#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1jgz s LEU 2 N 0.00 3.83 0.46 0.00 1.43 -1.26 -4.56 118.68 118.58 1jgz s LEU 2 Ca 0.00 -0.02 -0.20 0.00 -1.03 0.00 0.00 54.13 52.87 1jgz s LEU 2 Cb 0.00 -2.50 -0.10 0.00 0.03 0.00 0.00 46.19 43.63 1jgz s LEU 2 CO 0.00 0.15 1.00 -0.76 0.23 0.00 0.00 176.35 176.97 1jgz s LEU 3 N -2.56 3.88 0.57 1.79 1.43 -1.26 -4.91 118.68 117.62 1jgz s LEU 3 Ca 0.30 1.81 0.40 0.00 -1.03 0.00 0.00 54.13 55.61 1jgz s LEU 3 Cb -0.12 -4.55 1.51 0.00 0.03 0.00 0.00 46.19 43.06 1jgz s LEU 3 CO 0.23 -0.59 1.63 0.77 0.23 0.00 0.00 176.35 178.61 1jgz h SER 4 N 1.70 0.00 -0.24 2.29 4.64 -2.08 0.58 113.55 120.45 1jgz h SER 4 Ca -0.49 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.83 1jgz h SER 4 Cb 1.20 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.29 1jgz h SER 4 CO 0.60 0.00 0.00 2.22 -0.87 0.00 0.00 176.83 178.78 1jgz n PHE 5 N -3.87 0.32 -0.17 4.77 1.16 -1.26 -4.79 117.46 113.62 1jgz n PHE 5 Ca 0.31 -0.43 -0.11 0.00 -1.87 0.00 0.00 57.45 55.36 1jgz n PHE 5 Cb 1.57 -0.03 0.00 0.00 -1.61 0.00 0.00 39.48 39.41 1jgz n PHE 5 CO 0.00 0.00 0.00 1.49 -1.87 0.00 0.00 176.76 176.38 1jgz h GLU 6 N 1.66 1.02 -0.68 3.97 4.81 -1.23 -3.37 114.58 120.76 1jgz h GLU 6 Ca 0.00 -0.42 0.14 0.00 -0.13 0.00 0.00 59.36 58.95 1jgz h GLU 6 Cb 0.64 -0.04 -0.13 0.00 0.63 0.00 0.00 28.75 29.85 1jgz h GLU 6 CO 0.00 1.10 -0.14 -0.09 -0.73 0.00 0.00 179.01 179.15 1jgz h ARG 7 N 0.89 0.02 -0.02 1.92 2.43 -1.87 -1.54 114.38 116.20 1jgz h ARG 7 Ca 0.12 -0.00 0.01 0.00 -0.81 0.00 0.00 59.98 59.30 1jgz h ARG 7 Cb 0.76 -0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 30.30 1jgz h ARG 7 CO 0.06 0.01 0.21 1.57 -1.51 0.00 0.00 179.97 180.31 1jgz h LYS 8 N 0.02 0.00 0.00 0.20 2.10 -1.98 -1.64 116.57 115.27 1jgz h LYS 8 Ca 0.33 0.00 -0.08 0.00 -2.00 0.00 0.00 60.65 58.90 1jgz h LYS 8 Cb 0.52 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.84 1jgz h LYS 8 CO -0.68 0.00 -1.24 0.66 -2.00 0.00 0.00 179.45 176.19 1jgz n TYR 9 N -3.04 0.92 -0.96 0.07 4.01 -0.58 -4.56 117.16 113.02 1jgz n TYR 9 Ca -0.02 0.29 -0.22 0.00 -0.16 0.00 0.00 57.90 57.79 1jgz n TYR 9 Cb 0.27 -1.00 -0.08 0.00 -0.31 0.00 0.00 39.34 38.22 1jgz n TYR 9 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 1jgz n ARG 10 N -2.75 2.40 -2.42 -0.72 1.74 -0.62 -4.91 116.66 109.38 1jgz n ARG 10 Ca -0.05 -1.39 -0.24 0.00 -0.77 0.00 0.00 57.85 55.40 1jgz n ARG 10 Cb 0.68 -2.30 0.05 0.00 -1.02 0.00 0.00 32.46 29.87 1jgz n ARG 10 CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 1jgz s VAL 11 N 2.01 2.76 0.69 1.55 -7.23 -1.26 -5.08 120.40 113.84 1jgz s VAL 11 Ca 0.57 -0.35 -0.11 0.00 -1.81 0.00 0.00 61.98 60.28 1jgz s VAL 11 Cb 0.21 -3.12 0.02 0.00 0.56 0.00 0.00 36.38 34.04 1jgz s VAL 11 CO -0.03 -0.11 1.07 -2.84 -0.31 0.00 0.00 175.10 172.89 1jgz s PRO 12 N -5.01 2.84 0.00 4.82 0.02 -1.26 -5.00 135.00 131.40 1jgz s PRO 12 Ca 0.57 0.39 0.00 0.00 0.02 0.00 0.00 61.00 61.98 1jgz s PRO 12 Cb -0.11 -2.05 0.00 0.00 0.02 0.00 0.00 34.50 32.36 1jgz s PRO 12 CO 0.42 -1.01 0.00 0.41 -0.33 0.00 0.00 177.00 176.50 1jgz n GLY 13 N -2.96 2.30 0.00 0.52 0.00 -1.26 -5.04 105.19 98.74 1jgz n GLY 13 Ca 0.07 -1.88 0.00 0.00 0.00 0.00 0.00 46.02 44.21 1jgz n GLY 13 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1jgz n GLY 14 N 1.81 2.63 3.45 -0.02 0.00 -1.26 -4.50 105.19 107.30 1jgz n GLY 14 Ca 0.00 -0.85 -0.45 0.00 0.00 0.00 0.00 46.02 44.72 1jgz n GLY 14 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1jgz n THR 15 N 0.00 1.78 -0.03 2.61 -2.24 -1.26 -4.78 114.28 110.35 1jgz n THR 15 Ca 0.00 -0.50 -0.13 0.00 -2.27 0.00 0.00 64.05 61.15 1jgz n THR 15 Cb 0.00 -0.39 -0.14 0.00 -2.10 0.00 0.00 70.33 67.70 1jgz n THR 15 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1jgz n LEU 16 N 1.66 1.38 -4.02 3.22 4.77 -1.26 -4.86 117.00 117.89 1jgz n LEU 16 Ca 0.13 0.25 -0.15 0.00 -0.03 0.00 0.00 56.01 56.22 1jgz n LEU 16 Cb 0.32 -0.21 -0.13 0.00 -2.33 0.00 0.00 43.42 41.07 1jgz n LEU 16 CO 0.56 0.57 -0.41 -0.69 -1.33 0.00 0.00 177.39 176.10 1jgz s VAL 17 N -2.56 0.52 0.00 4.08 1.01 -1.26 -4.86 120.40 117.33 1jgz s VAL 17 Ca -0.13 -0.63 0.00 0.00 0.00 0.00 0.00 61.98 61.23 1jgz s VAL 17 Cb 0.07 -0.51 0.00 0.00 0.00 0.00 0.00 36.38 35.95 1jgz s VAL 17 CO 0.79 -0.09 0.00 0.61 0.00 0.00 0.00 175.10 176.42 1jgz n GLY 18 N 2.28 0.72 7.00 4.51 0.00 -1.26 -4.52 105.19 113.92 1jgz n GLY 18 Ca -0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.85 1jgz n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1jgz n GLY 19 N -2.53 2.57 0.51 -0.02 0.00 -1.26 -1.10 105.19 103.36 1jgz n GLY 19 Ca 0.00 0.32 0.06 0.00 0.00 0.00 0.00 46.02 46.40 1jgz n GLY 19 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1jgz n ASN 20 N 9.87 2.14 -0.29 1.61 6.94 -1.26 -4.55 115.26 129.71 1jgz n ASN 20 Ca 0.00 -1.57 0.07 0.00 -0.02 0.00 0.00 54.58 53.06 1jgz n ASN 20 Cb 0.00 -0.04 0.18 0.00 -2.36 0.00 0.00 39.78 37.56 1jgz n ASN 20 CO 0.00 0.00 0.00 -0.07 -1.03 0.00 0.00 177.26 176.16 1jgz h LEU 21 N 2.31 -0.48 -2.95 -4.53 -0.00 -1.46 -1.42 115.31 106.78 1jgz h LEU 21 Ca 0.00 0.23 0.00 0.00 -0.00 0.00 0.00 57.88 58.11 1jgz h LEU 21 Cb 0.53 0.42 0.00 0.00 -0.00 0.00 0.00 40.66 41.61 1jgz h LEU 21 CO 0.00 -0.24 0.00 0.49 -0.00 0.00 0.00 178.44 178.69 1jgz n PHE 22 N -5.42 0.48 -2.36 1.13 3.72 -1.26 -4.91 117.46 108.83 1jgz n PHE 22 Ca 0.16 -0.55 -0.36 0.00 -0.05 0.00 0.00 57.45 56.64 1jgz n PHE 22 Cb 0.53 -0.07 -0.03 0.00 -0.94 0.00 0.00 39.48 38.97 1jgz n PHE 22 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 1jgz s ASP 23 N -1.14 6.01 -0.24 4.37 2.15 -0.54 -1.15 116.67 126.14 1jgz s ASP 23 Ca 0.24 -1.39 -0.33 0.00 0.43 0.00 0.00 52.55 51.50 1jgz s ASP 23 Cb 0.14 -2.57 0.16 0.00 -0.30 0.00 0.00 42.92 40.35 1jgz s ASP 23 CO 0.13 -1.98 1.26 0.72 -0.17 0.00 0.00 175.17 175.14 1jgz s PHE 24 N 6.96 -0.11 0.70 -5.34 -0.12 -1.26 -5.00 117.98 113.81 1jgz s PHE 24 Ca 0.56 0.12 -0.02 0.00 -0.05 0.00 0.00 56.93 57.55 1jgz s PHE 24 Cb -0.01 0.50 0.10 0.00 -0.63 0.00 0.00 43.02 42.98 1jgz s PHE 24 CO -0.02 -0.13 0.97 -1.58 -0.05 0.00 0.00 175.22 174.41 1jgz s TRP 25 N -1.73 2.02 -0.32 3.49 0.51 -1.26 -1.98 118.94 119.67 1jgz s TRP 25 Ca 0.08 -0.09 0.03 0.00 -2.12 0.00 0.00 56.10 54.00 1jgz s TRP 25 Cb -0.01 -3.05 0.16 0.00 -0.81 0.00 0.00 33.47 29.76 1jgz s TRP 25 CO -0.05 -1.56 0.41 0.08 -0.51 0.00 0.00 176.95 175.32 1jgz s VAL 26 N -3.13 -0.58 0.00 4.03 1.01 0.30 -4.86 120.40 117.17 1jgz s VAL 26 Ca 0.64 -0.44 0.00 0.00 0.00 0.00 0.00 61.98 62.18 1jgz s VAL 26 Cb -0.07 -0.84 0.00 0.00 0.00 0.00 0.00 36.38 35.47 1jgz s VAL 26 CO 0.44 -0.34 0.00 0.61 0.00 0.00 0.00 175.10 175.80 1jgz n GLY 27 N 5.03 1.89 0.15 4.51 0.00 -1.26 -2.37 105.19 113.14 1jgz n GLY 27 Ca 0.04 -0.57 0.04 0.00 0.00 0.00 0.00 46.02 45.53 1jgz n GLY 27 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1jgz h PRO 28 N 0.00 0.00 -6.64 1.61 0.13 -1.98 -3.46 132.00 121.67 1jgz h PRO 28 Ca 0.00 0.00 -0.53 0.00 -0.87 0.00 0.00 66.00 64.60 1jgz h PRO 28 Cb 0.00 0.00 0.04 0.00 0.13 0.00 0.00 31.00 31.17 1jgz h PRO 28 CO 0.00 0.40 0.74 -0.06 -0.23 0.00 0.00 178.00 178.85 1jgz s PHE 29 N -3.00 3.16 0.32 1.56 0.08 -1.00 -5.02 117.98 114.08 1jgz s PHE 29 Ca 0.04 0.98 -0.16 0.00 0.12 0.00 0.00 56.93 57.91 1jgz s PHE 29 Cb 0.07 -3.74 -0.09 0.00 -0.57 0.00 0.00 43.02 38.69 1jgz s PHE 29 CO 0.74 -2.51 0.74 -0.47 -0.10 0.00 0.00 175.22 173.62 1jgz s TYR 30 N 0.61 3.40 0.00 0.36 5.04 -1.26 -0.54 117.35 124.95 1jgz s TYR 30 Ca 0.62 1.24 0.00 0.00 -2.44 0.00 0.00 57.07 56.50 1jgz s TYR 30 Cb -0.39 -2.55 0.00 0.00 0.35 0.00 0.00 41.96 39.37 1jgz s TYR 30 CO 0.35 0.11 0.00 0.28 -1.34 0.00 0.00 175.55 174.95 1jgz n VAL 31 N -0.27 0.00 -0.32 3.14 0.31 -0.84 -4.89 118.33 115.46 1jgz n VAL 31 Ca 0.03 0.00 0.02 0.00 -0.01 0.00 0.00 64.34 64.38 1jgz n VAL 31 Cb 0.53 -0.50 -0.01 0.00 -0.91 0.00 0.00 33.84 32.95 1jgz n VAL 31 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1jgz n GLY 32 N 3.21 -2.92 0.31 2.92 0.00 -0.30 -2.81 105.19 105.60 1jgz n GLY 32 Ca 0.00 -1.29 0.10 0.00 0.00 0.00 0.00 46.02 44.83 1jgz n GLY 32 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1jgz h PHE 33 N -0.15 0.04 0.00 1.61 3.57 -1.79 0.26 116.94 120.48 1jgz h PHE 33 Ca -0.02 0.06 -0.05 0.00 3.53 0.00 0.00 57.97 61.48 1jgz h PHE 33 Cb 0.25 0.12 -0.01 0.00 2.79 0.00 0.00 35.95 39.11 1jgz h PHE 33 CO 0.01 -0.30 -0.26 0.74 -2.23 0.00 0.00 178.31 176.27 1jgz h PHE 34 N 0.10 0.00 -0.53 0.41 0.04 -1.90 -1.94 116.94 113.12 1jgz h PHE 34 Ca 0.51 0.00 -0.06 0.00 2.80 0.00 0.00 57.97 61.22 1jgz h PHE 34 Cb 0.99 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 39.11 1jgz h PHE 34 CO -0.42 0.26 0.10 0.78 -0.60 0.00 0.00 178.31 178.43 1jgz h GLY 35 N 1.39 0.89 0.65 -1.45 0.00 -0.33 0.82 103.07 105.04 1jgz h GLY 35 Ca -0.00 -0.53 -0.00 0.00 0.00 0.00 0.00 47.33 46.79 1jgz h GLY 35 CO 0.03 0.50 -0.04 -2.08 0.00 0.00 0.00 176.54 174.96 1jgz h VAL 36 N 0.79 1.14 -0.36 4.60 2.07 -1.10 -2.64 116.25 120.75 1jgz h VAL 36 Ca 0.17 -0.78 0.04 0.00 0.82 0.00 0.00 66.70 66.95 1jgz h VAL 36 Cb 0.33 1.64 -0.07 0.00 -1.52 0.00 0.00 31.29 31.68 1jgz h VAL 36 CO 0.00 0.19 -0.43 0.00 0.02 0.00 0.00 177.57 177.36 1jgz h ALA 37 N 0.43 -0.65 -0.75 1.67 0.00 -0.83 0.86 119.26 120.00 1jgz h ALA 37 Ca -0.01 0.01 0.09 0.00 0.00 0.00 0.00 54.91 55.00 1jgz h ALA 37 Cb 0.39 1.06 -0.05 0.00 0.00 0.00 0.00 17.79 19.19 1jgz h ALA 37 CO 0.02 -0.86 0.49 0.00 0.00 0.00 0.00 179.25 178.90 1jgz h THR 38 N -0.27 0.94 0.19 0.00 1.03 -0.91 -1.45 112.91 112.44 1jgz h THR 38 Ca 0.06 -0.23 -0.00 0.00 -0.01 0.00 0.00 66.41 66.23 1jgz h THR 38 Cb 0.44 0.22 -0.01 0.00 -1.07 0.00 0.00 68.15 67.73 1jgz h THR 38 CO -0.48 0.12 -0.13 0.15 -0.01 0.00 0.00 175.52 175.17 1jgz h PHE 39 N 0.67 -0.34 -0.37 0.00 3.57 -0.53 0.19 116.94 120.12 1jgz h PHE 39 Ca 0.35 -0.00 0.07 0.00 3.53 0.00 0.00 57.97 61.91 1jgz h PHE 39 Cb 0.46 0.13 -0.09 0.00 2.79 0.00 0.00 35.95 39.23 1jgz h PHE 39 CO -0.00 -0.21 -0.38 0.35 -2.23 0.00 0.00 178.31 175.84 1jgz h PHE 40 N -0.32 -1.09 -0.09 0.41 3.57 -0.01 0.59 116.94 119.99 1jgz h PHE 40 Ca -0.01 0.06 -0.00 0.00 3.53 0.00 0.00 57.97 61.55 1jgz h PHE 40 Cb 0.28 0.53 -0.00 0.00 2.79 0.00 0.00 35.95 39.55 1jgz h PHE 40 CO -0.10 -0.42 0.05 0.74 -2.23 0.00 0.00 178.31 176.35 1jgz h PHE 41 N -0.32 0.13 -0.82 0.41 0.04 -1.07 -2.07 116.94 113.24 1jgz h PHE 41 Ca 0.14 -0.00 0.04 0.00 2.80 0.00 0.00 57.97 60.95 1jgz h PHE 41 Cb 0.57 -0.04 -0.05 0.00 2.20 0.00 0.00 35.95 38.63 1jgz h PHE 41 CO -0.57 0.15 0.52 0.00 -0.60 0.00 0.00 178.31 177.81 1jgz h ALA 42 N 0.96 1.10 0.35 2.45 0.00 -0.26 -0.36 119.26 123.50 1jgz h ALA 42 Ca 0.03 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 1jgz h ALA 42 Cb 0.07 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.60 1jgz h ALA 42 CO -0.01 0.32 -0.17 0.00 0.00 0.00 0.00 179.25 179.40 1jgz h ALA 43 N 1.36 -0.47 -0.37 0.00 0.00 -0.81 -2.79 119.26 116.18 1jgz h ALA 43 Ca 0.34 -0.18 0.08 0.00 0.00 0.00 0.00 54.91 55.14 1jgz h ALA 43 Cb 0.06 0.18 -0.09 0.00 0.00 0.00 0.00 17.79 17.94 1jgz h ALA 43 CO -0.13 -0.59 -0.31 1.25 0.00 0.00 0.00 179.25 179.46 1jgz h LEU 44 N -0.80 -1.02 -1.94 0.00 5.85 -1.21 -0.09 115.31 116.09 1jgz h LEU 44 Ca -0.05 0.18 -0.01 0.00 0.84 0.00 0.00 57.88 58.84 1jgz h LEU 44 Cb 0.52 0.48 -0.00 0.00 0.37 0.00 0.00 40.66 42.03 1jgz h LEU 44 CO 0.08 -0.31 -0.06 1.23 -0.34 0.00 0.00 178.44 179.04 1jgz h GLY 45 N -0.25 0.00 1.32 3.75 0.00 -1.12 -2.01 103.07 104.76 1jgz h GLY 45 Ca 0.17 0.00 -0.19 0.00 0.00 0.00 0.00 47.33 47.30 1jgz h GLY 45 CO -0.51 0.00 -0.66 -2.22 0.00 0.00 0.00 176.54 173.15 1jgz h ILE 46 N 0.00 1.31 0.21 2.60 2.04 -0.78 -2.23 117.51 120.66 1jgz h ILE 46 Ca -0.00 -1.90 -0.00 0.00 1.00 0.00 0.00 64.86 63.95 1jgz h ILE 46 Cb 0.10 1.86 -0.01 0.00 -0.74 0.00 0.00 36.82 38.04 1jgz h ILE 46 CO 0.01 0.60 -0.14 0.40 0.00 0.00 0.00 178.15 179.01 1jgz h ILE 47 N 0.50 0.69 -0.91 -0.67 2.04 -0.54 -1.53 117.51 117.10 1jgz h ILE 47 Ca -0.02 0.00 0.11 0.00 1.00 0.00 0.00 64.86 65.95 1jgz h ILE 47 Cb 1.25 0.69 -0.07 0.00 -0.74 0.00 0.00 36.82 37.96 1jgz h ILE 47 CO 0.13 0.00 0.58 -0.07 0.00 0.00 0.00 178.15 178.80 1jgz h LEU 48 N -0.35 0.79 -0.96 1.44 3.38 -1.33 0.18 115.31 118.46 1jgz h LEU 48 Ca -0.02 0.03 -0.09 0.00 0.09 0.00 0.00 57.88 57.90 1jgz h LEU 48 Cb 0.30 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.91 1jgz h LEU 48 CO 0.01 0.44 -0.18 0.40 0.09 0.00 0.00 178.44 179.20 1jgz h ILE 49 N 0.86 1.25 -0.32 1.22 2.04 -0.97 0.11 117.51 121.70 1jgz h ILE 49 Ca 0.44 -1.17 -0.10 0.00 1.00 0.00 0.00 64.86 65.02 1jgz h ILE 49 Cb 0.49 1.22 -0.01 0.00 -0.74 0.00 0.00 36.82 37.79 1jgz h ILE 49 CO -0.20 0.38 -0.21 0.00 0.00 0.00 0.00 178.15 178.12 1jgz h ALA 50 N 1.31 0.46 -0.49 1.87 0.00 0.07 -1.45 119.26 121.03 1jgz h ALA 50 Ca 0.08 -0.37 0.04 0.00 0.00 0.00 0.00 54.91 54.67 1jgz h ALA 50 Cb 0.60 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 18.24 1jgz h ALA 50 CO 0.04 0.41 0.25 2.35 0.00 0.00 0.00 179.25 182.30 1jgz h TRP 51 N 0.48 0.46 -0.05 0.00 2.91 -0.18 0.89 115.95 120.46 1jgz h TRP 51 Ca 0.07 0.02 -0.02 0.00 1.13 0.00 0.00 58.89 60.09 1jgz h TRP 51 Cb 0.76 -0.14 -0.00 0.00 -0.51 0.00 0.00 29.16 29.27 1jgz h TRP 51 CO 0.06 0.23 -0.05 1.03 -1.03 0.00 0.00 178.44 178.69 1jgz h SER 52 N 0.50 0.06 0.26 2.65 0.87 -0.58 -1.98 113.55 115.33 1jgz h SER 52 Ca 0.21 -0.01 -0.03 0.00 -1.23 0.00 0.00 61.79 60.74 1jgz h SER 52 Cb 0.11 -0.02 -0.00 0.00 -0.44 0.00 0.00 62.40 62.05 1jgz h SER 52 CO -0.14 0.13 -0.14 0.00 -0.53 0.00 0.00 176.83 176.15 1jgz h ALA 53 N 1.88 1.46 0.05 6.23 0.00 0.28 -2.73 119.26 126.43 1jgz h ALA 53 Ca 0.02 -0.12 -0.07 0.00 0.00 0.00 0.00 54.91 54.73 1jgz h ALA 53 Cb 0.14 -0.02 0.01 0.00 0.00 0.00 0.00 17.79 17.91 1jgz h ALA 53 CO 0.01 0.17 -0.31 -0.39 0.00 0.00 0.00 179.25 178.73 1jgz h VAL 54 N 0.00 1.68 -0.16 0.00 -1.51 -1.14 -1.50 116.25 113.62 1jgz h VAL 54 Ca -0.00 -2.38 0.05 0.00 -1.23 0.00 0.00 66.70 63.13 1jgz h VAL 54 Cb 0.31 3.28 -0.01 0.00 -2.13 0.00 0.00 31.29 32.74 1jgz h VAL 54 CO 0.02 0.64 0.18 -0.07 -1.23 0.00 0.00 177.57 177.11 1jgz h LEU 55 N -0.74 0.00 0.00 4.19 3.38 -1.47 0.50 115.31 121.17 1jgz h LEU 55 Ca -0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.92 1jgz h LEU 55 Cb 1.23 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.98 1jgz h LEU 55 CO 0.06 0.00 -0.71 1.67 0.09 0.00 0.00 178.44 179.55 1jgz n GLN 56 N -3.80 0.27 -2.69 1.13 7.27 -1.04 -4.98 117.38 113.53 1jgz n GLN 56 Ca 0.01 0.06 -0.05 0.00 0.07 0.00 0.00 57.00 57.09 1jgz n GLN 56 Cb 0.30 -1.65 0.02 0.00 2.41 0.00 0.00 30.24 31.32 1jgz n GLN 56 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1jgz n GLY 57 N 1.36 0.55 3.59 1.69 0.00 0.17 -5.05 105.19 107.50 1jgz n GLY 57 Ca 0.03 -0.44 -0.10 0.00 0.00 0.00 0.00 46.02 45.50 1jgz n GLY 57 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1jgz s THR 58 N -3.08 0.00 -0.51 2.61 -1.32 -0.58 -5.01 115.64 107.75 1jgz s THR 58 Ca 0.11 0.00 0.06 0.00 -1.21 0.00 0.00 61.69 60.65 1jgz s THR 58 Cb -0.05 -1.00 0.16 0.00 -1.51 0.00 0.00 72.50 70.10 1jgz s THR 58 CO 0.17 0.00 1.11 0.79 -2.21 0.00 0.00 174.62 174.48 1jgz n TRP 59 N 1.10 0.24 -2.73 9.09 7.02 -1.26 -4.42 117.44 126.47 1jgz n TRP 59 Ca -0.11 -0.47 -0.42 0.00 -1.02 0.00 0.00 57.50 55.47 1jgz n TRP 59 Cb 0.57 -0.04 -0.03 0.00 -2.42 0.00 0.00 31.31 29.40 1jgz n TRP 59 CO 0.00 0.00 0.00 1.21 -2.02 0.00 0.00 177.69 176.88 1jgz s ASN 60 N -0.97 7.20 0.26 -0.99 2.47 -1.26 -4.95 114.94 116.71 1jgz s ASN 60 Ca 0.12 1.48 -0.02 0.00 0.42 0.00 0.00 52.86 54.86 1jgz s ASN 60 Cb 0.06 -2.54 0.46 0.00 -1.45 0.00 0.00 41.25 37.79 1jgz s ASN 60 CO 0.08 -0.42 1.83 -0.65 -3.72 0.00 0.00 177.10 174.22 1jgz h PRO 61 N 7.11 0.93 0.00 0.43 0.11 -1.94 -0.25 132.00 138.38 1jgz h PRO 61 Ca -0.31 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 65.74 1jgz h PRO 61 Cb 1.15 -0.21 0.00 0.00 0.11 0.00 0.00 31.00 32.05 1jgz h PRO 61 CO 0.85 0.61 0.00 1.04 -0.21 0.00 0.00 178.00 180.29 1jgz n GLN 62 N -4.64 0.89 0.00 1.05 6.02 -1.26 -3.84 117.38 115.60 1jgz n GLN 62 Ca 0.16 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.15 1jgz n GLN 62 Cb 0.29 -1.27 0.00 0.00 1.02 0.00 0.00 30.24 30.28 1jgz n GLN 62 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 1jgz n LEU 63 N -0.77 2.42 -4.48 1.08 4.77 -0.46 -4.77 117.00 114.79 1jgz n LEU 63 Ca 0.11 0.00 -0.43 0.00 -0.03 0.00 0.00 56.01 55.67 1jgz n LEU 63 Cb 0.05 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.14 1jgz n LEU 63 CO 0.09 0.40 0.18 -0.38 -1.33 0.00 0.00 177.39 176.34 1jgz n ILE 64 N -2.49 1.88 -3.15 -0.08 5.41 -0.23 -4.97 119.36 115.73 1jgz n ILE 64 Ca 0.00 -0.50 0.05 0.00 1.00 0.00 0.00 62.75 63.30 1jgz n ILE 64 Cb 0.46 -0.62 -0.01 0.00 -0.71 0.00 0.00 39.64 38.76 1jgz n ILE 64 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 176.55 176.00 1jgz s SER 65 N -0.88 -0.64 -0.66 4.38 0.15 -1.26 -4.47 113.70 110.32 1jgz s SER 65 Ca 0.63 0.37 -0.22 0.00 0.70 0.00 0.00 55.95 57.43 1jgz s SER 65 Cb -0.64 1.53 0.08 0.00 -1.71 0.00 0.00 66.02 65.27 1jgz s SER 65 CO 0.58 -0.12 0.92 -0.69 1.20 0.00 0.00 173.24 175.13 1jgz s VAL 66 N 2.94 4.43 0.46 4.45 1.01 -1.01 -4.88 120.40 127.78 1jgz s VAL 66 Ca 0.05 -0.52 -0.18 0.00 0.00 0.00 0.00 61.98 61.32 1jgz s VAL 66 Cb -0.10 -4.65 -0.09 0.00 0.00 0.00 0.00 36.38 31.53 1jgz s VAL 66 CO -0.14 -1.40 0.94 -0.31 0.00 0.00 0.00 175.10 174.20 1jgz s TYR 67 N 3.76 3.38 1.01 5.22 2.02 -1.26 -2.22 117.35 129.26 1jgz s TYR 67 Ca 0.20 1.50 -0.16 0.00 -0.37 0.00 0.00 57.07 58.24 1jgz s TYR 67 Cb -0.18 -2.79 0.20 0.00 -0.40 0.00 0.00 41.96 38.80 1jgz s TYR 67 CO 0.09 -0.20 1.22 -1.25 -1.57 0.00 0.00 175.55 173.83 1jgz s PRO 68 N -3.57 0.32 0.56 -1.71 0.04 -1.26 -4.13 135.00 125.25 1jgz s PRO 68 Ca 0.60 -0.14 -0.21 0.00 0.04 0.00 0.00 61.00 61.29 1jgz s PRO 68 Cb -0.10 -1.78 -0.04 0.00 0.04 0.00 0.00 34.50 32.62 1jgz s PRO 68 CO 0.22 -2.67 1.31 -2.14 0.04 0.00 0.00 177.00 173.75 1jgz s PRO 69 N -5.61 3.07 0.69 0.56 0.02 -1.26 -4.35 135.00 128.11 1jgz s PRO 69 Ca 0.70 2.11 -0.15 0.00 0.02 0.00 0.00 61.00 63.68 1jgz s PRO 69 Cb -0.08 -2.15 0.02 0.00 0.02 0.00 0.00 34.50 32.30 1jgz s PRO 69 CO 0.54 -1.21 1.16 0.00 -0.33 0.00 0.00 177.00 177.16 1jgz s ALA 70 N -1.38 2.31 0.58 -1.55 0.00 -1.26 -3.09 121.76 117.37 1jgz s ALA 70 Ca 0.74 0.73 0.29 0.00 0.00 0.00 0.00 51.96 53.72 1jgz s ALA 70 Cb -0.37 -3.40 1.56 0.00 0.00 0.00 0.00 23.12 20.91 1jgz s ALA 70 CO 0.43 -1.54 1.87 -0.07 0.00 0.00 0.00 175.76 176.45 1jgz h LEU 71 N -0.05 0.00 -1.22 0.00 3.38 -1.93 -2.12 115.31 113.37 1jgz h LEU 71 Ca -0.47 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.42 1jgz h LEU 71 Cb 1.27 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.01 1jgz h LEU 71 CO 0.52 0.00 -0.27 -0.33 0.09 0.00 0.00 178.44 178.45 1jgz h GLU 72 N 0.00 0.19 0.00 1.13 4.39 -1.98 -2.47 114.58 115.85 1jgz h GLU 72 Ca 0.00 -0.06 0.00 0.00 0.34 0.00 0.00 59.36 59.64 1jgz h GLU 72 Cb 0.62 -0.02 0.00 0.00 -0.10 0.00 0.00 28.75 29.26 1jgz h GLU 72 CO 0.00 0.46 0.00 0.66 -1.16 0.00 0.00 179.01 178.97 1jgz n TYR 73 N -4.16 0.00 0.00 4.33 4.01 -0.80 -4.95 117.16 115.60 1jgz n TYR 73 Ca -0.01 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.73 1jgz n TYR 73 Cb 0.37 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.40 1jgz n TYR 73 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1jgz n GLY 74 N 0.68 2.35 0.42 2.72 0.00 -0.93 -0.06 105.19 110.36 1jgz n GLY 74 Ca 0.11 0.39 0.06 0.00 0.00 0.00 0.00 46.02 46.58 1jgz n GLY 74 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1jgz n LEU 75 N 0.00 2.83 0.00 0.99 4.77 -1.26 -0.92 117.00 123.41 1jgz n LEU 75 Ca 0.00 -2.55 -0.13 0.00 -0.03 0.00 0.00 56.01 53.30 1jgz n LEU 75 Cb 0.00 -0.31 0.08 0.00 -2.33 0.00 0.00 43.42 40.86 1jgz n LEU 75 CO 0.00 0.66 0.36 0.61 -1.33 0.00 0.00 177.39 177.69 1jgz n GLY 76 N -0.48 -0.30 3.75 -0.72 0.00 0.92 -4.97 105.19 103.38 1jgz n GLY 76 Ca 0.13 -1.84 -0.30 0.00 0.00 0.00 0.00 46.02 44.00 1jgz n GLY 76 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1jgz s GLY 77 N -4.11 1.70 -0.06 -0.02 0.00 -1.26 -4.97 107.32 98.59 1jgz s GLY 77 Ca 0.36 -1.22 -0.30 0.00 0.00 0.00 0.00 44.72 43.56 1jgz s GLY 77 CO 0.24 -0.32 0.76 0.00 0.00 0.00 0.00 173.10 173.79 1jgz s ALA 78 N -3.47 -1.80 0.33 3.20 0.00 -1.26 -4.92 121.76 113.84 1jgz s ALA 78 Ca 0.75 1.33 -0.29 0.00 0.00 0.00 0.00 51.96 53.75 1jgz s ALA 78 Cb -0.05 -0.11 -0.12 0.00 0.00 0.00 0.00 23.12 22.84 1jgz s ALA 78 CO 0.55 -0.38 1.51 -2.30 0.00 0.00 0.00 175.76 175.14 1jgz n PRO 79 N 0.77 2.61 -0.36 0.00 -0.02 -1.26 -3.20 135.00 133.53 1jgz n PRO 79 Ca -0.16 0.92 0.03 0.00 -2.02 0.00 0.00 63.50 62.27 1jgz n PRO 79 Cb 0.58 -2.66 0.10 0.00 -0.02 0.00 0.00 33.50 31.50 1jgz n PRO 79 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 1jgz n LEU 80 N 1.28 -0.46 0.00 2.45 4.77 -1.26 0.10 117.00 123.88 1jgz n LEU 80 Ca 0.05 1.69 0.10 0.00 -0.03 0.00 0.00 56.01 57.82 1jgz n LEU 80 Cb 0.37 -0.46 0.49 0.00 -2.33 0.00 0.00 43.42 41.49 1jgz n LEU 80 CO 0.64 -1.58 0.82 0.00 -1.33 0.00 0.00 177.39 175.93 1jgz n ALA 81 N -3.58 2.02 -2.85 -1.18 0.00 -1.26 -2.06 120.51 111.60 1jgz n ALA 81 Ca 0.13 -0.09 -0.18 0.00 0.00 0.00 0.00 53.44 53.30 1jgz n ALA 81 Cb 0.45 -1.33 -0.01 0.00 0.00 0.00 0.00 19.45 18.57 1jgz n ALA 81 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1jgz n LYS 82 N -1.34 1.84 0.00 0.00 5.02 0.28 -4.92 118.16 119.04 1jgz n LYS 82 Ca 0.08 -3.79 0.00 0.00 -2.02 0.00 0.00 58.31 52.58 1jgz n LYS 82 Cb 0.18 -1.74 0.00 0.00 -0.02 0.00 0.00 35.03 33.45 1jgz n LYS 82 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1jgz n GLY 83 N -0.05 3.00 0.05 0.72 0.00 -1.16 -4.35 105.19 103.40 1jgz n GLY 83 Ca 0.23 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.14 1jgz n GLY 83 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1jgz h GLY 84 N 0.00 0.06 0.51 -0.02 0.00 -1.10 -2.59 103.07 99.93 1jgz h GLY 84 Ca 0.00 -0.02 0.10 0.00 0.00 0.00 0.00 47.33 47.41 1jgz h GLY 84 CO 0.00 0.02 0.55 1.41 0.00 0.00 0.00 176.54 178.52 1jgz h LEU 85 N 0.04 0.80 -0.59 3.11 3.38 -1.63 -1.44 115.31 118.98 1jgz h LEU 85 Ca 0.01 0.05 -0.01 0.00 0.09 0.00 0.00 57.88 58.02 1jgz h LEU 85 Cb 0.01 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 40.62 1jgz h LEU 85 CO -0.00 0.45 0.34 -0.25 0.09 0.00 0.00 178.44 179.06 1jgz h TRP 86 N 0.90 0.80 -0.72 1.13 7.01 -1.73 -0.40 115.95 122.94 1jgz h TRP 86 Ca 0.44 -0.01 -0.02 0.00 2.11 0.00 0.00 58.89 61.41 1jgz h TRP 86 Cb 0.40 -0.26 -0.03 0.00 -2.10 0.00 0.00 29.16 27.17 1jgz h TRP 86 CO -0.03 0.56 0.36 1.96 -2.79 0.00 0.00 178.44 178.50 1jgz h GLN 87 N 0.80 1.01 -0.08 2.65 4.20 -0.90 0.14 115.11 122.92 1jgz h GLN 87 Ca 0.21 -0.13 -0.23 0.00 0.06 0.00 0.00 58.65 58.57 1jgz h GLN 87 Cb 0.02 -0.19 0.01 0.00 0.30 0.00 0.00 27.48 27.61 1jgz h GLN 87 CO -0.04 0.76 -0.85 0.82 -0.67 0.00 0.00 178.83 178.86 1jgz h ILE 88 N 1.01 1.32 -0.66 2.54 2.04 -1.00 -2.75 117.51 120.00 1jgz h ILE 88 Ca 0.25 -2.14 -0.08 0.00 1.00 0.00 0.00 64.86 63.89 1jgz h ILE 88 Cb 0.07 2.16 -0.03 0.00 -0.74 0.00 0.00 36.82 38.28 1jgz h ILE 88 CO -0.04 0.66 0.09 0.40 0.00 0.00 0.00 178.15 179.26 1jgz h ILE 89 N 0.41 1.27 -0.58 -0.67 2.04 -0.70 -1.66 117.51 117.62 1jgz h ILE 89 Ca -0.07 -1.07 0.03 0.00 1.00 0.00 0.00 64.86 64.75 1jgz h ILE 89 Cb 1.47 0.66 -0.03 0.00 -0.74 0.00 0.00 36.82 38.18 1jgz h ILE 89 CO 0.16 0.40 0.38 0.74 0.00 0.00 0.00 178.15 179.83 1jgz h THR 90 N 1.03 1.08 -0.08 -0.27 2.02 -0.71 0.23 112.91 116.22 1jgz h THR 90 Ca 0.20 -0.24 -0.02 0.00 0.77 0.00 0.00 66.41 67.13 1jgz h THR 90 Cb 0.47 0.34 -0.00 0.00 -1.74 0.00 0.00 68.15 67.21 1jgz h THR 90 CO 0.02 0.13 -0.02 0.40 0.37 0.00 0.00 175.52 176.41 1jgz h ILE 91 N 0.69 1.29 -0.45 3.11 2.04 -1.06 -1.74 117.51 121.39 1jgz h ILE 91 Ca 0.23 -0.93 -0.00 0.00 1.00 0.00 0.00 64.86 65.16 1jgz h ILE 91 Cb 0.06 1.76 -0.02 0.00 -0.74 0.00 0.00 36.82 37.87 1jgz h ILE 91 CO -0.06 0.26 0.27 0.00 0.00 0.00 0.00 178.15 178.62 1jgz h ALA 93 N 1.12 0.25 -0.34 0.00 0.00 -0.53 0.39 119.26 120.16 1jgz h ALA 93 Ca 0.16 0.15 -0.11 0.00 0.00 0.00 0.00 54.91 55.11 1jgz h ALA 93 Cb -0.00 0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 1jgz h ALA 93 CO -0.03 -0.46 -0.25 1.15 0.00 0.00 0.00 179.25 179.66 1jgz h THR 94 N -0.00 1.27 -0.69 0.00 2.02 -0.84 -1.70 112.91 112.97 1jgz h THR 94 Ca 0.19 -1.34 -0.05 0.00 0.77 0.00 0.00 66.41 65.98 1jgz h THR 94 Cb 0.29 1.29 -0.03 0.00 -1.74 0.00 0.00 68.15 67.96 1jgz h THR 94 CO -0.40 0.44 0.24 1.23 0.37 0.00 0.00 175.52 177.39 1jgz h GLY 95 N 0.99 1.13 0.85 2.16 0.00 0.42 -2.03 103.07 106.59 1jgz h GLY 95 Ca 0.08 -0.65 -0.00 0.00 0.00 0.00 0.00 47.33 46.76 1jgz h GLY 95 CO 0.06 0.61 0.02 0.00 0.00 0.00 0.00 176.54 177.22 1jgz h ALA 96 N 1.11 0.06 -0.74 3.60 0.00 -0.07 -2.27 119.26 120.94 1jgz h ALA 96 Ca 0.23 -0.09 0.02 0.00 0.00 0.00 0.00 54.91 55.07 1jgz h ALA 96 Cb 0.26 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 17.99 1jgz h ALA 96 CO -0.01 -0.35 0.47 0.74 0.00 0.00 0.00 179.25 180.10 1jgz h PHE 97 N -0.09 0.89 0.05 0.00 0.04 -1.14 -0.27 116.94 116.43 1jgz h PHE 97 Ca 0.02 0.02 -0.00 0.00 2.80 0.00 0.00 57.97 60.81 1jgz h PHE 97 Cb 0.17 -0.30 0.00 0.00 2.20 0.00 0.00 35.95 38.03 1jgz h PHE 97 CO -0.02 0.53 -0.03 0.28 -0.60 0.00 0.00 178.31 178.48 1jgz h VAL 98 N 0.94 1.18 -0.57 -0.55 2.07 -1.36 -2.42 116.25 115.54 1jgz h VAL 98 Ca 0.29 -0.78 0.12 0.00 0.82 0.00 0.00 66.70 67.15 1jgz h VAL 98 Cb -0.03 1.69 -0.09 0.00 -1.52 0.00 0.00 31.29 31.34 1jgz h VAL 98 CO -0.09 0.19 0.01 0.28 0.02 0.00 0.00 177.57 177.99 1jgz h SER 99 N -0.42 -0.22 -0.81 0.57 0.02 -1.20 -0.68 113.55 110.81 1jgz h SER 99 Ca -0.01 0.14 0.11 0.00 -0.84 0.00 0.00 61.79 61.19 1jgz h SER 99 Cb 0.37 0.24 -0.08 0.00 0.14 0.00 0.00 62.40 63.07 1jgz h SER 99 CO 0.01 -0.09 0.43 -0.25 -1.14 0.00 0.00 176.83 175.80 1jgz h TRP 100 N 0.13 0.77 0.07 3.45 2.91 -0.89 0.18 115.95 122.58 1jgz h TRP 100 Ca 0.30 0.03 -0.00 0.00 1.13 0.00 0.00 58.89 60.34 1jgz h TRP 100 Cb 0.46 -0.23 0.00 0.00 -0.51 0.00 0.00 29.16 28.89 1jgz h TRP 100 CO -0.33 0.27 -0.03 0.00 -1.03 0.00 0.00 178.44 177.31 1jgz h ALA 101 N 1.48 -0.09 -0.13 2.65 0.00 -0.74 -2.40 119.26 120.03 1jgz h ALA 101 Ca 0.41 -0.16 0.04 0.00 0.00 0.00 0.00 54.91 55.19 1jgz h ALA 101 Cb 0.45 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 1jgz h ALA 101 CO -0.29 -0.40 0.12 -0.07 0.00 0.00 0.00 179.25 178.61 1jgz h LEU 102 N -0.41 0.00 -0.38 0.00 3.38 -0.64 0.26 115.31 117.53 1jgz h LEU 102 Ca -0.01 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.83 1jgz h LEU 102 Cb 0.35 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.10 1jgz h LEU 102 CO 0.02 0.00 -0.27 -0.09 0.09 0.00 0.00 178.44 178.19 1jgz h ARG 103 N 0.00 0.85 0.00 1.13 2.43 -0.24 -2.59 114.38 115.96 1jgz h ARG 103 Ca 0.06 -0.41 -0.04 0.00 -0.81 0.00 0.00 59.98 58.78 1jgz h ARG 103 Cb 0.29 -0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.83 1jgz h ARG 103 CO -0.00 1.05 -0.20 0.93 -1.51 0.00 0.00 179.97 180.24 1jgz h GLU 104 N 0.65 0.00 -0.48 0.20 5.08 -0.48 -2.05 114.58 117.49 1jgz h GLU 104 Ca 0.07 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.35 1jgz h GLU 104 Cb 0.84 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.07 1jgz h GLU 104 CO 0.07 0.20 -0.01 0.28 -1.00 0.00 0.00 179.01 178.55 1jgz h VAL 105 N 0.00 1.26 -0.49 3.13 2.07 -1.02 0.15 116.25 121.35 1jgz h VAL 105 Ca -0.00 -1.08 -0.10 0.00 0.82 0.00 0.00 66.70 66.34 1jgz h VAL 105 Cb 0.45 1.01 -0.02 0.00 -1.52 0.00 0.00 31.29 31.22 1jgz h VAL 105 CO 0.03 0.38 -0.09 -0.33 0.02 0.00 0.00 177.57 177.58 1jgz h GLU 106 N 0.70 0.93 0.00 1.57 5.08 -1.25 -0.70 114.58 120.91 1jgz h GLU 106 Ca 0.13 -0.34 -0.03 0.00 -1.00 0.00 0.00 59.36 58.13 1jgz h GLU 106 Cb 0.52 -0.06 -0.00 0.00 0.50 0.00 0.00 28.75 29.71 1jgz h GLU 106 CO 0.03 1.00 -0.12 0.82 -1.00 0.00 0.00 179.01 179.73 1jgz h ILE 107 N 0.78 0.93 0.03 3.13 2.04 -1.06 -1.16 117.51 122.21 1jgz h ILE 107 Ca 0.13 -0.45 -0.00 0.00 1.00 0.00 0.00 64.86 65.54 1jgz h ILE 107 Cb 0.63 1.25 0.00 0.00 -0.74 0.00 0.00 36.82 37.97 1jgz h ILE 107 CO 0.04 0.12 -0.02 0.00 0.00 0.00 0.00 178.15 178.30 1jgz h ARG 109 N -0.60 1.10 -0.57 0.00 3.08 -0.60 -1.24 114.38 115.55 1jgz h ARG 109 Ca -0.00 -0.07 -0.11 0.00 0.07 0.00 0.00 59.98 59.87 1jgz h ARG 109 Cb 0.55 -0.25 -0.02 0.00 0.08 0.00 0.00 29.97 30.33 1jgz h ARG 109 CO 0.01 0.73 -0.07 -0.22 -1.07 0.00 0.00 179.97 179.35 1jgz h LYS 110 N 1.13 1.05 -0.00 0.04 3.64 -1.30 -2.89 116.57 118.24 1jgz h LYS 110 Ca 0.30 -0.37 0.00 0.00 -1.27 0.00 0.00 60.65 59.31 1jgz h LYS 110 Cb -0.12 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 31.62 1jgz h LYS 110 CO -0.07 1.07 -0.11 1.28 -2.27 0.00 0.00 179.45 179.35 1jgz n LEU 111 N -4.16 0.31 -1.55 5.20 4.77 -1.04 -4.95 117.00 115.58 1jgz n LEU 111 Ca 0.02 0.14 -0.15 0.00 -0.03 0.00 0.00 56.01 55.99 1jgz n LEU 111 Cb 0.39 -0.26 -0.03 0.00 -2.33 0.00 0.00 43.42 41.19 1jgz n LEU 111 CO 0.45 0.06 -0.18 0.61 -1.33 0.00 0.00 177.39 177.00 1jgz n GLY 112 N 1.34 0.37 3.66 -0.72 0.00 -0.50 -5.02 105.19 104.33 1jgz n GLY 112 Ca 0.12 -0.26 -0.21 0.00 0.00 0.00 0.00 46.02 45.67 1jgz n GLY 112 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1jgz n ILE 113 N -3.50 0.00 -2.10 -0.61 -5.35 -1.09 -5.05 119.36 101.66 1jgz n ILE 113 Ca -0.17 -1.94 -0.31 0.00 -0.27 0.00 0.00 62.75 60.06 1jgz n ILE 113 Cb 0.59 -0.32 -0.00 0.00 -1.74 0.00 0.00 39.64 38.17 1jgz n ILE 113 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 1jgz s GLY 114 N -4.31 1.78 -0.11 3.28 0.00 -1.26 -4.70 107.32 102.00 1jgz s GLY 114 Ca 0.45 -0.04 0.04 0.00 0.00 0.00 0.00 44.72 45.18 1jgz s GLY 114 CO 0.29 0.23 1.06 -1.72 0.00 0.00 0.00 173.10 172.96 1jgz n TYR 115 N -2.33 0.88 -0.06 1.90 4.01 -1.26 -4.52 117.16 115.78 1jgz n TYR 115 Ca 0.06 -0.45 -0.08 0.00 -0.16 0.00 0.00 57.90 57.27 1jgz n TYR 115 Cb 0.54 -0.32 -0.01 0.00 -0.31 0.00 0.00 39.34 39.24 1jgz n TYR 115 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 1jgz h HIS 116 N 1.24 -0.01 -0.01 -0.72 3.86 -1.99 -2.62 115.15 114.91 1jgz h HIS 116 Ca 0.06 0.02 0.01 0.00 -1.16 0.00 0.00 60.37 59.29 1jgz h HIS 116 Cb 1.22 0.04 -0.01 0.00 1.06 0.00 0.00 27.41 29.72 1jgz h HIS 116 CO 0.46 -0.04 -0.13 0.82 0.86 0.00 0.00 177.93 179.91 1jgz h ILE 117 N 0.08 0.00 -0.59 2.45 2.04 -2.00 0.22 117.51 119.70 1jgz h ILE 117 Ca 0.12 0.00 0.11 0.00 1.00 0.00 0.00 64.86 66.09 1jgz h ILE 117 Cb 0.15 0.00 -0.08 0.00 -0.74 0.00 0.00 36.82 36.15 1jgz h ILE 117 CO -0.20 0.00 0.13 1.55 0.00 0.00 0.00 178.15 179.64 1jgz h PRO 118 N -0.15 0.26 -0.49 2.37 0.13 -1.90 0.18 132.00 132.40 1jgz h PRO 118 Ca 0.00 -0.02 0.10 0.00 -0.87 0.00 0.00 66.00 65.22 1jgz h PRO 118 Cb 0.17 -0.06 -0.10 0.00 0.13 0.00 0.00 31.00 31.14 1jgz h PRO 118 CO -0.09 0.17 -0.18 0.35 -0.23 0.00 0.00 178.00 178.03 1jgz h PHE 119 N 0.27 -0.43 -0.38 1.56 3.57 -1.10 -0.11 116.94 120.32 1jgz h PHE 119 Ca 0.31 0.05 -0.05 0.00 3.53 0.00 0.00 57.97 61.81 1jgz h PHE 119 Cb 0.45 0.26 -0.02 0.00 2.79 0.00 0.00 35.95 39.44 1jgz h PHE 119 CO -0.24 -0.27 0.03 0.00 -2.23 0.00 0.00 178.31 175.60 1jgz h ALA 120 N 1.33 1.34 0.01 2.41 0.00 0.99 -2.78 119.26 122.57 1jgz h ALA 120 Ca 0.23 -0.20 0.02 0.00 0.00 0.00 0.00 54.91 54.96 1jgz h ALA 120 Cb 0.43 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.03 1jgz h ALA 120 CO -0.54 0.46 -0.13 0.35 0.00 0.00 0.00 179.25 179.39 1jgz h PHE 121 N 0.56 -0.33 -1.69 0.00 3.57 0.78 -1.71 116.94 118.12 1jgz h PHE 121 Ca 0.12 0.01 0.49 0.00 3.53 0.00 0.00 57.97 62.12 1jgz h PHE 121 Cb 0.32 0.15 -0.07 0.00 2.79 0.00 0.00 35.95 39.14 1jgz h PHE 121 CO 0.01 -0.19 1.28 0.00 -2.23 0.00 0.00 178.31 177.17 1jgz h ALA 122 N 0.72 3.60 -0.50 2.41 0.00 -1.01 0.95 119.26 125.43 1jgz h ALA 122 Ca 0.04 -0.06 -0.11 0.00 0.00 0.00 0.00 54.91 54.78 1jgz h ALA 122 Cb 0.27 0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.17 1jgz h ALA 122 CO -0.12 -2.15 -0.12 0.74 0.00 0.00 0.00 179.25 177.61 1jgz h PHE 123 N 0.00 1.05 0.38 0.00 -1.00 -1.40 -0.95 116.94 115.03 1jgz h PHE 123 Ca 0.80 -0.21 -0.02 0.00 2.81 0.00 0.00 57.97 61.35 1jgz h PHE 123 Cb 3.35 -0.26 0.00 0.00 3.61 0.00 0.00 35.95 42.65 1jgz h PHE 123 CO 0.00 1.00 -0.18 0.00 -1.61 0.00 0.00 178.31 177.51 1jgz h ALA 124 N 1.01 -0.52 -0.96 2.45 0.00 0.84 -2.36 119.26 119.73 1jgz h ALA 124 Ca 0.13 -0.16 0.26 0.00 0.00 0.00 0.00 54.91 55.14 1jgz h ALA 124 Cb 0.66 0.20 -0.13 0.00 0.00 0.00 0.00 17.79 18.52 1jgz h ALA 124 CO 0.05 -0.71 0.49 0.82 0.00 0.00 0.00 179.25 179.90 1jgz h ILE 125 N -0.68 0.43 -0.45 0.00 2.04 -1.40 0.35 117.51 117.79 1jgz h ILE 125 Ca -0.05 -0.14 0.02 0.00 1.00 0.00 0.00 64.86 65.68 1jgz h ILE 125 Cb 0.49 -0.03 -0.03 0.00 -0.74 0.00 0.00 36.82 36.51 1jgz h ILE 125 CO 0.09 0.08 0.28 0.25 0.00 0.00 0.00 178.15 178.84 1jgz h LEU 126 N 0.42 0.46 -0.98 1.44 5.85 -0.68 -0.62 115.31 121.19 1jgz h LEU 126 Ca 0.64 -0.00 0.02 0.00 0.84 0.00 0.00 57.88 59.37 1jgz h LEU 126 Cb 1.29 -0.10 -0.05 0.00 0.37 0.00 0.00 40.66 42.17 1jgz h LEU 126 CO -0.55 0.33 0.65 0.00 -0.34 0.00 0.00 178.44 178.53 1jgz h ALA 127 N 1.19 1.26 0.18 1.25 0.00 -0.46 -0.11 119.26 122.58 1jgz h ALA 127 Ca 0.18 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 1jgz h ALA 127 Cb -0.01 -0.39 0.00 0.00 0.00 0.00 0.00 17.79 17.40 1jgz h ALA 127 CO -0.07 0.61 -0.09 -0.92 0.00 0.00 0.00 179.25 178.79 1jgz h TYR 128 N 1.31 -0.22 -0.50 0.00 3.20 -0.79 -2.70 116.97 117.26 1jgz h TYR 128 Ca 0.37 -0.01 0.01 0.00 3.14 0.00 0.00 58.73 62.25 1jgz h TYR 128 Cb -0.12 0.07 -0.03 0.00 1.54 0.00 0.00 36.73 38.20 1jgz h TYR 128 CO -0.00 -0.02 0.33 -0.07 -1.64 0.00 0.00 178.16 176.76 1jgz h LEU 129 N -0.39 0.55 0.30 2.82 3.38 -0.68 -1.54 115.31 119.75 1jgz h LEU 129 Ca -0.02 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.93 1jgz h LEU 129 Cb 0.30 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.90 1jgz h LEU 129 CO 0.04 0.39 -0.38 0.74 0.09 0.00 0.00 178.44 179.32 1jgz h THR 130 N 0.64 0.00 -0.87 0.22 2.02 -0.76 0.54 112.91 114.70 1jgz h THR 130 Ca 0.19 0.00 0.07 0.00 0.77 0.00 0.00 66.41 67.44 1jgz h THR 130 Cb -0.02 0.00 -0.06 0.00 -1.74 0.00 0.00 68.15 66.34 1jgz h THR 130 CO -0.04 0.00 0.57 -0.07 0.37 0.00 0.00 175.52 176.34 1jgz h LEU 131 N -0.70 0.85 0.00 2.58 3.38 -1.17 -0.19 115.31 120.07 1jgz h LEU 131 Ca -0.04 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.94 1jgz h LEU 131 Cb 0.62 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.20 1jgz h LEU 131 CO -0.09 0.54 -1.57 1.33 0.09 0.00 0.00 178.44 178.74 1jgz n VAL 132 N -4.49 0.00 0.02 1.22 0.24 -0.61 -4.38 118.33 110.32 1jgz n VAL 132 Ca 0.13 -0.30 0.00 0.00 -2.04 0.00 0.00 64.34 62.13 1jgz n VAL 132 Cb 0.22 0.40 0.00 0.00 -1.47 0.00 0.00 33.84 32.99 1jgz n VAL 132 CO 0.00 0.00 0.00 -0.11 -2.14 0.00 0.00 176.83 174.58 1jgz n LEU 133 N -1.94 0.13 -0.05 1.34 0.00 0.17 -4.74 117.00 111.91 1jgz n LEU 133 Ca -0.01 0.05 -0.14 0.00 0.00 0.00 0.00 56.01 55.92 1jgz n LEU 133 Cb 0.46 -0.01 -0.08 0.00 0.00 0.00 0.00 43.42 43.78 1jgz n LEU 133 CO 0.43 -0.29 0.56 -0.26 0.00 0.00 0.00 177.39 177.82 1jgz h PHE 134 N 0.00 0.41 -0.27 1.96 0.04 -0.69 -2.45 116.94 115.94 1jgz h PHE 134 Ca 0.00 -0.14 -0.03 0.00 2.80 0.00 0.00 57.97 60.60 1jgz h PHE 134 Cb 0.52 -0.08 -0.01 0.00 2.20 0.00 0.00 35.95 38.58 1jgz h PHE 134 CO 0.00 0.79 0.03 -0.09 -0.60 0.00 0.00 178.31 178.44 1jgz h ARG 135 N -0.09 0.45 -0.35 1.51 2.43 -1.26 -2.21 114.38 114.86 1jgz h ARG 135 Ca 0.01 -0.13 -0.01 0.00 -0.81 0.00 0.00 59.98 59.04 1jgz h ARG 135 Cb 0.75 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 30.23 1jgz h ARG 135 CO 0.04 0.58 0.18 -1.35 -1.51 0.00 0.00 179.97 177.91 1jgz h PRO 136 N 0.25 0.49 0.00 0.20 0.11 -1.77 -1.76 132.00 129.52 1jgz h PRO 136 Ca 0.08 -0.06 -0.03 0.00 0.11 0.00 0.00 66.00 66.10 1jgz h PRO 136 Cb 0.36 -0.09 -0.00 0.00 0.11 0.00 0.00 31.00 31.37 1jgz h PRO 136 CO 0.01 0.42 -0.13 0.28 -0.21 0.00 0.00 178.00 178.38 1jgz h VAL 137 N 0.43 0.88 -0.00 3.15 2.07 -1.45 0.91 116.25 122.23 1jgz h VAL 137 Ca 0.12 -0.46 0.00 0.00 0.82 0.00 0.00 66.70 67.18 1jgz h VAL 137 Cb 0.09 1.27 0.00 0.00 -1.52 0.00 0.00 31.29 31.12 1jgz h VAL 137 CO -0.02 0.12 -0.14 0.23 0.02 0.00 0.00 177.57 177.79 1jgz n MET 138 N -4.08 0.35 -0.06 1.57 2.81 -0.83 -2.85 117.12 114.02 1jgz n MET 138 Ca -0.02 -0.10 0.02 0.00 -1.81 0.00 0.00 57.70 55.78 1jgz n MET 138 Cb 0.21 -1.50 0.06 0.00 -0.71 0.00 0.00 33.22 31.28 1jgz n MET 138 CO 0.00 0.00 0.00 -1.33 1.51 0.00 0.00 175.97 176.15 1jgz n MET 139 N -1.24 2.95 -3.91 0.03 2.81 -0.26 -4.96 117.12 112.55 1jgz n MET 139 Ca 0.11 -1.70 -0.29 0.00 -1.81 0.00 0.00 57.70 54.01 1jgz n MET 139 Cb 0.30 -1.10 0.02 0.00 -0.71 0.00 0.00 33.22 31.73 1jgz n MET 139 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1jgz n GLY 140 N -0.13 -0.43 3.51 3.03 0.00 0.15 -4.97 105.19 106.35 1jgz n GLY 140 Ca 0.04 0.17 0.01 0.00 0.00 0.00 0.00 46.02 46.24 1jgz n GLY 140 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1jgz s ALA 141 N -3.43 -2.65 0.61 4.61 0.00 -0.86 -4.01 121.76 116.03 1jgz s ALA 141 Ca 0.48 2.04 0.42 0.00 0.00 0.00 0.00 51.96 54.91 1jgz s ALA 141 Cb -0.25 -1.96 2.28 0.00 0.00 0.00 0.00 23.12 23.19 1jgz s ALA 141 CO 0.84 -0.59 2.33 -1.49 0.00 0.00 0.00 175.76 176.85 1jgz h TRP 142 N 6.34 0.00 0.00 0.00 4.06 -1.29 -2.73 115.95 122.33 1jgz h TRP 142 Ca -0.22 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.73 1jgz h TRP 142 Cb 1.15 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.31 1jgz h TRP 142 CO 0.17 0.00 0.00 0.78 -3.56 0.00 0.00 178.44 175.84 1jgz h GLY 143 N 0.18 0.00 1.89 1.49 0.00 -1.78 -2.52 103.07 102.33 1jgz h GLY 143 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1jgz h GLY 143 CO 0.00 0.00 -0.08 -0.97 0.00 0.00 0.00 176.54 175.49 1jgz h TYR 144 N 0.00 0.00 -4.03 5.60 0.05 -1.80 -3.46 116.97 113.32 1jgz h TYR 144 Ca 0.00 0.00 -0.46 0.00 0.05 0.00 0.00 58.73 58.32 1jgz h TYR 144 Cb 0.07 0.00 0.15 0.00 1.01 0.00 0.00 36.73 37.96 1jgz h TYR 144 CO 0.00 0.00 0.24 0.00 -1.05 0.00 0.00 178.16 177.35 1jgz s ALA 145 N -3.13 1.36 0.37 3.88 0.00 -0.95 -4.92 121.76 118.37 1jgz s ALA 145 Ca 0.09 -0.32 -0.04 0.00 0.00 0.00 0.00 51.96 51.69 1jgz s ALA 145 Cb 0.11 -3.11 -0.04 0.00 0.00 0.00 0.00 23.12 20.08 1jgz s ALA 145 CO 0.63 -2.53 0.64 -0.59 0.00 0.00 0.00 175.76 173.91 1jgz s PHE 146 N -3.04 3.51 0.42 0.00 -0.12 -1.26 -4.88 117.98 112.60 1jgz s PHE 146 Ca 0.64 0.64 -0.12 0.00 -0.05 0.00 0.00 56.93 58.05 1jgz s PHE 146 Cb -0.17 -2.13 -0.07 0.00 -0.63 0.00 0.00 43.02 40.02 1jgz s PHE 146 CO 0.56 0.00 0.80 -1.25 -0.05 0.00 0.00 175.22 175.29 1jgz s PRO 147 N -4.14 3.81 -1.00 1.99 0.04 -1.26 -4.74 135.00 129.71 1jgz s PRO 147 Ca 0.44 0.56 -0.13 0.00 0.04 0.00 0.00 61.00 61.91 1jgz s PRO 147 Cb -0.10 -2.35 0.21 0.00 0.04 0.00 0.00 34.50 32.30 1jgz s PRO 147 CO 0.36 -0.07 1.05 0.71 0.04 0.00 0.00 177.00 179.09 1jgz s TYR 148 N -2.40 3.75 -0.01 0.56 2.02 -0.94 -4.20 117.35 116.13 1jgz s TYR 148 Ca 0.53 -2.11 -0.19 0.00 -0.37 0.00 0.00 57.07 54.92 1jgz s TYR 148 Cb -0.10 -4.00 0.04 0.00 -0.40 0.00 0.00 41.96 37.50 1jgz s TYR 148 CO 0.31 -1.14 0.42 0.20 -1.57 0.00 0.00 175.55 173.76 1jgz s GLY 149 N 2.31 -0.28 0.11 0.71 0.00 -1.26 -2.41 107.32 106.49 1jgz s GLY 149 Ca 0.29 0.55 -0.27 0.00 0.00 0.00 0.00 44.72 45.29 1jgz s GLY 149 CO -0.07 0.30 1.64 -2.22 0.00 0.00 0.00 173.10 172.75 1jgz h ILE 150 N 3.47 0.44 0.00 0.90 1.08 -1.80 -2.89 117.51 118.72 1jgz h ILE 150 Ca -0.29 0.00 -0.36 0.00 -0.39 0.00 0.00 64.86 63.82 1jgz h ILE 150 Cb 1.17 0.44 -0.07 0.00 -3.07 0.00 0.00 36.82 35.30 1jgz h ILE 150 CO 0.41 0.00 -2.28 0.79 -0.69 0.00 0.00 178.15 176.38 1jgz n TRP 151 N -5.38 0.19 -0.30 1.37 7.02 -1.26 -4.16 117.44 114.91 1jgz n TRP 151 Ca -0.07 0.06 0.07 0.00 -1.02 0.00 0.00 57.50 56.54 1jgz n TRP 151 Cb 0.29 -1.03 0.27 0.00 -2.42 0.00 0.00 31.31 28.42 1jgz n TRP 151 CO 0.00 0.00 0.00 1.79 -2.02 0.00 0.00 177.69 177.46 1jgz h THR 152 N 0.00 0.98 0.00 -0.99 1.35 -1.93 0.24 112.91 112.56 1jgz h THR 152 Ca -0.51 -0.32 -0.06 0.00 -0.55 0.00 0.00 66.41 64.98 1jgz h THR 152 Cb 2.18 -0.04 -0.01 0.00 -1.73 0.00 0.00 68.15 68.55 1jgz h THR 152 CO 0.03 0.17 -0.27 1.12 -0.25 0.00 0.00 175.52 176.32 1jgz h HIS 153 N 0.94 0.00 -0.22 4.73 2.07 -1.67 -1.53 115.15 119.46 1jgz h HIS 153 Ca 0.42 0.00 -0.13 0.00 -2.85 0.00 0.00 60.37 57.81 1jgz h HIS 153 Cb 0.38 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 30.35 1jgz h HIS 153 CO -0.00 0.27 -0.43 -0.07 -3.07 0.00 0.00 177.93 174.62 1jgz h LEU 154 N 0.00 0.56 0.64 6.12 3.38 -0.77 -2.58 115.31 122.67 1jgz h LEU 154 Ca -0.00 -0.26 -0.03 0.00 0.09 0.00 0.00 57.88 57.68 1jgz h LEU 154 Cb 0.84 -0.16 0.01 0.00 0.09 0.00 0.00 40.66 41.43 1jgz h LEU 154 CO 0.03 0.92 -0.31 0.44 0.09 0.00 0.00 178.44 179.62 1jgz h ASP 155 N 0.43 -0.73 -0.99 -0.43 3.45 -0.21 -1.64 116.42 116.30 1jgz h ASP 155 Ca 0.03 -0.00 0.35 0.00 0.43 0.00 0.00 57.03 57.84 1jgz h ASP 155 Cb 0.93 0.19 -0.18 0.00 -0.56 0.00 0.00 39.33 39.71 1jgz h ASP 155 CO 0.08 -0.47 0.31 1.87 -1.57 0.00 0.00 179.24 179.46 1jgz n TRP 156 N -5.43 0.92 0.17 4.55 -0.00 -0.66 -0.45 117.44 116.54 1jgz n TRP 156 Ca -0.13 1.18 -0.07 0.00 -0.00 0.00 0.00 57.50 58.48 1jgz n TRP 156 Cb 0.36 -1.42 -0.03 0.00 -0.00 0.00 0.00 31.31 30.22 1jgz n TRP 156 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 177.69 177.97 1jgz h VAL 157 N 0.00 0.00 -0.92 5.87 2.07 -1.06 0.22 116.25 122.43 1jgz h VAL 157 Ca 0.73 -0.13 0.12 0.00 0.82 0.00 0.00 66.70 68.24 1jgz h VAL 157 Cb 1.78 0.00 -0.13 0.00 -1.52 0.00 0.00 31.29 31.42 1jgz h VAL 157 CO -0.84 0.00 -0.48 -1.28 0.02 0.00 0.00 177.57 175.00 1jgz h SER 158 N -0.58 -1.74 -0.09 0.57 0.87 0.20 0.81 113.55 113.59 1jgz h SER 158 Ca -0.05 0.31 -0.00 0.00 -1.23 0.00 0.00 61.79 60.82 1jgz h SER 158 Cb 0.35 0.82 -0.00 0.00 -0.44 0.00 0.00 62.40 63.13 1jgz h SER 158 CO 0.08 -0.28 0.04 0.78 -0.53 0.00 0.00 176.83 176.92 1jgz h ASN 159 N -0.05 0.12 -0.93 6.23 2.35 -0.84 -1.68 115.58 120.79 1jgz h ASN 159 Ca 0.24 -0.12 0.12 0.00 -0.55 0.00 0.00 56.30 55.99 1jgz h ASN 159 Cb 0.52 -0.03 -0.07 0.00 0.05 0.00 0.00 38.32 38.78 1jgz h ASN 159 CO -0.91 0.21 0.60 0.74 -1.65 0.00 0.00 177.43 176.41 1jgz h THR 160 N 0.02 0.91 -0.04 2.81 2.02 0.26 -1.24 112.91 117.66 1jgz h THR 160 Ca 0.03 -0.30 -0.03 0.00 0.77 0.00 0.00 66.41 66.89 1jgz h THR 160 Cb 0.12 -0.03 0.00 0.00 -1.74 0.00 0.00 68.15 66.50 1jgz h THR 160 CO -0.00 0.16 -0.08 1.23 0.37 0.00 0.00 175.52 177.19 1jgz h GLY 161 N 0.86 0.13 2.00 2.16 0.00 -0.66 -3.18 103.07 104.38 1jgz h GLY 161 Ca 0.45 -0.16 0.00 0.00 0.00 0.00 0.00 47.33 47.63 1jgz h GLY 161 CO -0.22 0.14 0.00 -1.72 0.00 0.00 0.00 176.54 174.74 1jgz n TYR 162 N -4.70 0.52 0.25 5.60 4.01 -0.65 -1.72 117.16 120.47 1jgz n TYR 162 Ca -0.08 0.23 0.11 0.00 -0.16 0.00 0.00 57.90 57.99 1jgz n TYR 162 Cb 0.35 -0.86 0.52 0.00 -0.31 0.00 0.00 39.34 39.03 1jgz n TYR 162 CO 0.00 0.00 0.00 2.41 -0.46 0.00 0.00 176.86 178.81 1jgz n THR 163 N -2.00 1.00 -1.73 -0.72 -1.04 -0.50 -1.54 114.28 107.76 1jgz n THR 163 Ca 0.01 0.54 0.06 0.00 -2.04 0.00 0.00 64.05 62.61 1jgz n THR 163 Cb 0.15 -1.51 0.11 0.00 -1.82 0.00 0.00 70.33 67.26 1jgz n THR 163 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 1jgz n TYR 164 N -2.21 0.00 -3.74 -1.42 4.01 -0.70 -4.92 117.16 108.19 1jgz n TYR 164 Ca -0.00 -0.86 0.00 0.00 -0.16 0.00 0.00 57.90 56.88 1jgz n TYR 164 Cb 0.11 -0.16 0.00 0.00 -0.31 0.00 0.00 39.34 38.97 1jgz n TYR 164 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1jgz n GLY 165 N -0.64 0.13 3.61 2.72 0.00 -0.59 -2.07 105.19 108.35 1jgz n GLY 165 Ca 0.12 -1.04 -0.43 0.00 0.00 0.00 0.00 46.02 44.66 1jgz n GLY 165 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1jgz s ASN 166 N -4.00 6.65 0.39 1.61 3.84 -1.26 -3.86 114.94 118.30 1jgz s ASN 166 Ca 0.00 0.61 0.28 0.00 0.21 0.00 0.00 52.86 53.96 1jgz s ASN 166 Cb 0.00 -2.55 1.28 0.00 -0.55 0.00 0.00 41.25 39.43 1jgz s ASN 166 CO 0.00 -1.21 1.84 0.15 -2.79 0.00 0.00 177.10 175.08 1jgz h PHE 167 N 9.22 0.00 -1.05 0.43 3.57 -1.81 -2.64 116.94 124.66 1jgz h PHE 167 Ca -0.23 0.00 0.27 0.00 3.53 0.00 0.00 57.97 61.54 1jgz h PHE 167 Cb 1.07 0.00 -0.08 0.00 2.79 0.00 0.00 35.95 39.73 1jgz h PHE 167 CO 0.95 0.00 0.69 0.45 -2.23 0.00 0.00 178.31 178.18 1jgz h HIS 168 N 0.00 0.49 0.00 0.41 3.86 -1.95 0.80 115.15 118.76 1jgz h HIS 168 Ca 0.00 0.02 0.00 0.00 -1.16 0.00 0.00 60.37 59.23 1jgz h HIS 168 Cb 0.27 -0.14 0.00 0.00 1.06 0.00 0.00 27.41 28.60 1jgz h HIS 168 CO 0.00 0.05 0.00 0.66 0.86 0.00 0.00 177.93 179.50 1jgz n TYR 169 N -4.52 0.00 -2.69 2.45 4.01 -1.00 -4.62 117.16 110.80 1jgz n TYR 169 Ca 0.24 0.00 -0.43 0.00 -0.16 0.00 0.00 57.90 57.56 1jgz n TYR 169 Cb 0.93 0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 39.93 1jgz n TYR 169 CO 0.00 0.00 0.00 1.21 -0.46 0.00 0.00 176.86 177.61 1jgz s ASN 170 N -1.64 6.53 0.28 7.72 3.84 0.27 -4.60 114.94 127.34 1jgz s ASN 170 Ca 0.10 0.22 -0.00 0.00 0.21 0.00 0.00 52.86 53.39 1jgz s ASN 170 Cb 0.05 -2.51 0.65 0.00 -0.55 0.00 0.00 41.25 38.89 1jgz s ASN 170 CO 0.08 -1.23 1.62 1.55 -2.79 0.00 0.00 177.10 176.33 1jgz h PRO 171 N 9.25 0.12 0.00 0.43 0.13 -1.89 0.10 132.00 140.14 1jgz h PRO 171 Ca -0.24 -0.01 -0.09 0.00 -0.87 0.00 0.00 66.00 64.79 1jgz h PRO 171 Cb 1.07 -0.03 -0.01 0.00 0.13 0.00 0.00 31.00 32.16 1jgz h PRO 171 CO 1.10 0.08 -0.45 0.00 -0.23 0.00 0.00 178.00 178.50 1jgz h ALA 172 N 1.82 0.97 0.00 -0.56 0.00 -1.91 -2.12 119.26 117.45 1jgz h ALA 172 Ca 0.53 -0.41 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 1jgz h ALA 172 Cb 1.05 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.77 1jgz h ALA 172 CO -0.73 0.56 -0.01 1.25 0.00 0.00 0.00 179.25 180.32 1jgz h HIS 173 N 0.00 0.00 0.20 0.00 6.17 -1.08 -2.11 115.15 118.33 1jgz h HIS 173 Ca -0.00 0.00 -0.32 0.00 0.71 0.00 0.00 60.37 60.76 1jgz h HIS 173 Cb 0.98 0.00 0.02 0.00 2.52 0.00 0.00 27.41 30.94 1jgz h HIS 173 CO 0.00 0.01 -1.42 0.52 0.71 0.00 0.00 177.93 177.75 1jgz h MET 174 N 0.00 0.43 -0.40 5.26 2.86 -0.63 -2.81 114.93 119.64 1jgz h MET 174 Ca -0.00 -0.73 -0.16 0.00 -2.06 0.00 0.00 59.70 56.75 1jgz h MET 174 Cb 0.62 0.27 -0.01 0.00 0.06 0.00 0.00 31.60 32.54 1jgz h MET 174 CO 0.00 1.34 -0.36 0.82 1.06 0.00 0.00 176.91 179.78 1jgz h ILE 175 N 0.12 1.27 0.51 -1.22 2.04 -1.28 -3.00 117.51 115.94 1jgz h ILE 175 Ca -0.22 -1.53 -0.02 0.00 1.00 0.00 0.00 64.86 64.09 1jgz h ILE 175 Cb 2.09 1.33 0.00 0.00 -0.74 0.00 0.00 36.82 39.51 1jgz h ILE 175 CO 0.24 0.52 -0.24 0.00 0.00 0.00 0.00 178.15 178.66 1jgz h ALA 176 N 0.80 -0.68 -0.19 1.87 0.00 -1.47 -1.62 119.26 117.97 1jgz h ALA 176 Ca 0.07 -0.16 0.05 0.00 0.00 0.00 0.00 54.91 54.88 1jgz h ALA 176 Cb 0.95 0.26 -0.01 0.00 0.00 0.00 0.00 17.79 19.00 1jgz h ALA 176 CO 0.09 -0.87 0.34 0.82 0.00 0.00 0.00 179.25 179.63 1jgz h ILE 177 N -0.71 0.22 -0.06 0.00 2.04 -1.53 0.18 117.51 117.64 1jgz h ILE 177 Ca -0.07 0.00 -0.14 0.00 1.00 0.00 0.00 64.86 65.65 1jgz h ILE 177 Cb 0.54 0.71 0.01 0.00 -0.74 0.00 0.00 36.82 37.33 1jgz h ILE 177 CO 0.11 0.00 -0.52 0.28 0.00 0.00 0.00 178.15 178.02 1jgz h SER 178 N 0.00 0.57 -0.02 1.72 0.02 -1.16 -1.84 113.55 112.84 1jgz h SER 178 Ca 0.09 -0.68 -0.11 0.00 -0.84 0.00 0.00 61.79 60.24 1jgz h SER 178 Cb 0.76 -0.17 -0.01 0.00 0.14 0.00 0.00 62.40 63.12 1jgz h SER 178 CO -0.00 1.17 -0.34 -0.26 -1.14 0.00 0.00 176.83 176.26 1jgz h PHE 179 N 0.02 0.58 -0.17 3.45 0.04 -0.54 -1.03 116.94 119.29 1jgz h PHE 179 Ca -0.05 -0.15 -0.02 0.00 2.80 0.00 0.00 57.97 60.55 1jgz h PHE 179 Cb 1.19 -0.13 -0.01 0.00 2.20 0.00 0.00 35.95 39.20 1jgz h PHE 179 CO 0.13 0.78 0.02 0.74 -0.60 0.00 0.00 178.31 179.38 1jgz h PHE 180 N 0.42 0.31 -0.29 -0.55 0.04 -1.26 0.22 116.94 115.82 1jgz h PHE 180 Ca 0.05 -0.05 -0.07 0.00 2.80 0.00 0.00 57.97 60.70 1jgz h PHE 180 Cb 0.80 -0.08 -0.02 0.00 2.20 0.00 0.00 35.95 38.85 1jgz h PHE 180 CO 0.03 0.46 -0.12 0.74 -0.60 0.00 0.00 178.31 178.82 1jgz h PHE 181 N 0.07 0.53 -0.05 -0.55 0.04 -1.27 -2.96 116.94 112.75 1jgz h PHE 181 Ca 0.05 -0.08 -0.10 0.00 2.80 0.00 0.00 57.97 60.65 1jgz h PHE 181 Cb 0.32 -0.14 0.01 0.00 2.20 0.00 0.00 35.95 38.33 1jgz h PHE 181 CO 0.02 0.60 -0.35 1.15 -0.60 0.00 0.00 178.31 179.14 1jgz h THR 182 N 0.46 1.45 -0.96 -1.55 2.02 -0.97 -2.84 112.91 110.52 1jgz h THR 182 Ca 0.09 -1.81 0.14 0.00 0.77 0.00 0.00 66.41 65.59 1jgz h THR 182 Cb 0.48 2.45 -0.08 0.00 -1.74 0.00 0.00 68.15 69.26 1jgz h THR 182 CO 0.03 0.52 0.61 -1.13 0.37 0.00 0.00 175.52 175.91 1jgz h ASN 183 N -0.21 0.80 0.16 4.18 -1.24 -0.54 0.38 115.58 119.10 1jgz h ASN 183 Ca -0.03 0.05 -0.19 0.00 0.71 0.00 0.00 56.30 56.84 1jgz h ASN 183 Cb 1.02 -0.10 -0.00 0.00 0.73 0.00 0.00 38.32 39.97 1jgz h ASN 183 CO 0.07 0.40 -0.74 0.00 -1.29 0.00 0.00 177.43 175.87 1jgz h ALA 184 N 1.58 0.53 -0.27 1.57 0.00 -1.53 0.38 119.26 121.51 1jgz h ALA 184 Ca 0.49 -0.60 -0.03 0.00 0.00 0.00 0.00 54.91 54.77 1jgz h ALA 184 Cb 0.65 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 1jgz h ALA 184 CO -0.26 0.74 0.05 1.25 0.00 0.00 0.00 179.25 181.03 1jgz h LEU 185 N 0.34 0.44 0.44 0.00 6.46 -0.94 0.21 115.31 122.27 1jgz h LEU 185 Ca -0.04 -0.26 -0.02 0.00 -0.12 0.00 0.00 57.88 57.45 1jgz h LEU 185 Cb 1.32 -0.12 -0.00 0.00 -0.73 0.00 0.00 40.66 41.14 1jgz h LEU 185 CO 0.13 0.58 -0.26 0.00 -0.62 0.00 0.00 178.44 178.28 1jgz h ALA 186 N 0.87 -0.66 -0.53 1.25 0.00 -0.20 -1.91 119.26 118.07 1jgz h ALA 186 Ca 0.08 -0.13 0.08 0.00 0.00 0.00 0.00 54.91 54.94 1jgz h ALA 186 Cb 0.33 0.31 -0.07 0.00 0.00 0.00 0.00 17.79 18.37 1jgz h ALA 186 CO 0.01 -0.88 0.16 1.25 0.00 0.00 0.00 179.25 179.79 1jgz h LEU 187 N -0.67 0.13 -0.88 0.00 5.85 -0.10 -0.79 115.31 118.86 1jgz h LEU 187 Ca -0.05 0.08 0.06 0.00 0.84 0.00 0.00 57.88 58.81 1jgz h LEU 187 Cb 0.54 0.08 -0.06 0.00 0.37 0.00 0.00 40.66 41.59 1jgz h LEU 187 CO 0.06 0.09 0.55 0.00 -0.34 0.00 0.00 178.44 178.80 1jgz h ALA 188 N 1.38 1.21 -0.11 1.25 0.00 -0.38 -2.86 119.26 119.74 1jgz h ALA 188 Ca 0.27 -0.01 -0.16 0.00 0.00 0.00 0.00 54.91 55.00 1jgz h ALA 188 Cb 0.33 -0.24 0.01 0.00 0.00 0.00 0.00 17.79 17.88 1jgz h ALA 188 CO -0.30 0.30 -0.56 -0.07 0.00 0.00 0.00 179.25 178.62 1jgz h LEU 189 N 1.00 0.69 -0.69 0.00 3.38 -0.52 -2.53 115.31 116.64 1jgz h LEU 189 Ca 0.38 -0.64 0.06 0.00 0.09 0.00 0.00 57.88 57.77 1jgz h LEU 189 Cb 0.17 -0.21 -0.05 0.00 0.09 0.00 0.00 40.66 40.66 1jgz h LEU 189 CO -0.17 1.22 0.40 -0.74 0.09 0.00 0.00 178.44 179.24 1jgz h HIS 190 N 0.21 0.73 -0.34 1.13 2.76 -1.05 0.31 115.15 118.91 1jgz h HIS 190 Ca -0.04 0.02 -0.16 0.00 -2.20 0.00 0.00 60.37 58.00 1jgz h HIS 190 Cb 1.21 -0.23 -0.00 0.00 1.55 0.00 0.00 27.41 29.93 1jgz h HIS 190 CO 0.11 0.36 -0.40 0.78 -1.30 0.00 0.00 177.93 177.48 1jgz h GLY 191 N 0.74 0.95 1.13 5.26 0.00 -1.59 -2.26 103.07 107.30 1jgz h GLY 191 Ca 0.31 -1.01 -0.05 0.00 0.00 0.00 0.00 47.33 46.58 1jgz h GLY 191 CO -0.17 0.91 0.25 0.00 0.00 0.00 0.00 176.54 177.53 1jgz h ALA 192 N 0.73 1.08 0.28 3.60 0.00 -0.95 -2.02 119.26 121.98 1jgz h ALA 192 Ca 0.05 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 54.74 1jgz h ALA 192 Cb 1.00 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.50 1jgz h ALA 192 CO 0.10 0.64 -0.14 1.25 0.00 0.00 0.00 179.25 181.10 1jgz h LEU 193 N 1.07 -0.32 -0.73 0.00 5.85 -0.34 -1.05 115.31 119.78 1jgz h LEU 193 Ca 0.24 0.01 0.16 0.00 0.84 0.00 0.00 57.88 59.13 1jgz h LEU 193 Cb 0.26 0.08 -0.13 0.00 0.37 0.00 0.00 40.66 41.24 1jgz h LEU 193 CO -0.01 -0.15 -0.11 0.58 -0.34 0.00 0.00 178.44 178.41 1jgz h VAL 194 N -0.55 0.30 -0.09 1.05 2.07 -1.47 -0.64 116.25 116.92 1jgz h VAL 194 Ca -0.04 -0.01 -0.00 0.00 0.82 0.00 0.00 66.70 67.47 1jgz h VAL 194 Cb 0.29 0.26 -0.00 0.00 -1.52 0.00 0.00 31.29 30.32 1jgz h VAL 194 CO 0.06 0.01 0.05 -0.07 0.02 0.00 0.00 177.57 177.64 1jgz h LEU 195 N 0.04 0.11 -2.48 2.57 3.38 -1.43 -1.50 115.31 116.00 1jgz h LEU 195 Ca 0.37 -0.09 0.02 0.00 0.09 0.00 0.00 57.88 58.27 1jgz h LEU 195 Cb 0.61 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 41.33 1jgz h LEU 195 CO -0.71 0.17 0.11 0.77 0.09 0.00 0.00 178.44 178.87 1jgz h SER 196 N 0.05 0.00 0.22 -0.43 4.64 0.21 0.34 113.55 118.58 1jgz h SER 196 Ca 0.03 0.00 -0.35 0.00 -0.47 0.00 0.00 61.79 61.00 1jgz h SER 196 Cb 0.09 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.19 1jgz h SER 196 CO -0.00 0.00 -1.70 0.00 -0.87 0.00 0.00 176.83 174.25 1jgz h ALA 197 N 1.84 0.11 0.00 5.18 0.00 -0.70 -3.28 119.26 122.42 1jgz h ALA 197 Ca 0.03 -1.10 0.00 0.00 0.00 0.00 0.00 54.91 53.84 1jgz h ALA 197 Cb 0.25 0.41 0.00 0.00 0.00 0.00 0.00 17.79 18.45 1jgz h ALA 197 CO -0.00 0.98 -0.27 0.00 0.00 0.00 0.00 179.25 179.96 1jgz n ALA 198 N -2.83 2.63 -3.17 0.00 0.00 -0.61 -1.61 120.51 114.92 1jgz n ALA 198 Ca -0.23 -0.14 -0.24 0.00 0.00 0.00 0.00 53.44 52.82 1jgz n ALA 198 Cb 1.08 -1.33 -0.05 0.00 0.00 0.00 0.00 19.45 19.14 1jgz n ALA 198 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1jgz n ASN 199 N -2.04 2.50 -3.26 0.00 3.02 0.11 -4.88 115.26 110.71 1jgz n ASN 199 Ca 0.05 -3.25 0.00 0.00 -0.03 0.00 0.00 54.58 51.35 1jgz n ASN 199 Cb 0.41 -0.62 0.00 0.00 -0.61 0.00 0.00 39.78 38.97 1jgz n ASN 199 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 1jgz n PRO 200 N 0.49 -1.09 -1.95 3.52 -0.04 -1.24 -4.71 135.00 129.98 1jgz n PRO 200 Ca 0.27 0.00 -0.37 0.00 -0.04 0.00 0.00 63.50 63.36 1jgz n PRO 200 Cb 0.49 0.00 0.04 0.00 -0.04 0.00 0.00 33.50 33.99 1jgz n PRO 200 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1jgz s GLU 201 N -2.13 3.02 -0.03 0.54 2.02 -1.26 -4.84 118.70 116.02 1jgz s GLU 201 Ca 0.00 1.94 -0.36 0.00 0.02 0.00 0.00 54.97 56.57 1jgz s GLU 201 Cb 0.00 -2.03 -0.14 0.00 0.10 0.00 0.00 34.13 32.06 1jgz s GLU 201 CO 0.00 -1.19 1.66 1.17 0.02 0.00 0.00 175.26 176.92 1jgz n LYS 202 N -1.41 1.74 0.00 1.61 4.81 -1.26 -1.35 118.16 122.30 1jgz n LYS 202 Ca 0.13 0.63 0.00 0.00 -0.87 0.00 0.00 58.31 58.20 1jgz n LYS 202 Cb 0.48 -2.38 0.00 0.00 0.02 0.00 0.00 35.03 33.15 1jgz n LYS 202 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1jgz n GLY 203 N 3.72 2.65 3.88 3.14 0.00 -1.26 -5.06 105.19 112.27 1jgz n GLY 203 Ca 0.21 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.93 1jgz n GLY 203 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1jgz s LYS 204 N -0.70 3.27 0.18 1.61 1.02 -0.46 -5.04 119.74 119.62 1jgz s LYS 204 Ca 0.00 0.52 -0.30 0.00 0.02 0.00 0.00 55.97 56.21 1jgz s LYS 204 Cb 0.00 -2.11 -0.08 0.00 -0.52 0.00 0.00 37.83 35.13 1jgz s LYS 204 CO 0.00 -0.71 1.12 -1.21 -0.92 0.00 0.00 175.35 173.63 1jgz s GLU 205 N -5.18 4.57 -0.39 1.68 2.02 -1.26 -4.84 118.70 115.31 1jgz s GLU 205 Ca 0.55 1.75 -0.39 0.00 0.02 0.00 0.00 54.97 56.90 1jgz s GLU 205 Cb -0.11 -3.27 -0.14 0.00 0.10 0.00 0.00 34.13 30.71 1jgz s GLU 205 CO 0.51 0.04 2.10 -0.12 0.02 0.00 0.00 175.26 177.82 1jgz n MET 206 N 2.39 0.74 -0.46 1.61 0.00 -1.26 -4.85 117.12 115.28 1jgz n MET 206 Ca 0.03 0.21 -0.28 0.00 -0.00 0.00 0.00 57.70 57.67 1jgz n MET 206 Cb 0.46 -2.10 0.23 0.00 0.00 0.00 0.00 33.22 31.81 1jgz n MET 206 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 175.97 176.51 1jgz n ARG 207 N 7.53 -2.95 -4.48 2.12 3.00 -0.63 -5.01 116.66 116.23 1jgz n ARG 207 Ca 0.43 -0.86 -0.24 0.00 -0.01 0.00 0.00 57.85 57.18 1jgz n ARG 207 Cb 0.13 -1.84 -0.10 0.00 0.00 0.00 0.00 32.46 30.65 1jgz n ARG 207 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.63 178.58 1jgz s THR 208 N -2.21 1.98 0.59 0.55 -4.23 -1.26 -4.78 115.64 106.27 1jgz s THR 208 Ca 0.59 -2.18 0.29 0.00 -1.18 0.00 0.00 61.69 59.20 1jgz s THR 208 Cb -0.15 -2.52 0.36 0.00 1.34 0.00 0.00 72.50 71.53 1jgz s THR 208 CO 0.57 -0.27 2.09 1.55 -0.54 0.00 0.00 174.62 178.02 1jgz h PRO 209 N 2.17 0.00 -0.44 3.99 0.13 -1.98 0.25 132.00 136.12 1jgz h PRO 209 Ca -0.41 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.71 1jgz h PRO 209 Cb 1.24 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.35 1jgz h PRO 209 CO 0.68 0.00 0.22 -0.44 -0.23 0.00 0.00 178.00 178.23 1jgz h ASP 210 N 0.00 0.54 0.60 1.44 5.19 -1.99 0.29 116.42 122.49 1jgz h ASP 210 Ca 0.09 -0.04 -0.13 0.00 -0.62 0.00 0.00 57.03 56.33 1jgz h ASP 210 Cb 0.53 -0.14 -0.02 0.00 0.18 0.00 0.00 39.33 39.88 1jgz h ASP 210 CO -0.00 0.46 -0.62 0.45 -3.12 0.00 0.00 179.24 176.41 1jgz h HIS 211 N 0.61 0.02 -0.09 4.55 3.86 -0.90 -1.77 115.15 121.43 1jgz h HIS 211 Ca 0.15 -0.01 -0.02 0.00 -1.16 0.00 0.00 60.37 59.34 1jgz h HIS 211 Cb 0.06 -0.00 -0.00 0.00 1.06 0.00 0.00 27.41 28.52 1jgz h HIS 211 CO 0.00 0.62 -0.01 0.93 0.86 0.00 0.00 177.93 180.33 1jgz h GLU 212 N 0.01 0.16 -0.24 2.45 5.08 -0.85 -0.66 114.58 120.54 1jgz h GLU 212 Ca -0.01 -0.06 -0.12 0.00 -1.00 0.00 0.00 59.36 58.17 1jgz h GLU 212 Cb 1.09 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 30.32 1jgz h GLU 212 CO 0.08 0.46 -0.37 -0.44 -1.00 0.00 0.00 179.01 177.74 1jgz h ASP 213 N -0.16 0.56 0.07 1.42 3.32 -1.02 -3.05 116.42 117.56 1jgz h ASP 213 Ca 0.02 -0.24 -0.00 0.00 0.02 0.00 0.00 57.03 56.83 1jgz h ASP 213 Cb 0.40 -0.16 0.00 0.00 0.22 0.00 0.00 39.33 39.80 1jgz h ASP 213 CO 0.01 0.88 -0.03 0.74 -1.72 0.00 0.00 179.24 179.12 1jgz h THR 214 N 0.45 0.99 -0.97 0.35 2.02 -1.25 -2.83 112.91 111.67 1jgz h THR 214 Ca 0.04 -0.19 0.22 0.00 0.77 0.00 0.00 66.41 67.26 1jgz h THR 214 Cb 0.85 1.11 -0.12 0.00 -1.74 0.00 0.00 68.15 68.26 1jgz h THR 214 CO 0.07 0.05 0.54 0.15 0.37 0.00 0.00 175.52 176.70 1jgz h PHE 215 N -0.18 0.93 0.00 3.16 3.57 -1.01 0.75 116.94 124.16 1jgz h PHE 215 Ca -0.01 0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.53 1jgz h PHE 215 Cb 0.15 -0.26 0.00 0.00 2.79 0.00 0.00 35.95 38.63 1jgz h PHE 215 CO -0.05 0.09 0.00 0.74 -2.23 0.00 0.00 178.31 176.86 1jgz h PHE 216 N 0.59 0.00 0.07 0.41 0.04 -1.41 -2.41 116.94 114.23 1jgz h PHE 216 Ca 0.60 0.00 -0.23 0.00 2.80 0.00 0.00 57.97 61.14 1jgz h PHE 216 Cb 1.07 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 39.21 1jgz h PHE 216 CO -0.04 0.00 -1.18 0.00 -0.60 0.00 0.00 178.31 176.49 1jgz h ARG 217 N 0.00 0.15 0.00 1.51 3.08 -0.87 -0.44 114.38 117.82 1jgz h ARG 217 Ca 0.00 -0.25 0.00 0.00 0.07 0.00 0.00 59.98 59.80 1jgz h ARG 217 Cb 0.72 0.09 0.00 0.00 0.08 0.00 0.00 29.97 30.86 1jgz h ARG 217 CO 0.00 1.12 0.04 -0.44 -1.07 0.00 0.00 179.97 179.62 1jgz h ASP 218 N -0.57 0.00 0.00 7.04 5.19 -0.95 -0.82 116.42 126.31 1jgz h ASP 218 Ca -0.27 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.14 1jgz h ASP 218 Cb 1.55 0.00 0.00 0.00 0.18 0.00 0.00 39.33 41.06 1jgz h ASP 218 CO -0.02 0.00 -0.81 -0.11 -3.12 0.00 0.00 179.24 175.19 1jgz n LEU 219 N -2.93 1.60 -0.11 1.55 7.94 -0.91 -4.83 117.00 119.31 1jgz n LEU 219 Ca -0.03 0.27 0.04 0.00 -1.11 0.00 0.00 56.01 55.18 1jgz n LEU 219 Cb 0.10 -0.69 -0.02 0.00 0.53 0.00 0.00 43.42 43.35 1jgz n LEU 219 CO 0.18 -0.32 0.11 1.33 -1.11 0.00 0.00 177.39 177.57 1jgz n VAL 220 N -4.11 0.00 -0.27 1.96 0.24 -0.23 -5.01 118.33 110.90 1jgz n VAL 220 Ca -0.11 -0.37 0.00 0.00 -2.04 0.00 0.00 64.34 61.82 1jgz n VAL 220 Cb 0.42 1.06 0.00 0.00 -1.47 0.00 0.00 33.84 33.85 1jgz n VAL 220 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1jgz n GLY 221 N 0.97 0.93 3.20 7.63 0.00 -0.32 -4.97 105.19 112.63 1jgz n GLY 221 Ca 0.03 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.94 1jgz n GLY 221 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1jgz s TYR 222 N -2.70 0.01 -0.05 1.61 5.04 -1.18 -4.81 117.35 115.28 1jgz s TYR 222 Ca 0.00 -0.19 -0.02 0.00 -2.44 0.00 0.00 57.07 54.41 1jgz s TYR 222 Cb 0.00 0.00 0.03 0.00 0.35 0.00 0.00 41.96 42.35 1jgz s TYR 222 CO 0.00 -0.44 0.08 0.45 -1.34 0.00 0.00 175.55 174.30 1jgz s SER 223 N -2.03 1.03 0.49 4.32 0.15 -1.26 -4.14 113.70 112.27 1jgz s SER 223 Ca -0.06 0.13 0.28 0.00 0.70 0.00 0.00 55.95 57.00 1jgz s SER 223 Cb -0.01 -0.06 1.08 0.00 -1.71 0.00 0.00 66.02 65.31 1jgz s SER 223 CO -0.03 -0.24 1.88 -0.29 1.20 0.00 0.00 173.24 175.75 1jgz h ILE 224 N 6.42 0.25 0.00 6.45 2.10 -1.98 -3.49 117.51 127.25 1jgz h ILE 224 Ca -0.13 -0.83 0.00 0.00 1.08 0.00 0.00 64.86 64.98 1jgz h ILE 224 Cb 1.12 1.67 0.00 0.00 -1.09 0.00 0.00 36.82 38.52 1jgz h ILE 224 CO 0.16 0.10 0.00 0.61 -1.08 0.00 0.00 178.15 177.94 1jgz n GLY 225 N 0.18 0.94 0.37 8.18 0.00 -1.26 -4.12 105.19 109.47 1jgz n GLY 225 Ca 0.01 -1.67 0.08 0.00 0.00 0.00 0.00 46.02 44.44 1jgz n GLY 225 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1jgz h THR 226 N 0.00 0.92 0.17 2.61 1.35 -1.98 0.84 112.91 116.82 1jgz h THR 226 Ca 0.00 -0.30 -0.30 0.00 -0.55 0.00 0.00 66.41 65.26 1jgz h THR 226 Cb 0.00 -0.03 0.01 0.00 -1.73 0.00 0.00 68.15 66.41 1jgz h THR 226 CO 0.00 0.16 -1.40 0.25 -0.25 0.00 0.00 175.52 174.28 1jgz h LEU 227 N 0.87 0.56 0.13 3.87 5.85 -2.00 -3.29 115.31 121.31 1jgz h LEU 227 Ca 0.45 -0.64 -0.01 0.00 0.84 0.00 0.00 57.88 58.52 1jgz h LEU 227 Cb 0.52 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 41.36 1jgz h LEU 227 CO -0.21 1.51 -0.06 1.23 -0.34 0.00 0.00 178.44 180.56 1jgz h GLY 228 N 1.11 -0.19 1.04 3.75 0.00 -1.54 -1.72 103.07 105.53 1jgz h GLY 228 Ca -0.20 0.07 0.13 0.00 0.00 0.00 0.00 47.33 47.32 1jgz h GLY 228 CO 0.22 -0.07 0.36 1.19 0.00 0.00 0.00 176.54 178.24 1jgz h ILE 229 N -0.34 0.80 0.00 2.60 6.09 -1.00 0.83 117.51 126.49 1jgz h ILE 229 Ca -0.02 -0.04 -0.18 0.00 -1.37 0.00 0.00 64.86 63.25 1jgz h ILE 229 Cb 0.28 0.66 -0.03 0.00 0.47 0.00 0.00 36.82 38.20 1jgz h ILE 229 CO 0.03 0.02 -0.85 0.45 -3.07 0.00 0.00 178.15 174.73 1jgz h HIS 230 N 0.13 0.00 -0.09 2.19 3.86 -1.58 -2.40 115.15 117.26 1jgz h HIS 230 Ca 0.24 0.00 -0.07 0.00 -1.16 0.00 0.00 60.37 59.38 1jgz h HIS 230 Cb 0.79 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.27 1jgz h HIS 230 CO -0.00 0.85 -0.23 0.00 0.86 0.00 0.00 177.93 179.41 1jgz h ARG 231 N 0.00 0.31 -0.03 2.45 3.08 0.61 -3.17 114.38 117.63 1jgz h ARG 231 Ca -0.01 -0.22 0.04 0.00 0.07 0.00 0.00 59.98 59.86 1jgz h ARG 231 Cb 1.58 0.03 -0.05 0.00 0.08 0.00 0.00 29.97 31.61 1jgz h ARG 231 CO 0.11 0.83 -0.27 1.25 -1.07 0.00 0.00 179.97 180.83 1jgz h LEU 232 N -0.15 -0.79 -0.28 3.04 5.85 0.45 -2.42 115.31 121.01 1jgz h LEU 232 Ca -0.00 0.11 0.04 0.00 0.84 0.00 0.00 57.88 58.87 1jgz h LEU 232 Cb 0.85 0.33 -0.04 0.00 0.37 0.00 0.00 40.66 42.17 1jgz h LEU 232 CO 0.05 -0.33 0.03 1.23 -0.34 0.00 0.00 178.44 179.08 1jgz h GLY 233 N -0.39 0.29 0.31 3.75 0.00 -1.53 -0.16 103.07 105.34 1jgz h GLY 233 Ca 0.07 0.01 0.12 0.00 0.00 0.00 0.00 47.33 47.53 1jgz h GLY 233 CO -0.25 -0.03 0.33 -2.00 0.00 0.00 0.00 176.54 174.58 1jgz h LEU 234 N 0.12 0.38 0.44 3.11 5.85 -1.49 -1.45 115.31 122.27 1jgz h LEU 234 Ca 0.13 0.08 -0.02 0.00 0.84 0.00 0.00 57.88 58.91 1jgz h LEU 234 Cb 0.16 0.03 0.00 0.00 0.37 0.00 0.00 40.66 41.22 1jgz h LEU 234 CO -0.20 0.18 -0.21 0.25 -0.34 0.00 0.00 178.44 178.13 1jgz h LEU 235 N 0.52 -0.50 -0.17 2.25 5.85 -0.81 -1.94 115.31 120.51 1jgz h LEU 235 Ca 0.38 -0.05 0.05 0.00 0.84 0.00 0.00 57.88 59.11 1jgz h LEU 235 Cb 0.50 0.13 -0.06 0.00 0.37 0.00 0.00 40.66 41.60 1jgz h LEU 235 CO -0.34 -0.26 -0.23 -0.07 -0.34 0.00 0.00 178.44 177.20 1jgz h LEU 236 N -0.73 -0.73 0.00 2.25 3.38 -0.87 0.18 115.31 118.79 1jgz h LEU 236 Ca -0.06 0.12 0.00 0.00 0.09 0.00 0.00 57.88 58.03 1jgz h LEU 236 Cb 0.52 0.33 0.00 0.00 0.09 0.00 0.00 40.66 41.60 1jgz h LEU 236 CO 0.10 -0.28 0.00 -1.20 0.09 0.00 0.00 178.44 177.15 1jgz n SER 237 N -5.37 0.00 -0.30 -0.43 7.64 -0.56 -0.36 113.62 114.24 1jgz n SER 237 Ca -0.02 0.76 0.30 0.00 1.01 0.00 0.00 58.87 60.92 1jgz n SER 237 Cb 0.28 -0.26 0.66 0.00 -1.01 0.00 0.00 64.21 63.88 1jgz n SER 237 CO 0.00 0.00 0.00 -0.07 -3.01 0.00 0.00 175.04 171.96 1jgz h LEU 238 N 0.00 0.15 0.23 -3.43 3.38 -1.25 -1.03 115.31 113.36 1jgz h LEU 238 Ca 0.00 0.03 -0.01 0.00 0.09 0.00 0.00 57.88 57.99 1jgz h LEU 238 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.76 1jgz h LEU 238 CO 0.00 0.03 -0.11 0.28 0.09 0.00 0.00 178.44 178.73 1jgz h SER 239 N 0.14 -0.26 -0.97 -0.43 0.02 0.15 0.12 113.55 112.33 1jgz h SER 239 Ca 0.55 -0.25 0.23 0.00 -0.84 0.00 0.00 61.79 61.48 1jgz h SER 239 Cb 1.91 0.07 -0.08 0.00 0.14 0.00 0.00 62.40 64.43 1jgz h SER 239 CO -0.11 0.15 0.63 0.00 -1.14 0.00 0.00 176.83 176.36 1jgz h ALA 240 N -0.08 2.17 0.11 3.77 0.00 0.61 0.12 119.26 125.96 1jgz h ALA 240 Ca -0.03 0.04 -0.28 0.00 0.00 0.00 0.00 54.91 54.64 1jgz h ALA 240 Cb 0.49 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.26 1jgz h ALA 240 CO 0.05 -0.51 -1.30 0.28 0.00 0.00 0.00 179.25 177.77 1jgz h VAL 241 N 0.44 1.43 -0.32 0.00 2.07 -1.25 -2.98 116.25 115.63 1jgz h VAL 241 Ca 0.53 -3.03 -0.01 0.00 0.82 0.00 0.00 66.70 65.01 1jgz h VAL 241 Cb 1.27 2.89 -0.01 0.00 -1.52 0.00 0.00 31.29 33.92 1jgz h VAL 241 CO -0.24 0.88 0.16 0.15 0.02 0.00 0.00 177.57 178.54 1jgz h PHE 242 N 0.07 0.45 0.00 1.57 3.57 0.16 -1.61 116.94 121.14 1jgz h PHE 242 Ca -0.15 -0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.33 1jgz h PHE 242 Cb 1.97 -0.14 0.00 0.00 2.79 0.00 0.00 35.95 40.57 1jgz h PHE 242 CO 0.06 0.38 0.00 1.19 -2.23 0.00 0.00 178.31 177.71 1jgz n PHE 243 N -4.78 0.68 0.06 0.41 3.72 0.13 -2.07 117.46 115.62 1jgz n PHE 243 Ca -0.01 0.28 -0.16 0.00 -0.05 0.00 0.00 57.45 57.51 1jgz n PHE 243 Cb 0.09 -0.95 -0.14 0.00 -0.94 0.00 0.00 39.48 37.54 1jgz n PHE 243 CO 0.00 0.00 0.00 0.77 -0.05 0.00 0.00 176.76 177.48 1jgz h SER 244 N 0.00 0.37 0.45 4.37 0.02 -1.15 -2.25 113.55 115.35 1jgz h SER 244 Ca 0.00 -0.50 -0.18 0.00 -0.84 0.00 0.00 61.79 60.27 1jgz h SER 244 Cb 0.28 -0.12 -0.01 0.00 0.14 0.00 0.00 62.40 62.69 1jgz h SER 244 CO 0.00 1.41 -0.76 0.00 -1.14 0.00 0.00 176.83 176.34 1jgz h ALA 245 N 0.53 0.64 0.59 3.77 0.00 -0.93 -3.19 119.26 120.67 1jgz h ALA 245 Ca -0.23 -0.64 -0.03 0.00 0.00 0.00 0.00 54.91 54.01 1jgz h ALA 245 Cb 2.00 -0.07 0.01 0.00 0.00 0.00 0.00 17.79 19.73 1jgz h ALA 245 CO 0.16 0.83 -0.28 1.25 0.00 0.00 0.00 179.25 181.20 1jgz h LEU 246 N 0.16 -0.67 -1.82 0.00 5.85 -1.49 -0.52 115.31 116.82 1jgz h LEU 246 Ca -0.03 0.02 0.41 0.00 0.84 0.00 0.00 57.88 59.13 1jgz h LEU 246 Cb 1.34 0.17 -0.08 0.00 0.37 0.00 0.00 40.66 42.47 1jgz h LEU 246 CO 0.12 -0.44 0.98 0.00 -0.34 0.00 0.00 178.44 178.76 1jgz n MET 248 N -4.26 0.64 0.19 0.00 2.81 -1.18 -3.36 117.12 111.97 1jgz n MET 248 Ca 0.33 0.23 0.04 0.00 -1.81 0.00 0.00 57.70 56.48 1jgz n MET 248 Cb 1.44 -1.75 0.42 0.00 -0.71 0.00 0.00 33.22 32.63 1jgz n MET 248 CO 0.00 0.00 0.00 0.97 1.51 0.00 0.00 175.97 178.45 1jgz h ILE 249 N 0.00 1.20 0.00 2.02 6.09 0.85 -2.81 117.51 124.85 1jgz h ILE 249 Ca -0.31 -0.93 -0.18 0.00 -1.37 0.00 0.00 64.86 62.07 1jgz h ILE 249 Cb 1.97 1.47 -0.03 0.00 0.47 0.00 0.00 36.82 40.71 1jgz h ILE 249 CO 0.06 0.27 -1.12 0.16 -3.07 0.00 0.00 178.15 174.46 1jgz h ILE 250 N 0.03 0.92 -3.00 2.19 3.07 -1.56 -3.41 117.51 115.76 1jgz h ILE 250 Ca 0.00 -2.49 -0.57 0.00 1.55 0.00 0.00 64.86 63.36 1jgz h ILE 250 Cb 0.48 2.39 -0.04 0.00 -0.27 0.00 0.00 36.82 39.37 1jgz h ILE 250 CO 0.03 0.53 1.03 -0.89 -1.05 0.00 0.00 178.15 177.80 1jgz s THR 251 N -2.83 3.98 0.00 0.16 2.01 -1.06 -2.49 115.64 115.40 1jgz s THR 251 Ca -0.00 1.11 0.00 0.00 0.31 0.00 0.00 61.69 63.10 1jgz s THR 251 Cb 0.09 -3.98 0.00 0.00 0.01 0.00 0.00 72.50 68.61 1jgz s THR 251 CO 0.80 -0.40 0.00 0.61 -0.69 0.00 0.00 174.62 174.94 1jgz n GLY 252 N 4.42 0.69 0.05 4.40 0.00 0.81 -4.92 105.19 110.63 1jgz n GLY 252 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.18 1jgz n GLY 252 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1jgz n THR 253 N -2.00 0.00 0.09 2.61 -2.24 -1.07 -4.84 114.28 106.84 1jgz n THR 253 Ca 0.00 0.01 -0.05 0.00 -2.27 0.00 0.00 64.05 61.73 1jgz n THR 253 Cb 0.00 -0.65 0.01 0.00 -2.10 0.00 0.00 70.33 67.59 1jgz n THR 253 CO 0.00 0.00 0.00 0.16 -0.57 0.00 0.00 175.07 174.66 1jgz h ILE 254 N 0.00 1.57 -3.31 2.28 3.07 -1.79 -3.43 117.51 115.90 1jgz h ILE 254 Ca 0.00 -2.78 -0.50 0.00 1.55 0.00 0.00 64.86 63.13 1jgz h ILE 254 Cb 0.00 2.51 -0.35 0.00 -0.27 0.00 0.00 36.82 38.71 1jgz h ILE 254 CO 0.00 0.80 -0.80 0.86 -1.05 0.00 0.00 178.15 177.96 1jgz s TRP 255 N -3.14 1.33 -0.05 0.16 -0.11 -1.04 -5.02 118.94 111.07 1jgz s TRP 255 Ca -0.01 -0.56 0.08 0.00 1.22 0.00 0.00 56.10 56.83 1jgz s TRP 255 Cb 0.11 -1.07 0.12 0.00 -1.50 0.00 0.00 33.47 31.12 1jgz s TRP 255 CO 0.80 -0.37 1.04 1.97 -4.62 0.00 0.00 176.95 175.77 1jgz n PHE 256 N 4.42 0.00 -2.16 5.86 1.16 -1.26 -0.14 117.46 125.34 1jgz n PHE 256 Ca -0.18 -0.41 0.00 0.00 -1.87 0.00 0.00 57.45 54.99 1jgz n PHE 256 Cb 0.51 -0.09 0.00 0.00 -1.61 0.00 0.00 39.48 38.29 1jgz n PHE 256 CO 0.00 0.00 0.00 -0.25 -1.87 0.00 0.00 176.76 174.64 1jgz n ASP 257 N -0.59 0.20 -4.77 5.98 8.00 -1.26 -4.94 116.55 119.17 1jgz n ASP 257 Ca 0.06 -0.06 -0.38 0.00 0.71 0.00 0.00 54.79 55.12 1jgz n ASP 257 Cb 0.66 0.00 -0.02 0.00 -0.02 0.00 0.00 41.12 41.73 1jgz n ASP 257 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 1jgz s GLN 258 N 2.49 4.11 0.19 -1.24 -1.52 -1.26 -4.76 119.66 117.67 1jgz s GLN 258 Ca 0.00 1.78 -0.00 0.00 -1.95 0.00 0.00 55.36 55.19 1jgz s GLN 258 Cb 0.00 -2.69 0.10 0.00 -0.22 0.00 0.00 33.01 30.20 1jgz s GLN 258 CO 0.00 -0.25 1.46 -1.49 -0.25 0.00 0.00 175.29 174.76 1jgz h TRP 259 N 2.70 0.50 -0.88 0.91 4.06 -1.70 -3.13 115.95 118.40 1jgz h TRP 259 Ca -0.48 -0.21 0.04 0.00 2.06 0.00 0.00 58.89 60.29 1jgz h TRP 259 Cb 1.23 -0.08 -0.05 0.00 -1.00 0.00 0.00 29.16 29.26 1jgz h TRP 259 CO 0.56 0.95 0.58 -0.24 -3.56 0.00 0.00 178.44 176.73 1jgz h VAL 260 N 0.26 1.14 0.00 1.49 3.04 -1.81 -1.83 116.25 118.54 1jgz h VAL 260 Ca -0.02 -0.37 -0.01 0.00 -1.01 0.00 0.00 66.70 65.28 1jgz h VAL 260 Cb 1.26 -0.05 -0.00 0.00 -2.01 0.00 0.00 31.29 30.49 1jgz h VAL 260 CO 0.12 0.20 -0.04 0.44 -1.01 0.00 0.00 177.57 177.27 1jgz h ASP 261 N 1.09 0.00 0.07 3.17 3.32 -1.94 -2.07 116.42 120.06 1jgz h ASP 261 Ca 0.36 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.40 1jgz h ASP 261 Cb 0.05 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.60 1jgz h ASP 261 CO -0.11 0.04 -0.04 -0.25 -1.72 0.00 0.00 179.24 177.17 1jgz h TRP 262 N 0.00 0.00 0.00 4.55 7.01 -1.40 -2.51 115.95 123.60 1jgz h TRP 262 Ca -0.00 0.00 0.00 0.00 2.11 0.00 0.00 58.89 61.00 1jgz h TRP 262 Cb 0.27 0.00 0.00 0.00 -2.10 0.00 0.00 29.16 27.33 1jgz h TRP 262 CO 0.00 0.04 0.00 0.91 -2.79 0.00 0.00 178.44 176.60 1jgz n TRP 263 N -4.02 0.00 0.12 2.65 7.02 -0.78 -3.58 117.44 118.84 1jgz n TRP 263 Ca -0.03 0.00 -0.02 0.00 -1.02 0.00 0.00 57.50 56.43 1jgz n TRP 263 Cb 0.12 0.00 0.08 0.00 -2.42 0.00 0.00 31.31 29.09 1jgz n TRP 263 CO 0.00 0.00 0.00 1.96 -2.02 0.00 0.00 177.69 177.63 1jgz h GLN 264 N 0.00 0.00 -1.16 -0.99 4.20 -1.64 -3.10 115.11 112.42 1jgz h GLN 264 Ca 0.00 0.00 0.33 0.00 0.06 0.00 0.00 58.65 59.04 1jgz h GLN 264 Cb 0.00 0.00 -0.07 0.00 0.30 0.00 0.00 27.48 27.71 1jgz h GLN 264 CO 0.00 0.72 0.79 0.11 -0.67 0.00 0.00 178.83 179.78 1jgz h TRP 265 N 0.00 0.29 0.29 2.96 5.08 -1.80 0.30 115.95 123.07 1jgz h TRP 265 Ca -0.01 0.01 -0.01 0.00 1.08 0.00 0.00 58.89 59.96 1jgz h TRP 265 Cb 1.33 -0.08 0.00 0.00 -3.00 0.00 0.00 29.16 27.41 1jgz h TRP 265 CO 0.00 0.01 -0.14 2.35 -1.28 0.00 0.00 178.44 179.38 1jgz h TRP 266 N 0.15 -0.36 0.00 0.12 2.91 -1.82 -3.24 115.95 113.71 1jgz h TRP 266 Ca 0.60 -0.01 -0.04 0.00 1.13 0.00 0.00 58.89 60.58 1jgz h TRP 266 Cb 2.03 0.12 -0.01 0.00 -0.51 0.00 0.00 29.16 30.80 1jgz h TRP 266 CO -0.00 -0.08 -0.18 -0.24 -1.03 0.00 0.00 178.44 176.91 1jgz h VAL 267 N -1.02 0.89 0.00 2.65 3.04 -1.18 -2.46 116.25 118.18 1jgz h VAL 267 Ca -0.04 -0.66 0.00 0.00 -1.01 0.00 0.00 66.70 64.99 1jgz h VAL 267 Cb 0.45 1.38 0.00 0.00 -2.01 0.00 0.00 31.29 31.11 1jgz h VAL 267 CO 0.07 0.17 0.00 0.11 -1.01 0.00 0.00 177.57 176.91 1jgz h LYS 268 N 0.00 0.00 -6.01 4.17 1.79 -0.58 -3.30 116.57 112.64 1jgz h LYS 268 Ca -0.00 0.00 -0.86 0.00 -2.18 0.00 0.00 60.65 57.61 1jgz h LYS 268 Cb 0.37 0.00 0.01 0.00 -1.58 0.00 0.00 32.23 31.02 1jgz h LYS 268 CO 0.02 0.00 0.76 1.28 -1.08 0.00 0.00 179.45 180.43 1jgz n LEU 269 N -2.59 1.23 -0.17 2.94 4.77 -0.93 -4.32 117.00 117.93 1jgz n LEU 269 Ca 0.03 1.13 -0.01 0.00 -0.03 0.00 0.00 56.01 57.13 1jgz n LEU 269 Cb 0.36 -0.90 0.01 0.00 -2.33 0.00 0.00 43.42 40.56 1jgz n LEU 269 CO 0.27 -0.81 0.26 -2.65 -1.33 0.00 0.00 177.39 173.12 1jgz n PRO 270 N 4.41 -0.12 -0.17 3.23 -0.02 -1.26 -0.23 135.00 140.85 1jgz n PRO 270 Ca 0.33 0.69 -0.07 0.00 -2.02 0.00 0.00 63.50 62.42 1jgz n PRO 270 Cb -0.05 -1.02 -0.02 0.00 -0.02 0.00 0.00 33.50 32.40 1jgz n PRO 270 CO 0.00 0.00 0.00 -1.49 1.98 0.00 0.00 175.50 175.99 1jgz h TRP 271 N 0.00 -1.04 0.00 6.00 6.55 -1.96 -2.80 115.95 122.71 1jgz h TRP 271 Ca 0.14 0.07 0.00 0.00 0.95 0.00 0.00 58.89 60.05 1jgz h TRP 271 Cb 0.26 0.53 0.00 0.00 -0.86 0.00 0.00 29.16 29.08 1jgz h TRP 271 CO -0.40 -0.40 -1.05 -2.67 -1.05 0.00 0.00 178.44 172.87 1jgz n TRP 272 N -5.42 0.00 -0.34 0.49 2.14 -0.80 -4.66 117.44 108.85 1jgz n TRP 272 Ca 0.02 0.00 0.06 0.00 2.07 0.00 0.00 57.50 59.65 1jgz n TRP 272 Cb 0.35 -0.06 0.14 0.00 -0.81 0.00 0.00 31.31 30.93 1jgz n TRP 272 CO 0.00 0.00 0.00 0.00 2.07 0.00 0.00 177.69 179.76 1jgz n ALA 273 N -1.55 0.23 0.42 -1.67 0.00 0.69 -2.21 120.51 116.42 1jgz n ALA 273 Ca 0.03 1.04 0.11 0.00 0.00 0.00 0.00 53.44 54.61 1jgz n ALA 273 Cb 0.33 -0.62 -0.14 0.00 0.00 0.00 0.00 19.45 19.01 1jgz n ALA 273 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1jgz n ASN 274 N -5.53 0.43 -4.54 0.00 4.13 -1.26 -4.94 115.26 103.55 1jgz n ASN 274 Ca 0.15 -0.42 -0.48 0.00 1.68 0.00 0.00 54.58 55.52 1jgz n ASN 274 Cb 0.48 1.54 -0.03 0.00 -1.54 0.00 0.00 39.78 40.23 1jgz n ASN 274 CO 0.00 0.00 0.00 -0.38 0.28 0.00 0.00 177.26 177.16 1jgz n ILE 275 N -1.94 1.43 -2.03 2.41 5.41 -0.94 -4.95 119.36 118.75 1jgz n ILE 275 Ca -0.01 -0.36 -0.28 0.00 1.00 0.00 0.00 62.75 63.10 1jgz n ILE 275 Cb 0.47 -0.66 0.14 0.00 -0.71 0.00 0.00 39.64 38.88 1jgz n ILE 275 CO 0.00 0.00 0.00 -2.16 0.00 0.00 0.00 176.55 174.39 1jgz s PRO 276 N -0.87 1.22 0.45 0.38 0.04 -1.26 -4.85 135.00 130.11 1jgz s PRO 276 Ca 0.68 -0.36 0.00 0.00 0.04 0.00 0.00 61.00 61.35 1jgz s PRO 276 Cb -0.85 -1.96 0.00 0.00 0.04 0.00 0.00 34.50 31.73 1jgz s PRO 276 CO 0.56 -2.00 0.00 0.41 0.04 0.00 0.00 177.00 176.01 1jgz n GLY 277 N -3.47 -2.02 6.97 0.56 0.00 -1.19 -5.02 105.19 101.02 1jgz n GLY 277 Ca 0.13 -1.37 0.00 0.00 0.00 0.00 0.00 46.02 44.78 1jgz n GLY 277 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1jgz n GLY 278 N -1.59 -1.55 0.14 -0.02 0.00 -1.26 -4.36 105.19 96.56 1jgz n GLY 278 Ca 0.00 -1.32 -0.23 0.00 0.00 0.00 0.00 46.02 44.47 1jgz n GLY 278 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1jgz h ILE 279 N 0.00 1.07 -3.72 -0.61 1.08 -2.00 -3.42 117.51 109.92 1jgz h ILE 279 Ca 0.00 -2.55 -0.78 0.00 -0.39 0.00 0.00 64.86 61.15 1jgz h ILE 279 Cb 0.00 2.86 -0.27 0.00 -3.07 0.00 0.00 36.82 36.34 1jgz h ILE 279 CO 0.00 0.82 0.01 0.20 -0.69 0.00 0.00 178.15 178.49 1jgz s ASN 280 N -7.33 6.54 0.00 1.72 0.01 -1.26 -5.26 114.94 109.36 1jgz s ASN 280 Ca -0.15 -2.61 0.00 0.00 -0.71 0.00 0.00 52.86 49.39 1jgz s ASN 280 Cb 0.05 -2.17 0.00 0.00 0.41 0.00 0.00 41.25 39.54 1jgz s ASN 280 CO 0.87 -0.58 0.00 0.61 -1.51 0.00 0.00 177.10 176.49