0.73 -0.02 0.00 -1.26 -1.32 105.19 104.00 1jgw n GLY 19 Ca 0.00 0.37 0.06 0.00 0.00 0.00 0.00 46.02 46.45 1jgw n GLY 19 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1jgw n ASN 20 N 8.48 3.12 -0.35 1.61 6.94 -1.26 -4.60 115.26 129.19 1jgw n ASN 20 Ca 0.00 -2.08 -0.00 0.00 -0.02 0.00 0.00 54.58 52.47 1jgw n ASN 20 Cb 0.00 -0.28 0.13 0.00 -2.36 0.00 0.00 39.78 37.27 1jgw n ASN 20 CO 0.00 0.00 0.00 -0.07 -1.03 0.00 0.00 177.26 176.16 1jgw h LEU 21 N 2.23 1.01 -3.12 -4.53 -0.00 -1.55 -3.12 115.31 106.22 1jgw h LEU 21 Ca 0.00 -0.01 -0.02 0.00 -0.00 0.00 0.00 57.88 57.85 1jgw h LEU 21 Cb 0.82 -0.23 -0.01 0.00 -0.00 0.00 0.00 40.66 41.24 1jgw h LEU 21 CO 0.02 0.69 -0.06 0.49 -0.00 0.00 0.00 178.44 179.58 1jgw n PHE 22 N -4.50 0.43 -2.52 1.13 3.72 -1.26 -4.89 117.46 109.57 1jgw n PHE 22 Ca 0.12 -1.07 -0.43 0.00 -0.05 0.00 0.00 57.45 56.02 1jgw n PHE 22 Cb 0.10 -0.25 0.00 0.00 -0.94 0.00 0.00 39.48 38.39 1jgw n PHE 22 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 176.76 173.24 1jgw n ASP 23 N -1.07 4.94 -3.88 4.37 2.03 -1.18 -0.77 116.55 121.00 1jgw n ASP 23 Ca 0.20 -2.99 -0.08 0.00 0.52 0.00 0.00 54.79 52.44 1jgw n ASP 23 Cb 0.77 -1.58 -0.03 0.00 -0.72 0.00 0.00 41.12 39.56 1jgw n ASP 23 CO 0.00 0.00 0.00 0.72 -1.92 0.00 0.00 177.20 176.00 1jgw s PHE 24 N 1.88 -0.06 0.29 -0.67 -0.12 -1.26 -5.03 117.98 113.01 1jgw s PHE 24 Ca 0.44 -0.37 0.09 0.00 -0.05 0.00 0.00 56.93 57.04 1jgw s PHE 24 Cb 0.05 0.57 -0.04 0.00 -0.63 0.00 0.00 43.02 42.97 1jgw s PHE 24 CO 0.00 -1.17 0.05 -1.58 -0.05 0.00 0.00 175.22 172.48 1jgw s TRP 25 N -3.94 2.72 -0.32 3.49 0.51 -1.26 -1.52 118.94 118.62 1jgw s TRP 25 Ca 0.14 -0.26 -0.01 0.00 -2.12 0.00 0.00 56.10 53.84 1jgw s TRP 25 Cb -0.04 -1.34 0.11 0.00 -0.81 0.00 0.00 33.47 31.38 1jgw s TRP 25 CO 0.07 0.53 0.12 0.08 -0.51 0.00 0.00 176.95 177.24 1jgw s VAL 26 N -2.35 0.79 0.00 4.03 1.01 0.65 -4.92 120.40 119.60 1jgw s VAL 26 Ca 0.33 -1.45 0.00 0.00 0.00 0.00 0.00 61.98 60.86 1jgw s VAL 26 Cb -0.05 -1.60 0.00 0.00 0.00 0.00 0.00 36.38 34.73 1jgw s VAL 26 CO 0.21 -0.72 0.00 0.61 0.00 0.00 0.00 175.10 175.20 1jgw n GLY 27 N 4.74 2.01 0.08 4.51 0.00 -1.26 -1.77 105.19 113.50 1jgw n GLY 27 Ca -0.01 -0.42 0.13 0.00 0.00 0.00 0.00 46.02 45.72 1jgw n GLY 27 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1jgw n PRO 28 N 13.06 0.31 -2.76 1.61 -0.04 -1.26 -4.89 135.00 141.02 1jgw n PRO 28 Ca 0.00 -0.16 -0.41 0.00 -0.04 0.00 0.00 63.50 62.89 1jgw n PRO 28 Cb 0.00 -1.50 -0.04 0.00 -0.04 0.00 0.00 33.50 31.93 1jgw n PRO 28 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 1jgw s PHE 29 N -2.80 3.71 0.14 0.54 0.08 -0.73 -5.04 117.98 113.89 1jgw s PHE 29 Ca 0.17 1.69 -0.25 0.00 0.12 0.00 0.00 56.93 58.66 1jgw s PHE 29 Cb 0.18 -3.05 -0.08 0.00 -0.57 0.00 0.00 43.02 39.51 1jgw s PHE 29 CO 0.60 0.10 0.76 -0.47 -0.10 0.00 0.00 175.22 176.11 1jgw s TYR 30 N 0.55 3.88 0.00 0.36 5.04 -1.26 -0.26 117.35 125.66 1jgw s TYR 30 Ca 0.48 1.59 0.00 0.00 -2.44 0.00 0.00 57.07 56.70 1jgw s TYR 30 Cb -0.22 -2.76 0.00 0.00 0.35 0.00 0.00 41.96 39.34 1jgw s TYR 30 CO 0.28 0.49 0.00 0.28 -1.34 0.00 0.00 175.55 175.25 1jgw n VAL 31 N 1.76 0.00 -0.14 3.14 0.31 -0.58 -4.88 118.33 117.94 1jgw n VAL 31 Ca -0.05 0.00 0.02 0.00 -0.01 0.00 0.00 64.34 64.29 1jgw n VAL 31 Cb 0.49 -0.45 -0.01 0.00 -0.91 0.00 0.00 33.84 32.96 1jgw n VAL 31 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1jgw n GLY 32 N 2.75 -2.40 0.11 2.92 0.00 0.05 -2.10 105.19 106.52 1jgw n GLY 32 Ca 0.00 -1.43 -0.08 0.00 0.00 0.00 0.00 46.02 44.51 1jgw n GLY 32 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1jgw h PHE 33 N -0.14 -0.02 0.00 1.61 3.57 -1.80 0.20 116.94 120.37 1jgw h PHE 33 Ca -0.01 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.50 1jgw h PHE 33 Cb 0.13 0.04 0.00 0.00 2.79 0.00 0.00 35.95 38.92 1jgw h PHE 33 CO 0.00 -0.04 0.00 1.19 -2.23 0.00 0.00 178.31 177.24 1jgw n PHE 34 N -5.15 0.51 -0.04 0.41 3.72 -1.26 -1.33 117.46 114.32 1jgw n PHE 34 Ca -0.02 0.21 -0.17 0.00 -0.05 0.00 0.00 57.45 57.43 1jgw n PHE 34 Cb 0.12 -0.84 -0.06 0.00 -0.94 0.00 0.00 39.48 37.76 1jgw n PHE 34 CO 0.00 0.00 0.00 0.78 -0.05 0.00 0.00 176.76 177.49 1jgw h GLY 35 N 1.92 0.88 1.43 1.37 0.00 -0.40 -2.36 103.07 105.90 1jgw h GLY 35 Ca 0.00 -1.18 -0.16 0.00 0.00 0.00 0.00 47.33 45.99 1jgw h GLY 35 CO 0.00 1.05 -0.51 -2.08 0.00 0.00 0.00 176.54 175.01 1jgw h VAL 36 N 0.54 1.31 -0.26 4.60 2.07 -0.86 -3.02 116.25 120.64 1jgw h VAL 36 Ca -0.03 -1.73 -0.02 0.00 0.82 0.00 0.00 66.70 65.74 1jgw h VAL 36 Cb 1.32 1.69 -0.01 0.00 -1.52 0.00 0.00 31.29 32.76 1jgw h VAL 36 CO 0.15 0.54 0.07 0.00 0.02 0.00 0.00 177.57 178.35 1jgw h ALA 37 N 0.96 0.34 0.00 1.67 0.00 -1.25 -1.80 119.26 119.18 1jgw h ALA 37 Ca 0.02 -0.16 -0.04 0.00 0.00 0.00 0.00 54.91 54.73 1jgw h ALA 37 Cb 1.05 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.74 1jgw h ALA 37 CO 0.10 -0.02 -0.20 1.79 0.00 0.00 0.00 179.25 180.93 1jgw h THR 38 N 0.24 0.93 -0.34 0.00 1.35 -1.45 -1.54 112.91 112.10 1jgw h THR 38 Ca 0.08 -0.72 -0.13 0.00 -0.55 0.00 0.00 66.41 65.09 1jgw h THR 38 Cb 0.27 1.41 -0.01 0.00 -1.73 0.00 0.00 68.15 68.10 1jgw h THR 38 CO -0.00 0.19 -0.29 0.15 -0.25 0.00 0.00 175.52 175.32 1jgw h PHE 39 N 0.00 0.95 0.44 4.73 3.57 -1.35 -1.36 116.94 123.92 1jgw h PHE 39 Ca -0.00 -0.27 -0.01 0.00 3.53 0.00 0.00 57.97 61.21 1jgw h PHE 39 Cb 0.40 -0.20 -0.01 0.00 2.79 0.00 0.00 35.95 38.93 1jgw h PHE 39 CO 0.00 1.04 -0.31 0.35 -2.23 0.00 0.00 178.31 177.17 1jgw h PHE 40 N 0.57 -0.81 -0.87 0.41 3.57 -0.47 -1.65 116.94 117.70 1jgw h PHE 40 Ca 0.06 -0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.55 1jgw h PHE 40 Cb 0.86 0.30 -0.04 0.00 2.79 0.00 0.00 35.95 39.86 1jgw h PHE 40 CO 0.07 -0.46 0.52 0.74 -2.23 0.00 0.00 178.31 176.95 1jgw h PHE 41 N -0.73 1.14 -0.29 0.41 0.04 -1.34 -2.56 116.94 113.62 1jgw h PHE 41 Ca -0.05 -0.00 -0.06 0.00 2.80 0.00 0.00 57.97 60.66 1jgw h PHE 41 Cb 0.61 -0.38 -0.01 0.00 2.20 0.00 0.00 35.95 38.38 1jgw h PHE 41 CO -0.12 0.76 -0.07 0.00 -0.60 0.00 0.00 178.31 178.28 1jgw h ALA 42 N 1.28 0.39 0.12 2.45 0.00 -1.14 -0.96 119.26 121.41 1jgw h ALA 42 Ca 0.31 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 1jgw h ALA 42 Cb -0.05 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.64 1jgw h ALA 42 CO -0.06 0.22 -0.06 0.00 0.00 0.00 0.00 179.25 179.35 1jgw h ALA 43 N 0.78 -0.16 -0.24 0.00 0.00 -1.28 0.39 119.26 118.75 1jgw h ALA 43 Ca 0.07 -0.11 0.06 0.00 0.00 0.00 0.00 54.91 54.93 1jgw h ALA 43 Cb 0.56 0.06 -0.06 0.00 0.00 0.00 0.00 17.79 18.35 1jgw h ALA 43 CO 0.03 -0.50 -0.17 1.25 0.00 0.00 0.00 179.25 179.86 1jgw h LEU 44 N -0.34 -0.55 -1.29 0.00 5.85 -1.50 0.13 115.31 117.60 1jgw h LEU 44 Ca -0.02 0.11 0.00 0.00 0.84 0.00 0.00 57.88 58.82 1jgw h LEU 44 Cb 0.28 0.28 -0.03 0.00 0.37 0.00 0.00 40.66 41.55 1jgw h LEU 44 CO 0.03 -0.21 0.45 1.23 -0.34 0.00 0.00 178.44 179.60 1jgw h GLY 45 N -0.16 0.99 0.86 3.75 0.00 -1.04 -1.12 103.07 106.34 1jgw h GLY 45 Ca 0.13 -0.38 -0.07 0.00 0.00 0.00 0.00 47.33 47.02 1jgw h GLY 45 CO -0.33 0.37 -0.11 -2.22 0.00 0.00 0.00 176.54 174.24 1jgw h ILE 46 N 0.95 1.30 -0.07 2.60 2.04 0.22 -2.55 117.51 122.00 1jgw h ILE 46 Ca 0.25 -1.18 0.04 0.00 1.00 0.00 0.00 64.86 64.97 1jgw h ILE 46 Cb -0.09 1.55 -0.06 0.00 -0.74 0.00 0.00 36.82 37.48 1jgw h ILE 46 CO -0.05 0.37 -0.31 0.40 0.00 0.00 0.00 178.15 178.56 1jgw h ILE 47 N 0.24 0.32 -0.56 -0.67 2.04 -0.29 -1.02 117.51 117.57 1jgw h ILE 47 Ca 0.06 0.00 0.16 0.00 1.00 0.00 0.00 64.86 66.07 1jgw h ILE 47 Cb 0.61 0.32 -0.02 0.00 -0.74 0.00 0.00 36.82 36.99 1jgw h ILE 47 CO 0.03 0.00 0.40 -0.07 0.00 0.00 0.00 178.15 178.52 1jgw h LEU 48 N -0.42 0.04 -0.50 1.44 3.38 -1.14 0.32 115.31 118.43 1jgw h LEU 48 Ca 0.08 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.95 1jgw h LEU 48 Cb 0.53 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.26 1jgw h LEU 48 CO -0.30 0.02 -0.49 0.40 0.09 0.00 0.00 178.44 178.15 1jgw h ILE 49 N 0.04 0.98 -0.08 1.22 2.04 -0.78 -2.20 117.51 118.74 1jgw h ILE 49 Ca 0.27 -1.99 -0.23 0.00 1.00 0.00 0.00 64.86 63.91 1jgw h ILE 49 Cb 1.01 2.21 0.01 0.00 -0.74 0.00 0.00 36.82 39.31 1jgw h ILE 49 CO -0.01 0.48 -0.87 0.00 0.00 0.00 0.00 178.15 177.75 1jgw h ALA 50 N 1.51 0.31 0.00 1.87 0.00 0.33 -1.85 119.26 121.42 1jgw h ALA 50 Ca -0.00 -0.64 -0.01 0.00 0.00 0.00 0.00 54.91 54.25 1jgw h ALA 50 Cb 1.17 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.96 1jgw h ALA 50 CO 0.06 0.71 -0.05 2.35 0.00 0.00 0.00 179.25 182.33 1jgw h TRP 51 N 0.42 0.00 0.00 0.00 7.01 -1.17 -1.44 115.95 120.77 1jgw h TRP 51 Ca -0.08 0.00 -0.16 0.00 2.11 0.00 0.00 58.89 60.77 1jgw h TRP 51 Cb 1.50 0.00 -0.02 0.00 -2.10 0.00 0.00 29.16 28.54 1jgw h TRP 51 CO 0.08 0.05 -0.74 1.03 -2.79 0.00 0.00 178.44 176.07 1jgw h SER 52 N 0.00 0.00 -0.28 2.65 0.87 -1.18 -3.08 113.55 112.54 1jgw h SER 52 Ca -0.00 0.00 -0.07 0.00 -1.23 0.00 0.00 61.79 60.48 1jgw h SER 52 Cb 0.65 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.60 1jgw h SER 52 CO 0.01 0.74 -0.12 0.00 -0.53 0.00 0.00 176.83 176.93 1jgw h ALA 53 N 1.26 0.39 -0.08 6.23 0.00 -0.42 -2.59 119.26 124.05 1jgw h ALA 53 Ca -0.01 -0.31 -0.00 0.00 0.00 0.00 0.00 54.91 54.59 1jgw h ALA 53 Cb 1.56 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 19.25 1jgw h ALA 53 CO 0.10 0.25 0.04 -0.39 0.00 0.00 0.00 179.25 179.25 1jgw h VAL 54 N 0.31 1.09 -0.64 0.00 -1.51 -1.49 -1.06 116.25 112.96 1jgw h VAL 54 Ca 0.06 -0.27 0.07 0.00 -1.23 0.00 0.00 66.70 65.34 1jgw h VAL 54 Cb 0.63 1.12 -0.04 0.00 -2.13 0.00 0.00 31.29 30.87 1jgw h VAL 54 CO 0.04 0.08 0.42 -0.07 -1.23 0.00 0.00 177.57 176.81 1jgw h LEU 55 N 0.03 0.52 -0.45 4.19 3.38 -1.56 -0.98 115.31 120.44 1jgw h LEU 55 Ca 0.03 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.90 1jgw h LEU 55 Cb 0.09 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.72 1jgw h LEU 55 CO -0.00 0.33 -0.48 -0.61 0.09 0.00 0.00 178.44 177.77 1jgw h GLN 56 N 0.59 0.00 0.00 1.13 4.15 -1.08 -3.48 115.11 116.42 1jgw h GLN 56 Ca 0.28 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.70 1jgw h GLN 56 Cb 0.34 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.03 1jgw h GLN 56 CO -0.09 0.48 0.00 0.41 -1.93 0.00 0.00 178.83 177.70 1jgw n GLY 57 N 0.77 0.92 3.43 2.39 0.00 -0.37 -5.08 105.19 107.25 1jgw n GLY 57 Ca 0.01 -0.56 -0.16 0.00 0.00 0.00 0.00 46.02 45.30 1jgw n GLY 57 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1jgw s THR 58 N -2.00 0.02 -0.76 2.61 -1.32 -1.05 -5.02 115.64 108.12 1jgw s THR 58 Ca 0.00 -0.15 0.08 0.00 -1.21 0.00 0.00 61.69 60.40 1jgw s THR 58 Cb 0.00 -0.87 0.16 0.00 -1.51 0.00 0.00 72.50 70.28 1jgw s THR 58 CO 0.00 -0.08 1.03 0.79 -2.21 0.00 0.00 174.62 174.15 1jgw n TRP 59 N 1.06 0.22 -2.42 9.09 5.03 -1.26 -4.54 117.44 124.62 1jgw n TRP 59 Ca -0.20 -0.33 -0.43 0.00 3.03 0.00 0.00 57.50 59.57 1jgw n TRP 59 Cb 0.57 -0.02 -0.02 0.00 -1.03 0.00 0.00 31.31 30.80 1jgw n TRP 59 CO 0.00 0.00 0.00 1.21 -0.03 0.00 0.00 177.69 178.87 1jgw s ASN 60 N -0.88 6.81 0.48 -0.99 3.84 -1.26 -4.89 114.94 118.04 1jgw s ASN 60 Ca 0.14 1.47 0.19 0.00 0.21 0.00 0.00 52.86 54.87 1jgw s ASN 60 Cb 0.08 -2.54 1.20 0.00 -0.55 0.00 0.00 41.25 39.44 1jgw s ASN 60 CO 0.11 -0.92 1.98 -0.65 -2.79 0.00 0.00 177.10 174.83 1jgw h PRO 61 N 8.75 0.22 -0.00 0.43 0.11 -1.94 0.24 132.00 139.81 1jgw h PRO 61 Ca -0.26 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.83 1jgw h PRO 61 Cb 1.10 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.16 1jgw h PRO 61 CO 1.00 0.14 -0.03 1.04 -0.21 0.00 0.00 178.00 179.95 1jgw n GLN 62 N -4.44 0.49 -0.01 1.05 6.02 -1.26 -3.96 117.38 115.26 1jgw n GLN 62 Ca 0.10 -0.04 -0.02 0.00 -0.01 0.00 0.00 57.00 57.03 1jgw n GLN 62 Cb 0.48 -1.50 -0.02 0.00 1.02 0.00 0.00 30.24 30.23 1jgw n GLN 62 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 1jgw n LEU 63 N -1.22 0.81 -4.65 1.08 4.77 0.40 -4.65 117.00 113.55 1jgw n LEU 63 Ca 0.15 -0.00 -0.44 0.00 -0.03 0.00 0.00 56.01 55.68 1jgw n LEU 63 Cb 0.25 0.02 -0.02 0.00 -2.33 0.00 0.00 43.42 41.33 1jgw n LEU 63 CO 0.23 0.20 0.80 -0.38 -1.33 0.00 0.00 177.39 176.91 1jgw n ILE 64 N -2.23 1.71 -3.60 -0.08 5.41 0.57 -4.99 119.36 116.16 1jgw n ILE 64 Ca -0.05 -0.43 -0.03 0.00 1.00 0.00 0.00 62.75 63.25 1jgw n ILE 64 Cb 0.58 -1.31 -0.06 0.00 -0.71 0.00 0.00 39.64 38.14 1jgw n ILE 64 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 176.55 176.00 1jgw s SER 65 N -0.25 -0.84 -0.29 4.38 0.15 -1.26 -4.51 113.70 111.08 1jgw s SER 65 Ca 0.60 1.25 -0.14 0.00 0.70 0.00 0.00 55.95 58.36 1jgw s SER 65 Cb -0.65 1.65 -0.03 0.00 -1.71 0.00 0.00 66.02 65.28 1jgw s SER 65 CO 0.58 -0.19 0.32 -0.69 1.20 0.00 0.00 173.24 174.47 1jgw s VAL 66 N 2.07 5.21 0.06 4.45 1.01 -0.70 -4.95 120.40 127.55 1jgw s VAL 66 Ca -0.07 0.30 -0.04 0.00 0.00 0.00 0.00 61.98 62.17 1jgw s VAL 66 Cb -0.07 -3.69 -0.05 0.00 0.00 0.00 0.00 36.38 32.57 1jgw s VAL 66 CO -0.18 0.10 0.28 -0.31 0.00 0.00 0.00 175.10 174.99 1jgw s TYR 67 N 1.97 3.53 0.96 5.22 2.02 -1.26 -1.80 117.35 127.99 1jgw s TYR 67 Ca 0.12 0.46 -0.14 0.00 -0.37 0.00 0.00 57.07 57.14 1jgw s TYR 67 Cb -0.16 -1.92 0.17 0.00 -0.40 0.00 0.00 41.96 39.65 1jgw s TYR 67 CO 0.11 0.56 1.16 -1.25 -1.57 0.00 0.00 175.55 174.55 1jgw s PRO 68 N -2.25 0.75 0.72 -1.71 0.04 -1.26 -3.78 135.00 127.50 1jgw s PRO 68 Ca 0.34 0.16 -0.16 0.00 0.04 0.00 0.00 61.00 61.38 1jgw s PRO 68 Cb -0.13 -1.81 0.03 0.00 0.04 0.00 0.00 34.50 32.64 1jgw s PRO 68 CO 0.22 -2.44 1.24 -2.14 0.04 0.00 0.00 177.00 173.92 1jgw s PRO 69 N -5.36 2.19 0.51 0.56 0.02 -1.26 -4.44 135.00 127.22 1jgw s PRO 69 Ca 0.66 1.87 -0.19 0.00 0.02 0.00 0.00 61.00 63.36 1jgw s PRO 69 Cb -0.13 -1.83 -0.07 0.00 0.02 0.00 0.00 34.50 32.49 1jgw s PRO 69 CO 0.54 -1.83 1.05 0.00 -0.33 0.00 0.00 177.00 176.43 1jgw s ALA 70 N -1.80 2.84 0.50 -1.55 0.00 -1.26 -3.26 121.76 117.22 1jgw s ALA 70 Ca 0.77 0.59 0.35 0.00 0.00 0.00 0.00 51.96 53.66 1jgw s ALA 70 Cb -0.32 -3.26 1.48 0.00 0.00 0.00 0.00 23.12 21.02 1jgw s ALA 70 CO 0.44 -0.43 1.72 -0.07 0.00 0.00 0.00 175.76 177.42 1jgw h LEU 71 N 1.33 0.13 -0.70 0.00 3.38 -1.92 0.17 115.31 117.70 1jgw h LEU 71 Ca -0.49 0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.52 1jgw h LEU 71 Cb 1.22 0.03 0.00 0.00 0.09 0.00 0.00 40.66 42.00 1jgw h LEU 71 CO 0.59 -0.02 0.07 -0.62 0.09 0.00 0.00 178.44 178.55 1jgw n GLU 72 N -4.31 0.07 0.00 1.13 -0.58 -1.26 -0.43 120.64 115.26 1jgw n GLU 72 Ca 0.31 0.54 0.11 0.00 -0.42 0.00 0.00 57.16 57.71 1jgw n GLU 72 Cb 1.36 -1.79 0.07 0.00 -0.57 0.00 0.00 31.44 30.50 1jgw n GLU 72 CO 0.00 0.00 0.00 0.66 -0.48 0.00 0.00 177.13 177.31 1jgw n TYR 73 N -1.86 0.00 -0.34 -0.32 4.01 0.59 -5.04 117.16 114.21 1jgw n TYR 73 Ca -0.01 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.73 1jgw n TYR 73 Cb 0.08 -0.04 0.00 0.00 -0.31 0.00 0.00 39.34 39.07 1jgw n TYR 73 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1jgw n GLY 74 N 1.43 3.11 1.46 2.72 0.00 0.43 -1.35 105.19 112.98 1jgw n GLY 74 Ca 0.08 -0.08 0.09 0.00 0.00 0.00 0.00 46.02 46.11 1jgw n GLY 74 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1jgw n LEU 75 N 0.00 4.58 -4.97 0.99 4.77 -1.25 -1.84 117.00 119.28 1jgw n LEU 75 Ca 0.00 -2.48 -0.25 0.00 -0.03 0.00 0.00 56.01 53.25 1jgw n LEU 75 Cb 0.00 -0.55 0.12 0.00 -2.33 0.00 0.00 43.42 40.66 1jgw n LEU 75 CO 0.00 0.79 0.64 -0.83 -1.33 0.00 0.00 177.39 176.66 1jgw s GLY 76 N -1.01 1.76 0.65 -0.72 0.00 -0.46 -4.97 107.32 102.57 1jgw s GLY 76 Ca 0.48 -1.44 -0.12 0.00 0.00 0.00 0.00 44.72 43.64 1jgw s GLY 76 CO 0.22 -0.86 1.04 -0.32 0.00 0.00 0.00 173.10 173.19 1jgw s GLY 77 N -4.73 1.74 0.10 0.20 0.00 -1.26 -4.97 107.32 98.40 1jgw s GLY 77 Ca 0.67 0.07 0.01 0.00 0.00 0.00 0.00 44.72 45.47 1jgw s GLY 77 CO 0.46 0.36 -0.04 0.00 0.00 0.00 0.00 173.10 173.89 1jgw s ALA 78 N -3.00 0.94 0.36 3.20 0.00 -1.26 -5.04 121.76 116.96 1jgw s ALA 78 Ca 0.58 -1.37 -0.28 0.00 0.00 0.00 0.00 51.96 50.88 1jgw s ALA 78 Cb -0.13 0.31 -0.11 0.00 0.00 0.00 0.00 23.12 23.18 1jgw s ALA 78 CO 0.51 -0.30 1.51 -2.30 0.00 0.00 0.00 175.76 175.19 1jgw n PRO 79 N -0.05 2.67 -0.19 0.00 -0.02 -1.26 -3.21 135.00 132.94 1jgw n PRO 79 Ca -0.11 0.94 -0.04 0.00 -2.02 0.00 0.00 63.50 62.27 1jgw n PRO 79 Cb 0.61 -2.68 0.02 0.00 -0.02 0.00 0.00 33.50 31.43 1jgw n PRO 79 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 1jgw h LEU 80 N 3.38 -1.02 -1.31 2.45 3.38 -1.91 0.36 115.31 120.64 1jgw h LEU 80 Ca -0.50 0.21 0.00 0.00 0.09 0.00 0.00 57.88 57.69 1jgw h LEU 80 Cb 1.24 0.52 0.00 0.00 0.09 0.00 0.00 40.66 42.51 1jgw h LEU 80 CO 0.68 -0.29 0.18 0.00 0.09 0.00 0.00 178.44 179.09 1jgw h ALA 81 N 1.11 1.13 -1.61 1.53 0.00 -1.97 -2.94 119.26 116.51 1jgw h ALA 81 Ca 0.24 0.00 -0.48 0.00 0.00 0.00 0.00 54.91 54.67 1jgw h ALA 81 Cb 0.53 0.00 -0.34 0.00 0.00 0.00 0.00 17.79 17.98 1jgw h ALA 81 CO -0.65 -0.13 -1.00 1.63 0.00 0.00 0.00 179.25 179.10 1jgw n LYS 82 N -2.27 0.77 0.00 0.00 5.02 0.11 -4.95 118.16 116.84 1jgw n LYS 82 Ca -0.01 -2.96 0.00 0.00 -2.02 0.00 0.00 58.31 53.32 1jgw n LYS 82 Cb 0.21 -1.31 0.00 0.00 -0.02 0.00 0.00 35.03 33.90 1jgw n LYS 82 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1jgw n GLY 83 N 1.26 2.65 0.07 0.72 0.00 -1.14 -4.27 105.19 104.47 1jgw n GLY 83 Ca 0.19 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.08 1jgw n GLY 83 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1jgw h GLY 84 N 0.00 -0.04 0.56 -0.02 0.00 -1.08 -1.98 103.07 100.52 1jgw h GLY 84 Ca 0.00 0.01 0.10 0.00 0.00 0.00 0.00 47.33 47.45 1jgw h GLY 84 CO 0.00 -0.01 0.64 1.41 0.00 0.00 0.00 176.54 178.57 1jgw h LEU 85 N -0.47 0.96 -0.51 3.11 3.38 -1.75 -0.59 115.31 119.44 1jgw h LEU 85 Ca -0.00 0.04 -0.05 0.00 0.09 0.00 0.00 57.88 57.95 1jgw h LEU 85 Cb 0.44 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.01 1jgw h LEU 85 CO 0.01 0.54 0.13 -0.25 0.09 0.00 0.00 178.44 178.97 1jgw h TRP 86 N 1.05 0.85 -0.47 1.13 7.01 -1.78 -0.08 115.95 123.66 1jgw h TRP 86 Ca 0.48 -0.10 -0.02 0.00 2.11 0.00 0.00 58.89 61.36 1jgw h TRP 86 Cb 0.39 -0.24 -0.02 0.00 -2.10 0.00 0.00 29.16 27.19 1jgw h TRP 86 CO -0.00 0.74 0.22 1.96 -2.79 0.00 0.00 178.44 178.58 1jgw h GLN 87 N 0.70 0.68 -0.31 2.65 4.20 -0.45 -1.75 115.11 120.83 1jgw h GLN 87 Ca 0.16 -0.10 -0.04 0.00 0.06 0.00 0.00 58.65 58.73 1jgw h GLN 87 Cb 0.32 -0.12 -0.01 0.00 0.30 0.00 0.00 27.48 27.96 1jgw h GLN 87 CO -0.00 0.58 0.04 0.82 -0.67 0.00 0.00 178.83 179.60 1jgw h ILE 88 N 0.62 1.24 -1.01 2.54 2.04 -0.96 -2.69 117.51 119.29 1jgw h ILE 88 Ca 0.16 -0.84 0.02 0.00 1.00 0.00 0.00 64.86 65.21 1jgw h ILE 88 Cb 0.12 1.18 -0.05 0.00 -0.74 0.00 0.00 36.82 37.33 1jgw h ILE 88 CO -0.02 0.28 0.66 0.40 0.00 0.00 0.00 178.15 179.47 1jgw h ILE 89 N 0.34 1.22 -0.10 -0.67 2.04 -0.90 -1.22 117.51 118.22 1jgw h ILE 89 Ca 0.09 -0.45 -0.04 0.00 1.00 0.00 0.00 64.86 65.46 1jgw h ILE 89 Cb 0.36 -0.22 -0.01 0.00 -0.74 0.00 0.00 36.82 36.21 1jgw h ILE 89 CO 0.01 0.24 -0.12 0.74 0.00 0.00 0.00 178.15 179.02 1jgw h THR 90 N 1.32 1.15 -0.20 -0.27 2.02 -1.17 0.60 112.91 116.35 1jgw h THR 90 Ca 0.39 -0.65 -0.14 0.00 0.77 0.00 0.00 66.41 66.77 1jgw h THR 90 Cb -0.08 1.21 0.00 0.00 -1.74 0.00 0.00 68.15 67.55 1jgw h THR 90 CO -0.10 0.20 -0.43 0.40 0.37 0.00 0.00 175.52 175.95 1jgw h ILE 91 N 0.14 1.32 -0.64 3.11 2.04 -0.95 -0.80 117.51 121.74 1jgw h ILE 91 Ca 0.03 -1.66 -0.08 0.00 1.00 0.00 0.00 64.86 64.15 1jgw h ILE 91 Cb 0.31 1.86 -0.03 0.00 -0.74 0.00 0.00 36.82 38.23 1jgw h ILE 91 CO 0.02 0.52 0.09 0.00 0.00 0.00 0.00 178.15 178.78 1jgw h ALA 93 N 1.10 -0.45 -0.79 0.00 0.00 0.24 -0.76 119.26 118.62 1jgw h ALA 93 Ca 0.19 -0.11 0.08 0.00 0.00 0.00 0.00 54.91 55.08 1jgw h ALA 93 Cb 0.44 0.17 -0.07 0.00 0.00 0.00 0.00 17.79 18.34 1jgw h ALA 93 CO 0.01 -0.74 0.45 1.15 0.00 0.00 0.00 179.25 180.13 1jgw h THR 94 N -0.47 0.94 -0.35 0.00 2.02 -0.92 -1.29 112.91 112.83 1jgw h THR 94 Ca -0.05 -0.27 -0.04 0.00 0.77 0.00 0.00 66.41 66.82 1jgw h THR 94 Cb 0.36 0.09 -0.02 0.00 -1.74 0.00 0.00 68.15 66.84 1jgw h THR 94 CO 0.07 0.14 0.03 1.23 0.37 0.00 0.00 175.52 177.37 1jgw h GLY 95 N 0.78 0.57 1.66 2.16 0.00 -0.37 -2.56 103.07 105.32 1jgw h GLY 95 Ca 0.37 -0.32 -0.23 0.00 0.00 0.00 0.00 47.33 47.15 1jgw h GLY 95 CO -0.22 0.30 -1.00 0.00 0.00 0.00 0.00 176.54 175.62 1jgw h ALA 96 N 1.52 0.35 -0.04 3.60 0.00 -0.28 -2.91 119.26 121.49 1jgw h ALA 96 Ca 0.11 -0.77 -0.02 0.00 0.00 0.00 0.00 54.91 54.24 1jgw h ALA 96 Cb 0.29 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.04 1jgw h ALA 96 CO 0.01 0.91 -0.04 0.74 0.00 0.00 0.00 179.25 180.86 1jgw h PHE 97 N 0.14 0.12 -0.41 0.00 0.04 -1.11 -2.05 116.94 113.67 1jgw h PHE 97 Ca -0.08 -0.04 -0.01 0.00 2.80 0.00 0.00 57.97 60.65 1jgw h PHE 97 Cb 1.66 -0.03 -0.02 0.00 2.20 0.00 0.00 35.95 39.77 1jgw h PHE 97 CO 0.05 0.55 0.22 0.28 -0.60 0.00 0.00 178.31 178.81 1jgw h VAL 98 N -0.34 1.16 -0.88 -0.55 2.07 -1.59 -1.63 116.25 114.48 1jgw h VAL 98 Ca 0.01 -0.41 0.05 0.00 0.82 0.00 0.00 66.70 67.17 1jgw h VAL 98 Cb 0.53 0.68 -0.06 0.00 -1.52 0.00 0.00 31.29 30.92 1jgw h VAL 98 CO 0.01 0.17 0.56 0.28 0.02 0.00 0.00 177.57 178.60 1jgw h SER 99 N 0.53 0.89 -0.75 0.57 0.02 -1.56 -0.99 113.55 112.27 1jgw h SER 99 Ca 0.14 0.01 -0.04 0.00 -0.84 0.00 0.00 61.79 61.07 1jgw h SER 99 Cb 0.07 -0.18 -0.03 0.00 0.14 0.00 0.00 62.40 62.39 1jgw h SER 99 CO -0.02 0.59 0.33 -0.25 -1.14 0.00 0.00 176.83 176.33 1jgw h TRP 100 N 1.04 1.12 -0.05 3.45 2.91 -0.95 -0.53 115.95 122.94 1jgw h TRP 100 Ca 0.37 -0.07 -0.00 0.00 1.13 0.00 0.00 58.89 60.32 1jgw h TRP 100 Cb 0.11 -0.34 -0.00 0.00 -0.51 0.00 0.00 29.16 28.42 1jgw h TRP 100 CO -0.02 0.84 0.03 0.00 -1.03 0.00 0.00 178.44 178.25 1jgw h ALA 101 N 1.16 0.06 0.00 2.65 0.00 -0.27 -1.70 119.26 121.16 1jgw h ALA 101 Ca 0.25 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 55.09 1jgw h ALA 101 Cb 0.17 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 1jgw h ALA 101 CO -0.03 -0.41 -0.21 -0.07 0.00 0.00 0.00 179.25 178.53 1jgw h LEU 102 N 0.01 0.00 -0.69 0.00 3.38 -1.01 -0.79 115.31 116.21 1jgw h LEU 102 Ca 0.02 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.85 1jgw h LEU 102 Cb 0.05 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 1jgw h LEU 102 CO -0.00 0.21 -0.43 -0.09 0.09 0.00 0.00 178.44 178.21 1jgw h ARG 103 N 0.00 0.50 -0.60 1.13 2.43 -0.68 -2.42 114.38 114.73 1jgw h ARG 103 Ca -0.00 -0.26 -0.07 0.00 -0.81 0.00 0.00 59.98 58.84 1jgw h ARG 103 Cb 0.45 0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.98 1jgw h ARG 103 CO 0.03 0.84 0.10 0.93 -1.51 0.00 0.00 179.97 180.35 1jgw h GLU 104 N 0.40 0.99 -0.98 0.20 5.08 -0.24 -2.05 114.58 117.98 1jgw h GLU 104 Ca 0.03 -0.27 0.08 0.00 -1.00 0.00 0.00 59.36 58.20 1jgw h GLU 104 Cb 0.93 -0.12 -0.07 0.00 0.50 0.00 0.00 28.75 29.99 1jgw h GLU 104 CO 0.08 0.94 0.63 0.28 -1.00 0.00 0.00 179.01 179.94 1jgw h VAL 105 N 0.90 1.05 -0.14 3.13 2.07 -1.03 0.57 116.25 122.79 1jgw h VAL 105 Ca 0.18 -0.38 -0.04 0.00 0.82 0.00 0.00 66.70 67.29 1jgw h VAL 105 Cb 0.42 -0.15 -0.00 0.00 -1.52 0.00 0.00 31.29 30.04 1jgw h VAL 105 CO 0.01 0.20 -0.05 -0.33 0.02 0.00 0.00 177.57 177.42 1jgw h GLU 106 N 1.10 0.29 -0.83 1.57 5.08 -1.04 -0.75 114.58 119.99 1jgw h GLU 106 Ca 0.43 -0.12 0.12 0.00 -1.00 0.00 0.00 59.36 58.80 1jgw h GLU 106 Cb 0.25 -0.01 -0.06 0.00 0.50 0.00 0.00 28.75 29.42 1jgw h GLU 106 CO -0.18 0.59 0.54 0.82 -1.00 0.00 0.00 179.01 179.78 1jgw h ILE 107 N -0.03 0.90 -0.18 3.13 2.04 -0.81 -1.09 117.51 121.47 1jgw h ILE 107 Ca 0.04 -0.24 -0.00 0.00 1.00 0.00 0.00 64.86 65.65 1jgw h ILE 107 Cb 0.49 0.13 -0.01 0.00 -0.74 0.00 0.00 36.82 36.70 1jgw h ILE 107 CO 0.02 0.13 0.09 0.00 0.00 0.00 0.00 178.15 178.39 1jgw h ARG 109 N 0.18 0.00 0.08 0.00 3.08 0.10 -2.35 114.38 115.46 1jgw h ARG 109 Ca 0.06 0.00 -0.28 0.00 0.07 0.00 0.00 59.98 59.83 1jgw h ARG 109 Cb 0.09 0.00 0.02 0.00 0.08 0.00 0.00 29.97 30.16 1jgw h ARG 109 CO -0.01 0.21 -1.16 -0.22 -1.07 0.00 0.00 179.97 177.72 1jgw h LYS 110 N 0.00 0.61 -0.00 0.04 3.64 -1.23 -3.26 116.57 116.37 1jgw h LYS 110 Ca -0.00 -0.76 0.00 0.00 -1.27 0.00 0.00 60.65 58.62 1jgw h LYS 110 Cb 0.53 0.24 0.00 0.00 -0.41 0.00 0.00 32.23 32.59 1jgw h LYS 110 CO 0.03 1.33 -0.04 1.28 -2.27 0.00 0.00 179.45 179.78 1jgw n LEU 111 N -3.79 0.16 -1.10 5.20 4.77 -0.96 -4.93 117.00 116.34 1jgw n LEU 111 Ca -0.12 0.18 -0.13 0.00 -0.03 0.00 0.00 56.01 55.91 1jgw n LEU 111 Cb 0.95 -0.24 -0.04 0.00 -2.33 0.00 0.00 43.42 41.76 1jgw n LEU 111 CO 0.57 0.03 -0.13 0.61 -1.33 0.00 0.00 177.39 177.13 1jgw n GLY 112 N 1.27 0.98 3.80 -0.72 0.00 -0.90 -5.02 105.19 104.59 1jgw n GLY 112 Ca 0.15 -0.41 -0.21 0.00 0.00 0.00 0.00 46.02 45.55 1jgw n GLY 112 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1jgw n ILE 113 N -2.98 0.00 -1.68 -0.61 -5.35 -1.16 -5.07 119.36 102.52 1jgw n ILE 113 Ca -0.13 -1.97 -0.30 0.00 -0.27 0.00 0.00 62.75 60.08 1jgw n ILE 113 Cb 0.47 -0.38 0.08 0.00 -1.74 0.00 0.00 39.64 38.07 1jgw n ILE 113 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 1jgw s GLY 114 N -4.46 1.62 -0.11 3.28 0.00 -1.26 -4.76 107.32 101.63 1jgw s GLY 114 Ca 0.51 -0.31 0.11 0.00 0.00 0.00 0.00 44.72 45.03 1jgw s GLY 114 CO 0.32 0.12 1.35 -1.72 0.00 0.00 0.00 173.10 173.17 1jgw n TYR 115 N -3.32 1.17 -0.32 1.90 4.01 -1.26 -4.57 117.16 114.77 1jgw n TYR 115 Ca 0.07 -0.44 0.09 0.00 -0.16 0.00 0.00 57.90 57.47 1jgw n TYR 115 Cb 0.57 -0.26 0.30 0.00 -0.31 0.00 0.00 39.34 39.65 1jgw n TYR 115 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 1jgw h HIS 116 N 2.76 1.00 0.70 -0.72 3.86 -1.99 -2.72 115.15 118.03 1jgw h HIS 116 Ca 0.00 0.03 -0.03 0.00 -1.16 0.00 0.00 60.37 59.20 1jgw h HIS 116 Cb 1.24 -0.32 0.01 0.00 1.06 0.00 0.00 27.41 29.40 1jgw h HIS 116 CO 0.61 0.38 -0.33 0.82 0.86 0.00 0.00 177.93 180.27 1jgw h ILE 117 N 0.85 0.00 -0.28 2.45 2.04 -2.00 -1.15 117.51 119.42 1jgw h ILE 117 Ca 0.48 -0.15 0.08 0.00 1.00 0.00 0.00 64.86 66.27 1jgw h ILE 117 Cb 0.60 0.00 -0.01 0.00 -0.74 0.00 0.00 36.82 36.67 1jgw h ILE 117 CO -0.24 0.00 0.22 1.55 0.00 0.00 0.00 178.15 179.68 1jgw h PRO 118 N -1.08 0.00 -0.30 2.37 0.13 -1.87 -0.75 132.00 130.50 1jgw h PRO 118 Ca -0.10 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.99 1jgw h PRO 118 Cb 0.72 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.84 1jgw h PRO 118 CO 0.16 0.00 -0.00 0.35 -0.23 0.00 0.00 178.00 178.27 1jgw h PHE 119 N 0.00 0.58 -0.64 1.56 3.57 -1.37 -1.97 116.94 118.67 1jgw h PHE 119 Ca 0.13 -0.10 -0.08 0.00 3.53 0.00 0.00 57.97 61.45 1jgw h PHE 119 Cb 0.58 -0.15 -0.02 0.00 2.79 0.00 0.00 35.95 39.15 1jgw h PHE 119 CO 0.00 0.67 0.08 0.00 -2.23 0.00 0.00 178.31 176.82 1jgw h ALA 120 N 0.83 0.85 -0.96 2.41 0.00 0.12 -2.85 119.26 119.66 1jgw h ALA 120 Ca 0.08 -0.28 0.01 0.00 0.00 0.00 0.00 54.91 54.72 1jgw h ALA 120 Cb 0.44 -0.24 -0.05 0.00 0.00 0.00 0.00 17.79 17.95 1jgw h ALA 120 CO 0.02 0.63 0.62 0.35 0.00 0.00 0.00 179.25 180.87 1jgw h PHE 121 N 0.98 1.22 -0.33 0.00 3.57 -1.09 -1.99 116.94 119.30 1jgw h PHE 121 Ca 0.19 0.02 0.10 0.00 3.53 0.00 0.00 57.97 61.81 1jgw h PHE 121 Cb 0.47 -0.41 -0.01 0.00 2.79 0.00 0.00 35.95 38.79 1jgw h PHE 121 CO 0.03 0.78 0.35 0.00 -2.23 0.00 0.00 178.31 177.24 1jgw h ALA 122 N 1.38 2.02 -0.07 2.41 0.00 -1.11 0.18 119.26 124.07 1jgw h ALA 122 Ca 0.35 -0.01 -0.13 0.00 0.00 0.00 0.00 54.91 55.12 1jgw h ALA 122 Cb -0.13 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 1jgw h ALA 122 CO -0.07 -0.52 -0.54 0.74 0.00 0.00 0.00 179.25 178.86 1jgw h PHE 123 N 0.00 0.25 -0.34 0.00 -1.00 -1.43 -1.33 116.94 113.09 1jgw h PHE 123 Ca 0.16 -0.09 -0.13 0.00 2.81 0.00 0.00 57.97 60.72 1jgw h PHE 123 Cb 0.85 -0.05 -0.01 0.00 3.61 0.00 0.00 35.95 40.35 1jgw h PHE 123 CO 0.00 0.70 -0.29 0.00 -1.61 0.00 0.00 178.31 177.11 1jgw h ALA 124 N 1.28 0.50 -0.84 2.45 0.00 -1.08 -2.13 119.26 119.45 1jgw h ALA 124 Ca 0.00 -0.41 0.02 0.00 0.00 0.00 0.00 54.91 54.52 1jgw h ALA 124 Cb 1.00 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 18.64 1jgw h ALA 124 CO 0.08 0.52 0.55 0.82 0.00 0.00 0.00 179.25 181.23 1jgw h ILE 125 N 0.59 1.18 -0.33 0.00 2.04 -1.30 -1.07 117.51 118.62 1jgw h ILE 125 Ca 0.06 -0.37 -0.08 0.00 1.00 0.00 0.00 64.86 65.46 1jgw h ILE 125 Cb 0.86 -0.01 -0.02 0.00 -0.74 0.00 0.00 36.82 36.92 1jgw h ILE 125 CO 0.07 0.20 -0.14 0.25 0.00 0.00 0.00 178.15 178.53 1jgw h LEU 126 N 1.09 0.57 -0.35 1.44 5.85 -0.99 -0.87 115.31 122.05 1jgw h LEU 126 Ca 0.32 -0.16 -0.07 0.00 0.84 0.00 0.00 57.88 58.81 1jgw h LEU 126 Cb -0.06 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 40.81 1jgw h LEU 126 CO -0.08 0.74 -0.06 0.00 -0.34 0.00 0.00 178.44 178.70 1jgw h ALA 127 N 1.32 0.48 0.41 1.25 0.00 -0.56 -1.95 119.26 120.21 1jgw h ALA 127 Ca 0.09 -0.28 -0.02 0.00 0.00 0.00 0.00 54.91 54.70 1jgw h ALA 127 Cb 0.56 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.22 1jgw h ALA 127 CO 0.04 0.30 -0.22 -0.92 0.00 0.00 0.00 179.25 178.45 1jgw h TYR 128 N 0.46 -0.57 -0.14 0.00 3.20 -0.99 -2.49 116.97 116.44 1jgw h TYR 128 Ca 0.09 -0.01 0.04 0.00 3.14 0.00 0.00 58.73 61.99 1jgw h TYR 128 Cb 0.55 0.20 -0.01 0.00 1.54 0.00 0.00 36.73 39.01 1jgw h TYR 128 CO 0.05 -0.35 0.12 -0.07 -1.64 0.00 0.00 178.16 176.27 1jgw h LEU 129 N -0.59 0.00 -0.81 2.82 3.38 -1.14 -1.30 115.31 117.68 1jgw h LEU 129 Ca -0.05 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.81 1jgw h LEU 129 Cb 0.46 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.20 1jgw h LEU 129 CO 0.07 0.00 -0.27 0.74 0.09 0.00 0.00 178.44 179.08 1jgw h THR 130 N 0.00 1.27 0.00 0.22 2.02 -0.89 0.12 112.91 115.65 1jgw h THR 130 Ca 0.06 -1.34 -0.14 0.00 0.77 0.00 0.00 66.41 65.77 1jgw h THR 130 Cb 0.30 1.33 -0.02 0.00 -1.74 0.00 0.00 68.15 68.03 1jgw h THR 130 CO -0.00 0.43 -0.91 -0.07 0.37 0.00 0.00 175.52 175.34 1jgw h LEU 131 N 0.52 0.00 -0.55 2.58 3.38 -1.07 -1.43 115.31 118.74 1jgw h LEU 131 Ca 0.07 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.04 1jgw h LEU 131 Cb 0.73 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.48 1jgw h LEU 131 CO 0.06 0.55 -0.18 1.33 0.09 0.00 0.00 178.44 180.29 1jgw n VAL 132 N -3.09 0.00 0.00 1.22 0.24 -0.98 -4.15 118.33 111.57 1jgw n VAL 132 Ca -0.03 -0.41 0.00 0.00 -2.04 0.00 0.00 64.34 61.86 1jgw n VAL 132 Cb 0.79 1.07 0.00 0.00 -1.47 0.00 0.00 33.84 34.22 1jgw n VAL 132 CO 0.00 0.00 0.00 -0.11 -2.14 0.00 0.00 176.83 174.58 1jgw n LEU 133 N -0.49 0.00 0.12 1.34 0.00 0.10 -4.80 117.00 113.28 1jgw n LEU 133 Ca 0.03 0.00 -0.13 0.00 0.00 0.00 0.00 56.01 55.91 1jgw n LEU 133 Cb 0.14 0.00 -0.06 0.00 0.00 0.00 0.00 43.42 43.50 1jgw n LEU 133 CO 0.10 -0.50 0.66 -0.26 0.00 0.00 0.00 177.39 177.39 1jgw h PHE 134 N 0.00 -0.82 0.16 1.96 0.04 -1.00 -1.69 116.94 115.58 1jgw h PHE 134 Ca 0.00 0.02 0.00 0.00 2.80 0.00 0.00 57.97 60.79 1jgw h PHE 134 Cb 0.00 0.34 -0.01 0.00 2.20 0.00 0.00 35.95 38.48 1jgw h PHE 134 CO 0.00 -0.41 -0.15 -0.09 -0.60 0.00 0.00 178.31 177.06 1jgw h ARG 135 N -0.54 -0.31 -0.69 1.51 2.43 -1.48 -2.07 114.38 113.23 1jgw h ARG 135 Ca 0.03 0.02 0.12 0.00 -0.81 0.00 0.00 59.98 59.33 1jgw h ARG 135 Cb 0.56 0.07 -0.08 0.00 -0.42 0.00 0.00 29.97 30.09 1jgw h ARG 135 CO -0.16 -0.21 0.27 -1.35 -1.51 0.00 0.00 179.97 177.01 1jgw h PRO 136 N -0.32 0.43 -0.40 0.20 0.11 -1.77 -0.71 132.00 129.54 1jgw h PRO 136 Ca 0.00 -0.03 -0.08 0.00 0.11 0.00 0.00 66.00 66.00 1jgw h PRO 136 Cb 0.30 -0.10 -0.02 0.00 0.11 0.00 0.00 31.00 31.30 1jgw h PRO 136 CO -0.03 0.29 -0.08 0.28 -0.21 0.00 0.00 178.00 178.24 1jgw h VAL 137 N 0.44 1.25 0.00 3.15 2.07 -1.18 0.29 116.25 122.26 1jgw h VAL 137 Ca 0.36 -1.08 -0.04 0.00 0.82 0.00 0.00 66.70 66.77 1jgw h VAL 137 Cb 0.50 1.03 -0.01 0.00 -1.52 0.00 0.00 31.29 31.29 1jgw h VAL 137 CO -0.35 0.37 -0.17 0.24 0.02 0.00 0.00 177.57 177.67 1jgw h MET 138 N 0.64 0.00 0.00 1.57 2.86 -0.54 -3.08 114.93 116.38 1jgw h MET 138 Ca 0.12 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.76 1jgw h MET 138 Cb 0.52 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.18 1jgw h MET 138 CO 0.03 0.17 -1.33 -1.33 1.06 0.00 0.00 176.91 175.51 1jgw n MET 139 N -3.27 0.48 -0.12 1.72 2.81 -0.38 -4.98 117.12 113.39 1jgw n MET 139 Ca 0.01 -0.03 0.00 0.00 -1.81 0.00 0.00 57.70 55.87 1jgw n MET 139 Cb 0.44 -1.63 0.00 0.00 -0.71 0.00 0.00 33.22 31.32 1jgw n MET 139 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1jgw n GLY 140 N 1.29 0.93 3.63 3.03 0.00 0.03 -5.08 105.19 109.02 1jgw n GLY 140 Ca -0.00 -0.07 -0.08 0.00 0.00 0.00 0.00 46.02 45.87 1jgw n GLY 140 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1jgw s ALA 141 N -2.00 -2.03 -0.44 4.61 0.00 -0.82 -3.77 121.76 117.32 1jgw s ALA 141 Ca 0.00 1.80 0.23 0.00 0.00 0.00 0.00 51.96 53.99 1jgw s ALA 141 Cb 0.00 -1.42 1.01 0.00 0.00 0.00 0.00 23.12 22.70 1jgw s ALA 141 CO 0.00 -0.22 1.69 0.91 0.00 0.00 0.00 175.76 178.15 1jgw n TRP 142 N 1.84 0.78 0.32 0.00 7.02 -0.77 -2.97 117.44 123.67 1jgw n TRP 142 Ca -0.11 0.33 0.20 0.00 -1.02 0.00 0.00 57.50 56.90 1jgw n TRP 142 Cb 0.56 -1.02 1.08 0.00 -2.42 0.00 0.00 31.31 29.51 1jgw n TRP 142 CO 0.00 0.00 0.00 0.78 -2.02 0.00 0.00 177.69 176.45 1jgw h GLY 143 N 1.83 0.00 1.80 6.99 0.00 -1.80 -2.14 103.07 109.74 1jgw h GLY 143 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1jgw h GLY 143 CO 0.00 0.00 -0.08 -1.72 0.00 0.00 0.00 176.54 174.74 1jgw n TYR 144 N -3.23 0.00 -1.12 5.60 4.01 -1.16 -4.86 117.16 116.40 1jgw n TYR 144 Ca -0.02 0.00 -0.29 0.00 -0.16 0.00 0.00 57.90 57.42 1jgw n TYR 144 Cb 0.11 -0.44 0.21 0.00 -0.31 0.00 0.00 39.34 38.91 1jgw n TYR 144 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1jgw s ALA 145 N -2.96 0.74 0.08 -0.72 0.00 -0.81 -4.92 121.76 113.17 1jgw s ALA 145 Ca 0.15 -0.66 0.01 0.00 0.00 0.00 0.00 51.96 51.46 1jgw s ALA 145 Cb 0.19 -3.00 -0.04 0.00 0.00 0.00 0.00 23.12 20.27 1jgw s ALA 145 CO 0.55 -3.24 0.20 -0.59 0.00 0.00 0.00 175.76 172.67 1jgw s PHE 146 N -2.98 3.45 0.58 0.00 -0.12 -1.26 -4.93 117.98 112.72 1jgw s PHE 146 Ca 0.68 0.20 -0.13 0.00 -0.05 0.00 0.00 56.93 57.63 1jgw s PHE 146 Cb -0.14 -1.72 -0.06 0.00 -0.63 0.00 0.00 43.02 40.47 1jgw s PHE 146 CO 0.57 0.57 1.01 -1.25 -0.05 0.00 0.00 175.22 176.07 1jgw s PRO 147 N -2.60 3.73 -0.62 1.99 0.04 -1.26 -4.80 135.00 131.48 1jgw s PRO 147 Ca 0.34 0.84 -0.16 0.00 0.04 0.00 0.00 61.00 62.06 1jgw s PRO 147 Cb -0.13 -2.10 0.15 0.00 0.04 0.00 0.00 34.50 32.46 1jgw s PRO 147 CO 0.27 -0.46 0.60 0.71 0.04 0.00 0.00 177.00 178.16 1jgw s TYR 148 N -2.95 3.32 -0.22 0.56 2.02 -0.74 -4.36 117.35 114.98 1jgw s TYR 148 Ca 0.57 -1.39 -0.27 0.00 -0.37 0.00 0.00 57.07 55.60 1jgw s TYR 148 Cb -0.11 -3.84 0.12 0.00 -0.40 0.00 0.00 41.96 37.73 1jgw s TYR 148 CO 0.45 -1.06 0.97 0.20 -1.57 0.00 0.00 175.55 174.54 1jgw s GLY 149 N 3.30 -0.25 0.11 0.71 0.00 -1.26 -1.73 107.32 108.21 1jgw s GLY 149 Ca 0.08 2.28 -0.32 0.00 0.00 0.00 0.00 44.72 46.76 1jgw s GLY 149 CO 0.01 1.45 1.58 -2.22 0.00 0.00 0.00 173.10 173.92 1jgw h ILE 150 N 3.17 0.13 0.00 0.90 1.08 -1.80 -2.37 117.51 118.62 1jgw h ILE 150 Ca -0.24 0.00 -0.24 0.00 -0.39 0.00 0.00 64.86 63.98 1jgw h ILE 150 Cb 1.17 0.13 -0.04 0.00 -3.07 0.00 0.00 36.82 35.00 1jgw h ILE 150 CO 0.21 0.00 -1.83 0.79 -0.69 0.00 0.00 178.15 176.63 1jgw n TRP 151 N -5.47 0.62 0.26 1.37 7.02 -1.26 -4.15 117.44 115.83 1jgw n TRP 151 Ca -0.07 0.21 0.14 0.00 -1.02 0.00 0.00 57.50 56.76 1jgw n TRP 151 Cb 0.39 -1.04 0.63 0.00 -2.42 0.00 0.00 31.31 28.87 1jgw n TRP 151 CO 0.00 0.00 0.00 1.79 -2.02 0.00 0.00 177.69 177.46 1jgw h THR 152 N 0.00 0.32 0.00 -0.99 1.35 -1.91 -2.13 112.91 109.55 1jgw h THR 152 Ca -0.29 -0.74 -0.02 0.00 -0.55 0.00 0.00 66.41 64.80 1jgw h THR 152 Cb 1.84 1.56 -0.00 0.00 -1.73 0.00 0.00 68.15 69.82 1jgw h THR 152 CO 0.05 0.11 -0.16 1.12 -0.25 0.00 0.00 175.52 176.38 1jgw h HIS 153 N 0.00 0.00 -0.02 4.73 2.07 -1.58 -2.88 115.15 117.48 1jgw h HIS 153 Ca -0.00 0.00 -0.25 0.00 -2.85 0.00 0.00 60.37 57.27 1jgw h HIS 153 Cb 0.55 0.00 0.01 0.00 2.57 0.00 0.00 27.41 30.55 1jgw h HIS 153 CO 0.00 0.10 -0.98 -0.07 -3.07 0.00 0.00 177.93 173.91 1jgw h LEU 154 N 0.00 0.80 -0.67 6.12 3.38 -1.56 -2.67 115.31 120.71 1jgw h LEU 154 Ca -0.00 -0.63 0.03 0.00 0.09 0.00 0.00 57.88 57.37 1jgw h LEU 154 Cb 1.08 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 41.54 1jgw h LEU 154 CO 0.01 1.43 0.41 0.44 0.09 0.00 0.00 178.44 180.82 1jgw h ASP 155 N 0.36 0.67 -0.73 -0.43 3.45 -1.40 -0.61 116.42 117.73 1jgw h ASP 155 Ca -0.11 0.01 0.03 0.00 0.43 0.00 0.00 57.03 57.39 1jgw h ASP 155 Cb 1.63 -0.14 -0.05 0.00 -0.56 0.00 0.00 39.33 40.22 1jgw h ASP 155 CO 0.19 0.46 0.46 -0.25 -1.57 0.00 0.00 179.24 178.53 1jgw h TRP 156 N 0.80 0.87 -0.10 4.55 7.01 -1.44 0.33 115.95 127.97 1jgw h TRP 156 Ca 0.27 0.02 -0.00 0.00 2.11 0.00 0.00 58.89 61.30 1jgw h TRP 156 Cb 0.05 -0.29 -0.00 0.00 -2.10 0.00 0.00 29.16 26.82 1jgw h TRP 156 CO -0.05 0.50 0.06 0.28 -2.79 0.00 0.00 178.44 176.44 1jgw h VAL 157 N 0.91 1.06 -0.34 2.65 2.07 -0.97 0.16 116.25 121.79 1jgw h VAL 157 Ca 0.29 -0.15 -0.01 0.00 0.82 0.00 0.00 66.70 67.65 1jgw h VAL 157 Cb 0.01 0.99 -0.02 0.00 -1.52 0.00 0.00 31.29 30.75 1jgw h VAL 157 CO -0.11 0.05 0.17 -1.28 0.02 0.00 0.00 177.57 176.42 1jgw h SER 158 N 0.09 0.44 -0.00 0.57 0.87 -0.50 -0.70 113.55 114.32 1jgw h SER 158 Ca 0.03 -0.12 -0.16 0.00 -1.23 0.00 0.00 61.79 60.31 1jgw h SER 158 Cb 0.03 -0.11 -0.01 0.00 -0.44 0.00 0.00 62.40 61.88 1jgw h SER 158 CO -0.01 0.43 -0.55 0.78 -0.53 0.00 0.00 176.83 176.96 1jgw h ASN 159 N 0.41 0.65 -0.36 6.23 2.35 -0.27 -1.93 115.58 122.67 1jgw h ASN 159 Ca 0.12 -0.35 -0.08 0.00 -0.55 0.00 0.00 56.30 55.44 1jgw h ASN 159 Cb 0.11 -0.19 -0.01 0.00 0.05 0.00 0.00 38.32 38.28 1jgw h ASN 159 CO -0.02 1.07 -0.09 0.74 -1.65 0.00 0.00 177.43 177.49 1jgw h THR 160 N 0.45 1.28 0.05 2.81 2.02 -0.59 -2.34 112.91 116.58 1jgw h THR 160 Ca 0.01 -1.15 -0.00 0.00 0.77 0.00 0.00 66.41 66.03 1jgw h THR 160 Cb 1.10 1.29 0.00 0.00 -1.74 0.00 0.00 68.15 68.80 1jgw h THR 160 CO 0.11 0.38 -0.02 1.23 0.37 0.00 0.00 175.52 177.58 1jgw h GLY 161 N 0.48 -0.06 2.00 2.16 0.00 -1.11 -2.90 103.07 103.64 1jgw h GLY 161 Ca 0.09 0.02 0.00 0.00 0.00 0.00 0.00 47.33 47.44 1jgw h GLY 161 CO 0.04 -0.02 0.00 -0.97 0.00 0.00 0.00 176.54 175.58 1jgw h TYR 162 N -0.17 0.00 0.00 5.60 0.05 -1.34 -2.35 116.97 118.76 1jgw h TYR 162 Ca -0.01 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.77 1jgw h TYR 162 Cb 0.15 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.89 1jgw h TYR 162 CO -0.04 0.00 0.00 2.41 -1.05 0.00 0.00 178.16 179.48 1jgw n THR 163 N -2.33 1.56 -1.86 -2.88 -1.04 -0.88 -1.72 114.28 105.12 1jgw n THR 163 Ca 0.01 0.40 0.05 0.00 -2.04 0.00 0.00 64.05 62.48 1jgw n THR 163 Cb 0.18 -1.31 0.13 0.00 -1.82 0.00 0.00 70.33 67.51 1jgw n THR 163 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 1jgw n TYR 164 N -1.54 0.00 -4.11 -1.42 4.01 -0.88 -4.87 117.16 108.35 1jgw n TYR 164 Ca 0.01 -1.06 0.00 0.00 -0.16 0.00 0.00 57.90 56.69 1jgw n TYR 164 Cb 0.07 -0.20 0.00 0.00 -0.31 0.00 0.00 39.34 38.90 1jgw n TYR 164 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1jgw n GLY 165 N -0.58 0.56 3.63 2.72 0.00 -0.70 -2.20 105.19 108.62 1jgw n GLY 165 Ca 0.14 -0.89 -0.42 0.00 0.00 0.00 0.00 46.02 44.84 1jgw n GLY 165 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1jgw s ASN 166 N -4.00 6.78 0.18 1.61 3.84 -1.26 -3.99 114.94 118.10 1jgw s ASN 166 Ca 0.00 0.87 0.18 0.00 0.21 0.00 0.00 52.86 54.12 1jgw s ASN 166 Cb 0.00 -2.44 0.83 0.00 -0.55 0.00 0.00 41.25 39.08 1jgw s ASN 166 CO 0.00 -0.63 1.56 0.33 -2.79 0.00 0.00 177.10 175.57 1jgw n PHE 167 N 6.26 0.52 0.01 0.43 7.35 -1.26 -2.63 117.46 128.14 1jgw n PHE 167 Ca 0.06 0.22 0.21 0.00 -0.76 0.00 0.00 57.45 57.19 1jgw n PHE 167 Cb 0.48 -0.86 0.72 0.00 0.35 0.00 0.00 39.48 40.16 1jgw n PHE 167 CO 0.00 0.00 0.00 0.45 -0.76 0.00 0.00 176.76 176.45 1jgw h HIS 168 N 0.00 0.00 -0.00 -5.13 3.86 -1.95 -1.17 115.15 110.76 1jgw h HIS 168 Ca 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 1jgw h HIS 168 Cb 0.21 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.68 1jgw h HIS 168 CO 0.00 0.00 -0.00 0.66 0.86 0.00 0.00 177.93 179.45 1jgw n TYR 169 N -4.18 0.00 -2.03 2.45 4.01 -1.08 -4.58 117.16 111.75 1jgw n TYR 169 Ca 0.10 0.00 -0.43 0.00 -0.16 0.00 0.00 57.90 57.41 1jgw n TYR 169 Cb 0.64 -0.30 -0.03 0.00 -0.31 0.00 0.00 39.34 39.34 1jgw n TYR 169 CO 0.00 0.00 0.00 1.21 -0.46 0.00 0.00 176.86 177.61 1jgw s ASN 170 N -2.59 6.33 0.54 7.72 3.84 -0.45 -4.71 114.94 125.63 1jgw s ASN 170 Ca 0.28 1.77 0.21 0.00 0.21 0.00 0.00 52.86 55.33 1jgw s ASN 170 Cb 0.20 -2.53 1.44 0.00 -0.55 0.00 0.00 41.25 39.81 1jgw s ASN 170 CO 0.47 -1.27 2.16 1.55 -2.79 0.00 0.00 177.10 177.22 1jgw h PRO 171 N 10.96 0.00 0.00 0.43 0.13 -1.89 -1.33 132.00 140.31 1jgw h PRO 171 Ca -0.36 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.77 1jgw h PRO 171 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 1jgw h PRO 171 CO 0.99 0.00 -0.25 0.00 -0.23 0.00 0.00 178.00 178.51 1jgw h ALA 172 N 1.97 0.86 -0.07 -0.56 0.00 -1.91 -3.06 119.26 116.49 1jgw h ALA 172 Ca 0.02 0.00 -0.23 0.00 0.00 0.00 0.00 54.91 54.70 1jgw h ALA 172 Cb 0.09 0.00 0.01 0.00 0.00 0.00 0.00 17.79 17.89 1jgw h ALA 172 CO -0.00 0.00 -0.89 1.25 0.00 0.00 0.00 179.25 179.61 1jgw h HIS 173 N 0.00 0.94 -0.45 0.00 6.17 -1.53 -2.09 115.15 118.18 1jgw h HIS 173 Ca 0.00 -0.46 -0.07 0.00 0.71 0.00 0.00 60.37 60.55 1jgw h HIS 173 Cb 0.92 -0.13 -0.02 0.00 2.52 0.00 0.00 27.41 30.70 1jgw h HIS 173 CO 0.00 1.29 0.03 0.52 0.71 0.00 0.00 177.93 180.47 1jgw h MET 174 N 0.42 0.78 -0.02 5.26 2.86 -1.42 -1.26 114.93 121.55 1jgw h MET 174 Ca -0.08 -0.23 -0.00 0.00 -2.06 0.00 0.00 59.70 57.32 1jgw h MET 174 Cb 1.52 -0.08 -0.00 0.00 0.06 0.00 0.00 31.60 33.10 1jgw h MET 174 CO 0.17 0.83 0.01 0.82 1.06 0.00 0.00 176.91 179.79 1jgw h ILE 175 N 0.63 1.18 -0.85 -1.22 2.04 -1.56 -2.73 117.51 115.01 1jgw h ILE 175 Ca 0.13 -0.53 0.12 0.00 1.00 0.00 0.00 64.86 65.59 1jgw h ILE 175 Cb 0.46 1.50 -0.06 0.00 -0.74 0.00 0.00 36.82 37.97 1jgw h ILE 175 CO 0.02 0.14 0.55 0.00 0.00 0.00 0.00 178.15 178.86 1jgw h ALA 176 N 0.79 1.81 -0.02 1.87 0.00 -1.26 -0.12 119.26 122.33 1jgw h ALA 176 Ca 0.01 0.01 -0.11 0.00 0.00 0.00 0.00 54.91 54.81 1jgw h ALA 176 Cb 0.22 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 1jgw h ALA 176 CO -0.00 -0.02 -0.52 0.82 0.00 0.00 0.00 179.25 179.53 1jgw h ILE 177 N 0.70 1.37 -0.56 0.00 2.04 -1.07 -2.68 117.51 117.31 1jgw h ILE 177 Ca 0.41 -1.78 -0.05 0.00 1.00 0.00 0.00 64.86 64.44 1jgw h ILE 177 Cb 0.61 1.93 -0.02 0.00 -0.74 0.00 0.00 36.82 38.60 1jgw h ILE 177 CO -0.17 0.51 0.14 0.28 0.00 0.00 0.00 178.15 178.91 1jgw h SER 178 N 0.05 0.84 0.04 1.72 0.02 -0.72 0.75 113.55 116.26 1jgw h SER 178 Ca -0.00 -0.23 -0.13 0.00 -0.84 0.00 0.00 61.79 60.59 1jgw h SER 178 Cb 0.93 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 63.24 1jgw h SER 178 CO 0.07 0.85 -0.42 -0.26 -1.14 0.00 0.00 176.83 175.93 1jgw h PHE 179 N 0.79 0.56 -0.29 3.45 0.04 -1.35 -0.25 116.94 119.89 1jgw h PHE 179 Ca 0.18 -0.16 -0.08 0.00 2.80 0.00 0.00 57.97 60.71 1jgw h PHE 179 Cb 0.33 -0.12 -0.01 0.00 2.20 0.00 0.00 35.95 38.36 1jgw h PHE 179 CO 0.02 0.82 -0.11 0.74 -0.60 0.00 0.00 178.31 179.18 1jgw h PHE 180 N 0.39 0.67 -0.55 -0.55 0.04 -1.15 0.16 116.94 115.95 1jgw h PHE 180 Ca 0.03 -0.16 -0.09 0.00 2.80 0.00 0.00 57.97 60.55 1jgw h PHE 180 Cb 0.90 -0.16 -0.02 0.00 2.20 0.00 0.00 35.95 38.87 1jgw h PHE 180 CO 0.03 0.81 -0.01 0.74 -0.60 0.00 0.00 178.31 179.28 1jgw h PHE 181 N 0.34 1.02 -0.14 -0.55 0.04 -0.78 -2.88 116.94 113.99 1jgw h PHE 181 Ca 0.07 -0.16 -0.20 0.00 2.80 0.00 0.00 57.97 60.47 1jgw h PHE 181 Cb 0.62 -0.27 0.01 0.00 2.20 0.00 0.00 35.95 38.51 1jgw h PHE 181 CO 0.06 0.92 -0.70 1.15 -0.60 0.00 0.00 178.31 179.14 1jgw h THR 182 N 0.87 1.30 -0.85 -1.55 2.02 -0.94 -2.93 112.91 110.83 1jgw h THR 182 Ca 0.16 -1.93 0.08 0.00 0.77 0.00 0.00 66.41 65.49 1jgw h THR 182 Cb 0.52 2.04 -0.06 0.00 -1.74 0.00 0.00 68.15 68.92 1jgw h THR 182 CO 0.03 0.60 0.55 -1.13 0.37 0.00 0.00 175.52 175.94 1jgw h ASN 183 N 0.42 0.80 -0.23 4.18 -1.24 -0.64 0.51 115.58 119.39 1jgw h ASN 183 Ca -0.05 0.01 -0.09 0.00 0.71 0.00 0.00 56.30 56.89 1jgw h ASN 183 Cb 1.34 -0.16 -0.00 0.00 0.73 0.00 0.00 38.32 40.22 1jgw h ASN 183 CO 0.15 0.50 -0.20 0.00 -1.29 0.00 0.00 177.43 176.59 1jgw h ALA 184 N 1.55 0.33 0.11 1.57 0.00 -1.51 -1.11 119.26 120.20 1jgw h ALA 184 Ca 0.37 -0.35 0.01 0.00 0.00 0.00 0.00 54.91 54.94 1jgw h ALA 184 Cb 0.29 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 1jgw h ALA 184 CO -0.14 0.26 -0.18 1.25 0.00 0.00 0.00 179.25 180.44 1jgw h LEU 185 N 0.23 -0.51 -1.30 0.00 6.46 -1.17 -0.49 115.31 118.54 1jgw h LEU 185 Ca 0.04 0.06 0.08 0.00 -0.12 0.00 0.00 57.88 57.94 1jgw h LEU 185 Cb 0.74 0.19 -0.05 0.00 -0.73 0.00 0.00 40.66 40.81 1jgw h LEU 185 CO 0.05 -0.26 0.53 0.00 -0.62 0.00 0.00 178.44 178.13 1jgw h ALA 186 N 0.47 1.69 -0.30 1.25 0.00 -0.85 -1.28 119.26 120.24 1jgw h ALA 186 Ca 0.02 -0.01 -0.13 0.00 0.00 0.00 0.00 54.91 54.79 1jgw h ALA 186 Cb 0.37 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.96 1jgw h ALA 186 CO -0.10 0.16 -0.31 1.25 0.00 0.00 0.00 179.25 180.25 1jgw h LEU 187 N 0.81 0.79 -0.75 0.00 5.85 -0.63 -0.40 115.31 120.97 1jgw h LEU 187 Ca 0.36 -0.48 -0.03 0.00 0.84 0.00 0.00 57.88 58.58 1jgw h LEU 187 Cb 0.35 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 41.12 1jgw h LEU 187 CO -0.14 1.10 0.36 0.00 -0.34 0.00 0.00 178.44 179.42 1jgw h ALA 188 N 0.71 0.97 0.33 1.25 0.00 -0.43 -1.63 119.26 120.46 1jgw h ALA 188 Ca 0.04 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 54.78 1jgw h ALA 188 Cb 0.89 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.38 1jgw h ALA 188 CO 0.08 0.54 -0.16 -0.07 0.00 0.00 0.00 179.25 179.64 1jgw h LEU 189 N 1.06 -0.38 -0.67 0.00 3.38 -1.18 -0.84 115.31 116.68 1jgw h LEU 189 Ca 0.26 -0.17 0.13 0.00 0.09 0.00 0.00 57.88 58.19 1jgw h LEU 189 Cb 0.13 0.10 -0.10 0.00 0.09 0.00 0.00 40.66 40.88 1jgw h LEU 189 CO -0.03 0.01 0.16 -0.74 0.09 0.00 0.00 178.44 177.93 1jgw h HIS 190 N -0.82 0.26 -0.31 1.13 2.76 -1.05 0.43 115.15 117.54 1jgw h HIS 190 Ca -0.05 0.04 -0.02 0.00 -2.20 0.00 0.00 60.37 58.14 1jgw h HIS 190 Cb 0.52 -0.01 -0.01 0.00 1.55 0.00 0.00 27.41 29.45 1jgw h HIS 190 CO 0.03 -0.04 0.12 0.78 -1.30 0.00 0.00 177.93 177.52 1jgw h GLY 191 N 0.29 0.51 1.49 5.26 0.00 -1.29 -2.27 103.07 107.05 1jgw h GLY 191 Ca 0.36 -0.28 -0.09 0.00 0.00 0.00 0.00 47.33 47.32 1jgw h GLY 191 CO -0.44 0.27 -0.17 0.00 0.00 0.00 0.00 176.54 176.19 1jgw h ALA 192 N 0.96 1.09 0.68 3.60 0.00 -0.19 -2.59 119.26 122.81 1jgw h ALA 192 Ca 0.10 -0.32 -0.03 0.00 0.00 0.00 0.00 54.91 54.66 1jgw h ALA 192 Cb 0.20 -0.14 0.01 0.00 0.00 0.00 0.00 17.79 17.85 1jgw h ALA 192 CO -0.01 0.56 -0.33 1.25 0.00 0.00 0.00 179.25 180.73 1jgw h LEU 193 N 0.54 -0.77 -1.48 0.00 5.85 0.02 -0.72 115.31 118.75 1jgw h LEU 193 Ca 0.09 0.03 0.22 0.00 0.84 0.00 0.00 57.88 59.05 1jgw h LEU 193 Cb 0.60 0.20 -0.07 0.00 0.37 0.00 0.00 40.66 41.76 1jgw h LEU 193 CO 0.04 -0.46 0.62 0.58 -0.34 0.00 0.00 178.44 178.88 1jgw h VAL 194 N -1.10 0.65 0.05 1.05 2.07 -1.48 -1.80 116.25 115.69 1jgw h VAL 194 Ca -0.09 -0.14 -0.24 0.00 0.82 0.00 0.00 66.70 67.05 1jgw h VAL 194 Cb 0.70 0.20 -0.02 0.00 -1.52 0.00 0.00 31.29 30.66 1jgw h VAL 194 CO 0.15 0.07 -1.10 -0.07 0.02 0.00 0.00 177.57 176.64 1jgw h LEU 195 N 0.41 0.17 -0.79 2.57 3.38 -1.37 -2.49 115.31 117.18 1jgw h LEU 195 Ca 0.50 -0.18 0.00 0.00 0.09 0.00 0.00 57.88 58.29 1jgw h LEU 195 Cb 1.24 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.93 1jgw h LEU 195 CO -0.20 1.14 0.00 0.77 0.09 0.00 0.00 178.44 180.24 1jgw h SER 196 N 0.03 0.00 0.28 -0.43 4.64 -0.29 -0.04 113.55 117.74 1jgw h SER 196 Ca -0.06 0.00 -0.34 0.00 -0.47 0.00 0.00 61.79 60.92 1jgw h SER 196 Cb 1.85 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.92 1jgw h SER 196 CO 0.16 0.00 -1.85 0.00 -0.87 0.00 0.00 176.83 174.27 1jgw h ALA 197 N 2.06 0.50 0.00 5.18 0.00 -1.45 -3.28 119.26 122.28 1jgw h ALA 197 Ca 0.00 -1.37 -0.04 0.00 0.00 0.00 0.00 54.91 53.50 1jgw h ALA 197 Cb 0.68 0.58 -0.01 0.00 0.00 0.00 0.00 17.79 19.04 1jgw h ALA 197 CO 0.00 1.36 -0.49 0.00 0.00 0.00 0.00 179.25 180.12 1jgw h ALA 198 N 0.40 0.77 -2.12 0.00 0.00 -1.39 -1.77 119.26 115.16 1jgw h ALA 198 Ca -0.36 -0.16 -0.58 0.00 0.00 0.00 0.00 54.91 53.80 1jgw h ALA 198 Cb 2.03 0.01 -0.41 0.00 0.00 0.00 0.00 17.79 19.42 1jgw h ALA 198 CO 0.10 0.20 -0.79 0.09 0.00 0.00 0.00 179.25 178.85 1jgw n ASN 199 N -2.99 2.40 -2.96 0.00 3.02 -0.03 -4.89 115.26 109.80 1jgw n ASN 199 Ca 0.01 -3.16 -0.13 0.00 -0.03 0.00 0.00 54.58 51.27 1jgw n ASN 199 Cb 0.60 -0.66 0.11 0.00 -0.61 0.00 0.00 39.78 39.23 1jgw n ASN 199 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 1jgw n PRO 200 N 1.03 -1.92 -1.67 3.52 -0.04 -1.24 -4.65 135.00 130.03 1jgw n PRO 200 Ca 0.27 -0.77 -0.39 0.00 -0.04 0.00 0.00 63.50 62.57 1jgw n PRO 200 Cb 0.46 -0.71 0.04 0.00 -0.04 0.00 0.00 33.50 33.25 1jgw n PRO 200 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1jgw n GLU 201 N -2.95 1.27 -1.64 0.54 1.02 -1.26 -4.81 120.64 112.80 1jgw n GLU 201 Ca 0.07 0.47 -0.52 0.00 -0.02 0.00 0.00 57.16 57.16 1jgw n GLU 201 Cb 0.26 -2.31 -0.06 0.00 -0.02 0.00 0.00 31.44 29.31 1jgw n GLU 201 CO 0.00 0.00 0.00 1.17 1.18 0.00 0.00 177.13 179.48 1jgw n LYS 202 N -0.87 1.43 0.00 3.49 4.81 -1.26 -1.64 118.16 124.12 1jgw n LYS 202 Ca 0.12 0.52 0.00 0.00 -0.87 0.00 0.00 58.31 58.08 1jgw n LYS 202 Cb 0.45 -2.22 0.00 0.00 0.02 0.00 0.00 35.03 33.28 1jgw n LYS 202 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1jgw n GLY 203 N 3.27 3.01 3.81 3.14 0.00 -1.26 -5.05 105.19 112.11 1jgw n GLY 203 Ca 0.20 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.90 1jgw n GLY 203 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1jgw s LYS 204 N -0.22 3.32 0.61 1.61 1.02 -0.65 -5.03 119.74 120.40 1jgw s LYS 204 Ca 0.00 1.10 -0.16 0.00 0.02 0.00 0.00 55.97 56.93 1jgw s LYS 204 Cb 0.00 -2.04 -0.03 0.00 -0.52 0.00 0.00 37.83 35.24 1jgw s LYS 204 CO 0.00 -0.80 1.08 -1.21 -0.92 0.00 0.00 175.35 173.50 1jgw s GLU 205 N -4.34 3.18 0.04 1.68 2.02 -1.26 -4.84 118.70 115.18 1jgw s GLU 205 Ca 0.61 1.28 -0.31 0.00 0.02 0.00 0.00 54.97 56.57 1jgw s GLU 205 Cb -0.15 -2.01 -0.10 0.00 0.10 0.00 0.00 34.13 31.98 1jgw s GLU 205 CO 0.41 -0.93 1.92 -0.12 0.02 0.00 0.00 175.26 176.56 1jgw n MET 206 N -2.08 2.71 -0.66 1.61 0.00 -1.26 -4.83 117.12 112.61 1jgw n MET 206 Ca 0.09 0.99 -0.30 0.00 -0.00 0.00 0.00 57.70 58.49 1jgw n MET 206 Cb 0.52 -2.91 0.26 0.00 0.00 0.00 0.00 33.22 31.09 1jgw n MET 206 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 175.97 177.00 1jgw s ARG 207 N 3.88 -1.78 0.38 2.12 3.00 -0.66 -5.04 118.95 120.84 1jgw s ARG 207 Ca 0.88 0.27 0.06 0.00 0.00 0.00 0.00 55.73 56.93 1jgw s ARG 207 Cb -0.50 -1.50 -0.07 0.00 0.00 0.00 0.00 34.95 32.88 1jgw s ARG 207 CO 0.43 -4.15 0.03 0.95 0.00 0.00 0.00 175.30 172.55 1jgw s THR 208 N -2.56 1.67 0.66 0.02 -4.23 -1.26 -4.80 115.64 105.13 1jgw s THR 208 Ca 0.69 -2.00 0.43 0.00 -1.18 0.00 0.00 61.69 59.63 1jgw s THR 208 Cb -0.16 -2.90 0.44 0.00 1.34 0.00 0.00 72.50 71.22 1jgw s THR 208 CO 0.59 0.00 2.36 1.55 -0.54 0.00 0.00 174.62 178.58 1jgw h PRO 209 N 1.89 0.00 -0.39 3.99 0.13 -1.99 -0.22 132.00 135.42 1jgw h PRO 209 Ca -0.43 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 64.64 1jgw h PRO 209 Cb 1.24 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.36 1jgw h PRO 209 CO 0.76 0.00 -0.02 -0.44 -0.23 0.00 0.00 178.00 178.08 1jgw h ASP 210 N 0.00 0.69 -0.09 1.44 5.19 -1.99 -1.09 116.42 120.57 1jgw h ASP 210 Ca -0.00 -0.32 -0.03 0.00 -0.62 0.00 0.00 57.03 56.06 1jgw h ASP 210 Cb 0.00 -0.19 -0.01 0.00 0.18 0.00 0.00 39.33 39.32 1jgw h ASP 210 CO 0.00 0.84 -0.02 0.45 -3.12 0.00 0.00 179.24 177.39 1jgw h HIS 211 N 0.52 0.30 -0.47 4.55 3.86 -1.44 0.14 115.15 122.61 1jgw h HIS 211 Ca 0.11 -0.02 -0.10 0.00 -1.16 0.00 0.00 60.37 59.20 1jgw h HIS 211 Cb 0.50 -0.09 -0.01 0.00 1.06 0.00 0.00 27.41 28.87 1jgw h HIS 211 CO 0.04 0.33 -0.09 0.93 0.86 0.00 0.00 177.93 180.00 1jgw h GLU 212 N 0.29 0.89 -0.06 2.45 5.08 -1.09 0.15 114.58 122.28 1jgw h GLU 212 Ca 0.07 -0.33 -0.21 0.00 -1.00 0.00 0.00 59.36 57.89 1jgw h GLU 212 Cb 0.24 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.43 1jgw h GLU 212 CO 0.01 0.97 -0.82 -0.44 -1.00 0.00 0.00 179.01 177.73 1jgw h ASP 213 N 0.73 0.61 -0.30 1.42 3.32 -0.68 -3.07 116.42 118.45 1jgw h ASP 213 Ca 0.12 -0.43 -0.05 0.00 0.02 0.00 0.00 57.03 56.69 1jgw h ASP 213 Cb 0.63 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.99 1jgw h ASP 213 CO 0.04 1.20 0.00 0.74 -1.72 0.00 0.00 179.24 179.51 1jgw h THR 214 N 0.32 1.26 -0.48 0.35 2.02 -0.64 -2.12 112.91 113.61 1jgw h THR 214 Ca -0.06 -0.94 0.08 0.00 0.77 0.00 0.00 66.41 66.27 1jgw h THR 214 Cb 1.43 1.28 -0.07 0.00 -1.74 0.00 0.00 68.15 69.05 1jgw h THR 214 CO 0.15 0.30 0.08 0.15 0.37 0.00 0.00 175.52 176.57 1jgw h PHE 215 N 0.32 0.12 -0.13 3.16 3.57 -1.00 0.18 116.94 123.15 1jgw h PHE 215 Ca 0.08 0.03 -0.15 0.00 3.53 0.00 0.00 57.97 61.47 1jgw h PHE 215 Cb 0.43 0.02 -0.01 0.00 2.79 0.00 0.00 35.95 39.18 1jgw h PHE 215 CO 0.04 -0.02 -0.55 0.74 -2.23 0.00 0.00 178.31 176.29 1jgw h PHE 216 N 0.21 0.50 -0.29 0.41 0.04 -1.49 -1.96 116.94 114.36 1jgw h PHE 216 Ca 0.24 -0.18 -0.05 0.00 2.80 0.00 0.00 57.97 60.78 1jgw h PHE 216 Cb 0.32 -0.09 -0.01 0.00 2.20 0.00 0.00 35.95 38.37 1jgw h PHE 216 CO -0.24 0.86 -0.04 0.00 -0.60 0.00 0.00 178.31 178.30 1jgw h ARG 217 N 0.31 0.53 -0.77 1.51 3.08 -0.90 0.23 114.38 118.37 1jgw h ARG 217 Ca 0.01 -0.19 0.04 0.00 0.07 0.00 0.00 59.98 59.91 1jgw h ARG 217 Cb 1.06 -0.04 -0.05 0.00 0.08 0.00 0.00 29.97 31.02 1jgw h ARG 217 CO 0.09 0.71 0.48 -0.44 -1.07 0.00 0.00 179.97 179.74 1jgw h ASP 218 N 0.30 0.77 0.35 7.04 3.32 -0.93 0.29 116.42 127.56 1jgw h ASP 218 Ca 0.08 0.01 -0.02 0.00 0.02 0.00 0.00 57.03 57.12 1jgw h ASP 218 Cb 0.49 -0.16 0.00 0.00 0.22 0.00 0.00 39.33 39.89 1jgw h ASP 218 CO 0.02 0.52 -0.17 0.25 -1.72 0.00 0.00 179.24 178.14 1jgw h LEU 219 N 0.91 -0.40 -2.54 1.55 5.85 -1.03 -3.40 115.31 116.24 1jgw h LEU 219 Ca 0.32 -0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.98 1jgw h LEU 219 Cb 0.08 0.10 0.00 0.00 0.37 0.00 0.00 40.66 41.22 1jgw h LEU 219 CO -0.14 0.05 0.00 1.33 -0.34 0.00 0.00 178.44 179.34 1jgw n VAL 220 N -5.10 0.77 -1.07 1.05 0.24 0.77 -5.00 118.33 110.00 1jgw n VAL 220 Ca -0.07 -0.89 -0.02 0.00 -2.04 0.00 0.00 64.34 61.32 1jgw n VAL 220 Cb 0.23 0.62 -0.01 0.00 -1.47 0.00 0.00 33.84 33.21 1jgw n VAL 220 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1jgw n GLY 221 N -0.20 0.57 3.64 7.63 0.00 0.10 -4.98 105.19 111.95 1jgw n GLY 221 Ca 0.02 -0.47 -0.08 0.00 0.00 0.00 0.00 46.02 45.50 1jgw n GLY 221 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1jgw s TYR 222 N -1.99 -0.56 -0.08 1.61 5.04 -1.25 -4.90 117.35 115.22 1jgw s TYR 222 Ca 0.00 1.28 0.04 0.00 -2.44 0.00 0.00 57.07 55.95 1jgw s TYR 222 Cb 0.00 0.37 0.00 0.00 0.35 0.00 0.00 41.96 42.68 1jgw s TYR 222 CO 0.00 -0.27 -0.20 0.45 -1.34 0.00 0.00 175.55 174.18 1jgw s SER 223 N 0.60 2.64 0.43 4.32 0.15 -1.26 -4.31 113.70 116.27 1jgw s SER 223 Ca -0.01 -0.47 0.23 0.00 0.70 0.00 0.00 55.95 56.41 1jgw s SER 223 Cb -0.05 -1.14 0.38 0.00 -1.71 0.00 0.00 66.02 63.50 1jgw s SER 223 CO -0.09 0.13 1.62 -0.29 1.20 0.00 0.00 173.24 175.82 1jgw h ILE 224 N 5.70 0.00 0.00 6.45 2.10 -1.98 -3.50 117.51 126.28 1jgw h ILE 224 Ca -0.24 -0.96 0.00 0.00 1.08 0.00 0.00 64.86 64.73 1jgw h ILE 224 Cb 1.21 1.96 0.00 0.00 -1.09 0.00 0.00 36.82 38.91 1jgw h ILE 224 CO 0.47 0.00 0.00 0.61 -1.08 0.00 0.00 178.15 178.15 1jgw n GLY 225 N 1.11 1.30 0.34 8.18 0.00 -1.26 -3.94 105.19 110.92 1jgw n GLY 225 Ca 0.04 -1.71 0.06 0.00 0.00 0.00 0.00 46.02 44.40 1jgw n GLY 225 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1jgw h THR 226 N 0.00 0.92 0.10 2.61 1.35 -1.96 -0.25 112.91 115.68 1jgw h THR 226 Ca 0.00 -0.32 -0.27 0.00 -0.55 0.00 0.00 66.41 65.27 1jgw h THR 226 Cb 0.00 -0.09 -0.00 0.00 -1.73 0.00 0.00 68.15 66.32 1jgw h THR 226 CO 0.00 0.17 -1.29 0.25 -0.25 0.00 0.00 175.52 174.40 1jgw h LEU 227 N 0.93 0.34 -0.62 3.87 5.85 -2.02 -3.33 115.31 120.34 1jgw h LEU 227 Ca 0.46 -0.39 -0.03 0.00 0.84 0.00 0.00 57.88 58.76 1jgw h LEU 227 Cb 0.44 -0.11 -0.03 0.00 0.37 0.00 0.00 40.66 41.33 1jgw h LEU 227 CO -0.26 1.31 0.28 1.23 -0.34 0.00 0.00 178.44 180.67 1jgw h GLY 228 N 1.88 0.96 2.00 3.75 0.00 -1.52 -2.65 103.07 107.49 1jgw h GLY 228 Ca -0.15 -0.49 -0.01 0.00 0.00 0.00 0.00 47.33 46.68 1jgw h GLY 228 CO 0.18 0.47 -0.05 1.19 0.00 0.00 0.00 176.54 178.32 1jgw h ILE 229 N 0.85 0.33 0.00 2.60 6.09 -1.17 0.72 117.51 126.93 1jgw h ILE 229 Ca 0.21 -0.31 -0.20 0.00 -1.37 0.00 0.00 64.86 63.19 1jgw h ILE 229 Cb 0.15 1.22 -0.03 0.00 0.47 0.00 0.00 36.82 38.63 1jgw h ILE 229 CO -0.02 0.05 -1.30 0.45 -3.07 0.00 0.00 178.15 174.26 1jgw h HIS 230 N 0.00 0.00 -0.21 2.19 3.86 -1.60 -2.48 115.15 116.92 1jgw h HIS 230 Ca -0.00 0.00 -0.21 0.00 -1.16 0.00 0.00 60.37 59.00 1jgw h HIS 230 Cb 0.22 0.00 0.01 0.00 1.06 0.00 0.00 27.41 28.70 1jgw h HIS 230 CO 0.00 0.77 -0.69 0.00 0.86 0.00 0.00 177.93 178.87 1jgw h ARG 231 N 0.00 0.84 -0.32 2.45 3.08 -0.99 -2.57 114.38 116.88 1jgw h ARG 231 Ca -0.15 -0.62 -0.02 0.00 0.07 0.00 0.00 59.98 59.26 1jgw h ARG 231 Cb 1.72 0.11 -0.01 0.00 0.08 0.00 0.00 29.97 31.86 1jgw h ARG 231 CO 0.07 1.24 0.13 1.25 -1.07 0.00 0.00 179.97 181.59 1jgw h LEU 232 N 0.60 0.43 -0.24 3.04 5.85 -0.95 -1.86 115.31 122.18 1jgw h LEU 232 Ca -0.03 -0.16 0.01 0.00 0.84 0.00 0.00 57.88 58.54 1jgw h LEU 232 Cb 1.31 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 42.22 1jgw h LEU 232 CO 0.15 0.47 0.15 1.23 -0.34 0.00 0.00 178.44 180.09 1jgw h GLY 233 N 0.36 0.33 0.93 3.75 0.00 -1.45 0.95 103.07 107.95 1jgw h GLY 233 Ca 0.11 -0.11 0.03 0.00 0.00 0.00 0.00 47.33 47.35 1jgw h GLY 233 CO -0.01 0.11 0.65 -2.00 0.00 0.00 0.00 176.54 175.29 1jgw h LEU 234 N 0.30 1.09 0.07 3.11 5.85 -1.34 -2.74 115.31 121.66 1jgw h LEU 234 Ca 0.09 -0.02 -0.00 0.00 0.84 0.00 0.00 57.88 58.79 1jgw h LEU 234 Cb -0.02 -0.26 0.00 0.00 0.37 0.00 0.00 40.66 40.76 1jgw h LEU 234 CO -0.03 0.76 -0.03 0.25 -0.34 0.00 0.00 178.44 179.04 1jgw h LEU 235 N 1.27 -0.08 -0.69 2.25 5.85 -0.83 -2.32 115.31 120.76 1jgw h LEU 235 Ca 0.39 -0.43 0.11 0.00 0.84 0.00 0.00 57.88 58.78 1jgw h LEU 235 Cb -0.04 0.02 -0.08 0.00 0.37 0.00 0.00 40.66 40.93 1jgw h LEU 235 CO -0.11 0.42 0.28 -0.07 -0.34 0.00 0.00 178.44 178.61 1jgw h LEU 236 N -0.61 0.29 0.72 2.25 3.38 -0.79 -0.62 115.31 119.93 1jgw h LEU 236 Ca -0.01 0.09 -0.03 0.00 0.09 0.00 0.00 57.88 58.01 1jgw h LEU 236 Cb 0.51 0.06 0.01 0.00 0.09 0.00 0.00 40.66 41.33 1jgw h LEU 236 CO 0.02 0.14 -0.36 0.28 0.09 0.00 0.00 178.44 178.61 1jgw h SER 237 N 0.46 -0.86 0.30 -0.43 0.02 -1.51 -0.30 113.55 111.23 1jgw h SER 237 Ca 0.36 0.03 -0.03 0.00 -0.84 0.00 0.00 61.79 61.32 1jgw h SER 237 Cb 0.48 0.23 -0.00 0.00 0.14 0.00 0.00 62.40 63.25 1jgw h SER 237 CO -0.34 -0.60 -0.14 -0.07 -1.14 0.00 0.00 176.83 174.53 1jgw h LEU 238 N -0.99 0.00 -0.02 5.07 3.38 -1.28 -2.63 115.31 118.84 1jgw h LEU 238 Ca -0.10 0.00 -0.24 0.00 0.09 0.00 0.00 57.88 57.64 1jgw h LEU 238 Cb 0.76 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.53 1jgw h LEU 238 CO 0.15 0.14 -0.91 0.28 0.09 0.00 0.00 178.44 178.20 1jgw h SER 239 N 0.00 0.84 -0.82 -0.43 0.02 -0.92 -0.93 113.55 111.32 1jgw h SER 239 Ca -0.00 -0.73 0.04 0.00 -0.84 0.00 0.00 61.79 60.27 1jgw h SER 239 Cb 0.33 -0.26 -0.05 0.00 0.14 0.00 0.00 62.40 62.56 1jgw h SER 239 CO 0.02 1.45 0.51 0.00 -1.14 0.00 0.00 176.83 177.67 1jgw h ALA 240 N 0.41 1.09 0.00 3.77 0.00 -0.70 -1.69 119.26 122.14 1jgw h ALA 240 Ca -0.11 -0.02 -0.19 0.00 0.00 0.00 0.00 54.91 54.59 1jgw h ALA 240 Cb 1.57 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 19.08 1jgw h ALA 240 CO 0.18 0.30 -0.91 0.28 0.00 0.00 0.00 179.25 179.10 1jgw h VAL 241 N 0.97 1.60 -0.33 0.00 2.07 -1.51 -2.38 116.25 116.67 1jgw h VAL 241 Ca 0.34 -3.16 -0.10 0.00 0.82 0.00 0.00 66.70 64.60 1jgw h VAL 241 Cb 0.08 2.73 -0.01 0.00 -1.52 0.00 0.00 31.29 32.56 1jgw h VAL 241 CO -0.14 0.89 -0.22 0.15 0.02 0.00 0.00 177.57 178.27 1jgw h PHE 242 N 0.00 0.71 0.00 1.57 3.57 -0.64 -1.83 116.94 120.32 1jgw h PHE 242 Ca -0.01 -0.15 -0.13 0.00 3.53 0.00 0.00 57.97 61.21 1jgw h PHE 242 Cb 1.65 -0.18 -0.02 0.00 2.79 0.00 0.00 35.95 40.20 1jgw h PHE 242 CO 0.00 0.80 -0.64 0.74 -2.23 0.00 0.00 178.31 176.99 1jgw h PHE 243 N 0.56 0.00 0.61 0.41 0.04 -1.34 -2.74 116.94 114.48 1jgw h PHE 243 Ca 0.08 0.00 -0.03 0.00 2.80 0.00 0.00 57.97 60.82 1jgw h PHE 243 Cb 0.68 0.00 0.01 0.00 2.20 0.00 0.00 35.95 38.83 1jgw h PHE 243 CO 0.03 0.59 -0.29 0.77 -0.60 0.00 0.00 178.31 178.80 1jgw h SER 244 N 0.00 -0.69 -1.00 2.17 0.02 -1.12 0.13 113.55 113.05 1jgw h SER 244 Ca -0.02 -0.02 0.19 0.00 -0.84 0.00 0.00 61.79 61.11 1jgw h SER 244 Cb 1.46 0.18 -0.11 0.00 0.14 0.00 0.00 62.40 64.07 1jgw h SER 244 CO 0.07 -0.41 0.61 0.00 -1.14 0.00 0.00 176.83 175.97 1jgw h ALA 245 N -0.63 1.69 0.30 3.77 0.00 -1.38 -2.48 119.26 120.54 1jgw h ALA 245 Ca -0.08 0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 1jgw h ALA 245 Cb 0.67 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.38 1jgw h ALA 245 CO 0.14 -0.06 -0.15 1.25 0.00 0.00 0.00 179.25 180.43 1jgw h LEU 246 N 0.75 -0.35 -1.98 0.00 5.85 -1.15 -0.85 115.31 117.58 1jgw h LEU 246 Ca 0.58 -0.17 0.09 0.00 0.84 0.00 0.00 57.88 59.22 1jgw h LEU 246 Cb 0.91 0.09 -0.01 0.00 0.37 0.00 0.00 40.66 42.02 1jgw h LEU 246 CO -0.37 0.02 0.42 0.00 -0.34 0.00 0.00 178.44 178.16 1jgw n MET 248 N -3.56 0.65 0.26 0.00 2.81 -1.09 -3.66 117.12 112.54 1jgw n MET 248 Ca 0.05 0.12 0.15 0.00 -1.81 0.00 0.00 57.70 56.21 1jgw n MET 248 Cb 0.57 -1.67 0.62 0.00 -0.71 0.00 0.00 33.22 32.03 1jgw n MET 248 CO 0.00 0.00 0.00 0.97 1.51 0.00 0.00 175.97 178.45 1jgw h ILE 249 N 0.00 0.20 -0.01 2.02 6.09 0.14 -2.77 117.51 123.19 1jgw h ILE 249 Ca -0.33 -0.70 0.00 0.00 -1.37 0.00 0.00 64.86 62.47 1jgw h ILE 249 Cb 1.89 1.58 0.00 0.00 0.47 0.00 0.00 36.82 40.76 1jgw h ILE 249 CO 0.04 0.07 -0.54 2.30 -3.07 0.00 0.00 178.15 176.95 1jgw n ILE 250 N -3.21 0.00 -3.32 2.19 -5.35 -1.02 -4.63 119.36 104.01 1jgw n ILE 250 Ca 0.00 -0.15 -0.41 0.00 -0.27 0.00 0.00 62.75 61.92 1jgw n ILE 250 Cb 0.34 0.92 -0.09 0.00 -1.74 0.00 0.00 39.64 39.07 1jgw n ILE 250 CO 0.00 0.00 0.00 -0.89 -1.76 0.00 0.00 176.55 173.90 1jgw s THR 251 N -2.64 5.09 0.00 7.28 2.01 -1.05 -2.60 115.64 123.73 1jgw s THR 251 Ca 0.17 0.13 0.00 0.00 0.31 0.00 0.00 61.69 62.30 1jgw s THR 251 Cb 0.18 -3.91 0.00 0.00 0.01 0.00 0.00 72.50 68.78 1jgw s THR 251 CO 0.64 -0.19 0.00 0.61 -0.69 0.00 0.00 174.62 174.99 1jgw n GLY 252 N 4.90 0.61 0.00 4.40 0.00 0.28 -4.96 105.19 110.43 1jgw n GLY 252 Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.95 1jgw n GLY 252 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1jgw n THR 253 N -1.37 0.00 0.23 2.61 -2.24 -1.25 -4.84 114.28 107.43 1jgw n THR 253 Ca 0.00 0.00 0.13 0.00 -2.27 0.00 0.00 64.05 61.91 1jgw n THR 253 Cb 0.00 -0.57 0.29 0.00 -2.10 0.00 0.00 70.33 67.94 1jgw n THR 253 CO 0.00 0.00 0.00 0.16 -0.57 0.00 0.00 175.07 174.66 1jgw h ILE 254 N 0.00 0.04 -3.41 2.28 3.07 -1.85 -3.42 117.51 114.21 1jgw h ILE 254 Ca 0.00 -0.93 -0.37 0.00 1.55 0.00 0.00 64.86 65.10 1jgw h ILE 254 Cb 0.00 1.90 -0.36 0.00 -0.27 0.00 0.00 36.82 38.09 1jgw h ILE 254 CO 0.00 0.02 -0.75 0.86 -1.05 0.00 0.00 178.15 177.23 1jgw s TRP 255 N -3.31 0.40 -0.01 0.16 -0.11 -1.07 -5.01 118.94 109.99 1jgw s TRP 255 Ca 0.05 -0.02 0.01 0.00 1.22 0.00 0.00 56.10 57.36 1jgw s TRP 255 Cb 0.06 -0.53 0.02 0.00 -1.50 0.00 0.00 33.47 31.52 1jgw s TRP 255 CO 0.64 -0.19 0.88 1.97 -4.62 0.00 0.00 176.95 175.64 1jgw n PHE 256 N 4.50 0.00 -3.07 5.86 1.16 -1.26 -0.55 117.46 124.09 1jgw n PHE 256 Ca -0.19 -0.08 0.00 0.00 -1.87 0.00 0.00 57.45 55.31 1jgw n PHE 256 Cb 0.50 -0.04 0.00 0.00 -1.61 0.00 0.00 39.48 38.33 1jgw n PHE 256 CO 0.00 0.00 0.00 -0.25 -1.87 0.00 0.00 176.76 174.64 1jgw n ASP 257 N -0.11 0.19 -4.74 5.98 8.00 -1.26 -4.95 116.55 119.67 1jgw n ASP 257 Ca 0.01 -0.97 -0.42 0.00 0.71 0.00 0.00 54.79 54.12 1jgw n ASP 257 Cb 0.63 0.00 -0.03 0.00 -0.02 0.00 0.00 41.12 41.71 1jgw n ASP 257 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 1jgw s GLN 258 N -1.88 4.30 0.30 -1.24 -1.52 -1.26 -4.80 119.66 113.57 1jgw s GLN 258 Ca 0.00 2.21 0.02 0.00 -1.95 0.00 0.00 55.36 55.64 1jgw s GLN 258 Cb 0.00 -3.16 0.48 0.00 -0.22 0.00 0.00 33.01 30.12 1jgw s GLN 258 CO 0.00 -0.40 1.81 -1.49 -0.25 0.00 0.00 175.29 174.96 1jgw h TRP 259 N 5.56 0.62 0.00 0.91 4.06 -1.73 -2.59 115.95 122.78 1jgw h TRP 259 Ca -0.45 -0.09 -0.01 0.00 2.06 0.00 0.00 58.89 60.41 1jgw h TRP 259 Cb 1.21 -0.17 -0.00 0.00 -1.00 0.00 0.00 29.16 29.20 1jgw h TRP 259 CO 0.62 0.64 -0.04 -0.24 -3.56 0.00 0.00 178.44 175.85 1jgw h VAL 260 N 0.54 1.03 0.00 1.49 3.04 -1.81 -1.58 116.25 118.95 1jgw h VAL 260 Ca 0.11 -0.15 -0.07 0.00 -1.01 0.00 0.00 66.70 65.58 1jgw h VAL 260 Cb 0.45 1.08 -0.01 0.00 -2.01 0.00 0.00 31.29 30.80 1jgw h VAL 260 CO 0.02 0.04 -0.31 0.44 -1.01 0.00 0.00 177.57 176.76 1jgw h ASP 261 N 0.00 0.00 -0.21 3.17 3.32 -1.85 -2.81 116.42 118.05 1jgw h ASP 261 Ca -0.00 0.00 0.06 0.00 0.02 0.00 0.00 57.03 57.11 1jgw h ASP 261 Cb 0.08 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.62 1jgw h ASP 261 CO 0.01 0.31 0.18 -0.25 -1.72 0.00 0.00 179.24 177.76 1jgw h TRP 262 N 0.00 0.00 0.00 4.55 7.01 -1.32 -1.90 115.95 124.29 1jgw h TRP 262 Ca -0.00 0.00 0.00 0.00 2.11 0.00 0.00 58.89 61.00 1jgw h TRP 262 Cb 0.80 0.00 0.00 0.00 -2.10 0.00 0.00 29.16 27.86 1jgw h TRP 262 CO 0.00 0.00 0.00 0.91 -2.79 0.00 0.00 178.44 176.56 1jgw n TRP 263 N -4.15 0.00 0.25 2.65 7.02 -1.06 -3.42 117.44 118.73 1jgw n TRP 263 Ca 0.02 0.00 0.13 0.00 -1.02 0.00 0.00 57.50 56.63 1jgw n TRP 263 Cb 0.31 -0.23 0.54 0.00 -2.42 0.00 0.00 31.31 29.51 1jgw n TRP 263 CO 0.00 0.00 0.00 1.96 -2.02 0.00 0.00 177.69 177.63 1jgw h GLN 264 N 0.00 0.00 -1.00 -0.99 4.20 -1.55 -3.05 115.11 112.72 1jgw h GLN 264 Ca 0.00 0.00 0.11 0.00 0.06 0.00 0.00 58.65 58.82 1jgw h GLN 264 Cb 0.16 0.00 -0.08 0.00 0.30 0.00 0.00 27.48 27.85 1jgw h GLN 264 CO 0.00 0.12 0.63 0.11 -0.67 0.00 0.00 178.83 179.02 1jgw h TRP 265 N 0.00 1.15 0.20 2.96 5.08 -1.80 -0.39 115.95 123.16 1jgw h TRP 265 Ca -0.00 0.03 -0.01 0.00 1.08 0.00 0.00 58.89 59.99 1jgw h TRP 265 Cb 0.66 -0.37 0.00 0.00 -3.00 0.00 0.00 29.16 26.45 1jgw h TRP 265 CO 0.00 0.48 -0.10 2.35 -1.28 0.00 0.00 178.44 179.90 1jgw h TRP 266 N 1.03 -0.25 0.00 0.12 2.91 -1.81 -3.18 115.95 114.77 1jgw h TRP 266 Ca 0.48 -0.01 -0.05 0.00 1.13 0.00 0.00 58.89 60.44 1jgw h TRP 266 Cb 0.43 0.08 -0.01 0.00 -0.51 0.00 0.00 29.16 29.15 1jgw h TRP 266 CO -0.00 0.04 -0.26 -0.24 -1.03 0.00 0.00 178.44 176.95 1jgw h VAL 267 N -0.54 1.14 -0.00 2.65 3.04 -1.56 -2.78 116.25 118.19 1jgw h VAL 267 Ca -0.03 -0.91 0.00 0.00 -1.01 0.00 0.00 66.70 64.75 1jgw h VAL 267 Cb 0.40 1.50 0.00 0.00 -2.01 0.00 0.00 31.29 31.18 1jgw h VAL 267 CO 0.04 0.26 0.00 0.29 -1.01 0.00 0.00 177.57 177.15 1jgw n LYS 268 N -4.15 1.05 -1.68 4.17 4.76 -0.19 -3.90 118.16 118.22 1jgw n LYS 268 Ca -0.02 -0.07 -0.47 0.00 -2.87 0.00 0.00 58.31 54.88 1jgw n LYS 268 Cb 0.32 -1.46 -0.04 0.00 -1.84 0.00 0.00 35.03 32.01 1jgw n LYS 268 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 1jgw n LEU 269 N -0.88 3.44 -0.27 -0.35 4.77 -1.05 -4.55 117.00 118.12 1jgw n LEU 269 Ca 0.22 0.99 0.00 0.00 -0.03 0.00 0.00 56.01 57.19 1jgw n LEU 269 Cb 0.12 -1.40 0.04 0.00 -2.33 0.00 0.00 43.42 39.85 1jgw n LEU 269 CO 0.16 -0.08 0.42 -2.65 -1.33 0.00 0.00 177.39 173.92 1jgw n PRO 270 N 5.93 -0.14 -0.34 3.23 -0.02 -1.26 0.07 135.00 142.47 1jgw n PRO 270 Ca 0.21 1.08 0.05 0.00 -2.02 0.00 0.00 63.50 62.82 1jgw n PRO 270 Cb 0.30 -1.60 0.13 0.00 -0.02 0.00 0.00 33.50 32.32 1jgw n PRO 270 CO 0.00 0.00 0.00 -1.49 1.98 0.00 0.00 175.50 175.99 1jgw h TRP 271 N 0.00 -0.48 -0.00 6.00 6.55 -1.96 -2.61 115.95 123.44 1jgw h TRP 271 Ca 0.26 0.08 0.00 0.00 0.95 0.00 0.00 58.89 60.19 1jgw h TRP 271 Cb 0.44 0.36 0.00 0.00 -0.86 0.00 0.00 29.16 29.09 1jgw h TRP 271 CO -0.60 -0.40 0.00 -2.67 -1.05 0.00 0.00 178.44 173.72 1jgw n TRP 272 N -5.59 0.00 0.01 0.49 2.14 -0.89 -4.75 117.44 108.86 1jgw n TRP 272 Ca 0.15 -0.02 0.01 0.00 2.07 0.00 0.00 57.50 59.71 1jgw n TRP 272 Cb 0.48 -0.00 0.03 0.00 -0.81 0.00 0.00 31.31 31.01 1jgw n TRP 272 CO 0.00 0.00 0.00 0.00 2.07 0.00 0.00 177.69 179.76 1jgw n ALA 273 N 0.08 0.55 0.00 -1.67 0.00 0.11 -2.50 120.51 117.08 1jgw n ALA 273 Ca 0.01 0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.46 1jgw n ALA 273 Cb 0.05 -0.57 0.00 0.00 0.00 0.00 0.00 19.45 18.93 1jgw n ALA 273 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1jgw n ASN 274 N -1.34 1.01 -4.52 0.00 4.13 -1.26 -4.90 115.26 108.38 1jgw n ASN 274 Ca -0.00 -0.01 -0.52 0.00 1.68 0.00 0.00 54.58 55.73 1jgw n ASN 274 Cb 0.24 0.23 -0.05 0.00 -1.54 0.00 0.00 39.78 38.65 1jgw n ASN 274 CO 0.00 0.00 0.00 -0.38 0.28 0.00 0.00 177.26 177.16 1jgw n ILE 275 N -0.33 0.83 -1.33 2.41 5.41 -1.04 -4.91 119.36 120.40 1jgw n ILE 275 Ca 0.00 -0.21 -0.29 0.00 1.00 0.00 0.00 62.75 63.25 1jgw n ILE 275 Cb 0.00 -0.44 0.20 0.00 -0.71 0.00 0.00 39.64 38.68 1jgw n ILE 275 CO 0.00 0.00 0.00 -2.16 0.00 0.00 0.00 176.55 174.39 1jgw s PRO 276 N -0.36 -0.07 0.42 0.38 0.04 -1.26 -4.70 135.00 129.44 1jgw s PRO 276 Ca 0.77 0.08 0.00 0.00 0.04 0.00 0.00 61.00 61.88 1jgw s PRO 276 Cb -0.99 -1.72 0.00 0.00 0.04 0.00 0.00 34.50 31.84 1jgw s PRO 276 CO 0.54 -2.98 0.00 0.41 0.04 0.00 0.00 177.00 175.02 1jgw n GLY 277 N -1.70 -1.95 3.01 0.56 0.00 -1.26 -4.92 105.19 98.94 1jgw n GLY 277 Ca 0.10 -1.28 0.00 0.00 0.00 0.00 0.00 46.02 44.84 1jgw n GLY 277 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1jgw n GLY 278 N -2.53 0.60 0.05 -0.02 0.00 -1.26 -3.59 105.19 98.44 1jgw n GLY 278 Ca 0.01 -1.37 -0.06 0.00 0.00 0.00 0.00 46.02 44.60 1jgw n GLY 278 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1jgw n ILE 279 N 0.00 0.60 -2.09 -0.61 2.08 -1.26 -4.70 119.36 113.39 1jgw n ILE 279 Ca 0.00 -0.31 -0.29 0.00 0.56 0.00 0.00 62.75 62.72 1jgw n ILE 279 Cb 0.00 -0.82 0.02 0.00 -0.75 0.00 0.00 39.64 38.09 1jgw n ILE 279 CO 0.00 0.00 0.00 0.59 0.56 0.00 0.00 176.55 177.70 1jgw n ASN 280 N -2.54 5.57 0.00 4.38 3.02 -1.26 -5.28 115.26 119.15 1jgw n ASN 280 Ca -0.16 -3.76 0.00 0.00 -0.03 0.00 0.00 54.58 50.63 1jgw n ASN 280 Cb 0.75 -0.57 0.00 0.00 -0.61 0.00 0.00 39.78 39.35 1jgw n ASN 280 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25