#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1jzs s PHE 2 N 0.00 2.51 0.68 1.12 0.08 -1.26 -4.88 117.98 116.23 1jzs s PHE 2 Ca 0.00 -0.27 -0.15 0.00 0.12 0.00 0.00 56.93 56.63 1jzs s PHE 2 Cb 0.00 -1.22 0.01 0.00 -0.57 0.00 0.00 43.02 41.24 1jzs s PHE 2 CO 0.00 0.53 1.14 0.21 -0.10 0.00 0.00 175.22 177.00 1jzs s LYS 3 N -2.86 2.58 0.29 0.44 2.20 -1.26 -4.96 119.74 116.17 1jzs s LYS 3 Ca 0.24 1.51 -0.29 0.00 -0.36 0.00 0.00 55.97 57.07 1jzs s LYS 3 Cb -0.08 -1.91 -0.10 0.00 -1.51 0.00 0.00 37.83 34.23 1jzs s LYS 3 CO 0.14 -1.44 1.14 -1.83 -0.36 0.00 0.00 175.35 173.00 1jzs s GLU 4 N -4.03 4.58 0.00 4.03 1.03 -1.26 -5.02 118.70 118.03 1jzs s GLU 4 Ca 0.69 1.89 0.00 0.00 0.03 0.00 0.00 54.97 57.58 1jzs s GLU 4 Cb -0.23 -3.17 0.00 0.00 -0.80 0.00 0.00 34.13 29.93 1jzs s GLU 4 CO 0.43 0.12 0.00 1.33 -1.33 0.00 0.00 175.26 175.81 1jzs n VAL 5 N 1.15 0.00 0.00 1.83 0.24 -1.26 -5.07 118.33 115.22 1jzs n VAL 5 Ca -0.01 0.31 0.00 0.00 -2.04 0.00 0.00 64.34 62.60 1jzs n VAL 5 Cb 0.44 -1.17 0.00 0.00 -1.47 0.00 0.00 33.84 31.64 1jzs n VAL 5 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1jzs n GLY 6 N 0.44 -0.28 3.78 7.63 0.00 -1.26 -5.04 105.19 110.46 1jzs n GLY 6 Ca 0.00 -2.23 -0.30 0.00 0.00 0.00 0.00 46.02 43.49 1jzs n GLY 6 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1jzs s GLU 7 N 0.00 2.24 -0.31 1.61 8.01 -1.26 -4.93 118.70 124.06 1jzs s GLU 7 Ca 0.00 0.91 -0.05 0.00 0.01 0.00 0.00 54.97 55.84 1jzs s GLU 7 Cb 0.00 -1.91 -0.07 0.00 -4.31 0.00 0.00 34.13 27.84 1jzs s GLU 7 CO 0.00 -1.58 3.10 -2.30 0.01 0.00 0.00 175.26 174.49 1jzs n PRO 8 N -3.44 2.31 -2.11 0.39 -0.02 -1.26 -4.85 135.00 126.02 1jzs n PRO 8 Ca 0.08 -1.85 -0.41 0.00 -2.02 0.00 0.00 63.50 59.29 1jzs n PRO 8 Cb 0.54 -2.11 -0.01 0.00 -0.02 0.00 0.00 33.50 31.91 1jzs n PRO 8 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 1jzs n ASN 9 N 1.56 4.20 -0.09 2.55 2.85 -1.26 -4.81 115.26 120.26 1jzs n ASN 9 Ca 0.47 -2.85 -0.06 0.00 -0.11 0.00 0.00 54.58 52.03 1jzs n ASN 9 Cb 0.68 -1.67 -0.00 0.00 1.24 0.00 0.00 39.78 40.03 1jzs n ASN 9 CO 0.00 0.00 0.00 -0.26 -2.11 0.00 0.00 177.26 174.89 1jzs h PHE 10 N 7.15 -0.16 -0.98 1.20 -1.00 -1.89 -2.42 116.94 118.85 1jzs h PHE 10 Ca 0.48 0.03 0.22 0.00 2.81 0.00 0.00 57.97 61.51 1jzs h PHE 10 Cb 0.77 0.12 -0.12 0.00 3.61 0.00 0.00 35.95 40.33 1jzs h PHE 10 CO 1.41 -0.13 0.56 -1.35 -1.61 0.00 0.00 178.31 177.19 1jzs h PRO 11 N 0.01 0.59 -0.03 1.51 0.11 -1.85 -1.76 132.00 130.57 1jzs h PRO 11 Ca 0.16 -0.04 -0.03 0.00 0.11 0.00 0.00 66.00 66.20 1jzs h PRO 11 Cb 0.24 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 31.21 1jzs h PRO 11 CO -0.33 0.39 -0.09 -0.22 -0.21 0.00 0.00 178.00 177.54 1jzs h LYS 12 N 0.60 0.12 -0.84 1.05 3.64 -1.87 -3.15 116.57 116.13 1jzs h LYS 12 Ca 0.60 -0.08 0.17 0.00 -1.27 0.00 0.00 60.65 60.07 1jzs h LYS 12 Cb 1.08 0.01 -0.11 0.00 -0.41 0.00 0.00 32.23 32.81 1jzs h LYS 12 CO -0.45 0.70 0.37 -0.07 -2.27 0.00 0.00 179.45 177.73 1jzs h LEU 13 N -0.44 0.37 -0.63 5.20 3.38 -0.92 -0.61 115.31 121.66 1jzs h LEU 13 Ca -0.00 0.12 -0.01 0.00 0.09 0.00 0.00 57.88 58.08 1jzs h LEU 13 Cb 0.70 0.08 -0.03 0.00 0.09 0.00 0.00 40.66 41.50 1jzs h LEU 13 CO 0.02 0.10 0.37 -0.33 0.09 0.00 0.00 178.44 178.69 1jzs h GLU 14 N 0.48 0.85 -0.80 1.13 5.08 -1.37 -1.51 114.58 118.44 1jzs h GLU 14 Ca 0.48 -0.08 0.03 0.00 -1.00 0.00 0.00 59.36 58.79 1jzs h GLU 14 Cb 0.79 -0.18 -0.05 0.00 0.50 0.00 0.00 28.75 29.82 1jzs h GLU 14 CO -0.44 0.62 0.51 0.93 -1.00 0.00 0.00 179.01 179.63 1jzs h GLU 15 N 0.85 0.99 -0.07 2.33 5.08 -1.09 0.30 114.58 122.97 1jzs h GLU 15 Ca 0.22 -0.06 0.02 0.00 -1.00 0.00 0.00 59.36 58.54 1jzs h GLU 15 Cb -0.01 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 29.00 1jzs h GLU 15 CO -0.04 0.65 -0.03 0.93 -1.00 0.00 0.00 179.01 179.53 1jzs h GLU 16 N 1.02 -0.01 -0.39 2.33 5.08 -0.93 -2.40 114.58 119.27 1jzs h GLU 16 Ca 0.31 0.00 0.04 0.00 -1.00 0.00 0.00 59.36 58.71 1jzs h GLU 16 Cb -0.02 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.19 1jzs h GLU 16 CO -0.10 -0.01 0.17 0.28 -1.00 0.00 0.00 179.01 178.36 1jzs h VAL 17 N -0.01 0.94 -0.64 3.13 2.07 -0.33 -2.02 116.25 119.39 1jzs h VAL 17 Ca 0.04 -0.12 0.10 0.00 0.82 0.00 0.00 66.70 67.53 1jzs h VAL 17 Cb 0.07 0.55 -0.04 0.00 -1.52 0.00 0.00 31.29 30.35 1jzs h VAL 17 CO -0.08 0.07 0.43 0.25 0.02 0.00 0.00 177.57 178.25 1jzs h LEU 18 N 0.36 0.43 -0.00 2.57 5.85 -0.22 -0.79 115.31 123.51 1jzs h LEU 18 Ca 0.17 0.01 -0.00 0.00 0.84 0.00 0.00 57.88 58.90 1jzs h LEU 18 Cb 0.11 -0.08 -0.00 0.00 0.37 0.00 0.00 40.66 41.06 1jzs h LEU 18 CO -0.14 0.26 0.00 0.00 -0.34 0.00 0.00 178.44 178.22 1jzs h ALA 19 N 1.68 0.00 -0.80 1.25 0.00 -0.87 -2.81 119.26 117.71 1jzs h ALA 19 Ca 0.29 -0.13 0.11 0.00 0.00 0.00 0.00 54.91 55.19 1jzs h ALA 19 Cb 0.52 -0.00 -0.08 0.00 0.00 0.00 0.00 17.79 18.23 1jzs h ALA 19 CO -0.09 -0.37 0.42 0.35 0.00 0.00 0.00 179.25 179.56 1jzs h PHE 20 N -0.25 0.75 -0.65 0.00 3.04 -0.76 -2.20 116.94 116.87 1jzs h PHE 20 Ca 0.00 0.03 -0.07 0.00 3.98 0.00 0.00 57.97 61.92 1jzs h PHE 20 Cb 0.26 -0.22 -0.03 0.00 2.56 0.00 0.00 35.95 38.52 1jzs h PHE 20 CO 0.01 0.25 0.15 -1.49 -2.02 0.00 0.00 178.31 175.21 1jzs h TRP 21 N 0.67 1.08 0.00 0.41 6.55 -1.19 -2.24 115.95 121.23 1jzs h TRP 21 Ca 0.41 -0.12 -0.07 0.00 0.95 0.00 0.00 58.89 60.05 1jzs h TRP 21 Cb 0.46 -0.31 -0.01 0.00 -0.86 0.00 0.00 29.16 28.45 1jzs h TRP 21 CO -0.09 0.89 -0.34 0.87 -1.05 0.00 0.00 178.44 178.73 1jzs h LYS 22 N 0.98 0.00 0.00 0.49 1.79 -1.19 -2.86 116.57 115.78 1jzs h LYS 22 Ca 0.21 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.68 1jzs h LYS 22 Cb 0.36 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.01 1jzs h LYS 22 CO 0.00 0.34 0.00 -2.13 -1.08 0.00 0.00 179.45 176.58 1jzs n ARG 23 N -3.98 0.00 -0.35 3.15 0.63 -0.87 -3.98 116.66 111.26 1jzs n ARG 23 Ca -0.02 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.91 1jzs n ARG 23 Cb 0.39 -0.56 0.00 0.00 0.45 0.00 0.00 32.46 32.74 1jzs n ARG 23 CO 0.00 0.00 0.00 0.39 -2.51 0.00 0.00 177.63 175.51 1jzs n GLU 24 N -0.35 0.82 -2.99 -0.14 1.02 -1.03 -4.81 120.64 113.16 1jzs n GLU 24 Ca 0.00 0.00 -0.10 0.00 -0.02 0.00 0.00 57.16 57.04 1jzs n GLU 24 Cb 0.00 -1.09 -0.03 0.00 -0.02 0.00 0.00 31.44 30.30 1jzs n GLU 24 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1jzs n LYS 25 N 1.44 -0.97 -0.19 3.49 5.02 -1.17 -4.85 118.16 120.94 1jzs n LYS 25 Ca 0.00 0.03 -0.12 0.00 -2.02 0.00 0.00 58.31 56.20 1jzs n LYS 25 Cb 0.41 -1.13 -0.09 0.00 -0.02 0.00 0.00 35.03 34.20 1jzs n LYS 25 CO 0.00 0.00 0.00 0.82 -0.52 0.00 0.00 177.40 177.70 1jzs h ILE 26 N 0.11 0.00 -0.54 -0.18 1.08 -1.80 -2.45 117.51 113.73 1jzs h ILE 26 Ca -0.20 0.00 0.09 0.00 -0.39 0.00 0.00 64.86 64.36 1jzs h ILE 26 Cb 0.43 0.00 -0.11 0.00 -3.07 0.00 0.00 36.82 34.07 1jzs h ILE 26 CO 0.22 0.00 -0.38 0.15 -0.69 0.00 0.00 178.15 177.46 1jzs h PHE 27 N -0.27 -1.08 -0.53 1.37 3.57 -1.89 0.24 116.94 118.34 1jzs h PHE 27 Ca 0.08 0.07 0.04 0.00 3.53 0.00 0.00 57.97 61.70 1jzs h PHE 27 Cb 0.50 0.55 -0.03 0.00 2.79 0.00 0.00 35.95 39.76 1jzs h PHE 27 CO -0.79 -0.40 0.35 0.37 -2.23 0.00 0.00 178.31 175.61 1jzs h GLN 28 N -0.22 0.57 0.13 1.11 4.15 -1.88 -2.87 115.11 116.10 1jzs h GLN 28 Ca 0.20 -0.03 -0.01 0.00 0.77 0.00 0.00 58.65 59.58 1jzs h GLN 28 Cb 0.56 -0.13 0.00 0.00 0.21 0.00 0.00 27.48 28.12 1jzs h GLN 28 CO -0.65 0.37 -0.06 0.87 -1.93 0.00 0.00 178.83 177.43 1jzs h LYS 29 N 0.58 -0.17 -1.43 1.69 1.57 -0.58 -1.29 116.57 116.94 1jzs h LYS 29 Ca 0.22 0.01 0.42 0.00 -1.87 0.00 0.00 60.65 59.43 1jzs h LYS 29 Cb 0.14 0.04 -0.07 0.00 0.08 0.00 0.00 32.23 32.42 1jzs h LYS 29 CO -0.06 0.28 1.01 0.66 -0.57 0.00 0.00 179.45 180.78 1jzs h SER 30 N -0.74 0.06 0.00 0.86 4.64 -0.85 1.69 113.55 119.20 1jzs h SER 30 Ca -0.02 0.02 -0.12 0.00 -0.47 0.00 0.00 61.79 61.20 1jzs h SER 30 Cb 0.53 0.01 -0.02 0.00 -0.31 0.00 0.00 62.40 62.62 1jzs h SER 30 CO 0.03 -0.01 -0.76 0.58 -0.87 0.00 0.00 176.83 175.80 1jzs h VAL 31 N 0.04 0.75 -0.83 0.95 2.07 -1.49 -3.36 116.25 114.38 1jzs h VAL 31 Ca 0.71 -1.81 0.19 0.00 0.82 0.00 0.00 66.70 66.60 1jzs h VAL 31 Cb 2.70 1.67 -0.12 0.00 -1.52 0.00 0.00 31.29 34.02 1jzs h VAL 31 CO -0.07 0.25 0.30 -0.08 0.02 0.00 0.00 177.57 178.00 1jzs h GLU 32 N -1.00 0.35 0.00 1.57 4.81 0.26 0.18 114.58 120.74 1jzs h GLU 32 Ca -0.18 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.03 1jzs h GLU 32 Cb 0.94 -0.08 0.00 0.00 0.63 0.00 0.00 28.75 30.25 1jzs h GLU 32 CO -0.11 0.23 0.04 0.09 -0.73 0.00 0.00 179.01 178.53 1jzs n ASN 33 N -5.08 0.00 -0.09 1.04 4.13 0.56 -2.07 115.26 113.74 1jzs n ASN 33 Ca 0.19 0.40 0.03 0.00 1.68 0.00 0.00 54.58 56.87 1jzs n ASN 33 Cb 0.56 -0.40 0.05 0.00 -1.54 0.00 0.00 39.78 38.46 1jzs n ASN 33 CO 0.00 0.00 0.00 0.54 0.28 0.00 0.00 177.26 178.08 1jzs n ARG 34 N -1.39 2.55 -0.82 3.52 5.12 0.62 -5.05 116.66 121.21 1jzs n ARG 34 Ca 0.00 -1.85 -0.33 0.00 -1.93 0.00 0.00 57.85 53.73 1jzs n ARG 34 Cb 0.04 -1.17 0.12 0.00 -1.16 0.00 0.00 32.46 30.28 1jzs n ARG 34 CO 0.00 0.00 0.00 1.17 -1.93 0.00 0.00 177.63 176.87 1jzs n LYS 35 N -0.66 -0.26 0.00 5.56 3.00 -0.88 -1.39 118.16 123.53 1jzs n LYS 35 Ca 0.06 -0.03 0.00 0.00 -0.00 0.00 0.00 58.31 58.33 1jzs n LYS 35 Cb 0.38 -1.84 0.00 0.00 0.00 0.00 0.00 35.03 33.57 1jzs n LYS 35 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1jzs n GLY 36 N 1.55 1.62 3.93 3.14 0.00 -1.26 -4.95 105.19 109.22 1jzs n GLY 36 Ca 0.07 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.81 1jzs n GLY 36 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1jzs s GLY 37 N -1.51 1.71 0.10 -0.02 0.00 -0.48 -5.01 107.32 102.11 1jzs s GLY 37 Ca 0.00 -1.08 -0.31 0.00 0.00 0.00 0.00 44.72 43.33 1jzs s GLY 37 CO 0.00 -0.49 1.45 2.56 0.00 0.00 0.00 173.10 176.62 1jzs s PRO 38 N -5.55 4.28 0.36 2.90 0.04 -1.26 -4.50 135.00 131.28 1jzs s PRO 38 Ca 0.67 2.13 -0.27 0.00 0.04 0.00 0.00 61.00 63.57 1jzs s PRO 38 Cb -0.07 -3.34 -0.09 0.00 0.04 0.00 0.00 34.50 31.04 1jzs s PRO 38 CO 0.49 -0.53 1.21 0.50 0.04 0.00 0.00 177.00 178.71 1jzs s ARG 39 N 1.54 4.21 -0.39 4.56 6.06 -1.26 -0.85 118.95 132.83 1jzs s ARG 39 Ca 0.67 1.98 0.01 0.00 -2.50 0.00 0.00 55.73 55.89 1jzs s ARG 39 Cb -0.37 -2.87 0.13 0.00 0.06 0.00 0.00 34.95 31.89 1jzs s ARG 39 CO 0.30 -0.23 0.19 -0.47 -2.50 0.00 0.00 175.30 172.60 1jzs s TYR 40 N -1.28 1.73 -0.02 5.12 5.04 -0.96 -4.82 117.35 122.16 1jzs s TYR 40 Ca 0.53 -2.12 -0.14 0.00 -2.44 0.00 0.00 57.07 52.90 1jzs s TYR 40 Cb -0.34 -1.70 -0.05 0.00 0.35 0.00 0.00 41.96 40.21 1jzs s TYR 40 CO 0.44 -0.82 0.38 -0.08 -1.34 0.00 0.00 175.55 174.13 1jzs s THR 41 N 0.82 5.09 -0.01 4.34 -1.32 -1.26 -4.32 115.64 118.98 1jzs s THR 41 Ca 0.15 0.76 0.04 0.00 -1.21 0.00 0.00 61.69 61.44 1jzs s THR 41 Cb -0.22 -3.68 -0.01 0.00 -1.51 0.00 0.00 72.50 67.08 1jzs s THR 41 CO -0.07 0.57 -0.13 -0.69 -2.21 0.00 0.00 174.62 172.10 1jzs s VAL 42 N -0.99 1.02 0.06 5.08 1.01 -1.26 -0.86 120.40 124.46 1jzs s VAL 42 Ca 0.23 -0.55 0.05 0.00 0.00 0.00 0.00 61.98 61.70 1jzs s VAL 42 Cb -0.16 -0.85 -0.04 0.00 0.00 0.00 0.00 36.38 35.33 1jzs s VAL 42 CO 0.12 0.29 -0.07 -0.31 0.00 0.00 0.00 175.10 175.13 1jzs s TYR 43 N -0.30 2.83 -0.06 5.22 2.02 -1.21 -4.73 117.35 121.13 1jzs s TYR 43 Ca 0.05 -0.09 0.03 0.00 -0.37 0.00 0.00 57.07 56.69 1jzs s TYR 43 Cb -0.05 -1.52 -0.03 0.00 -0.40 0.00 0.00 41.96 39.97 1jzs s TYR 43 CO -0.00 0.41 -0.13 -2.00 -1.57 0.00 0.00 175.55 172.25 1jzs s GLU 44 N -1.92 2.62 -0.08 -0.62 2.12 -1.26 -4.65 118.70 114.91 1jzs s GLU 44 Ca 0.20 -0.68 -0.30 0.00 0.36 0.00 0.00 54.97 54.56 1jzs s GLU 44 Cb -0.11 -2.43 -0.05 0.00 0.26 0.00 0.00 34.13 31.81 1jzs s GLU 44 CO 0.12 0.58 1.57 0.20 -0.54 0.00 0.00 175.26 177.20 1jzs s GLY 45 N -0.62 1.56 -0.20 -1.50 0.00 -1.26 -4.91 107.32 100.38 1jzs s GLY 45 Ca 0.09 0.84 -0.29 0.00 0.00 0.00 0.00 44.72 45.36 1jzs s GLY 45 CO 0.01 2.92 1.90 2.56 0.00 0.00 0.00 173.10 180.50 1jzs s PRO 46 N 3.92 3.54 0.77 2.90 0.04 -1.26 -5.02 135.00 139.89 1jzs s PRO 46 Ca 0.69 1.88 -0.05 0.00 0.04 0.00 0.00 61.00 63.57 1jzs s PRO 46 Cb -0.31 -4.20 0.16 0.00 0.04 0.00 0.00 34.50 30.19 1jzs s PRO 46 CO 0.26 -1.62 1.05 -0.35 0.04 0.00 0.00 177.00 176.38 1jzs n PRO 47 N 8.16 -0.43 -4.91 0.56 -0.04 -1.26 -4.08 135.00 133.00 1jzs n PRO 47 Ca 0.23 -2.42 -0.26 0.00 -0.04 0.00 0.00 63.50 61.01 1jzs n PRO 47 Cb 0.45 -0.84 -0.15 0.00 -0.04 0.00 0.00 33.50 32.91 1jzs n PRO 47 CO 0.00 0.00 0.00 0.99 -0.04 0.00 0.00 175.50 176.45 1jzs s THR 48 N -3.21 1.55 -0.47 0.52 2.01 -1.26 -1.61 115.64 113.16 1jzs s THR 48 Ca 0.66 -0.87 -0.00 0.00 0.31 0.00 0.00 61.69 61.79 1jzs s THR 48 Cb -0.03 -1.29 0.41 0.00 0.01 0.00 0.00 72.50 71.60 1jzs s THR 48 CO 0.45 0.41 1.93 0.00 -0.69 0.00 0.00 174.62 176.72 1jzs n ALA 49 N 2.52 5.57 -0.60 7.40 0.00 -1.09 -3.96 120.51 130.34 1jzs n ALA 49 Ca -0.15 -2.60 0.08 0.00 0.00 0.00 0.00 53.44 50.77 1jzs n ALA 49 Cb 0.53 -1.53 0.29 0.00 0.00 0.00 0.00 19.45 18.74 1jzs n ALA 49 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 1jzs n ASN 50 N -0.53 4.17 -3.81 0.00 2.04 -1.17 -1.71 115.26 114.25 1jzs n ASN 50 Ca 0.49 -2.47 -0.09 0.00 -0.44 0.00 0.00 54.58 52.07 1jzs n ASN 50 Cb 0.88 -0.49 -0.04 0.00 -2.53 0.00 0.00 39.78 37.60 1jzs n ASN 50 CO 0.00 0.00 0.00 -0.83 -0.44 0.00 0.00 177.26 175.99 1jzs s GLY 51 N -1.15 0.03 0.78 4.83 0.00 -1.25 -4.98 107.32 105.57 1jzs s GLY 51 Ca 0.43 -0.36 -0.09 0.00 0.00 0.00 0.00 44.72 44.69 1jzs s GLY 51 CO 0.19 -0.30 1.12 1.08 0.00 0.00 0.00 173.10 175.19 1jzs s LEU 52 N -2.91 2.71 0.63 0.66 1.43 -1.26 -4.88 118.68 115.06 1jzs s LEU 52 Ca 0.12 0.47 -0.05 0.00 -1.03 0.00 0.00 54.13 53.64 1jzs s LEU 52 Cb -0.02 -2.95 0.03 0.00 0.03 0.00 0.00 46.19 43.28 1jzs s LEU 52 CO 0.01 -1.90 0.93 -2.84 0.23 0.00 0.00 176.35 172.78 1jzs s PRO 53 N -5.45 2.59 0.14 1.29 0.02 -1.26 -5.10 135.00 127.23 1jzs s PRO 53 Ca 0.63 -0.18 -0.18 0.00 0.02 0.00 0.00 61.00 61.29 1jzs s PRO 53 Cb -0.09 -2.25 0.04 0.00 0.02 0.00 0.00 34.50 32.22 1jzs s PRO 53 CO 0.47 -0.91 0.46 -3.38 -0.33 0.00 0.00 177.00 173.31 1jzs s HIS 54 N -3.07 -0.29 0.27 6.54 -3.43 -1.26 -4.90 115.29 109.16 1jzs s HIS 54 Ca 0.57 0.00 -0.30 0.00 -0.80 0.00 0.00 55.06 54.53 1jzs s HIS 54 Cb -0.11 0.35 -0.13 0.00 -1.43 0.00 0.00 32.58 31.26 1jzs s HIS 54 CO 0.44 -0.75 1.36 1.33 -2.00 0.00 0.00 174.74 175.12 1jzs n VAL 55 N -0.27 1.32 0.00 -5.38 0.24 -1.26 0.12 118.33 113.10 1jzs n VAL 55 Ca -0.16 -0.33 0.00 0.00 -2.04 0.00 0.00 64.34 61.81 1jzs n VAL 55 Cb 0.64 -1.49 0.00 0.00 -1.47 0.00 0.00 33.84 31.52 1jzs n VAL 55 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1jzs n GLY 56 N 1.68 2.88 0.07 7.63 0.00 -1.26 -4.64 105.19 111.54 1jzs n GLY 56 Ca 0.09 -1.06 -0.08 0.00 0.00 0.00 0.00 46.02 44.97 1jzs n GLY 56 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 173.32 173.77 1jzs h HIS 57 N 0.00 0.01 0.17 1.61 -0.00 -0.74 -2.64 115.15 113.56 1jzs h HIS 57 Ca 0.00 -0.01 -0.27 0.00 -0.00 0.00 0.00 60.37 60.10 1jzs h HIS 57 Cb 0.00 -0.00 0.03 0.00 -0.00 0.00 0.00 27.41 27.44 1jzs h HIS 57 CO 0.00 1.01 -1.15 0.00 -0.00 0.00 0.00 177.93 177.78 1jzs h ALA 58 N 0.99 -0.09 -0.54 2.45 0.00 -1.78 -2.16 119.26 118.13 1jzs h ALA 58 Ca -0.13 -0.76 -0.06 0.00 0.00 0.00 0.00 54.91 53.96 1jzs h ALA 58 Cb 1.87 0.13 -0.02 0.00 0.00 0.00 0.00 17.79 19.77 1jzs h ALA 58 CO 0.11 0.57 0.10 0.37 0.00 0.00 0.00 179.25 180.40 1jzs h GLN 59 N 0.00 0.89 0.11 0.00 4.15 -1.86 0.12 115.11 118.52 1jzs h GLN 59 Ca -0.19 -0.23 0.01 0.00 0.77 0.00 0.00 58.65 59.01 1jzs h GLN 59 Cb 1.88 -0.11 -0.02 0.00 0.21 0.00 0.00 27.48 29.44 1jzs h GLN 59 CO 0.22 0.85 -0.16 0.00 -1.93 0.00 0.00 178.83 177.81 1jzs h ALA 60 N 1.00 -0.28 0.00 3.38 0.00 -1.53 -2.60 119.26 119.22 1jzs h ALA 60 Ca 0.17 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 55.02 1jzs h ALA 60 Cb 0.38 0.24 -0.00 0.00 0.00 0.00 0.00 17.79 18.41 1jzs h ALA 60 CO 0.01 -0.68 -0.13 0.00 0.00 0.00 0.00 179.25 178.45 1jzs h ARG 61 N -0.32 0.00 0.00 0.00 3.08 -1.14 -1.49 114.38 114.52 1jzs h ARG 61 Ca 0.02 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.07 1jzs h ARG 61 Cb 0.32 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.37 1jzs h ARG 61 CO -0.07 0.13 0.00 0.43 -1.07 0.00 0.00 179.97 179.39 1jzs n SER 62 N -3.47 0.05 -0.13 7.04 7.64 0.39 -2.05 113.62 123.08 1jzs n SER 62 Ca -0.01 0.51 -0.26 0.00 1.01 0.00 0.00 58.87 60.11 1jzs n SER 62 Cb 0.28 -0.52 -0.09 0.00 -1.01 0.00 0.00 64.21 62.87 1jzs n SER 62 CO 0.00 0.00 0.00 -1.22 -3.01 0.00 0.00 175.04 170.81 1jzs n TYR 63 N -1.55 0.00 0.23 1.43 0.53 -0.62 -3.96 117.16 113.22 1jzs n TYR 63 Ca 0.05 0.00 0.12 0.00 -1.02 0.00 0.00 57.90 57.04 1jzs n TYR 63 Cb 0.24 -0.92 0.58 0.00 -1.03 0.00 0.00 39.34 38.21 1jzs n TYR 63 CO 0.00 0.00 0.00 0.87 -1.02 0.00 0.00 176.86 176.71 1jzs h LYS 64 N -0.83 0.00 0.01 -0.72 1.57 -1.40 -3.09 116.57 112.11 1jzs h LYS 64 Ca -0.64 0.00 -0.40 0.00 -1.87 0.00 0.00 60.65 57.74 1jzs h LYS 64 Cb 1.59 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 33.84 1jzs h LYS 64 CO -0.36 0.00 -2.37 -3.47 -0.57 0.00 0.00 179.45 172.68 1jzs n ASP 65 N -2.29 1.98 -0.13 0.86 -0.08 -0.87 -4.38 116.55 111.64 1jzs n ASP 65 Ca -0.01 0.11 -0.04 0.00 -1.51 0.00 0.00 54.79 53.34 1jzs n ASP 65 Cb 0.09 -0.64 0.03 0.00 2.34 0.00 0.00 41.12 42.94 1jzs n ASP 65 CO 0.00 0.00 0.00 0.25 0.12 0.00 0.00 177.20 177.57 1jzs h LEU 66 N -0.42 -0.25 -0.42 -2.67 6.46 -1.66 -2.90 115.31 113.44 1jzs h LEU 66 Ca -0.59 0.11 -0.05 0.00 -0.12 0.00 0.00 57.88 57.22 1jzs h LEU 66 Cb 1.77 0.21 -0.02 0.00 -0.73 0.00 0.00 40.66 41.89 1jzs h LEU 66 CO -0.20 -0.09 0.06 -0.26 -0.62 0.00 0.00 178.44 177.33 1jzs h PHE 67 N 0.07 0.76 0.00 1.25 -1.00 -1.80 -1.76 116.94 114.46 1jzs h PHE 67 Ca 0.21 -0.11 -0.04 0.00 2.81 0.00 0.00 57.97 60.84 1jzs h PHE 67 Cb 0.31 -0.21 -0.01 0.00 3.61 0.00 0.00 35.95 39.66 1jzs h PHE 67 CO -0.31 0.73 -0.17 -1.35 -1.61 0.00 0.00 178.31 175.60 1jzs h PRO 68 N 0.56 0.00 0.50 1.51 0.11 -1.74 0.16 132.00 133.09 1jzs h PRO 68 Ca 0.13 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 66.21 1jzs h PRO 68 Cb 0.39 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.51 1jzs h PRO 68 CO 0.01 0.17 -0.24 0.00 -0.21 0.00 0.00 178.00 177.74 1jzs h ARG 69 N 0.00 -0.64 -0.94 1.05 3.08 -1.29 -0.96 114.38 114.68 1jzs h ARG 69 Ca -0.00 0.04 0.28 0.00 0.07 0.00 0.00 59.98 60.38 1jzs h ARG 69 Cb 0.36 0.15 -0.16 0.00 0.08 0.00 0.00 29.97 30.40 1jzs h ARG 69 CO 0.02 -0.43 0.27 -0.92 -1.07 0.00 0.00 179.97 177.85 1jzs h TYR 70 N -0.99 0.40 -0.55 3.04 3.20 -1.00 0.83 116.97 121.90 1jzs h TYR 70 Ca -0.07 0.05 -0.08 0.00 3.14 0.00 0.00 58.73 61.77 1jzs h TYR 70 Cb 0.51 -0.02 -0.02 0.00 1.54 0.00 0.00 36.73 38.74 1jzs h TYR 70 CO 0.03 -0.31 0.02 0.87 -1.64 0.00 0.00 178.16 177.13 1jzs h LYS 71 N 0.14 0.96 -0.24 1.82 1.79 -0.60 -2.80 116.57 117.64 1jzs h LYS 71 Ca 0.63 -0.29 -0.14 0.00 -2.18 0.00 0.00 60.65 58.67 1jzs h LYS 71 Cb 1.39 -0.09 -0.01 0.00 -1.58 0.00 0.00 32.23 31.94 1jzs h LYS 71 CO -0.73 0.95 -0.42 1.79 -1.08 0.00 0.00 179.45 179.96 1jzs h THR 72 N 0.84 1.30 0.00 -0.16 1.35 0.52 -1.16 112.91 115.60 1jzs h THR 72 Ca 0.16 -1.60 0.00 0.00 -0.55 0.00 0.00 66.41 64.42 1jzs h THR 72 Cb 0.51 1.58 0.00 0.00 -1.73 0.00 0.00 68.15 68.50 1jzs h THR 72 CO 0.02 0.51 0.00 0.23 -0.25 0.00 0.00 175.52 176.03 1jzs n MET 73 N -4.02 0.00 -0.07 4.72 2.81 -0.24 -1.30 117.12 119.02 1jzs n MET 73 Ca -0.02 0.44 0.02 0.00 -1.81 0.00 0.00 57.70 56.34 1jzs n MET 73 Cb 0.53 -1.50 0.06 0.00 -0.71 0.00 0.00 33.22 31.60 1jzs n MET 73 CO 0.00 0.00 0.00 0.54 1.51 0.00 0.00 175.97 178.02 1jzs n ARG 74 N -1.48 2.94 0.00 0.03 1.74 -0.50 0.13 116.66 119.52 1jzs n ARG 74 Ca 0.01 -1.73 0.00 0.00 -0.77 0.00 0.00 57.85 55.36 1jzs n ARG 74 Cb 0.03 -1.11 0.00 0.00 -1.02 0.00 0.00 32.46 30.35 1jzs n ARG 74 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1jzs n GLY 75 N -0.10 0.72 3.88 -0.13 0.00 -0.42 -5.02 105.19 104.11 1jzs n GLY 75 Ca 0.05 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.76 1jzs n GLY 75 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1jzs s TYR 76 N -2.00 3.44 -0.69 1.61 1.51 -0.82 -4.14 117.35 116.26 1jzs s TYR 76 Ca 0.00 0.95 -0.18 0.00 -1.01 0.00 0.00 57.07 56.83 1jzs s TYR 76 Cb 0.00 -2.34 0.13 0.00 -0.11 0.00 0.00 41.96 39.65 1jzs s TYR 76 CO 0.00 0.11 0.77 -0.47 -1.11 0.00 0.00 175.55 174.85 1jzs s TYR 77 N -2.06 3.18 -0.98 2.71 5.04 -0.03 -4.32 117.35 120.90 1jzs s TYR 77 Ca 0.49 -1.26 -0.04 0.00 -2.44 0.00 0.00 57.07 53.82 1jzs s TYR 77 Cb -0.11 -4.01 0.24 0.00 0.35 0.00 0.00 41.96 38.44 1jzs s TYR 77 CO 0.25 -1.25 0.91 0.00 -1.34 0.00 0.00 175.55 174.12 1jzs s ALA 78 N 2.12 4.44 -0.23 3.97 0.00 -1.26 -2.27 121.76 128.53 1jzs s ALA 78 Ca 0.16 -3.85 -0.29 0.00 0.00 0.00 0.00 51.96 47.98 1jzs s ALA 78 Cb -0.19 -3.11 -0.01 0.00 0.00 0.00 0.00 23.12 19.81 1jzs s ALA 78 CO 0.00 -2.17 1.38 -2.14 0.00 0.00 0.00 175.76 172.84 1jzs s PRO 79 N -1.34 3.99 -0.16 0.00 0.02 -1.26 -4.97 135.00 131.28 1jzs s PRO 79 Ca 0.29 1.51 -0.08 0.00 0.02 0.00 0.00 61.00 62.74 1jzs s PRO 79 Cb -0.08 -3.89 -0.04 0.00 0.02 0.00 0.00 34.50 30.51 1jzs s PRO 79 CO -0.11 -1.03 0.11 1.03 -0.33 0.00 0.00 177.00 176.67 1jzs s ARG 80 N 4.09 3.75 0.17 5.54 3.00 -1.26 -4.74 118.95 129.51 1jzs s ARG 80 Ca 0.60 -0.23 0.06 0.00 0.00 0.00 0.00 55.73 56.17 1jzs s ARG 80 Cb -0.21 -3.23 -0.04 0.00 0.00 0.00 0.00 34.95 31.46 1jzs s ARG 80 CO 0.23 0.51 -0.13 0.50 0.00 0.00 0.00 175.30 176.41 1jzs s ARG 81 N -0.28 1.19 0.38 3.54 3.52 -1.26 -2.41 118.95 123.63 1jzs s ARG 81 Ca 0.10 -1.50 0.04 0.00 -0.13 0.00 0.00 55.73 54.24 1jzs s ARG 81 Cb -0.12 -0.90 -0.04 0.00 -1.56 0.00 0.00 34.95 32.33 1jzs s ARG 81 CO 0.01 0.14 0.08 0.00 -0.81 0.00 0.00 175.30 174.72 1jzs s ALA 82 N -3.03 2.80 0.05 6.12 0.00 -1.24 -4.63 121.76 121.83 1jzs s ALA 82 Ca 0.19 -1.55 -0.28 0.00 0.00 0.00 0.00 51.96 50.31 1jzs s ALA 82 Cb 0.00 0.62 0.10 0.00 0.00 0.00 0.00 23.12 23.84 1jzs s ALA 82 CO 0.04 -0.28 1.18 0.20 0.00 0.00 0.00 175.76 176.89 1jzs s GLY 83 N -3.58 -0.29 -0.03 0.00 0.00 -1.26 -1.05 107.32 101.10 1jzs s GLY 83 Ca 0.28 0.39 0.05 0.00 0.00 0.00 0.00 44.72 45.44 1jzs s GLY 83 CO 0.14 0.81 -0.18 -0.98 0.00 0.00 0.00 173.10 172.89 1jzs s TRP 84 N -2.59 1.73 -0.54 1.90 0.52 0.12 -4.14 118.94 115.94 1jzs s TRP 84 Ca 0.16 -0.44 -0.20 0.00 0.02 0.00 0.00 56.10 55.64 1jzs s TRP 84 Cb 0.02 -1.15 0.06 0.00 -1.15 0.00 0.00 33.47 31.26 1jzs s TRP 84 CO -0.01 -0.12 0.71 0.34 0.02 0.00 0.00 176.95 177.89 1jzs s ASP 85 N -0.14 6.23 0.00 2.95 2.15 -0.64 -2.35 116.67 124.87 1jzs s ASP 85 Ca 0.00 -0.93 0.08 0.00 0.43 0.00 0.00 52.55 52.14 1jzs s ASP 85 Cb -0.10 -2.32 0.05 0.00 -0.30 0.00 0.00 42.92 40.25 1jzs s ASP 85 CO 0.01 -1.02 0.72 0.35 -0.17 0.00 0.00 175.17 175.06 1jzs n THR 86 N 5.71 0.00 -3.35 1.71 -2.24 -1.26 -4.37 114.28 110.48 1jzs n THR 86 Ca -0.06 -0.48 -0.22 0.00 -2.27 0.00 0.00 64.05 61.03 1jzs n THR 86 Cb 0.45 1.16 0.04 0.00 -2.10 0.00 0.00 70.33 69.88 1jzs n THR 86 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 1jzs n HIS 87 N 0.30 -1.68 -0.45 4.78 8.25 -1.26 -4.93 115.22 120.23 1jzs n HIS 87 Ca 0.05 -2.17 0.06 0.00 -0.26 0.00 0.00 57.72 55.40 1jzs n HIS 87 Cb 0.20 -0.51 -0.02 0.00 1.12 0.00 0.00 29.99 30.79 1jzs n HIS 87 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1jzs n GLY 88 N -1.83 -1.88 0.33 -1.41 0.00 -0.39 -4.32 105.19 95.70 1jzs n GLY 88 Ca 0.10 -1.40 0.21 0.00 0.00 0.00 0.00 46.02 44.93 1jzs n GLY 88 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1jzs h LEU 89 N -0.42 -0.05 -1.81 0.99 3.38 -1.95 0.66 115.31 116.11 1jzs h LEU 89 Ca -0.01 0.25 -0.01 0.00 0.09 0.00 0.00 57.88 58.20 1jzs h LEU 89 Cb 0.41 0.35 -0.00 0.00 0.09 0.00 0.00 40.66 41.51 1jzs h LEU 89 CO 0.01 -0.34 -0.03 -0.65 0.09 0.00 0.00 178.44 177.53 1jzs h PRO 90 N 0.06 0.08 0.00 1.13 0.11 -1.99 -1.49 132.00 129.91 1jzs h PRO 90 Ca 0.69 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 66.78 1jzs h PRO 90 Cb 1.59 -0.02 -0.00 0.00 0.11 0.00 0.00 31.00 32.68 1jzs h PRO 90 CO -0.80 0.12 -0.07 0.28 -0.21 0.00 0.00 178.00 177.32 1jzs h VAL 91 N 0.08 1.06 -0.98 3.15 2.07 0.07 -3.33 116.25 118.37 1jzs h VAL 91 Ca 0.02 -1.82 0.21 0.00 0.82 0.00 0.00 66.70 65.93 1jzs h VAL 91 Cb 0.11 2.02 -0.09 0.00 -1.52 0.00 0.00 31.29 31.81 1jzs h VAL 91 CO 0.00 0.36 0.62 -0.33 0.02 0.00 0.00 177.57 178.24 1jzs h GLU 92 N -1.00 0.58 -0.10 1.57 5.08 -0.99 -2.41 114.58 117.31 1jzs h GLU 92 Ca -0.01 -0.04 -0.12 0.00 -1.00 0.00 0.00 59.36 58.20 1jzs h GLU 92 Cb 0.64 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.74 1jzs h GLU 92 CO -0.01 0.39 -0.45 -0.07 -1.00 0.00 0.00 179.01 177.86 1jzs h LEU 93 N 0.60 0.25 -0.40 1.33 4.07 -1.41 -0.36 115.31 119.39 1jzs h LEU 93 Ca 0.55 -0.11 -0.18 0.00 0.08 0.00 0.00 57.88 58.22 1jzs h LEU 93 Cb 1.09 -0.07 -0.00 0.00 1.08 0.00 0.00 40.66 42.75 1jzs h LEU 93 CO -0.31 0.67 -0.67 -0.33 -1.08 0.00 0.00 178.44 176.72 1jzs h GLU 94 N 0.19 0.53 0.00 1.13 4.39 -1.54 -2.22 114.58 117.07 1jzs h GLU 94 Ca 0.01 -0.39 -0.10 0.00 0.34 0.00 0.00 59.36 59.22 1jzs h GLU 94 Cb 0.88 0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 29.58 1jzs h GLU 94 CO 0.07 1.02 -0.47 0.28 -1.16 0.00 0.00 179.01 178.75 1jzs h VAL 95 N 0.38 1.15 0.26 3.13 2.07 -1.37 -2.99 116.25 118.89 1jzs h VAL 95 Ca -0.02 -1.71 -0.01 0.00 0.82 0.00 0.00 66.70 65.78 1jzs h VAL 95 Cb 1.24 1.97 0.00 0.00 -1.52 0.00 0.00 31.29 32.98 1jzs h VAL 95 CO 0.12 0.46 -0.13 -0.08 0.02 0.00 0.00 177.57 177.96 1jzs h GLU 96 N 0.00 -0.34 0.38 1.57 4.81 -0.72 -2.73 114.58 117.54 1jzs h GLU 96 Ca -0.00 0.02 -0.02 0.00 -0.13 0.00 0.00 59.36 59.23 1jzs h GLU 96 Cb 0.93 0.08 -0.00 0.00 0.63 0.00 0.00 28.75 30.39 1jzs h GLU 96 CO 0.06 -0.04 -0.26 0.87 -0.73 0.00 0.00 179.01 178.92 1jzs h LYS 97 N -0.65 -0.58 -0.99 1.92 1.57 -1.44 -0.15 116.57 116.25 1jzs h LYS 97 Ca -0.04 0.04 0.36 0.00 -1.87 0.00 0.00 60.65 59.14 1jzs h LYS 97 Cb 0.46 0.13 -0.18 0.00 0.08 0.00 0.00 32.23 32.72 1jzs h LYS 97 CO 0.06 -0.39 0.36 0.87 -0.57 0.00 0.00 179.45 179.78 1jzs h LYS 98 N -0.60 0.03 -0.36 3.15 1.57 -1.64 0.94 116.57 119.67 1jzs h LYS 98 Ca -0.05 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.73 1jzs h LYS 98 Cb 0.49 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.79 1jzs h LYS 98 CO 0.03 0.02 0.00 1.28 -0.57 0.00 0.00 179.45 180.21 1jzs n LEU 99 N -5.33 2.03 -3.50 2.94 4.77 -1.03 -4.95 117.00 111.94 1jzs n LEU 99 Ca 0.32 -1.00 -0.20 0.00 -0.03 0.00 0.00 56.01 55.11 1jzs n LEU 99 Cb 1.07 -0.24 0.06 0.00 -2.33 0.00 0.00 43.42 41.98 1jzs n LEU 99 CO -0.01 0.50 0.01 0.61 -1.33 0.00 0.00 177.39 177.17 1jzs n GLY 100 N 1.12 -0.64 3.29 -0.72 0.00 0.33 -5.01 105.19 103.57 1jzs n GLY 100 Ca 0.13 0.29 -0.32 0.00 0.00 0.00 0.00 46.02 46.12 1jzs n GLY 100 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1jzs s LEU 101 N -6.21 2.31 -0.00 0.99 1.02 -0.12 -5.02 118.68 111.65 1jzs s LEU 101 Ca 0.19 -0.46 0.03 0.00 0.02 0.00 0.00 54.13 53.91 1jzs s LEU 101 Cb -0.04 -1.47 -0.03 0.00 0.02 0.00 0.00 46.19 44.67 1jzs s LEU 101 CO 0.78 0.19 0.10 0.29 0.02 0.00 0.00 176.35 177.73 1jzs n LYS 102 N 3.32 5.15 -4.16 1.70 5.02 -1.26 -4.43 118.16 123.50 1jzs n LYS 102 Ca -0.18 -0.00 -0.13 0.00 -2.02 0.00 0.00 58.31 55.97 1jzs n LYS 102 Cb 0.53 -0.69 -0.08 0.00 -0.02 0.00 0.00 35.03 34.76 1jzs n LYS 102 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1jzs s SER 103 N -1.42 0.50 0.13 4.39 1.04 -1.26 -4.97 113.70 112.11 1jzs s SER 103 Ca 0.01 -1.38 -0.09 0.00 0.48 0.00 0.00 55.95 54.96 1jzs s SER 103 Cb 0.02 0.50 -0.08 0.00 0.10 0.00 0.00 66.02 66.56 1jzs s SER 103 CO 0.11 -1.01 1.36 0.11 0.98 0.00 0.00 173.24 174.79 1jzs h LYS 104 N 2.38 0.71 0.00 4.02 1.57 -1.89 -2.50 116.57 120.86 1jzs h LYS 104 Ca -0.31 -0.55 -0.06 0.00 -1.87 0.00 0.00 60.65 57.86 1jzs h LYS 104 Cb 1.25 0.10 -0.01 0.00 0.08 0.00 0.00 32.23 33.65 1jzs h LYS 104 CO 0.44 1.17 -0.28 0.07 -0.57 0.00 0.00 179.45 180.27 1jzs h ARG 105 N 0.50 0.00 0.60 3.15 0.11 -1.98 0.89 114.38 117.64 1jzs h ARG 105 Ca -0.03 0.00 -0.03 0.00 0.10 0.00 0.00 59.98 60.02 1jzs h ARG 105 Cb 1.33 0.00 0.01 0.00 1.11 0.00 0.00 29.97 32.41 1jzs h ARG 105 CO 0.14 0.28 -0.29 0.93 0.10 0.00 0.00 179.97 181.14 1jzs h GLU 106 N 0.00 -0.77 -0.97 0.08 5.08 -1.96 0.17 114.58 116.20 1jzs h GLU 106 Ca -0.00 0.05 0.31 0.00 -1.00 0.00 0.00 59.36 58.71 1jzs h GLU 106 Cb 0.56 0.18 -0.15 0.00 0.50 0.00 0.00 28.75 29.84 1jzs h GLU 106 CO 0.04 -0.47 0.48 0.82 -1.00 0.00 0.00 179.01 178.87 1jzs h ILE 107 N -1.13 0.28 -0.44 3.13 2.04 -0.98 0.70 117.51 121.12 1jzs h ILE 107 Ca -0.08 -0.10 -0.11 0.00 1.00 0.00 0.00 64.86 65.58 1jzs h ILE 107 Cb 0.66 -0.02 -0.01 0.00 -0.74 0.00 0.00 36.82 36.71 1jzs h ILE 107 CO 0.13 0.05 -0.14 -0.33 0.00 0.00 0.00 178.15 177.86 1jzs h GLU 108 N 0.28 0.87 -0.63 2.37 4.39 -0.52 -2.33 114.58 119.01 1jzs h GLU 108 Ca 0.70 -0.35 -0.07 0.00 0.34 0.00 0.00 59.36 59.97 1jzs h GLU 108 Cb 1.56 -0.04 -0.03 0.00 -0.10 0.00 0.00 28.75 30.14 1jzs h GLU 108 CO -0.63 0.99 0.10 0.00 -1.16 0.00 0.00 179.01 178.32 1jzs h ALA 109 N 0.85 1.00 0.00 3.43 0.00 0.32 -1.87 119.26 122.99 1jzs h ALA 109 Ca 0.11 -0.26 -0.04 0.00 0.00 0.00 0.00 54.91 54.72 1jzs h ALA 109 Cb 0.69 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 1jzs h ALA 109 CO 0.05 0.64 -0.21 -0.92 0.00 0.00 0.00 179.25 178.81 1jzs h TYR 110 N 0.96 0.00 0.00 0.00 3.20 -0.29 -3.48 116.97 117.36 1jzs h TYR 110 Ca 0.19 0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.06 1jzs h TYR 110 Cb 0.41 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.68 1jzs h TYR 110 CO 0.03 0.21 0.00 0.41 -1.64 0.00 0.00 178.16 177.16 1jzs n GLY 111 N -0.81 3.02 0.18 1.82 0.00 -0.70 -4.76 105.19 103.94 1jzs n GLY 111 Ca -0.02 -1.36 -0.12 0.00 0.00 0.00 0.00 46.02 44.52 1jzs n GLY 111 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1jzs h ILE 112 N 0.00 0.71 -0.49 -0.61 2.04 -1.76 0.51 117.51 117.91 1jzs h ILE 112 Ca 0.00 -0.78 0.14 0.00 1.00 0.00 0.00 64.86 65.22 1jzs h ILE 112 Cb 0.00 1.09 -0.02 0.00 -0.74 0.00 0.00 36.82 37.15 1jzs h ILE 112 CO 0.00 0.15 0.35 -0.08 0.00 0.00 0.00 178.15 178.57 1jzs h GLU 113 N -0.82 0.01 -0.00 2.37 4.81 -1.96 0.14 114.58 119.14 1jzs h GLU 113 Ca -0.04 -0.00 -0.06 0.00 -0.13 0.00 0.00 59.36 59.13 1jzs h GLU 113 Cb 0.51 -0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.90 1jzs h GLU 113 CO 0.06 0.00 -0.24 0.00 -0.73 0.00 0.00 179.01 178.10 1jzs h ARG 114 N 0.01 0.17 -0.25 1.92 2.47 -1.84 -3.04 114.38 113.82 1jzs h ARG 114 Ca 0.23 -0.18 0.00 0.00 -1.26 0.00 0.00 59.98 58.77 1jzs h ARG 114 Cb 0.92 0.05 -0.01 0.00 -1.65 0.00 0.00 29.97 29.28 1jzs h ARG 114 CO -0.00 0.92 0.16 0.35 0.56 0.00 0.00 179.97 181.95 1jzs h PHE 115 N -0.51 0.32 -0.34 3.04 3.57 0.61 -2.83 116.94 120.80 1jzs h PHE 115 Ca -0.03 0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.49 1jzs h PHE 115 Cb 1.00 -0.11 -0.02 0.00 2.79 0.00 0.00 35.95 39.61 1jzs h PHE 115 CO 0.18 0.22 0.20 -0.91 -2.23 0.00 0.00 178.31 175.77 1jzs h ASN 116 N 0.33 0.32 -0.85 0.41 2.35 -0.91 -2.28 115.58 114.95 1jzs h ASN 116 Ca 0.09 0.00 0.18 0.00 -0.55 0.00 0.00 56.30 56.02 1jzs h ASN 116 Cb -0.02 -0.06 -0.06 0.00 0.05 0.00 0.00 38.32 38.23 1jzs h ASN 116 CO -0.02 0.23 0.56 -0.61 -1.65 0.00 0.00 177.43 175.95 1jzs h GLN 117 N 0.41 0.43 0.00 0.81 4.15 -1.39 0.45 115.11 119.96 1jzs h GLN 117 Ca 0.14 -0.03 -0.11 0.00 0.77 0.00 0.00 58.65 59.42 1jzs h GLN 117 Cb 0.01 -0.10 -0.02 0.00 0.21 0.00 0.00 27.48 27.58 1jzs h GLN 117 CO -0.07 0.28 -0.54 0.00 -1.93 0.00 0.00 178.83 176.58 1jzs h ALA 118 N 1.62 0.84 -0.09 3.38 0.00 -1.18 -2.33 119.26 121.49 1jzs h ALA 118 Ca 0.43 -0.49 -0.11 0.00 0.00 0.00 0.00 54.91 54.75 1jzs h ALA 118 Cb 1.01 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.72 1jzs h ALA 118 CO -0.16 0.67 -0.36 0.00 0.00 0.00 0.00 179.25 179.40 1jzs h ARG 120 N -0.04 0.28 -0.35 0.00 2.43 -0.55 -2.63 114.38 113.53 1jzs h ARG 120 Ca -0.02 -0.02 -0.15 0.00 -0.81 0.00 0.00 59.98 58.99 1jzs h ARG 120 Cb 1.00 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 30.48 1jzs h ARG 120 CO 0.08 0.18 -0.37 0.93 -1.51 0.00 0.00 179.97 179.28 1jzs h GLU 121 N 0.29 0.82 0.00 0.20 5.08 -1.43 -3.28 114.58 116.26 1jzs h GLU 121 Ca 0.27 -0.42 -0.00 0.00 -1.00 0.00 0.00 59.36 58.21 1jzs h GLU 121 Cb 0.35 0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.61 1jzs h GLU 121 CO -0.32 1.05 -0.01 0.66 -1.00 0.00 0.00 179.01 179.39 1jzs h SER 122 N 0.68 0.00 0.48 1.42 4.64 -1.04 -3.15 113.55 116.57 1jzs h SER 122 Ca 0.06 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 61.25 1jzs h SER 122 Cb 0.93 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.01 1jzs h SER 122 CO 0.09 0.01 -0.59 -0.37 -0.87 0.00 0.00 176.83 175.09 1jzs h VAL 123 N 0.00 1.41 -0.18 0.95 -1.51 -1.60 -3.26 116.25 112.05 1jzs h VAL 123 Ca -0.00 -2.00 0.00 0.00 -1.23 0.00 0.00 66.70 63.47 1jzs h VAL 123 Cb 0.02 2.04 0.00 0.00 -2.13 0.00 0.00 31.29 31.22 1jzs h VAL 123 CO 0.00 0.58 0.00 0.49 -1.23 0.00 0.00 177.57 177.41 1jzs n PHE 124 N -3.86 0.21 0.05 5.19 0.99 -1.19 -2.67 117.46 116.18 1jzs n PHE 124 Ca -0.02 -0.12 0.02 0.00 -0.00 0.00 0.00 57.45 57.33 1jzs n PHE 124 Cb 0.60 -0.00 0.12 0.00 -1.00 0.00 0.00 39.48 39.20 1jzs n PHE 124 CO 0.00 0.00 0.00 0.25 -0.00 0.00 0.00 176.76 177.01 1jzs n THR 125 N 1.20 1.17 -1.06 4.37 -2.24 -1.22 -0.58 114.28 115.91 1jzs n THR 125 Ca 0.14 0.57 0.04 0.00 -2.27 0.00 0.00 64.05 62.53 1jzs n THR 125 Cb 0.53 -1.57 0.05 0.00 -2.10 0.00 0.00 70.33 67.24 1jzs n THR 125 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 1jzs n TYR 126 N -1.56 0.00 -0.26 4.78 4.02 -0.69 -4.86 117.16 118.58 1jzs n TYR 126 Ca -0.00 -0.49 0.00 0.00 -0.01 0.00 0.00 57.90 57.40 1jzs n TYR 126 Cb 0.19 -0.08 0.07 0.00 -0.02 0.00 0.00 39.34 39.50 1jzs n TYR 126 CO 0.00 0.00 0.00 1.49 -1.01 0.00 0.00 176.86 177.34 1jzs h GLU 127 N 0.00 -0.03 -0.17 -0.72 4.81 -1.03 -1.27 114.58 116.17 1jzs h GLU 127 Ca 0.00 0.00 -0.08 0.00 -0.13 0.00 0.00 59.36 59.15 1jzs h GLU 127 Cb 0.99 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 30.37 1jzs h GLU 127 CO 0.00 -0.02 -0.26 0.87 -0.73 0.00 0.00 179.01 178.87 1jzs h LYS 128 N -0.03 0.32 0.00 1.92 6.56 -1.89 0.46 116.57 123.91 1jzs h LYS 128 Ca 0.34 -0.11 -0.06 0.00 -1.06 0.00 0.00 60.65 59.76 1jzs h LYS 128 Cb 0.56 -0.02 -0.01 0.00 -0.57 0.00 0.00 32.23 32.19 1jzs h LYS 128 CO -0.78 0.56 -0.30 1.05 -2.06 0.00 0.00 179.45 177.92 1jzs h GLU 129 N 0.29 0.00 0.20 3.15 9.09 -1.67 -2.79 114.58 122.84 1jzs h GLU 129 Ca 0.04 0.00 -0.01 0.00 0.05 0.00 0.00 59.36 59.44 1jzs h GLU 129 Cb 0.62 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.72 1jzs h GLU 129 CO 0.04 0.30 -0.09 -1.49 0.05 0.00 0.00 179.01 177.82 1jzs h TRP 130 N 0.00 -0.24 -0.81 2.06 4.06 -0.53 -2.52 115.95 117.97 1jzs h TRP 130 Ca -0.00 -0.01 0.23 0.00 2.06 0.00 0.00 58.89 61.17 1jzs h TRP 130 Cb 0.97 0.08 -0.03 0.00 -1.00 0.00 0.00 29.16 29.17 1jzs h TRP 130 CO 0.00 0.16 0.58 1.49 -3.56 0.00 0.00 178.44 177.11 1jzs h GLU 131 N -0.83 0.03 0.00 0.49 4.81 -0.91 0.21 114.58 118.38 1jzs h GLU 131 Ca -0.03 -0.00 -0.19 0.00 -0.13 0.00 0.00 59.36 59.01 1jzs h GLU 131 Cb 0.52 -0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.86 1jzs h GLU 131 CO 0.04 0.02 -1.10 0.00 -0.73 0.00 0.00 179.01 177.25 1jzs h ALA 132 N 1.60 0.57 0.10 2.92 0.00 -1.48 -3.14 119.26 119.83 1jzs h ALA 132 Ca 0.39 -0.90 -0.26 0.00 0.00 0.00 0.00 54.91 54.13 1jzs h ALA 132 Cb 1.51 0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.37 1jzs h ALA 132 CO -0.02 1.11 -1.17 0.35 0.00 0.00 0.00 179.25 179.52 1jzs h PHE 133 N 0.00 0.52 -0.29 0.00 3.04 -0.67 -2.48 116.94 117.05 1jzs h PHE 133 Ca -0.09 -0.35 0.03 0.00 3.98 0.00 0.00 57.97 61.54 1jzs h PHE 133 Cb 1.69 -0.03 -0.03 0.00 2.56 0.00 0.00 35.95 40.14 1jzs h PHE 133 CO 0.00 1.25 0.10 1.15 -2.02 0.00 0.00 178.31 178.78 1jzs h THR 134 N 0.11 0.91 -0.08 4.41 2.02 -1.11 -3.07 112.91 116.11 1jzs h THR 134 Ca -0.12 -0.08 -0.15 0.00 0.77 0.00 0.00 66.41 66.83 1jzs h THR 134 Cb 1.87 0.67 0.01 0.00 -1.74 0.00 0.00 68.15 68.96 1jzs h THR 134 CO 0.19 0.04 -0.54 -0.33 0.37 0.00 0.00 175.52 175.25 1jzs h GLU 135 N 0.22 0.50 -0.54 6.66 5.08 -1.59 -2.25 114.58 122.66 1jzs h GLU 135 Ca 0.13 -0.44 0.09 0.00 -1.00 0.00 0.00 59.36 58.14 1jzs h GLU 135 Cb 0.11 0.10 -0.03 0.00 0.50 0.00 0.00 28.75 29.42 1jzs h GLU 135 CO -0.14 1.07 0.36 -0.09 -1.00 0.00 0.00 179.01 179.22 1jzs h ARG 136 N 0.08 0.36 -0.23 2.33 9.65 -1.43 -0.95 114.38 124.19 1jzs h ARG 136 Ca -0.05 -0.02 0.00 0.00 -1.10 0.00 0.00 59.98 58.81 1jzs h ARG 136 Cb 1.20 -0.08 0.00 0.00 -1.39 0.00 0.00 29.97 29.70 1jzs h ARG 136 CO 0.11 0.24 0.00 0.44 2.80 0.00 0.00 179.97 183.56 1jzs n ILE 137 N -4.47 0.29 -3.16 1.20 -5.35 -1.16 -4.72 119.36 101.99 1jzs n ILE 137 Ca 0.08 -0.42 -0.15 0.00 -0.27 0.00 0.00 62.75 61.99 1jzs n ILE 137 Cb 0.34 0.42 0.06 0.00 -1.74 0.00 0.00 39.64 38.72 1jzs n ILE 137 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1jzs n ALA 138 N 0.50 -1.12 -3.20 -1.28 0.00 -0.36 -4.96 120.51 110.10 1jzs n ALA 138 Ca 0.16 0.16 -0.45 0.00 0.00 0.00 0.00 53.44 53.30 1jzs n ALA 138 Cb 0.36 -3.17 -0.01 0.00 0.00 0.00 0.00 19.45 16.63 1jzs n ALA 138 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 1jzs s TYR 139 N -3.24 3.79 -0.32 0.00 5.04 -0.85 -4.99 117.35 116.79 1jzs s TYR 139 Ca 0.25 -2.17 -0.28 0.00 -2.44 0.00 0.00 57.07 52.43 1jzs s TYR 139 Cb -0.11 -3.99 -0.03 0.00 0.35 0.00 0.00 41.96 38.18 1jzs s TYR 139 CO 0.51 -1.13 1.90 -1.58 -1.34 0.00 0.00 175.55 173.91 1jzs s TRP 140 N 0.32 1.66 0.08 4.97 0.51 -1.26 -4.73 118.94 120.49 1jzs s TRP 140 Ca 0.29 0.64 -0.25 0.00 -2.12 0.00 0.00 56.10 54.66 1jzs s TRP 140 Cb -0.08 -4.07 0.07 0.00 -0.81 0.00 0.00 33.47 28.57 1jzs s TRP 140 CO -0.07 -3.13 0.60 0.54 -0.51 0.00 0.00 176.95 174.38 1jzs s VAL 141 N 7.40 0.01 0.56 4.03 0.11 -1.26 -4.80 120.40 126.44 1jzs s VAL 141 Ca 0.84 -0.06 -0.17 0.00 -2.93 0.00 0.00 61.98 59.66 1jzs s VAL 141 Cb -0.24 -1.00 -0.05 0.00 -1.53 0.00 0.00 36.38 33.56 1jzs s VAL 141 CO 0.33 -0.04 1.04 -1.81 -3.33 0.00 0.00 175.10 171.29 1jzs s ASP 142 N -2.16 6.06 0.00 3.54 -0.00 -1.01 -4.97 116.67 118.13 1jzs s ASP 142 Ca -0.03 1.78 0.00 0.00 -0.00 0.00 0.00 52.55 54.30 1jzs s ASP 142 Cb -0.01 -2.53 0.00 0.00 -0.00 0.00 0.00 42.92 40.38 1jzs s ASP 142 CO -0.04 -0.97 0.00 0.18 -0.00 0.00 0.00 175.17 174.33 1jzs n LEU 143 N -1.75 0.00 0.32 1.23 4.77 -1.26 -3.62 117.00 116.69 1jzs n LEU 143 Ca 0.08 0.00 0.19 0.00 -0.03 0.00 0.00 56.01 56.25 1jzs n LEU 143 Cb 0.53 0.00 1.05 0.00 -2.33 0.00 0.00 43.42 42.67 1jzs n LEU 143 CO 0.46 0.00 1.15 1.05 -1.33 0.00 0.00 177.39 178.71 1jzs h GLU 144 N 0.00 0.00 -0.11 3.23 4.11 -1.99 -2.28 114.58 117.54 1jzs h GLU 144 Ca 0.00 0.00 -0.11 0.00 0.07 0.00 0.00 59.36 59.32 1jzs h GLU 144 Cb 0.20 0.00 -0.13 0.00 0.50 0.00 0.00 28.75 29.33 1jzs h GLU 144 CO 0.00 0.01 -0.64 -0.40 0.07 0.00 0.00 179.01 178.04 1jzs n ASP 145 N -3.46 2.02 -4.77 3.06 5.75 -1.26 -5.06 116.55 112.83 1jzs n ASP 145 Ca -0.03 -3.54 -0.41 0.00 -0.01 0.00 0.00 54.79 50.80 1jzs n ASP 145 Cb 0.09 -0.47 -0.01 0.00 -1.03 0.00 0.00 41.12 39.70 1jzs n ASP 145 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1jzs s ALA 146 N -2.81 3.58 0.48 2.12 0.00 -0.86 -4.85 121.76 119.42 1jzs s ALA 146 Ca 0.39 1.46 -0.14 0.00 0.00 0.00 0.00 51.96 53.67 1jzs s ALA 146 Cb 0.38 -3.57 -0.07 0.00 0.00 0.00 0.00 23.12 19.86 1jzs s ALA 146 CO -0.07 -0.90 0.90 1.52 0.00 0.00 0.00 175.76 177.21 1jzs s TYR 147 N -0.87 3.47 -0.03 0.00 -0.85 -0.22 -4.88 117.35 113.98 1jzs s TYR 147 Ca 0.54 1.28 -0.00 0.00 -0.52 0.00 0.00 57.07 58.36 1jzs s TYR 147 Cb -0.44 -2.64 0.03 0.00 0.38 0.00 0.00 41.96 39.28 1jzs s TYR 147 CO 0.56 -0.28 0.03 0.00 -1.52 0.00 0.00 175.55 174.34 1jzs s ALA 148 N -2.56 0.22 -0.86 9.51 0.00 -1.26 0.13 121.76 126.94 1jzs s ALA 148 Ca 0.55 0.22 0.08 0.00 0.00 0.00 0.00 51.96 52.81 1jzs s ALA 148 Cb -0.10 -0.39 0.38 0.00 0.00 0.00 0.00 23.12 23.01 1jzs s ALA 148 CO 0.33 -0.21 1.25 0.25 0.00 0.00 0.00 175.76 177.38 1jzs n THR 149 N 4.49 1.55 1.16 0.00 -2.24 -0.99 -1.67 114.28 116.58 1jzs n THR 149 Ca -0.21 0.45 0.13 0.00 -2.27 0.00 0.00 64.05 62.16 1jzs n THR 149 Cb 0.50 -1.39 0.45 0.00 -2.10 0.00 0.00 70.33 67.79 1jzs n THR 149 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1jzs n LEU 150 N -1.65 0.48 -4.76 3.22 -0.00 -1.26 -4.59 117.00 108.43 1jzs n LEU 150 Ca 0.01 0.06 -0.41 0.00 -0.00 0.00 0.00 56.01 55.67 1jzs n LEU 150 Cb 0.06 -0.26 -0.02 0.00 -0.00 0.00 0.00 43.42 43.20 1jzs n LEU 150 CO 0.06 0.10 1.03 -1.61 -0.00 0.00 0.00 177.39 176.97 1jzs s GLU 151 N -2.76 4.32 0.58 1.47 2.02 -0.67 -4.92 118.70 118.75 1jzs s GLU 151 Ca 0.19 2.23 0.28 0.00 0.02 0.00 0.00 54.97 57.69 1jzs s GLU 151 Cb 0.19 -3.10 1.54 0.00 0.10 0.00 0.00 34.13 32.86 1jzs s GLU 151 CO 0.57 -0.29 1.98 -1.35 0.02 0.00 0.00 175.26 176.19 1jzs h PRO 152 N 4.27 0.00 0.18 0.39 0.11 -1.91 -2.18 132.00 132.86 1jzs h PRO 152 Ca -0.47 0.00 -0.35 0.00 0.11 0.00 0.00 66.00 65.29 1jzs h PRO 152 Cb 1.22 0.00 0.01 0.00 0.11 0.00 0.00 31.00 32.34 1jzs h PRO 152 CO 0.72 0.00 -1.73 1.79 -0.21 0.00 0.00 178.00 178.56 1jzs h THR 153 N 0.00 0.96 -0.49 -1.15 1.35 -1.95 -2.58 112.91 109.05 1jzs h THR 153 Ca 0.17 -2.54 0.01 0.00 -0.55 0.00 0.00 66.41 63.49 1jzs h THR 153 Cb 0.90 2.76 -0.02 0.00 -1.73 0.00 0.00 68.15 70.05 1jzs h THR 153 CO -0.00 0.85 0.32 0.22 -0.25 0.00 0.00 175.52 176.66 1jzs h TYR 154 N 0.10 0.61 0.01 4.73 3.20 -1.61 -1.54 116.97 122.47 1jzs h TYR 154 Ca -0.33 0.01 -0.20 0.00 3.14 0.00 0.00 58.73 61.35 1jzs h TYR 154 Cb 2.09 -0.21 -0.03 0.00 1.54 0.00 0.00 36.73 40.13 1jzs h TYR 154 CO 0.10 0.39 -0.94 0.82 -1.64 0.00 0.00 178.16 176.89 1jzs h ILE 155 N 0.66 1.65 0.00 1.81 2.04 -1.52 -2.71 117.51 119.44 1jzs h ILE 155 Ca 0.18 -3.14 -0.14 0.00 1.00 0.00 0.00 64.86 62.77 1jzs h ILE 155 Cb -0.07 2.71 -0.02 0.00 -0.74 0.00 0.00 36.82 38.70 1jzs h ILE 155 CO -0.04 0.90 -0.64 -0.08 0.00 0.00 0.00 178.15 178.28 1jzs h GLU 156 N 0.01 0.00 -0.02 2.37 4.81 -0.92 -0.20 114.58 120.62 1jzs h GLU 156 Ca -0.02 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.21 1jzs h GLU 156 Cb 1.64 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 31.02 1jzs h GLU 156 CO 0.12 0.64 -0.01 0.77 -0.73 0.00 0.00 179.01 179.81 1jzs h SER 157 N 0.00 0.05 -0.71 1.04 0.02 -1.28 -0.95 113.55 111.72 1jzs h SER 157 Ca -0.01 -0.42 0.11 0.00 -0.84 0.00 0.00 61.79 60.64 1jzs h SER 157 Cb 1.16 -0.01 -0.08 0.00 0.14 0.00 0.00 62.40 63.60 1jzs h SER 157 CO 0.08 0.46 0.30 0.40 -1.14 0.00 0.00 176.83 176.93 1jzs h ILE 158 N -0.36 0.74 -0.52 3.27 2.04 -1.34 0.51 117.51 121.85 1jzs h ILE 158 Ca 0.01 -0.17 0.05 0.00 1.00 0.00 0.00 64.86 65.74 1jzs h ILE 158 Cb 0.44 0.21 -0.03 0.00 -0.74 0.00 0.00 36.82 36.70 1jzs h ILE 158 CO 0.00 0.09 0.35 -0.50 0.00 0.00 0.00 178.15 178.09 1jzs h TRP 159 N 0.49 0.53 -0.03 1.37 4.06 -0.74 -0.76 115.95 120.87 1jzs h TRP 159 Ca 0.37 0.01 -0.00 0.00 2.06 0.00 0.00 58.89 61.33 1jzs h TRP 159 Cb 0.49 -0.18 -0.00 0.00 -1.00 0.00 0.00 29.16 28.47 1jzs h TRP 159 CO -0.15 0.30 0.01 2.35 -3.56 0.00 0.00 178.44 177.39 1jzs h TRP 160 N 0.54 0.05 -0.42 0.49 7.01 0.14 -2.58 115.95 121.17 1jzs h TRP 160 Ca 0.22 -0.01 -0.01 0.00 2.11 0.00 0.00 58.89 61.20 1jzs h TRP 160 Cb 0.19 -0.01 -0.02 0.00 -2.10 0.00 0.00 29.16 27.22 1jzs h TRP 160 CO -0.00 0.23 0.22 0.66 -2.79 0.00 0.00 178.44 176.76 1jzs h SER 161 N -0.14 0.51 0.69 2.65 4.64 -0.13 -1.90 113.55 119.87 1jzs h SER 161 Ca 0.01 -0.03 -0.18 0.00 -0.47 0.00 0.00 61.79 61.12 1jzs h SER 161 Cb 0.20 -0.13 -0.02 0.00 -0.31 0.00 0.00 62.40 62.14 1jzs h SER 161 CO -0.00 0.43 -0.83 -0.07 -0.87 0.00 0.00 176.83 175.49 1jzs h LEU 162 N 0.58 0.12 -0.77 5.97 3.38 -1.11 -1.92 115.31 121.57 1jzs h LEU 162 Ca 0.15 -0.10 -0.13 0.00 0.09 0.00 0.00 57.88 57.89 1jzs h LEU 162 Cb 0.04 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 40.73 1jzs h LEU 162 CO -0.02 0.89 -0.59 0.50 0.09 0.00 0.00 178.44 179.31 1jzs h LYS 163 N 0.05 0.10 0.00 1.13 3.64 -1.16 0.46 116.57 120.79 1jzs h LYS 163 Ca -0.02 -0.07 0.00 0.00 -1.27 0.00 0.00 60.65 59.29 1jzs h LYS 163 Cb 1.44 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 33.27 1jzs h LYS 163 CO 0.12 0.66 0.00 -1.71 -2.27 0.00 0.00 179.45 176.24 1jzs n ASN 164 N -3.86 0.00 -0.29 4.20 5.15 -0.74 0.12 115.26 119.83 1jzs n ASN 164 Ca -0.02 0.87 0.12 0.00 -0.60 0.00 0.00 54.58 54.96 1jzs n ASN 164 Cb 0.59 -0.37 0.28 0.00 -0.53 0.00 0.00 39.78 39.75 1jzs n ASN 164 CO 0.00 0.00 0.00 -0.07 1.40 0.00 0.00 177.26 178.59 1jzs h LEU 165 N 0.00 0.04 -0.39 1.20 3.38 -1.33 -0.16 115.31 118.05 1jzs h LEU 165 Ca 0.00 0.19 -0.03 0.00 0.09 0.00 0.00 57.88 58.13 1jzs h LEU 165 Cb 0.00 0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.98 1jzs h LEU 165 CO 0.00 -0.13 0.14 0.15 0.09 0.00 0.00 178.44 178.69 1jzs h PHE 166 N 0.24 0.62 0.00 1.13 3.57 -0.72 0.27 116.94 122.05 1jzs h PHE 166 Ca 0.54 -0.06 0.00 0.00 3.53 0.00 0.00 57.97 61.98 1jzs h PHE 166 Cb 1.07 -0.18 0.00 0.00 2.79 0.00 0.00 35.95 39.63 1jzs h PHE 166 CO -0.25 0.57 0.00 -0.44 -2.23 0.00 0.00 178.31 175.96 1jzs h ASP 167 N 0.49 0.00 0.35 0.41 3.32 0.13 -2.24 116.42 118.89 1jzs h ASP 167 Ca 0.13 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.18 1jzs h ASP 167 Cb 0.23 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.78 1jzs h ASP 167 CO -0.01 0.00 -0.47 0.54 -1.72 0.00 0.00 179.24 177.58 1jzs n ARG 168 N -3.05 0.30 -1.96 3.56 1.74 -0.27 -4.96 116.66 112.03 1jzs n ARG 168 Ca 0.01 -0.19 -0.01 0.00 -0.77 0.00 0.00 57.85 56.89 1jzs n ARG 168 Cb 0.34 -1.50 -0.00 0.00 -1.02 0.00 0.00 32.46 30.28 1jzs n ARG 168 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1jzs n GLY 169 N 1.45 0.33 0.61 -0.13 0.00 -0.41 -4.95 105.19 102.10 1jzs n GLY 169 Ca 0.08 -0.86 0.07 0.00 0.00 0.00 0.00 46.02 45.31 1jzs n GLY 169 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1jzs n LEU 170 N -0.15 2.39 -3.93 0.99 4.77 0.81 -4.83 117.00 117.05 1jzs n LEU 170 Ca -0.01 -1.23 -0.30 0.00 -0.03 0.00 0.00 56.01 54.44 1jzs n LEU 170 Cb 0.48 -0.07 -0.16 0.00 -2.33 0.00 0.00 43.42 41.35 1jzs n LEU 170 CO 0.01 0.49 -0.42 -0.22 -1.33 0.00 0.00 177.39 175.92 1jzs s LEU 171 N -1.12 2.55 0.18 2.23 2.96 -1.18 -0.79 118.68 123.51 1jzs s LEU 171 Ca 0.19 -1.18 0.06 0.00 -0.22 0.00 0.00 54.13 52.98 1jzs s LEU 171 Cb 0.12 -1.17 -0.05 0.00 0.50 0.00 0.00 46.19 45.60 1jzs s LEU 171 CO 0.18 -0.24 -0.11 -0.72 -1.32 0.00 0.00 176.35 174.14 1jzs s TYR 172 N 1.40 1.50 -0.13 5.38 -0.85 -0.71 -4.69 117.35 119.26 1jzs s TYR 172 Ca -0.06 -0.68 -0.04 0.00 -0.52 0.00 0.00 57.07 55.77 1jzs s TYR 172 Cb -0.19 -0.74 -0.03 0.00 0.38 0.00 0.00 41.96 41.38 1jzs s TYR 172 CO -0.06 0.21 0.02 0.50 -1.52 0.00 0.00 175.55 174.69 1jzs s ARG 173 N -3.71 3.47 0.27 -3.49 3.52 -1.26 -0.18 118.95 117.58 1jzs s ARG 173 Ca 0.20 -0.40 -0.12 0.00 -0.13 0.00 0.00 55.73 55.28 1jzs s ARG 173 Cb 0.01 -2.97 0.00 0.00 -1.56 0.00 0.00 34.95 30.44 1jzs s ARG 173 CO 0.04 0.46 0.50 0.34 -0.81 0.00 0.00 175.30 175.84 1jzs s ASP 174 N -0.21 0.02 -0.45 -2.12 2.15 -0.32 -5.01 116.67 110.73 1jzs s ASP 174 Ca 0.06 -0.99 0.03 0.00 0.43 0.00 0.00 52.55 52.07 1jzs s ASP 174 Cb -0.12 0.61 0.13 0.00 -0.30 0.00 0.00 42.92 43.24 1jzs s ASP 174 CO 0.02 -1.20 0.21 -2.28 -0.17 0.00 0.00 175.17 171.76 1jzs s HIS 175 N -3.81 2.55 0.29 -5.34 5.65 -1.26 -1.15 115.29 112.21 1jzs s HIS 175 Ca 0.23 -2.69 0.03 0.00 0.25 0.00 0.00 55.06 52.87 1jzs s HIS 175 Cb -0.01 -2.30 -0.01 0.00 -1.18 0.00 0.00 32.58 29.08 1jzs s HIS 175 CO 0.10 -0.79 0.09 1.63 -0.65 0.00 0.00 174.74 175.12 1jzs n LYS 176 N 3.57 0.73 -3.37 2.88 5.02 -1.22 -4.79 118.16 120.98 1jzs n LYS 176 Ca 0.06 -2.39 -0.41 0.00 -2.02 0.00 0.00 58.31 53.54 1jzs n LYS 176 Cb 0.35 1.24 -0.09 0.00 -0.02 0.00 0.00 35.03 36.51 1jzs n LYS 176 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1jzs s VAL 177 N -2.57 5.14 0.31 -0.18 1.01 -1.26 -1.66 120.40 121.19 1jzs s VAL 177 Ca 0.13 0.03 0.07 0.00 0.00 0.00 0.00 61.98 62.20 1jzs s VAL 177 Cb 0.01 -3.87 -0.06 0.00 0.00 0.00 0.00 36.38 32.45 1jzs s VAL 177 CO 0.09 -0.15 -0.05 0.68 0.00 0.00 0.00 175.10 175.67 1jzs s VAL 178 N 2.08 1.76 0.29 2.92 -7.23 0.57 -4.80 120.40 115.98 1jzs s VAL 178 Ca 0.13 -2.12 -0.29 0.00 -1.81 0.00 0.00 61.98 57.88 1jzs s VAL 178 Cb -0.16 -2.57 -0.10 0.00 0.56 0.00 0.00 36.38 34.10 1jzs s VAL 178 CO 0.12 -0.22 1.22 -2.84 -0.31 0.00 0.00 175.10 173.07 1jzs s PRO 179 N -3.72 4.48 -0.00 4.82 0.02 -1.26 -1.13 135.00 138.21 1jzs s PRO 179 Ca 0.31 2.02 0.01 0.00 0.02 0.00 0.00 61.00 63.37 1jzs s PRO 179 Cb 0.04 -3.14 -0.00 0.00 0.02 0.00 0.00 34.50 31.42 1jzs s PRO 179 CO 0.14 -0.03 -0.05 -0.47 -0.33 0.00 0.00 177.00 176.26 1jzs s TYR 180 N -0.97 0.43 -0.27 6.54 5.04 -0.79 -1.40 117.35 125.94 1jzs s TYR 180 Ca 0.48 -0.09 -0.09 0.00 -2.44 0.00 0.00 57.07 54.93 1jzs s TYR 180 Cb -0.36 -0.27 -0.03 0.00 0.35 0.00 0.00 41.96 41.64 1jzs s TYR 180 CO 0.46 -0.01 0.13 0.00 -1.34 0.00 0.00 175.55 174.79 1jzs h PRO 182 N 8.30 0.10 0.06 0.00 0.13 -1.86 0.13 132.00 138.86 1jzs h PRO 182 Ca -0.36 -0.05 -0.21 0.00 -0.87 0.00 0.00 66.00 64.51 1jzs h PRO 182 Cb 1.18 0.00 0.02 0.00 0.13 0.00 0.00 31.00 32.33 1jzs h PRO 182 CO 0.57 0.54 -0.84 0.07 -0.23 0.00 0.00 178.00 178.11 1jzs h ARG 183 N 0.08 0.47 0.00 0.86 0.11 -1.90 -3.26 114.38 110.74 1jzs h ARG 183 Ca 0.00 -0.58 -0.17 0.00 0.10 0.00 0.00 59.98 59.34 1jzs h ARG 183 Cb 0.84 0.18 -0.02 0.00 1.11 0.00 0.00 29.97 32.08 1jzs h ARG 183 CO 0.06 1.22 -0.79 0.00 0.10 0.00 0.00 179.97 180.56 1jzs n GLY 185 N 0.85 0.68 3.30 0.00 0.00 0.42 -4.85 105.19 105.59 1jzs n GLY 185 Ca -0.00 -0.52 -0.13 0.00 0.00 0.00 0.00 46.02 45.36 1jzs n GLY 185 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1jzs s THR 186 N -3.05 0.05 1.05 2.61 -1.32 -1.09 -4.51 115.64 109.38 1jzs s THR 186 Ca 0.08 -0.45 -0.13 0.00 -1.21 0.00 0.00 61.69 59.98 1jzs s THR 186 Cb -0.04 -0.85 0.21 0.00 -1.51 0.00 0.00 72.50 70.32 1jzs s THR 186 CO 0.11 -0.25 1.09 -2.84 -2.21 0.00 0.00 174.62 170.52 1jzs s PRO 187 N -1.99 0.02 0.00 7.08 0.02 -1.26 -2.15 135.00 136.72 1jzs s PRO 187 Ca -0.08 0.45 0.00 0.00 0.02 0.00 0.00 61.00 61.39 1jzs s PRO 187 Cb -0.02 -1.70 0.00 0.00 0.02 0.00 0.00 34.50 32.80 1jzs s PRO 187 CO 0.01 -2.99 0.00 1.28 -0.33 0.00 0.00 177.00 174.97 1jzs n LEU 188 N -4.35 0.00 -4.32 -5.54 4.77 -0.49 -4.84 117.00 102.23 1jzs n LEU 188 Ca 0.05 0.00 -0.17 0.00 -0.03 0.00 0.00 56.01 55.86 1jzs n LEU 188 Cb 0.57 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.56 1jzs n LEU 188 CO 0.56 0.00 -0.42 -0.94 -1.33 0.00 0.00 177.39 175.26 1jzs s SER 189 N -0.56 2.35 0.12 -1.43 1.04 -1.26 -4.61 113.70 109.34 1jzs s SER 189 Ca 0.00 -1.03 -0.32 0.00 0.48 0.00 0.00 55.95 55.08 1jzs s SER 189 Cb 0.00 -0.10 -0.10 0.00 0.10 0.00 0.00 66.02 65.92 1jzs s SER 189 CO 0.00 -0.23 1.57 0.28 0.98 0.00 0.00 173.24 175.84 1jzs h SER 190 N 2.60 -1.42 -0.79 7.02 0.02 -1.93 0.25 113.55 119.30 1jzs h SER 190 Ca -0.38 0.16 0.15 0.00 -0.84 0.00 0.00 61.79 60.89 1jzs h SER 190 Cb 1.21 0.54 -0.10 0.00 0.14 0.00 0.00 62.40 64.20 1jzs h SER 190 CO 0.63 -0.49 0.33 1.12 -1.14 0.00 0.00 176.83 177.27 1jzs h HIS 191 N -0.63 0.56 -0.17 3.45 -0.00 -1.97 0.19 115.15 116.58 1jzs h HIS 191 Ca 0.03 0.04 -0.01 0.00 -0.00 0.00 0.00 60.37 60.43 1jzs h HIS 191 Cb 0.69 -0.13 -0.01 0.00 -0.00 0.00 0.00 27.41 27.96 1jzs h HIS 191 CO -0.45 0.06 0.08 0.93 -0.00 0.00 0.00 177.93 178.54 1jzs h GLU 192 N 0.46 0.25 -0.89 5.12 5.08 -1.57 -2.61 114.58 120.42 1jzs h GLU 192 Ca 0.44 -0.04 0.13 0.00 -1.00 0.00 0.00 59.36 58.89 1jzs h GLU 192 Cb 0.69 -0.04 -0.09 0.00 0.50 0.00 0.00 28.75 29.81 1jzs h GLU 192 CO -0.42 0.31 0.51 0.28 -1.00 0.00 0.00 179.01 178.69 1jzs h VAL 193 N 0.13 0.83 0.00 3.13 2.07 0.17 -0.06 116.25 122.52 1jzs h VAL 193 Ca 0.06 -0.26 -0.02 0.00 0.82 0.00 0.00 66.70 67.29 1jzs h VAL 193 Cb 0.15 -0.01 -0.00 0.00 -1.52 0.00 0.00 31.29 29.90 1jzs h VAL 193 CO -0.01 0.14 -0.10 0.00 0.02 0.00 0.00 177.57 177.62 1jzs h ALA 194 N 1.53 1.39 0.00 1.67 0.00 -0.38 -1.88 119.26 121.59 1jzs h ALA 194 Ca 0.46 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.27 1jzs h ALA 194 Cb 0.54 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.32 1jzs h ALA 194 CO -0.31 0.13 -0.15 -0.07 0.00 0.00 0.00 179.25 178.85 1jzs h LEU 195 N 0.00 0.00 -4.33 0.00 -0.00 -0.72 -3.38 115.31 106.89 1jzs h LEU 195 Ca -0.00 -0.05 -0.60 0.00 -0.00 0.00 0.00 57.88 57.24 1jzs h LEU 195 Cb 0.27 0.00 -0.41 0.00 -0.00 0.00 0.00 40.66 40.52 1jzs h LEU 195 CO 0.01 0.02 -0.56 0.61 -0.00 0.00 0.00 178.44 178.53 1jzs n GLY 196 N 1.29 6.08 3.75 0.83 0.00 -0.70 -4.88 105.19 111.56 1jzs n GLY 196 Ca 0.05 -2.70 -0.39 0.00 0.00 0.00 0.00 46.02 42.98 1jzs n GLY 196 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1jzs s TYR 197 N -3.61 3.64 0.04 1.61 2.02 -1.26 -0.10 117.35 119.70 1jzs s TYR 197 Ca 0.50 1.14 -0.05 0.00 -0.37 0.00 0.00 57.07 58.28 1jzs s TYR 197 Cb 0.41 -2.60 -0.01 0.00 -0.40 0.00 0.00 41.96 39.36 1jzs s TYR 197 CO -0.14 0.31 0.09 0.21 -1.57 0.00 0.00 175.55 174.45 1jzs s LYS 198 N 0.01 0.58 -0.19 -0.62 2.20 0.18 -4.92 119.74 116.97 1jzs s LYS 198 Ca 0.30 -0.74 -0.29 0.00 -0.36 0.00 0.00 55.97 54.88 1jzs s LYS 198 Cb -0.17 0.22 -0.00 0.00 -1.51 0.00 0.00 37.83 36.37 1jzs s LYS 198 CO 0.16 -0.14 1.17 -2.00 -0.36 0.00 0.00 175.35 174.18 1jzs s GLU 199 N -2.55 4.25 0.22 4.03 2.12 -1.26 0.17 118.70 125.68 1jzs s GLU 199 Ca -0.05 1.54 0.08 0.00 0.36 0.00 0.00 54.97 56.89 1jzs s GLU 199 Cb -0.02 -3.71 -0.05 0.00 0.26 0.00 0.00 34.13 30.62 1jzs s GLU 199 CO -0.04 -0.67 -0.15 -1.50 -0.54 0.00 0.00 175.26 172.36 1jzs s ILE 200 N 3.34 1.82 -0.22 -3.70 2.07 0.12 -4.90 121.20 119.73 1jzs s ILE 200 Ca 0.50 -2.23 -0.04 0.00 -1.41 0.00 0.00 60.65 57.47 1jzs s ILE 200 Cb -0.19 -2.10 -0.01 0.00 0.13 0.00 0.00 42.46 40.29 1jzs s ILE 200 CO 0.11 -0.56 -0.04 -1.58 -1.91 0.00 0.00 174.94 170.97 1jzs s GLN 201 N -3.63 3.40 0.36 3.50 0.74 -1.26 -2.18 119.66 120.58 1jzs s GLN 201 Ca 0.24 -0.61 0.09 0.00 0.05 0.00 0.00 55.36 55.12 1jzs s GLN 201 Cb -0.01 -3.02 -0.07 0.00 1.10 0.00 0.00 33.01 31.02 1jzs s GLN 201 CO 0.08 -0.18 -0.07 -0.51 -0.55 0.00 0.00 175.29 174.06 1jzs s ASP 202 N 1.43 3.79 -0.16 6.67 1.01 0.19 -4.97 116.67 124.63 1jzs s ASP 202 Ca 0.05 -1.22 -0.24 0.00 0.71 0.00 0.00 52.55 51.86 1jzs s ASP 202 Cb -0.14 -0.37 -0.02 0.00 1.01 0.00 0.00 42.92 43.40 1jzs s ASP 202 CO -0.03 -0.25 0.76 -2.16 0.21 0.00 0.00 175.17 173.71 1jzs s PRO 203 N -3.63 4.29 -0.39 8.23 0.04 -1.26 -0.25 135.00 142.03 1jzs s PRO 203 Ca 0.33 0.90 -0.16 0.00 0.04 0.00 0.00 61.00 62.11 1jzs s PRO 203 Cb 0.04 -3.56 0.01 0.00 0.04 0.00 0.00 34.50 31.03 1jzs s PRO 203 CO 0.17 -0.26 0.35 0.45 0.04 0.00 0.00 177.00 177.75 1jzs s SER 204 N 1.13 6.15 0.06 6.66 0.15 0.43 -4.09 113.70 124.18 1jzs s SER 204 Ca 0.36 -0.64 0.03 0.00 0.70 0.00 0.00 55.95 56.40 1jzs s SER 204 Cb -0.16 -2.19 -0.03 0.00 -1.71 0.00 0.00 66.02 61.93 1jzs s SER 204 CO 0.13 -0.45 -0.10 0.68 1.20 0.00 0.00 173.24 174.70 1jzs s VAL 205 N 1.91 0.75 -0.25 4.45 -7.23 -1.00 0.81 120.40 119.84 1jzs s VAL 205 Ca 0.09 -1.27 -0.04 0.00 -1.81 0.00 0.00 61.98 58.96 1jzs s VAL 205 Cb -0.18 -0.90 0.01 0.00 0.56 0.00 0.00 36.38 35.88 1jzs s VAL 205 CO 0.12 -0.40 -0.03 -0.31 -0.31 0.00 0.00 175.10 174.17 1jzs s TYR 206 N -1.64 3.04 -0.23 2.82 1.51 0.94 -2.24 117.35 121.56 1jzs s TYR 206 Ca -0.05 -1.20 -0.00 0.00 -1.01 0.00 0.00 57.07 54.81 1jzs s TYR 206 Cb -0.08 -2.12 0.03 0.00 -0.11 0.00 0.00 41.96 39.68 1jzs s TYR 206 CO 0.01 -0.63 -0.11 0.08 -1.11 0.00 0.00 175.55 173.78 1jzs s VAL 207 N 1.42 2.56 0.13 0.71 1.01 0.35 0.16 120.40 126.73 1jzs s VAL 207 Ca 0.03 -1.04 -0.30 0.00 0.00 0.00 0.00 61.98 60.67 1jzs s VAL 207 Cb -0.16 -2.25 -0.07 0.00 0.00 0.00 0.00 36.38 33.90 1jzs s VAL 207 CO -0.03 0.29 1.17 0.00 0.00 0.00 0.00 175.10 176.54 1jzs s ARG 208 N 1.29 4.49 -0.44 2.72 1.70 -0.81 -2.08 118.95 125.82 1jzs s ARG 208 Ca 0.01 1.79 -0.06 0.00 -0.47 0.00 0.00 55.73 57.00 1jzs s ARG 208 Cb -0.16 -3.29 0.12 0.00 -0.57 0.00 0.00 34.95 31.04 1jzs s ARG 208 CO -0.07 -0.12 0.27 -0.06 -1.08 0.00 0.00 175.30 174.24 1jzs s PHE 209 N 0.38 3.52 0.23 5.89 0.40 0.34 -4.89 117.98 123.84 1jzs s PHE 209 Ca 0.54 -2.19 -0.32 0.00 -0.60 0.00 0.00 56.93 54.37 1jzs s PHE 209 Cb -0.30 -3.35 -0.13 0.00 0.51 0.00 0.00 43.02 39.75 1jzs s PHE 209 CO 0.33 -0.98 1.58 -2.30 0.70 0.00 0.00 175.22 174.55 1jzs n PRO 210 N 4.71 2.45 -2.77 0.24 -0.02 -1.26 0.08 135.00 138.43 1jzs n PRO 210 Ca -0.04 0.88 -0.36 0.00 -2.02 0.00 0.00 63.50 61.96 1jzs n PRO 210 Cb 0.41 -2.65 -0.06 0.00 -0.02 0.00 0.00 33.50 31.18 1jzs n PRO 210 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1jzs s LEU 211 N 0.39 4.18 0.12 2.45 2.01 -0.93 -1.48 118.68 125.43 1jzs s LEU 211 Ca 0.71 1.81 0.17 0.00 0.01 0.00 0.00 54.13 56.83 1jzs s LEU 211 Cb -0.57 -4.21 -0.08 0.00 0.01 0.00 0.00 46.19 41.33 1jzs s LEU 211 CO 0.42 -0.21 0.96 0.11 1.01 0.00 0.00 176.35 178.64 1jzs h LYS 212 N 2.68 0.00 -2.10 1.70 1.57 -1.86 -3.39 116.57 115.16 1jzs h LYS 212 Ca -0.48 0.00 -0.57 0.00 -1.87 0.00 0.00 60.65 57.73 1jzs h LYS 212 Cb 1.19 0.00 -0.41 0.00 0.08 0.00 0.00 32.23 33.09 1jzs h LYS 212 CO 0.63 0.29 -0.87 0.39 -0.57 0.00 0.00 179.45 179.33 1jzs n GLU 213 N -2.93 1.69 0.07 3.15 -0.58 -1.26 -4.90 120.64 115.88 1jzs n GLU 213 Ca -0.07 -3.96 0.07 0.00 -0.42 0.00 0.00 57.16 52.79 1jzs n GLU 213 Cb 0.79 -1.77 0.34 0.00 -0.57 0.00 0.00 31.44 30.23 1jzs n GLU 213 CO 0.00 0.00 0.00 -0.35 -0.48 0.00 0.00 177.13 176.30 1jzs n PRO 214 N 0.93 0.08 0.33 3.49 -0.04 -1.26 -3.13 135.00 135.39 1jzs n PRO 214 Ca 0.26 0.44 -0.15 0.00 -0.04 0.00 0.00 63.50 64.01 1jzs n PRO 214 Cb 0.48 -1.69 -0.08 0.00 -0.04 0.00 0.00 33.50 32.17 1jzs n PRO 214 CO 0.00 0.00 0.00 0.87 -0.04 0.00 0.00 175.50 176.33 1jzs h LYS 215 N 0.00 -0.82 -0.52 0.54 1.57 -1.84 -2.20 116.57 113.31 1jzs h LYS 215 Ca 0.00 0.06 0.15 0.00 -1.87 0.00 0.00 60.65 58.99 1jzs h LYS 215 Cb 0.16 0.19 -0.02 0.00 0.08 0.00 0.00 32.23 32.64 1jzs h LYS 215 CO 0.00 -0.50 0.95 0.87 -0.57 0.00 0.00 179.45 180.20 1jzs h LYS 216 N -1.09 0.00 -0.57 3.15 6.56 -1.86 1.24 116.57 124.01 1jzs h LYS 216 Ca -0.09 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.50 1jzs h LYS 216 Cb 0.69 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.35 1jzs h LYS 216 CO 0.14 0.00 0.00 1.28 -2.06 0.00 0.00 179.45 178.81 1jzs n LEU 217 N -3.04 5.29 -2.25 2.94 7.99 -1.18 -4.93 117.00 121.83 1jzs n LEU 217 Ca 0.11 -2.80 -0.19 0.00 -0.01 0.00 0.00 56.01 53.12 1jzs n LEU 217 Cb 1.12 -0.64 -0.00 0.00 -0.11 0.00 0.00 43.42 43.78 1jzs n LEU 217 CO 0.16 0.69 -0.22 0.61 -1.51 0.00 0.00 177.39 177.11 1jzs n GLY 218 N 0.65 -0.42 3.29 -0.72 0.00 0.43 -4.99 105.19 103.42 1jzs n GLY 218 Ca 0.27 -0.07 -0.23 0.00 0.00 0.00 0.00 46.02 45.99 1jzs n GLY 218 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1jzs s LEU 219 N -5.58 2.33 -0.14 0.99 1.43 -0.83 -5.04 118.68 111.84 1jzs s LEU 219 Ca 0.03 -0.72 -0.24 0.00 -1.03 0.00 0.00 54.13 52.17 1jzs s LEU 219 Cb -0.01 -0.84 -0.25 0.00 0.03 0.00 0.00 46.19 45.12 1jzs s LEU 219 CO 0.03 0.02 0.60 -0.08 0.23 0.00 0.00 176.35 177.15 1jzs h GLU 220 N 3.90 0.08 -2.04 1.70 4.57 -1.93 -3.13 114.58 117.72 1jzs h GLU 220 Ca -0.45 -0.13 -0.20 0.00 -1.18 0.00 0.00 59.36 57.40 1jzs h GLU 220 Cb 1.19 0.05 -0.31 0.00 -0.16 0.00 0.00 28.75 29.51 1jzs h GLU 220 CO 0.42 1.06 -0.53 0.21 -1.18 0.00 0.00 179.01 179.00 1jzs s LYS 221 N -2.33 0.32 0.12 1.92 2.47 -1.26 -4.76 119.74 116.22 1jzs s LYS 221 Ca -0.21 0.38 0.04 0.00 -1.56 0.00 0.00 55.97 54.61 1jzs s LYS 221 Cb 0.01 -0.64 -0.04 0.00 -1.46 0.00 0.00 37.83 35.70 1jzs s LYS 221 CO 0.69 -0.71 -0.10 0.00 0.16 0.00 0.00 175.35 175.40 1jzs s ALA 222 N 2.48 1.23 0.00 3.13 0.00 -1.26 0.44 121.76 127.78 1jzs s ALA 222 Ca 0.11 -1.34 -0.01 0.00 0.00 0.00 0.00 51.96 50.72 1jzs s ALA 222 Cb -0.15 0.06 -0.00 0.00 0.00 0.00 0.00 23.12 23.02 1jzs s ALA 222 CO -0.17 -0.09 0.01 -1.12 0.00 0.00 0.00 175.76 174.39 1jzs s SER 223 N -2.84 0.06 0.18 0.00 0.01 -0.20 -2.19 113.70 108.72 1jzs s SER 223 Ca 0.11 -0.12 -0.30 0.00 1.31 0.00 0.00 55.95 56.95 1jzs s SER 223 Cb 0.01 0.07 -0.08 0.00 0.21 0.00 0.00 66.02 66.23 1jzs s SER 223 CO -0.01 -0.11 1.05 -0.76 0.41 0.00 0.00 173.24 173.83 1jzs s LEU 224 N -0.48 4.52 -0.28 2.44 1.43 0.11 -1.37 118.68 125.05 1jzs s LEU 224 Ca -0.05 2.03 -0.11 0.00 -1.03 0.00 0.00 54.13 54.98 1jzs s LEU 224 Cb -0.03 -3.60 -0.05 0.00 0.03 0.00 0.00 46.19 42.54 1jzs s LEU 224 CO -0.00 -0.14 0.18 -0.22 0.23 0.00 0.00 176.35 176.40 1jzs s LEU 225 N -0.50 3.96 0.13 1.79 0.20 -0.95 0.13 118.68 123.45 1jzs s LEU 225 Ca 0.47 -0.04 0.08 0.00 0.69 0.00 0.00 54.13 55.33 1jzs s LEU 225 Cb -0.28 -2.10 -0.04 0.00 -0.43 0.00 0.00 46.19 43.34 1jzs s LEU 225 CO 0.34 -0.05 -0.10 -0.63 -0.29 0.00 0.00 176.35 175.62 1jzs s ILE 226 N 1.74 3.26 0.11 6.68 -1.09 -0.88 -4.47 121.20 126.55 1jzs s ILE 226 Ca 0.07 -1.44 0.08 0.00 -2.23 0.00 0.00 60.65 57.13 1jzs s ILE 226 Cb -0.16 -2.56 -0.04 0.00 -1.58 0.00 0.00 42.46 38.13 1jzs s ILE 226 CO 0.10 0.02 -0.20 -1.66 -1.23 0.00 0.00 174.94 171.97 1jzs s TRP 227 N -1.39 1.78 -0.07 3.97 1.48 -1.26 -0.50 118.94 122.95 1jzs s TRP 227 Ca 0.22 -0.43 -0.30 0.00 -1.06 0.00 0.00 56.10 54.53 1jzs s TRP 227 Cb -0.10 -0.96 0.12 0.00 -1.16 0.00 0.00 33.47 31.36 1jzs s TRP 227 CO 0.14 0.23 0.98 -0.08 -4.06 0.00 0.00 176.95 174.16 1jzs s THR 228 N -1.35 0.00 -0.44 0.66 -1.32 -0.95 -4.65 115.64 107.60 1jzs s THR 228 Ca 0.08 0.00 0.09 0.00 -1.21 0.00 0.00 61.69 60.65 1jzs s THR 228 Cb -0.09 -1.00 -0.10 0.00 -1.51 0.00 0.00 72.50 69.80 1jzs s THR 228 CO 0.05 0.00 0.40 0.35 -2.21 0.00 0.00 174.62 173.20 1jzs n THR 229 N -0.03 0.00 -3.53 5.08 -2.24 -1.26 -2.37 114.28 109.94 1jzs n THR 229 Ca -0.07 -0.28 -0.30 0.00 -2.27 0.00 0.00 64.05 61.13 1jzs n THR 229 Cb 0.60 1.00 -0.08 0.00 -2.10 0.00 0.00 70.33 69.75 1jzs n THR 229 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1jzs n THR 230 N -1.22 2.62 -0.28 4.28 -2.24 -1.26 -4.14 114.28 112.04 1jzs n THR 230 Ca 0.02 -5.20 0.31 0.00 -2.27 0.00 0.00 64.05 56.90 1jzs n THR 230 Cb 0.15 -2.16 0.70 0.00 -2.10 0.00 0.00 70.33 66.91 1jzs n THR 230 CO 0.00 0.00 0.00 -0.65 -0.57 0.00 0.00 175.07 173.85 1jzs h PRO 231 N 4.88 0.08 0.00 -0.78 0.11 -1.89 -0.91 132.00 133.49 1jzs h PRO 231 Ca 0.18 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.29 1jzs h PRO 231 Cb 0.70 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 31.79 1jzs h PRO 231 CO 0.87 0.05 0.00 -2.67 -0.21 0.00 0.00 178.00 176.04 1jzs n TRP 232 N -4.29 0.75 0.27 0.65 4.27 -1.26 -2.25 117.44 115.58 1jzs n TRP 232 Ca 0.23 0.32 0.12 0.00 -3.89 0.00 0.00 57.50 54.28 1jzs n TRP 232 Cb 1.09 -1.02 0.07 0.00 -1.36 0.00 0.00 31.31 30.08 1jzs n TRP 232 CO 0.00 0.00 0.00 1.79 -2.29 0.00 0.00 177.69 177.19 1jzs h THR 233 N 0.00 0.00 -0.85 -1.67 1.35 -1.56 -3.38 112.91 106.80 1jzs h THR 233 Ca 0.00 -0.83 0.21 0.00 -0.55 0.00 0.00 66.41 65.24 1jzs h THR 233 Cb 0.25 1.39 -0.13 0.00 -1.73 0.00 0.00 68.15 67.93 1jzs h THR 233 CO 0.00 0.00 0.28 -0.07 -0.25 0.00 0.00 175.52 175.48 1jzs h LEU 234 N 0.00 0.12 -1.52 3.87 3.38 -1.60 1.05 115.31 120.62 1jzs h LEU 234 Ca 0.00 0.17 0.00 0.00 0.09 0.00 0.00 57.88 58.14 1jzs h LEU 234 Cb 0.92 0.20 0.00 0.00 0.09 0.00 0.00 40.66 41.87 1jzs h LEU 234 CO 0.00 -0.08 0.07 -0.65 0.09 0.00 0.00 178.44 177.87 1jzs h PRO 235 N 0.29 0.00 -0.57 1.13 0.11 -1.79 -0.33 132.00 130.84 1jzs h PRO 235 Ca 0.53 0.00 -0.08 0.00 0.11 0.00 0.00 66.00 66.55 1jzs h PRO 235 Cb 1.01 0.00 -0.05 0.00 0.11 0.00 0.00 31.00 32.07 1jzs h PRO 235 CO -0.58 0.00 0.09 0.41 -0.21 0.00 0.00 178.00 177.71 1jzs n GLY 236 N -1.27 3.50 3.78 -0.55 0.00 0.36 -4.93 105.19 106.08 1jzs n GLY 236 Ca -0.02 -0.99 -0.35 0.00 0.00 0.00 0.00 46.02 44.67 1jzs n GLY 236 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1jzs s ASN 237 N -1.15 5.75 0.00 1.61 2.47 -0.14 -4.31 114.94 119.17 1jzs s ASN 237 Ca 0.52 2.15 0.00 0.00 0.42 0.00 0.00 52.86 55.96 1jzs s ASN 237 Cb 0.41 -2.58 0.00 0.00 -1.45 0.00 0.00 41.25 37.63 1jzs s ASN 237 CO 0.13 -1.20 0.00 1.33 -3.72 0.00 0.00 177.10 173.64 1jzs n VAL 238 N -1.31 0.00 -3.80 -5.21 0.24 -0.82 -4.97 118.33 102.46 1jzs n VAL 238 Ca 0.11 0.00 -0.04 0.00 -2.04 0.00 0.00 64.34 62.37 1jzs n VAL 238 Cb 0.51 0.51 -0.00 0.00 -1.47 0.00 0.00 33.84 33.39 1jzs n VAL 238 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1jzs s ALA 239 N 0.00 -1.52 0.01 2.33 0.00 -1.21 -0.15 121.76 121.21 1jzs s ALA 239 Ca 0.00 -0.10 0.02 0.00 0.00 0.00 0.00 51.96 51.89 1jzs s ALA 239 Cb 0.00 0.69 -0.01 0.00 0.00 0.00 0.00 23.12 23.80 1jzs s ALA 239 CO 0.00 -1.04 -0.08 0.00 0.00 0.00 0.00 175.76 174.64 1jzs s ALA 240 N -3.00 0.63 -0.02 0.00 0.00 -1.15 -1.67 121.76 116.56 1jzs s ALA 240 Ca 0.15 -0.45 0.06 0.00 0.00 0.00 0.00 51.96 51.72 1jzs s ALA 240 Cb -0.02 -0.11 -0.02 0.00 0.00 0.00 0.00 23.12 22.97 1jzs s ALA 240 CO 0.04 0.11 -0.20 0.00 0.00 0.00 0.00 175.76 175.72 1jzs s ALA 241 N -0.49 1.63 0.19 0.00 0.00 -0.14 -0.17 121.76 122.78 1jzs s ALA 241 Ca -0.00 -0.85 0.07 0.00 0.00 0.00 0.00 51.96 51.18 1jzs s ALA 241 Cb -0.05 -0.42 -0.05 0.00 0.00 0.00 0.00 23.12 22.61 1jzs s ALA 241 CO 0.00 0.40 -0.14 0.14 0.00 0.00 0.00 175.76 176.16 1jzs s VAL 242 N -0.46 1.64 0.18 0.00 -7.23 -1.08 -0.34 120.40 113.12 1jzs s VAL 242 Ca 0.08 -2.12 -0.30 0.00 -1.81 0.00 0.00 61.98 57.83 1jzs s VAL 242 Cb -0.08 -1.95 -0.08 0.00 0.56 0.00 0.00 36.38 34.83 1jzs s VAL 242 CO -0.01 -0.57 1.06 -2.28 -0.31 0.00 0.00 175.10 173.00 1jzs s HIS 243 N -2.85 3.66 0.56 2.82 2.46 -1.26 -2.85 115.29 117.84 1jzs s HIS 243 Ca 0.20 1.67 0.24 0.00 0.47 0.00 0.00 55.06 57.64 1jzs s HIS 243 Cb -0.01 -3.22 1.53 0.00 -0.13 0.00 0.00 32.58 30.75 1jzs s HIS 243 CO 0.06 -0.38 2.15 -1.00 -2.47 0.00 0.00 174.74 173.09 1jzs h PRO 244 N 4.96 0.00 -1.63 2.88 0.13 -1.87 -3.22 132.00 133.25 1jzs h PRO 244 Ca -0.44 0.00 -0.53 0.00 -0.87 0.00 0.00 66.00 64.16 1jzs h PRO 244 Cb 1.21 0.00 -0.41 0.00 0.13 0.00 0.00 31.00 31.93 1jzs h PRO 244 CO 0.71 0.00 -0.86 -0.85 -0.23 0.00 0.00 178.00 176.77 1jzs n GLU 245 N -4.16 2.62 -4.39 0.86 0.28 -1.26 0.96 120.64 115.55 1jzs n GLU 245 Ca -0.00 -4.19 -0.26 0.00 -0.16 0.00 0.00 57.16 52.54 1jzs n GLU 245 Cb 0.21 -1.97 -0.12 0.00 1.43 0.00 0.00 31.44 30.99 1jzs n GLU 245 CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 177.13 177.68 1jzs s TYR 246 N -3.32 2.18 -0.45 -1.84 4.12 -1.22 -4.88 117.35 111.95 1jzs s TYR 246 Ca 0.43 -0.39 -0.17 0.00 0.02 0.00 0.00 57.07 56.96 1jzs s TYR 246 Cb 0.38 -1.12 0.04 0.00 -1.52 0.00 0.00 41.96 39.74 1jzs s TYR 246 CO -0.12 0.40 0.45 0.95 0.02 0.00 0.00 175.55 177.25 1jzs s THR 247 N -1.48 5.11 -0.16 -0.71 -4.23 -1.26 -0.64 115.64 112.26 1jzs s THR 247 Ca 0.16 -0.63 -0.15 0.00 -1.18 0.00 0.00 61.69 59.89 1jzs s THR 247 Cb -0.08 -4.11 -0.04 0.00 1.34 0.00 0.00 72.50 69.61 1jzs s THR 247 CO 0.08 -0.53 0.36 -0.31 -0.54 0.00 0.00 174.62 173.68 1jzs s TYR 248 N 2.03 3.45 0.46 3.99 1.51 -0.00 -1.19 117.35 127.59 1jzs s TYR 248 Ca 0.09 0.67 0.01 0.00 -1.01 0.00 0.00 57.07 56.83 1jzs s TYR 248 Cb -0.20 -2.44 0.00 0.00 -0.11 0.00 0.00 41.96 39.21 1jzs s TYR 248 CO 0.11 0.15 0.67 0.00 -1.11 0.00 0.00 175.55 175.36 1jzs s ALA 249 N 0.75 3.84 -0.67 3.71 0.00 -0.96 -1.41 121.76 127.02 1jzs s ALA 249 Ca 0.19 -1.15 0.05 0.00 0.00 0.00 0.00 51.96 51.05 1jzs s ALA 249 Cb -0.14 -2.07 0.27 0.00 0.00 0.00 0.00 23.12 21.17 1jzs s ALA 249 CO 0.06 -0.40 0.84 0.00 0.00 0.00 0.00 175.76 176.26 1jzs n ALA 250 N -2.08 4.27 -1.26 0.00 0.00 -0.95 -2.18 120.51 118.31 1jzs n ALA 250 Ca 0.02 -4.77 -0.36 0.00 0.00 0.00 0.00 53.44 48.33 1jzs n ALA 250 Cb 0.58 -0.99 0.07 0.00 0.00 0.00 0.00 19.45 19.12 1jzs n ALA 250 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1jzs n PHE 251 N 0.71 -0.56 -4.05 0.00 3.01 -1.09 -2.92 117.46 112.57 1jzs n PHE 251 Ca 0.30 0.36 -0.33 0.00 1.01 0.00 0.00 57.45 58.78 1jzs n PHE 251 Cb 0.40 -1.94 -0.15 0.00 -0.01 0.00 0.00 39.48 37.78 1jzs n PHE 251 CO 0.00 0.00 0.00 -1.14 1.01 0.00 0.00 176.76 176.63 1jzs s GLN 252 N -2.89 2.78 -0.02 -1.08 -0.44 -1.13 -1.00 119.66 115.88 1jzs s GLN 252 Ca 0.67 -0.99 -0.02 0.00 -2.50 0.00 0.00 55.36 52.52 1jzs s GLN 252 Cb -0.34 -2.80 0.01 0.00 -1.64 0.00 0.00 33.01 28.24 1jzs s GLN 252 CO 0.57 -0.35 0.05 0.14 0.50 0.00 0.00 175.29 176.20 1jzs s VAL 253 N 1.27 -0.01 0.00 1.34 -7.23 -1.08 -4.71 120.40 109.98 1jzs s VAL 253 Ca 0.00 0.03 0.00 0.00 -1.81 0.00 0.00 61.98 60.20 1jzs s VAL 253 Cb -0.16 -0.09 0.00 0.00 0.56 0.00 0.00 36.38 36.70 1jzs s VAL 253 CO -0.08 0.01 0.00 0.61 -0.31 0.00 0.00 175.10 175.33 1jzs n GLY 254 N 3.21 3.21 1.36 2.32 0.00 -1.26 -2.51 105.19 111.52 1jzs n GLY 254 Ca -0.14 -0.20 0.10 0.00 0.00 0.00 0.00 46.02 45.78 1jzs n GLY 254 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1jzs n ASP 255 N 2.88 4.13 -4.01 1.61 9.92 -1.26 -4.98 116.55 124.84 1jzs n ASP 255 Ca 0.00 -2.15 -0.10 0.00 -0.53 0.00 0.00 54.79 52.01 1jzs n ASP 255 Cb 0.00 -0.50 -0.08 0.00 -0.64 0.00 0.00 41.12 39.91 1jzs n ASP 255 CO 0.00 0.00 0.00 -1.83 0.13 0.00 0.00 177.20 175.50 1jzs s GLU 256 N -1.29 1.14 0.03 -1.24 -1.05 -1.05 -4.77 118.70 110.48 1jzs s GLU 256 Ca 0.48 -1.25 -0.05 0.00 -0.15 0.00 0.00 54.97 54.00 1jzs s GLU 256 Cb 0.27 0.35 -0.05 0.00 -0.44 0.00 0.00 34.13 34.26 1jzs s GLU 256 CO 0.29 -0.40 0.26 0.00 0.95 0.00 0.00 175.26 176.36 1jzs s ALA 257 N -4.00 3.88 -0.34 -0.84 0.00 0.17 -2.64 121.76 117.99 1jzs s ALA 257 Ca 0.20 -0.64 -0.02 0.00 0.00 0.00 0.00 51.96 51.50 1jzs s ALA 257 Cb 0.04 -2.01 0.07 0.00 0.00 0.00 0.00 23.12 21.22 1jzs s ALA 257 CO 0.01 0.70 0.07 -0.51 0.00 0.00 0.00 175.76 176.03 1jzs s LEU 258 N -2.04 4.40 0.17 0.00 1.43 -0.17 -1.04 118.68 121.43 1jzs s LEU 258 Ca 0.31 -1.58 -0.30 0.00 -1.03 0.00 0.00 54.13 51.53 1jzs s LEU 258 Cb -0.13 -1.75 -0.07 0.00 0.03 0.00 0.00 46.19 44.27 1jzs s LEU 258 CO 0.20 -0.36 0.95 -0.63 0.23 0.00 0.00 176.35 176.73 1jzs s ILE 259 N 1.19 4.29 0.00 -0.59 1.01 -0.47 -2.66 121.20 123.97 1jzs s ILE 259 Ca 0.00 2.07 0.00 0.00 0.00 0.00 0.00 60.65 62.73 1jzs s ILE 259 Cb -0.21 -4.32 0.00 0.00 0.01 0.00 0.00 42.46 37.94 1jzs s ILE 259 CO -0.03 0.41 0.00 0.00 0.00 0.00 0.00 174.94 175.32 1jzs n LEU 260 N 2.14 0.00 -3.77 2.97 -0.00 -0.93 -2.24 117.00 115.18 1jzs n LEU 260 Ca 0.00 0.00 -0.50 0.00 -0.00 0.00 0.00 56.01 55.51 1jzs n LEU 260 Cb 0.48 0.00 -0.07 0.00 -0.00 0.00 0.00 43.42 43.83 1jzs n LEU 260 CO 0.50 0.00 0.51 1.21 -0.00 0.00 0.00 177.39 179.62 1jzs n GLU 261 N -0.23 0.00 -0.79 1.47 0.00 -0.66 -2.27 120.64 118.16 1jzs n GLU 261 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 57.16 56.86 1jzs n GLU 261 Cb 0.00 -1.25 0.17 0.00 0.00 0.00 0.00 31.44 30.36 1jzs n GLU 261 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.13 175.13 1jzs s GLU 262 N 0.19 0.83 0.00 5.31 2.12 -0.34 -1.13 118.70 125.69 1jzs s GLU 262 Ca 0.77 1.29 0.00 0.00 0.36 0.00 0.00 54.97 57.39 1jzs s GLU 262 Cb -1.07 -1.72 0.00 0.00 0.26 0.00 0.00 34.13 31.59 1jzs s GLU 262 CO 0.49 -2.68 0.00 0.41 -0.54 0.00 0.00 175.26 172.95 1jzs n GLY 263 N -0.00 0.85 0.19 -1.50 0.00 -1.26 -3.97 105.19 99.49 1jzs n GLY 263 Ca 0.09 -0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.15 1jzs n GLY 263 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1jzs h LEU 264 N 0.00 0.00 0.08 0.99 5.85 -1.90 -2.23 115.31 118.10 1jzs h LEU 264 Ca 0.00 0.00 -0.21 0.00 0.84 0.00 0.00 57.88 58.51 1jzs h LEU 264 Cb 0.00 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.02 1jzs h LEU 264 CO 0.00 0.39 -1.07 1.23 -0.34 0.00 0.00 178.44 178.65 1jzs h GLY 265 N 1.66 0.18 1.84 3.75 0.00 -1.25 -2.74 103.07 106.52 1jzs h GLY 265 Ca -0.00 -0.47 0.00 0.00 0.00 0.00 0.00 47.33 46.86 1jzs h GLY 265 CO 0.05 0.41 0.00 -0.96 0.00 0.00 0.00 176.54 176.04 1jzs n ARG 266 N -4.16 0.05 -0.12 4.80 1.85 -1.19 -0.81 116.66 117.08 1jzs n ARG 266 Ca -0.22 0.28 -0.16 0.00 -1.00 0.00 0.00 57.85 56.75 1jzs n ARG 266 Cb 0.78 -1.50 -0.13 0.00 -1.05 0.00 0.00 32.46 30.56 1jzs n ARG 266 CO 0.00 0.00 0.00 1.17 -0.01 0.00 0.00 177.63 178.79 1jzs n LYS 267 N -1.42 0.66 0.27 2.89 4.81 -0.85 -2.00 118.16 122.52 1jzs n LYS 267 Ca 0.03 0.11 -0.11 0.00 -0.87 0.00 0.00 58.31 57.48 1jzs n LYS 267 Cb 0.10 -1.51 -0.05 0.00 0.02 0.00 0.00 35.03 33.58 1jzs n LYS 267 CO 0.00 0.00 0.00 1.25 1.17 0.00 0.00 177.40 179.82 1jzs h LEU 268 N 0.00 -0.59 0.37 3.14 7.12 -1.02 -3.35 115.31 120.97 1jzs h LEU 268 Ca -0.57 0.02 -0.02 0.00 0.13 0.00 0.00 57.88 57.45 1jzs h LEU 268 Cb 1.97 0.15 0.00 0.00 -0.53 0.00 0.00 40.66 42.26 1jzs h LEU 268 CO -0.06 -0.36 -0.18 -0.07 -0.13 0.00 0.00 178.44 177.64 1jzs h LEU 269 N -0.83 -0.42 0.00 2.25 3.38 -1.21 -3.50 115.31 114.99 1jzs h LEU 269 Ca -0.07 -0.14 0.00 0.00 0.09 0.00 0.00 57.88 57.76 1jzs h LEU 269 Cb 0.53 0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.39 1jzs h LEU 269 CO 0.12 -0.03 0.00 0.61 0.09 0.00 0.00 178.44 179.22 1jzs n GLY 270 N -0.25 4.37 3.57 0.83 0.00 -1.09 -5.06 105.19 107.57 1jzs n GLY 270 Ca -0.10 -0.59 -0.41 0.00 0.00 0.00 0.00 46.02 44.92 1jzs n GLY 270 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1jzs n GLU 271 N -1.44 1.59 0.00 1.61 -0.58 -0.85 -3.92 120.64 117.04 1jzs n GLU 271 Ca 0.00 0.34 0.00 0.00 -0.42 0.00 0.00 57.16 57.08 1jzs n GLU 271 Cb 0.00 -3.24 0.00 0.00 -0.57 0.00 0.00 31.44 27.63 1jzs n GLU 271 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1jzs n GLY 272 N 5.91 0.12 3.57 0.62 0.00 -1.26 -5.14 105.19 109.02 1jzs n GLY 272 Ca 0.33 -0.72 -0.00 0.00 0.00 0.00 0.00 46.02 45.64 1jzs n GLY 272 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1jzs s THR 273 N 0.00 -0.99 0.28 2.61 2.01 -1.25 -5.14 115.64 113.15 1jzs s THR 273 Ca 0.00 0.00 -0.21 0.00 0.31 0.00 0.00 61.69 61.79 1jzs s THR 273 Cb 0.00 -1.00 -0.14 0.00 0.01 0.00 0.00 72.50 71.37 1jzs s THR 273 CO 0.00 0.00 0.24 0.00 -0.69 0.00 0.00 174.62 174.17 1jzs n GLN 274 N 5.44 0.00 -3.82 4.92 0.00 -1.26 -4.81 117.38 117.85 1jzs n GLN 274 Ca -0.10 0.00 -0.30 0.00 0.00 0.00 0.00 57.00 56.59 1jzs n GLN 274 Cb 0.49 -0.88 -0.15 0.00 0.00 0.00 0.00 30.24 29.71 1jzs n GLN 274 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.06 177.14 1jzs s VAL 275 N -1.22 1.35 0.15 -0.39 1.01 -1.26 -2.86 120.40 117.18 1jzs s VAL 275 Ca 0.54 -1.76 -0.18 0.00 0.00 0.00 0.00 61.98 60.57 1jzs s VAL 275 Cb -0.67 -2.01 0.02 0.00 0.00 0.00 0.00 36.38 33.72 1jzs s VAL 275 CO 0.53 -0.66 1.70 -0.07 0.00 0.00 0.00 175.10 176.59 1jzs h LEU 276 N 7.86 -0.16 0.00 3.92 3.38 -1.86 -3.47 115.31 124.98 1jzs h LEU 276 Ca -0.10 0.07 -0.09 0.00 0.09 0.00 0.00 57.88 57.85 1jzs h LEU 276 Cb 1.01 0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.87 1jzs h LEU 276 CO 0.49 -0.05 -0.07 0.29 0.09 0.00 0.00 178.44 179.20 1jzs n LYS 277 N -5.19 0.18 -3.63 1.13 5.02 -1.26 -5.01 118.16 109.40 1jzs n LYS 277 Ca -0.00 -0.83 -0.12 0.00 -2.02 0.00 0.00 58.31 55.34 1jzs n LYS 277 Cb 0.16 0.76 -0.07 0.00 -0.02 0.00 0.00 35.03 35.86 1jzs n LYS 277 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 1jzs s THR 278 N -2.49 0.00 0.16 -0.18 2.01 -1.26 -2.24 115.64 111.63 1jzs s THR 278 Ca 0.09 0.00 -0.19 0.00 0.31 0.00 0.00 61.69 61.90 1jzs s THR 278 Cb -0.00 -1.00 0.05 0.00 0.01 0.00 0.00 72.50 71.56 1jzs s THR 278 CO 0.06 0.00 0.51 0.72 -0.69 0.00 0.00 174.62 175.22 1jzs s PHE 279 N 0.20 -0.32 0.27 4.92 -0.00 -0.50 -4.98 117.98 117.57 1jzs s PHE 279 Ca 0.01 0.03 -0.29 0.00 -0.00 0.00 0.00 56.93 56.68 1jzs s PHE 279 Cb -0.05 0.41 -0.09 0.00 -0.00 0.00 0.00 43.02 43.29 1jzs s PHE 279 CO -0.02 -0.81 1.01 -1.25 -0.00 0.00 0.00 175.22 174.15 1jzs s PRO 280 N -3.80 4.72 0.20 1.99 0.04 -1.26 -0.82 135.00 136.07 1jzs s PRO 280 Ca 0.04 1.60 -0.16 0.00 0.04 0.00 0.00 61.00 62.51 1jzs s PRO 280 Cb 0.00 -3.17 0.20 0.00 0.04 0.00 0.00 34.50 31.57 1jzs s PRO 280 CO -0.10 0.35 1.60 0.78 0.04 0.00 0.00 177.00 179.67 1jzs h GLY 281 N 3.86 0.22 -0.00 0.56 0.00 -0.87 0.38 103.07 107.22 1jzs h GLY 281 Ca -0.46 0.32 0.18 0.00 0.00 0.00 0.00 47.33 47.37 1jzs h GLY 281 CO 0.67 -0.24 0.83 1.70 0.00 0.00 0.00 176.54 179.50 1jzs h LYS 282 N -0.08 0.00 -0.17 4.80 1.63 0.44 0.27 116.57 123.47 1jzs h LYS 282 Ca 0.28 0.00 -0.15 0.00 -0.85 0.00 0.00 60.65 59.94 1jzs h LYS 282 Cb 0.52 0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 32.14 1jzs h LYS 282 CO -0.69 0.00 -0.51 0.00 -3.45 0.00 0.00 179.45 174.81 1jzs h ALA 283 N 0.93 0.80 0.00 5.00 0.00 -0.50 -3.24 119.26 122.25 1jzs h ALA 283 Ca 0.29 -0.49 -0.02 0.00 0.00 0.00 0.00 54.91 54.69 1jzs h ALA 283 Cb 1.94 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 19.64 1jzs h ALA 283 CO -0.00 0.67 -0.10 -0.07 0.00 0.00 0.00 179.25 179.75 1jzs h LEU 284 N 0.37 0.00 -9.19 0.00 4.07 -0.53 -3.47 115.31 106.57 1jzs h LEU 284 Ca 0.01 0.00 -0.68 0.00 0.08 0.00 0.00 57.88 57.30 1jzs h LEU 284 Cb 1.02 0.00 0.08 0.00 1.08 0.00 0.00 40.66 42.84 1jzs h LEU 284 CO 0.09 0.10 0.01 1.21 -1.08 0.00 0.00 178.44 178.77 1jzs n GLU 285 N -3.21 0.64 0.00 1.13 2.13 -1.22 -1.37 120.64 118.74 1jzs n GLU 285 Ca 0.01 0.23 0.00 0.00 0.66 0.00 0.00 57.16 58.06 1jzs n GLU 285 Cb 0.40 -1.59 0.00 0.00 0.27 0.00 0.00 31.44 30.52 1jzs n GLU 285 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1jzs n GLY 286 N 1.84 2.78 3.61 8.31 0.00 -0.04 -4.93 105.19 116.76 1jzs n GLY 286 Ca 0.16 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.75 1jzs n GLY 286 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1jzs s LEU 287 N 0.00 3.59 0.47 0.99 1.43 -0.47 -4.46 118.68 120.23 1jzs s LEU 287 Ca 0.00 1.81 -0.22 0.00 -1.03 0.00 0.00 54.13 54.69 1jzs s LEU 287 Cb 0.00 -3.52 -0.07 0.00 0.03 0.00 0.00 46.19 42.63 1jzs s LEU 287 CO 0.00 -1.76 1.11 -2.16 0.23 0.00 0.00 176.35 173.78 1jzs s PRO 288 N 5.87 3.75 0.23 1.29 0.04 -1.26 0.26 135.00 145.18 1jzs s PRO 288 Ca 0.92 1.62 0.05 0.00 0.04 0.00 0.00 61.00 63.63 1jzs s PRO 288 Cb -0.31 -2.29 -0.02 0.00 0.04 0.00 0.00 34.50 31.93 1jzs s PRO 288 CO 0.35 -0.53 0.21 2.48 0.04 0.00 0.00 177.00 179.56 1jzs n TYR 289 N -0.68 -0.62 -4.00 0.56 0.18 -0.21 -3.17 117.16 109.22 1jzs n TYR 289 Ca 0.08 -1.91 -0.33 0.00 1.88 0.00 0.00 57.90 57.62 1jzs n TYR 289 Cb 0.50 0.22 -0.14 0.00 -0.38 0.00 0.00 39.34 39.53 1jzs n TYR 289 CO 0.00 0.00 0.00 0.99 -2.08 0.00 0.00 176.86 175.77 1jzs s THR 290 N -2.91 2.54 0.45 -3.48 2.01 -0.55 -4.83 115.64 108.88 1jzs s THR 290 Ca 0.27 -1.44 -0.20 0.00 0.31 0.00 0.00 61.69 60.63 1jzs s THR 290 Cb 0.01 -2.44 -0.10 0.00 0.01 0.00 0.00 72.50 69.98 1jzs s THR 290 CO 0.19 0.00 0.96 -2.16 -0.69 0.00 0.00 174.62 172.92 1jzs s PRO 291 N 1.19 4.14 0.55 4.92 0.04 -1.26 -4.20 135.00 140.38 1jzs s PRO 291 Ca -0.06 1.13 0.22 0.00 0.04 0.00 0.00 61.00 62.33 1jzs s PRO 291 Cb -0.19 -2.16 1.50 0.00 0.04 0.00 0.00 34.50 33.69 1jzs s PRO 291 CO -0.04 -0.11 2.18 -1.00 0.04 0.00 0.00 177.00 178.07 1jzs h PRO 292 N 1.75 0.00 -2.07 0.56 0.13 -1.94 -3.31 132.00 127.12 1jzs h PRO 292 Ca -0.49 0.00 -0.56 0.00 -0.87 0.00 0.00 66.00 64.08 1jzs h PRO 292 Cb 1.19 0.00 -0.40 0.00 0.13 0.00 0.00 31.00 31.91 1jzs h PRO 292 CO 0.61 0.00 -0.96 0.66 -0.23 0.00 0.00 178.00 178.08 1jzs n TYR 293 N -4.23 0.99 -1.51 1.56 4.02 -1.26 -5.11 117.16 111.61 1jzs n TYR 293 Ca -0.02 -3.77 -0.39 0.00 -0.01 0.00 0.00 57.90 53.71 1jzs n TYR 293 Cb 0.13 -0.42 0.04 0.00 -0.02 0.00 0.00 39.34 39.06 1jzs n TYR 293 CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 176.86 175.50 1jzs n PRO 294 N 1.05 0.67 -4.47 -0.72 -0.04 -1.25 -4.91 135.00 125.33 1jzs n PRO 294 Ca 0.24 0.26 -0.23 0.00 -0.04 0.00 0.00 63.50 63.73 1jzs n PRO 294 Cb 0.51 -1.82 -0.09 0.00 -0.04 0.00 0.00 33.50 32.06 1jzs n PRO 294 CO 0.00 0.00 0.00 -0.65 -0.04 0.00 0.00 175.50 174.81 1jzs s GLN 295 N -2.18 1.77 -1.20 0.54 -1.52 -1.26 -5.06 119.66 110.74 1jzs s GLN 295 Ca 0.69 -2.03 -0.20 0.00 -1.95 0.00 0.00 55.36 51.87 1jzs s GLN 295 Cb -0.46 -0.70 0.05 0.00 -0.22 0.00 0.00 33.01 31.68 1jzs s GLN 295 CO 0.53 -0.34 1.68 0.00 -0.25 0.00 0.00 175.29 176.92 1jzs s ALA 296 N -3.30 2.98 -0.05 6.09 0.00 -1.26 -4.95 121.76 121.27 1jzs s ALA 296 Ca 0.30 -2.64 -0.02 0.00 0.00 0.00 0.00 51.96 49.61 1jzs s ALA 296 Cb 0.06 -4.62 -0.04 0.00 0.00 0.00 0.00 23.12 18.52 1jzs s ALA 296 CO 0.15 -3.59 0.05 -0.51 0.00 0.00 0.00 175.76 171.86 1jzs s LEU 297 N 5.16 3.82 0.00 0.00 1.43 -1.26 -5.00 118.68 122.83 1jzs s LEU 297 Ca 0.53 0.18 0.27 0.00 -1.03 0.00 0.00 54.13 54.08 1jzs s LEU 297 Cb 0.02 -2.05 0.83 0.00 0.03 0.00 0.00 46.19 45.03 1jzs s LEU 297 CO 0.03 0.33 1.62 -1.84 0.23 0.00 0.00 176.35 176.73 1jzs n GLU 298 N 1.68 0.35 -3.63 1.70 0.00 -1.26 -4.90 120.64 114.58 1jzs n GLU 298 Ca -0.16 -0.17 -0.06 0.00 0.00 0.00 0.00 57.16 56.77 1jzs n GLU 298 Cb 0.53 -1.50 -0.06 0.00 0.00 0.00 0.00 31.44 30.42 1jzs n GLU 298 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.13 177.34 1jzs s LYS 299 N -2.76 0.28 0.00 3.44 2.20 -1.26 -5.13 119.74 116.50 1jzs s LYS 299 Ca 0.19 0.23 0.00 0.00 -0.36 0.00 0.00 55.97 56.02 1jzs s LYS 299 Cb 0.19 0.13 0.00 0.00 -1.51 0.00 0.00 37.83 36.64 1jzs s LYS 299 CO 0.58 -0.05 0.00 0.41 -0.36 0.00 0.00 175.35 175.93 1jzs n GLY 300 N 1.43 0.87 1.09 5.54 0.00 -1.26 -4.46 105.19 108.39 1jzs n GLY 300 Ca -0.09 -2.17 0.00 0.00 0.00 0.00 0.00 46.02 43.76 1jzs n GLY 300 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1jzs n TYR 301 N -0.45 0.00 -4.24 1.61 0.53 0.78 -4.99 117.16 110.40 1jzs n TYR 301 Ca 0.00 0.00 -0.29 0.00 -1.02 0.00 0.00 57.90 56.59 1jzs n TYR 301 Cb 0.00 -0.15 -0.04 0.00 -1.03 0.00 0.00 39.34 38.12 1jzs n TYR 301 CO 0.00 0.00 0.00 -0.59 -1.02 0.00 0.00 176.86 175.25 1jzs s PHE 302 N -2.00 1.82 0.34 -0.72 -0.71 -1.26 -1.05 117.98 114.40 1jzs s PHE 302 Ca 0.00 -0.86 -0.25 0.00 -1.04 0.00 0.00 56.93 54.78 1jzs s PHE 302 Cb 0.00 -1.80 -0.10 0.00 -1.21 0.00 0.00 43.02 39.91 1jzs s PHE 302 CO 0.00 -0.14 0.96 0.08 -1.34 0.00 0.00 175.22 174.78 1jzs s VAL 303 N -2.79 4.14 0.13 -2.49 1.01 0.14 -2.94 120.40 117.60 1jzs s VAL 303 Ca 0.24 1.72 0.04 0.00 0.00 0.00 0.00 61.98 63.97 1jzs s VAL 303 Cb -0.00 -3.93 -0.04 0.00 0.00 0.00 0.00 36.38 32.41 1jzs s VAL 303 CO 0.14 0.09 -0.09 -0.69 0.00 0.00 0.00 175.10 174.54 1jzs s VAL 304 N -1.66 1.05 -0.14 2.92 1.01 0.76 -0.86 120.40 123.47 1jzs s VAL 304 Ca 0.52 -1.98 -0.07 0.00 0.00 0.00 0.00 61.98 60.45 1jzs s VAL 304 Cb -0.18 -1.75 -0.04 0.00 0.00 0.00 0.00 36.38 34.40 1jzs s VAL 304 CO 0.24 -0.74 0.12 -0.76 0.00 0.00 0.00 175.10 173.95 1jzs s LEU 305 N -3.04 4.22 -0.25 3.92 1.43 -1.26 -2.62 118.68 121.07 1jzs s LEU 305 Ca 0.14 0.35 -0.16 0.00 -1.03 0.00 0.00 54.13 53.43 1jzs s LEU 305 Cb 0.02 -2.04 0.07 0.00 0.03 0.00 0.00 46.19 44.28 1jzs s LEU 305 CO -0.01 0.33 0.62 0.00 0.23 0.00 0.00 176.35 177.53 1jzs s ALA 306 N -0.56 -1.66 -2.12 4.21 0.00 -1.13 -4.97 121.76 115.54 1jzs s ALA 306 Ca 0.12 2.14 0.15 0.00 0.00 0.00 0.00 51.96 54.37 1jzs s ALA 306 Cb -0.12 -1.26 0.51 0.00 0.00 0.00 0.00 23.12 22.25 1jzs s ALA 306 CO 0.02 -0.34 1.39 -0.40 0.00 0.00 0.00 175.76 176.43 1jzs n ASP 307 N 4.05 1.75 0.05 0.00 5.75 -1.26 -3.92 116.55 122.98 1jzs n ASP 307 Ca -0.20 -1.86 0.12 0.00 -0.01 0.00 0.00 54.79 52.84 1jzs n ASP 307 Cb 0.58 -0.17 0.18 0.00 -1.03 0.00 0.00 41.12 40.67 1jzs n ASP 307 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1jzs n TYR 308 N 0.42 0.46 -1.68 2.11 4.11 -1.26 -4.90 117.16 116.41 1jzs n TYR 308 Ca 0.14 0.13 -0.43 0.00 -0.00 0.00 0.00 57.90 57.74 1jzs n TYR 308 Cb 0.31 -0.59 -0.03 0.00 -0.00 0.00 0.00 39.34 39.02 1jzs n TYR 308 CO 0.00 0.00 0.00 1.55 -0.00 0.00 0.00 176.86 178.41 1jzs n VAL 309 N -2.01 0.48 -0.04 -3.48 3.14 -1.25 -4.97 118.33 110.20 1jzs n VAL 309 Ca 0.04 -0.09 0.00 0.00 -2.96 0.00 0.00 64.34 61.33 1jzs n VAL 309 Cb 0.42 -2.12 0.00 0.00 -1.06 0.00 0.00 33.84 31.09 1jzs n VAL 309 CO 0.00 0.00 0.00 -0.24 -6.46 0.00 0.00 176.83 170.13 1jzs n SER 310 N 6.15 -1.65 0.00 6.55 2.88 -1.26 -4.84 113.62 121.44 1jzs n SER 310 Ca 0.19 -0.04 0.00 0.00 -1.33 0.00 0.00 58.87 57.69 1jzs n SER 310 Cb 0.37 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.83 1jzs n SER 310 CO 0.00 0.00 0.00 1.67 -1.23 0.00 0.00 175.04 175.48 1jzs n GLN 311 N -1.69 0.00 0.08 -1.46 7.27 -1.26 -4.76 117.38 115.56 1jzs n GLN 311 Ca 0.00 0.00 0.11 0.00 0.07 0.00 0.00 57.00 57.18 1jzs n GLN 311 Cb 0.00 0.00 -0.00 0.00 2.41 0.00 0.00 30.24 32.65 1jzs n GLN 311 CO 0.00 0.00 0.00 -1.91 0.07 0.00 0.00 177.06 175.22 1jzs n GLU 312 N 0.00 0.57 -3.77 3.69 0.00 -1.26 -4.91 120.64 114.96 1jzs n GLU 312 Ca 0.00 0.08 -0.08 0.00 0.00 0.00 0.00 57.16 57.16 1jzs n GLU 312 Cb 0.18 -1.77 -0.02 0.00 0.00 0.00 0.00 31.44 29.83 1jzs n GLU 312 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.13 177.29 1jzs s ASP 313 N -5.09 -0.32 0.00 4.31 1.47 -1.26 -5.12 116.67 110.66 1jzs s ASP 313 Ca -0.01 -0.49 0.00 0.00 1.18 0.00 0.00 52.55 53.23 1jzs s ASP 313 Cb 0.11 0.69 0.00 0.00 -0.34 0.00 0.00 42.92 43.38 1jzs s ASP 313 CO 0.80 -1.25 0.00 0.61 0.68 0.00 0.00 175.17 176.01 1jzs n GLY 314 N -0.44 0.38 0.00 2.12 0.00 -1.26 -4.48 105.19 101.51 1jzs n GLY 314 Ca -0.07 -1.22 0.00 0.00 0.00 0.00 0.00 46.02 44.73 1jzs n GLY 314 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1jzs n THR 315 N 0.00 0.00 0.00 2.61 -2.24 -1.26 -4.96 114.28 108.43 1jzs n THR 315 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 1jzs n THR 315 Cb 0.00 0.24 0.00 0.00 -2.10 0.00 0.00 70.33 68.47 1jzs n THR 315 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1jzs n GLY 316 N 2.11 1.88 3.42 3.38 0.00 -1.26 -1.65 105.19 113.07 1jzs n GLY 316 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 1jzs n GLY 316 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1jzs s ILE 317 N -2.11 2.81 -0.04 -0.61 1.01 -1.26 -4.31 121.20 116.69 1jzs s ILE 317 Ca 0.00 -0.81 0.06 0.00 0.00 0.00 0.00 60.65 59.91 1jzs s ILE 317 Cb 0.00 -2.09 -0.01 0.00 0.01 0.00 0.00 42.46 40.37 1jzs s ILE 317 CO 0.00 0.58 -0.23 -0.69 0.00 0.00 0.00 174.94 174.59 1jzs s VAL 318 N -0.50 1.89 0.28 2.92 1.01 0.54 -4.29 120.40 122.24 1jzs s VAL 318 Ca 0.06 -1.00 -0.29 0.00 0.00 0.00 0.00 61.98 60.75 1jzs s VAL 318 Cb -0.12 -1.59 -0.10 0.00 0.00 0.00 0.00 36.38 34.58 1jzs s VAL 318 CO 0.01 0.53 1.31 -2.28 0.00 0.00 0.00 175.10 174.67 1jzs s HIS 319 N -0.31 3.14 -0.33 5.22 2.46 -1.26 -0.96 115.29 123.24 1jzs s HIS 319 Ca 0.02 1.33 0.03 0.00 0.47 0.00 0.00 55.06 56.91 1jzs s HIS 319 Cb -0.11 -3.65 0.10 0.00 -0.13 0.00 0.00 32.58 28.79 1jzs s HIS 319 CO 0.01 -1.88 0.06 -1.14 -2.47 0.00 0.00 174.74 169.33 1jzs s GLN 320 N -1.11 1.33 -0.40 2.88 2.00 -0.67 -4.90 119.66 118.81 1jzs s GLN 320 Ca 0.52 -1.71 -0.02 0.00 -2.00 0.00 0.00 55.36 52.15 1jzs s GLN 320 Cb -0.39 -2.96 0.11 0.00 0.80 0.00 0.00 33.01 30.57 1jzs s GLN 320 CO 0.47 -0.94 0.18 0.00 -0.50 0.00 0.00 175.29 174.50 1jzs s ALA 321 N 1.05 3.12 0.60 1.58 0.00 -1.26 -1.94 121.76 124.90 1jzs s ALA 321 Ca 0.10 -2.50 0.30 0.00 0.00 0.00 0.00 51.96 49.86 1jzs s ALA 321 Cb -0.19 -2.36 1.69 0.00 0.00 0.00 0.00 23.12 22.26 1jzs s ALA 321 CO -0.11 -1.77 2.09 -1.00 0.00 0.00 0.00 175.76 174.97 1jzs h PRO 322 N 8.01 0.00 -0.34 0.00 0.13 -1.76 -2.38 132.00 135.66 1jzs h PRO 322 Ca -0.13 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.00 1jzs h PRO 322 Cb 1.05 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.18 1jzs h PRO 322 CO 0.68 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 178.45 1jzs n ALA 323 N -2.29 2.46 -0.97 -0.56 0.00 -1.26 -3.74 120.51 114.14 1jzs n ALA 323 Ca 0.01 -0.66 0.00 0.00 0.00 0.00 0.00 53.44 52.80 1jzs n ALA 323 Cb 0.33 -0.99 0.00 0.00 0.00 0.00 0.00 19.45 18.79 1jzs n ALA 323 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1jzs n PHE 324 N 0.60 0.00 -3.77 0.00 3.01 -0.91 -2.94 117.46 113.43 1jzs n PHE 324 Ca 0.14 -0.01 -0.13 0.00 1.01 0.00 0.00 57.45 58.46 1jzs n PHE 324 Cb 0.34 -0.00 -0.13 0.00 -0.01 0.00 0.00 39.48 39.68 1jzs n PHE 324 CO 0.00 0.00 0.00 0.20 1.01 0.00 0.00 176.76 177.97 1jzs s GLY 325 N -0.02 -0.12 0.07 1.37 0.00 -1.12 -4.58 107.32 102.93 1jzs s GLY 325 Ca 0.00 0.69 -0.17 0.00 0.00 0.00 0.00 44.72 45.23 1jzs s GLY 325 CO 0.00 0.77 1.40 0.00 0.00 0.00 0.00 173.10 175.27 1jzs h ALA 326 N 6.45 0.33 -0.63 3.20 0.00 -1.87 -1.90 119.26 124.85 1jzs h ALA 326 Ca -0.33 -0.36 -0.04 0.00 0.00 0.00 0.00 54.91 54.19 1jzs h ALA 326 Cb 1.18 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.86 1jzs h ALA 326 CO 0.39 0.27 0.22 0.93 0.00 0.00 0.00 179.25 181.07 1jzs h GLU 327 N 0.24 0.94 -0.21 0.00 5.08 -1.96 -2.54 114.58 116.13 1jzs h GLU 327 Ca 0.04 -0.17 -0.12 0.00 -1.00 0.00 0.00 59.36 58.12 1jzs h GLU 327 Cb 0.75 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.83 1jzs h GLU 327 CO 0.05 0.79 -0.37 -0.44 -1.00 0.00 0.00 179.01 178.04 1jzs h ASP 328 N 0.92 0.47 0.74 1.42 5.19 -1.84 -2.06 116.42 121.27 1jzs h ASP 328 Ca 0.21 -0.19 -0.08 0.00 -0.62 0.00 0.00 57.03 56.35 1jzs h ASP 328 Cb 0.22 -0.13 -0.01 0.00 0.18 0.00 0.00 39.33 39.59 1jzs h ASP 328 CO -0.01 0.80 -0.39 0.25 -3.12 0.00 0.00 179.24 176.77 1jzs h LEU 329 N 0.38 0.00 0.15 1.55 7.12 -0.93 -0.27 115.31 123.31 1jzs h LEU 329 Ca 0.04 0.00 -0.32 0.00 0.13 0.00 0.00 57.88 57.73 1jzs h LEU 329 Cb 0.82 0.00 0.00 0.00 -0.53 0.00 0.00 40.66 40.95 1jzs h LEU 329 CO 0.07 0.39 -1.64 -0.08 -0.13 0.00 0.00 178.44 177.05 1jzs h GLU 330 N 0.00 0.31 -0.91 1.25 4.81 -1.40 -2.80 114.58 115.85 1jzs h GLU 330 Ca -0.00 -0.53 0.08 0.00 -0.13 0.00 0.00 59.36 58.77 1jzs h GLU 330 Cb 0.87 0.20 -0.06 0.00 0.63 0.00 0.00 28.75 30.38 1jzs h GLU 330 CO 0.05 1.26 0.59 1.15 -0.73 0.00 0.00 179.01 181.32 1jzs h THR 331 N -0.08 1.02 0.00 0.32 2.02 -1.35 0.15 112.91 114.99 1jzs h THR 331 Ca -0.34 -0.33 -0.04 0.00 0.77 0.00 0.00 66.41 66.47 1jzs h THR 331 Cb 1.94 -0.04 -0.01 0.00 -1.74 0.00 0.00 68.15 68.31 1jzs h THR 331 CO 0.11 0.18 -0.18 0.00 0.37 0.00 0.00 175.52 176.00 1jzs h ALA 332 N 1.53 1.10 0.02 6.16 0.00 -1.09 -2.58 119.26 124.41 1jzs h ALA 332 Ca 0.40 -0.16 -0.21 0.00 0.00 0.00 0.00 54.91 54.94 1jzs h ALA 332 Cb 0.30 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 1jzs h ALA 332 CO -0.16 0.23 -0.97 -0.09 0.00 0.00 0.00 179.25 178.25 1jzs h ARG 333 N 0.00 0.09 0.57 0.00 9.65 -0.44 -0.78 114.38 123.47 1jzs h ARG 333 Ca -0.00 -0.13 -0.03 0.00 -1.10 0.00 0.00 59.98 58.72 1jzs h ARG 333 Cb 0.59 0.04 0.01 0.00 -1.39 0.00 0.00 29.97 29.22 1jzs h ARG 333 CO 0.02 0.98 -0.27 0.28 2.80 0.00 0.00 179.97 183.78 1jzs h VAL 334 N 0.04 0.00 0.00 0.20 2.07 -0.94 -3.06 116.25 114.56 1jzs h VAL 334 Ca -0.04 -0.04 0.00 0.00 0.82 0.00 0.00 66.70 67.44 1jzs h VAL 334 Cb 1.66 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 31.43 1jzs h VAL 334 CO 0.14 0.00 0.00 -1.22 0.02 0.00 0.00 177.57 176.51 1jzs n TYR 335 N -4.17 0.00 -2.50 1.57 4.02 -1.17 -4.88 117.16 110.03 1jzs n TYR 335 Ca -0.10 0.00 -0.12 0.00 -0.01 0.00 0.00 57.90 57.67 1jzs n TYR 335 Cb 0.30 -0.14 0.01 0.00 -0.02 0.00 0.00 39.34 39.49 1jzs n TYR 335 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1jzs n GLY 336 N 0.50 -0.05 3.79 2.72 0.00 -0.92 -5.00 105.19 106.22 1jzs n GLY 336 Ca 0.14 -0.32 -0.36 0.00 0.00 0.00 0.00 46.02 45.48 1jzs n GLY 336 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1jzs s LEU 337 N -3.76 4.27 0.97 0.99 1.43 -0.35 -4.99 118.68 117.24 1jzs s LEU 337 Ca 0.10 1.78 -0.11 0.00 -1.03 0.00 0.00 54.13 54.87 1jzs s LEU 337 Cb -0.04 -4.07 0.17 0.00 0.03 0.00 0.00 46.19 42.28 1jzs s LEU 337 CO 0.12 -0.11 1.10 -2.84 0.23 0.00 0.00 176.35 174.86 1jzs s PRO 338 N -2.24 0.61 -0.38 1.29 0.02 -1.26 -4.71 135.00 128.33 1jzs s PRO 338 Ca 0.52 1.25 -0.10 0.00 0.02 0.00 0.00 61.00 62.69 1jzs s PRO 338 Cb -0.17 -1.70 0.04 0.00 0.02 0.00 0.00 34.50 32.69 1jzs s PRO 338 CO 0.22 -2.81 0.20 -1.17 -0.33 0.00 0.00 177.00 173.11 1jzs s LEU 339 N -6.68 4.74 -0.48 -5.54 2.96 -1.26 -4.86 118.68 107.57 1jzs s LEU 339 Ca 0.66 -1.10 -0.18 0.00 -0.22 0.00 0.00 54.13 53.29 1jzs s LEU 339 Cb -0.22 -2.00 0.05 0.00 0.50 0.00 0.00 46.19 44.52 1jzs s LEU 339 CO 0.59 -0.41 0.52 -0.76 -1.32 0.00 0.00 176.35 174.98 1jzs s LEU 340 N 1.51 5.10 -0.73 -0.68 1.43 -1.26 -5.02 118.68 119.04 1jzs s LEU 340 Ca 0.01 -0.95 -0.19 0.00 -1.03 0.00 0.00 54.13 51.98 1jzs s LEU 340 Cb -0.20 -2.37 0.12 0.00 0.03 0.00 0.00 46.19 43.77 1jzs s LEU 340 CO 0.05 -0.75 0.88 -0.54 0.23 0.00 0.00 176.35 176.23 1jzs s LYS 341 N 2.26 3.27 0.00 1.70 1.02 -1.26 -4.60 119.74 122.14 1jzs s LYS 341 Ca 0.12 -1.47 0.23 0.00 0.02 0.00 0.00 55.97 54.86 1jzs s LYS 341 Cb -0.20 -4.46 0.53 0.00 -0.52 0.00 0.00 37.83 33.18 1jzs s LYS 341 CO 0.11 -1.64 1.47 0.25 -0.92 0.00 0.00 175.35 174.62 1jzs n THR 342 N 5.43 0.71 -4.09 2.17 -2.24 -1.26 -4.90 114.28 110.10 1jzs n THR 342 Ca 0.04 -0.85 -0.15 0.00 -2.27 0.00 0.00 64.05 60.81 1jzs n THR 342 Cb 0.45 0.78 -0.15 0.00 -2.10 0.00 0.00 70.33 69.32 1jzs n THR 342 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1jzs s VAL 343 N -1.29 0.32 0.47 2.28 1.01 -1.26 -0.99 120.40 120.94 1jzs s VAL 343 Ca 0.44 -0.16 -0.02 0.00 0.00 0.00 0.00 61.98 62.23 1jzs s VAL 343 Cb 0.24 -0.29 0.10 0.00 0.00 0.00 0.00 36.38 36.43 1jzs s VAL 343 CO 0.33 0.10 0.65 -0.90 0.00 0.00 0.00 175.10 175.28 1jzs n ASP 344 N 3.10 0.63 0.00 3.32 5.68 -0.11 -4.91 116.55 124.26 1jzs n ASP 344 Ca -0.14 -1.59 0.05 0.00 -0.50 0.00 0.00 54.79 52.61 1jzs n ASP 344 Cb 0.58 -0.44 0.31 0.00 -1.14 0.00 0.00 41.12 40.42 1jzs n ASP 344 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 1jzs n GLU 345 N -2.25 0.34 0.00 0.11 1.02 -1.26 -1.84 120.64 116.76 1jzs n GLU 345 Ca 0.10 0.00 0.04 0.00 -0.02 0.00 0.00 57.16 57.28 1jzs n GLU 345 Cb 0.35 -1.47 0.01 0.00 -0.02 0.00 0.00 31.44 30.31 1jzs n GLU 345 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 1jzs n GLU 346 N -0.97 1.77 -0.65 3.49 1.02 -1.26 -4.72 120.64 119.32 1jzs n GLU 346 Ca 0.08 -0.64 0.00 0.00 -0.02 0.00 0.00 57.16 56.58 1jzs n GLU 346 Cb 0.04 -1.05 0.00 0.00 -0.02 0.00 0.00 31.44 30.40 1jzs n GLU 346 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1jzs n GLY 347 N 0.74 1.01 3.49 0.62 0.00 -0.77 -4.68 105.19 105.60 1jzs n GLY 347 Ca 0.04 -0.43 -0.33 0.00 0.00 0.00 0.00 46.02 45.29 1jzs n GLY 347 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1jzs s LYS 348 N -1.59 3.03 0.57 1.61 1.02 -1.26 -0.12 119.74 123.01 1jzs s LYS 348 Ca 0.00 -0.61 -0.20 0.00 0.02 0.00 0.00 55.97 55.18 1jzs s LYS 348 Cb 0.00 -2.61 -0.04 0.00 -0.52 0.00 0.00 37.83 34.66 1jzs s LYS 348 CO 0.00 0.46 1.27 -0.51 -0.92 0.00 0.00 175.35 175.65 1jzs s LEU 349 N -0.28 3.74 0.00 3.17 2.01 -0.45 -0.94 118.68 125.94 1jzs s LEU 349 Ca 0.03 2.55 0.00 0.00 0.01 0.00 0.00 54.13 56.72 1jzs s LEU 349 Cb -0.13 -4.46 0.00 0.00 0.01 0.00 0.00 46.19 41.61 1jzs s LEU 349 CO 0.03 -1.60 0.86 0.18 1.01 0.00 0.00 176.35 176.82 1jzs n LEU 350 N -1.35 1.71 -4.53 1.79 4.32 -0.16 0.01 117.00 118.78 1jzs n LEU 350 Ca 0.12 -1.71 -0.42 0.00 -0.02 0.00 0.00 56.01 53.98 1jzs n LEU 350 Cb 0.48 0.00 -0.07 0.00 -1.62 0.00 0.00 43.42 42.20 1jzs n LEU 350 CO 0.48 0.43 0.28 -0.69 -1.22 0.00 0.00 177.39 176.67 1jzs s VAL 351 N -0.72 4.95 0.00 4.08 1.01 -1.26 -4.80 120.40 123.66 1jzs s VAL 351 Ca 0.00 0.19 0.00 0.00 0.00 0.00 0.00 61.98 62.17 1jzs s VAL 351 Cb 0.00 -4.07 0.00 0.00 0.00 0.00 0.00 36.38 32.31 1jzs s VAL 351 CO 0.00 -0.39 0.00 1.21 0.00 0.00 0.00 175.10 175.92 1jzs n GLU 352 N 5.94 0.00 -0.01 2.72 4.07 -1.26 0.02 120.64 132.12 1jzs n GLU 352 Ca -0.04 0.00 0.23 0.00 -0.06 0.00 0.00 57.16 57.29 1jzs n GLU 352 Cb 0.48 0.00 0.72 0.00 -0.06 0.00 0.00 31.44 32.59 1jzs n GLU 352 CO 0.00 0.00 0.00 -1.00 -0.06 0.00 0.00 177.13 176.07 1jzs h PRO 353 N 0.00 0.00 0.00 5.31 0.13 -2.02 -2.49 132.00 132.93 1jzs h PRO 353 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1jzs h PRO 353 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 1jzs h PRO 353 CO 0.00 0.00 -0.04 1.19 -0.23 0.00 0.00 178.00 178.92 1jzs n PHE 354 N -4.06 0.00 -1.66 1.56 3.01 0.10 -5.07 117.46 111.34 1jzs n PHE 354 Ca 0.11 -0.58 -0.54 0.00 1.01 0.00 0.00 57.45 57.45 1jzs n PHE 354 Cb 0.71 -0.08 -0.06 0.00 -0.01 0.00 0.00 39.48 40.04 1jzs n PHE 354 CO 0.00 0.00 0.00 1.17 1.01 0.00 0.00 176.76 178.94 1jzs n LYS 355 N -0.74 1.30 0.00 -1.08 4.81 -0.13 -1.86 118.16 120.46 1jzs n LYS 355 Ca 0.06 0.47 0.00 0.00 -0.87 0.00 0.00 58.31 57.97 1jzs n LYS 355 Cb 0.45 -2.16 0.00 0.00 0.02 0.00 0.00 35.03 33.35 1jzs n LYS 355 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1jzs n GLY 356 N 3.47 1.69 3.77 3.14 0.00 0.10 -4.96 105.19 112.41 1jzs n GLY 356 Ca 0.22 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.85 1jzs n GLY 356 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1jzs s LEU 357 N 0.00 4.56 0.24 0.99 1.02 -0.78 -4.71 118.68 120.01 1jzs s LEU 357 Ca 0.00 1.77 -0.30 0.00 0.02 0.00 0.00 54.13 55.62 1jzs s LEU 357 Cb 0.00 -3.55 -0.10 0.00 0.02 0.00 0.00 46.19 42.56 1jzs s LEU 357 CO 0.00 0.13 1.47 -0.47 0.02 0.00 0.00 176.35 177.51 1jzs s TYR 358 N -1.26 3.00 0.48 0.29 5.04 -1.26 -1.34 117.35 122.29 1jzs s TYR 358 Ca 0.41 0.95 0.30 0.00 -2.44 0.00 0.00 57.07 56.28 1jzs s TYR 358 Cb -0.23 -3.86 1.38 0.00 0.35 0.00 0.00 41.96 39.60 1jzs s TYR 358 CO 0.28 -2.87 1.78 0.27 -1.34 0.00 0.00 175.55 173.67 1jzs h PHE 359 N 5.25 0.28 0.00 4.97 -5.15 -0.89 0.91 116.94 122.31 1jzs h PHE 359 Ca -0.46 0.01 -0.11 0.00 -0.20 0.00 0.00 57.97 57.21 1jzs h PHE 359 Cb 1.22 -0.08 -0.02 0.00 0.22 0.00 0.00 35.95 37.29 1jzs h PHE 359 CO 0.61 0.01 -0.54 0.00 -2.00 0.00 0.00 178.31 176.39 1jzs h ARG 360 N 0.15 0.00 0.19 6.09 2.47 -1.90 -3.19 114.38 118.18 1jzs h ARG 360 Ca 0.59 0.00 -0.26 0.00 -1.26 0.00 0.00 59.98 59.05 1jzs h ARG 360 Cb 2.02 0.00 0.03 0.00 -1.65 0.00 0.00 29.97 30.36 1jzs h ARG 360 CO -0.14 0.54 -1.16 0.93 0.56 0.00 0.00 179.97 180.70 1jzs h GLU 361 N 0.00 0.40 -0.48 0.04 5.08 -1.21 -3.29 114.58 115.12 1jzs h GLU 361 Ca -0.01 -0.68 0.14 0.00 -1.00 0.00 0.00 59.36 57.82 1jzs h GLU 361 Cb 0.97 0.25 -0.02 0.00 0.50 0.00 0.00 28.75 30.45 1jzs h GLU 361 CO 0.07 1.32 0.61 0.00 -1.00 0.00 0.00 179.01 180.02 1jzs h ALA 362 N 0.10 2.19 0.06 3.43 0.00 -1.38 -2.32 119.26 121.34 1jzs h ALA 362 Ca -0.21 -0.02 0.03 0.00 0.00 0.00 0.00 54.91 54.71 1jzs h ALA 362 Cb 1.88 0.04 -0.04 0.00 0.00 0.00 0.00 17.79 19.66 1jzs h ALA 362 CO 0.20 -0.86 -0.31 -0.91 0.00 0.00 0.00 179.25 177.37 1jzs h ASN 363 N 0.00 -0.91 0.14 0.00 2.35 -1.63 0.45 115.58 115.99 1jzs h ASN 363 Ca 0.23 0.11 -0.11 0.00 -0.55 0.00 0.00 56.30 55.98 1jzs h ASN 363 Cb 1.45 0.36 -0.01 0.00 0.05 0.00 0.00 38.32 40.16 1jzs h ASN 363 CO -0.00 -0.39 -0.38 0.08 -1.65 0.00 0.00 177.43 175.10 1jzs h ARG 364 N -0.49 0.32 -0.27 0.81 0.11 -1.67 0.29 114.38 113.48 1jzs h ARG 364 Ca 0.05 -0.15 -0.10 0.00 0.10 0.00 0.00 59.98 59.88 1jzs h ARG 364 Cb 0.55 -0.01 -0.01 0.00 1.11 0.00 0.00 29.97 31.61 1jzs h ARG 364 CO -0.22 0.66 -0.27 0.00 0.10 0.00 0.00 179.97 180.23 1jzs h ALA 365 N 1.33 1.03 0.15 0.08 0.00 -1.38 -0.69 119.26 119.78 1jzs h ALA 365 Ca 0.03 -0.36 -0.21 0.00 0.00 0.00 0.00 54.91 54.36 1jzs h ALA 365 Cb 0.79 -0.12 0.02 0.00 0.00 0.00 0.00 17.79 18.48 1jzs h ALA 365 CO 0.06 0.58 -0.96 0.82 0.00 0.00 0.00 179.25 179.76 1jzs h ILE 366 N 0.47 1.43 -0.60 0.00 2.04 0.11 -2.79 117.51 118.17 1jzs h ILE 366 Ca 0.06 -2.54 0.10 0.00 1.00 0.00 0.00 64.86 63.49 1jzs h ILE 366 Cb 0.72 3.13 -0.08 0.00 -0.74 0.00 0.00 36.82 39.85 1jzs h ILE 366 CO 0.06 0.73 0.17 0.25 0.00 0.00 0.00 178.15 179.35 1jzs h LEU 367 N -0.31 0.10 -0.25 1.44 5.85 -0.31 -1.16 115.31 120.67 1jzs h LEU 367 Ca -0.17 0.10 0.04 0.00 0.84 0.00 0.00 57.88 58.68 1jzs h LEU 367 Cb 1.72 0.11 -0.03 0.00 0.37 0.00 0.00 40.66 42.83 1jzs h LEU 367 CO 0.16 0.06 0.03 -0.09 -0.34 0.00 0.00 178.44 178.25 1jzs h ARG 368 N 0.32 0.11 -0.53 1.25 2.43 -1.17 -1.10 114.38 115.68 1jzs h ARG 368 Ca 0.31 -0.01 0.02 0.00 -0.81 0.00 0.00 59.98 59.49 1jzs h ARG 368 Cb 0.43 -0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 29.92 1jzs h ARG 368 CO -0.36 0.07 0.33 0.22 -1.51 0.00 0.00 179.97 178.72 1jzs h ASP 369 N 0.11 0.54 -0.41 -3.80 -0.00 -1.00 -1.90 116.42 109.96 1jzs h ASP 369 Ca 0.11 -0.00 -0.04 0.00 -0.00 0.00 0.00 57.03 57.10 1jzs h ASP 369 Cb 0.13 -0.12 -0.02 0.00 -0.00 0.00 0.00 39.33 39.33 1jzs h ASP 369 CO -0.17 0.38 0.08 -0.07 -0.00 0.00 0.00 179.24 179.46 1jzs h LEU 370 N 0.65 0.63 -2.10 2.28 3.38 -0.90 -2.40 115.31 116.85 1jzs h LEU 370 Ca 0.21 -0.25 -0.01 0.00 0.09 0.00 0.00 57.88 57.92 1jzs h LEU 370 Cb -0.00 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 40.58 1jzs h LEU 370 CO -0.08 0.72 -0.04 -0.09 0.09 0.00 0.00 178.44 179.03 1jzs h ARG 371 N 0.52 0.00 -0.01 1.13 2.43 -1.01 -0.78 114.38 116.66 1jzs h ARG 371 Ca 0.13 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.30 1jzs h ARG 371 Cb 0.35 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.90 1jzs h ARG 371 CO 0.00 0.04 -0.22 0.41 -1.51 0.00 0.00 179.97 178.70 1jzs n GLY 372 N -0.56 -0.52 0.14 2.80 0.00 -0.73 -3.42 105.19 102.89 1jzs n GLY 372 Ca -0.01 -0.41 0.09 0.00 0.00 0.00 0.00 46.02 45.69 1jzs n GLY 372 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1jzs n ARG 373 N -0.53 1.62 -3.93 1.61 1.74 -0.62 -4.98 116.66 111.57 1jzs n ARG 373 Ca 0.13 -2.49 -0.31 0.00 -0.77 0.00 0.00 57.85 54.42 1jzs n ARG 373 Cb 0.35 -1.48 0.02 0.00 -1.02 0.00 0.00 32.46 30.34 1jzs n ARG 373 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1jzs n GLY 374 N -1.24 -0.49 0.48 -0.13 0.00 -1.04 -4.87 105.19 97.89 1jzs n GLY 374 Ca 0.15 0.19 0.06 0.00 0.00 0.00 0.00 46.02 46.42 1jzs n GLY 374 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1jzs n LEU 375 N -4.67 2.10 -4.54 0.99 4.77 -0.40 -4.92 117.00 110.33 1jzs n LEU 375 Ca 0.04 -1.17 -0.38 0.00 -0.03 0.00 0.00 56.01 54.48 1jzs n LEU 375 Cb 0.52 -0.04 -0.11 0.00 -2.33 0.00 0.00 43.42 41.46 1jzs n LEU 375 CO 0.76 0.43 -0.20 -0.76 -1.33 0.00 0.00 177.39 176.29 1jzs s LEU 376 N -0.94 3.85 -0.21 2.23 1.43 -1.24 -1.93 118.68 121.86 1jzs s LEU 376 Ca 0.15 -0.10 -0.21 0.00 -1.03 0.00 0.00 54.13 52.94 1jzs s LEU 376 Cb 0.10 -2.06 -0.19 0.00 0.03 0.00 0.00 46.19 44.07 1jzs s LEU 376 CO 0.14 -0.05 0.18 0.33 0.23 0.00 0.00 176.35 177.17 1jzs n PHE 377 N 5.02 0.95 -3.79 0.29 -0.00 0.12 -4.96 117.46 115.09 1jzs n PHE 377 Ca -0.15 0.40 -0.13 0.00 -0.00 0.00 0.00 57.45 57.58 1jzs n PHE 377 Cb 0.52 -1.10 -0.11 0.00 -0.00 0.00 0.00 39.48 38.79 1jzs n PHE 377 CO 0.00 0.00 0.00 0.21 -0.00 0.00 0.00 176.76 176.97 1jzs s LYS 378 N -2.38 0.38 -0.13 -4.13 2.20 -1.21 -4.98 119.74 109.49 1jzs s LYS 378 Ca -0.29 0.22 -0.01 0.00 -0.36 0.00 0.00 55.97 55.52 1jzs s LYS 378 Cb 0.07 0.18 0.04 0.00 -1.51 0.00 0.00 37.83 36.60 1jzs s LYS 378 CO 0.59 -0.06 -0.02 -2.00 -0.36 0.00 0.00 175.35 173.50 1jzs s GLU 379 N -0.21 0.95 0.41 4.03 2.12 -1.26 -0.04 118.70 124.70 1jzs s GLU 379 Ca -0.03 -0.20 0.02 0.00 0.36 0.00 0.00 54.97 55.11 1jzs s GLU 379 Cb -0.03 -1.55 -0.01 0.00 0.26 0.00 0.00 34.13 32.80 1jzs s GLU 379 CO 0.01 -0.40 0.07 0.39 -0.54 0.00 0.00 175.26 174.79 1jzs n GLU 380 N 5.03 0.73 -4.74 4.30 1.02 0.24 -4.99 120.64 122.24 1jzs n GLU 380 Ca -0.09 -3.26 -0.33 0.00 -0.02 0.00 0.00 57.16 53.46 1jzs n GLU 380 Cb 0.49 1.35 -0.13 0.00 -0.02 0.00 0.00 31.44 33.13 1jzs n GLU 380 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 1jzs s SER 381 N -3.41 4.29 -0.17 1.62 0.15 -1.26 -0.43 113.70 114.48 1jzs s SER 381 Ca 0.10 -0.17 -0.04 0.00 0.70 0.00 0.00 55.95 56.54 1jzs s SER 381 Cb 0.01 -1.22 -0.02 0.00 -1.71 0.00 0.00 66.02 63.07 1jzs s SER 381 CO 0.07 0.29 -0.03 -0.47 1.20 0.00 0.00 173.24 174.30 1jzs s TYR 382 N -0.38 3.02 -0.34 3.44 6.04 0.66 -4.79 117.35 125.00 1jzs s TYR 382 Ca 0.05 -0.41 -0.00 0.00 0.04 0.00 0.00 57.07 56.74 1jzs s TYR 382 Cb -0.12 -2.01 0.08 0.00 -1.04 0.00 0.00 41.96 38.87 1jzs s TYR 382 CO 0.02 -0.15 0.06 -1.17 -1.54 0.00 0.00 175.55 172.77 1jzs s LEU 383 N 0.67 4.47 0.18 6.97 1.98 -1.26 -0.64 118.68 131.05 1jzs s LEU 383 Ca -0.02 -1.73 -0.06 0.00 -2.89 0.00 0.00 54.13 49.43 1jzs s LEU 383 Cb -0.14 -1.71 -0.02 0.00 0.66 0.00 0.00 46.19 44.97 1jzs s LEU 383 CO 0.02 -0.37 0.23 -1.38 -1.89 0.00 0.00 176.35 172.97 1jzs s HIS 384 N 1.12 0.68 -0.02 5.38 -3.43 -0.93 -4.99 115.29 113.09 1jzs s HIS 384 Ca 0.02 -1.01 -0.26 0.00 -0.80 0.00 0.00 55.06 53.02 1jzs s HIS 384 Cb -0.21 -0.22 -0.04 0.00 -1.43 0.00 0.00 32.58 30.68 1jzs s HIS 384 CO -0.04 -0.71 0.82 -1.54 -2.00 0.00 0.00 174.74 171.27 1jzs s SER 385 N -3.04 7.17 0.06 7.38 1.04 -1.26 0.10 113.70 125.15 1jzs s SER 385 Ca 0.25 1.41 0.02 0.00 0.48 0.00 0.00 55.95 58.11 1jzs s SER 385 Cb 0.04 -2.48 -0.03 0.00 0.10 0.00 0.00 66.02 63.65 1jzs s SER 385 CO 0.05 -0.16 -0.07 -0.47 0.98 0.00 0.00 173.24 173.58 1jzs s TYR 386 N 0.77 0.71 -0.16 5.02 5.04 0.45 -4.89 117.35 124.29 1jzs s TYR 386 Ca 0.43 -0.70 -0.29 0.00 -2.44 0.00 0.00 57.07 54.07 1jzs s TYR 386 Cb -0.19 -0.43 -0.02 0.00 0.35 0.00 0.00 41.96 41.67 1jzs s TYR 386 CO 0.23 -0.14 1.31 -1.25 -1.34 0.00 0.00 175.55 174.36 1jzs s PRO 387 N -2.61 4.20 0.31 4.97 0.04 -1.26 -0.65 135.00 140.00 1jzs s PRO 387 Ca -0.01 1.70 0.10 0.00 0.04 0.00 0.00 61.00 62.83 1jzs s PRO 387 Cb -0.03 -3.80 -0.05 0.00 0.04 0.00 0.00 34.50 30.66 1jzs s PRO 387 CO -0.02 -0.75 -0.04 -1.01 0.04 0.00 0.00 177.00 175.21 1jzs s HIS 388 N 3.63 2.52 0.15 0.56 3.76 0.86 -1.12 115.29 125.66 1jzs s HIS 388 Ca 0.57 -0.36 -0.31 0.00 -0.15 0.00 0.00 55.06 54.81 1jzs s HIS 388 Cb -0.23 -1.29 -0.10 0.00 1.11 0.00 0.00 32.58 32.07 1jzs s HIS 388 CO 0.17 0.58 1.59 0.00 -0.85 0.00 0.00 174.74 176.22 1jzs h TRP 390 N 7.02 0.00 0.00 0.00 5.08 -1.87 -3.26 115.95 122.93 1jzs h TRP 390 Ca -0.43 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.54 1jzs h TRP 390 Cb 1.20 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.36 1jzs h TRP 390 CO 0.67 0.06 0.00 0.54 -1.28 0.00 0.00 178.44 178.42 1jzs n ARG 391 N -4.45 0.00 -2.78 0.12 5.12 -1.26 -4.80 116.66 108.61 1jzs n ARG 391 Ca -0.03 0.00 -0.42 0.00 -1.93 0.00 0.00 57.85 55.47 1jzs n ARG 391 Cb 0.14 -0.18 -0.03 0.00 -1.16 0.00 0.00 32.46 31.23 1jzs n ARG 391 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1jzs n SER 393 N 5.04 0.32 -4.76 0.00 7.64 -1.23 -3.65 113.62 116.98 1jzs n SER 393 Ca 0.07 -0.27 -0.41 0.00 1.01 0.00 0.00 58.87 59.27 1jzs n SER 393 Cb 0.49 -0.06 -0.03 0.00 -1.01 0.00 0.00 64.21 63.60 1jzs n SER 393 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1jzs s THR 394 N 0.97 3.19 0.21 0.44 2.01 -1.26 -4.51 115.64 116.68 1jzs s THR 394 Ca 0.00 1.12 -0.30 0.00 0.31 0.00 0.00 61.69 62.82 1jzs s THR 394 Cb 0.00 -3.72 -0.09 0.00 0.01 0.00 0.00 72.50 68.71 1jzs s THR 394 CO 0.00 0.24 1.23 -2.16 -0.69 0.00 0.00 174.62 173.24 1jzs s PRO 395 N -1.16 4.46 0.77 4.92 0.04 -1.26 0.59 135.00 143.36 1jzs s PRO 395 Ca 0.49 1.95 -0.11 0.00 0.04 0.00 0.00 61.00 63.37 1jzs s PRO 395 Cb -0.35 -3.21 0.06 0.00 0.04 0.00 0.00 34.50 31.04 1jzs s PRO 395 CO 0.44 -0.12 1.14 -0.51 0.04 0.00 0.00 177.00 177.98 1jzs s LEU 396 N -0.41 2.64 -0.09 -3.56 1.02 -0.27 -4.76 118.68 113.25 1jzs s LEU 396 Ca 0.53 0.83 -0.04 0.00 0.02 0.00 0.00 54.13 55.47 1jzs s LEU 396 Cb -0.34 -3.42 0.04 0.00 0.02 0.00 0.00 46.19 42.49 1jzs s LEU 396 CO 0.39 -1.72 0.21 0.00 0.02 0.00 0.00 176.35 175.24 1jzs s MET 397 N -5.48 0.16 -0.00 1.70 0.23 -0.85 -4.97 119.30 110.09 1jzs s MET 397 Ca 0.61 0.47 -0.30 0.00 -1.03 0.00 0.00 55.69 55.44 1jzs s MET 397 Cb -0.11 -0.14 -0.06 0.00 -1.53 0.00 0.00 34.83 32.99 1jzs s MET 397 CO 0.49 -0.17 1.48 0.71 -2.03 0.00 0.00 175.02 175.50 1jzs s TYR 398 N 1.24 2.66 0.07 3.16 2.02 -1.26 -1.88 117.35 123.36 1jzs s TYR 398 Ca -0.09 0.65 0.04 0.00 -0.37 0.00 0.00 57.07 57.30 1jzs s TYR 398 Cb -0.11 -3.75 -0.03 0.00 -0.40 0.00 0.00 41.96 37.67 1jzs s TYR 398 CO -0.08 -2.87 -0.11 -0.47 -1.57 0.00 0.00 175.55 170.46 1jzs s TYR 399 N 2.69 0.99 -0.24 2.71 5.04 -0.28 -4.33 117.35 123.94 1jzs s TYR 399 Ca 0.67 -0.53 -0.07 0.00 -2.44 0.00 0.00 57.07 54.69 1jzs s TYR 399 Cb -0.33 -0.56 -0.03 0.00 0.35 0.00 0.00 41.96 41.39 1jzs s TYR 399 CO 0.27 -0.01 0.06 0.00 -1.34 0.00 0.00 175.55 174.53 1jzs s ALA 400 N -1.66 3.13 0.18 3.97 0.00 -1.15 -0.32 121.76 125.91 1jzs s ALA 400 Ca -0.02 -1.11 -0.24 0.00 0.00 0.00 0.00 51.96 50.59 1jzs s ALA 400 Cb -0.08 -2.02 0.05 0.00 0.00 0.00 0.00 23.12 21.08 1jzs s ALA 400 CO 0.01 -0.43 0.80 -0.08 0.00 0.00 0.00 175.76 176.06 1jzs s THR 401 N 1.51 0.00 0.37 0.00 -1.32 -0.66 -4.92 115.64 110.61 1jzs s THR 401 Ca 0.06 -0.56 -0.28 0.00 -1.21 0.00 0.00 61.69 59.69 1jzs s THR 401 Cb -0.15 -1.67 -0.11 0.00 -1.51 0.00 0.00 72.50 69.06 1jzs s THR 401 CO 0.03 0.00 1.46 1.21 -2.21 0.00 0.00 174.62 175.11 1jzs n GLU 402 N -0.42 2.59 -3.44 7.08 2.13 -1.26 -3.46 120.64 123.87 1jzs n GLU 402 Ca -0.08 0.91 -0.12 0.00 0.66 0.00 0.00 57.16 58.54 1jzs n GLU 402 Cb 0.61 -2.62 -0.02 0.00 0.27 0.00 0.00 31.44 29.68 1jzs n GLU 402 CO 0.00 0.00 0.00 0.45 -0.41 0.00 0.00 177.13 177.17 1jzs s SER 403 N -0.12 -0.54 -0.07 4.31 0.15 -0.30 -4.99 113.70 112.13 1jzs s SER 403 Ca 0.54 0.04 0.03 0.00 0.70 0.00 0.00 55.95 57.27 1jzs s SER 403 Cb -0.49 0.56 -0.02 0.00 -1.71 0.00 0.00 66.02 64.36 1jzs s SER 403 CO 0.63 -0.88 -0.16 0.26 1.20 0.00 0.00 173.24 174.28 1jzs s TRP 404 N -3.48 2.67 0.28 3.44 0.52 -1.26 -1.18 118.94 119.93 1jzs s TRP 404 Ca 0.01 -0.43 0.09 0.00 0.02 0.00 0.00 56.10 55.80 1jzs s TRP 404 Cb -0.01 -1.68 -0.05 0.00 -1.15 0.00 0.00 33.47 30.57 1jzs s TRP 404 CO -0.11 -0.02 -0.14 -0.06 0.02 0.00 0.00 176.95 176.64 1jzs s PHE 405 N -0.29 2.12 -0.27 -1.98 0.40 0.75 -1.52 117.98 117.19 1jzs s PHE 405 Ca 0.02 -0.50 -0.07 0.00 -0.60 0.00 0.00 56.93 55.77 1jzs s PHE 405 Cb -0.13 -1.06 -0.01 0.00 0.51 0.00 0.00 43.02 42.33 1jzs s PHE 405 CO 0.03 0.52 0.08 0.42 0.70 0.00 0.00 175.22 176.97 1jzs s ILE 406 N -2.74 4.21 -0.64 0.64 1.01 0.16 -1.74 121.20 122.10 1jzs s ILE 406 Ca 0.29 -0.40 -0.09 0.00 0.00 0.00 0.00 60.65 60.44 1jzs s ILE 406 Cb -0.01 -3.06 -0.08 0.00 0.01 0.00 0.00 42.46 39.32 1jzs s ILE 406 CO 0.13 0.21 1.81 0.29 0.00 0.00 0.00 174.94 177.38 1jzs n LYS 407 N 4.91 1.41 0.00 2.79 5.02 0.03 -2.55 118.16 129.77 1jzs n LYS 407 Ca -0.15 -1.31 0.10 0.00 -2.02 0.00 0.00 58.31 54.93 1jzs n LYS 407 Cb 0.50 -2.45 0.48 0.00 -0.02 0.00 0.00 35.03 33.53 1jzs n LYS 407 CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 1jzs n ASN 408 N 5.32 0.00 0.15 4.39 2.04 -1.26 -3.07 115.26 122.83 1jzs n ASN 408 Ca 0.36 0.12 0.03 0.00 -0.44 0.00 0.00 54.58 54.65 1jzs n ASN 408 Cb 0.18 -0.34 0.16 0.00 -2.53 0.00 0.00 39.78 37.25 1jzs n ASN 408 CO 0.00 0.00 0.00 0.71 -0.44 0.00 0.00 177.26 177.53 1jzs h THR 409 N 0.00 1.00 0.00 5.53 1.35 -1.89 -2.85 112.91 116.05 1jzs h THR 409 Ca 0.00 -2.04 0.00 0.00 -0.55 0.00 0.00 66.41 63.82 1jzs h THR 409 Cb 0.22 2.24 0.00 0.00 -1.73 0.00 0.00 68.15 68.88 1jzs h THR 409 CO 0.00 0.50 0.00 0.18 -0.25 0.00 0.00 175.52 175.95 1jzs n LEU 410 N -3.40 0.00 -0.27 3.87 4.77 -1.17 -1.79 117.00 119.00 1jzs n LEU 410 Ca 0.01 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.99 1jzs n LEU 410 Cb 0.65 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.75 1jzs n LEU 410 CO 0.40 0.00 0.27 0.49 -1.33 0.00 0.00 177.39 177.21 1jzs n PHE 411 N -0.59 0.00 -0.27 -1.77 3.01 -1.08 -4.94 117.46 111.82 1jzs n PHE 411 Ca 0.01 -0.05 0.08 0.00 1.01 0.00 0.00 57.45 58.50 1jzs n PHE 411 Cb 0.01 -0.03 0.22 0.00 -0.01 0.00 0.00 39.48 39.67 1jzs n PHE 411 CO 0.00 0.00 0.00 -0.22 1.01 0.00 0.00 176.76 177.55 1jzs h LYS 412 N 0.00 0.40 -0.20 -1.08 3.64 -1.42 -0.61 116.57 117.30 1jzs h LYS 412 Ca 0.00 -0.02 -0.10 0.00 -1.27 0.00 0.00 60.65 59.26 1jzs h LYS 412 Cb 1.20 -0.09 -0.00 0.00 -0.41 0.00 0.00 32.23 32.93 1jzs h LYS 412 CO 0.00 0.27 -0.25 -0.44 -2.27 0.00 0.00 179.45 176.76 1jzs h ASP 413 N 0.41 0.57 -0.41 4.20 3.32 -1.92 -2.34 116.42 120.25 1jzs h ASP 413 Ca 0.46 -0.50 0.06 0.00 0.02 0.00 0.00 57.03 57.08 1jzs h ASP 413 Cb 0.77 -0.16 -0.06 0.00 0.22 0.00 0.00 39.33 40.10 1jzs h ASP 413 CO -0.46 0.95 0.08 -0.08 -1.72 0.00 0.00 179.24 178.02 1jzs h GLU 414 N 0.20 0.21 -0.49 3.56 4.57 -1.81 0.53 114.58 121.34 1jzs h GLU 414 Ca 0.03 -0.01 0.03 0.00 -1.18 0.00 0.00 59.36 58.22 1jzs h GLU 414 Cb 0.81 -0.05 -0.03 0.00 -0.16 0.00 0.00 28.75 29.33 1jzs h GLU 414 CO 0.06 0.14 0.33 -0.07 -1.18 0.00 0.00 179.01 178.28 1jzs h LEU 415 N 0.21 0.49 0.07 1.64 3.38 -1.09 0.43 115.31 120.44 1jzs h LEU 415 Ca 0.20 -0.01 -0.27 0.00 0.09 0.00 0.00 57.88 57.90 1jzs h LEU 415 Cb 0.24 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.88 1jzs h LEU 415 CO -0.26 0.34 -1.19 0.40 0.09 0.00 0.00 178.44 177.82 1jzs h ILE 416 N 0.57 1.48 0.86 1.22 2.04 -0.49 -2.80 117.51 120.40 1jzs h ILE 416 Ca 0.20 -2.95 -0.04 0.00 1.00 0.00 0.00 64.86 63.06 1jzs h ILE 416 Cb 0.08 2.85 0.01 0.00 -0.74 0.00 0.00 36.82 39.02 1jzs h ILE 416 CO -0.05 0.86 -0.41 0.03 0.00 0.00 0.00 178.15 178.58 1jzs h ARG 417 N 0.10 -1.11 -0.77 2.37 3.08 0.84 -2.90 114.38 115.99 1jzs h ARG 417 Ca -0.13 0.08 0.15 0.00 0.07 0.00 0.00 59.98 60.15 1jzs h ARG 417 Cb 1.90 0.25 -0.10 0.00 0.08 0.00 0.00 29.97 32.11 1jzs h ARG 417 CO 0.20 -0.74 0.29 -0.91 -1.07 0.00 0.00 179.97 177.74 1jzs h ASN 418 N -1.27 0.25 -0.30 7.04 2.35 -1.07 0.66 115.58 123.25 1jzs h ASN 418 Ca -0.12 0.12 0.09 0.00 -0.55 0.00 0.00 56.30 55.83 1jzs h ASN 418 Cb 0.89 0.10 -0.01 0.00 0.05 0.00 0.00 38.32 39.35 1jzs h ASN 418 CO 0.19 0.08 0.26 -1.13 -1.65 0.00 0.00 177.43 175.18 1jzs h ASN 419 N 0.42 0.00 -0.27 5.81 -0.00 -1.45 0.11 115.58 120.20 1jzs h ASN 419 Ca 0.43 0.00 -0.08 0.00 -0.00 0.00 0.00 56.30 56.65 1jzs h ASN 419 Cb 0.67 0.00 -0.02 0.00 -0.00 0.00 0.00 38.32 38.98 1jzs h ASN 419 CO -0.43 0.00 -0.07 1.56 -0.00 0.00 0.00 177.43 178.49 1jzs h GLN 420 N 0.00 0.65 -0.16 6.67 1.08 -0.65 -2.94 115.11 119.76 1jzs h GLN 420 Ca 0.14 -0.19 -0.05 0.00 -1.45 0.00 0.00 58.65 57.10 1jzs h GLN 420 Cb 0.65 -0.07 -0.01 0.00 -0.05 0.00 0.00 27.48 28.00 1jzs h GLN 420 CO -0.00 0.72 -0.14 0.93 -0.95 0.00 0.00 178.83 179.39 1jzs h GLU 421 N 0.60 0.25 -7.18 1.46 5.08 -0.79 -3.45 114.58 110.56 1jzs h GLU 421 Ca 0.11 -0.06 -0.52 0.00 -1.00 0.00 0.00 59.36 57.89 1jzs h GLU 421 Cb 0.49 -0.03 0.13 0.00 0.50 0.00 0.00 28.75 29.83 1jzs h GLU 421 CO 0.03 0.40 0.39 0.42 -1.00 0.00 0.00 179.01 179.25 1jzs s ILE 422 N -4.70 2.75 -0.83 3.13 1.01 -1.11 -4.99 121.20 116.46 1jzs s ILE 422 Ca -0.05 0.37 -0.02 0.00 0.00 0.00 0.00 60.65 60.95 1jzs s ILE 422 Cb 0.15 -2.92 0.20 0.00 0.01 0.00 0.00 42.46 39.90 1jzs s ILE 422 CO 0.74 -0.19 0.69 -2.28 0.00 0.00 0.00 174.94 173.89 1jzs s HIS 423 N -2.10 3.78 0.19 3.97 5.65 -0.73 -5.02 115.29 121.03 1jzs s HIS 423 Ca 0.71 -2.98 -0.30 0.00 0.25 0.00 0.00 55.06 52.74 1jzs s HIS 423 Cb -0.25 -3.20 -0.09 0.00 -1.18 0.00 0.00 32.58 27.86 1jzs s HIS 423 CO 0.42 -0.75 1.36 -1.58 -0.65 0.00 0.00 174.74 173.54 1jzs s TRP 424 N -1.09 3.20 0.00 3.88 0.52 -1.26 -2.19 118.94 121.99 1jzs s TRP 424 Ca 0.25 1.12 0.00 0.00 0.02 0.00 0.00 56.10 57.49 1jzs s TRP 424 Cb -0.10 -3.67 0.00 0.00 -1.15 0.00 0.00 33.47 28.55 1jzs s TRP 424 CO -0.11 -2.17 0.29 0.28 0.02 0.00 0.00 176.95 175.25 1jzs n VAL 425 N 2.83 0.00 -1.54 4.03 0.31 0.94 -3.63 118.33 121.26 1jzs n VAL 425 Ca 0.07 0.72 -0.47 0.00 -0.01 0.00 0.00 64.34 64.65 1jzs n VAL 425 Cb 0.42 -1.58 -0.05 0.00 -0.91 0.00 0.00 33.84 31.72 1jzs n VAL 425 CO 0.00 0.00 0.00 -0.81 -1.32 0.00 0.00 176.83 174.70 1jzs n PRO 426 N -0.33 1.61 -0.31 5.55 -0.04 -1.26 -4.70 135.00 135.51 1jzs n PRO 426 Ca 0.00 0.46 0.13 0.00 -0.04 0.00 0.00 63.50 64.05 1jzs n PRO 426 Cb 0.00 -2.82 0.36 0.00 -0.04 0.00 0.00 33.50 30.99 1jzs n PRO 426 CO 0.00 0.00 0.00 -1.35 -0.04 0.00 0.00 175.50 174.11 1jzs h PRO 427 N 13.14 0.70 0.00 0.54 0.11 -1.98 -2.51 132.00 142.00 1jzs h PRO 427 Ca -0.36 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.71 1jzs h PRO 427 Cb 1.28 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 32.23 1jzs h PRO 427 CO 0.98 0.47 0.21 1.12 -0.21 0.00 0.00 178.00 180.57 1jzs h HIS 428 N 0.73 0.00 0.00 0.65 2.07 -1.90 -0.16 115.15 116.53 1jzs h HIS 428 Ca 0.50 0.00 -0.03 0.00 -2.85 0.00 0.00 60.37 58.00 1jzs h HIS 428 Cb 0.81 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 30.79 1jzs h HIS 428 CO -0.00 0.00 -0.13 0.82 -3.07 0.00 0.00 177.93 175.55 1jzs h ILE 429 N 0.00 0.27 -0.19 6.12 1.08 -1.81 0.38 117.51 123.36 1jzs h ILE 429 Ca 0.00 -1.00 -0.02 0.00 -0.39 0.00 0.00 64.86 63.46 1jzs h ILE 429 Cb 0.42 1.80 -0.01 0.00 -3.07 0.00 0.00 36.82 35.96 1jzs h ILE 429 CO 0.00 0.12 0.05 0.50 -0.69 0.00 0.00 178.15 178.13 1jzs h LYS 430 N 0.00 0.30 0.00 2.37 3.64 -1.23 -1.96 116.57 119.70 1jzs h LYS 430 Ca -0.00 -0.07 -0.25 0.00 -1.27 0.00 0.00 60.65 59.06 1jzs h LYS 430 Cb 0.79 -0.04 -0.05 0.00 -0.41 0.00 0.00 32.23 32.52 1jzs h LYS 430 CO 0.02 0.43 -2.18 0.39 -2.27 0.00 0.00 179.45 175.84 1jzs n GLU 431 N -4.79 0.67 0.00 1.90 4.71 -1.23 -2.06 120.64 119.85 1jzs n GLU 431 Ca -0.04 -0.03 0.00 0.00 -0.01 0.00 0.00 57.16 57.08 1jzs n GLU 431 Cb 0.17 -1.55 0.00 0.00 -1.01 0.00 0.00 31.44 29.04 1jzs n GLU 431 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1jzs n GLY 432 N 1.58 1.02 0.31 0.62 0.00 0.13 -2.37 105.19 106.49 1jzs n GLY 432 Ca -0.23 -0.01 0.18 0.00 0.00 0.00 0.00 46.02 45.96 1jzs n GLY 432 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1jzs n ARG 433 N 0.00 -0.07 -0.10 1.61 5.12 -1.25 -0.97 116.66 121.00 1jzs n ARG 433 Ca 0.00 1.34 -0.14 0.00 -1.93 0.00 0.00 57.85 57.12 1jzs n ARG 433 Cb 0.00 -2.21 -0.14 0.00 -1.16 0.00 0.00 32.46 28.95 1jzs n ARG 433 CO 0.00 0.00 0.00 0.98 -1.93 0.00 0.00 177.63 176.68 1jzs n TYR 434 N -5.26 0.18 0.02 -1.55 9.36 -0.74 -3.91 117.16 115.26 1jzs n TYR 434 Ca 0.26 0.05 -0.12 0.00 3.32 0.00 0.00 57.90 61.41 1jzs n TYR 434 Cb 0.85 -1.03 -0.07 0.00 -0.63 0.00 0.00 39.34 38.47 1jzs n TYR 434 CO 0.00 0.00 0.00 0.78 0.22 0.00 0.00 176.86 177.86 1jzs h GLY 435 N 3.02 0.06 0.38 2.98 0.00 -0.96 -2.47 103.07 106.08 1jzs h GLY 435 Ca -0.53 -0.03 0.11 0.00 0.00 0.00 0.00 47.33 46.89 1jzs h GLY 435 CO -0.01 0.03 0.38 -2.09 0.00 0.00 0.00 176.54 174.85 1jzs h GLU 436 N -0.03 0.59 0.00 4.80 4.57 -0.67 -0.90 114.58 122.95 1jzs h GLU 436 Ca 0.01 -0.04 -0.05 0.00 -1.18 0.00 0.00 59.36 58.11 1jzs h GLU 436 Cb 0.08 -0.13 -0.01 0.00 -0.16 0.00 0.00 28.75 28.53 1jzs h GLU 436 CO -0.00 0.39 -0.22 2.35 -1.18 0.00 0.00 179.01 180.35 1jzs h TRP 437 N 0.61 0.00 -0.07 0.92 7.01 -1.60 -3.00 115.95 119.83 1jzs h TRP 437 Ca 0.39 0.00 -0.20 0.00 2.11 0.00 0.00 58.89 61.20 1jzs h TRP 437 Cb 0.47 0.00 -0.00 0.00 -2.10 0.00 0.00 29.16 27.53 1jzs h TRP 437 CO -0.11 0.22 -0.78 -0.07 -2.79 0.00 0.00 178.44 174.91 1jzs h LEU 438 N 0.00 0.52 -1.38 0.65 3.38 -0.72 -3.09 115.31 114.68 1jzs h LEU 438 Ca -0.00 -0.36 -0.02 0.00 0.09 0.00 0.00 57.88 57.58 1jzs h LEU 438 Cb 0.39 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.96 1jzs h LEU 438 CO 0.03 1.12 0.15 0.11 0.09 0.00 0.00 178.44 179.94 1jzs h LYS 439 N 0.28 0.57 -0.36 1.13 1.57 -1.35 -2.10 116.57 116.32 1jzs h LYS 439 Ca -0.04 -0.08 0.00 0.00 -1.87 0.00 0.00 60.65 58.66 1jzs h LYS 439 Cb 1.37 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 33.58 1jzs h LYS 439 CO 0.14 0.48 0.00 0.09 -0.57 0.00 0.00 179.45 179.59 1jzs n ASN 440 N -4.37 2.21 -4.25 0.86 5.03 -1.20 -5.00 115.26 108.53 1jzs n ASN 440 Ca 0.03 -1.93 -0.50 0.00 0.87 0.00 0.00 54.58 53.05 1jzs n ASN 440 Cb 0.15 -0.24 -0.05 0.00 -1.02 0.00 0.00 39.78 38.63 1jzs n ASN 440 CO 0.00 0.00 0.00 -0.11 -1.83 0.00 0.00 177.26 175.32 1jzs n LEU 441 N 0.69 -0.79 -4.18 3.41 -0.00 -0.79 -5.00 117.00 110.34 1jzs n LEU 441 Ca 0.15 1.09 -0.21 0.00 -0.00 0.00 0.00 56.01 57.05 1jzs n LEU 441 Cb 0.37 -0.90 -0.13 0.00 -0.00 0.00 0.00 43.42 42.76 1jzs n LEU 441 CO 0.11 -2.51 -0.48 -0.69 -0.00 0.00 0.00 177.39 173.82 1jzs s VAL 442 N -0.63 1.26 0.32 1.96 1.01 -1.26 -4.96 120.40 118.10 1jzs s VAL 442 Ca 0.70 -1.18 -0.26 0.00 0.00 0.00 0.00 61.98 61.25 1jzs s VAL 442 Cb -1.00 -1.15 -0.14 0.00 0.00 0.00 0.00 36.38 34.09 1jzs s VAL 442 CO 0.54 -0.04 0.74 0.47 0.00 0.00 0.00 175.10 176.81 1jzs n ASP 443 N 1.61 -0.00 -4.62 3.32 10.43 -1.26 -4.85 116.55 121.18 1jzs n ASP 443 Ca -0.19 1.07 -0.43 0.00 2.57 0.00 0.00 54.79 57.81 1jzs n ASP 443 Cb 0.54 -1.16 -0.02 0.00 1.84 0.00 0.00 41.12 42.32 1jzs n ASP 443 CO 0.00 0.00 0.00 0.86 -1.07 0.00 0.00 177.20 176.99 1jzs s TRP 444 N -1.20 3.01 -0.39 1.24 -0.11 -1.06 -4.84 118.94 115.60 1jzs s TRP 444 Ca 0.61 0.94 -0.29 0.00 1.22 0.00 0.00 56.10 58.59 1jzs s TRP 444 Cb -0.71 -3.97 0.02 0.00 -1.50 0.00 0.00 33.47 27.31 1jzs s TRP 444 CO 0.58 -0.97 1.13 0.00 -4.62 0.00 0.00 176.95 173.07 1jzs s ALA 445 N 3.93 3.33 -0.25 5.86 0.00 -1.26 -0.67 121.76 132.70 1jzs s ALA 445 Ca 0.45 -0.22 -0.09 0.00 0.00 0.00 0.00 51.96 52.10 1jzs s ALA 445 Cb -0.10 -3.78 -0.16 0.00 0.00 0.00 0.00 23.12 19.08 1jzs s ALA 445 CO 0.22 -1.86 -0.17 -0.11 0.00 0.00 0.00 175.76 173.84 1jzs n LEU 446 N 7.40 2.34 -4.68 0.00 7.94 -0.57 -4.62 117.00 124.80 1jzs n LEU 446 Ca 0.12 0.19 -0.38 0.00 -1.11 0.00 0.00 56.01 54.83 1jzs n LEU 446 Cb 0.48 -0.90 0.05 0.00 0.53 0.00 0.00 43.42 43.58 1jzs n LEU 446 CO 0.65 0.68 0.78 -1.54 -1.11 0.00 0.00 177.39 176.85 1jzs n SER 447 N -3.89 1.76 -3.71 1.96 3.41 -1.18 -1.64 113.62 110.34 1jzs n SER 447 Ca -0.47 0.89 -0.17 0.00 -0.26 0.00 0.00 58.87 58.86 1jzs n SER 447 Cb 0.91 -1.49 -0.17 0.00 -0.26 0.00 0.00 64.21 63.21 1jzs n SER 447 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 1jzs s ARG 448 N -2.86 -0.02 -1.40 4.33 1.81 -0.68 -4.65 118.95 115.48 1jzs s ARG 448 Ca 0.75 0.37 -0.09 0.00 -1.72 0.00 0.00 55.73 55.03 1jzs s ARG 448 Cb -0.42 -0.35 -0.07 0.00 -0.45 0.00 0.00 34.95 33.65 1jzs s ARG 448 CO 0.47 -0.26 2.95 0.09 -0.68 0.00 0.00 175.30 177.87 1jzs n ASN 449 N 4.87 8.27 0.00 0.23 4.13 -1.26 -1.75 115.26 129.75 1jzs n ASN 449 Ca -0.13 -2.66 0.00 0.00 1.68 0.00 0.00 54.58 53.47 1jzs n ASN 449 Cb 0.50 -1.51 0.00 0.00 -1.54 0.00 0.00 39.78 37.23 1jzs n ASN 449 CO 0.00 0.00 0.00 0.54 0.28 0.00 0.00 177.26 178.08 1jzs n ARG 450 N 3.14 3.54 0.00 3.52 5.12 -1.26 -4.79 116.66 125.92 1jzs n ARG 450 Ca 0.72 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 56.64 1jzs n ARG 450 Cb 0.31 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.61 1jzs n ARG 450 CO 0.00 0.00 0.00 0.66 -1.93 0.00 0.00 177.63 176.36 1jzs n TYR 451 N 0.00 0.00 -3.03 -1.55 4.02 -1.26 -4.66 117.16 110.68 1jzs n TYR 451 Ca 0.00 0.00 -0.44 0.00 -0.01 0.00 0.00 57.90 57.45 1jzs n TYR 451 Cb 0.00 0.12 -0.03 0.00 -0.02 0.00 0.00 39.34 39.41 1jzs n TYR 451 CO 0.00 0.00 0.00 -0.46 -1.01 0.00 0.00 176.86 175.39 1jzs s TRP 452 N -1.90 3.07 0.00 -0.72 -0.00 -1.26 -4.39 118.94 113.74 1jzs s TRP 452 Ca 0.00 -1.15 0.00 0.00 -0.00 0.00 0.00 56.10 54.95 1jzs s TRP 452 Cb 0.00 -4.13 0.00 0.00 -0.00 0.00 0.00 33.47 29.34 1jzs s TRP 452 CO 0.00 -1.38 0.00 0.41 -0.00 0.00 0.00 176.95 175.98 1jzs n GLY 453 N 5.19 -0.86 3.65 5.86 0.00 -1.26 -1.26 105.19 116.51 1jzs n GLY 453 Ca 0.05 -1.01 -0.43 0.00 0.00 0.00 0.00 46.02 44.64 1jzs n GLY 453 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1jzs s THR 454 N -2.00 3.56 0.94 2.61 2.01 -1.26 -4.45 115.64 117.06 1jzs s THR 454 Ca 0.00 0.66 -0.10 0.00 0.31 0.00 0.00 61.69 62.56 1jzs s THR 454 Cb 0.00 -3.49 0.16 0.00 0.01 0.00 0.00 72.50 69.18 1jzs s THR 454 CO 0.00 -0.13 1.14 -2.84 -0.69 0.00 0.00 174.62 172.10 1jzs s PRO 455 N 4.40 0.79 -0.40 4.92 0.02 -1.26 -1.61 135.00 141.85 1jzs s PRO 455 Ca 0.75 1.51 -0.14 0.00 0.02 0.00 0.00 61.00 63.13 1jzs s PRO 455 Cb -0.31 -1.70 0.02 0.00 0.02 0.00 0.00 34.50 32.53 1jzs s PRO 455 CO 0.30 -2.78 0.29 -1.17 -0.33 0.00 0.00 177.00 173.31 1jzs s LEU 456 N -6.70 5.04 0.00 -5.54 2.96 -0.85 -4.75 118.68 108.84 1jzs s LEU 456 Ca 0.67 -0.89 0.00 0.00 -0.22 0.00 0.00 54.13 53.69 1jzs s LEU 456 Cb -0.23 -2.14 0.00 0.00 0.50 0.00 0.00 46.19 44.32 1jzs s LEU 456 CO 0.59 -0.43 0.36 -0.81 -1.32 0.00 0.00 176.35 174.74 1jzs n PRO 457 N 5.14 0.20 -4.36 0.98 -0.04 -1.26 -4.59 135.00 131.07 1jzs n PRO 457 Ca -0.11 0.00 -0.34 0.00 -0.04 0.00 0.00 63.50 63.01 1jzs n PRO 457 Cb 0.47 -1.40 -0.12 0.00 -0.04 0.00 0.00 33.50 32.41 1jzs n PRO 457 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1jzs s ILE 458 N 1.47 3.85 -0.12 0.52 1.01 -1.26 -1.84 121.20 124.83 1jzs s ILE 458 Ca 0.00 -0.37 -0.02 0.00 0.00 0.00 0.00 60.65 60.26 1jzs s ILE 458 Cb 0.00 -2.69 -0.03 0.00 0.01 0.00 0.00 42.46 39.75 1jzs s ILE 458 CO 0.00 0.48 -0.04 0.26 0.00 0.00 0.00 174.94 175.64 1jzs s TRP 459 N 0.47 3.02 -0.08 3.97 0.51 0.11 -0.80 118.94 126.15 1jzs s TRP 459 Ca -0.03 -0.14 0.04 0.00 -2.12 0.00 0.00 56.10 53.85 1jzs s TRP 459 Cb -0.14 -1.86 -0.00 0.00 -0.81 0.00 0.00 33.47 30.65 1jzs s TRP 459 CO 0.03 0.14 -0.21 0.08 -0.51 0.00 0.00 176.95 176.48 1jzs s VAL 460 N -0.15 1.82 0.25 4.03 1.01 0.11 -1.04 120.40 126.41 1jzs s VAL 460 Ca 0.03 -0.90 -0.30 0.00 0.00 0.00 0.00 61.98 60.81 1jzs s VAL 460 Cb -0.13 -1.57 -0.09 0.00 0.00 0.00 0.00 36.38 34.59 1jzs s VAL 460 CO 0.02 0.51 1.21 0.00 0.00 0.00 0.00 175.10 176.84 1jzs n GLN 462 N 1.77 1.32 0.00 0.00 6.02 -1.09 -4.67 117.38 120.73 1jzs n GLN 462 Ca 0.02 -0.49 0.00 0.00 -0.01 0.00 0.00 57.00 56.52 1jzs n GLN 462 Cb 0.44 -1.30 0.00 0.00 1.02 0.00 0.00 30.24 30.39 1jzs n GLN 462 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1jzs n ALA 463 N -0.27 0.00 -1.31 -1.58 0.00 -1.26 -5.08 120.51 111.01 1jzs n ALA 463 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.57 1jzs n ALA 463 Cb 0.17 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.62 1jzs n ALA 463 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1jzs n GLY 465 N 5.00 0.60 0.46 0.00 0.00 -1.26 -4.82 105.19 105.17 1jzs n GLY 465 Ca 0.00 0.96 -0.03 0.00 0.00 0.00 0.00 46.02 46.95 1jzs n GLY 465 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1jzs n LYS 466 N 6.27 1.36 -1.93 1.61 2.85 -1.26 -4.13 118.16 122.93 1jzs n LYS 466 Ca 0.34 -0.41 0.00 0.00 -1.05 0.00 0.00 58.31 57.19 1jzs n LYS 466 Cb 0.12 0.04 0.00 0.00 -0.65 0.00 0.00 35.03 34.54 1jzs n LYS 466 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 1jzs n GLU 467 N -0.70 -2.06 -3.68 -1.58 1.02 -1.23 -4.79 120.64 107.62 1jzs n GLU 467 Ca -0.00 1.47 -0.10 0.00 -0.02 0.00 0.00 57.16 58.51 1jzs n GLU 467 Cb 0.07 -2.02 -0.09 0.00 -0.02 0.00 0.00 31.44 29.38 1jzs n GLU 467 CO 0.00 0.00 0.00 -2.00 1.18 0.00 0.00 177.13 176.31 1jzs s GLU 468 N -0.21 0.55 -0.07 3.49 2.12 -0.21 -4.98 118.70 119.39 1jzs s GLU 468 Ca 0.00 0.90 -0.06 0.00 0.36 0.00 0.00 54.97 56.17 1jzs s GLU 468 Cb 0.00 0.12 -0.04 0.00 0.26 0.00 0.00 34.13 34.47 1jzs s GLU 468 CO 0.00 -0.13 0.18 0.00 -0.54 0.00 0.00 175.26 174.77 1jzs s ALA 469 N 1.12 3.89 -0.18 6.30 0.00 -1.26 -0.71 121.76 130.92 1jzs s ALA 469 Ca -0.07 -0.65 -0.04 0.00 0.00 0.00 0.00 51.96 51.20 1jzs s ALA 469 Cb -0.06 -1.97 -0.02 0.00 0.00 0.00 0.00 23.12 21.07 1jzs s ALA 469 CO -0.11 0.66 -0.04 0.42 0.00 0.00 0.00 175.76 176.69 1jzs s ILE 470 N -1.15 3.69 -1.89 0.00 1.09 -0.77 -4.97 121.20 117.19 1jzs s ILE 470 Ca 0.21 -0.41 0.19 0.00 -1.10 0.00 0.00 60.65 59.53 1jzs s ILE 470 Cb -0.13 -2.64 0.04 0.00 -1.06 0.00 0.00 42.46 38.67 1jzs s ILE 470 CO 0.10 0.46 0.99 0.61 -0.10 0.00 0.00 174.94 177.00 1jzs n GLY 471 N 4.05 0.14 3.53 6.18 0.00 -1.26 -4.72 105.19 113.11 1jzs n GLY 471 Ca -0.18 -0.54 -0.09 0.00 0.00 0.00 0.00 46.02 45.21 1jzs n GLY 471 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1jzs s SER 472 N -1.98 -0.19 0.15 1.61 1.04 -1.26 -3.25 113.70 109.82 1jzs s SER 472 Ca 0.17 -0.62 -0.03 0.00 0.48 0.00 0.00 55.95 55.96 1jzs s SER 472 Cb 0.15 0.57 -0.03 0.00 0.10 0.00 0.00 66.02 66.81 1jzs s SER 472 CO 0.40 -1.07 1.36 -0.26 0.98 0.00 0.00 173.24 174.66 1jzs h PHE 473 N 2.24 0.57 -0.30 5.02 0.04 -1.95 -3.11 116.94 119.46 1jzs h PHE 473 Ca -0.28 -0.29 -0.04 0.00 2.80 0.00 0.00 57.97 60.17 1jzs h PHE 473 Cb 1.25 -0.07 -0.02 0.00 2.20 0.00 0.00 35.95 39.31 1jzs h PHE 473 CO 0.37 1.08 0.03 0.37 -0.60 0.00 0.00 178.31 179.57 1jzs h GLN 474 N 0.24 0.44 -0.23 1.51 4.15 -2.00 -0.79 115.11 118.42 1jzs h GLN 474 Ca -0.06 -0.07 -0.08 0.00 0.77 0.00 0.00 58.65 59.21 1jzs h GLN 474 Cb 1.47 -0.07 -0.01 0.00 0.21 0.00 0.00 27.48 29.07 1jzs h GLN 474 CO 0.15 0.44 -0.18 1.49 -1.93 0.00 0.00 178.83 178.79 1jzs h GLU 475 N 0.43 0.41 -0.04 1.69 4.81 -1.96 -2.77 114.58 117.15 1jzs h GLU 475 Ca 0.10 -0.13 -0.00 0.00 -0.13 0.00 0.00 59.36 59.20 1jzs h GLU 475 Cb 0.24 -0.04 -0.00 0.00 0.63 0.00 0.00 28.75 29.58 1jzs h GLU 475 CO 0.00 0.58 0.01 -0.07 -0.73 0.00 0.00 179.01 178.81 1jzs h LEU 476 N 0.37 0.06 -0.26 1.64 3.38 -1.11 -2.89 115.31 116.51 1jzs h LEU 476 Ca 0.07 -0.20 0.04 0.00 0.09 0.00 0.00 57.88 57.88 1jzs h LEU 476 Cb 0.54 -0.02 -0.07 0.00 0.09 0.00 0.00 40.66 41.20 1jzs h LEU 476 CO 0.04 0.25 -0.51 0.11 0.09 0.00 0.00 178.44 178.41 1jzs h LYS 477 N -0.12 -0.46 -0.03 1.13 1.79 -1.19 0.54 116.57 118.22 1jzs h LYS 477 Ca 0.01 0.03 0.01 0.00 -2.18 0.00 0.00 60.65 58.53 1jzs h LYS 477 Cb 0.21 0.10 -0.00 0.00 -1.58 0.00 0.00 32.23 30.96 1jzs h LYS 477 CO -0.00 -0.31 0.05 0.00 -1.08 0.00 0.00 179.45 178.11 1jzs h ALA 478 N -0.04 1.46 0.00 3.86 0.00 -1.50 -2.97 119.26 120.08 1jzs h ALA 478 Ca 0.07 -0.00 -0.25 0.00 0.00 0.00 0.00 54.91 54.73 1jzs h ALA 478 Cb 0.64 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.38 1jzs h ALA 478 CO -0.50 -0.07 -2.14 0.54 0.00 0.00 0.00 179.25 177.08 1jzs n ARG 479 N -3.64 0.99 -1.72 0.00 5.12 -0.74 -4.98 116.66 111.69 1jzs n ARG 479 Ca -0.02 -0.05 -0.42 0.00 -1.93 0.00 0.00 57.85 55.43 1jzs n ARG 479 Cb 0.14 -1.45 -0.03 0.00 -1.16 0.00 0.00 32.46 29.95 1jzs n ARG 479 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1jzs n ALA 480 N -2.55 2.58 1.65 7.54 0.00 0.18 -3.02 120.51 126.90 1jzs n ALA 480 Ca -0.23 0.40 0.07 0.00 0.00 0.00 0.00 53.44 53.68 1jzs n ALA 480 Cb 0.95 -2.49 0.42 0.00 0.00 0.00 0.00 19.45 18.33 1jzs n ALA 480 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1jzs n THR 481 N 3.45 0.00 -3.64 0.00 -2.24 -0.22 -4.63 114.28 107.00 1jzs n THR 481 Ca 0.14 0.00 -0.05 0.00 -2.27 0.00 0.00 64.05 61.88 1jzs n THR 481 Cb 0.35 -0.36 -0.06 0.00 -2.10 0.00 0.00 70.33 68.16 1jzs n THR 481 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1jzs s LYS 482 N -2.00 0.65 0.51 -0.78 1.02 -1.26 -5.09 119.74 112.79 1jzs s LYS 482 Ca 0.21 1.32 -0.19 0.00 0.02 0.00 0.00 55.97 57.34 1jzs s LYS 482 Cb 0.10 0.45 -0.12 0.00 -0.52 0.00 0.00 37.83 37.74 1jzs s LYS 482 CO 0.16 -0.17 0.29 -0.35 -0.92 0.00 0.00 175.35 174.37 1jzs n PRO 483 N 4.80 0.33 -2.19 -1.68 -0.04 -1.26 -4.95 135.00 130.00 1jzs n PRO 483 Ca -0.17 0.13 -0.29 0.00 -0.04 0.00 0.00 63.50 63.13 1jzs n PRO 483 Cb 0.55 -1.40 0.01 0.00 -0.04 0.00 0.00 33.50 32.62 1jzs n PRO 483 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1jzs s LEU 484 N 2.50 3.35 0.55 1.53 1.43 -1.26 -5.04 118.68 121.75 1jzs s LEU 484 Ca 0.63 1.16 -0.21 0.00 -1.03 0.00 0.00 54.13 54.69 1jzs s LEU 484 Cb -0.50 -4.13 -0.05 0.00 0.03 0.00 0.00 46.19 41.54 1jzs s LEU 484 CO 0.59 -0.82 1.26 -2.16 0.23 0.00 0.00 176.35 175.45 1jzs s PRO 485 N -5.02 3.15 0.07 1.29 0.04 -1.26 -4.94 135.00 128.34 1jzs s PRO 485 Ca 0.52 1.98 -0.15 0.00 0.04 0.00 0.00 61.00 63.39 1jzs s PRO 485 Cb -0.11 -2.13 -0.04 0.00 0.04 0.00 0.00 34.50 32.26 1jzs s PRO 485 CO 0.50 -1.11 1.26 0.93 0.04 0.00 0.00 177.00 178.63 1jzs h GLU 486 N 1.29 -0.05 -4.99 4.56 5.08 -2.05 -3.19 114.58 115.23 1jzs h GLU 486 Ca -0.50 0.00 -0.68 0.00 -1.00 0.00 0.00 59.36 57.18 1jzs h GLU 486 Cb 1.29 0.01 -0.18 0.00 0.50 0.00 0.00 28.75 30.37 1jzs h GLU 486 CO 0.57 -0.03 0.04 -1.25 -1.00 0.00 0.00 179.01 177.33 1jzs s PRO 487 N -4.24 3.13 -0.34 2.33 0.04 -1.26 -5.03 135.00 129.64 1jzs s PRO 487 Ca -0.06 -0.84 -0.22 0.00 0.04 0.00 0.00 61.00 59.91 1jzs s PRO 487 Cb 0.05 -4.08 0.00 0.00 0.04 0.00 0.00 34.50 30.51 1jzs s PRO 487 CO 0.30 -1.18 0.73 0.12 0.04 0.00 0.00 177.00 177.01 1jzs s PHE 488 N 2.61 3.15 -0.35 0.56 5.36 -1.21 -5.03 117.98 123.08 1jzs s PHE 488 Ca 0.15 0.57 -0.09 0.00 -0.96 0.00 0.00 56.93 56.61 1jzs s PHE 488 Cb -0.19 -3.26 0.02 0.00 -0.34 0.00 0.00 43.02 39.26 1jzs s PHE 488 CO 0.13 -0.64 0.15 0.34 -1.46 0.00 0.00 175.22 173.74 1jzs s ASP 489 N 1.76 5.51 -0.01 6.13 2.15 -1.26 -4.99 116.67 125.95 1jzs s ASP 489 Ca 0.29 -0.94 -0.06 0.00 0.43 0.00 0.00 52.55 52.27 1jzs s ASP 489 Cb -0.14 -1.96 -0.25 0.00 -0.30 0.00 0.00 42.92 40.27 1jzs s ASP 489 CO 0.15 -0.32 3.56 -0.81 -0.17 0.00 0.00 175.17 177.58 1jzs n PRO 490 N 4.92 1.98 -4.21 4.34 -0.04 -1.26 -4.53 135.00 136.20 1jzs n PRO 490 Ca -0.13 -1.01 -0.23 0.00 -0.04 0.00 0.00 63.50 62.10 1jzs n PRO 490 Cb 0.46 -1.98 -0.06 0.00 -0.04 0.00 0.00 33.50 31.89 1jzs n PRO 490 CO 0.00 0.00 0.00 -1.01 -0.04 0.00 0.00 175.50 174.45 1jzs s HIS 491 N 0.90 2.87 0.13 0.54 3.76 -1.26 -4.58 115.29 117.65 1jzs s HIS 491 Ca 0.65 -0.18 0.06 0.00 -0.15 0.00 0.00 55.06 55.44 1jzs s HIS 491 Cb 0.31 -1.29 0.45 0.00 1.11 0.00 0.00 32.58 33.17 1jzs s HIS 491 CO -0.01 0.57 0.58 -2.13 -0.85 0.00 0.00 174.74 172.91 1jzs n ARG 492 N -1.02 -0.02 0.06 1.40 3.00 -1.26 -1.50 116.66 117.32 1jzs n ARG 492 Ca -0.07 0.51 -0.21 0.00 -0.00 0.00 0.00 57.85 58.08 1jzs n ARG 492 Cb 0.59 -0.90 -0.15 0.00 0.00 0.00 0.00 32.46 32.00 1jzs n ARG 492 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.63 176.63 1jzs h PRO 493 N 0.00 0.34 0.00 -0.14 0.13 -1.93 -3.39 132.00 127.02 1jzs h PRO 493 Ca 0.29 -0.58 -0.20 0.00 -0.87 0.00 0.00 66.00 64.65 1jzs h PRO 493 Cb 0.75 0.22 -0.01 0.00 0.13 0.00 0.00 31.00 32.09 1jzs h PRO 493 CO -0.29 1.28 -0.88 1.88 -0.23 0.00 0.00 178.00 179.76 1jzs h TYR 494 N -0.23 0.29 0.00 1.56 -1.99 -1.54 -3.28 116.97 111.78 1jzs h TYR 494 Ca -0.21 -0.16 -0.01 0.00 2.00 0.00 0.00 58.73 60.35 1jzs h TYR 494 Cb 1.80 -0.03 -0.00 0.00 2.00 0.00 0.00 36.73 40.49 1jzs h TYR 494 CO 0.16 0.97 -0.05 -0.39 -0.00 0.00 0.00 178.16 178.86 1jzs h VAL 495 N 0.11 0.18 0.00 -2.88 -1.51 -1.69 -2.76 116.25 107.71 1jzs h VAL 495 Ca -0.04 -0.42 0.00 0.00 -1.23 0.00 0.00 66.70 65.01 1jzs h VAL 495 Cb 1.51 1.34 0.00 0.00 -2.13 0.00 0.00 31.29 32.01 1jzs h VAL 495 CO 0.13 0.05 0.00 0.47 -1.23 0.00 0.00 177.57 176.99 1jzs n ASP 496 N -3.25 0.35 -0.00 4.19 8.00 -1.24 -2.90 116.55 121.70 1jzs n ASP 496 Ca -0.01 0.56 0.11 0.00 0.71 0.00 0.00 54.79 56.16 1jzs n ASP 496 Cb 0.23 -0.64 0.08 0.00 -0.02 0.00 0.00 41.12 40.77 1jzs n ASP 496 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1jzs n GLN 497 N -1.85 0.01 -2.91 -1.24 1.13 -1.04 -4.83 117.38 106.65 1jzs n GLN 497 Ca 0.04 -0.01 -0.40 0.00 -1.94 0.00 0.00 57.00 54.69 1jzs n GLN 497 Cb 0.28 -1.50 -0.04 0.00 0.11 0.00 0.00 30.24 29.09 1jzs n GLN 497 CO 0.00 0.00 0.00 0.08 -1.44 0.00 0.00 177.06 175.70 1jzs s VAL 498 N -2.99 4.87 0.00 5.09 1.01 -1.14 -5.05 120.40 122.19 1jzs s VAL 498 Ca 0.10 1.71 0.06 0.00 0.00 0.00 0.00 61.98 63.84 1jzs s VAL 498 Cb 0.17 -4.16 -0.02 0.00 0.00 0.00 0.00 36.38 32.37 1jzs s VAL 498 CO 0.78 0.26 -0.19 -1.61 0.00 0.00 0.00 175.10 174.34 1jzs s GLU 499 N 0.56 1.42 0.42 2.72 2.02 -1.26 -4.58 118.70 120.00 1jzs s GLU 499 Ca 0.42 -0.73 0.08 0.00 0.02 0.00 0.00 54.97 54.76 1jzs s GLU 499 Cb -0.20 -1.42 -0.00 0.00 0.10 0.00 0.00 34.13 32.61 1jzs s GLU 499 CO 0.23 0.38 0.49 -0.51 0.02 0.00 0.00 175.26 175.87 1jzs s LEU 500 N -0.67 3.54 -0.25 1.80 1.43 -1.04 -1.06 118.68 122.44 1jzs s LEU 500 Ca 0.07 -0.56 -0.12 0.00 -1.03 0.00 0.00 54.13 52.48 1jzs s LEU 500 Cb -0.08 -2.39 -0.05 0.00 0.03 0.00 0.00 46.19 43.71 1jzs s LEU 500 CO 0.00 -0.73 0.25 0.00 0.23 0.00 0.00 176.35 176.10 1jzs s ALA 501 N -2.41 3.57 0.12 4.21 0.00 -1.17 -1.42 121.76 124.66 1jzs s ALA 501 Ca 0.52 -0.88 -0.30 0.00 0.00 0.00 0.00 51.96 51.31 1jzs s ALA 501 Cb -0.07 -2.50 -0.06 0.00 0.00 0.00 0.00 23.12 20.49 1jzs s ALA 501 CO 0.31 -0.41 0.97 0.00 0.00 0.00 0.00 175.76 176.63 1jzs n ALA 503 N 2.76 0.33 -0.18 0.00 0.00 -1.26 0.11 120.51 122.27 1jzs n ALA 503 Ca 0.02 1.00 -0.01 0.00 0.00 0.00 0.00 53.44 54.45 1jzs n ALA 503 Cb 0.49 -0.65 0.08 0.00 0.00 0.00 0.00 19.45 19.37 1jzs n ALA 503 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1jzs n GLY 505 N -1.31 1.83 0.00 0.00 0.00 0.31 -5.13 105.19 100.89 1jzs n GLY 505 Ca 0.07 -0.16 0.00 0.00 0.00 0.00 0.00 46.02 45.93 1jzs n GLY 505 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1jzs n GLY 506 N 0.00 -1.78 3.19 -0.02 0.00 -1.25 -4.58 105.19 100.74 1jzs n GLY 506 Ca 0.00 -0.81 -0.10 0.00 0.00 0.00 0.00 46.02 45.11 1jzs n GLY 506 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1jzs s THR 507 N 0.00 0.09 0.01 2.61 -4.23 -1.26 -2.38 115.64 110.47 1jzs s THR 507 Ca 0.00 -1.83 0.08 0.00 -1.18 0.00 0.00 61.69 58.77 1jzs s THR 507 Cb 0.00 -2.05 -0.02 0.00 1.34 0.00 0.00 72.50 71.77 1jzs s THR 507 CO 0.00 -0.39 -0.25 -0.04 -0.54 0.00 0.00 174.62 173.39 1jzs s MET 508 N -4.04 1.90 -0.02 3.99 1.00 -0.51 -2.68 119.30 118.94 1jzs s MET 508 Ca 0.24 -0.98 0.07 0.00 0.00 0.00 0.00 55.69 55.02 1jzs s MET 508 Cb 0.07 -1.94 -0.02 0.00 0.00 0.00 0.00 34.83 32.94 1jzs s MET 508 CO 0.02 0.52 -0.24 1.03 0.00 0.00 0.00 175.02 176.36 1jzs s ARG 509 N -0.88 1.99 0.52 2.03 1.81 -0.75 -2.49 118.95 121.19 1jzs s ARG 509 Ca 0.10 -0.85 -0.18 0.00 -1.72 0.00 0.00 55.73 53.09 1jzs s ARG 509 Cb -0.10 -1.89 -0.07 0.00 -0.45 0.00 0.00 34.95 32.45 1jzs s ARG 509 CO 0.00 0.49 1.02 -0.98 -0.68 0.00 0.00 175.30 175.15 1jzs s ARG 510 N -0.50 3.74 1.08 3.54 1.70 -1.26 -0.71 118.95 126.54 1jzs s ARG 510 Ca 0.07 1.15 -0.12 0.00 -0.47 0.00 0.00 55.73 56.36 1jzs s ARG 510 Cb -0.10 -2.10 0.23 0.00 -0.57 0.00 0.00 34.95 32.41 1jzs s ARG 510 CO -0.00 -0.45 1.00 1.33 -1.08 0.00 0.00 175.30 176.09 1jzs n VAL 511 N -1.47 0.00 1.20 4.99 0.24 0.02 -4.88 118.33 118.43 1jzs n VAL 511 Ca 0.08 -0.27 0.13 0.00 -2.04 0.00 0.00 64.34 62.23 1jzs n VAL 511 Cb 0.53 -0.97 0.28 0.00 -1.47 0.00 0.00 33.84 32.21 1jzs n VAL 511 CO 0.00 0.00 0.00 -0.81 -2.14 0.00 0.00 176.83 173.88 1jzs n PRO 512 N -4.50 1.17 -1.37 7.34 -0.04 -1.26 -4.89 135.00 131.45 1jzs n PRO 512 Ca 0.06 -0.80 -0.31 0.00 -0.04 0.00 0.00 63.50 62.41 1jzs n PRO 512 Cb 0.54 -1.48 0.08 0.00 -0.04 0.00 0.00 33.50 32.59 1jzs n PRO 512 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 1jzs s TYR 513 N -2.38 2.75 0.52 0.54 1.51 -1.26 -4.87 117.35 114.16 1jzs s TYR 513 Ca 0.25 1.48 0.04 0.00 -1.01 0.00 0.00 57.07 57.84 1jzs s TYR 513 Cb 0.19 -3.00 0.01 0.00 -0.11 0.00 0.00 41.96 39.06 1jzs s TYR 513 CO 0.49 -1.64 0.26 0.08 -1.11 0.00 0.00 175.55 173.63 1jzs s VAL 514 N -2.96 1.55 0.19 0.71 1.01 -0.72 -2.01 120.40 118.17 1jzs s VAL 514 Ca 0.60 -1.67 0.09 0.00 0.00 0.00 0.00 61.98 61.00 1jzs s VAL 514 Cb -0.16 -2.22 -0.04 0.00 0.00 0.00 0.00 36.38 33.95 1jzs s VAL 514 CO 0.56 0.00 -0.07 -0.63 0.00 0.00 0.00 175.10 174.96 1jzs s ILE 515 N -2.79 3.31 0.30 2.22 1.09 -0.64 -1.68 121.20 123.01 1jzs s ILE 515 Ca 0.25 -1.66 -0.30 0.00 -1.10 0.00 0.00 60.65 57.85 1jzs s ILE 515 Cb -0.01 -2.66 -0.12 0.00 -1.06 0.00 0.00 42.46 38.62 1jzs s ILE 515 CO 0.15 -0.15 1.59 -0.67 -0.10 0.00 0.00 174.94 175.77 1jzs n ASP 516 N -0.11 3.85 0.30 3.58 2.03 -0.65 -4.67 116.55 120.86 1jzs n ASP 516 Ca -0.10 1.15 0.16 0.00 0.52 0.00 0.00 54.79 56.52 1jzs n ASP 516 Cb 0.56 -1.59 0.92 0.00 -0.72 0.00 0.00 41.12 40.29 1jzs n ASP 516 CO 0.00 0.00 0.00 1.62 -1.92 0.00 0.00 177.20 176.90 1jzs h VAL 517 N 3.33 0.46 0.00 5.18 3.04 -1.93 -1.55 116.25 124.78 1jzs h VAL 517 Ca -0.47 -0.09 0.00 0.00 -1.01 0.00 0.00 66.70 65.13 1jzs h VAL 517 Cb 1.23 1.06 0.00 0.00 -2.01 0.00 0.00 31.29 31.57 1jzs h VAL 517 CO 0.78 0.02 0.00 -0.50 -1.01 0.00 0.00 177.57 176.86 1jzs h TRP 518 N 0.00 0.00 -0.12 3.17 4.06 -1.97 -2.65 115.95 118.44 1jzs h TRP 518 Ca -0.00 0.00 -0.05 0.00 2.06 0.00 0.00 58.89 60.90 1jzs h TRP 518 Cb 0.06 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 28.22 1jzs h TRP 518 CO 0.00 0.00 -0.12 -0.92 -3.56 0.00 0.00 178.44 173.84 1jzs h TYR 519 N 0.00 0.34 0.28 0.49 3.20 -1.65 -0.66 116.97 118.97 1jzs h TYR 519 Ca 0.00 -0.10 0.00 0.00 3.14 0.00 0.00 58.73 61.77 1jzs h TYR 519 Cb 0.73 -0.07 -0.04 0.00 1.54 0.00 0.00 36.73 38.89 1jzs h TYR 519 CO 0.00 0.70 -0.52 -0.44 -1.64 0.00 0.00 178.16 176.25 1jzs h ASP 520 N -0.11 -1.52 -0.15 -2.11 3.32 -1.56 0.14 116.42 114.43 1jzs h ASP 520 Ca 0.02 0.15 0.04 0.00 0.02 0.00 0.00 57.03 57.26 1jzs h ASP 520 Cb 0.64 0.54 -0.01 0.00 0.22 0.00 0.00 39.33 40.72 1jzs h ASP 520 CO 0.03 -0.61 0.18 0.28 -1.72 0.00 0.00 179.24 177.40 1jzs h SER 521 N -0.86 0.00 0.74 6.45 0.02 -1.50 -2.55 113.55 115.85 1jzs h SER 521 Ca -0.03 0.00 -0.25 0.00 -0.84 0.00 0.00 61.79 60.67 1jzs h SER 521 Cb 0.81 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 63.33 1jzs h SER 521 CO -0.20 0.00 -1.29 1.23 -1.14 0.00 0.00 176.83 175.43 1jzs h GLY 522 N 0.00 0.08 0.93 -3.77 0.00 0.60 -3.26 103.07 97.65 1jzs h GLY 522 Ca 0.07 -0.21 0.00 0.00 0.00 0.00 0.00 47.33 47.19 1jzs h GLY 522 CO -0.00 0.18 0.00 0.00 0.00 0.00 0.00 176.54 176.72 1jzs n ALA 523 N -2.48 2.68 -0.31 3.60 0.00 0.28 -4.32 120.51 119.97 1jzs n ALA 523 Ca -0.08 -0.19 0.15 0.00 0.00 0.00 0.00 53.44 53.32 1jzs n ALA 523 Cb 0.99 -1.49 0.32 0.00 0.00 0.00 0.00 19.45 19.28 1jzs n ALA 523 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 177.50 179.48 1jzs h MET 524 N 0.02 0.21 -0.90 0.00 4.05 -1.59 -0.78 114.93 115.93 1jzs h MET 524 Ca 0.00 -0.01 0.19 0.00 -0.28 0.00 0.00 59.70 59.60 1jzs h MET 524 Cb 0.00 -0.05 -0.07 0.00 -0.80 0.00 0.00 31.60 30.69 1jzs h MET 524 CO 0.00 0.14 0.59 -1.35 0.23 0.00 0.00 176.91 176.52 1jzs h PRO 525 N 0.21 0.48 0.00 0.39 0.11 -1.88 -2.46 132.00 128.85 1jzs h PRO 525 Ca 0.59 -0.03 -0.08 0.00 0.11 0.00 0.00 66.00 66.59 1jzs h PRO 525 Cb 1.22 -0.11 -0.02 0.00 0.11 0.00 0.00 31.00 32.20 1jzs h PRO 525 CO -0.66 0.32 -1.53 1.97 -0.21 0.00 0.00 178.00 177.89 1jzs n PHE 526 N -4.55 0.00 0.13 0.65 1.16 -0.92 -4.62 117.46 109.31 1jzs n PHE 526 Ca 0.19 0.00 -0.01 0.00 -1.87 0.00 0.00 57.45 55.76 1jzs n PHE 526 Cb 0.64 -0.33 0.11 0.00 -1.61 0.00 0.00 39.48 38.29 1jzs n PHE 526 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 1jzs h ALA 527 N 0.68 0.78 0.00 1.98 0.00 -1.12 -2.88 119.26 118.69 1jzs h ALA 527 Ca -0.12 -0.59 0.00 0.00 0.00 0.00 0.00 54.91 54.20 1jzs h ALA 527 Cb 0.99 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.67 1jzs h ALA 527 CO 0.01 0.82 0.00 0.66 0.00 0.00 0.00 179.25 180.73 1jzs h SER 528 N 0.00 0.00 -1.85 0.00 4.64 -1.66 -3.39 113.55 111.29 1jzs h SER 528 Ca -0.01 0.00 -0.52 0.00 -0.47 0.00 0.00 61.79 60.79 1jzs h SER 528 Cb 1.27 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 63.30 1jzs h SER 528 CO 0.08 0.00 -0.49 -0.76 -0.87 0.00 0.00 176.83 174.80 1jzs s LEU 529 N -4.87 3.43 -0.52 5.97 1.43 -1.10 -4.94 118.68 118.07 1jzs s LEU 529 Ca 0.02 -0.64 -0.01 0.00 -1.03 0.00 0.00 54.13 52.46 1jzs s LEU 529 Cb 0.09 -1.98 0.37 0.00 0.03 0.00 0.00 46.19 44.71 1jzs s LEU 529 CO 0.38 -0.34 2.01 1.57 0.23 0.00 0.00 176.35 180.20 1jzs n HIS 530 N -1.27 2.59 0.00 0.29 -0.00 -1.26 -4.86 115.22 110.71 1jzs n HIS 530 Ca -0.02 -2.56 0.00 0.00 -0.00 0.00 0.00 57.72 55.14 1jzs n HIS 530 Cb 0.61 -1.24 0.00 0.00 -0.00 0.00 0.00 29.99 29.36 1jzs n HIS 530 CO 0.00 0.00 0.00 0.98 -0.00 0.00 0.00 176.34 177.32 1jzs n TYR 531 N -0.47 0.00 -0.28 1.57 9.36 -1.13 -0.99 117.16 125.22 1jzs n TYR 531 Ca 0.50 0.00 0.06 0.00 3.32 0.00 0.00 57.90 61.78 1jzs n TYR 531 Cb 0.69 0.00 0.16 0.00 -0.63 0.00 0.00 39.34 39.56 1jzs n TYR 531 CO 0.00 0.00 0.00 -1.00 0.22 0.00 0.00 176.86 176.08 1jzs h PRO 532 N 0.00 0.06 0.00 2.98 0.13 -1.90 -1.15 132.00 132.11 1jzs h PRO 532 Ca 0.00 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1jzs h PRO 532 Cb 0.00 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 31.12 1jzs h PRO 532 CO 0.00 0.04 0.00 0.74 -0.23 0.00 0.00 178.00 178.55 1jzs h PHE 533 N 0.06 0.00 -3.87 1.56 -1.00 -1.48 -3.46 116.94 108.75 1jzs h PHE 533 Ca 0.44 0.00 -0.23 0.00 2.81 0.00 0.00 57.97 60.99 1jzs h PHE 533 Cb 0.77 0.00 -0.06 0.00 3.61 0.00 0.00 35.95 40.27 1jzs h PHE 533 CO -0.49 0.00 -0.07 -1.21 -1.61 0.00 0.00 178.31 174.93 1jzs s GLU 534 N -3.38 2.05 -0.06 1.51 2.02 -0.44 -4.95 118.70 115.45 1jzs s GLU 534 Ca 0.05 -1.73 0.00 0.00 0.02 0.00 0.00 54.97 53.31 1jzs s GLU 534 Cb 0.08 0.49 0.00 0.00 0.10 0.00 0.00 34.13 34.80 1jzs s GLU 534 CO 0.59 -0.88 0.00 0.72 0.02 0.00 0.00 175.26 175.70 1jzs n HIS 535 N -0.58 -1.70 -0.38 1.61 8.25 -1.26 -3.69 115.22 117.47 1jzs n HIS 535 Ca -0.01 0.00 0.31 0.00 -0.26 0.00 0.00 57.72 57.76 1jzs n HIS 535 Cb 0.61 -1.08 0.58 0.00 1.12 0.00 0.00 29.99 31.21 1jzs n HIS 535 CO 0.00 0.00 0.00 1.49 0.64 0.00 0.00 176.34 178.47 1jzs h GLU 536 N 0.00 0.16 0.04 -0.41 4.22 -1.88 0.43 114.58 117.14 1jzs h GLU 536 Ca -0.01 -0.01 -0.23 0.00 0.08 0.00 0.00 59.36 59.18 1jzs h GLU 536 Cb 0.74 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.94 1jzs h GLU 536 CO 0.02 0.11 -1.09 1.05 -2.18 0.00 0.00 179.01 176.91 1jzs h GLU 537 N 0.17 0.09 -0.01 1.92 9.09 -1.96 -2.97 114.58 120.91 1jzs h GLU 537 Ca 0.78 -0.15 -0.20 0.00 0.05 0.00 0.00 59.36 59.84 1jzs h GLU 537 Cb 2.17 0.06 -0.01 0.00 -1.65 0.00 0.00 28.75 29.32 1jzs h GLU 537 CO -0.52 1.06 -0.88 0.28 0.05 0.00 0.00 179.01 179.01 1jzs h VAL 538 N 0.02 1.45 -0.33 -1.06 2.07 -0.63 -3.14 116.25 114.64 1jzs h VAL 538 Ca -0.06 -2.50 -0.01 0.00 0.82 0.00 0.00 66.70 64.95 1jzs h VAL 538 Cb 1.84 2.40 -0.02 0.00 -1.52 0.00 0.00 31.29 34.00 1jzs h VAL 538 CO 0.15 0.74 0.17 0.15 0.02 0.00 0.00 177.57 178.80 1jzs h PHE 539 N 0.16 0.46 0.00 1.57 3.57 -0.97 -2.72 116.94 119.02 1jzs h PHE 539 Ca -0.05 -0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.43 1jzs h PHE 539 Cb 1.50 -0.15 -0.00 0.00 2.79 0.00 0.00 35.95 40.09 1jzs h PHE 539 CO 0.04 0.39 -0.02 0.00 -2.23 0.00 0.00 178.31 176.49 1jzs h ARG 540 N 0.40 0.00 -0.02 1.11 3.08 -1.50 -1.38 114.38 116.08 1jzs h ARG 540 Ca 0.11 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.16 1jzs h ARG 540 Cb 0.09 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.14 1jzs h ARG 540 CO -0.02 0.02 -0.18 0.39 -1.07 0.00 0.00 179.97 179.11 1jzs n GLU 541 N -3.40 1.62 0.00 0.04 1.02 -1.03 -4.46 120.64 114.43 1jzs n GLU 541 Ca -0.03 -1.22 0.00 0.00 -0.02 0.00 0.00 57.16 55.90 1jzs n GLU 541 Cb 0.11 -1.47 0.00 0.00 -0.02 0.00 0.00 31.44 30.06 1jzs n GLU 541 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 1jzs n SER 542 N 0.37 0.00 0.00 1.62 3.41 -0.97 -4.91 113.62 113.14 1jzs n SER 542 Ca 0.13 -1.00 0.00 0.00 -0.26 0.00 0.00 58.87 57.74 1jzs n SER 542 Cb 0.47 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.42 1jzs n SER 542 CO 0.00 0.00 0.00 0.33 -0.16 0.00 0.00 175.04 175.21 1jzs n PHE 543 N 0.00 0.00 -1.92 7.33 7.35 -0.56 -3.99 117.46 125.67 1jzs n PHE 543 Ca 0.00 0.00 -0.42 0.00 -0.76 0.00 0.00 57.45 56.27 1jzs n PHE 543 Cb 0.48 -0.41 -0.03 0.00 0.35 0.00 0.00 39.48 39.87 1jzs n PHE 543 CO 0.00 0.00 0.00 -2.14 -0.76 0.00 0.00 176.76 173.86 1jzs s PRO 544 N -2.47 4.18 0.88 -7.13 0.02 -1.26 -4.75 135.00 124.46 1jzs s PRO 544 Ca 0.00 2.32 -0.12 0.00 0.02 0.00 0.00 61.00 63.22 1jzs s PRO 544 Cb 0.00 -3.91 0.12 0.00 0.02 0.00 0.00 34.50 30.73 1jzs s PRO 544 CO 0.00 -0.83 1.11 0.00 -0.33 0.00 0.00 177.00 176.95 1jzs s ALA 545 N 3.72 1.82 -0.08 -1.55 0.00 -0.72 -4.89 121.76 120.05 1jzs s ALA 545 Ca 0.77 -0.33 0.21 0.00 0.00 0.00 0.00 51.96 52.61 1jzs s ALA 545 Cb -0.37 -3.09 -0.29 0.00 0.00 0.00 0.00 23.12 19.37 1jzs s ALA 545 CO 0.33 -2.16 0.43 -0.25 0.00 0.00 0.00 175.76 174.11 1jzs n ASP 546 N -3.71 0.09 -3.57 0.00 9.92 -0.04 -1.95 116.55 117.28 1jzs n ASP 546 Ca 0.07 0.03 -0.16 0.00 -0.53 0.00 0.00 54.79 54.20 1jzs n ASP 546 Cb 0.57 1.61 -0.07 0.00 -0.64 0.00 0.00 41.12 42.60 1jzs n ASP 546 CO 0.00 0.00 0.00 0.12 0.13 0.00 0.00 177.20 177.45 1jzs s PHE 547 N -3.25 -0.68 0.12 1.24 2.19 -1.23 -2.58 117.98 113.78 1jzs s PHE 547 Ca -0.08 1.36 -0.08 0.00 0.33 0.00 0.00 56.93 58.46 1jzs s PHE 547 Cb 0.12 0.35 -0.01 0.00 -1.31 0.00 0.00 43.02 42.16 1jzs s PHE 547 CO 0.88 -0.52 0.21 0.96 1.83 0.00 0.00 175.22 178.58 1jzs s ILE 548 N -0.65 0.11 -0.32 3.12 -4.36 -1.17 -3.28 121.20 114.66 1jzs s ILE 548 Ca -0.07 -1.33 0.04 0.00 -0.26 0.00 0.00 60.65 59.03 1jzs s ILE 548 Cb -0.02 -1.58 0.19 0.00 1.25 0.00 0.00 42.46 42.31 1jzs s ILE 548 CO 0.07 -0.52 0.67 0.00 0.24 0.00 0.00 174.94 175.40 1jzs s ALA 549 N -3.91 -2.68 0.00 2.27 0.00 -1.26 -3.02 121.76 113.16 1jzs s ALA 549 Ca 0.11 0.93 0.00 0.00 0.00 0.00 0.00 51.96 53.00 1jzs s ALA 549 Cb 0.05 -2.64 0.00 0.00 0.00 0.00 0.00 23.12 20.53 1jzs s ALA 549 CO -0.06 -1.97 0.00 0.39 0.00 0.00 0.00 175.76 174.12 1jzs n GLU 550 N 5.11 1.50 -2.59 0.00 -0.58 -1.22 -4.74 120.64 118.12 1jzs n GLU 550 Ca 0.07 0.00 -0.30 0.00 -0.42 0.00 0.00 57.16 56.51 1jzs n GLU 550 Cb 0.55 0.00 -0.02 0.00 -0.57 0.00 0.00 31.44 31.41 1jzs n GLU 550 CO 0.00 0.00 0.00 0.20 -0.48 0.00 0.00 177.13 176.85 1jzs s GLY 551 N -0.91 1.81 0.40 0.62 0.00 -1.26 -2.90 107.32 105.07 1jzs s GLY 551 Ca 0.00 -0.21 0.20 0.00 0.00 0.00 0.00 44.72 44.71 1jzs s GLY 551 CO 0.00 0.00 1.73 1.19 0.00 0.00 0.00 173.10 176.02 1jzs h ILE 552 N 0.65 0.43 0.00 0.90 6.09 -1.63 0.78 117.51 124.73 1jzs h ILE 552 Ca -0.47 -0.12 0.00 0.00 -1.37 0.00 0.00 64.86 62.91 1jzs h ILE 552 Cb 1.19 0.06 0.00 0.00 0.47 0.00 0.00 36.82 38.54 1jzs h ILE 552 CO 0.63 0.06 0.00 -0.90 -3.07 0.00 0.00 178.15 174.87 1jzs n ASP 553 N -4.69 0.00 -0.17 2.19 3.85 -1.26 -1.04 116.55 115.42 1jzs n ASP 553 Ca 0.28 0.41 0.15 0.00 -0.71 0.00 0.00 54.79 54.92 1jzs n ASP 553 Cb 0.99 -0.42 0.78 0.00 -1.35 0.00 0.00 41.12 41.12 1jzs n ASP 553 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 1jzs n GLN 554 N -1.42 1.24 0.00 0.11 1.13 0.27 -2.95 117.38 115.76 1jzs n GLN 554 Ca 0.01 -0.34 0.08 0.00 -1.94 0.00 0.00 57.00 54.81 1jzs n GLN 554 Cb 0.03 -1.48 0.38 0.00 0.11 0.00 0.00 30.24 29.28 1jzs n GLN 554 CO 0.00 0.00 0.00 0.25 -1.44 0.00 0.00 177.06 175.87 1jzs n THR 555 N -0.57 0.76 -0.31 5.09 -2.24 -0.21 -1.88 114.28 114.92 1jzs n THR 555 Ca 0.22 0.19 0.02 0.00 -2.27 0.00 0.00 64.05 62.21 1jzs n THR 555 Cb 0.20 -0.89 0.03 0.00 -2.10 0.00 0.00 70.33 67.56 1jzs n THR 555 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1jzs n ARG 556 N -1.47 2.41 0.00 -0.78 5.12 -1.15 -4.61 116.66 116.18 1jzs n ARG 556 Ca 0.05 -1.62 0.00 0.00 -1.93 0.00 0.00 57.85 54.35 1jzs n ARG 556 Cb 0.19 -1.05 0.00 0.00 -1.16 0.00 0.00 32.46 30.45 1jzs n ARG 556 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1jzs n GLY 557 N -0.63 1.92 0.14 -0.13 0.00 -0.79 -4.62 105.19 101.07 1jzs n GLY 557 Ca 0.03 -0.21 -0.12 0.00 0.00 0.00 0.00 46.02 45.73 1jzs n GLY 557 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 173.32 173.07 1jzs h TRP 558 N 0.00 0.40 -0.79 1.61 7.01 -1.90 -2.18 115.95 120.10 1jzs h TRP 558 Ca 0.00 -0.07 0.14 0.00 2.11 0.00 0.00 58.89 61.07 1jzs h TRP 558 Cb 0.00 -0.10 -0.09 0.00 -2.10 0.00 0.00 29.16 26.86 1jzs h TRP 558 CO 0.00 0.56 0.36 0.74 -2.79 0.00 0.00 178.44 177.31 1jzs h PHE 559 N 0.12 0.62 -0.36 2.65 0.05 -1.88 -0.37 116.94 117.77 1jzs h PHE 559 Ca 0.06 0.03 -0.16 0.00 3.82 0.00 0.00 57.97 61.72 1jzs h PHE 559 Cb 0.41 -0.15 -0.01 0.00 2.00 0.00 0.00 35.95 38.20 1jzs h PHE 559 CO 0.04 0.12 -0.41 -0.97 -0.18 0.00 0.00 178.31 176.91 1jzs h ASN 560 N 0.52 0.96 1.61 2.17 -0.73 -1.63 -2.38 115.58 116.09 1jzs h ASN 560 Ca 0.43 -0.45 -0.07 0.00 1.87 0.00 0.00 56.30 58.09 1jzs h ASN 560 Cb 0.62 -0.27 -0.01 0.00 0.27 0.00 0.00 38.32 38.93 1jzs h ASN 560 CO -0.38 1.23 -0.40 0.77 -0.37 0.00 0.00 177.43 178.29 1jzs h SER 561 N 0.72 0.00 0.51 1.15 4.64 -1.09 -2.44 113.55 117.04 1jzs h SER 561 Ca 0.05 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.35 1jzs h SER 561 Cb 0.99 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 63.09 1jzs h SER 561 CO 0.10 0.30 -0.25 -0.07 -0.87 0.00 0.00 176.83 176.04 1jzs h LEU 562 N 0.00 -0.59 -0.15 5.97 3.38 -1.06 -2.76 115.31 120.11 1jzs h LEU 562 Ca -0.01 -0.06 0.05 0.00 0.09 0.00 0.00 57.88 57.95 1jzs h LEU 562 Cb 1.24 0.15 -0.06 0.00 0.09 0.00 0.00 40.66 42.07 1jzs h LEU 562 CO 0.04 -0.25 -0.31 -0.74 0.09 0.00 0.00 178.44 177.27 1jzs h HIS 563 N -0.94 -0.84 0.00 1.13 2.76 -1.46 -1.68 115.15 114.13 1jzs h HIS 563 Ca -0.07 0.04 -0.02 0.00 -2.20 0.00 0.00 60.37 58.12 1jzs h HIS 563 Cb 0.61 0.39 -0.00 0.00 1.55 0.00 0.00 27.41 29.96 1jzs h HIS 563 CO 0.00 -0.38 -0.08 1.96 -1.30 0.00 0.00 177.93 178.13 1jzs h GLN 564 N -0.37 0.00 0.01 5.26 4.20 -1.50 -2.25 115.11 120.45 1jzs h GLN 564 Ca 0.10 0.00 -0.24 0.00 0.06 0.00 0.00 58.65 58.57 1jzs h GLN 564 Cb 0.53 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.27 1jzs h GLN 564 CO -0.35 0.08 -1.26 -0.07 -0.67 0.00 0.00 178.83 176.56 1jzs h LEU 565 N 0.00 0.03 -0.31 1.46 4.07 -1.16 -2.60 115.31 116.80 1jzs h LEU 565 Ca -0.00 -0.04 -0.03 0.00 0.08 0.00 0.00 57.88 57.89 1jzs h LEU 565 Cb 0.15 -0.01 -0.01 0.00 1.08 0.00 0.00 40.66 41.87 1jzs h LEU 565 CO 0.01 1.03 0.06 1.23 -1.08 0.00 0.00 178.44 179.69 1jzs h GLY 566 N 3.08 0.55 1.36 0.83 0.00 -0.95 -1.86 103.07 106.08 1jzs h GLY 566 Ca -0.11 -0.35 -0.21 0.00 0.00 0.00 0.00 47.33 46.65 1jzs h GLY 566 CO 0.12 0.33 -0.80 -2.08 0.00 0.00 0.00 176.54 174.10 1jzs h VAL 567 N 0.34 1.32 0.00 4.60 2.07 -0.63 -0.70 116.25 123.26 1jzs h VAL 567 Ca 0.10 -2.10 -0.11 0.00 0.82 0.00 0.00 66.70 65.40 1jzs h VAL 567 Cb 0.32 2.10 -0.02 0.00 -1.52 0.00 0.00 31.29 32.18 1jzs h VAL 567 CO 0.00 0.65 -0.55 0.24 0.02 0.00 0.00 177.57 177.93 1jzs h MET 568 N 0.41 0.00 0.00 1.57 2.07 -1.48 -2.06 114.93 115.44 1jzs h MET 568 Ca -0.05 0.00 -0.37 0.00 -2.07 0.00 0.00 59.70 57.21 1jzs h MET 568 Cb 1.42 0.00 -0.07 0.00 -1.87 0.00 0.00 31.60 31.08 1jzs h MET 568 CO 0.15 0.55 -2.39 1.28 1.07 0.00 0.00 176.91 177.57 1jzs n LEU 569 N -3.24 2.77 -0.15 1.22 4.77 -0.70 -4.68 117.00 116.98 1jzs n LEU 569 Ca 0.02 -0.12 0.08 0.00 -0.03 0.00 0.00 56.01 55.95 1jzs n LEU 569 Cb 0.75 -0.76 0.11 0.00 -2.33 0.00 0.00 43.42 41.19 1jzs n LEU 569 CO 0.41 0.88 0.51 0.49 -1.33 0.00 0.00 177.39 178.35 1jzs n PHE 570 N -3.18 0.00 -4.18 -1.77 3.01 -0.65 -5.00 117.46 105.69 1jzs n PHE 570 Ca -0.42 -0.80 -0.29 0.00 1.01 0.00 0.00 57.45 56.95 1jzs n PHE 570 Cb 0.97 -0.13 -0.09 0.00 -0.01 0.00 0.00 39.48 40.22 1jzs n PHE 570 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1jzs n GLY 571 N -1.14 -0.12 3.29 1.37 0.00 -0.77 -4.87 105.19 102.94 1jzs n GLY 571 Ca 0.13 0.17 -0.12 0.00 0.00 0.00 0.00 46.02 46.19 1jzs n GLY 571 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1jzs s SER 572 N -4.27 -0.22 0.89 1.61 0.15 -0.36 -4.88 113.70 106.62 1jzs s SER 572 Ca 0.01 -0.07 -0.12 0.00 0.70 0.00 0.00 55.95 56.48 1jzs s SER 572 Cb -0.00 0.39 0.12 0.00 -1.71 0.00 0.00 66.02 64.82 1jzs s SER 572 CO 0.92 -0.63 1.09 0.27 1.20 0.00 0.00 173.24 176.10 1jzs s ILE 573 N -2.41 2.67 -1.05 6.45 -4.36 -1.26 -1.34 121.20 119.91 1jzs s ILE 573 Ca -0.06 0.22 0.12 0.00 -0.26 0.00 0.00 60.65 60.67 1jzs s ILE 573 Cb -0.01 -2.73 -0.01 0.00 1.25 0.00 0.00 42.46 40.96 1jzs s ILE 573 CO -0.02 -0.29 0.68 0.00 0.24 0.00 0.00 174.94 175.56 1jzs n ALA 574 N -3.84 2.95 -3.60 2.27 0.00 -1.26 -4.63 120.51 112.39 1jzs n ALA 574 Ca 0.07 -0.46 -0.15 0.00 0.00 0.00 0.00 53.44 52.90 1jzs n ALA 574 Cb 0.55 -0.41 -0.07 0.00 0.00 0.00 0.00 19.45 19.53 1jzs n ALA 574 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 1jzs s PHE 575 N -1.52 -0.72 -0.08 0.00 -0.12 -1.26 -1.76 117.98 112.51 1jzs s PHE 575 Ca 0.09 1.61 0.13 0.00 -0.05 0.00 0.00 56.93 58.72 1jzs s PHE 575 Cb 0.09 0.32 -0.23 0.00 -0.63 0.00 0.00 43.02 42.57 1jzs s PHE 575 CO 0.30 -0.44 0.53 1.63 -0.05 0.00 0.00 175.22 177.19 1jzs n LYS 576 N 2.08 0.65 -4.07 1.99 5.02 -0.82 -4.78 118.16 118.22 1jzs n LYS 576 Ca -0.15 0.23 -0.09 0.00 -2.02 0.00 0.00 58.31 56.28 1jzs n LYS 576 Cb 0.56 -1.73 -0.11 0.00 -0.02 0.00 0.00 35.03 33.73 1jzs n LYS 576 CO 0.00 0.00 0.00 -0.80 -0.52 0.00 0.00 177.40 176.08 1jzs s ASN 577 N -5.99 0.61 -0.19 4.39 0.01 -1.07 -1.78 114.94 110.93 1jzs s ASN 577 Ca -0.06 -0.77 -0.19 0.00 -0.71 0.00 0.00 52.86 51.13 1jzs s ASN 577 Cb 0.08 0.12 0.05 0.00 0.41 0.00 0.00 41.25 41.91 1jzs s ASN 577 CO 0.82 -0.41 0.53 -0.69 -1.51 0.00 0.00 177.10 175.84 1jzs s VAL 578 N -2.65 0.00 -0.23 1.60 1.01 -0.93 -3.06 120.40 116.14 1jzs s VAL 578 Ca -0.02 -0.02 -0.03 0.00 0.00 0.00 0.00 61.98 61.91 1jzs s VAL 578 Cb -0.01 -0.74 0.00 0.00 0.00 0.00 0.00 36.38 35.63 1jzs s VAL 578 CO -0.04 -0.01 -0.05 -0.63 0.00 0.00 0.00 175.10 174.37 1jzs s ILE 579 N 0.17 3.22 -0.51 2.22 1.01 -1.17 -0.04 121.20 126.10 1jzs s ILE 579 Ca -0.01 -0.65 -0.09 0.00 0.00 0.00 0.00 60.65 59.91 1jzs s ILE 579 Cb -0.04 -2.51 0.13 0.00 0.01 0.00 0.00 42.46 40.06 1jzs s ILE 579 CO 0.01 0.36 0.38 0.00 0.00 0.00 0.00 174.94 175.70 1jzs s HIS 581 N 1.15 3.47 0.00 0.00 -3.43 -1.14 -4.25 115.29 111.09 1jzs s HIS 581 Ca 0.08 0.16 0.00 0.00 -0.80 0.00 0.00 55.06 54.49 1jzs s HIS 581 Cb -0.25 -1.72 0.00 0.00 -1.43 0.00 0.00 32.58 29.19 1jzs s HIS 581 CO -0.02 0.35 0.00 0.41 -2.00 0.00 0.00 174.74 173.48 1jzs n GLY 582 N -1.31 -2.02 3.58 -1.38 0.00 -0.20 -1.80 105.19 102.06 1jzs n GLY 582 Ca -0.07 -1.33 -0.27 0.00 0.00 0.00 0.00 46.02 44.35 1jzs n GLY 582 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1jzs s LEU 583 N 0.00 3.02 -0.41 0.99 1.02 -1.25 -4.70 118.68 117.34 1jzs s LEU 583 Ca 0.00 -0.54 -0.23 0.00 0.02 0.00 0.00 54.13 53.38 1jzs s LEU 583 Cb 0.00 -1.71 0.02 0.00 0.02 0.00 0.00 46.19 44.52 1jzs s LEU 583 CO 0.00 0.11 0.77 -0.63 0.02 0.00 0.00 176.35 176.61 1jzs s ILE 584 N -1.68 4.70 0.30 -0.59 -1.09 -1.26 -2.09 121.20 119.50 1jzs s ILE 584 Ca 0.25 0.61 0.03 0.00 -2.23 0.00 0.00 60.65 59.31 1jzs s ILE 584 Cb -0.09 -4.25 -0.03 0.00 -1.58 0.00 0.00 42.46 36.51 1jzs s ILE 584 CO 0.15 -0.57 0.46 -0.76 -1.23 0.00 0.00 174.94 172.99 1jzs s LEU 585 N 3.16 4.12 1.19 2.97 1.43 0.26 -4.54 118.68 127.28 1jzs s LEU 585 Ca 0.30 0.18 -0.17 0.00 -1.03 0.00 0.00 54.13 53.41 1jzs s LEU 585 Cb -0.13 -3.02 0.23 0.00 0.03 0.00 0.00 46.19 43.30 1jzs s LEU 585 CO 0.20 -0.24 0.51 -0.67 0.23 0.00 0.00 176.35 176.38 1jzs n ASP 586 N -1.61 -2.59 0.00 2.29 4.64 0.37 0.57 116.55 120.21 1jzs n ASP 586 Ca -0.06 -0.31 0.15 0.00 -1.38 0.00 0.00 54.79 53.19 1jzs n ASP 586 Cb 0.57 -1.03 0.81 0.00 -1.04 0.00 0.00 41.12 40.43 1jzs n ASP 586 CO 0.00 0.00 0.00 1.21 -0.82 0.00 0.00 177.20 177.59 1jzs n GLU 587 N -3.61 0.65 0.00 -0.67 2.13 -1.24 -2.96 120.64 114.93 1jzs n GLU 587 Ca 0.04 0.01 0.02 0.00 0.66 0.00 0.00 57.16 57.88 1jzs n GLU 587 Cb 0.56 -1.50 -0.02 0.00 0.27 0.00 0.00 31.44 30.75 1jzs n GLU 587 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 1jzs n LYS 588 N -1.16 5.42 0.00 5.31 4.01 -1.26 -4.93 118.16 125.54 1jzs n LYS 588 Ca 0.18 -0.02 0.00 0.00 -0.51 0.00 0.00 58.31 57.96 1jzs n LYS 588 Cb 0.18 -0.71 0.00 0.00 -0.51 0.00 0.00 35.03 33.99 1jzs n LYS 588 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1jzs n GLY 589 N 1.08 1.03 3.88 0.72 0.00 -1.16 -5.11 105.19 105.63 1jzs n GLY 589 Ca 0.01 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.73 1jzs n GLY 589 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1jzs s GLN 590 N -0.22 3.74 0.73 1.61 -0.21 -1.26 -4.65 119.66 119.39 1jzs s GLN 590 Ca 0.00 0.44 -0.11 0.00 0.02 0.00 0.00 55.36 55.71 1jzs s GLN 590 Cb 0.00 -2.38 0.03 0.00 1.00 0.00 0.00 33.01 31.66 1jzs s GLN 590 CO 0.00 -0.07 1.07 0.21 -2.12 0.00 0.00 175.29 174.38 1jzs s LYS 591 N -4.01 2.68 -0.19 2.91 2.20 -1.26 0.14 119.74 122.20 1jzs s LYS 591 Ca 0.51 0.85 -0.12 0.00 -0.36 0.00 0.00 55.97 56.85 1jzs s LYS 591 Cb -0.10 -1.97 -0.05 0.00 -1.51 0.00 0.00 37.83 34.20 1jzs s LYS 591 CO 0.34 -1.26 0.20 -1.64 -0.36 0.00 0.00 175.35 172.63 1jzs s MET 592 N -5.08 4.20 0.04 4.03 -1.94 -1.26 -4.73 119.30 114.56 1jzs s MET 592 Ca 0.59 -0.11 0.00 0.00 -1.71 0.00 0.00 55.69 54.47 1jzs s MET 592 Cb -0.14 -3.44 -0.03 0.00 2.01 0.00 0.00 34.83 33.23 1jzs s MET 592 CO 0.55 0.24 -0.04 0.45 -0.01 0.00 0.00 175.02 176.21 1jzs s SER 593 N 0.50 0.50 0.46 3.03 0.15 -1.26 -4.99 113.70 112.08 1jzs s SER 593 Ca 0.11 -0.66 0.14 0.00 0.70 0.00 0.00 55.95 56.23 1jzs s SER 593 Cb -0.12 0.11 1.04 0.00 -1.71 0.00 0.00 66.02 65.33 1jzs s SER 593 CO 0.01 -0.36 2.03 0.07 1.20 0.00 0.00 173.24 176.19 1jzs h LYS 594 N 4.15 0.07 0.00 5.44 2.10 -2.01 -3.22 116.57 123.10 1jzs h LYS 594 Ca -0.33 -0.01 -0.00 0.00 -2.00 0.00 0.00 60.65 58.30 1jzs h LYS 594 Cb 1.19 -0.01 0.00 0.00 -0.90 0.00 0.00 32.23 32.51 1jzs h LYS 594 CO 0.48 0.17 -0.00 0.66 -2.00 0.00 0.00 179.45 178.76 1jzs h SER 595 N 0.07 -0.01 0.00 7.07 4.64 -2.02 -3.33 113.55 119.98 1jzs h SER 595 Ca 0.02 -0.20 0.00 0.00 -0.47 0.00 0.00 61.79 61.14 1jzs h SER 595 Cb 0.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.30 1jzs h SER 595 CO 0.01 0.59 0.66 0.11 -0.87 0.00 0.00 176.83 177.33 1jzs h LYS 596 N -1.00 0.00 -5.96 4.77 1.79 -1.96 -3.44 116.57 110.78 1jzs h LYS 596 Ca -0.00 0.00 -0.40 0.00 -2.18 0.00 0.00 60.65 58.07 1jzs h LYS 596 Cb 0.20 0.00 0.09 0.00 -1.58 0.00 0.00 32.23 30.94 1jzs h LYS 596 CO 0.00 0.00 -0.78 0.41 -1.08 0.00 0.00 179.45 178.00 1jzs n GLY 597 N -1.32 -0.37 0.00 3.86 0.00 -1.22 -4.88 105.19 101.25 1jzs n GLY 597 Ca -0.00 0.15 0.00 0.00 0.00 0.00 0.00 46.02 46.16 1jzs n GLY 597 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1jzs n ASN 598 N -3.04 0.55 -4.67 1.61 6.94 -1.26 -5.09 115.26 110.30 1jzs n ASN 598 Ca -0.21 -1.16 -0.35 0.00 -0.02 0.00 0.00 54.58 52.84 1jzs n ASN 598 Cb 0.64 0.00 0.10 0.00 -2.36 0.00 0.00 39.78 38.16 1jzs n ASN 598 CO 0.00 0.00 0.00 1.33 -1.03 0.00 0.00 177.26 177.56 1jzs n VAL 599 N -0.08 2.88 -3.80 3.53 0.24 -1.26 -4.91 118.33 114.93 1jzs n VAL 599 Ca 0.00 -0.32 -0.26 0.00 -2.04 0.00 0.00 64.34 61.72 1jzs n VAL 599 Cb 0.26 -1.23 -0.17 0.00 -1.47 0.00 0.00 33.84 31.23 1jzs n VAL 599 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 1jzs s VAL 600 N -1.87 0.63 -0.15 3.34 1.01 -1.26 -5.10 120.40 117.00 1jzs s VAL 600 Ca 0.75 -0.27 -0.26 0.00 0.00 0.00 0.00 61.98 62.20 1jzs s VAL 600 Cb -0.33 -0.88 -0.02 0.00 0.00 0.00 0.00 36.38 35.16 1jzs s VAL 600 CO 0.49 0.10 0.84 -0.62 0.00 0.00 0.00 175.10 175.91 1jzs s ASP 601 N 1.85 7.00 0.29 3.32 -1.08 -1.26 -4.43 116.67 122.35 1jzs s ASP 601 Ca 0.02 1.23 -0.01 0.00 -0.52 0.00 0.00 52.55 53.27 1jzs s ASP 601 Cb -0.14 -2.46 0.64 0.00 -1.46 0.00 0.00 42.92 39.49 1jzs s ASP 601 CO -0.07 -0.37 1.51 -0.81 0.52 0.00 0.00 175.17 175.95 1jzs n PRO 602 N 5.03 -0.08 -0.34 4.34 -0.04 -1.26 -0.35 135.00 142.30 1jzs n PRO 602 Ca 0.04 1.46 0.18 0.00 -0.04 0.00 0.00 63.50 65.15 1jzs n PRO 602 Cb 0.49 -2.28 0.39 0.00 -0.04 0.00 0.00 33.50 32.06 1jzs n PRO 602 CO 0.00 0.00 0.00 -1.49 -0.04 0.00 0.00 175.50 173.97 1jzs h TRP 603 N 0.00 0.95 -0.15 0.54 4.06 -1.98 0.12 115.95 119.48 1jzs h TRP 603 Ca 0.54 0.04 0.04 0.00 2.06 0.00 0.00 58.89 61.57 1jzs h TRP 603 Cb 1.03 -0.26 -0.04 0.00 -1.00 0.00 0.00 29.16 28.89 1jzs h TRP 603 CO -0.58 0.01 -0.10 -0.44 -3.56 0.00 0.00 178.44 173.77 1jzs h ASP 604 N 0.51 -0.33 -0.78 -3.49 3.32 -1.09 -0.80 116.42 113.76 1jzs h ASP 604 Ca 0.65 0.07 -0.04 0.00 0.02 0.00 0.00 57.03 57.73 1jzs h ASP 604 Cb 1.28 0.17 -0.03 0.00 0.22 0.00 0.00 39.33 40.97 1jzs h ASP 604 CO -0.51 -0.14 0.33 0.40 -1.72 0.00 0.00 179.24 177.61 1jzs h ILE 605 N -0.11 1.25 -0.49 0.35 1.08 -1.04 -2.98 117.51 115.57 1jzs h ILE 605 Ca 0.09 -0.77 0.03 0.00 -0.39 0.00 0.00 64.86 63.82 1jzs h ILE 605 Cb 0.24 0.31 -0.03 0.00 -3.07 0.00 0.00 36.82 34.27 1jzs h ILE 605 CO -0.22 0.32 0.28 0.40 -0.69 0.00 0.00 178.15 178.25 1jzs h ILE 606 N 1.11 1.03 -0.00 -0.67 2.04 0.01 -1.46 117.51 119.57 1jzs h ILE 606 Ca 0.26 -0.19 0.00 0.00 1.00 0.00 0.00 64.86 65.93 1jzs h ILE 606 Cb 0.18 0.42 0.00 0.00 -0.74 0.00 0.00 36.82 36.68 1jzs h ILE 606 CO -0.03 0.10 -0.06 -2.11 0.00 0.00 0.00 178.15 176.06 1jzs n ARG 607 N -4.83 0.11 -0.10 2.37 1.85 -0.39 0.27 116.66 115.94 1jzs n ARG 607 Ca 0.03 -0.01 -0.18 0.00 -1.00 0.00 0.00 57.85 56.69 1jzs n ARG 607 Cb 0.09 -1.50 -0.13 0.00 -1.05 0.00 0.00 32.46 29.87 1jzs n ARG 607 CO 0.00 0.00 0.00 1.63 -0.01 0.00 0.00 177.63 179.25 1jzs n LYS 608 N -1.43 0.68 0.00 2.89 5.02 -1.06 -4.72 118.16 119.53 1jzs n LYS 608 Ca 0.09 0.16 0.00 0.00 -2.02 0.00 0.00 58.31 56.54 1jzs n LYS 608 Cb 0.32 -1.56 0.00 0.00 -0.02 0.00 0.00 35.03 33.76 1jzs n LYS 608 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 1jzs n PHE 609 N -3.26 0.00 0.00 2.13 3.01 -0.57 -4.86 117.46 113.91 1jzs n PHE 609 Ca -0.42 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.04 1jzs n PHE 609 Cb 1.02 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 40.49 1jzs n PHE 609 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1jzs n GLY 610 N 1.61 1.39 0.24 1.37 0.00 0.14 -4.41 105.19 105.53 1jzs n GLY 610 Ca 0.00 -1.90 0.04 0.00 0.00 0.00 0.00 46.02 44.16 1jzs n GLY 610 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1jzs h ALA 611 N 0.00 1.63 -0.37 4.61 0.00 -1.85 -2.98 119.26 120.30 1jzs h ALA 611 Ca 0.00 -0.17 -0.06 0.00 0.00 0.00 0.00 54.91 54.69 1jzs h ALA 611 Cb 0.00 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1jzs h ALA 611 CO 0.00 0.27 0.01 -0.44 0.00 0.00 0.00 179.25 179.09 1jzs h ASP 612 N 0.12 0.63 -0.91 0.00 3.32 -1.92 -2.63 116.42 115.02 1jzs h ASP 612 Ca 0.03 -0.30 0.11 0.00 0.02 0.00 0.00 57.03 56.88 1jzs h ASP 612 Cb 0.31 -0.17 -0.07 0.00 0.22 0.00 0.00 39.33 39.62 1jzs h ASP 612 CO 0.02 0.78 0.59 0.00 -1.72 0.00 0.00 179.24 178.90 1jzs h ALA 613 N 0.87 1.65 0.94 3.45 0.00 -1.73 0.53 119.26 124.98 1jzs h ALA 613 Ca 0.10 0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.97 1jzs h ALA 613 Cb 0.45 -0.19 0.01 0.00 0.00 0.00 0.00 17.79 18.06 1jzs h ALA 613 CO 0.02 0.14 -0.45 1.25 0.00 0.00 0.00 179.25 180.20 1jzs h LEU 614 N 0.87 -1.07 -0.41 0.00 5.85 -1.48 -0.78 115.31 118.28 1jzs h LEU 614 Ca 0.44 0.04 0.09 0.00 0.84 0.00 0.00 57.88 59.28 1jzs h LEU 614 Cb 0.49 0.28 -0.09 0.00 0.37 0.00 0.00 40.66 41.71 1jzs h LEU 614 CO -0.20 -0.75 -0.21 0.03 -0.34 0.00 0.00 178.44 176.97 1jzs h ARG 615 N -1.30 -0.12 -0.26 1.25 3.08 -0.96 -2.16 114.38 113.91 1jzs h ARG 615 Ca -0.13 0.01 0.05 0.00 0.07 0.00 0.00 59.98 59.98 1jzs h ARG 615 Cb 0.97 0.03 -0.05 0.00 0.08 0.00 0.00 29.97 31.00 1jzs h ARG 615 CO 0.21 -0.08 -0.06 2.35 -1.07 0.00 0.00 179.97 181.32 1jzs h TRP 616 N -0.13 -0.12 0.09 3.04 2.91 0.12 -2.41 115.95 119.45 1jzs h TRP 616 Ca 0.20 0.02 0.02 0.00 1.13 0.00 0.00 58.89 60.27 1jzs h TRP 616 Cb 0.44 0.09 -0.04 0.00 -0.51 0.00 0.00 29.16 29.14 1jzs h TRP 616 CO -0.45 -0.10 -0.35 -0.92 -1.03 0.00 0.00 178.44 175.59 1jzs h TYR 617 N 0.01 -0.96 -0.94 2.65 3.20 -0.52 -0.63 116.97 119.78 1jzs h TYR 617 Ca 0.12 0.03 0.24 0.00 3.14 0.00 0.00 58.73 62.26 1jzs h TYR 617 Cb 0.19 0.41 -0.13 0.00 1.54 0.00 0.00 36.73 38.74 1jzs h TYR 617 CO -0.25 -0.45 0.46 0.82 -1.64 0.00 0.00 178.16 177.10 1jzs h ILE 618 N -0.56 0.45 0.09 1.81 1.08 -1.16 0.42 117.51 119.65 1jzs h ILE 618 Ca 0.04 -0.15 -0.00 0.00 -0.39 0.00 0.00 64.86 64.36 1jzs h ILE 618 Cb 0.60 -0.01 0.00 0.00 -3.07 0.00 0.00 36.82 34.35 1jzs h ILE 618 CO -0.23 0.08 -0.04 1.88 -0.69 0.00 0.00 178.15 179.15 1jzs h TYR 619 N 0.42 -0.11 0.02 1.37 0.99 -0.75 -3.36 116.97 115.55 1jzs h TYR 619 Ca 0.61 -0.00 -0.21 0.00 2.00 0.00 0.00 58.73 61.13 1jzs h TYR 619 Cb 1.20 0.04 -0.02 0.00 1.00 0.00 0.00 36.73 38.95 1jzs h TYR 619 CO -0.09 0.39 -0.95 0.28 -0.00 0.00 0.00 178.16 177.79 1jzs h VAL 620 N -0.71 1.58 -0.65 -2.88 2.07 -0.81 -3.38 116.25 111.48 1jzs h VAL 620 Ca -0.01 -2.95 0.06 0.00 0.82 0.00 0.00 66.70 64.62 1jzs h VAL 620 Cb 0.55 2.65 -0.08 0.00 -1.52 0.00 0.00 31.29 32.90 1jzs h VAL 620 CO 0.02 0.85 -0.38 -1.20 0.02 0.00 0.00 177.57 176.88 1jzs n SER 621 N -3.53 -0.69 -3.54 0.57 7.64 0.14 -4.87 113.62 109.35 1jzs n SER 621 Ca -0.03 1.47 -0.02 0.00 1.01 0.00 0.00 58.87 61.30 1jzs n SER 621 Cb 0.87 -0.30 0.01 0.00 -1.01 0.00 0.00 64.21 63.77 1jzs n SER 621 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1jzs s ALA 622 N -4.99 -1.73 0.98 -0.43 0.00 -1.26 -5.12 121.76 109.22 1jzs s ALA 622 Ca -0.08 -0.06 -0.12 0.00 0.00 0.00 0.00 51.96 51.70 1jzs s ALA 622 Cb 0.07 0.69 0.12 0.00 0.00 0.00 0.00 23.12 24.00 1jzs s ALA 622 CO 0.40 -1.06 0.74 -2.30 0.00 0.00 0.00 175.76 173.54 1jzs n PRO 623 N -0.62 -0.78 -0.29 0.00 -0.02 -1.26 -4.80 135.00 127.23 1jzs n PRO 623 Ca -0.04 -0.18 0.02 0.00 -2.02 0.00 0.00 63.50 61.28 1jzs n PRO 623 Cb 0.60 -2.09 0.15 0.00 -0.02 0.00 0.00 33.50 32.14 1jzs n PRO 623 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 1jzs h PRO 624 N -1.90 0.79 0.26 0.52 0.11 -1.92 -3.20 132.00 126.66 1jzs h PRO 624 Ca -0.47 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.60 1jzs h PRO 624 Cb 1.29 -0.18 -0.04 0.00 0.11 0.00 0.00 31.00 32.19 1jzs h PRO 624 CO 0.39 0.52 -0.51 0.93 -0.21 0.00 0.00 178.00 179.12 1jzs h GLU 625 N 0.81 -0.81 -4.98 1.05 3.07 -1.91 -1.34 114.58 110.48 1jzs h GLU 625 Ca 0.38 0.06 -0.41 0.00 -0.50 0.00 0.00 59.36 58.88 1jzs h GLU 625 Cb 0.29 0.18 0.21 0.00 -0.84 0.00 0.00 28.75 28.60 1jzs h GLU 625 CO -0.22 -0.54 -2.21 0.00 -1.40 0.00 0.00 179.01 174.64 1jzs n ALA 626 N -2.88 -4.86 -2.55 3.43 0.00 -1.21 -1.03 120.51 111.41 1jzs n ALA 626 Ca -0.10 -1.10 -0.33 0.00 0.00 0.00 0.00 53.44 51.91 1jzs n ALA 626 Cb 0.43 -0.68 -0.12 0.00 0.00 0.00 0.00 19.45 19.08 1jzs n ALA 626 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1jzs s ASP 627 N -0.83 4.45 0.11 0.00 1.11 -1.26 -2.85 116.67 117.40 1jzs s ASP 627 Ca 0.30 -0.10 0.05 0.00 0.18 0.00 0.00 52.55 52.98 1jzs s ASP 627 Cb 0.07 -1.05 -0.04 0.00 1.07 0.00 0.00 42.92 42.97 1jzs s ASP 627 CO 0.56 0.34 -0.13 0.00 1.18 0.00 0.00 175.17 177.12 1jzs s ARG 628 N -0.92 0.97 0.06 8.23 3.03 -0.89 -4.95 118.95 124.49 1jzs s ARG 628 Ca 0.13 -1.21 -0.29 0.00 2.03 0.00 0.00 55.73 56.39 1jzs s ARG 628 Cb -0.11 -0.81 -0.05 0.00 -1.03 0.00 0.00 34.95 32.96 1jzs s ARG 628 CO 0.02 0.15 0.93 1.03 -1.13 0.00 0.00 175.30 176.30 1jzs s ARG 629 N -2.68 4.62 -0.11 3.89 3.00 -1.26 0.92 118.95 127.32 1jzs s ARG 629 Ca 0.08 1.36 0.00 0.00 0.00 0.00 0.00 55.73 57.17 1jzs s ARG 629 Cb -0.04 -3.40 0.02 0.00 0.00 0.00 0.00 34.95 31.52 1jzs s ARG 629 CO 0.02 0.13 -0.09 0.12 0.00 0.00 0.00 175.30 175.48 1jzs s PHE 630 N 0.34 1.56 -0.14 -0.53 5.36 0.19 -4.87 117.98 119.89 1jzs s PHE 630 Ca 0.47 -0.76 -0.30 0.00 -0.96 0.00 0.00 56.93 55.38 1jzs s PHE 630 Cb -0.22 -1.25 0.12 0.00 -0.34 0.00 0.00 43.02 41.34 1jzs s PHE 630 CO 0.28 -0.49 0.98 0.20 -1.46 0.00 0.00 175.22 174.73 1jzs s GLY 631 N 1.50 -0.29 0.24 13.12 0.00 -1.26 -3.68 107.32 116.94 1jzs s GLY 631 Ca 0.02 1.92 -0.12 0.00 0.00 0.00 0.00 44.72 46.53 1jzs s GLY 631 CO -0.06 0.96 1.59 -0.56 0.00 0.00 0.00 173.10 175.03 1jzs h PRO 632 N 2.52 -0.02 -0.56 2.90 0.13 -1.99 -1.05 132.00 133.93 1jzs h PRO 632 Ca -0.19 0.00 0.01 0.00 -0.87 0.00 0.00 66.00 64.95 1jzs h PRO 632 Cb 1.17 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.27 1jzs h PRO 632 CO 0.31 -0.01 0.36 -0.91 -0.23 0.00 0.00 178.00 177.52 1jzs h ASN 633 N -0.02 0.62 -0.69 1.44 4.21 -1.99 0.40 115.58 119.56 1jzs h ASN 633 Ca 0.37 -0.01 -0.05 0.00 1.21 0.00 0.00 56.30 57.81 1jzs h ASN 633 Cb 0.59 -0.15 -0.03 0.00 -1.12 0.00 0.00 38.32 37.61 1jzs h ASN 633 CO -0.82 0.45 0.22 0.25 -1.29 0.00 0.00 177.43 176.23 1jzs h LEU 634 N 0.74 0.99 0.23 1.61 5.85 -1.68 -2.63 115.31 120.42 1jzs h LEU 634 Ca 0.21 -0.21 -0.01 0.00 0.84 0.00 0.00 57.88 58.71 1jzs h LEU 634 Cb -0.07 -0.26 0.00 0.00 0.37 0.00 0.00 40.66 40.70 1jzs h LEU 634 CO -0.05 0.94 -0.11 0.58 -0.34 0.00 0.00 178.44 179.45 1jzs h VAL 635 N 1.00 0.82 -1.06 1.05 2.07 -0.75 -2.72 116.25 116.65 1jzs h VAL 635 Ca 0.22 -0.27 0.30 0.00 0.82 0.00 0.00 66.70 67.77 1jzs h VAL 635 Cb 0.29 0.98 -0.05 0.00 -1.52 0.00 0.00 31.29 30.99 1jzs h VAL 635 CO -0.01 0.06 0.76 -0.09 0.02 0.00 0.00 177.57 178.31 1jzs h ARG 636 N -0.45 0.04 -0.76 1.57 2.43 -0.79 -0.26 114.38 116.16 1jzs h ARG 636 Ca -0.03 -0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 59.11 1jzs h ARG 636 Cb 0.34 -0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 29.84 1jzs h ARG 636 CO 0.05 0.03 0.37 1.49 -1.51 0.00 0.00 179.97 180.40 1jzs h GLU 637 N 0.05 1.10 0.00 0.20 4.57 -1.13 -2.78 114.58 116.58 1jzs h GLU 637 Ca 0.52 -0.16 -0.13 0.00 -1.18 0.00 0.00 59.36 58.40 1jzs h GLU 637 Cb 1.98 -0.20 -0.02 0.00 -0.16 0.00 0.00 28.75 30.35 1jzs h GLU 637 CO -0.04 0.86 -0.64 1.79 -1.18 0.00 0.00 179.01 179.80 1jzs h THR 638 N 1.08 1.33 -0.48 0.32 1.35 -1.12 -3.01 112.91 112.37 1jzs h THR 638 Ca 0.26 -2.29 -0.05 0.00 -0.55 0.00 0.00 66.41 63.78 1jzs h THR 638 Cb 0.12 2.28 -0.02 0.00 -1.73 0.00 0.00 68.15 68.80 1jzs h THR 638 CO -0.03 0.63 0.09 0.58 -0.25 0.00 0.00 175.52 176.54 1jzs h VAL 639 N 0.00 1.22 0.00 6.82 2.07 -1.35 -1.30 116.25 123.71 1jzs h VAL 639 Ca -0.01 -0.80 -0.02 0.00 0.82 0.00 0.00 66.70 66.69 1jzs h VAL 639 Cb 1.23 0.75 -0.00 0.00 -1.52 0.00 0.00 31.29 31.75 1jzs h VAL 639 CO 0.08 0.29 -0.12 0.03 0.02 0.00 0.00 177.57 177.88 1jzs h ARG 640 N 0.71 0.00 0.14 1.57 3.08 -1.39 -0.84 114.38 117.65 1jzs h ARG 640 Ca 0.16 0.00 -0.29 0.00 0.07 0.00 0.00 59.98 59.91 1jzs h ARG 640 Cb 0.30 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.35 1jzs h ARG 640 CO 0.00 0.12 -1.47 0.22 -1.07 0.00 0.00 179.97 177.77 1jzs h ASP 641 N 0.00 0.45 0.00 7.04 3.58 -1.23 -3.39 116.42 122.87 1jzs h ASP 641 Ca -0.00 -0.88 0.00 0.00 0.42 0.00 0.00 57.03 56.57 1jzs h ASP 641 Cb 0.84 -0.15 0.00 0.00 1.72 0.00 0.00 39.33 41.75 1jzs h ASP 641 CO 0.01 1.65 -0.73 0.00 -2.88 0.00 0.00 179.24 177.29 1jzs n TYR 642 N -3.85 0.00 -0.21 0.28 9.36 -0.57 -4.35 117.16 117.82 1jzs n TYR 642 Ca -0.24 0.00 -0.02 0.00 3.32 0.00 0.00 57.90 60.96 1jzs n TYR 642 Cb 0.94 -0.37 0.09 0.00 -0.63 0.00 0.00 39.34 39.38 1jzs n TYR 642 CO 0.00 0.00 0.00 0.74 0.22 0.00 0.00 176.86 177.82 1jzs h PHE 643 N -0.73 0.58 -0.05 2.98 -1.00 -1.56 -0.47 116.94 116.68 1jzs h PHE 643 Ca 0.00 0.02 -0.18 0.00 2.81 0.00 0.00 57.97 60.63 1jzs h PHE 643 Cb 0.73 -0.17 -0.01 0.00 3.61 0.00 0.00 35.95 40.12 1jzs h PHE 643 CO -0.32 0.26 -0.75 -0.07 -1.61 0.00 0.00 178.31 175.83 1jzs h LEU 644 N 0.59 0.36 -0.45 1.54 3.38 -1.39 -1.92 115.31 117.42 1jzs h LEU 644 Ca 0.28 -0.25 -0.11 0.00 0.09 0.00 0.00 57.88 57.89 1jzs h LEU 644 Cb 0.22 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 1jzs h LEU 644 CO -0.20 0.98 -0.16 0.74 0.09 0.00 0.00 178.44 179.90 1jzs h THR 645 N 0.20 1.27 -0.23 0.22 2.02 -1.68 -1.32 112.91 113.40 1jzs h THR 645 Ca -0.03 -1.30 -0.04 0.00 0.77 0.00 0.00 66.41 65.81 1jzs h THR 645 Cb 1.32 1.16 -0.01 0.00 -1.74 0.00 0.00 68.15 68.88 1jzs h THR 645 CO 0.12 0.44 -0.03 0.25 0.37 0.00 0.00 175.52 176.67 1jzs h LEU 646 N 0.75 0.42 -0.30 2.58 5.85 -1.08 -2.04 115.31 121.48 1jzs h LEU 646 Ca 0.11 -0.34 0.00 0.00 0.84 0.00 0.00 57.88 58.49 1jzs h LEU 646 Cb 0.71 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.62 1jzs h LEU 646 CO 0.05 0.67 0.20 -0.25 -0.34 0.00 0.00 178.44 178.77 1jzs h TRP 647 N 0.17 0.38 0.05 1.25 2.91 -1.33 0.12 115.95 119.50 1jzs h TRP 647 Ca 0.06 0.01 0.02 0.00 1.13 0.00 0.00 58.89 60.11 1jzs h TRP 647 Cb 0.47 -0.13 -0.04 0.00 -0.51 0.00 0.00 29.16 28.95 1jzs h TRP 647 CO 0.05 0.25 -0.24 -0.97 -1.03 0.00 0.00 178.44 176.49 1jzs h ASN 648 N 0.40 -0.69 -0.78 2.65 -0.73 -1.17 0.53 115.58 115.79 1jzs h ASN 648 Ca 0.11 0.09 -0.03 0.00 1.87 0.00 0.00 56.30 58.34 1jzs h ASN 648 Cb -0.04 0.28 -0.04 0.00 0.27 0.00 0.00 38.32 38.79 1jzs h ASN 648 CO -0.02 -0.31 0.39 1.62 -0.37 0.00 0.00 177.43 178.73 1jzs h VAL 649 N -0.40 1.25 -0.45 2.57 3.04 -1.19 -1.00 116.25 120.07 1jzs h VAL 649 Ca 0.05 -0.68 -0.00 0.00 -1.01 0.00 0.00 66.70 65.05 1jzs h VAL 649 Cb 0.46 0.22 -0.02 0.00 -2.01 0.00 0.00 31.29 29.94 1jzs h VAL 649 CO -0.18 0.29 0.26 0.22 -1.01 0.00 0.00 177.57 177.15 1jzs h TYR 650 N 1.13 0.60 -0.51 3.17 3.20 -0.04 -2.28 116.97 122.22 1jzs h TYR 650 Ca 0.27 -0.01 -0.03 0.00 3.14 0.00 0.00 58.73 62.11 1jzs h TYR 650 Cb 0.10 -0.19 -0.03 0.00 1.54 0.00 0.00 36.73 38.15 1jzs h TYR 650 CO 0.01 0.43 0.20 1.03 -1.64 0.00 0.00 178.16 178.20 1jzs h SER 651 N 0.59 0.67 0.23 -2.11 0.87 0.52 -2.77 113.55 111.55 1jzs h SER 651 Ca 0.16 -0.08 0.00 0.00 -1.23 0.00 0.00 61.79 60.64 1jzs h SER 651 Cb 0.02 -0.17 -0.02 0.00 -0.44 0.00 0.00 62.40 61.79 1jzs h SER 651 CO -0.03 0.61 -0.22 0.15 -0.53 0.00 0.00 176.83 176.82 1jzs h PHE 652 N 0.73 -0.57 0.24 2.24 3.57 -0.64 -1.70 116.94 120.81 1jzs h PHE 652 Ca 0.18 0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.68 1jzs h PHE 652 Cb 0.15 0.22 -0.02 0.00 2.79 0.00 0.00 35.95 39.09 1jzs h PHE 652 CO 0.01 -0.32 -0.32 0.35 -2.23 0.00 0.00 178.31 175.80 1jzs h PHE 653 N -0.47 -0.91 -0.76 0.41 3.57 -1.24 -2.20 116.94 115.35 1jzs h PHE 653 Ca -0.01 0.01 0.17 0.00 3.53 0.00 0.00 57.97 61.68 1jzs h PHE 653 Cb 0.44 0.36 -0.12 0.00 2.79 0.00 0.00 35.95 39.42 1jzs h PHE 653 CO -0.15 -0.41 0.14 0.28 -2.23 0.00 0.00 178.31 175.94 1jzs h VAL 654 N -0.58 0.44 0.30 1.41 2.07 -1.52 0.78 116.25 119.16 1jzs h VAL 654 Ca -0.03 -0.07 -0.00 0.00 0.82 0.00 0.00 66.70 67.42 1jzs h VAL 654 Cb 0.52 0.21 -0.02 0.00 -1.52 0.00 0.00 31.29 30.49 1jzs h VAL 654 CO -0.08 0.04 -0.27 0.74 0.02 0.00 0.00 177.57 178.01 1jzs h THR 655 N 0.21 0.42 0.00 2.57 2.02 -1.09 -1.54 112.91 115.51 1jzs h THR 655 Ca 0.43 0.00 -0.06 0.00 0.77 0.00 0.00 66.41 67.55 1jzs h THR 655 Cb 0.77 0.42 -0.01 0.00 -1.74 0.00 0.00 68.15 67.59 1jzs h THR 655 CO -0.57 0.00 -0.44 1.88 0.37 0.00 0.00 175.52 176.76 1jzs h TYR 656 N -0.60 0.00 0.00 3.16 0.05 -0.93 -3.17 116.97 115.48 1jzs h TYR 656 Ca -0.02 0.00 -0.10 0.00 0.05 0.00 0.00 58.73 58.67 1jzs h TYR 656 Cb 0.54 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.26 1jzs h TYR 656 CO -0.16 0.27 -0.46 0.00 -1.05 0.00 0.00 178.16 176.77 1jzs h ALA 657 N 1.73 1.07 0.00 3.88 0.00 0.63 -1.11 119.26 125.46 1jzs h ALA 657 Ca -0.02 -0.41 0.00 0.00 0.00 0.00 0.00 54.91 54.48 1jzs h ALA 657 Cb 1.22 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.94 1jzs h ALA 657 CO 0.03 0.57 0.00 0.09 0.00 0.00 0.00 179.25 179.94 1jzs n ASN 658 N -3.75 0.00 -0.07 0.00 5.03 -0.59 -1.62 115.26 114.27 1jzs n ASN 658 Ca -0.01 -0.49 -0.13 0.00 0.87 0.00 0.00 54.58 54.83 1jzs n ASN 658 Cb 0.52 -0.15 -0.06 0.00 -1.02 0.00 0.00 39.78 39.06 1jzs n ASN 658 CO 0.00 0.00 0.00 0.18 -1.83 0.00 0.00 177.26 175.61 1jzs n LEU 659 N -1.15 2.09 -0.38 3.41 7.99 -0.75 -4.59 117.00 123.62 1jzs n LEU 659 Ca 0.17 0.04 0.14 0.00 -0.01 0.00 0.00 56.01 56.36 1jzs n LEU 659 Cb 0.17 -0.47 0.55 0.00 -0.11 0.00 0.00 43.42 43.56 1jzs n LEU 659 CO 0.19 0.54 0.86 0.47 -1.51 0.00 0.00 177.39 177.94 1jzs n ASP 660 N -3.26 1.24 -1.74 -1.43 9.92 -0.50 -4.99 116.55 115.79 1jzs n ASP 660 Ca -0.27 -1.32 -0.04 0.00 -0.53 0.00 0.00 54.79 52.63 1jzs n ASP 660 Cb 0.74 0.02 0.00 0.00 -0.64 0.00 0.00 41.12 41.24 1jzs n ASP 660 CO 0.00 0.00 0.00 0.54 0.13 0.00 0.00 177.20 177.87 1jzs n ARG 661 N -0.11 -0.21 -2.93 -1.24 1.74 -0.64 -4.88 116.66 108.38 1jzs n ARG 661 Ca 0.18 0.14 -0.33 0.00 -0.77 0.00 0.00 57.85 57.08 1jzs n ARG 661 Cb 0.33 -0.24 -0.06 0.00 -1.02 0.00 0.00 32.46 31.46 1jzs n ARG 661 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 1jzs s PRO 662 N -0.96 4.12 -1.07 5.56 0.04 -1.26 -4.96 135.00 136.47 1jzs s PRO 662 Ca 0.03 0.92 -0.18 0.00 0.04 0.00 0.00 61.00 61.81 1jzs s PRO 662 Cb -0.00 -2.28 -0.07 0.00 0.04 0.00 0.00 34.50 32.18 1jzs s PRO 662 CO 0.10 0.04 2.07 -3.47 0.04 0.00 0.00 177.00 175.78 1jzs n ASP 663 N -0.58 3.16 0.00 6.66 4.64 -1.26 -4.74 116.55 124.43 1jzs n ASP 663 Ca 0.06 -2.74 0.00 0.00 -1.38 0.00 0.00 54.79 50.72 1jzs n ASP 663 Cb 0.54 -1.35 0.00 0.00 -1.04 0.00 0.00 41.12 39.27 1jzs n ASP 663 CO 0.00 0.00 0.00 0.18 -0.82 0.00 0.00 177.20 176.56 1jzs n LEU 664 N 6.83 0.00 -0.00 -2.67 4.77 -1.26 -0.08 117.00 124.59 1jzs n LEU 664 Ca 0.51 0.07 0.10 0.00 -0.03 0.00 0.00 56.01 56.65 1jzs n LEU 664 Cb 0.39 -0.07 -0.12 0.00 -2.33 0.00 0.00 43.42 41.30 1jzs n LEU 664 CO 0.98 -0.07 -0.21 0.29 -1.33 0.00 0.00 177.39 177.05 1jzs n LYS 665 N -0.99 0.49 -3.26 3.23 5.02 -1.26 -4.67 118.16 116.72 1jzs n LYS 665 Ca 0.00 -0.04 -0.24 0.00 -2.02 0.00 0.00 58.31 56.00 1jzs n LYS 665 Cb 0.01 -1.45 -0.08 0.00 -0.02 0.00 0.00 35.03 33.50 1jzs n LYS 665 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1jzs n ASN 666 N -1.64 -0.38 -4.83 4.39 3.02 0.89 -5.14 115.26 111.57 1jzs n ASN 666 Ca 0.02 -2.56 -0.34 0.00 -0.03 0.00 0.00 54.58 51.67 1jzs n ASN 666 Cb 0.36 -0.43 -0.06 0.00 -0.61 0.00 0.00 39.78 39.04 1jzs n ASN 666 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 1jzs s PRO 667 N -0.45 4.15 0.34 3.52 0.04 -1.24 -4.83 135.00 136.53 1jzs s PRO 667 Ca 0.34 0.87 -0.29 0.00 0.04 0.00 0.00 61.00 61.96 1jzs s PRO 667 Cb 0.10 -2.49 -0.12 0.00 0.04 0.00 0.00 34.50 32.03 1jzs s PRO 667 CO -0.16 0.17 1.40 -2.30 0.04 0.00 0.00 177.00 176.16 1jzs n PRO 668 N -0.13 2.36 -1.68 0.56 -0.02 -1.26 -4.90 135.00 129.93 1jzs n PRO 668 Ca 0.03 0.83 -0.41 0.00 -2.02 0.00 0.00 63.50 61.93 1jzs n PRO 668 Cb 0.53 -2.49 0.01 0.00 -0.02 0.00 0.00 33.50 31.53 1jzs n PRO 668 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1jzs n PRO 669 N 0.84 1.75 -0.26 0.52 -0.02 -1.26 -4.86 135.00 131.72 1jzs n PRO 669 Ca 0.05 0.63 -0.09 0.00 -2.02 0.00 0.00 63.50 62.06 1jzs n PRO 669 Cb 0.37 -2.30 -0.05 0.00 -0.02 0.00 0.00 33.50 31.50 1jzs n PRO 669 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 1jzs h PRO 670 N 1.90 -0.18 -1.31 0.52 0.11 -1.97 -0.41 132.00 130.67 1jzs h PRO 670 Ca -0.47 0.01 0.47 0.00 0.11 0.00 0.00 66.00 66.12 1jzs h PRO 670 Cb 1.31 0.04 -0.15 0.00 0.11 0.00 0.00 31.00 32.31 1jzs h PRO 670 CO 0.59 -0.12 0.82 0.39 -0.21 0.00 0.00 178.00 179.47 1jzs n GLU 671 N -5.38 -0.04 0.00 1.05 4.71 -1.26 0.17 120.64 119.89 1jzs n GLU 671 Ca 0.02 1.29 0.15 0.00 -0.01 0.00 0.00 57.16 58.61 1jzs n GLU 671 Cb 0.34 -2.49 0.77 0.00 -1.01 0.00 0.00 31.44 29.05 1jzs n GLU 671 CO 0.00 0.00 0.00 1.63 0.09 0.00 0.00 177.13 178.85 1jzs n LYS 672 N -4.85 0.83 -3.06 3.49 5.02 -0.16 -4.86 118.16 114.56 1jzs n LYS 672 Ca 0.40 -0.15 -0.30 0.00 -2.02 0.00 0.00 58.31 56.24 1jzs n LYS 672 Cb 1.52 -1.50 -0.04 0.00 -0.02 0.00 0.00 35.03 35.00 1jzs n LYS 672 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 1jzs s ARG 673 N -2.27 3.76 1.31 1.97 1.81 0.45 -4.96 118.95 121.02 1jzs s ARG 673 Ca 0.37 0.34 -0.20 0.00 -1.72 0.00 0.00 55.73 54.53 1jzs s ARG 673 Cb 0.21 -2.49 0.31 0.00 -0.45 0.00 0.00 34.95 32.53 1jzs s ARG 673 CO 0.42 0.08 0.72 -2.30 -0.68 0.00 0.00 175.30 173.54 1jzs n PRO 674 N -1.01 -3.79 -0.05 3.54 -0.02 -1.26 -4.65 135.00 127.76 1jzs n PRO 674 Ca 0.01 -1.12 -0.15 0.00 -2.02 0.00 0.00 63.50 60.22 1jzs n PRO 674 Cb 0.54 -1.84 -0.07 0.00 -0.02 0.00 0.00 33.50 32.11 1jzs n PRO 674 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 1jzs h GLU 675 N -3.23 0.65 -0.51 -0.52 3.07 -1.97 -1.51 114.58 110.57 1jzs h GLU 675 Ca -0.40 -0.46 0.08 0.00 -0.50 0.00 0.00 59.36 58.08 1jzs h GLU 675 Cb 1.20 0.07 -0.03 0.00 -0.84 0.00 0.00 28.75 29.15 1jzs h GLU 675 CO 0.26 1.08 0.34 1.98 -1.40 0.00 0.00 179.01 181.28 1jzs h MET 676 N 0.33 0.34 0.22 2.33 4.05 -2.00 0.15 114.93 120.35 1jzs h MET 676 Ca -0.01 -0.02 -0.31 0.00 -0.28 0.00 0.00 59.70 59.08 1jzs h MET 676 Cb 1.11 -0.08 0.03 0.00 -0.80 0.00 0.00 31.60 31.86 1jzs h MET 676 CO 0.11 0.22 -1.39 -0.44 0.23 0.00 0.00 176.91 175.64 1jzs h ASP 677 N 0.35 0.74 0.06 1.39 3.32 -1.87 -3.07 116.42 117.33 1jzs h ASP 677 Ca 0.23 -0.93 -0.03 0.00 0.02 0.00 0.00 57.03 56.32 1jzs h ASP 677 Cb 0.46 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.76 1jzs h ASP 677 CO -0.06 1.66 -0.09 -0.09 -1.72 0.00 0.00 179.24 178.94 1jzs h ARG 678 N 0.02 0.10 0.45 3.56 2.43 -0.44 -2.58 114.38 117.92 1jzs h ARG 678 Ca -0.25 -0.02 -0.02 0.00 -0.81 0.00 0.00 59.98 58.88 1jzs h ARG 678 Cb 2.05 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 31.59 1jzs h ARG 678 CO 0.23 0.20 -0.21 2.35 -1.51 0.00 0.00 179.97 181.03 1jzs h TRP 679 N 0.10 -0.55 -1.26 2.20 7.01 -0.79 -2.70 115.95 119.95 1jzs h TRP 679 Ca 0.02 -0.01 0.37 0.00 2.11 0.00 0.00 58.89 61.38 1jzs h TRP 679 Cb 0.23 0.18 -0.10 0.00 -2.10 0.00 0.00 29.16 27.38 1jzs h TRP 679 CO 0.00 -0.34 0.84 1.25 -2.79 0.00 0.00 178.44 177.40 1jzs h LEU 680 N -0.72 0.24 -0.53 0.65 5.85 -1.40 0.82 115.31 120.21 1jzs h LEU 680 Ca -0.06 0.08 -0.16 0.00 0.84 0.00 0.00 57.88 58.58 1jzs h LEU 680 Cb 0.46 0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.53 1jzs h LEU 680 CO 0.10 -0.04 -0.68 -0.07 -0.34 0.00 0.00 178.44 177.41 1jzs h LEU 681 N 0.16 0.31 -0.21 2.25 3.38 -1.46 -1.97 115.31 117.77 1jzs h LEU 681 Ca 0.71 -0.20 -0.14 0.00 0.09 0.00 0.00 57.88 58.34 1jzs h LEU 681 Cb 2.27 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 42.93 1jzs h LEU 681 CO -0.26 0.90 -0.41 0.00 0.09 0.00 0.00 178.44 178.76 1jzs h ALA 682 N 1.10 0.34 -0.11 1.53 0.00 0.90 -3.01 119.26 120.01 1jzs h ALA 682 Ca -0.02 -0.46 -0.02 0.00 0.00 0.00 0.00 54.91 54.41 1jzs h ALA 682 Cb 1.22 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.94 1jzs h ALA 682 CO 0.11 0.45 -0.05 -0.09 0.00 0.00 0.00 179.25 179.67 1jzs h ARG 683 N 0.35 0.16 -0.06 0.00 9.65 -0.89 -2.21 114.38 121.38 1jzs h ARG 683 Ca 0.01 -0.02 -0.08 0.00 -1.10 0.00 0.00 59.98 58.79 1jzs h ARG 683 Cb 1.01 -0.03 -0.01 0.00 -1.39 0.00 0.00 29.97 29.55 1jzs h ARG 683 CO 0.09 0.22 -0.31 0.52 2.80 0.00 0.00 179.97 183.28 1jzs h MET 684 N 0.15 0.12 -0.14 0.20 2.86 -1.22 -1.17 114.93 115.73 1jzs h MET 684 Ca 0.04 -0.04 -0.16 0.00 -2.06 0.00 0.00 59.70 57.47 1jzs h MET 684 Cb 0.19 -0.01 -0.01 0.00 0.06 0.00 0.00 31.60 31.83 1jzs h MET 684 CO 0.01 0.43 -0.60 1.96 1.06 0.00 0.00 176.91 179.77 1jzs h GLN 685 N 0.11 0.46 0.61 1.72 1.08 -1.36 -2.37 115.11 115.37 1jzs h GLN 685 Ca 0.01 -0.31 -0.03 0.00 -1.45 0.00 0.00 58.65 56.88 1jzs h GLN 685 Cb 0.62 0.04 0.00 0.00 -0.05 0.00 0.00 27.48 28.09 1jzs h GLN 685 CO 0.04 0.92 -0.31 0.22 -0.95 0.00 0.00 178.83 178.75 1jzs h ASP 686 N 0.34 -0.75 -0.52 1.46 -0.00 -1.20 -2.13 116.42 113.62 1jzs h ASP 686 Ca -0.00 0.03 0.10 0.00 -0.00 0.00 0.00 57.03 57.16 1jzs h ASP 686 Cb 1.14 0.20 -0.10 0.00 -0.00 0.00 0.00 39.33 40.57 1jzs h ASP 686 CO 0.11 -0.52 -0.13 0.25 -0.00 0.00 0.00 179.24 178.95 1jzs h LEU 687 N -0.85 -0.48 -1.13 2.28 5.85 -1.20 0.17 115.31 119.96 1jzs h LEU 687 Ca -0.08 0.15 0.04 0.00 0.84 0.00 0.00 57.88 58.84 1jzs h LEU 687 Cb 0.66 0.32 -0.05 0.00 0.37 0.00 0.00 40.66 41.96 1jzs h LEU 687 CO 0.12 -0.17 0.59 0.40 -0.34 0.00 0.00 178.44 179.05 1jzs h ILE 688 N 0.00 1.13 -0.03 4.05 2.04 -1.29 -0.58 117.51 122.82 1jzs h ILE 688 Ca 0.25 -0.38 -0.01 0.00 1.00 0.00 0.00 64.86 65.72 1jzs h ILE 688 Cb 0.38 -0.07 -0.00 0.00 -0.74 0.00 0.00 36.82 36.38 1jzs h ILE 688 CO -0.53 0.20 -0.00 -0.61 0.00 0.00 0.00 178.15 177.21 1jzs h GLN 689 N 1.11 0.06 0.20 2.37 5.75 -0.51 -2.36 115.11 121.72 1jzs h GLN 689 Ca 0.37 -0.02 -0.01 0.00 -0.15 0.00 0.00 58.65 58.84 1jzs h GLN 689 Cb 0.07 -0.01 -0.00 0.00 1.07 0.00 0.00 27.48 28.61 1jzs h GLN 689 CO -0.12 0.35 -0.13 0.00 -2.65 0.00 0.00 178.83 176.28 1jzs h ARG 690 N -0.24 -0.30 -0.88 1.69 3.08 -0.52 0.16 114.38 117.37 1jzs h ARG 690 Ca 0.01 0.02 0.24 0.00 0.07 0.00 0.00 59.98 60.32 1jzs h ARG 690 Cb 0.32 0.07 -0.15 0.00 0.08 0.00 0.00 29.97 30.30 1jzs h ARG 690 CO 0.00 -0.20 0.21 0.28 -1.07 0.00 0.00 179.97 179.19 1jzs h VAL 691 N -0.31 0.28 -0.43 2.04 2.07 -1.23 0.28 116.25 118.95 1jzs h VAL 691 Ca -0.03 -0.06 -0.15 0.00 0.82 0.00 0.00 66.70 67.29 1jzs h VAL 691 Cb 0.25 0.09 -0.01 0.00 -1.52 0.00 0.00 31.29 30.10 1jzs h VAL 691 CO 0.02 0.03 -0.30 0.74 0.02 0.00 0.00 177.57 178.08 1jzs h THR 692 N 0.17 1.27 -0.40 2.57 2.02 -1.36 -2.69 112.91 114.49 1jzs h THR 692 Ca 0.56 -1.47 0.05 0.00 0.77 0.00 0.00 66.41 66.32 1jzs h THR 692 Cb 1.13 1.25 -0.05 0.00 -1.74 0.00 0.00 68.15 68.74 1jzs h THR 692 CO -0.69 0.50 0.13 -0.08 0.37 0.00 0.00 175.52 175.75 1jzs h GLU 693 N 0.81 0.27 -0.27 6.66 4.81 0.25 -1.14 114.58 125.97 1jzs h GLU 693 Ca 0.09 -0.02 -0.14 0.00 -0.13 0.00 0.00 59.36 59.16 1jzs h GLU 693 Cb 0.89 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 30.20 1jzs h GLU 693 CO 0.08 0.18 -0.42 0.00 -0.73 0.00 0.00 179.01 178.12 1jzs h ALA 694 N 1.27 0.76 -0.07 2.92 0.00 -1.18 -3.08 119.26 119.88 1jzs h ALA 694 Ca 0.19 -0.45 -0.14 0.00 0.00 0.00 0.00 54.91 54.51 1jzs h ALA 694 Cb 0.19 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 1jzs h ALA 694 CO -0.21 0.66 -0.56 -0.07 0.00 0.00 0.00 179.25 179.07 1jzs h LEU 695 N 0.54 0.24 -1.53 0.00 3.38 -1.20 0.43 115.31 117.18 1jzs h LEU 695 Ca 0.04 -0.13 -0.00 0.00 0.09 0.00 0.00 57.88 57.88 1jzs h LEU 695 Cb 0.95 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 41.63 1jzs h LEU 695 CO 0.09 0.75 -0.01 -0.08 0.09 0.00 0.00 178.44 179.28 1jzs h GLU 696 N 0.17 0.00 -0.18 1.13 4.57 -1.20 -1.61 114.58 117.45 1jzs h GLU 696 Ca -0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 1jzs h GLU 696 Cb 1.04 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.63 1jzs h GLU 696 CO 0.09 0.01 0.00 0.00 -1.18 0.00 0.00 179.01 177.93 1jzs n ALA 697 N -2.10 2.43 -3.43 2.92 0.00 -0.79 -4.98 120.51 114.58 1jzs n ALA 697 Ca 0.00 -0.82 -0.20 0.00 0.00 0.00 0.00 53.44 52.43 1jzs n ALA 697 Cb 0.30 -0.74 0.07 0.00 0.00 0.00 0.00 19.45 19.08 1jzs n ALA 697 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1jzs n TYR 698 N 1.25 -2.44 -3.67 0.00 4.02 -0.41 -4.98 117.16 110.93 1jzs n TYR 698 Ca 0.15 0.87 -0.38 0.00 -0.01 0.00 0.00 57.90 58.53 1jzs n TYR 698 Cb 0.54 -4.51 -0.10 0.00 -0.02 0.00 0.00 39.34 35.26 1jzs n TYR 698 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 176.86 176.19 1jzs s ASP 699 N -3.37 5.47 0.00 7.72 3.68 0.14 -4.94 116.67 125.37 1jzs s ASP 699 Ca 0.46 -2.22 0.29 0.00 2.13 0.00 0.00 52.55 53.21 1jzs s ASP 699 Cb -0.20 -1.91 1.33 0.00 -1.45 0.00 0.00 42.92 40.69 1jzs s ASP 699 CO 0.63 -0.55 1.93 -0.81 0.13 0.00 0.00 175.17 176.49 1jzs n PRO 700 N 4.41 0.60 -0.07 4.34 -0.04 -1.26 -3.91 135.00 139.07 1jzs n PRO 700 Ca -0.01 -0.15 -0.06 0.00 -0.04 0.00 0.00 63.50 63.24 1jzs n PRO 700 Cb 0.41 -1.50 -0.12 0.00 -0.04 0.00 0.00 33.50 32.25 1jzs n PRO 700 CO 0.00 0.00 0.00 -2.37 -0.04 0.00 0.00 175.50 173.09 1jzs n THR 701 N -1.07 0.94 0.06 0.52 5.66 -1.26 -3.53 114.28 115.60 1jzs n THR 701 Ca 0.14 -0.61 -0.09 0.00 -3.05 0.00 0.00 64.05 60.45 1jzs n THR 701 Cb 0.26 -0.55 -0.13 0.00 -1.55 0.00 0.00 70.33 68.37 1jzs n THR 701 CO 0.00 0.00 0.00 0.71 -3.05 0.00 0.00 175.07 172.73 1jzs h THR 702 N 0.00 1.62 0.39 1.09 1.35 -1.88 -1.91 112.91 113.57 1jzs h THR 702 Ca -0.37 -3.31 -0.02 0.00 -0.55 0.00 0.00 66.41 62.16 1jzs h THR 702 Cb 1.82 2.84 0.00 0.00 -1.73 0.00 0.00 68.15 71.09 1jzs h THR 702 CO 0.02 0.93 -0.19 0.77 -0.25 0.00 0.00 175.52 176.81 1jzs h SER 703 N 0.01 -0.44 -0.89 5.36 4.64 -1.79 -0.16 113.55 120.29 1jzs h SER 703 Ca -0.05 -0.10 0.11 0.00 -0.47 0.00 0.00 61.79 61.28 1jzs h SER 703 Cb 1.82 0.11 -0.07 0.00 -0.31 0.00 0.00 62.40 63.96 1jzs h SER 703 CO 0.14 -0.14 0.57 0.00 -0.87 0.00 0.00 176.83 176.53 1jzs h ALA 704 N -0.23 1.71 -0.07 5.18 0.00 -1.62 -1.00 119.26 123.23 1jzs h ALA 704 Ca -0.05 0.00 -0.12 0.00 0.00 0.00 0.00 54.91 54.75 1jzs h ALA 704 Cb 0.51 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 1jzs h ALA 704 CO 0.09 0.08 -0.48 0.00 0.00 0.00 0.00 179.25 178.94 1jzs h ARG 705 N 0.80 0.17 -0.18 0.00 3.08 -1.06 -1.96 114.38 115.23 1jzs h ARG 705 Ca 0.42 -0.09 -0.02 0.00 0.07 0.00 0.00 59.98 60.37 1jzs h ARG 705 Cb 0.53 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.57 1jzs h ARG 705 CO -0.19 0.62 0.04 0.00 -1.07 0.00 0.00 179.97 179.36 1jzs h ALA 706 N 1.37 0.23 -0.72 0.04 0.00 0.28 0.19 119.26 120.66 1jzs h ALA 706 Ca 0.01 -0.16 0.10 0.00 0.00 0.00 0.00 54.91 54.86 1jzs h ALA 706 Cb 0.90 -0.07 -0.07 0.00 0.00 0.00 0.00 17.79 18.55 1jzs h ALA 706 CO 0.07 -0.11 0.35 1.25 0.00 0.00 0.00 179.25 180.81 1jzs h LEU 707 N 0.09 0.44 0.26 0.00 6.46 -1.24 -0.88 115.31 120.45 1jzs h LEU 707 Ca 0.05 0.07 -0.01 0.00 -0.12 0.00 0.00 57.88 57.87 1jzs h LEU 707 Cb 0.29 -0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.22 1jzs h LEU 707 CO 0.00 0.24 -0.13 -0.09 -0.62 0.00 0.00 178.44 177.85 1jzs h ARG 708 N 0.59 -0.34 -0.97 1.25 1.12 -0.97 -2.80 114.38 112.26 1jzs h ARG 708 Ca 0.36 0.02 0.03 0.00 -1.11 0.00 0.00 59.98 59.29 1jzs h ARG 708 Cb 0.41 0.08 -0.06 0.00 -0.01 0.00 0.00 29.97 30.39 1jzs h ARG 708 CO -0.29 -0.12 0.63 -0.44 -3.11 0.00 0.00 179.97 176.65 1jzs h ASP 709 N -0.50 1.06 0.24 -3.80 3.32 -0.52 -2.31 116.42 113.91 1jzs h ASP 709 Ca -0.04 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.01 1jzs h ASP 709 Cb 0.38 -0.24 -0.04 0.00 0.22 0.00 0.00 39.33 39.64 1jzs h ASP 709 CO 0.06 0.73 -0.51 0.15 -1.72 0.00 0.00 179.24 177.95 1jzs h PHE 710 N 1.24 -1.45 -0.60 4.55 3.57 -1.10 -0.88 116.94 122.27 1jzs h PHE 710 Ca 0.38 0.03 0.17 0.00 3.53 0.00 0.00 57.97 62.09 1jzs h PHE 710 Cb -0.01 0.60 -0.02 0.00 2.79 0.00 0.00 35.95 39.30 1jzs h PHE 710 CO -0.01 -0.61 0.49 0.28 -2.23 0.00 0.00 178.31 176.23 1jzs h VAL 711 N -0.83 0.55 -2.33 1.41 2.07 -1.21 -1.01 116.25 114.90 1jzs h VAL 711 Ca -0.02 0.00 -0.73 0.00 0.82 0.00 0.00 66.70 66.77 1jzs h VAL 711 Cb 0.79 0.65 -0.33 0.00 -1.52 0.00 0.00 31.29 30.88 1jzs h VAL 711 CO -0.21 0.00 0.37 0.52 0.02 0.00 0.00 177.57 178.27 1jzs n VAL 712 N -4.10 4.83 0.00 2.57 0.31 -0.34 -2.28 118.33 119.31 1jzs n VAL 712 Ca 0.12 -5.81 0.00 0.00 -0.01 0.00 0.00 64.34 58.64 1jzs n VAL 712 Cb 0.72 -1.60 0.00 0.00 -0.91 0.00 0.00 33.84 32.05 1jzs n VAL 712 CO 0.00 0.00 0.00 -1.84 -1.32 0.00 0.00 176.83 173.67 1jzs n GLU 713 N 0.10 0.00 -0.09 5.55 -0.00 -0.99 -4.50 120.64 120.71 1jzs n GLU 713 Ca 0.38 0.00 -0.10 0.00 -0.00 0.00 0.00 57.16 57.44 1jzs n GLU 713 Cb 0.32 0.00 -0.12 0.00 -0.00 0.00 0.00 31.44 31.64 1jzs n GLU 713 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.13 173.66 1jzs n ASP 714 N 0.00 1.38 0.03 -1.84 2.03 -0.42 -3.88 116.55 113.85 1jzs n ASP 714 Ca 0.00 -0.04 -0.01 0.00 0.52 0.00 0.00 54.79 55.26 1jzs n ASP 714 Cb 0.00 0.52 -0.00 0.00 -0.72 0.00 0.00 41.12 40.92 1jzs n ASP 714 CO 0.00 0.00 0.00 -0.11 -1.92 0.00 0.00 177.20 175.17 1jzs n LEU 715 N -2.77 1.16 0.00 -2.67 -0.00 -0.97 -2.17 117.00 109.58 1jzs n LEU 715 Ca -0.30 0.16 0.00 0.00 -0.00 0.00 0.00 56.01 55.87 1jzs n LEU 715 Cb 0.99 -0.38 0.00 0.00 -0.00 0.00 0.00 43.42 44.04 1jzs n LEU 715 CO 0.31 -0.68 0.00 -0.24 -0.00 0.00 0.00 177.39 176.78 1jzs n SER 716 N -3.56 0.00 -0.93 1.96 2.88 -1.25 -3.82 113.62 108.90 1jzs n SER 716 Ca -0.02 0.00 -0.02 0.00 -1.33 0.00 0.00 58.87 57.51 1jzs n SER 716 Cb 0.07 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.51 1jzs n SER 716 CO 0.00 0.00 0.00 1.67 -1.23 0.00 0.00 175.04 175.48 1jzs n GLN 717 N -1.59 0.00 0.00 -1.46 7.27 -1.26 -4.93 117.38 115.41 1jzs n GLN 717 Ca 0.00 -1.01 0.00 0.00 0.07 0.00 0.00 57.00 56.06 1jzs n GLN 717 Cb 0.00 0.11 0.00 0.00 2.41 0.00 0.00 30.24 32.76 1jzs n GLN 717 CO 0.00 0.00 0.00 1.87 0.07 0.00 0.00 177.06 179.00 1jzs n TRP 718 N 0.12 0.00 0.00 3.69 -0.00 -1.25 -4.78 117.44 115.22 1jzs n TRP 718 Ca -0.09 0.00 0.00 0.00 -0.00 0.00 0.00 57.50 57.41 1jzs n TRP 718 Cb 0.76 0.00 0.00 0.00 -0.00 0.00 0.00 31.31 32.07 1jzs n TRP 718 CO 0.00 0.00 0.00 0.98 -0.00 0.00 0.00 177.69 178.67 1jzs n TYR 719 N 0.00 0.00 0.11 5.87 9.36 -1.25 0.43 117.16 131.68 1jzs n TYR 719 Ca 0.00 0.00 0.17 0.00 3.32 0.00 0.00 57.90 61.39 1jzs n TYR 719 Cb 0.00 -0.41 0.72 0.00 -0.63 0.00 0.00 39.34 39.02 1jzs n TYR 719 CO 0.00 0.00 0.00 -0.24 0.22 0.00 0.00 176.86 176.84 1jzs h VAL 720 N 0.00 0.69 0.24 2.97 3.04 -1.70 -1.22 116.25 120.27 1jzs h VAL 720 Ca 0.00 0.00 -0.01 0.00 -1.01 0.00 0.00 66.70 65.68 1jzs h VAL 720 Cb 0.00 0.81 0.00 0.00 -2.01 0.00 0.00 31.29 30.09 1jzs h VAL 720 CO 0.00 0.00 -0.12 -0.09 -1.01 0.00 0.00 177.57 176.35 1jzs h ARG 721 N 0.00 -0.31 -0.50 4.17 9.65 -0.22 -2.77 114.38 124.40 1jzs h ARG 721 Ca 0.16 0.02 0.00 0.00 -1.10 0.00 0.00 59.98 59.06 1jzs h ARG 721 Cb 0.68 0.07 0.00 0.00 -1.39 0.00 0.00 29.97 29.33 1jzs h ARG 721 CO -0.00 -0.21 0.00 0.54 2.80 0.00 0.00 179.97 183.10 1jzs n ARG 722 N -3.25 1.77 0.00 0.20 1.74 0.14 -3.26 116.66 113.99 1jzs n ARG 722 Ca -0.04 -0.83 0.00 0.00 -0.77 0.00 0.00 57.85 56.21 1jzs n ARG 722 Cb 0.13 -1.40 0.00 0.00 -1.02 0.00 0.00 32.46 30.16 1jzs n ARG 722 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 1jzs n ASN 723 N 0.15 1.24 0.01 0.55 3.02 -0.47 -4.80 115.26 114.96 1jzs n ASN 723 Ca 0.08 -1.59 0.07 0.00 -0.03 0.00 0.00 54.58 53.10 1jzs n ASN 723 Cb 0.33 0.00 0.48 0.00 -0.61 0.00 0.00 39.78 39.98 1jzs n ASN 723 CO 0.00 0.00 0.00 -0.09 -2.62 0.00 0.00 177.26 174.55 1jzs h ARG 724 N 0.00 0.42 0.00 3.52 2.43 -1.47 -2.34 114.38 116.94 1jzs h ARG 724 Ca 0.00 -0.03 -0.07 0.00 -0.81 0.00 0.00 59.98 59.08 1jzs h ARG 724 Cb 0.64 -0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 30.09 1jzs h ARG 724 CO 0.00 0.28 -0.31 0.07 -1.51 0.00 0.00 179.97 178.49 1jzs h ARG 725 N 0.43 0.00 -0.57 0.20 0.11 -1.87 -3.12 114.38 109.56 1jzs h ARG 725 Ca 0.17 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.25 1jzs h ARG 725 Cb 0.13 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.21 1jzs h ARG 725 CO -0.04 0.31 0.00 0.54 0.10 0.00 0.00 179.97 180.88 1jzs n ARG 726 N -3.59 0.75 0.00 0.08 1.74 -0.88 -2.80 116.66 111.96 1jzs n ARG 726 Ca -0.01 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.07 1jzs n ARG 726 Cb 0.44 -1.29 0.00 0.00 -1.02 0.00 0.00 32.46 30.60 1jzs n ARG 726 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 1jzs n PHE 727 N -0.02 0.00 -3.84 -1.55 3.72 -1.18 -4.80 117.46 109.80 1jzs n PHE 727 Ca 0.00 0.00 -0.21 0.00 -0.05 0.00 0.00 57.45 57.19 1jzs n PHE 727 Cb 0.14 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.65 1jzs n PHE 727 CO 0.00 0.00 0.00 -0.46 -0.05 0.00 0.00 176.76 176.25 1jzs s TRP 728 N -0.14 2.95 0.00 1.38 -0.00 -1.12 -4.97 118.94 117.04 1jzs s TRP 728 Ca 0.00 -0.27 0.00 0.00 -0.00 0.00 0.00 56.10 55.83 1jzs s TRP 728 Cb 0.00 -1.75 0.00 0.00 -0.00 0.00 0.00 33.47 31.72 1jzs s TRP 728 CO 0.00 0.22 0.40 0.36 -0.00 0.00 0.00 176.95 177.93 1jzs n LYS 729 N -1.36 0.00 -0.32 5.86 2.85 -1.26 -0.10 118.16 123.83 1jzs n LYS 729 Ca -0.03 0.40 0.26 0.00 -1.05 0.00 0.00 58.31 57.90 1jzs n LYS 729 Cb 0.59 -0.63 0.40 0.00 -0.65 0.00 0.00 35.03 34.74 1jzs n LYS 729 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 1jzs n ASN 730 N -2.03 0.00 -4.56 -5.58 3.02 -1.26 -3.90 115.26 100.94 1jzs n ASN 730 Ca 0.00 0.52 -0.23 0.00 -0.03 0.00 0.00 54.58 54.83 1jzs n ASN 730 Cb 0.00 -0.24 -0.06 0.00 -0.61 0.00 0.00 39.78 38.87 1jzs n ASN 730 CO 0.00 0.00 0.00 -0.70 -2.62 0.00 0.00 177.26 173.94 1jzs s GLU 731 N -3.84 2.24 -0.29 3.52 -6.30 0.86 -4.72 118.70 110.16 1jzs s GLU 731 Ca -0.02 -0.30 0.10 0.00 -2.50 0.00 0.00 54.97 52.25 1jzs s GLU 731 Cb 0.13 -5.03 0.54 0.00 0.00 0.00 0.00 34.13 29.77 1jzs s GLU 731 CO 0.43 -3.88 1.53 -0.40 0.02 0.00 0.00 175.26 172.96 1jzs n ASP 732 N 15.48 2.99 -4.21 -1.70 3.85 -1.25 -4.84 116.55 126.87 1jzs n ASP 732 Ca 0.42 -3.59 -0.40 0.00 -0.71 0.00 0.00 54.79 50.51 1jzs n ASP 732 Cb 0.46 -0.65 -0.04 0.00 -1.35 0.00 0.00 41.12 39.54 1jzs n ASP 732 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 1jzs s ALA 733 N -3.16 4.36 0.00 2.12 0.00 -1.26 -4.99 121.76 118.82 1jzs s ALA 733 Ca 0.46 -3.75 0.00 0.00 0.00 0.00 0.00 51.96 48.67 1jzs s ALA 733 Cb 0.40 -3.14 0.00 0.00 0.00 0.00 0.00 23.12 20.39 1jzs s ALA 733 CO 0.03 -2.18 0.00 -0.11 0.00 0.00 0.00 175.76 173.51 1jzs n LEU 734 N 2.70 0.00 0.29 0.00 7.94 -1.26 0.59 117.00 127.25 1jzs n LEU 734 Ca 0.20 0.00 -0.17 0.00 -1.11 0.00 0.00 56.01 54.93 1jzs n LEU 734 Cb 0.39 0.00 -0.09 0.00 0.53 0.00 0.00 43.42 44.24 1jzs n LEU 734 CO 0.39 0.00 0.52 0.44 -1.11 0.00 0.00 177.39 177.64 1jzs h ASP 735 N 0.00 -1.30 -0.88 1.96 5.19 -1.95 0.37 116.42 119.81 1jzs h ASP 735 Ca 0.00 0.10 0.11 0.00 -0.62 0.00 0.00 57.03 56.63 1jzs h ASP 735 Cb 0.00 0.43 -0.07 0.00 0.18 0.00 0.00 39.33 39.87 1jzs h ASP 735 CO 0.00 -0.64 0.57 -0.09 -3.12 0.00 0.00 179.24 175.96 1jzs h ARG 736 N -0.97 0.77 -0.54 3.56 2.43 -0.97 0.41 114.38 119.07 1jzs h ARG 736 Ca -0.06 -0.05 0.01 0.00 -0.81 0.00 0.00 59.98 59.07 1jzs h ARG 736 Cb 0.84 -0.17 -0.03 0.00 -0.42 0.00 0.00 29.97 30.19 1jzs h ARG 736 CO -0.05 0.51 0.36 1.49 -1.51 0.00 0.00 179.97 180.77 1jzs h GLU 737 N 0.79 0.69 -2.01 0.20 4.81 0.11 -1.79 114.58 117.39 1jzs h GLU 737 Ca 0.42 -0.04 -0.00 0.00 -0.13 0.00 0.00 59.36 59.60 1jzs h GLU 737 Cb 0.53 -0.16 -0.00 0.00 0.63 0.00 0.00 28.75 29.75 1jzs h GLU 737 CO -0.18 0.46 -0.00 0.00 -0.73 0.00 0.00 179.01 178.55 1jzs n ALA 738 N -2.46 3.35 1.34 2.92 0.00 0.14 -4.00 120.51 121.81 1jzs n ALA 738 Ca 0.05 -0.04 0.13 0.00 0.00 0.00 0.00 53.44 53.58 1jzs n ALA 738 Cb 0.06 -1.31 0.70 0.00 0.00 0.00 0.00 19.45 18.89 1jzs n ALA 738 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1jzs n ALA 739 N 1.67 2.37 0.32 0.00 0.00 -0.67 -3.27 120.51 120.93 1jzs n ALA 739 Ca 0.01 -0.13 0.15 0.00 0.00 0.00 0.00 53.44 53.46 1jzs n ALA 739 Cb 0.37 -1.44 0.50 0.00 0.00 0.00 0.00 19.45 18.89 1jzs n ALA 739 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.50 179.38 1jzs h TYR 740 N 0.00 0.00 -0.53 0.00 -1.99 -1.87 -3.27 116.97 109.31 1jzs h TYR 740 Ca 0.00 0.00 -0.03 0.00 2.00 0.00 0.00 58.73 60.70 1jzs h TYR 740 Cb 0.21 0.00 -0.02 0.00 2.00 0.00 0.00 36.73 38.92 1jzs h TYR 740 CO 0.00 0.00 0.23 0.00 -0.00 0.00 0.00 178.16 178.39 1jzs h ALA 741 N 2.11 0.69 -0.02 3.88 0.00 -1.92 0.58 119.26 124.57 1jzs h ALA 741 Ca 0.00 -0.14 -0.24 0.00 0.00 0.00 0.00 54.91 54.52 1jzs h ALA 741 Cb 0.62 -0.21 0.02 0.00 0.00 0.00 0.00 17.79 18.22 1jzs h ALA 741 CO 0.00 0.28 -0.93 1.79 0.00 0.00 0.00 179.25 180.39 1jzs h THR 742 N 0.72 1.30 0.00 0.00 1.35 -1.84 -2.02 112.91 112.42 1jzs h THR 742 Ca 0.18 -2.17 0.00 0.00 -0.55 0.00 0.00 66.41 63.87 1jzs h THR 742 Cb 0.16 2.35 0.00 0.00 -1.73 0.00 0.00 68.15 68.93 1jzs h THR 742 CO -0.02 0.67 0.00 0.25 -0.25 0.00 0.00 175.52 176.17 1jzs h LEU 743 N 0.34 0.00 0.09 3.87 5.85 -1.63 -1.79 115.31 122.05 1jzs h LEU 743 Ca -0.11 0.00 -0.17 0.00 0.84 0.00 0.00 57.88 58.44 1jzs h LEU 743 Cb 1.59 0.00 0.01 0.00 0.37 0.00 0.00 40.66 42.63 1jzs h LEU 743 CO 0.19 0.00 -0.84 0.22 -0.34 0.00 0.00 178.44 177.66 1jzs h TYR 744 N 0.00 0.35 0.00 1.25 3.20 -0.84 -3.06 116.97 117.87 1jzs h TYR 744 Ca 0.00 -0.26 -0.06 0.00 3.14 0.00 0.00 58.73 61.55 1jzs h TYR 744 Cb 0.66 -0.01 -0.01 0.00 1.54 0.00 0.00 36.73 38.91 1jzs h TYR 744 CO 0.00 1.33 -0.31 0.93 -1.64 0.00 0.00 178.16 178.47 1jzs h GLU 745 N -0.55 0.00 0.77 1.82 3.07 -1.35 -1.82 114.58 116.52 1jzs h GLU 745 Ca -0.17 0.00 -0.04 0.00 -0.50 0.00 0.00 59.36 58.65 1jzs h GLU 745 Cb 1.51 0.00 0.01 0.00 -0.84 0.00 0.00 28.75 29.42 1jzs h GLU 745 CO 0.06 0.31 -0.37 0.00 -1.40 0.00 0.00 179.01 177.61 1jzs h ALA 746 N 1.69 -1.04 -0.82 3.43 0.00 -1.42 -1.97 119.26 119.13 1jzs h ALA 746 Ca -0.00 -0.23 0.10 0.00 0.00 0.00 0.00 54.91 54.78 1jzs h ALA 746 Cb 0.70 0.40 -0.07 0.00 0.00 0.00 0.00 17.79 18.81 1jzs h ALA 746 CO 0.04 -0.96 0.47 -0.07 0.00 0.00 0.00 179.25 178.72 1jzs h LEU 747 N -1.27 0.66 -2.12 0.00 3.38 -1.46 0.28 115.31 114.78 1jzs h LEU 747 Ca -0.11 0.05 -0.01 0.00 0.09 0.00 0.00 57.88 57.90 1jzs h LEU 747 Cb 0.79 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 41.47 1jzs h LEU 747 CO 0.17 0.37 -0.06 0.58 0.09 0.00 0.00 178.44 179.59 1jzs h VAL 748 N 0.77 0.30 0.15 1.22 2.07 -1.33 -1.73 116.25 117.71 1jzs h VAL 748 Ca 0.40 -0.37 -0.25 0.00 0.82 0.00 0.00 66.70 67.30 1jzs h VAL 748 Cb 0.39 1.27 0.03 0.00 -1.52 0.00 0.00 31.29 31.46 1jzs h VAL 748 CO -0.26 0.06 -1.08 0.25 0.02 0.00 0.00 177.57 176.56 1jzs h LEU 749 N 0.00 0.69 -0.59 2.57 5.85 0.32 -3.07 115.31 121.08 1jzs h LEU 749 Ca -0.00 -0.89 0.00 0.00 0.84 0.00 0.00 57.88 57.83 1jzs h LEU 749 Cb 0.27 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 41.05 1jzs h LEU 749 CO 0.01 1.52 0.37 0.58 -0.34 0.00 0.00 178.44 180.57 1jzs h VAL 750 N -0.03 1.17 -0.02 1.05 2.07 -0.53 -0.52 116.25 119.43 1jzs h VAL 750 Ca -0.18 -0.35 -0.04 0.00 0.82 0.00 0.00 66.70 66.96 1jzs h VAL 750 Cb 1.81 0.34 -0.01 0.00 -1.52 0.00 0.00 31.29 31.92 1jzs h VAL 750 CO 0.20 0.17 -0.16 0.00 0.02 0.00 0.00 177.57 177.80 1jzs h ALA 751 N 1.19 1.69 0.11 1.67 0.00 -1.43 0.56 119.26 123.05 1jzs h ALA 751 Ca 0.21 -0.16 -0.19 0.00 0.00 0.00 0.00 54.91 54.77 1jzs h ALA 751 Cb -0.05 -0.04 0.01 0.00 0.00 0.00 0.00 17.79 17.72 1jzs h ALA 751 CO -0.04 0.23 -0.88 1.15 0.00 0.00 0.00 179.25 179.71 1jzs h THR 752 N 0.04 1.41 -0.71 0.00 2.02 -1.34 -2.98 112.91 111.34 1jzs h THR 752 Ca 0.01 -2.47 -0.07 0.00 0.77 0.00 0.00 66.41 64.64 1jzs h THR 752 Cb 0.31 3.08 -0.03 0.00 -1.74 0.00 0.00 68.15 69.77 1jzs h THR 752 CO 0.02 0.69 0.17 -0.07 0.37 0.00 0.00 175.52 176.70 1jzs h LEU 753 N -0.45 1.08 -0.23 2.58 3.38 -0.95 -2.60 115.31 118.12 1jzs h LEU 753 Ca -0.17 -0.23 0.00 0.00 0.09 0.00 0.00 57.88 57.57 1jzs h LEU 753 Cb 1.59 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 42.05 1jzs h LEU 753 CO 0.10 1.03 0.00 0.00 0.09 0.00 0.00 178.44 179.66 1jzs n ALA 754 N -2.45 1.53 0.06 1.53 0.00 0.19 -4.08 120.51 117.29 1jzs n ALA 754 Ca 0.05 -0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.38 1jzs n ALA 754 Cb 0.26 -1.24 -0.05 0.00 0.00 0.00 0.00 19.45 18.43 1jzs n ALA 754 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1jzs h ALA 755 N 2.35 -0.30 0.00 0.00 0.00 -1.30 -0.81 119.26 119.20 1jzs h ALA 755 Ca 0.00 -0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 1jzs h ALA 755 Cb 0.22 0.40 -0.00 0.00 0.00 0.00 0.00 17.79 18.41 1jzs h ALA 755 CO 0.00 -0.73 -0.12 -1.35 0.00 0.00 0.00 179.25 177.05 1jzs h PRO 756 N -0.36 0.00 0.00 0.00 0.11 -1.81 -2.69 132.00 127.25 1jzs h PRO 756 Ca 0.06 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.17 1jzs h PRO 756 Cb 0.44 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.55 1jzs h PRO 756 CO -0.20 0.12 -0.20 0.74 -0.21 0.00 0.00 178.00 178.25 1jzs h PHE 757 N 0.00 0.00 -3.28 0.65 -1.00 -1.75 -3.37 116.94 108.19 1jzs h PHE 757 Ca -0.00 0.00 -0.67 0.00 2.81 0.00 0.00 57.97 60.11 1jzs h PHE 757 Cb 0.38 0.00 -0.38 0.00 3.61 0.00 0.00 35.95 39.56 1jzs h PHE 757 CO 0.00 0.00 -0.31 0.95 -1.61 0.00 0.00 178.31 177.34 1jzs s THR 758 N -1.70 3.70 0.56 -1.55 -4.23 -0.33 -4.74 115.64 107.35 1jzs s THR 758 Ca -0.06 -3.84 0.25 0.00 -1.18 0.00 0.00 61.69 56.87 1jzs s THR 758 Cb 0.01 -3.36 0.34 0.00 1.34 0.00 0.00 72.50 70.83 1jzs s THR 758 CO 0.09 -1.01 2.13 1.55 -0.54 0.00 0.00 174.62 176.83 1jzs h PRO 759 N 5.99 0.00 0.06 3.99 0.13 -1.66 -2.34 132.00 138.17 1jzs h PRO 759 Ca 0.11 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.24 1jzs h PRO 759 Cb 0.82 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.95 1jzs h PRO 759 CO 0.78 0.00 -0.03 0.74 -0.23 0.00 0.00 178.00 179.26 1jzs h PHE 760 N 0.00 -0.08 -1.01 1.56 -1.00 -1.93 -3.23 116.94 111.26 1jzs h PHE 760 Ca 0.07 -0.00 0.11 0.00 2.81 0.00 0.00 57.97 60.96 1jzs h PHE 760 Cb 0.34 0.03 -0.08 0.00 3.61 0.00 0.00 35.95 39.84 1jzs h PHE 760 CO 0.00 -0.00 0.64 1.25 -1.61 0.00 0.00 178.31 178.58 1jzs h LEU 761 N -1.02 0.95 -0.56 1.54 5.85 -1.96 -0.80 115.31 119.33 1jzs h LEU 761 Ca -0.01 0.04 0.02 0.00 0.84 0.00 0.00 57.88 58.77 1jzs h LEU 761 Cb 0.11 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 40.95 1jzs h LEU 761 CO 0.01 0.52 0.35 0.00 -0.34 0.00 0.00 178.44 178.99 1jzs h ALA 762 N 1.53 0.71 0.16 1.25 0.00 -1.58 -2.16 119.26 119.17 1jzs h ALA 762 Ca 0.49 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.37 1jzs h ALA 762 Cb 0.44 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.04 1jzs h ALA 762 CO -0.25 0.09 -0.08 1.49 0.00 0.00 0.00 179.25 180.50 1jzs h GLU 763 N 0.70 -0.21 -0.80 0.00 4.57 -1.20 -1.10 114.58 116.53 1jzs h GLU 763 Ca 0.22 0.01 0.02 0.00 -1.18 0.00 0.00 59.36 58.43 1jzs h GLU 763 Cb -0.02 0.05 -0.04 0.00 -0.16 0.00 0.00 28.75 28.58 1jzs h GLU 763 CO -0.08 -0.12 0.53 -0.39 -1.18 0.00 0.00 179.01 177.78 1jzs h VAL 764 N -0.24 1.18 -0.10 0.32 -1.51 -1.13 -0.06 116.25 114.72 1jzs h VAL 764 Ca -0.02 -0.36 -0.10 0.00 -1.23 0.00 0.00 66.70 64.99 1jzs h VAL 764 Cb 0.19 0.03 -0.01 0.00 -2.13 0.00 0.00 31.29 29.36 1jzs h VAL 764 CO 0.04 0.19 -0.38 0.25 -1.23 0.00 0.00 177.57 176.44 1jzs h LEU 765 N 1.06 0.22 -0.18 4.19 5.85 -1.19 -3.09 115.31 122.17 1jzs h LEU 765 Ca 0.30 -0.08 -0.22 0.00 0.84 0.00 0.00 57.88 58.72 1jzs h LEU 765 Cb -0.08 -0.06 -0.00 0.00 0.37 0.00 0.00 40.66 40.89 1jzs h LEU 765 CO -0.07 0.58 -0.95 -0.25 -0.34 0.00 0.00 178.44 177.42 1jzs h TRP 766 N 0.18 0.50 0.17 1.25 2.91 0.15 -2.34 115.95 118.77 1jzs h TRP 766 Ca 0.02 -0.28 -0.01 0.00 1.13 0.00 0.00 58.89 59.75 1jzs h TRP 766 Cb 0.76 -0.05 0.00 0.00 -0.51 0.00 0.00 29.16 29.36 1jzs h TRP 766 CO 0.01 1.11 -0.08 1.96 -1.03 0.00 0.00 178.44 180.41 1jzs h GLN 767 N 0.18 -0.22 0.00 2.65 1.08 -1.00 -1.81 115.11 115.99 1jzs h GLN 767 Ca -0.07 0.01 0.00 0.00 -1.45 0.00 0.00 58.65 57.14 1jzs h GLN 767 Cb 1.59 0.05 0.00 0.00 -0.05 0.00 0.00 27.48 29.07 1jzs h GLN 767 CO 0.16 -0.01 0.00 -1.71 -0.95 0.00 0.00 178.83 176.32 1jzs n ASN 768 N -5.11 0.00 -0.23 1.46 2.85 -1.17 -2.38 115.26 110.68 1jzs n ASN 768 Ca -0.09 0.16 0.22 0.00 -0.11 0.00 0.00 54.58 54.75 1jzs n ASN 768 Cb 0.18 0.00 0.40 0.00 1.24 0.00 0.00 39.78 41.60 1jzs n ASN 768 CO 0.00 0.00 0.00 0.18 -2.11 0.00 0.00 177.26 175.33 1jzs n LEU 769 N -0.30 0.22 -0.11 1.20 4.32 -0.88 -1.58 117.00 119.88 1jzs n LEU 769 Ca 0.00 1.17 -0.20 0.00 -0.02 0.00 0.00 56.01 56.96 1jzs n LEU 769 Cb 0.00 -0.56 -0.07 0.00 -1.62 0.00 0.00 43.42 41.17 1jzs n LEU 769 CO 0.00 -1.30 -1.08 0.52 -1.22 0.00 0.00 177.39 174.31 1jzs n VAL 770 N -4.61 1.43 0.33 4.08 0.31 -0.73 -4.37 118.33 114.75 1jzs n VAL 770 Ca 0.26 -0.16 0.21 0.00 -0.01 0.00 0.00 64.34 64.65 1jzs n VAL 770 Cb 0.88 -2.01 1.12 0.00 -0.91 0.00 0.00 33.84 32.92 1jzs n VAL 770 CO 0.00 0.00 0.00 0.03 -1.32 0.00 0.00 176.83 175.54 1jzs h ARG 771 N -0.91 0.00 -0.03 5.55 2.47 -1.05 -0.72 114.38 119.69 1jzs h ARG 771 Ca -0.40 0.00 -0.25 0.00 -1.26 0.00 0.00 59.98 58.08 1jzs h ARG 771 Cb 1.31 0.00 0.01 0.00 -1.65 0.00 0.00 29.97 29.65 1jzs h ARG 771 CO -0.24 0.00 -0.96 0.77 0.56 0.00 0.00 179.97 180.11 1jzs h SER 772 N 0.00 0.81 0.00 7.04 0.02 -1.28 -3.33 113.55 116.82 1jzs h SER 772 Ca -0.00 -0.62 -0.09 0.00 -0.84 0.00 0.00 61.79 60.23 1jzs h SER 772 Cb 0.08 -0.25 -0.01 0.00 0.14 0.00 0.00 62.40 62.36 1jzs h SER 772 CO 0.00 1.42 -0.80 0.58 -1.14 0.00 0.00 176.83 176.89 1jzs h VAL 773 N 0.38 0.38 -3.27 2.27 2.07 -1.63 -3.42 116.25 113.03 1jzs h VAL 773 Ca -0.10 -1.49 -0.78 0.00 0.82 0.00 0.00 66.70 65.16 1jzs h VAL 773 Cb 1.60 0.92 -0.30 0.00 -1.52 0.00 0.00 31.29 31.99 1jzs h VAL 773 CO 0.18 0.13 0.41 0.54 0.02 0.00 0.00 177.57 178.86 1jzs n ARG 774 N -4.55 3.62 -0.06 1.57 1.74 -0.33 -4.89 116.66 113.77 1jzs n ARG 774 Ca -0.17 -4.50 0.25 0.00 -0.77 0.00 0.00 57.85 52.66 1jzs n ARG 774 Cb 0.43 -2.50 0.69 0.00 -1.02 0.00 0.00 32.46 30.06 1jzs n ARG 774 CO 0.00 0.00 0.00 1.37 -1.52 0.00 0.00 177.63 177.48 1jzs h LEU 775 N 6.07 0.00 -1.28 0.55 -0.00 -1.78 0.18 115.31 119.04 1jzs h LEU 775 Ca 0.18 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 58.06 1jzs h LEU 775 Cb 0.78 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.44 1jzs h LEU 775 CO 1.08 0.00 0.00 -1.84 -0.00 0.00 0.00 178.44 177.68 1jzs n GLU 776 N -3.77 1.86 -1.31 0.17 0.00 -1.26 -4.91 120.64 111.42 1jzs n GLU 776 Ca 0.14 -0.94 -0.30 0.00 0.00 0.00 0.00 57.16 56.06 1jzs n GLU 776 Cb 0.92 -1.42 0.22 0.00 0.00 0.00 0.00 31.44 31.16 1jzs n GLU 776 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1jzs s ALA 777 N -1.64 1.08 0.25 -1.84 0.00 0.62 -5.00 121.76 115.23 1jzs s ALA 777 Ca 0.17 -0.96 -0.30 0.00 0.00 0.00 0.00 51.96 50.88 1jzs s ALA 777 Cb 0.11 -2.88 -0.09 0.00 0.00 0.00 0.00 23.12 20.26 1jzs s ALA 777 CO 0.09 -3.21 1.17 0.15 0.00 0.00 0.00 175.76 173.96 1jzs s LYS 778 N -5.49 4.54 0.47 0.00 -0.14 -1.26 -4.92 119.74 112.93 1jzs s LYS 778 Ca 0.71 1.89 0.20 0.00 -1.36 0.00 0.00 55.97 57.40 1jzs s LYS 778 Cb -0.09 -3.20 1.20 0.00 -1.68 0.00 0.00 37.83 34.06 1jzs s LYS 778 CO 0.55 0.03 1.96 0.93 -0.76 0.00 0.00 175.35 178.07 1jzs h GLU 779 N 4.38 0.23 -3.97 1.68 5.08 -1.96 -3.44 114.58 116.58 1jzs h GLU 779 Ca -0.46 -0.01 -0.17 0.00 -1.00 0.00 0.00 59.36 57.72 1jzs h GLU 779 Cb 1.21 -0.05 -0.21 0.00 0.50 0.00 0.00 28.75 30.21 1jzs h GLU 779 CO 0.70 0.15 -0.69 0.45 -1.00 0.00 0.00 179.01 178.62 1jzs s SER 780 N -6.11 0.24 0.27 1.42 0.15 -1.26 -4.92 113.70 103.48 1jzs s SER 780 Ca -0.07 -0.51 -0.01 0.00 0.70 0.00 0.00 55.95 56.07 1jzs s SER 780 Cb 0.20 0.11 0.51 0.00 -1.71 0.00 0.00 66.02 65.13 1jzs s SER 780 CO 0.75 -0.32 1.81 0.58 1.20 0.00 0.00 173.24 177.26 1jzs h VAL 781 N 4.55 0.87 0.00 4.45 2.07 -1.91 0.48 116.25 126.76 1jzs h VAL 781 Ca -0.32 -0.29 0.00 0.00 0.82 0.00 0.00 66.70 66.91 1jzs h VAL 781 Cb 1.21 -0.06 0.00 0.00 -1.52 0.00 0.00 31.29 30.92 1jzs h VAL 781 CO 0.42 0.16 0.00 1.41 0.02 0.00 0.00 177.57 179.58 1jzs n HIS 782 N -4.71 0.00 -0.04 1.57 8.25 -1.26 0.34 115.22 119.37 1jzs n HIS 782 Ca 0.17 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.63 1jzs n HIS 782 Cb 0.36 -0.01 0.00 0.00 1.12 0.00 0.00 29.99 31.45 1jzs n HIS 782 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 1jzs n LEU 783 N -0.23 0.15 -4.87 2.41 4.77 0.15 -4.74 117.00 114.64 1jzs n LEU 783 Ca 0.00 -0.47 -0.29 0.00 -0.03 0.00 0.00 56.01 55.22 1jzs n LEU 783 Cb 0.04 0.00 0.10 0.00 -2.33 0.00 0.00 43.42 41.22 1jzs n LEU 783 CO 0.00 0.04 0.77 0.00 -1.33 0.00 0.00 177.39 176.87 1jzs s ALA 784 N -0.64 2.46 -0.01 -1.18 0.00 0.15 -5.02 121.76 117.53 1jzs s ALA 784 Ca 0.00 -0.59 -0.03 0.00 0.00 0.00 0.00 51.96 51.34 1jzs s ALA 784 Cb 0.00 -2.98 -0.04 0.00 0.00 0.00 0.00 23.12 20.10 1jzs s ALA 784 CO 0.00 -1.78 0.17 -0.51 0.00 0.00 0.00 175.76 173.64 1jzs s ASP 785 N -4.43 6.30 0.22 0.00 1.01 -1.26 -4.53 116.67 113.97 1jzs s ASP 785 Ca 0.62 0.33 -0.31 0.00 0.71 0.00 0.00 52.55 53.91 1jzs s ASP 785 Cb -0.12 -1.97 -0.10 0.00 1.01 0.00 0.00 42.92 41.74 1jzs s ASP 785 CO 0.50 0.27 1.50 0.86 0.21 0.00 0.00 175.17 178.51 1jzs s TRP 786 N -1.30 3.02 1.29 4.23 -0.11 0.34 -4.97 118.94 121.44 1jzs s TRP 786 Ca 0.26 0.85 -0.19 0.00 1.22 0.00 0.00 56.10 58.25 1jzs s TRP 786 Cb -0.13 -3.88 0.32 0.00 -1.50 0.00 0.00 33.47 28.29 1jzs s TRP 786 CO 0.18 -3.03 0.99 -1.25 -4.62 0.00 0.00 176.95 169.21 1jzs s PRO 787 N 0.23 -1.93 -0.13 5.86 0.04 -1.26 -4.97 135.00 132.84 1jzs s PRO 787 Ca 0.64 0.34 -0.10 0.00 0.04 0.00 0.00 61.00 61.92 1jzs s PRO 787 Cb -0.43 -1.48 0.04 0.00 0.04 0.00 0.00 34.50 32.67 1jzs s PRO 787 CO 0.39 -4.27 0.34 -1.21 0.04 0.00 0.00 177.00 172.29 1jzs s GLU 788 N -4.91 0.36 0.47 4.56 2.02 -1.26 -5.11 118.70 114.83 1jzs s GLU 788 Ca 0.69 0.54 -0.24 0.00 0.02 0.00 0.00 54.97 55.98 1jzs s GLU 788 Cb -0.17 0.09 -0.08 0.00 0.10 0.00 0.00 34.13 34.08 1jzs s GLU 788 CO 0.60 -0.09 1.40 0.00 0.02 0.00 0.00 175.26 177.18 1jzs n ALA 789 N 3.42 1.84 -3.18 5.21 0.00 -1.26 -4.99 120.51 121.55 1jzs n ALA 789 Ca -0.17 0.22 -0.37 0.00 0.00 0.00 0.00 53.44 53.11 1jzs n ALA 789 Cb 0.56 -2.37 -0.13 0.00 0.00 0.00 0.00 19.45 17.52 1jzs n ALA 789 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1jzs s ASP 790 N -0.59 5.12 0.00 0.00 2.15 -1.26 -4.97 116.67 117.12 1jzs s ASP 790 Ca 0.64 -0.69 0.00 0.00 0.43 0.00 0.00 52.55 52.93 1jzs s ASP 790 Cb -0.45 -1.88 0.00 0.00 -0.30 0.00 0.00 42.92 40.29 1jzs s ASP 790 CO 0.55 -0.18 0.67 -2.65 -0.17 0.00 0.00 175.17 173.39 1jzs n PRO 791 N 4.87 0.00 0.04 4.34 -0.02 -1.26 -1.22 135.00 141.75 1jzs n PRO 791 Ca -0.15 0.20 0.11 0.00 -2.02 0.00 0.00 63.50 61.64 1jzs n PRO 791 Cb 0.48 -1.52 -0.06 0.00 -0.02 0.00 0.00 33.50 32.38 1jzs n PRO 791 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1jzs n ALA 792 N -1.17 2.95 0.30 3.55 0.00 -1.26 -4.25 120.51 120.63 1jzs n ALA 792 Ca 0.00 -0.40 0.06 0.00 0.00 0.00 0.00 53.44 53.10 1jzs n ALA 792 Cb 0.02 -0.93 -0.08 0.00 0.00 0.00 0.00 19.45 18.46 1jzs n ALA 792 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1jzs n LEU 793 N -2.28 0.30 -4.71 0.00 4.77 -0.36 -5.01 117.00 109.71 1jzs n LEU 793 Ca -0.01 -0.27 -0.33 0.00 -0.03 0.00 0.00 56.01 55.38 1jzs n LEU 793 Cb 0.52 0.00 0.12 0.00 -2.33 0.00 0.00 43.42 41.73 1jzs n LEU 793 CO 0.42 0.08 0.74 0.00 -1.33 0.00 0.00 177.39 177.30 1jzs s ALA 794 N -2.46 1.88 -0.34 -1.18 0.00 -1.06 -3.39 121.76 115.22 1jzs s ALA 794 Ca 0.00 0.69 -0.08 0.00 0.00 0.00 0.00 51.96 52.58 1jzs s ALA 794 Cb 0.08 -3.44 0.19 0.00 0.00 0.00 0.00 23.12 19.96 1jzs s ALA 794 CO 0.50 -2.22 1.03 0.34 0.00 0.00 0.00 175.76 175.41 1jzs s ASP 795 N -2.46 -0.40 0.15 0.00 -1.08 -1.26 -4.94 116.67 106.69 1jzs s ASP 795 Ca 0.70 -0.26 -0.22 0.00 -0.52 0.00 0.00 52.55 52.24 1jzs s ASP 795 Cb -0.25 0.51 0.03 0.00 -1.46 0.00 0.00 42.92 41.75 1jzs s ASP 795 CO 0.52 -0.04 1.63 -0.08 0.52 0.00 0.00 175.17 177.72 1jzs h GLU 796 N 5.21 -0.23 0.03 4.34 4.57 -1.95 -2.58 114.58 123.98 1jzs h GLU 796 Ca -0.02 0.02 -0.00 0.00 -1.18 0.00 0.00 59.36 58.17 1jzs h GLU 796 Cb 1.21 0.05 -0.00 0.00 -0.16 0.00 0.00 28.75 29.86 1jzs h GLU 796 CO -0.07 -0.15 -0.02 0.00 -1.18 0.00 0.00 179.01 177.59 1jzs h ALA 797 N 0.82 -0.87 -0.91 2.92 0.00 -1.98 0.22 119.26 119.46 1jzs h ALA 797 Ca 0.14 -0.01 0.25 0.00 0.00 0.00 0.00 54.91 55.29 1jzs h ALA 797 Cb 0.44 0.16 -0.16 0.00 0.00 0.00 0.00 17.79 18.24 1jzs h ALA 797 CO -0.38 -0.87 0.19 1.25 0.00 0.00 0.00 179.25 179.44 1jzs h LEU 798 N -0.05 -0.13 -0.88 0.00 5.85 -2.00 0.96 115.31 119.06 1jzs h LEU 798 Ca -0.00 0.22 -0.03 0.00 0.84 0.00 0.00 57.88 58.91 1jzs h LEU 798 Cb 0.04 0.33 -0.04 0.00 0.37 0.00 0.00 40.66 41.36 1jzs h LEU 798 CO 0.00 -0.23 0.43 0.58 -0.34 0.00 0.00 178.44 178.88 1jzs h VAL 799 N 0.13 1.26 0.38 1.05 2.07 -1.38 -2.12 116.25 117.64 1jzs h VAL 799 Ca 0.58 -0.71 -0.02 0.00 0.82 0.00 0.00 66.70 67.37 1jzs h VAL 799 Cb 1.20 0.14 0.00 0.00 -1.52 0.00 0.00 31.29 31.11 1jzs h VAL 799 CO -0.74 0.31 -0.18 0.00 0.02 0.00 0.00 177.57 176.98 1jzs h ALA 800 N 1.24 -0.51 -0.02 1.67 0.00 0.30 -2.49 119.26 119.45 1jzs h ALA 800 Ca 0.30 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 55.00 1jzs h ALA 800 Cb 0.09 0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.08 1jzs h ALA 800 CO -0.04 -0.62 -0.10 -0.56 0.00 0.00 0.00 179.25 177.93 1jzs h GLN 801 N -0.84 0.03 -0.09 0.00 3.07 -0.87 -1.54 115.11 114.88 1jzs h GLN 801 Ca -0.05 -0.00 -0.16 0.00 0.09 0.00 0.00 58.65 58.53 1jzs h GLN 801 Cb 0.54 -0.01 -0.01 0.00 0.08 0.00 0.00 27.48 28.08 1jzs h GLN 801 CO 0.09 0.14 -0.62 1.98 0.09 0.00 0.00 178.83 180.50 1jzs h MET 802 N 0.03 0.34 -0.67 0.06 4.05 -1.40 -1.26 114.93 116.08 1jzs h MET 802 Ca 0.01 -0.24 -0.08 0.00 -0.28 0.00 0.00 59.70 59.11 1jzs h MET 802 Cb 0.20 0.04 -0.03 0.00 -0.80 0.00 0.00 31.60 31.01 1jzs h MET 802 CO 0.01 0.85 0.12 -0.09 0.23 0.00 0.00 176.91 178.03 1jzs h ARG 803 N 0.25 1.10 -0.79 0.39 2.43 -0.85 -1.31 114.38 115.59 1jzs h ARG 803 Ca -0.01 -0.29 0.02 0.00 -0.81 0.00 0.00 59.98 58.89 1jzs h ARG 803 Cb 1.15 -0.13 -0.04 0.00 -0.42 0.00 0.00 29.97 30.53 1jzs h ARG 803 CO 0.10 1.00 0.51 0.00 -1.51 0.00 0.00 179.97 180.08 1jzs h ALA 804 N 1.05 1.02 -0.01 2.80 0.00 -0.96 -2.69 119.26 120.48 1jzs h ALA 804 Ca 0.20 -0.04 0.01 0.00 0.00 0.00 0.00 54.91 55.08 1jzs h ALA 804 Cb 0.43 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 1jzs h ALA 804 CO 0.01 0.37 -0.02 0.28 0.00 0.00 0.00 179.25 179.89 1jzs h VAL 805 N 1.03 0.94 -0.75 0.00 2.07 -0.56 -2.51 116.25 116.47 1jzs h VAL 805 Ca 0.30 0.00 0.17 0.00 0.82 0.00 0.00 66.70 67.99 1jzs h VAL 805 Cb -0.06 0.94 -0.05 0.00 -1.52 0.00 0.00 31.29 30.60 1jzs h VAL 805 CO -0.08 0.00 0.51 -0.07 0.02 0.00 0.00 177.57 177.94 1jzs h LEU 806 N -0.04 0.28 0.00 2.57 3.38 -0.94 -1.54 115.31 119.03 1jzs h LEU 806 Ca 0.01 0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1jzs h LEU 806 Cb 0.05 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 40.77 1jzs h LEU 806 CO -0.03 0.14 0.00 0.29 0.09 0.00 0.00 178.44 178.93 1jzs n LYS 807 N -4.44 0.00 -0.41 1.13 5.02 -0.96 -2.43 118.16 116.07 1jzs n LYS 807 Ca 0.15 0.43 0.34 0.00 -2.02 0.00 0.00 58.31 57.20 1jzs n LYS 807 Cb 0.61 -1.39 0.61 0.00 -0.02 0.00 0.00 35.03 34.85 1jzs n LYS 807 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 1jzs h VAL 808 N 0.00 0.15 -0.63 -0.18 2.07 -1.31 0.53 116.25 116.88 1jzs h VAL 808 Ca 0.00 -0.04 -0.07 0.00 0.82 0.00 0.00 66.70 67.40 1jzs h VAL 808 Cb 0.00 0.02 -0.02 0.00 -1.52 0.00 0.00 31.29 29.76 1jzs h VAL 808 CO 0.00 0.02 0.11 0.58 0.02 0.00 0.00 177.57 178.30 1jzs h VAL 809 N 0.12 1.26 -0.31 2.57 2.07 -1.25 0.30 116.25 121.02 1jzs h VAL 809 Ca 0.80 -1.01 -0.18 0.00 0.82 0.00 0.00 66.70 67.13 1jzs h VAL 809 Cb 2.36 0.69 -0.00 0.00 -1.52 0.00 0.00 31.29 32.81 1jzs h VAL 809 CO -0.49 0.38 -0.50 0.44 0.02 0.00 0.00 177.57 177.43 1jzs h ASP 810 N 0.96 0.97 -0.57 0.57 3.32 0.37 0.55 116.42 122.60 1jzs h ASP 810 Ca 0.19 -0.52 -0.02 0.00 0.02 0.00 0.00 57.03 56.71 1jzs h ASP 810 Cb 0.43 -0.28 -0.03 0.00 0.22 0.00 0.00 39.33 39.68 1jzs h ASP 810 CO 0.01 1.30 0.29 -0.07 -1.72 0.00 0.00 179.24 179.05 1jzs h LEU 811 N 0.67 0.74 0.45 1.55 -0.00 -1.13 0.59 115.31 118.18 1jzs h LEU 811 Ca 0.02 -0.12 -0.02 0.00 -0.00 0.00 0.00 57.88 57.76 1jzs h LEU 811 Cb 1.10 -0.19 0.00 0.00 -0.00 0.00 0.00 40.66 41.58 1jzs h LEU 811 CO 0.11 0.65 -0.22 0.00 -0.00 0.00 0.00 178.44 178.98 1jzs h ALA 812 N 1.12 -0.61 0.00 1.53 0.00 -0.21 -0.55 119.26 120.55 1jzs h ALA 812 Ca 0.20 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1jzs h ALA 812 Cb 0.10 0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.12 1jzs h ALA 812 CO -0.03 -0.72 0.07 0.00 0.00 0.00 0.00 179.25 178.57 1jzs h ARG 813 N -0.86 0.00 0.22 0.00 -0.00 0.20 0.25 114.38 114.19 1jzs h ARG 813 Ca -0.06 0.00 -0.31 0.00 -0.50 0.00 0.00 59.98 59.11 1jzs h ARG 813 Cb 0.57 0.00 0.04 0.00 0.00 0.00 0.00 29.97 30.57 1jzs h ARG 813 CO 0.10 0.00 -1.34 0.00 0.00 0.00 0.00 179.97 178.73 1jzs h ALA 814 N 1.85 -0.14 0.00 0.04 0.00 -0.41 -3.27 119.26 117.33 1jzs h ALA 814 Ca 0.00 -0.82 0.00 0.00 0.00 0.00 0.00 54.91 54.09 1jzs h ALA 814 Cb 0.14 0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.09 1jzs h ALA 814 CO 0.00 0.64 0.00 0.00 0.00 0.00 0.00 179.25 179.89 1jzs n ALA 815 N -2.71 1.72 -3.21 0.00 0.00 0.86 -3.53 120.51 113.65 1jzs n ALA 815 Ca -0.16 0.00 -0.23 0.00 0.00 0.00 0.00 53.44 53.05 1jzs n ALA 815 Cb 1.04 -1.11 -0.06 0.00 0.00 0.00 0.00 19.45 19.33 1jzs n ALA 815 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 1jzs n ARG 816 N 1.04 1.40 -0.20 0.00 0.63 -1.24 -4.82 116.66 113.48 1jzs n ARG 816 Ca 0.00 -3.72 0.07 0.00 -0.92 0.00 0.00 57.85 53.28 1jzs n ARG 816 Cb 0.09 -1.65 0.17 0.00 0.45 0.00 0.00 32.46 31.53 1jzs n ARG 816 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1jzs n ALA 817 N 0.83 2.23 -3.66 5.13 0.00 -1.23 -4.87 120.51 118.94 1jzs n ALA 817 Ca 0.25 -1.14 -0.15 0.00 0.00 0.00 0.00 53.44 52.41 1jzs n ALA 817 Cb 0.53 -0.51 -0.14 0.00 0.00 0.00 0.00 19.45 19.32 1jzs n ALA 817 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 1jzs s LYS 818 N -1.01 0.11 0.51 0.00 2.47 -1.26 -5.14 119.74 115.42 1jzs s LYS 818 Ca 0.27 0.67 -0.15 0.00 -1.56 0.00 0.00 55.97 55.20 1jzs s LYS 818 Cb 0.14 -0.14 -0.13 0.00 -1.46 0.00 0.00 37.83 36.24 1jzs s LYS 818 CO 0.19 -0.30 -0.23 -1.13 0.16 0.00 0.00 175.35 174.04 1jzs n SER 819 N 5.34 -3.49 0.00 1.43 3.41 -1.26 -4.95 113.62 114.10 1jzs n SER 819 Ca -0.06 0.46 0.00 0.00 -0.26 0.00 0.00 58.87 59.02 1jzs n SER 819 Cb 0.50 -0.69 0.00 0.00 -0.26 0.00 0.00 64.21 63.75 1jzs n SER 819 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1jzs n GLY 820 N 2.27 -0.69 0.00 5.00 0.00 -1.26 -5.16 105.19 105.35 1jzs n GLY 820 Ca 0.05 0.31 0.00 0.00 0.00 0.00 0.00 46.02 46.38 1jzs n GLY 820 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87