#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2joz s ILE 2 N 0.00 2.35 0.02 3.17 -4.36 -1.26 -5.06 121.20 116.06 2joz s ILE 2 Ca 0.00 -1.83 -0.28 0.00 -0.26 0.00 0.00 60.65 58.28 2joz s ILE 2 Cb 0.00 -2.49 0.10 0.00 1.25 0.00 0.00 42.46 41.32 2joz s ILE 2 CO 0.00 -0.23 1.23 0.00 0.24 0.00 0.00 174.94 176.18 2joz s MET 3 N 1.06 0.58 -0.89 0.37 0.23 -1.26 -5.09 119.30 114.31 2joz s MET 3 Ca -0.02 -0.35 -0.12 0.00 -1.03 0.00 0.00 55.69 54.16 2joz s MET 3 Cb -0.20 0.18 0.23 0.00 -1.53 0.00 0.00 34.83 33.51 2joz s MET 3 CO -0.05 -0.27 0.84 0.14 -2.03 0.00 0.00 175.02 173.64 2joz s VAL 4 N -2.32 5.63 -0.03 5.16 -7.23 -1.26 -4.92 120.40 115.43 2joz s VAL 4 Ca 0.20 -2.72 0.00 0.00 -1.81 0.00 0.00 61.98 57.65 2joz s VAL 4 Cb 0.02 -4.46 0.04 0.00 0.56 0.00 0.00 36.38 32.53 2joz s VAL 4 CO -0.01 -1.06 1.49 -1.20 -0.31 0.00 0.00 175.10 174.01 2joz n SER 5 N 3.65 4.18 -3.38 4.85 7.64 -1.26 -4.66 113.62 124.63 2joz n SER 5 Ca 0.16 -2.28 -0.10 0.00 1.01 0.00 0.00 58.87 57.65 2joz n SER 5 Cb 0.45 -0.80 -0.09 0.00 -1.01 0.00 0.00 64.21 62.76 2joz n SER 5 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2joz s GLY 6 N 1.27 -0.35 -0.06 0.23 0.00 -1.25 -3.95 107.32 103.21 2joz s GLY 6 Ca 0.04 0.83 -0.03 0.00 0.00 0.00 0.00 44.72 45.56 2joz s GLY 6 CO 0.00 2.58 0.14 0.00 0.00 0.00 0.00 173.10 175.83 2joz n GLN 8 N 4.01 0.33 0.08 0.00 6.02 -1.26 -2.18 117.38 124.37 2joz n GLN 8 Ca -0.24 0.06 0.11 0.00 -0.01 0.00 0.00 57.00 56.92 2joz n GLN 8 Cb 0.53 -1.50 0.01 0.00 1.02 0.00 0.00 30.24 30.30 2joz n GLN 8 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 2joz n GLN 9 N -1.29 0.52 -0.06 -1.09 3.00 -1.26 -4.24 117.38 112.96 2joz n GLN 9 Ca 0.11 0.07 -0.13 0.00 -0.01 0.00 0.00 57.00 57.04 2joz n GLN 9 Cb 0.19 -1.75 -0.07 0.00 0.00 0.00 0.00 30.24 28.62 2joz n GLN 9 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.06 179.02 2joz h GLN 10 N 0.00 0.41 0.00 -1.09 4.20 -1.87 -3.46 115.11 113.30 2joz h GLN 10 Ca 0.00 -0.23 0.00 0.00 0.06 0.00 0.00 58.65 58.48 2joz h GLN 10 Cb 0.93 0.02 0.00 0.00 0.30 0.00 0.00 27.48 28.72 2joz h GLN 10 CO 0.00 0.81 0.00 1.17 -0.67 0.00 0.00 178.83 180.14 2joz n LYS 11 N -4.49 0.00 0.00 1.46 4.81 -1.26 -4.85 118.16 113.83 2joz n LYS 11 Ca -0.06 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.38 2joz n LYS 11 Cb 0.40 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.45 2joz n LYS 11 CO 0.00 0.00 0.00 0.39 1.17 0.00 0.00 177.40 178.96 2joz n GLU 12 N 0.00 0.00 -3.94 1.64 -0.58 -1.26 -4.68 120.64 111.82 2joz n GLU 12 Ca 0.00 0.00 -0.10 0.00 -0.42 0.00 0.00 57.16 56.64 2joz n GLU 12 Cb 0.00 0.00 -0.03 0.00 -0.57 0.00 0.00 31.44 30.84 2joz n GLU 12 CO 0.00 0.00 0.00 -2.00 -0.48 0.00 0.00 177.13 174.65 2joz s GLU 13 N 0.00 1.83 0.20 3.49 2.56 -1.26 -5.15 118.70 120.37 2joz s GLU 13 Ca 0.00 -1.33 -0.30 0.00 0.00 0.00 0.00 54.97 53.34 2joz s GLU 13 Cb 0.00 0.53 -0.08 0.00 2.00 0.00 0.00 34.13 36.58 2joz s GLU 13 CO 0.00 -0.81 1.08 -0.08 -0.56 0.00 0.00 175.26 174.89 2joz s THR 14 N -3.42 3.85 -0.05 -1.70 -1.32 -1.26 -4.96 115.64 106.78 2joz s THR 14 Ca 0.20 1.65 -0.37 0.00 -1.21 0.00 0.00 61.69 61.97 2joz s THR 14 Cb -0.03 -4.06 -0.15 0.00 -1.51 0.00 0.00 72.50 66.76 2joz s THR 14 CO 0.11 0.31 1.64 -2.65 -2.21 0.00 0.00 174.62 171.82 2joz n PRO 15 N 2.11 1.60 0.23 7.08 -0.02 -1.26 -4.87 135.00 139.87 2joz n PRO 15 Ca 0.02 0.58 0.08 0.00 -2.02 0.00 0.00 63.50 62.16 2joz n PRO 15 Cb 0.46 -2.31 0.57 0.00 -0.02 0.00 0.00 33.50 32.20 2joz n PRO 15 CO 0.00 0.00 0.00 0.27 1.98 0.00 0.00 175.50 177.75 2joz h PHE 16 N 6.76 0.00 -0.00 6.00 -0.00 -1.93 -2.20 116.94 125.57 2joz h PHE 16 Ca -0.47 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 57.50 2joz h PHE 16 Cb 1.30 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 37.25 2joz h PHE 16 CO 0.72 0.19 -0.12 2.48 -0.00 0.00 0.00 178.31 181.58 2joz n TYR 17 N -4.01 0.00 -2.34 6.09 4.11 -1.26 -4.87 117.16 114.89 2joz n TYR 17 Ca -0.02 0.00 -0.41 0.00 -0.00 0.00 0.00 57.90 57.47 2joz n TYR 17 Cb 0.27 -0.26 -0.03 0.00 -0.00 0.00 0.00 39.34 39.31 2joz n TYR 17 CO 0.00 0.00 0.00 -0.47 -0.00 0.00 0.00 176.86 176.39 2joz s TYR 18 N -2.64 3.38 -1.47 -3.48 5.04 -0.83 -4.69 117.35 112.66 2joz s TYR 18 Ca 0.24 1.47 0.00 0.00 -2.44 0.00 0.00 57.07 56.34 2joz s TYR 18 Cb 0.20 -3.46 0.00 0.00 0.35 0.00 0.00 41.96 39.05 2joz s TYR 18 CO 0.51 -1.23 0.00 0.41 -1.34 0.00 0.00 175.55 173.90 2joz n GLY 19 N 1.72 0.40 3.08 8.97 0.00 -1.24 -4.98 105.19 113.13 2joz n GLY 19 Ca 0.02 -1.92 -0.26 0.00 0.00 0.00 0.00 46.02 43.87 2joz n GLY 19 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2joz s THR 20 N -1.21 1.31 0.14 2.61 2.01 -1.26 -0.56 115.64 118.68 2joz s THR 20 Ca 0.00 -0.61 0.11 0.00 0.31 0.00 0.00 61.69 61.49 2joz s THR 20 Cb 0.00 -1.16 -0.04 0.00 0.01 0.00 0.00 72.50 71.31 2joz s THR 20 CO 0.00 0.39 -0.26 0.26 -0.69 0.00 0.00 174.62 174.32 2joz s TRP 21 N 0.37 2.24 -0.18 4.92 0.52 -0.26 -3.46 118.94 123.08 2joz s TRP 21 Ca -0.10 -0.38 -0.05 0.00 0.02 0.00 0.00 56.10 55.58 2joz s TRP 21 Cb -0.14 -1.19 -0.03 0.00 -1.15 0.00 0.00 33.47 30.96 2joz s TRP 21 CO 0.03 0.35 0.01 0.34 0.02 0.00 0.00 176.95 177.71 2joz s ASP 22 N -2.17 5.06 0.35 2.95 2.15 -0.21 -1.29 116.67 123.51 2joz s ASP 22 Ca 0.14 -0.10 0.23 0.00 0.43 0.00 0.00 52.55 53.26 2joz s ASP 22 Cb -0.10 -1.85 0.36 0.00 -0.30 0.00 0.00 42.92 41.03 2joz s ASP 22 CO 0.06 0.13 1.53 -0.33 -0.17 0.00 0.00 175.17 176.39 2joz h GLU 23 N 7.01 0.00 0.00 4.34 5.08 -1.36 -0.07 114.58 129.58 2joz h GLU 23 Ca -0.34 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.02 2joz h GLU 23 Cb 1.18 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.43 2joz h GLU 23 CO 0.64 0.00 0.00 0.41 -1.00 0.00 0.00 179.01 179.06 2joz n GLY 24 N 1.16 2.66 3.59 -3.84 0.00 -1.26 -4.90 105.19 102.60 2joz n GLY 24 Ca 0.04 -0.62 -0.09 0.00 0.00 0.00 0.00 46.02 45.35 2joz n GLY 24 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2joz s ARG 25 N 0.00 0.50 0.05 1.61 3.52 -1.26 -4.12 118.95 119.25 2joz s ARG 25 Ca 0.00 0.13 -0.09 0.00 -0.13 0.00 0.00 55.73 55.64 2joz s ARG 25 Cb 0.00 0.24 0.00 0.00 -1.56 0.00 0.00 34.95 33.63 2joz s ARG 25 CO 0.00 -0.16 0.18 0.00 -0.81 0.00 0.00 175.30 174.51 2joz s ALA 26 N -1.06 -0.29 0.22 6.12 0.00 -1.26 -4.78 121.76 120.71 2joz s ALA 26 Ca 0.00 -0.39 -0.30 0.00 0.00 0.00 0.00 51.96 51.27 2joz s ALA 26 Cb -0.01 0.31 -0.09 0.00 0.00 0.00 0.00 23.12 23.33 2joz s ALA 26 CO -0.00 -0.38 1.39 -2.14 0.00 0.00 0.00 175.76 174.62 2joz s PRO 27 N -2.83 4.32 0.00 0.00 0.02 -1.26 -4.92 135.00 130.32 2joz s PRO 27 Ca -0.03 2.19 0.00 0.00 0.02 0.00 0.00 61.00 63.18 2joz s PRO 27 Cb 0.00 -3.15 0.00 0.00 0.02 0.00 0.00 34.50 31.37 2joz s PRO 27 CO -0.05 -0.36 0.00 0.41 -0.33 0.00 0.00 177.00 176.67 2joz n GLY 28 N 2.39 2.64 3.67 0.52 0.00 -1.26 -5.14 105.19 108.00 2joz n GLY 28 Ca 0.07 -0.50 -0.44 0.00 0.00 0.00 0.00 46.02 45.15 2joz n GLY 28 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2joz n PRO 29 N 0.00 1.93 -0.01 1.61 -0.04 -1.26 -4.86 135.00 132.38 2joz n PRO 29 Ca 0.00 0.68 0.00 0.00 -0.04 0.00 0.00 63.50 64.14 2joz n PRO 29 Cb 0.00 -2.24 0.01 0.00 -0.04 0.00 0.00 33.50 31.23 2joz n PRO 29 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 2joz n THR 30 N 0.70 0.03 0.07 0.52 -2.24 -1.26 -3.08 114.28 109.02 2joz n THR 30 Ca 0.07 -0.02 -0.09 0.00 -2.27 0.00 0.00 64.05 61.75 2joz n THR 30 Cb 0.34 -0.30 -0.11 0.00 -2.10 0.00 0.00 70.33 68.15 2joz n THR 30 CO 0.00 0.00 0.00 -0.78 -0.57 0.00 0.00 175.07 173.72 2joz h ASP 31 N 0.06 0.09 0.00 3.42 3.58 -2.00 -3.48 116.42 118.10 2joz h ASP 31 Ca 0.00 -0.10 0.00 0.00 0.42 0.00 0.00 57.03 57.35 2joz h ASP 31 Cb 0.33 -0.03 0.00 0.00 1.72 0.00 0.00 39.33 41.35 2joz h ASP 31 CO 0.00 1.07 0.00 0.61 -2.88 0.00 0.00 179.24 178.04 2joz n GLY 32 N 1.35 1.95 3.67 -0.78 0.00 -1.18 -4.89 105.19 105.31 2joz n GLY 32 Ca -0.02 -0.41 -0.35 0.00 0.00 0.00 0.00 46.02 45.25 2joz n GLY 32 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2joz s VAL 33 N 0.00 4.82 -0.05 1.61 1.01 -1.26 -1.10 120.40 125.44 2joz s VAL 33 Ca 0.00 -0.03 -0.04 0.00 0.00 0.00 0.00 61.98 61.91 2joz s VAL 33 Cb 0.00 -3.15 -0.27 0.00 0.00 0.00 0.00 36.38 32.96 2joz s VAL 33 CO 0.00 0.50 0.65 0.11 0.00 0.00 0.00 175.10 176.36 2joz h LYS 34 N 6.30 0.25 -3.01 2.72 1.79 -0.78 -3.47 116.57 120.37 2joz h LYS 34 Ca -0.41 -0.43 0.01 0.00 -2.18 0.00 0.00 60.65 57.64 2joz h LYS 34 Cb 1.18 0.16 -0.09 0.00 -1.58 0.00 0.00 32.23 31.89 2joz h LYS 34 CO 0.67 1.10 0.21 -1.12 -1.08 0.00 0.00 179.45 179.24 2joz s SER 35 N -6.94 -0.45 -0.07 0.86 0.01 -1.19 -4.46 113.70 101.46 2joz s SER 35 Ca -0.14 -0.23 0.03 0.00 1.31 0.00 0.00 55.95 56.92 2joz s SER 35 Cb 0.07 0.65 0.01 0.00 0.21 0.00 0.00 66.02 66.95 2joz s SER 35 CO 0.83 -1.11 -0.14 0.00 0.41 0.00 0.00 173.24 173.22 2joz s ALA 36 N -3.81 1.41 -0.08 1.44 0.00 -1.26 -1.41 121.76 118.05 2joz s ALA 36 Ca 0.05 -0.53 0.03 0.00 0.00 0.00 0.00 51.96 51.52 2joz s ALA 36 Cb -0.03 -0.58 0.00 0.00 0.00 0.00 0.00 23.12 22.51 2joz s ALA 36 CO -0.06 0.16 -0.19 0.95 0.00 0.00 0.00 175.76 176.63 2joz s THR 37 N 0.51 1.66 -0.16 0.00 -4.23 0.54 -1.00 115.64 112.96 2joz s THR 37 Ca -0.13 -0.79 -0.02 0.00 -1.18 0.00 0.00 61.69 59.57 2joz s THR 37 Cb -0.15 -1.45 -0.02 0.00 1.34 0.00 0.00 72.50 72.22 2joz s THR 37 CO 0.04 0.47 -0.09 0.54 -0.54 0.00 0.00 174.62 175.04 2joz s VAL 38 N 0.40 3.27 -0.16 2.29 0.11 -0.42 -0.83 120.40 125.07 2joz s VAL 38 Ca -0.15 -0.57 -0.04 0.00 -2.93 0.00 0.00 61.98 58.29 2joz s VAL 38 Cb -0.16 -2.42 -0.03 0.00 -1.53 0.00 0.00 36.38 32.24 2joz s VAL 38 CO 0.06 0.50 -0.02 -0.89 -3.33 0.00 0.00 175.10 171.41 2joz s THR 39 N 0.62 4.00 -0.30 5.04 2.01 0.19 -1.10 115.64 126.10 2joz s THR 39 Ca -0.05 -0.32 -0.11 0.00 0.31 0.00 0.00 61.69 61.52 2joz s THR 39 Cb -0.15 -2.76 -0.03 0.00 0.01 0.00 0.00 72.50 69.57 2joz s THR 39 CO 0.03 0.48 0.19 -0.36 -0.69 0.00 0.00 174.62 174.27 2joz s PHE 40 N 0.42 3.20 0.57 4.92 0.08 0.27 -0.40 117.98 127.04 2joz s PHE 40 Ca -0.03 -0.18 0.09 0.00 0.12 0.00 0.00 56.93 56.92 2joz s PHE 40 Cb -0.14 -2.40 0.09 0.00 -0.57 0.00 0.00 43.02 40.00 2joz s PHE 40 CO 0.03 -0.31 0.71 2.41 -0.10 0.00 0.00 175.22 177.95 2joz n THR 41 N 5.05 0.00 -0.08 0.64 -1.04 -0.41 -3.72 114.28 114.72 2joz n THR 41 Ca -0.14 -1.98 -0.05 0.00 -2.04 0.00 0.00 64.05 59.85 2joz n THR 41 Cb 0.51 -0.40 -0.04 0.00 -1.82 0.00 0.00 70.33 68.58 2joz n THR 41 CO 0.00 0.00 0.00 -0.33 -0.64 0.00 0.00 175.07 174.10 2joz h GLU 42 N 0.00 -0.10 0.00 -2.82 4.39 -2.03 -3.31 114.58 110.71 2joz h GLU 42 Ca -0.29 0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.42 2joz h GLU 42 Cb 1.25 0.02 0.00 0.00 -0.10 0.00 0.00 28.75 29.92 2joz h GLU 42 CO 0.42 -0.07 0.00 -0.40 -1.16 0.00 0.00 179.01 177.80 2joz n ASP 43 N -3.69 1.36 -4.05 1.42 5.75 -1.26 -5.04 116.55 111.04 2joz n ASP 43 Ca -0.01 -1.66 -0.17 0.00 -0.01 0.00 0.00 54.79 52.93 2joz n ASP 43 Cb 0.11 0.00 -0.14 0.00 -1.03 0.00 0.00 41.12 40.07 2joz n ASP 43 CO 0.00 0.00 0.00 -1.61 -0.11 0.00 0.00 177.20 175.48 2joz s GLU 44 N -0.66 0.70 -0.19 0.11 2.02 -1.25 -3.25 118.70 116.17 2joz s GLU 44 Ca 0.00 -0.49 -0.13 0.00 0.02 0.00 0.00 54.97 54.37 2joz s GLU 44 Cb 0.00 -0.64 -0.05 0.00 0.10 0.00 0.00 34.13 33.54 2joz s GLU 44 CO 0.00 0.16 0.27 0.08 0.02 0.00 0.00 175.26 175.80 2joz s VAL 45 N -0.57 5.31 -0.23 2.63 1.01 0.12 -1.29 120.40 127.37 2joz s VAL 45 Ca 0.00 0.47 -0.08 0.00 0.00 0.00 0.00 61.98 62.38 2joz s VAL 45 Cb -0.06 -3.61 -0.04 0.00 0.00 0.00 0.00 36.38 32.68 2joz s VAL 45 CO 0.00 0.36 0.09 -0.69 0.00 0.00 0.00 175.10 174.86 2joz s VAL 46 N 0.72 4.64 -0.16 2.92 1.01 0.47 -0.83 120.40 129.16 2joz s VAL 46 Ca 0.14 -0.07 -0.15 0.00 0.00 0.00 0.00 61.98 61.91 2joz s VAL 46 Cb -0.13 -3.15 -0.04 0.00 0.00 0.00 0.00 36.38 33.06 2joz s VAL 46 CO 0.04 0.37 0.34 -1.61 0.00 0.00 0.00 175.10 174.23 2joz s GLU 47 N 1.21 4.26 -0.16 2.72 2.02 -1.26 -0.64 118.70 126.85 2joz s GLU 47 Ca 0.05 0.17 -0.00 0.00 0.02 0.00 0.00 54.97 55.20 2joz s GLU 47 Cb -0.14 -3.45 0.04 0.00 0.10 0.00 0.00 34.13 30.67 2joz s GLU 47 CO 0.04 0.17 -0.07 0.95 0.02 0.00 0.00 175.26 176.37 2joz s THR 48 N 0.65 1.20 -0.14 3.63 -4.23 -0.01 -0.29 115.64 116.45 2joz s THR 48 Ca 0.18 -0.62 -0.06 0.00 -1.18 0.00 0.00 61.69 60.02 2joz s THR 48 Cb -0.14 -1.31 -0.04 0.00 1.34 0.00 0.00 72.50 72.35 2joz s THR 48 CO 0.06 0.20 0.07 -1.61 -0.54 0.00 0.00 174.62 172.80 2joz s GLU 49 N 1.60 3.55 -0.40 3.99 2.02 -0.34 -0.34 118.70 128.79 2joz s GLU 49 Ca 0.02 -0.29 -0.14 0.00 0.02 0.00 0.00 54.97 54.57 2joz s GLU 49 Cb -0.15 -3.10 0.02 0.00 0.10 0.00 0.00 34.13 31.00 2joz s GLU 49 CO -0.08 0.55 0.28 0.08 0.02 0.00 0.00 175.26 176.11 2joz s VAL 50 N -0.41 5.16 -0.08 2.63 1.01 -0.50 -0.52 120.40 127.70 2joz s VAL 50 Ca 0.10 -0.63 0.04 0.00 0.00 0.00 0.00 61.98 61.49 2joz s VAL 50 Cb -0.12 -3.84 -0.02 0.00 0.00 0.00 0.00 36.38 32.40 2joz s VAL 50 CO 0.02 -0.26 -0.19 -0.04 0.00 0.00 0.00 175.10 174.63 2joz s MET 51 N 1.67 2.78 -0.18 2.72 -1.94 -0.70 -0.00 119.30 123.66 2joz s MET 51 Ca 0.05 -0.79 -0.29 0.00 -1.71 0.00 0.00 55.69 52.94 2joz s MET 51 Cb -0.19 -2.35 -0.03 0.00 2.01 0.00 0.00 34.83 34.27 2joz s MET 51 CO 0.10 0.39 1.59 -1.83 -0.01 0.00 0.00 175.02 175.26 2joz s GLU 52 N -0.15 3.93 0.00 2.03 -1.05 -0.26 -0.73 118.70 122.47 2joz s GLU 52 Ca -0.02 1.78 0.00 0.00 -0.15 0.00 0.00 54.97 56.58 2joz s GLU 52 Cb -0.14 -4.00 0.00 0.00 -0.44 0.00 0.00 34.13 29.56 2joz s GLU 52 CO 0.04 -1.13 0.00 0.41 0.95 0.00 0.00 175.26 175.52 2joz n GLY 53 N 4.44 1.03 0.42 -3.83 0.00 -1.26 -4.85 105.19 101.13 2joz n GLY 53 Ca 0.18 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.13 2joz n GLY 53 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2joz n ARG 54 N -2.00 0.35 0.00 1.61 5.12 -0.65 -5.15 116.66 115.95 2joz n ARG 54 Ca 0.00 0.14 0.00 0.00 -1.93 0.00 0.00 57.85 56.06 2joz n ARG 54 Cb 0.00 -1.11 0.00 0.00 -1.16 0.00 0.00 32.46 30.19 2joz n ARG 54 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2joz n GLY 55 N 2.14 -0.07 3.70 -0.13 0.00 0.09 -4.97 105.19 105.94 2joz n GLY 55 Ca -0.11 -2.24 -0.42 0.00 0.00 0.00 0.00 46.02 43.25 2joz n GLY 55 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2joz s GLU 56 N 0.00 4.41 -0.19 1.61 8.01 -1.26 -1.71 118.70 129.57 2joz s GLU 56 Ca 0.00 1.67 -0.01 0.00 0.01 0.00 0.00 54.97 56.64 2joz s GLU 56 Cb 0.00 -3.47 0.00 0.00 -4.31 0.00 0.00 34.13 26.36 2joz s GLU 56 CO 0.00 -0.32 -0.13 0.08 0.01 0.00 0.00 175.26 174.90 2joz s VAL 57 N 1.63 2.73 -0.21 2.63 1.01 0.33 -4.93 120.40 123.58 2joz s VAL 57 Ca 0.56 -0.72 -0.21 0.00 0.00 0.00 0.00 61.98 61.60 2joz s VAL 57 Cb -0.26 -2.19 -0.02 0.00 0.00 0.00 0.00 36.38 33.91 2joz s VAL 57 CO 0.25 0.49 0.66 -1.10 0.00 0.00 0.00 175.10 175.40 2joz s GLN 58 N 1.19 4.19 0.50 2.72 -0.21 -1.26 -1.19 119.66 125.60 2joz s GLN 58 Ca 0.02 0.66 -0.02 0.00 0.02 0.00 0.00 55.36 56.04 2joz s GLN 58 Cb -0.14 -3.60 0.00 0.00 1.00 0.00 0.00 33.01 30.27 2joz s GLN 58 CO -0.05 -0.31 0.75 -0.51 -2.12 0.00 0.00 175.29 173.05 2joz s LEU 59 N 2.13 3.50 0.26 2.90 1.43 0.60 -5.01 118.68 124.49 2joz s LEU 59 Ca 0.29 0.40 -0.31 0.00 -1.03 0.00 0.00 54.13 53.48 2joz s LEU 59 Cb -0.16 -3.26 -0.12 0.00 0.03 0.00 0.00 46.19 42.68 2joz s LEU 59 CO 0.10 -0.83 1.52 -0.81 0.23 0.00 0.00 176.35 176.56 2joz n PRO 60 N -2.25 2.41 -1.72 1.29 -0.04 -1.26 -4.40 135.00 129.03 2joz n PRO 60 Ca 0.03 0.86 -0.43 0.00 -0.04 0.00 0.00 63.50 63.92 2joz n PRO 60 Cb 0.58 -2.59 -0.03 0.00 -0.04 0.00 0.00 33.50 31.42 2joz n PRO 60 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 2joz n PHE 61 N 2.20 2.69 -3.54 0.54 3.01 -1.26 -4.74 117.46 116.35 2joz n PHE 61 Ca 0.11 0.17 -0.38 0.00 1.01 0.00 0.00 57.45 58.35 2joz n PHE 61 Cb 0.34 -2.62 -0.11 0.00 -0.01 0.00 0.00 39.48 37.09 2joz n PHE 61 CO 0.00 0.00 0.00 -1.64 1.01 0.00 0.00 176.76 176.13 2joz s MET 62 N 0.43 3.96 0.13 -1.08 -1.94 -0.01 -4.90 119.30 115.89 2joz s MET 62 Ca 0.71 -0.24 -0.30 0.00 -1.71 0.00 0.00 55.69 54.15 2joz s MET 62 Cb -0.53 -3.66 -0.07 0.00 2.01 0.00 0.00 34.83 32.58 2joz s MET 62 CO 0.40 -0.21 1.14 0.00 -0.01 0.00 0.00 175.02 176.34 2joz s ALA 63 N 1.84 3.38 0.16 3.03 0.00 -1.26 0.11 121.76 129.01 2joz s ALA 63 Ca 0.09 0.84 0.05 0.00 0.00 0.00 0.00 51.96 52.94 2joz s ALA 63 Cb -0.16 -3.39 -0.04 0.00 0.00 0.00 0.00 23.12 19.52 2joz s ALA 63 CO 0.11 -0.31 -0.11 1.52 0.00 0.00 0.00 175.76 176.96 2joz s TYR 64 N 0.27 1.38 0.22 0.00 1.13 -1.20 -0.81 117.35 118.34 2joz s TYR 64 Ca 0.53 -0.69 0.10 0.00 -1.41 0.00 0.00 57.07 55.60 2joz s TYR 64 Cb -0.30 -0.68 -0.05 0.00 -1.10 0.00 0.00 41.96 39.83 2joz s TYR 64 CO 0.33 0.15 -0.19 0.15 -2.51 0.00 0.00 175.55 173.49 2joz s LYS 65 N -3.60 1.48 -0.35 -3.49 1.02 0.77 -4.87 119.74 110.70 2joz s LYS 65 Ca 0.17 -1.61 -0.11 0.00 0.02 0.00 0.00 55.97 54.44 2joz s LYS 65 Cb 0.01 -1.51 0.01 0.00 -0.52 0.00 0.00 37.83 35.82 2joz s LYS 65 CO 0.02 0.29 0.20 0.08 -0.92 0.00 0.00 175.35 175.02 2joz s VAL 66 N -2.42 4.71 -0.14 3.17 1.01 -1.26 -0.47 120.40 125.00 2joz s VAL 66 Ca 0.24 -0.60 -0.16 0.00 0.00 0.00 0.00 61.98 61.45 2joz s VAL 66 Cb -0.04 -3.52 -0.14 0.00 0.00 0.00 0.00 36.38 32.68 2joz s VAL 66 CO 0.10 -0.10 0.31 0.40 0.00 0.00 0.00 175.10 175.81 2joz h ILE 67 N 5.73 0.84 -3.77 2.22 2.04 -1.21 -3.49 117.51 119.87 2joz h ILE 67 Ca -0.29 -1.72 -0.15 0.00 1.00 0.00 0.00 64.86 63.70 2joz h ILE 67 Cb 1.13 1.68 -0.20 0.00 -0.74 0.00 0.00 36.82 38.68 2joz h ILE 67 CO 0.65 0.29 -0.59 -0.44 0.00 0.00 0.00 178.15 178.05 2joz s SER 68 N -6.05 0.15 -0.15 1.72 0.01 -1.03 -5.00 113.70 103.34 2joz s SER 68 Ca -0.14 -0.40 -0.09 0.00 1.31 0.00 0.00 55.95 56.63 2joz s SER 68 Cb 0.00 0.16 0.05 0.00 0.21 0.00 0.00 66.02 66.44 2joz s SER 68 CO 0.39 -0.36 0.37 -1.58 0.41 0.00 0.00 173.24 172.47 2joz s GLN 69 N -1.61 0.37 0.09 12.44 0.74 -1.26 0.09 119.66 130.52 2joz s GLN 69 Ca -0.14 0.67 0.21 0.00 0.05 0.00 0.00 55.36 56.16 2joz s GLN 69 Cb -0.08 0.02 -0.14 0.00 1.10 0.00 0.00 33.01 33.91 2joz s GLN 69 CO -0.00 -0.13 0.79 0.45 -0.55 0.00 0.00 175.29 175.84 2joz n SER 70 N 3.91 0.54 0.00 6.67 2.88 0.12 -3.88 113.62 123.85 2joz n SER 70 Ca -0.21 0.21 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 2joz n SER 70 Cb 0.55 0.93 0.00 0.00 -0.75 0.00 0.00 64.21 64.95 2joz n SER 70 CO 0.00 0.00 0.00 0.41 -1.23 0.00 0.00 175.04 174.22 2joz n THR 71 N -2.58 0.00 0.91 2.46 -1.04 -1.22 -4.48 114.28 108.32 2joz n THR 71 Ca -0.04 0.00 0.10 0.00 -2.04 0.00 0.00 64.05 62.07 2joz n THR 71 Cb 0.62 0.00 -0.05 0.00 -1.82 0.00 0.00 70.33 69.08 2joz n THR 71 CO 0.00 0.00 0.00 -0.90 -0.64 0.00 0.00 175.07 173.53 2joz n ASP 72 N 1.17 1.48 0.04 8.00 5.75 -1.26 -4.86 116.55 126.87 2joz n ASP 72 Ca 0.00 -1.24 0.00 0.00 -0.01 0.00 0.00 54.79 53.54 2joz n ASP 72 Cb 0.00 0.70 0.00 0.00 -1.03 0.00 0.00 41.12 40.79 2joz n ASP 72 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2joz n GLY 73 N 1.39 -0.90 3.37 6.12 0.00 -1.26 -5.04 105.19 108.87 2joz n GLY 73 Ca 0.06 0.13 -0.31 0.00 0.00 0.00 0.00 46.02 45.91 2joz n GLY 73 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2joz s SER 74 N -2.17 3.34 -0.01 1.61 1.04 -1.26 -2.98 113.70 113.27 2joz s SER 74 Ca 0.00 -0.49 0.01 0.00 0.48 0.00 0.00 55.95 55.95 2joz s SER 74 Cb 0.00 -0.41 0.00 0.00 0.10 0.00 0.00 66.02 65.71 2joz s SER 74 CO 0.00 0.28 -0.04 -0.63 0.98 0.00 0.00 173.24 173.83 2joz s ILE 75 N -0.77 0.33 -0.15 -1.02 1.01 -0.32 0.11 121.20 120.39 2joz s ILE 75 Ca 0.12 -0.14 0.02 0.00 0.00 0.00 0.00 60.65 60.65 2joz s ILE 75 Cb -0.10 -0.31 0.01 0.00 0.01 0.00 0.00 42.46 42.07 2joz s ILE 75 CO 0.02 0.11 -0.20 -0.70 0.00 0.00 0.00 174.94 174.17 2joz s GLU 76 N 0.15 3.07 0.15 2.79 2.12 0.11 0.12 118.70 127.22 2joz s GLU 76 Ca -0.01 -0.82 0.07 0.00 0.36 0.00 0.00 54.97 54.57 2joz s GLU 76 Cb -0.05 -2.51 -0.04 0.00 0.26 0.00 0.00 34.13 31.80 2joz s GLU 76 CO -0.00 -0.03 -0.16 0.96 -0.54 0.00 0.00 175.26 175.48 2joz s ILE 77 N 0.87 1.62 0.07 -3.70 -4.36 -0.33 -0.63 121.20 114.74 2joz s ILE 77 Ca -0.05 -1.85 0.08 0.00 -0.26 0.00 0.00 60.65 58.56 2joz s ILE 77 Cb -0.15 -1.73 -0.03 0.00 1.25 0.00 0.00 42.46 41.80 2joz s ILE 77 CO -0.02 -0.37 -0.21 -1.58 0.24 0.00 0.00 174.94 173.00 2joz s GLN 78 N -2.79 1.31 0.37 0.37 0.74 0.38 -0.64 119.66 119.40 2joz s GLN 78 Ca 0.13 -1.04 -0.12 0.00 0.05 0.00 0.00 55.36 54.38 2joz s GLN 78 Cb -0.05 -1.49 -0.07 0.00 1.10 0.00 0.00 33.01 32.49 2joz s GLN 78 CO 0.05 0.37 0.75 0.71 -0.55 0.00 0.00 175.29 176.62 2joz s TYR 79 N -0.94 3.44 0.32 1.67 2.02 -0.60 -0.16 117.35 123.09 2joz s TYR 79 Ca 0.07 1.09 0.09 0.00 -0.37 0.00 0.00 57.07 57.95 2joz s TYR 79 Cb -0.09 -2.46 -0.05 0.00 -0.40 0.00 0.00 41.96 38.96 2joz s TYR 79 CO 0.03 -0.02 0.04 -0.51 -1.57 0.00 0.00 175.55 173.52 2joz s LEU 80 N -3.51 3.09 0.00 -1.29 1.43 0.01 -3.89 118.68 114.52 2joz s LEU 80 Ca 0.52 -0.86 0.00 0.00 -1.03 0.00 0.00 54.13 52.76 2joz s LEU 80 Cb -0.10 -1.53 0.00 0.00 0.03 0.00 0.00 46.19 44.59 2joz s LEU 80 CO 0.26 -0.19 0.00 0.61 0.23 0.00 0.00 176.35 177.26 2joz n GLY 81 N -0.99 -0.53 0.00 -3.19 0.00 -1.26 -4.05 105.19 95.17 2joz n GLY 81 Ca -0.04 -1.59 0.02 0.00 0.00 0.00 0.00 46.02 44.40 2joz n GLY 81 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2joz n PRO 82 N 0.00 0.02 -0.65 1.61 -0.02 -1.26 -1.04 135.00 133.65 2joz n PRO 82 Ca 0.00 0.38 0.08 0.00 -2.02 0.00 0.00 63.50 61.94 2joz n PRO 82 Cb 0.00 -1.50 0.33 0.00 -0.02 0.00 0.00 33.50 32.31 2joz n PRO 82 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 2joz n TYR 83 N -1.43 1.50 -0.57 6.00 4.02 -1.26 -5.03 117.16 120.39 2joz n TYR 83 Ca 0.01 -0.75 -0.30 0.00 -0.01 0.00 0.00 57.90 56.84 2joz n TYR 83 Cb 0.04 -0.38 0.22 0.00 -0.02 0.00 0.00 39.34 39.20 2joz n TYR 83 CO 0.00 0.00 0.00 2.48 -1.01 0.00 0.00 176.86 178.33 2joz n TYR 84 N 0.28 -1.41 0.00 -0.72 4.11 -0.21 -2.82 117.16 116.39 2joz n TYR 84 Ca 0.24 -0.01 0.00 0.00 -0.00 0.00 0.00 57.90 58.13 2joz n TYR 84 Cb 1.00 -1.62 0.00 0.00 -0.00 0.00 0.00 39.34 38.73 2joz n TYR 84 CO 0.00 0.00 0.00 -2.30 -0.00 0.00 0.00 176.86 174.56 2joz n PRO 85 N -3.44 0.00 -2.46 -3.48 -0.02 -1.25 -4.87 135.00 119.48 2joz n PRO 85 Ca 0.01 0.00 -0.37 0.00 -2.02 0.00 0.00 63.50 61.13 2joz n PRO 85 Cb 0.59 0.00 -0.03 0.00 -0.02 0.00 0.00 33.50 34.03 2joz n PRO 85 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 2joz s LEU 86 N 0.00 4.09 0.26 2.45 1.98 -1.13 -4.88 118.68 121.45 2joz s LEU 86 Ca 0.00 2.11 -0.03 0.00 -2.89 0.00 0.00 54.13 53.32 2joz s LEU 86 Cb 0.00 -4.22 -0.02 0.00 0.66 0.00 0.00 46.19 42.61 2joz s LEU 86 CO 0.00 -0.63 0.30 -1.59 -1.89 0.00 0.00 176.35 172.54 2joz s LYS 87 N -2.59 1.50 0.13 1.98 -2.85 -1.26 -1.56 119.74 115.09 2joz s LYS 87 Ca 0.60 -1.63 0.04 0.00 -1.00 0.00 0.00 55.97 53.97 2joz s LYS 87 Cb -0.24 0.36 -0.04 0.00 -2.06 0.00 0.00 37.83 35.85 2joz s LYS 87 CO 0.29 -0.56 -0.09 -1.12 0.10 0.00 0.00 175.35 173.96 2joz s SER 88 N -3.18 1.61 0.01 0.03 0.01 0.19 -4.33 113.70 108.05 2joz s SER 88 Ca 0.34 -0.99 0.04 0.00 1.31 0.00 0.00 55.95 56.66 2joz s SER 88 Cb 0.03 0.02 -0.02 0.00 0.21 0.00 0.00 66.02 66.26 2joz s SER 88 CO 0.15 -0.35 -0.13 -0.89 0.41 0.00 0.00 173.24 172.43 2joz s THR 89 N -3.28 1.04 -0.13 1.44 2.01 0.10 -1.19 115.64 115.63 2joz s THR 89 Ca 0.14 -0.76 0.02 0.00 0.31 0.00 0.00 61.69 61.40 2joz s THR 89 Cb 0.02 -0.91 0.01 0.00 0.01 0.00 0.00 72.50 71.64 2joz s THR 89 CO -0.01 0.14 -0.20 -0.76 -0.69 0.00 0.00 174.62 173.11 2joz s LEU 90 N -0.71 1.98 0.41 4.42 1.43 0.12 0.63 118.68 126.96 2joz s LEU 90 Ca 0.03 -0.55 0.07 0.00 -1.03 0.00 0.00 54.13 52.65 2joz s LEU 90 Cb -0.06 -1.33 -0.06 0.00 0.03 0.00 0.00 46.19 44.77 2joz s LEU 90 CO 0.00 0.05 0.16 -0.54 0.23 0.00 0.00 176.35 176.26 2joz s LYS 91 N 0.91 2.20 0.10 1.70 -0.14 0.49 -1.17 119.74 123.83 2joz s LYS 91 Ca -0.06 -1.88 -0.12 0.00 -1.36 0.00 0.00 55.97 52.56 2joz s LYS 91 Cb -0.15 -1.94 -0.06 0.00 -1.68 0.00 0.00 37.83 33.99 2joz s LYS 91 CO -0.03 -0.11 0.46 -0.98 -0.76 0.00 0.00 175.35 173.93 2joz s ARG 92 N -3.88 3.84 -0.11 1.68 1.70 -1.16 -0.69 118.95 120.33 2joz s ARG 92 Ca 0.40 0.29 -0.04 0.00 -0.47 0.00 0.00 55.73 55.92 2joz s ARG 92 Cb 0.05 -2.97 -0.04 0.00 -0.57 0.00 0.00 34.95 31.42 2joz s ARG 92 CO 0.22 0.53 0.04 0.20 -1.08 0.00 0.00 175.30 175.22 2joz s GLY 93 N -1.74 1.94 0.36 3.88 0.00 0.85 -4.69 107.32 107.92 2joz s GLY 93 Ca 0.35 -0.75 0.03 0.00 0.00 0.00 0.00 44.72 44.34 2joz s GLY 93 CO 0.18 -0.44 2.01 0.83 0.00 0.00 0.00 173.10 175.69 2joz h GLU 94 N 5.31 0.78 -0.82 2.90 5.08 -1.98 -2.29 114.58 123.55 2joz h GLU 94 Ca -0.50 -0.05 -0.20 0.00 -1.00 0.00 0.00 59.36 57.61 2joz h GLU 94 Cb 1.20 -0.17 -0.12 0.00 0.50 0.00 0.00 28.75 30.16 2joz h GLU 94 CO 0.57 0.52 0.25 0.09 -1.00 0.00 0.00 179.01 179.44 2joz n ASN 95 N -4.44 4.23 -1.17 1.42 3.02 -1.26 -4.82 115.26 112.24 2joz n ASN 95 Ca 0.06 -3.00 -0.04 0.00 -0.03 0.00 0.00 54.58 51.57 2joz n ASN 95 Cb 0.05 -0.71 0.02 0.00 -0.61 0.00 0.00 39.78 38.53 2joz n ASN 95 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2joz n GLY 96 N -0.12 0.59 3.66 7.41 0.00 -0.87 -5.04 105.19 110.82 2joz n GLY 96 Ca 0.34 -0.47 -0.30 0.00 0.00 0.00 0.00 46.02 45.59 2joz n GLY 96 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2joz s THR 97 N -3.06 1.53 -0.09 2.61 -4.23 -1.18 -4.38 115.64 106.84 2joz s THR 97 Ca 0.09 -2.00 0.04 0.00 -1.18 0.00 0.00 61.69 58.64 2joz s THR 97 Cb -0.04 -2.60 -0.00 0.00 1.34 0.00 0.00 72.50 71.20 2joz s THR 97 CO 0.14 0.00 -0.24 -0.22 -0.54 0.00 0.00 174.62 173.76 2joz s LEU 98 N -3.76 2.07 -0.37 4.79 2.96 -0.84 -0.11 118.68 123.42 2joz s LEU 98 Ca 0.22 -0.54 -0.14 0.00 -0.22 0.00 0.00 54.13 53.45 2joz s LEU 98 Cb 0.06 -1.37 0.00 0.00 0.50 0.00 0.00 46.19 45.38 2joz s LEU 98 CO 0.11 0.18 0.30 -0.63 -1.32 0.00 0.00 176.35 174.99 2joz s ILE 99 N 0.23 5.23 -0.34 6.68 1.01 0.13 -0.18 121.20 133.97 2joz s ILE 99 Ca -0.15 -0.33 -0.13 0.00 0.00 0.00 0.00 60.65 60.04 2joz s ILE 99 Cb -0.17 -3.84 -0.02 0.00 0.01 0.00 0.00 42.46 38.44 2joz s ILE 99 CO 0.07 -0.17 0.24 0.86 0.00 0.00 0.00 174.94 175.94 2joz s TRP 100 N 1.81 3.23 -0.18 3.97 -0.00 0.88 -0.38 118.94 128.27 2joz s TRP 100 Ca 0.07 -0.19 -0.12 0.00 -0.00 0.00 0.00 56.10 55.86 2joz s TRP 100 Cb -0.18 -2.47 -0.05 0.00 -0.00 0.00 0.00 33.47 30.77 2joz s TRP 100 CO 0.11 -0.35 0.23 -1.21 -0.00 0.00 0.00 176.95 175.73 2joz s GLU 101 N 1.73 4.22 -0.20 5.86 2.02 0.20 -0.16 118.70 132.38 2joz s GLU 101 Ca 0.06 -0.03 -0.08 0.00 0.02 0.00 0.00 54.97 54.93 2joz s GLU 101 Cb -0.17 -3.43 0.08 0.00 0.10 0.00 0.00 34.13 30.70 2joz s GLU 101 CO 0.11 0.24 0.44 -1.14 0.02 0.00 0.00 175.26 174.93 2joz s GLN 102 N 0.49 0.38 0.00 1.61 -0.44 -0.42 -0.72 119.66 120.56 2joz s GLN 102 Ca 0.13 0.98 0.00 0.00 -2.50 0.00 0.00 55.36 53.97 2joz s GLN 102 Cb -0.12 0.22 0.00 0.00 -1.64 0.00 0.00 33.01 31.46 2joz s GLN 102 CO 0.02 -0.21 0.00 0.09 0.50 0.00 0.00 175.29 175.69 2joz n ASN 103 N 4.92 0.00 0.00 6.67 3.02 -1.26 -0.73 115.26 127.87 2joz n ASN 103 Ca -0.15 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.40 2joz n ASN 103 Cb 0.52 -1.12 0.00 0.00 -0.61 0.00 0.00 39.78 38.57 2joz n ASN 103 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2joz n GLY 104 N -2.00 1.42 3.80 7.41 0.00 -1.26 -5.11 105.19 109.44 2joz n GLY 104 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.64 2joz n GLY 104 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2joz s GLN 105 N 0.00 4.08 -0.33 1.61 -0.21 0.09 -5.06 119.66 119.84 2joz s GLN 105 Ca 0.00 0.45 -0.12 0.00 0.02 0.00 0.00 55.36 55.71 2joz s GLN 105 Cb 0.00 -3.29 -0.02 0.00 1.00 0.00 0.00 33.01 30.70 2joz s GLN 105 CO 0.00 0.53 0.22 1.03 -2.12 0.00 0.00 175.29 174.95 2joz s ARG 106 N -0.58 3.57 -0.00 2.91 0.52 -1.26 -1.30 118.95 122.81 2joz s ARG 106 Ca 0.25 -0.59 0.08 0.00 -0.52 0.00 0.00 55.73 54.95 2joz s ARG 106 Cb -0.16 -3.76 -0.02 0.00 0.52 0.00 0.00 34.95 31.53 2joz s ARG 106 CO 0.13 -0.39 -0.25 0.15 0.02 0.00 0.00 175.30 174.96 2joz s LYS 107 N 1.72 2.06 -0.23 3.54 1.02 0.77 -4.96 119.74 123.66 2joz s LYS 107 Ca 0.06 -0.96 -0.16 0.00 0.02 0.00 0.00 55.97 54.93 2joz s LYS 107 Cb -0.17 -2.06 -0.04 0.00 -0.52 0.00 0.00 37.83 35.05 2joz s LYS 107 CO 0.10 0.55 0.41 -0.08 -0.92 0.00 0.00 175.35 175.42 2joz s THR 108 N -0.68 5.17 -0.16 2.17 -1.32 -1.26 -0.09 115.64 119.47 2joz s THR 108 Ca 0.11 0.70 -0.07 0.00 -1.21 0.00 0.00 61.69 61.21 2joz s THR 108 Cb -0.10 -3.74 -0.04 0.00 -1.51 0.00 0.00 72.50 67.11 2joz s THR 108 CO 0.00 0.19 0.08 -0.04 -2.21 0.00 0.00 174.62 172.65 2joz s MET 109 N 1.73 3.78 -0.01 7.08 1.00 0.75 -4.75 119.30 128.88 2joz s MET 109 Ca 0.18 -0.28 -0.07 0.00 0.00 0.00 0.00 55.69 55.52 2joz s MET 109 Cb -0.15 -3.20 -0.05 0.00 0.00 0.00 0.00 34.83 31.44 2joz s MET 109 CO 0.09 0.45 0.25 0.95 0.00 0.00 0.00 175.02 176.76 2joz s THR 110 N -0.10 5.32 -0.19 2.05 -4.23 -0.04 -1.98 115.64 116.47 2joz s THR 110 Ca 0.08 0.19 -0.21 0.00 -1.18 0.00 0.00 61.69 60.56 2joz s THR 110 Cb -0.12 -3.55 -0.02 0.00 1.34 0.00 0.00 72.50 70.15 2joz s THR 110 CO 0.01 0.41 0.66 -0.60 -0.54 0.00 0.00 174.62 174.55 2joz s ARG 111 N -1.64 4.24 0.55 3.99 3.52 -1.26 -1.04 118.95 127.30 2joz s ARG 111 Ca 0.26 0.68 -0.15 0.00 -0.13 0.00 0.00 55.73 56.39 2joz s ARG 111 Cb -0.13 -3.57 -0.06 0.00 -1.56 0.00 0.00 34.95 29.63 2joz s ARG 111 CO 0.15 -0.23 1.01 0.42 -0.81 0.00 0.00 175.30 175.83 2joz s ILE 112 N 1.87 4.45 -0.78 4.11 -1.09 -1.23 -4.94 121.20 123.59 2joz s ILE 112 Ca 0.30 1.08 -0.25 0.00 -2.23 0.00 0.00 60.65 59.55 2joz s ILE 112 Cb -0.16 -3.69 -0.05 0.00 -1.58 0.00 0.00 42.46 36.98 2joz s ILE 112 CO 0.11 -0.77 1.97 -1.61 -1.23 0.00 0.00 174.94 173.42 2joz s GLU 113 N -4.34 2.49 -0.48 2.79 8.01 -1.26 -4.91 118.70 121.00 2joz s GLU 113 Ca 0.59 0.13 -0.16 0.00 0.01 0.00 0.00 54.97 55.53 2joz s GLU 113 Cb -0.11 -4.80 0.07 0.00 -4.31 0.00 0.00 34.13 24.97 2joz s GLU 113 CO 0.38 -3.25 0.45 0.45 0.01 0.00 0.00 175.26 173.30 2joz s SER 114 N 8.45 6.17 -0.03 -0.19 0.15 -1.26 -5.04 113.70 121.96 2joz s SER 114 Ca 0.72 -1.19 0.07 0.00 0.70 0.00 0.00 55.95 56.25 2joz s SER 114 Cb -0.09 -2.21 -0.02 0.00 -1.71 0.00 0.00 66.02 61.99 2joz s SER 114 CO 0.08 -0.70 -0.22 -0.54 1.20 0.00 0.00 173.24 173.05 2joz s LYS 115 N 1.92 1.93 -0.06 5.44 -0.14 -1.26 -5.11 119.74 122.46 2joz s LYS 115 Ca 0.07 -0.80 -0.30 0.00 -1.36 0.00 0.00 55.97 53.58 2joz s LYS 115 Cb -0.23 -1.81 -0.03 0.00 -1.68 0.00 0.00 37.83 34.08 2joz s LYS 115 CO 0.08 0.45 1.21 0.95 -0.76 0.00 0.00 175.35 177.28 2joz s THR 116 N -0.43 4.23 0.00 2.17 -4.23 -1.26 -4.97 115.64 111.16 2joz s THR 116 Ca 0.06 1.56 0.00 0.00 -1.18 0.00 0.00 61.69 62.13 2joz s THR 116 Cb -0.10 -4.00 0.00 0.00 1.34 0.00 0.00 72.50 69.74 2joz s THR 116 CO 0.00 -0.01 0.00 0.61 -0.54 0.00 0.00 174.62 174.68 2joz n GLY 117 N 3.39 -0.16 3.03 3.99 0.00 -1.26 -5.03 105.19 109.15 2joz n GLY 117 Ca 0.11 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.83 2joz n GLY 117 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2joz s ARG 118 N 0.36 2.40 0.23 1.61 3.03 -1.26 -5.13 118.95 120.20 2joz s ARG 118 Ca 0.00 -0.62 0.12 0.00 2.03 0.00 0.00 55.73 57.26 2joz s ARG 118 Cb 0.00 -2.20 -0.05 0.00 -1.03 0.00 0.00 34.95 31.67 2joz s ARG 118 CO 0.00 -0.24 -0.22 -1.83 -1.13 0.00 0.00 175.30 171.88 2joz s GLU 119 N 1.45 1.59 -0.11 3.89 -1.05 -1.26 -4.95 118.70 118.27 2joz s GLU 119 Ca 0.05 -1.64 -0.07 0.00 -0.15 0.00 0.00 54.97 53.15 2joz s GLU 119 Cb -0.13 -1.81 0.03 0.00 -0.44 0.00 0.00 34.13 31.78 2joz s GLU 119 CO -0.11 0.37 0.15 -1.91 0.95 0.00 0.00 175.26 174.71 2joz n GLU 120 N -0.14 -2.88 -4.87 -4.83 2.13 -1.26 -5.07 120.64 103.72 2joz n GLU 120 Ca -0.09 2.35 -0.26 0.00 0.66 0.00 0.00 57.16 59.82 2joz n GLU 120 Cb 0.58 -3.49 -0.15 0.00 0.27 0.00 0.00 31.44 28.65 2joz n GLU 120 CO 0.00 0.00 0.00 0.21 -0.41 0.00 0.00 177.13 176.93 2joz s LYS 121 N -0.82 1.53 0.27 5.31 2.20 -1.26 -5.14 119.74 121.82 2joz s LYS 121 Ca -0.17 -0.75 -0.02 0.00 -0.36 0.00 0.00 55.97 54.67 2joz s LYS 121 Cb 0.01 -1.51 -0.04 0.00 -1.51 0.00 0.00 37.83 34.78 2joz s LYS 121 CO 0.46 0.41 0.49 0.34 -0.36 0.00 0.00 175.35 176.69 2joz s ASP 122 N -0.62 6.39 0.00 1.43 2.15 -1.26 -5.01 116.67 119.74 2joz s ASP 122 Ca 0.07 0.53 0.15 0.00 0.43 0.00 0.00 52.55 53.73 2joz s ASP 122 Cb -0.08 -2.07 -0.09 0.00 -0.30 0.00 0.00 42.92 40.39 2joz s ASP 122 CO -0.00 -0.15 0.71 -1.84 -0.17 0.00 0.00 175.17 173.71 2joz n GLU 123 N -1.00 2.00 -1.68 4.34 0.28 -1.26 -4.95 120.64 118.37 2joz n GLU 123 Ca -0.04 -0.34 -0.41 0.00 -0.16 0.00 0.00 57.16 56.22 2joz n GLU 123 Cb 0.54 -1.21 -0.03 0.00 1.43 0.00 0.00 31.44 32.17 2joz n GLU 123 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 177.13 177.18 2joz s LYS 124 N -2.14 2.81 0.03 3.44 2.47 -1.26 -4.92 119.74 120.18 2joz s LYS 124 Ca 0.09 1.66 -0.01 0.00 -1.56 0.00 0.00 55.97 56.15 2joz s LYS 124 Cb 0.12 -4.41 -0.03 0.00 -1.46 0.00 0.00 37.83 32.04 2joz s LYS 124 CO 0.51 -2.47 -0.03 -1.54 0.16 0.00 0.00 175.35 171.98 2joz s SER 125 N 9.15 0.35 -0.07 1.43 1.04 -1.26 -5.15 113.70 119.18 2joz s SER 125 Ca 0.95 -0.72 -0.00 0.00 0.48 0.00 0.00 55.95 56.65 2joz s SER 125 Cb -0.25 0.15 0.02 0.00 0.10 0.00 0.00 66.02 66.04 2joz s SER 125 CO 0.31 -0.44 -0.03 -0.75 0.98 0.00 0.00 173.24 173.31 2joz s LYS 126 N -2.58 0.85 -0.34 4.02 2.20 -1.26 -5.12 119.74 117.52 2joz s LYS 126 Ca -0.06 -0.03 -0.22 0.00 -0.36 0.00 0.00 55.97 55.30 2joz s LYS 126 Cb -0.02 -1.04 0.00 0.00 -1.51 0.00 0.00 37.83 35.27 2joz s LYS 126 CO -0.05 -0.22 0.74 -1.12 -0.36 0.00 0.00 175.35 174.34 2joz s SER 127 N 1.55 6.55 0.10 1.43 0.01 -1.26 -5.04 113.70 117.03 2joz s SER 127 Ca -0.01 0.39 0.00 0.00 1.31 0.00 0.00 55.95 57.64 2joz s SER 127 Cb -0.13 -2.38 0.00 0.00 0.21 0.00 0.00 66.02 63.72 2joz s SER 127 CO -0.04 -0.65 0.00 0.18 0.41 0.00 0.00 173.24 173.14 2joz n LEU 128 N 6.25 0.00 -4.23 2.44 4.32 -1.26 -5.14 117.00 119.37 2joz n LEU 128 Ca 0.02 0.00 -0.13 0.00 -0.02 0.00 0.00 56.01 55.88 2joz n LEU 128 Cb 0.48 0.00 -0.10 0.00 -1.62 0.00 0.00 43.42 42.18 2joz n LEU 128 CO 0.51 -0.14 -0.32 -1.83 -1.22 0.00 0.00 177.39 174.39 2joz s GLU 129 N 0.72 1.10 -0.28 3.23 4.04 -1.26 -5.16 118.70 121.09 2joz s GLU 129 Ca 0.00 -1.53 -0.20 0.00 0.04 0.00 0.00 54.97 53.28 2joz s GLU 129 Cb 0.00 -0.21 0.08 0.00 0.02 0.00 0.00 34.13 34.02 2joz s GLU 129 CO 0.00 -0.15 0.74 -1.01 -1.84 0.00 0.00 175.26 173.00 2joz s HIS 130 N -3.70 -0.88 -1.07 4.83 3.76 -1.26 -5.08 115.29 111.88 2joz s HIS 130 Ca 0.24 1.93 -0.16 0.00 -0.15 0.00 0.00 55.06 56.92 2joz s HIS 130 Cb 0.06 0.45 0.16 0.00 1.11 0.00 0.00 32.58 34.37 2joz s HIS 130 CO 0.04 -0.43 1.26 -1.01 -0.85 0.00 0.00 174.74 173.74 2joz s HIS 131 N 1.01 3.39 -0.04 1.40 3.76 -1.26 -4.99 115.29 118.57 2joz s HIS 131 Ca -0.05 -1.84 0.07 0.00 -0.15 0.00 0.00 55.06 53.09 2joz s HIS 131 Cb -0.05 -4.25 -0.01 0.00 1.11 0.00 0.00 32.58 29.37 2joz s HIS 131 CO -0.10 -1.39 -0.25 -1.58 -0.85 0.00 0.00 174.74 170.56 2joz s HIS 132 N 1.83 2.36 0.04 1.40 2.46 -1.26 -5.12 115.29 117.00 2joz s HIS 132 Ca 0.37 -0.58 -0.27 0.00 0.47 0.00 0.00 55.06 55.04 2joz s HIS 132 Cb -0.04 -1.53 0.07 0.00 -0.13 0.00 0.00 32.58 30.95 2joz s HIS 132 CO -0.05 -0.13 0.67 -3.38 -2.47 0.00 0.00 174.74 169.38 2joz s HIS 133 N -0.37 -0.58 -0.36 3.88 -3.43 -1.26 -5.13 115.29 108.04 2joz s HIS 133 Ca 0.03 0.72 0.00 0.00 -0.80 0.00 0.00 55.06 55.01 2joz s HIS 133 Cb -0.12 0.48 0.12 0.00 -1.43 0.00 0.00 32.58 31.63 2joz s HIS 133 CO 0.01 -0.70 0.17 -1.01 -2.00 0.00 0.00 174.74 171.22 2joz s HIS 134 N -2.37 1.47 0.00 0.38 3.76 -1.26 -5.34 115.29 111.93 2joz s HIS 134 Ca -0.05 -1.88 0.00 0.00 -0.15 0.00 0.00 55.06 52.98 2joz s HIS 134 Cb -0.00 -1.53 0.00 0.00 1.11 0.00 0.00 32.58 32.15 2joz s HIS 134 CO -0.01 -0.83 0.00 1.58 -0.85 0.00 0.00 174.74 174.63