#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 3.59 -0.44 3.17 1.09 -1.26 -5.05 121.20 122.30 2joz s ILE 2 Ca 0.00 -1.26 -0.11 0.00 -1.10 0.00 0.00 60.65 58.17 2joz s ILE 2 Cb 0.00 -3.08 0.08 0.00 -1.06 0.00 0.00 42.46 38.40 2joz s ILE 2 CO 0.00 -0.21 0.31 -0.04 -0.10 0.00 0.00 174.94 174.89 2joz s MET 3 N 1.35 2.71 -0.01 2.79 -1.94 -1.26 -5.05 119.30 117.89 2joz s MET 3 Ca -0.02 -1.45 0.01 0.00 -1.71 0.00 0.00 55.69 52.52 2joz s MET 3 Cb -0.20 -3.90 0.01 0.00 2.01 0.00 0.00 34.83 32.75 2joz s MET 3 CO 0.01 -1.00 -0.02 0.54 -0.01 0.00 0.00 175.02 174.55 2joz s VAL 4 N 1.48 0.20 -0.12 -6.03 0.11 -1.26 -5.13 120.40 109.65 2joz s VAL 4 Ca 0.03 -0.03 -0.04 0.00 -2.93 0.00 0.00 61.98 59.01 2joz s VAL 4 Cb -0.24 -0.22 0.06 0.00 -1.53 0.00 0.00 36.38 34.45 2joz s VAL 4 CO 0.03 0.10 0.19 -0.44 -3.33 0.00 0.00 175.10 171.65 2joz s SER 5 N 0.39 0.88 -0.47 3.54 0.01 -1.26 -5.10 113.70 111.70 2joz s SER 5 Ca -0.04 0.22 -0.28 0.00 1.31 0.00 0.00 55.95 57.16 2joz s SER 5 Cb -0.06 0.36 -0.01 0.00 0.21 0.00 0.00 66.02 66.52 2joz s SER 5 CO -0.01 -0.27 1.64 -0.83 0.41 0.00 0.00 173.24 174.19 2joz s GLY 6 N 2.32 0.74 0.04 3.44 0.00 -1.26 -4.98 107.32 107.62 2joz s GLY 6 Ca 0.04 -0.26 0.05 0.00 0.00 0.00 0.00 44.72 44.55 2joz s GLY 6 CO -0.08 3.09 -0.16 0.00 0.00 0.00 0.00 173.10 175.96 2joz s GLN 8 N -1.13 3.95 -0.09 0.00 -0.21 -1.26 -4.71 119.66 116.20 2joz s GLN 8 Ca 0.03 -2.04 -0.07 0.00 0.02 0.00 0.00 55.36 53.31 2joz s GLN 8 Cb -0.08 -5.35 -0.27 0.00 1.00 0.00 0.00 33.01 28.30 2joz s GLN 8 CO 0.01 -2.09 0.47 1.96 -2.12 0.00 0.00 175.29 173.52 2joz h GLN 9 N 7.80 0.28 -3.44 2.91 4.20 -2.00 -3.47 115.11 121.40 2joz h GLN 9 Ca 0.37 -0.49 -0.27 0.00 0.06 0.00 0.00 58.65 58.32 2joz h GLN 9 Cb 0.90 0.18 -0.32 0.00 0.30 0.00 0.00 27.48 28.53 2joz h GLN 9 CO 1.38 1.20 -0.68 -1.14 -0.67 0.00 0.00 178.83 178.93 2joz s GLN 10 N -2.57 0.02 -0.06 1.46 2.00 -1.26 -5.02 119.66 114.23 2joz s GLN 10 Ca -0.19 0.24 0.06 0.00 -2.00 0.00 0.00 55.36 53.46 2joz s GLN 10 Cb 0.06 -0.19 -0.24 0.00 0.80 0.00 0.00 33.01 33.44 2joz s GLN 10 CO 0.80 -0.15 0.61 0.87 -0.50 0.00 0.00 175.29 176.92 2joz h LYS 11 N 7.13 0.10 -6.37 1.67 1.57 -2.00 -3.46 116.57 115.21 2joz h LYS 11 Ca -0.42 -0.16 -0.55 0.00 -1.87 0.00 0.00 60.65 57.65 2joz h LYS 11 Cb 1.14 0.06 -0.01 0.00 0.08 0.00 0.00 32.23 33.49 2joz h LYS 11 CO 0.46 0.76 0.63 -1.21 -0.57 0.00 0.00 179.45 179.52 2joz s GLU 12 N -2.59 4.39 0.14 3.15 2.02 -1.26 -5.03 118.70 119.52 2joz s GLU 12 Ca -0.10 1.68 -0.02 0.00 0.02 0.00 0.00 54.97 56.55 2joz s GLU 12 Cb 0.08 -3.49 0.03 0.00 0.10 0.00 0.00 34.13 30.85 2joz s GLU 12 CO 0.81 -0.36 0.19 0.39 0.02 0.00 0.00 175.26 176.31 2joz n GLU 13 N 4.72 0.07 -2.89 1.61 1.02 -1.26 -5.05 120.64 118.86 2joz n GLU 13 Ca 0.10 -0.37 -0.40 0.00 -0.02 0.00 0.00 57.16 56.48 2joz n GLU 13 Cb 0.47 -0.17 -0.06 0.00 -0.02 0.00 0.00 31.44 31.65 2joz n GLU 13 CO 0.00 0.00 0.00 -0.08 1.18 0.00 0.00 177.13 178.23 2joz s THR 14 N -1.01 4.25 -0.26 2.62 -1.32 -1.26 -4.98 115.64 113.69 2joz s THR 14 Ca 0.11 1.85 -0.28 0.00 -1.21 0.00 0.00 61.69 62.16 2joz s THR 14 Cb -0.00 -4.21 -0.05 0.00 -1.51 0.00 0.00 72.50 66.74 2joz s THR 14 CO 0.08 0.50 2.16 -2.84 -2.21 0.00 0.00 174.62 172.31 2joz s PRO 15 N -1.19 3.09 0.52 7.08 0.02 -1.26 -4.85 135.00 138.40 2joz s PRO 15 Ca 0.38 1.89 0.33 0.00 0.02 0.00 0.00 61.00 63.62 2joz s PRO 15 Cb -0.24 -4.36 1.45 0.00 0.02 0.00 0.00 34.50 31.37 2joz s PRO 15 CO 0.28 -2.15 1.99 0.27 -0.33 0.00 0.00 177.00 177.06 2joz h PHE 16 N 15.02 0.00 0.00 6.54 -0.00 -1.94 -2.57 116.94 133.99 2joz h PHE 16 Ca -0.39 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 57.58 2joz h PHE 16 Cb 1.23 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 37.18 2joz h PHE 16 CO 0.94 0.00 -0.76 2.48 -0.00 0.00 0.00 178.31 180.97 2joz n TYR 17 N -2.93 0.01 -2.74 6.09 4.11 -1.26 -4.93 117.16 115.51 2joz n TYR 17 Ca 0.00 0.00 -0.42 0.00 -0.00 0.00 0.00 57.90 57.49 2joz n TYR 17 Cb 0.25 -0.14 -0.03 0.00 -0.00 0.00 0.00 39.34 39.42 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 -3.01 3.66 -4.47 -3.48 5.04 -0.97 -4.68 117.35 109.45 2joz s TYR 18 Ca 0.09 1.66 0.00 0.00 -2.44 0.00 0.00 57.07 56.39 2joz s TYR 18 Cb 0.17 -3.09 0.00 0.00 0.35 0.00 0.00 41.96 39.39 2joz s TYR 18 CO 0.79 0.01 0.00 0.41 -1.34 0.00 0.00 175.55 175.42 2joz n GLY 19 N 2.88 0.93 3.60 8.97 0.00 -1.22 -5.02 105.19 115.32 2joz n GLY 19 Ca 0.05 -1.94 -0.34 0.00 0.00 0.00 0.00 46.02 43.79 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 -2.30 4.51 0.05 2.61 2.01 -1.26 -2.34 115.64 118.91 2joz s THR 20 Ca 0.00 -0.14 0.09 0.00 0.31 0.00 0.00 61.69 61.95 2joz s THR 20 Cb 0.00 -3.01 -0.03 0.00 0.01 0.00 0.00 72.50 69.47 2joz s THR 20 CO 0.00 0.48 -0.25 0.26 -0.69 0.00 0.00 174.62 174.42 2joz s TRP 21 N 0.27 2.35 -0.04 4.92 0.52 0.65 -1.04 118.94 126.56 2joz s TRP 21 Ca 0.02 -0.39 -0.10 0.00 0.02 0.00 0.00 56.10 55.64 2joz s TRP 21 Cb -0.13 -1.40 -0.05 0.00 -1.15 0.00 0.00 33.47 30.75 2joz s TRP 21 CO 0.01 0.15 0.28 0.34 0.02 0.00 0.00 176.95 177.74 2joz s ASP 22 N -1.28 6.57 0.20 2.95 -1.08 0.61 -0.54 116.67 124.10 2joz s ASP 22 Ca 0.12 0.68 -0.14 0.00 -0.52 0.00 0.00 52.55 52.69 2joz s ASP 22 Cb -0.10 -2.14 0.21 0.00 -1.46 0.00 0.00 42.92 39.43 2joz s ASP 22 CO 0.02 0.33 1.63 -0.33 0.52 0.00 0.00 175.17 177.35 2joz h GLU 23 N 4.58 0.00 0.00 4.34 4.39 -1.85 -3.05 114.58 122.99 2joz h GLU 23 Ca -0.52 -0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.18 2joz h GLU 23 Cb 1.22 -0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.87 2joz h GLU 23 CO 0.62 0.00 0.00 0.41 -1.16 0.00 0.00 179.01 178.88 2joz n GLY 24 N -1.41 1.22 3.22 -3.84 0.00 -1.26 -4.55 105.19 98.57 2joz n GLY 24 Ca 0.07 -0.01 -0.12 0.00 0.00 0.00 0.00 46.02 45.95 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 1.05 0.24 1.61 3.52 -1.26 -5.05 118.95 119.06 2joz s ARG 25 Ca 0.00 -1.50 0.00 0.00 -0.13 0.00 0.00 55.73 54.10 2joz s ARG 25 Cb 0.00 -0.16 0.00 0.00 -1.56 0.00 0.00 34.95 33.23 2joz s ARG 25 CO 0.00 -0.15 0.00 0.00 -0.81 0.00 0.00 175.30 174.34 2joz n ALA 26 N -0.19 -1.50 -1.23 6.12 0.00 -1.26 -4.96 120.51 117.48 2joz n ALA 26 Ca -0.07 0.36 -0.30 0.00 0.00 0.00 0.00 53.44 53.44 2joz n ALA 26 Cb 0.63 -0.62 0.21 0.00 0.00 0.00 0.00 19.45 19.67 2joz n ALA 26 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 2joz s PRO 27 N -3.38 -0.49 0.00 0.00 0.02 -1.26 -5.10 135.00 124.80 2joz s PRO 27 Ca 0.00 0.05 0.00 0.00 0.02 0.00 0.00 61.00 61.07 2joz s PRO 27 Cb 0.00 -1.67 0.00 0.00 0.02 0.00 0.00 34.50 32.85 2joz s PRO 27 CO 0.00 -3.25 0.00 0.41 -0.33 0.00 0.00 177.00 173.83 2joz n GLY 28 N -1.38 5.67 3.45 0.52 0.00 -1.26 -5.12 105.19 107.07 2joz n GLY 28 Ca 0.11 -1.53 -0.39 0.00 0.00 0.00 0.00 46.02 44.21 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 0.51 0.00 1.61 -0.04 -1.26 -4.87 135.00 130.95 2joz n PRO 29 Ca 0.00 0.20 0.15 0.00 -0.04 0.00 0.00 63.50 63.81 2joz n PRO 29 Cb 0.00 -1.60 0.83 0.00 -0.04 0.00 0.00 33.50 32.69 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 -1.41 0.00 1.87 0.52 -2.24 -1.26 -2.93 114.28 108.83 2joz n THR 30 Ca 0.11 -0.02 0.16 0.00 -2.27 0.00 0.00 64.05 62.02 2joz n THR 30 Cb 0.45 -0.38 0.90 0.00 -2.10 0.00 0.00 70.33 69.20 2joz n THR 30 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2joz n ASP 31 N -0.99 0.00 -0.31 3.42 9.92 -1.26 -4.87 116.55 122.45 2joz n ASP 31 Ca 0.20 -0.83 -0.00 0.00 -0.53 0.00 0.00 54.79 53.62 2joz n ASP 31 Cb 0.18 -0.05 0.00 0.00 -0.64 0.00 0.00 41.12 40.61 2joz n ASP 31 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2joz n GLY 32 N 1.02 0.66 3.73 0.44 0.00 -1.15 -5.02 105.19 104.87 2joz n GLY 32 Ca 0.22 -0.76 -0.41 0.00 0.00 0.00 0.00 46.02 45.06 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 -2.54 4.15 -0.72 1.61 1.01 -1.25 -4.94 120.40 117.73 2joz s VAL 33 Ca 0.01 1.70 0.24 0.00 0.00 0.00 0.00 61.98 63.92 2joz s VAL 33 Cb -0.00 -4.09 -0.04 0.00 0.00 0.00 0.00 36.38 32.26 2joz s VAL 33 CO 0.01 0.22 1.20 0.29 0.00 0.00 0.00 175.10 176.82 2joz n LYS 34 N 3.12 0.22 -3.79 2.72 5.02 -1.24 -4.75 118.16 119.46 2joz n LYS 34 Ca 0.05 0.03 -0.10 0.00 -2.02 0.00 0.00 58.31 56.27 2joz n LYS 34 Cb 0.47 -1.60 -0.07 0.00 -0.02 0.00 0.00 35.03 33.81 2joz n LYS 34 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 2joz s SER 35 N -3.80 -0.02 -0.14 4.39 0.01 -1.09 -5.05 113.70 108.01 2joz s SER 35 Ca 0.06 -0.42 -0.28 0.00 1.31 0.00 0.00 55.95 56.62 2joz s SER 35 Cb 0.15 0.35 0.07 0.00 0.21 0.00 0.00 66.02 66.80 2joz s SER 35 CO 0.75 -0.68 0.69 0.00 0.41 0.00 0.00 173.24 174.41 2joz s ALA 36 N -3.22 -1.75 -0.01 1.44 0.00 -1.26 -0.06 121.76 116.89 2joz s ALA 36 Ca -0.00 1.59 0.02 0.00 0.00 0.00 0.00 51.96 53.57 2joz s ALA 36 Cb 0.02 -0.48 -0.00 0.00 0.00 0.00 0.00 23.12 22.65 2joz s ALA 36 CO -0.08 -0.35 -0.06 0.95 0.00 0.00 0.00 175.76 176.22 2joz s THR 37 N -0.54 0.50 -0.11 0.00 -4.23 0.11 -3.54 115.64 107.82 2joz s THR 37 Ca -0.06 -0.26 -0.01 0.00 -1.18 0.00 0.00 61.69 60.17 2joz s THR 37 Cb -0.02 -0.43 -0.02 0.00 1.34 0.00 0.00 72.50 73.36 2joz s THR 37 CO 0.06 0.15 -0.08 0.54 -0.54 0.00 0.00 174.62 174.75 2joz s VAL 38 N -0.10 3.53 -0.14 2.29 0.11 0.29 -0.48 120.40 125.91 2joz s VAL 38 Ca 0.02 -0.51 0.02 0.00 -2.93 0.00 0.00 61.98 58.58 2joz s VAL 38 Cb -0.03 -2.48 0.01 0.00 -1.53 0.00 0.00 36.38 32.35 2joz s VAL 38 CO -0.00 0.54 -0.20 -0.89 -3.33 0.00 0.00 175.10 171.22 2joz s THR 39 N -0.11 1.92 -0.30 5.04 2.01 0.37 -0.26 115.64 124.33 2joz s THR 39 Ca 0.00 -0.89 -0.11 0.00 0.31 0.00 0.00 61.69 61.01 2joz s THR 39 Cb -0.13 -1.72 -0.03 0.00 0.01 0.00 0.00 72.50 70.63 2joz s THR 39 CO 0.03 0.52 0.18 -0.36 -0.69 0.00 0.00 174.62 174.30 2joz s PHE 40 N 0.91 3.19 0.58 4.92 0.40 -0.99 -0.69 117.98 126.31 2joz s PHE 40 Ca -0.06 -0.21 0.09 0.00 -0.60 0.00 0.00 56.93 56.15 2joz s PHE 40 Cb -0.15 -2.38 0.08 0.00 0.51 0.00 0.00 43.02 41.09 2joz s PHE 40 CO -0.03 -0.31 0.72 0.99 0.70 0.00 0.00 175.22 177.29 2joz s THR 41 N 1.69 1.94 0.24 0.64 2.01 0.15 -3.43 115.64 118.88 2joz s THR 41 Ca 0.06 -1.12 -0.05 0.00 0.31 0.00 0.00 61.69 60.89 2joz s THR 41 Cb -0.16 -2.06 0.20 0.00 0.01 0.00 0.00 72.50 70.49 2joz s THR 41 CO 0.09 0.00 1.80 -0.33 -0.69 0.00 0.00 174.62 175.48 2joz h GLU 42 N 0.27 0.70 0.00 4.92 5.08 -2.01 -3.32 114.58 120.21 2joz h GLU 42 Ca -0.30 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.01 2joz h GLU 42 Cb 1.29 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 30.38 2joz h GLU 42 CO 0.44 0.47 -0.37 -3.47 -1.00 0.00 0.00 179.01 175.08 2joz n ASP 43 N -4.79 1.84 -4.20 1.42 2.03 -1.26 -5.05 116.55 106.54 2joz n ASP 43 Ca 0.13 -0.11 -0.25 0.00 0.52 0.00 0.00 54.79 55.08 2joz n ASP 43 Cb 0.28 0.59 -0.15 0.00 -0.72 0.00 0.00 41.12 41.12 2joz n ASP 43 CO 0.00 0.00 0.00 -1.83 -1.92 0.00 0.00 177.20 173.45 2joz s GLU 44 N -0.96 1.41 -0.22 -0.67 -1.05 -1.25 -2.43 118.70 113.53 2joz s GLU 44 Ca 0.00 -0.77 -0.09 0.00 -0.15 0.00 0.00 54.97 53.97 2joz s GLU 44 Cb 0.00 -1.42 -0.04 0.00 -0.44 0.00 0.00 34.13 32.22 2joz s GLU 44 CO 0.00 0.38 0.11 0.08 0.95 0.00 0.00 175.26 176.78 2joz s VAL 45 N -0.60 4.93 -0.17 1.83 1.01 0.12 -0.67 120.40 126.85 2joz s VAL 45 Ca 0.07 0.03 -0.00 0.00 0.00 0.00 0.00 61.98 62.07 2joz s VAL 45 Cb -0.08 -3.28 -0.00 0.00 0.00 0.00 0.00 36.38 33.02 2joz s VAL 45 CO 0.00 0.38 -0.14 -0.69 0.00 0.00 0.00 175.10 174.66 2joz s VAL 46 N 0.95 2.73 -0.07 2.92 1.01 0.14 -0.59 120.40 127.48 2joz s VAL 46 Ca 0.05 -0.74 -0.12 0.00 0.00 0.00 0.00 61.98 61.18 2joz s VAL 46 Cb -0.14 -2.17 -0.05 0.00 0.00 0.00 0.00 36.38 34.02 2joz s VAL 46 CO 0.03 0.50 0.30 -1.61 0.00 0.00 0.00 175.10 174.32 2joz s GLU 47 N 0.99 3.83 -0.15 2.72 8.01 -1.26 -0.48 118.70 132.36 2joz s GLU 47 Ca -0.02 0.17 0.00 0.00 0.01 0.00 0.00 54.97 55.13 2joz s GLU 47 Cb -0.15 -3.25 0.03 0.00 -4.31 0.00 0.00 34.13 26.45 2joz s GLU 47 CO -0.02 0.63 -0.12 0.99 0.01 0.00 0.00 175.26 176.74 2joz s THR 48 N -0.74 1.46 -0.21 3.63 2.01 0.37 -1.93 115.64 120.23 2joz s THR 48 Ca 0.19 -0.63 -0.07 0.00 0.31 0.00 0.00 61.69 61.49 2joz s THR 48 Cb -0.14 -1.43 -0.03 0.00 0.01 0.00 0.00 72.50 70.91 2joz s THR 48 CO 0.08 0.38 0.05 -1.61 -0.69 0.00 0.00 174.62 172.83 2joz s GLU 49 N 1.52 3.79 -0.40 4.92 2.02 0.70 0.04 118.70 131.29 2joz s GLU 49 Ca 0.04 -0.43 -0.15 0.00 0.02 0.00 0.00 54.97 54.44 2joz s GLU 49 Cb -0.13 -3.21 0.01 0.00 0.10 0.00 0.00 34.13 30.90 2joz s GLU 49 CO -0.10 0.07 0.34 0.08 0.02 0.00 0.00 175.26 175.67 2joz s VAL 50 N 0.91 5.21 -0.42 2.63 1.01 0.91 0.24 120.40 130.89 2joz s VAL 50 Ca 0.03 -0.47 -0.15 0.00 0.00 0.00 0.00 61.98 61.39 2joz s VAL 50 Cb -0.14 -3.93 0.03 0.00 0.00 0.00 0.00 36.38 32.34 2joz s VAL 50 CO 0.02 -0.29 0.34 -0.32 0.00 0.00 0.00 175.10 174.85 2joz s MET 51 N 1.84 2.99 -0.38 2.72 1.75 -0.30 -2.67 119.30 125.26 2joz s MET 51 Ca 0.08 -1.04 -0.28 0.00 -1.25 0.00 0.00 55.69 53.20 2joz s MET 51 Cb -0.18 -4.01 -0.03 0.00 2.84 0.00 0.00 34.83 33.45 2joz s MET 51 CO 0.11 -0.82 2.00 -2.00 -0.65 0.00 0.00 175.02 173.66 2joz s GLU 52 N 1.75 2.97 0.00 4.11 2.12 -1.26 -1.77 118.70 126.62 2joz s GLU 52 Ca 0.06 1.41 0.00 0.00 0.36 0.00 0.00 54.97 56.80 2joz s GLU 52 Cb -0.20 -4.33 0.00 0.00 0.26 0.00 0.00 34.13 29.86 2joz s GLU 52 CO 0.10 -2.29 0.00 0.41 -0.54 0.00 0.00 175.26 172.94 2joz n GLY 53 N 5.64 1.39 1.26 -1.50 0.00 -1.26 -4.95 105.19 105.76 2joz n GLY 53 Ca 0.26 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.28 2joz n GLY 53 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2joz n ARG 54 N 0.00 0.00 -0.31 1.61 1.85 -0.73 -5.17 116.66 113.91 2joz n ARG 54 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.85 2joz n ARG 54 Cb 0.00 -0.37 0.00 0.00 -1.05 0.00 0.00 32.46 31.04 2joz n ARG 54 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2joz n GLY 55 N 2.69 0.72 3.79 2.89 0.00 -0.75 -5.04 105.19 109.49 2joz n GLY 55 Ca 0.00 -1.68 -0.36 0.00 0.00 0.00 0.00 46.02 43.99 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 -2.00 4.45 -0.12 1.61 8.01 -1.26 -1.15 118.70 128.24 2joz s GLU 56 Ca 0.00 1.27 0.00 0.00 0.01 0.00 0.00 54.97 56.25 2joz s GLU 56 Cb 0.00 -2.58 0.02 0.00 -4.31 0.00 0.00 34.13 27.26 2joz s GLU 56 CO 0.00 0.16 -0.11 0.08 0.01 0.00 0.00 175.26 175.39 2joz s VAL 57 N -1.81 1.28 -0.14 2.63 1.01 0.14 -4.93 120.40 118.58 2joz s VAL 57 Ca 0.54 -0.47 -0.14 0.00 0.00 0.00 0.00 61.98 61.91 2joz s VAL 57 Cb -0.15 -1.23 -0.05 0.00 0.00 0.00 0.00 36.38 34.95 2joz s VAL 57 CO 0.20 0.41 0.31 -1.10 0.00 0.00 0.00 175.10 174.92 2joz s GLN 58 N 1.40 4.19 0.32 2.72 -0.21 -1.26 -0.21 119.66 126.61 2joz s GLN 58 Ca 0.01 0.15 -0.02 0.00 0.02 0.00 0.00 55.36 55.51 2joz s GLN 58 Cb -0.13 -3.40 -0.04 0.00 1.00 0.00 0.00 33.01 30.44 2joz s GLN 58 CO -0.07 0.30 0.55 -0.51 -2.12 0.00 0.00 175.29 173.45 2joz s LEU 59 N 0.27 4.02 -0.25 2.90 1.43 -0.81 -5.01 118.68 121.23 2joz s LEU 59 Ca 0.18 0.59 -0.38 0.00 -1.03 0.00 0.00 54.13 53.49 2joz s LEU 59 Cb -0.13 -3.43 -0.14 0.00 0.03 0.00 0.00 46.19 42.51 2joz s LEU 59 CO 0.05 -0.25 1.85 -2.65 0.23 0.00 0.00 176.35 175.58 2joz n PRO 60 N -1.36 1.38 -1.78 1.29 -0.02 -1.26 -4.52 135.00 128.74 2joz n PRO 60 Ca -0.03 0.49 -0.39 0.00 -2.02 0.00 0.00 63.50 61.56 2joz n PRO 60 Cb 0.55 -2.28 0.04 0.00 -0.02 0.00 0.00 33.50 31.79 2joz n PRO 60 CO 0.00 0.00 0.00 -0.59 1.98 0.00 0.00 175.50 176.89 2joz s PHE 61 N 4.22 2.32 -0.22 6.00 -0.71 -1.26 -4.88 117.98 123.44 2joz s PHE 61 Ca 0.99 1.34 -0.08 0.00 -1.04 0.00 0.00 56.93 58.13 2joz s PHE 61 Cb -0.96 -3.85 -0.04 0.00 -1.21 0.00 0.00 43.02 36.97 2joz s PHE 61 CO 0.60 -2.95 0.10 -1.64 -1.34 0.00 0.00 175.22 169.99 2joz s MET 62 N -2.78 3.92 0.10 1.99 -1.94 0.24 -4.89 119.30 115.94 2joz s MET 62 Ca 0.69 -0.35 -0.26 0.00 -1.71 0.00 0.00 55.69 54.05 2joz s MET 62 Cb -0.42 -3.35 -0.06 0.00 2.01 0.00 0.00 34.83 33.01 2joz s MET 62 CO 0.51 0.09 0.80 0.00 -0.01 0.00 0.00 175.02 176.41 2joz s ALA 63 N 0.91 3.37 0.21 3.03 0.00 -1.26 0.10 121.76 128.13 2joz s ALA 63 Ca 0.05 0.36 0.07 0.00 0.00 0.00 0.00 51.96 52.44 2joz s ALA 63 Cb -0.14 -3.03 -0.05 0.00 0.00 0.00 0.00 23.12 19.90 2joz s ALA 63 CO 0.03 0.13 -0.12 1.52 0.00 0.00 0.00 175.76 177.32 2joz s TYR 64 N -0.42 1.70 0.04 0.00 -0.85 -1.02 -2.82 117.35 113.98 2joz s TYR 64 Ca 0.39 -0.63 0.08 0.00 -0.52 0.00 0.00 57.07 56.39 2joz s TYR 64 Cb -0.22 -0.84 -0.03 0.00 0.38 0.00 0.00 41.96 41.25 2joz s TYR 64 CO 0.25 0.30 -0.24 0.15 -1.52 0.00 0.00 175.55 174.49 2joz s LYS 65 N -3.68 1.61 -0.37 -3.49 1.02 -0.18 -4.89 119.74 109.76 2joz s LYS 65 Ca 0.23 -1.03 -0.22 0.00 0.02 0.00 0.00 55.97 54.98 2joz s LYS 65 Cb 0.01 -1.76 0.01 0.00 -0.52 0.00 0.00 37.83 35.57 2joz s LYS 65 CO 0.07 0.45 0.70 0.08 -0.92 0.00 0.00 175.35 175.74 2joz s VAL 66 N -0.79 4.81 -0.12 3.17 1.01 -1.26 -0.07 120.40 127.15 2joz s VAL 66 Ca 0.10 0.67 -0.10 0.00 0.00 0.00 0.00 61.98 62.64 2joz s VAL 66 Cb -0.09 -4.15 -0.09 0.00 0.00 0.00 0.00 36.38 32.05 2joz s VAL 66 CO 0.02 -0.40 0.22 0.40 0.00 0.00 0.00 175.10 175.34 2joz h ILE 67 N 5.74 0.56 -3.96 2.22 2.04 -1.32 -3.47 117.51 119.32 2joz h ILE 67 Ca -0.26 -1.44 -0.57 0.00 1.00 0.00 0.00 64.86 63.60 2joz h ILE 67 Cb 1.10 1.08 -0.22 0.00 -0.74 0.00 0.00 36.82 38.04 2joz h ILE 67 CO 0.88 0.19 -0.83 -0.44 0.00 0.00 0.00 178.15 177.95 2joz s SER 68 N -5.81 2.57 -0.11 1.72 0.01 -1.11 -5.00 113.70 105.97 2joz s SER 68 Ca -0.08 -0.67 -0.08 0.00 1.31 0.00 0.00 55.95 56.43 2joz s SER 68 Cb -0.00 -0.15 0.03 0.00 0.21 0.00 0.00 66.02 66.11 2joz s SER 68 CO 0.24 0.08 0.28 -1.58 0.41 0.00 0.00 173.24 172.67 2joz s GLN 69 N -1.83 0.29 0.02 12.44 0.74 -1.26 -0.57 119.66 129.49 2joz s GLN 69 Ca 0.07 0.46 -0.02 0.00 0.05 0.00 0.00 55.36 55.91 2joz s GLN 69 Cb -0.10 0.07 -0.02 0.00 1.10 0.00 0.00 33.01 34.06 2joz s GLN 69 CO 0.04 -0.08 0.02 0.45 -0.55 0.00 0.00 175.29 175.16 2joz s SER 70 N 0.55 0.19 0.00 6.67 0.15 -0.74 -4.99 113.70 115.54 2joz s SER 70 Ca -0.03 -0.45 0.26 0.00 0.70 0.00 0.00 55.95 56.43 2joz s SER 70 Cb -0.05 0.13 0.76 0.00 -1.71 0.00 0.00 66.02 65.15 2joz s SER 70 CO -0.03 -0.34 1.59 0.35 1.20 0.00 0.00 173.24 176.01 2joz n THR 71 N 1.48 0.00 0.00 6.45 -2.24 -1.26 -4.49 114.28 114.21 2joz n THR 71 Ca -0.23 -0.01 0.00 0.00 -2.27 0.00 0.00 64.05 61.54 2joz n THR 71 Cb 0.55 0.03 0.00 0.00 -2.10 0.00 0.00 70.33 68.81 2joz n THR 71 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 2joz n ASP 72 N -1.44 0.00 0.00 3.42 5.75 -1.26 -4.55 116.55 118.47 2joz n ASP 72 Ca 0.07 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.85 2joz n ASP 72 Cb 0.33 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.42 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 0.13 0.66 3.60 6.12 0.00 -1.26 -4.90 105.19 109.53 2joz n GLY 73 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.92 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 -1.77 -0.41 -0.03 1.61 1.04 -1.26 -4.18 113.70 108.70 2joz s SER 74 Ca 0.00 -0.30 0.02 0.00 0.48 0.00 0.00 55.95 56.15 2joz s SER 74 Cb 0.00 0.64 0.00 0.00 0.10 0.00 0.00 66.02 66.77 2joz s SER 74 CO 0.00 -1.12 -0.08 -0.63 0.98 0.00 0.00 173.24 172.39 2joz s ILE 75 N -3.83 0.71 -0.12 -1.02 1.01 0.16 -1.79 121.20 116.33 2joz s ILE 75 Ca 0.06 -0.32 0.00 0.00 0.00 0.00 0.00 60.65 60.39 2joz s ILE 75 Cb -0.03 -0.64 -0.02 0.00 0.01 0.00 0.00 42.46 41.78 2joz s ILE 75 CO -0.04 0.23 -0.12 -0.70 0.00 0.00 0.00 174.94 174.31 2joz s GLU 76 N 0.25 3.27 0.13 2.79 2.12 0.26 -0.04 118.70 127.48 2joz s GLU 76 Ca -0.04 -0.66 0.05 0.00 0.36 0.00 0.00 54.97 54.68 2joz s GLU 76 Cb -0.09 -2.63 -0.04 0.00 0.26 0.00 0.00 34.13 31.64 2joz s GLU 76 CO 0.00 0.29 -0.12 0.96 -0.54 0.00 0.00 175.26 175.86 2joz s ILE 77 N 0.16 1.21 -0.07 -3.70 -4.36 -0.10 -0.84 121.20 113.50 2joz s ILE 77 Ca -0.06 -1.84 0.04 0.00 -0.26 0.00 0.00 60.65 58.52 2joz s ILE 77 Cb -0.15 -1.62 0.00 0.00 1.25 0.00 0.00 42.46 41.95 2joz s ILE 77 CO 0.05 -0.57 -0.18 -1.58 0.24 0.00 0.00 174.94 172.90 2joz s GLN 78 N -3.10 2.16 0.38 0.37 0.74 0.90 -0.40 119.66 120.72 2joz s GLN 78 Ca 0.11 -0.63 -0.13 0.00 0.05 0.00 0.00 55.36 54.77 2joz s GLN 78 Cb -0.02 -1.74 -0.07 0.00 1.10 0.00 0.00 33.01 32.27 2joz s GLN 78 CO 0.02 0.15 0.77 0.71 -0.55 0.00 0.00 175.29 176.39 2joz s TYR 79 N 0.35 3.43 0.43 1.67 2.02 -1.24 -1.01 117.35 123.00 2joz s TYR 79 Ca -0.12 1.14 0.01 0.00 -0.37 0.00 0.00 57.07 57.72 2joz s TYR 79 Cb -0.15 -2.50 0.01 0.00 -0.40 0.00 0.00 41.96 38.92 2joz s TYR 79 CO 0.05 -0.05 0.08 1.28 -1.57 0.00 0.00 175.55 175.33 2joz n LEU 80 N -0.97 0.00 0.00 -1.29 4.77 -1.13 -3.23 117.00 115.16 2joz n LEU 80 Ca 0.03 -2.59 0.00 0.00 -0.03 0.00 0.00 56.01 53.42 2joz n LEU 80 Cb 0.54 0.22 0.00 0.00 -2.33 0.00 0.00 43.42 41.85 2joz n LEU 80 CO 0.45 -0.41 0.00 0.61 -1.33 0.00 0.00 177.39 176.71 2joz n GLY 81 N -0.15 -0.65 0.02 -0.72 0.00 -1.26 -3.48 105.19 98.96 2joz n GLY 81 Ca -0.14 -1.16 0.03 0.00 0.00 0.00 0.00 46.02 44.75 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 -0.76 1.61 -0.02 -1.26 -1.05 135.00 133.54 2joz n PRO 82 Ca 0.00 0.48 -0.02 0.00 -2.02 0.00 0.00 63.50 61.94 2joz n PRO 82 Cb 0.00 -1.57 0.23 0.00 -0.02 0.00 0.00 33.50 32.14 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 -1.61 1.40 -0.64 6.00 4.01 -1.23 -5.04 117.16 120.05 2joz n TYR 83 Ca 0.00 -1.35 -0.31 0.00 -0.16 0.00 0.00 57.90 56.08 2joz n TYR 83 Cb 0.03 -0.50 0.19 0.00 -0.31 0.00 0.00 39.34 38.75 2joz n TYR 83 CO 0.00 0.00 0.00 2.48 -0.46 0.00 0.00 176.86 178.88 2joz n TYR 84 N -0.82 -1.14 0.00 -0.72 4.11 -0.21 -3.08 117.16 115.29 2joz n TYR 84 Ca 0.33 0.10 0.00 0.00 -0.00 0.00 0.00 57.90 58.33 2joz n TYR 84 Cb 1.10 -1.69 0.00 0.00 -0.00 0.00 0.00 39.34 38.74 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 -3.07 0.00 -2.10 -3.48 -0.02 -1.20 -4.83 135.00 120.30 2joz n PRO 85 Ca 0.04 0.00 -0.40 0.00 -2.02 0.00 0.00 63.50 61.12 2joz n PRO 85 Cb 0.57 0.00 -0.03 0.00 -0.02 0.00 0.00 33.50 34.02 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 3.36 0.51 2.45 2.96 -1.18 -4.84 118.68 121.94 2joz s LEU 86 Ca 0.00 0.54 0.07 0.00 -0.22 0.00 0.00 54.13 54.52 2joz s LEU 86 Cb 0.00 -2.86 0.04 0.00 0.50 0.00 0.00 46.19 43.87 2joz s LEU 86 CO 0.00 -2.09 0.69 -1.59 -1.32 0.00 0.00 176.35 172.05 2joz s LYS 87 N 6.41 2.55 0.05 1.98 -2.85 -1.26 -3.65 119.74 122.98 2joz s LYS 87 Ca 0.67 -1.28 -0.03 0.00 -1.00 0.00 0.00 55.97 54.33 2joz s LYS 87 Cb -0.14 -2.66 -0.03 0.00 -2.06 0.00 0.00 37.83 32.94 2joz s LYS 87 CO 0.24 -0.59 0.03 0.45 0.10 0.00 0.00 175.35 175.58 2joz s SER 88 N -4.48 0.37 -0.00 0.03 0.15 0.47 -4.16 113.70 106.07 2joz s SER 88 Ca 0.58 -0.85 0.07 0.00 0.70 0.00 0.00 55.95 56.45 2joz s SER 88 Cb -0.08 0.23 -0.02 0.00 -1.71 0.00 0.00 66.02 64.43 2joz s SER 88 CO 0.36 -0.60 -0.21 -0.89 1.20 0.00 0.00 173.24 173.10 2joz s THR 89 N -3.63 1.68 -0.15 6.45 2.01 0.84 -0.92 115.64 121.92 2joz s THR 89 Ca 0.04 -0.97 0.02 0.00 0.31 0.00 0.00 61.69 61.09 2joz s THR 89 Cb 0.05 -1.41 0.01 0.00 0.01 0.00 0.00 72.50 71.17 2joz s THR 89 CO -0.09 0.42 -0.21 -0.76 -0.69 0.00 0.00 174.62 173.29 2joz s LEU 90 N -0.65 2.08 0.03 4.42 1.43 0.95 -0.77 118.68 126.17 2joz s LEU 90 Ca 0.08 -0.61 0.01 0.00 -1.03 0.00 0.00 54.13 52.58 2joz s LEU 90 Cb -0.08 -1.43 -0.02 0.00 0.03 0.00 0.00 46.19 44.68 2joz s LEU 90 CO -0.00 0.04 -0.05 -0.54 0.23 0.00 0.00 176.35 176.03 2joz s LYS 91 N 1.03 0.41 0.19 1.70 1.02 -0.74 -0.66 119.74 122.69 2joz s LYS 91 Ca -0.02 -0.65 -0.13 0.00 0.02 0.00 0.00 55.97 55.19 2joz s LYS 91 Cb -0.14 -0.10 -0.07 0.00 -0.52 0.00 0.00 37.83 36.99 2joz s LYS 91 CO -0.06 0.00 0.56 -0.98 -0.92 0.00 0.00 175.35 173.95 2joz s ARG 92 N -1.44 3.92 0.00 1.68 1.70 -1.26 0.12 118.95 123.67 2joz s ARG 92 Ca -0.12 0.42 0.00 0.00 -0.47 0.00 0.00 55.73 55.56 2joz s ARG 92 Cb -0.10 -2.80 0.00 0.00 -0.57 0.00 0.00 34.95 31.49 2joz s ARG 92 CO -0.00 0.40 0.00 0.41 -1.08 0.00 0.00 175.30 175.03 2joz n GLY 93 N 0.39 4.80 3.76 3.88 0.00 0.04 -4.77 105.19 113.29 2joz n GLY 93 Ca -0.03 -2.04 -0.41 0.00 0.00 0.00 0.00 46.02 43.54 2joz n GLY 93 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2joz s GLU 94 N 1.70 4.24 2.89 1.61 8.01 -1.26 -4.58 118.70 131.31 2joz s GLU 94 Ca 0.00 2.37 0.00 0.00 0.01 0.00 0.00 54.97 57.35 2joz s GLU 94 Cb 0.00 -3.06 0.00 0.00 -4.31 0.00 0.00 34.13 26.76 2joz s GLU 94 CO 0.00 -0.41 0.00 0.09 0.01 0.00 0.00 175.26 174.95 2joz n ASN 95 N 1.57 -1.64 -3.20 -0.19 5.03 -1.26 -3.74 115.26 111.82 2joz n ASN 95 Ca 0.04 0.00 -0.36 0.00 0.87 0.00 0.00 54.58 55.13 2joz n ASN 95 Cb 0.40 0.00 -0.02 0.00 -1.02 0.00 0.00 39.78 39.14 2joz n ASN 95 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2joz n GLY 96 N 0.00 4.99 3.36 7.41 0.00 -1.26 -4.91 105.19 114.77 2joz n GLY 96 Ca 0.00 -2.01 -0.28 0.00 0.00 0.00 0.00 46.02 43.73 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 -1.52 2.12 -0.12 2.61 -4.23 -1.25 -3.97 115.64 109.29 2joz s THR 97 Ca 0.55 -1.64 -0.01 0.00 -1.18 0.00 0.00 61.69 59.42 2joz s THR 97 Cb 0.24 -1.87 -0.02 0.00 1.34 0.00 0.00 72.50 72.19 2joz s THR 97 CO -0.13 0.11 -0.09 -0.22 -0.54 0.00 0.00 174.62 173.75 2joz s LEU 98 N -1.86 2.95 -0.37 4.79 2.96 -1.02 -0.78 118.68 125.34 2joz s LEU 98 Ca 0.12 -0.20 -0.15 0.00 -0.22 0.00 0.00 54.13 53.67 2joz s LEU 98 Cb -0.10 -1.67 -0.00 0.00 0.50 0.00 0.00 46.19 44.92 2joz s LEU 98 CO 0.05 0.22 0.36 -0.63 -1.32 0.00 0.00 176.35 175.03 2joz s ILE 99 N 0.04 5.17 -0.36 6.68 1.01 0.33 -1.61 121.20 132.46 2joz s ILE 99 Ca -0.03 -0.17 -0.16 0.00 0.00 0.00 0.00 60.65 60.30 2joz s ILE 99 Cb -0.14 -3.88 -0.00 0.00 0.01 0.00 0.00 42.46 38.45 2joz s ILE 99 CO 0.04 -0.19 0.40 0.86 0.00 0.00 0.00 174.94 176.04 2joz s TRP 100 N 1.98 3.20 -0.14 3.97 -0.00 0.11 -1.79 118.94 126.26 2joz s TRP 100 Ca 0.10 -0.07 -0.05 0.00 -0.00 0.00 0.00 56.10 56.09 2joz s TRP 100 Cb -0.17 -2.74 -0.03 0.00 -0.00 0.00 0.00 33.47 30.52 2joz s TRP 100 CO 0.12 -0.50 0.02 -1.21 -0.00 0.00 0.00 176.95 175.38 2joz s GLU 101 N 2.09 3.59 -0.15 5.86 2.02 0.05 -0.53 118.70 131.62 2joz s GLU 101 Ca 0.13 -0.40 -0.10 0.00 0.02 0.00 0.00 54.97 54.62 2joz s GLU 101 Cb -0.16 -3.01 0.05 0.00 0.10 0.00 0.00 34.13 31.10 2joz s GLU 101 CO 0.12 0.41 0.38 -1.14 0.02 0.00 0.00 175.26 175.06 2joz s GLN 102 N -0.06 0.38 0.00 1.61 -0.44 -0.93 -0.11 119.66 120.11 2joz s GLN 102 Ca 0.05 0.67 0.00 0.00 -2.50 0.00 0.00 55.36 53.58 2joz s GLN 102 Cb -0.13 0.04 0.00 0.00 -1.64 0.00 0.00 33.01 31.28 2joz s GLN 102 CO 0.02 -0.13 0.00 -1.71 0.50 0.00 0.00 175.29 173.97 2joz n ASN 103 N 3.81 0.00 0.00 6.67 2.85 -1.26 -2.19 115.26 125.14 2joz n ASN 103 Ca -0.20 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.27 2joz n ASN 103 Cb 0.56 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.58 2joz n ASN 103 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2joz n GLY 104 N 0.00 0.00 3.80 8.20 0.00 -1.26 -5.15 105.19 110.78 2joz n GLY 104 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 2joz n GLY 104 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2joz s GLN 105 N 0.00 3.23 -0.13 1.61 -2.07 -0.93 -5.09 119.66 116.28 2joz s GLN 105 Ca 0.00 -0.29 -0.06 0.00 -1.82 0.00 0.00 55.36 53.19 2joz s GLN 105 Cb 0.00 -3.00 -0.04 0.00 -1.09 0.00 0.00 33.01 28.88 2joz s GLN 105 CO 0.00 0.73 0.11 -0.98 -1.32 0.00 0.00 175.29 173.83 2joz s ARG 106 N -1.14 3.47 -0.05 9.60 1.70 -1.26 -2.20 118.95 129.06 2joz s ARG 106 Ca 0.16 -0.20 0.04 0.00 -0.47 0.00 0.00 55.73 55.26 2joz s ARG 106 Cb -0.12 -3.15 0.00 0.00 -0.57 0.00 0.00 34.95 31.12 2joz s ARG 106 CO 0.06 0.69 -0.15 0.15 -1.08 0.00 0.00 175.30 174.97 2joz s LYS 107 N -0.80 1.71 -0.16 3.89 -0.14 0.31 -4.95 119.74 119.60 2joz s LYS 107 Ca 0.13 -0.54 -0.15 0.00 -1.36 0.00 0.00 55.97 54.06 2joz s LYS 107 Cb -0.12 -1.47 -0.04 0.00 -1.68 0.00 0.00 37.83 34.52 2joz s LYS 107 CO 0.03 0.18 0.35 -0.08 -0.76 0.00 0.00 175.35 175.07 2joz s THR 108 N 0.21 5.26 0.10 2.17 -1.32 -1.26 0.05 115.64 120.84 2joz s THR 108 Ca -0.07 0.66 0.09 0.00 -1.21 0.00 0.00 61.69 61.16 2joz s THR 108 Cb -0.12 -3.69 -0.03 0.00 -1.51 0.00 0.00 72.50 67.14 2joz s THR 108 CO 0.03 0.34 -0.23 0.00 -2.21 0.00 0.00 174.62 172.55 2joz s MET 109 N 0.73 1.25 0.14 7.08 0.23 -0.64 -4.54 119.30 123.56 2joz s MET 109 Ca 0.19 -1.17 -0.04 0.00 -1.03 0.00 0.00 55.69 53.63 2joz s MET 109 Cb -0.14 -1.55 -0.05 0.00 -1.53 0.00 0.00 34.83 31.56 2joz s MET 109 CO 0.06 0.37 0.37 0.99 -2.03 0.00 0.00 175.02 174.78 2joz s THR 110 N -1.07 5.18 0.43 3.16 2.01 -1.15 -2.44 115.64 121.75 2joz s THR 110 Ca 0.09 -0.00 -0.12 0.00 0.31 0.00 0.00 61.69 61.97 2joz s THR 110 Cb -0.10 -3.63 -0.07 0.00 0.01 0.00 0.00 72.50 68.72 2joz s THR 110 CO 0.04 0.04 0.81 0.00 -0.69 0.00 0.00 174.62 174.82 2joz s ARG 111 N -2.66 3.80 0.13 4.92 1.70 -1.25 -0.28 118.95 125.30 2joz s ARG 111 Ca 0.41 0.56 -0.03 0.00 -0.47 0.00 0.00 55.73 56.19 2joz s ARG 111 Cb -0.12 -2.34 -0.05 0.00 -0.57 0.00 0.00 34.95 31.87 2joz s ARG 111 CO 0.25 -0.09 0.33 0.42 -1.08 0.00 0.00 175.30 175.14 2joz s ILE 112 N -2.43 5.23 -1.14 4.99 -1.09 -0.21 -4.74 121.20 121.81 2joz s ILE 112 Ca 0.53 -0.13 -0.16 0.00 -2.23 0.00 0.00 60.65 58.65 2joz s ILE 112 Cb -0.10 -3.64 0.14 0.00 -1.58 0.00 0.00 42.46 37.27 2joz s ILE 112 CO 0.32 0.04 1.40 -1.61 -1.23 0.00 0.00 174.94 173.86 2joz s GLU 113 N -2.70 3.91 0.04 2.79 0.41 -1.26 -4.71 118.70 117.18 2joz s GLU 113 Ca 0.39 -2.17 -0.27 0.00 -0.41 0.00 0.00 54.97 52.51 2joz s GLU 113 Cb -0.12 -5.12 -0.05 0.00 -1.78 0.00 0.00 34.13 27.05 2joz s GLU 113 CO 0.26 -1.88 0.84 -1.12 -0.49 0.00 0.00 175.26 172.87 2joz s SER 114 N 3.42 7.28 -1.02 -0.19 0.01 -1.26 -4.97 113.70 116.97 2joz s SER 114 Ca 0.42 1.54 -0.23 0.00 1.31 0.00 0.00 55.95 58.99 2joz s SER 114 Cb -0.02 -2.51 0.02 0.00 0.21 0.00 0.00 66.02 63.73 2joz s SER 114 CO -0.02 -0.06 1.60 -0.75 0.41 0.00 0.00 173.24 174.42 2joz s LYS 115 N 0.23 3.34 -0.17 12.44 2.20 -1.26 -4.88 119.74 131.64 2joz s LYS 115 Ca 0.43 -0.99 -0.13 0.00 -0.36 0.00 0.00 55.97 54.92 2joz s LYS 115 Cb -0.21 -5.30 0.05 0.00 -1.51 0.00 0.00 37.83 30.86 2joz s LYS 115 CO 0.25 -2.54 0.43 0.99 -0.36 0.00 0.00 175.35 174.11 2joz s THR 116 N 6.32 -0.01 0.00 3.43 2.01 -1.26 -4.98 115.64 121.15 2joz s THR 116 Ca 0.53 0.04 0.00 0.00 0.31 0.00 0.00 61.69 62.57 2joz s THR 116 Cb -0.01 -0.61 0.00 0.00 0.01 0.00 0.00 72.50 71.88 2joz s THR 116 CO -0.06 0.02 0.00 0.61 -0.69 0.00 0.00 174.62 174.50 2joz n GLY 117 N 3.46 2.71 3.40 4.40 0.00 -1.26 -5.07 105.19 112.83 2joz n GLY 117 Ca -0.18 -0.33 -0.45 0.00 0.00 0.00 0.00 46.02 45.07 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 0.00 3.43 -0.12 1.61 1.04 -1.26 -4.98 118.95 118.67 2joz s ARG 118 Ca 0.00 -1.78 -0.05 0.00 -1.04 0.00 0.00 55.73 52.86 2joz s ARG 118 Cb 0.00 -4.59 0.06 0.00 -2.04 0.00 0.00 34.95 28.38 2joz s ARG 118 CO 0.00 -1.59 0.25 -1.21 -0.04 0.00 0.00 175.30 172.71 2joz s GLU 119 N 2.10 0.14 0.24 3.89 2.02 -1.26 -5.13 118.70 120.70 2joz s GLU 119 Ca 0.23 0.72 0.00 0.00 0.02 0.00 0.00 54.97 55.94 2joz s GLU 119 Cb -0.12 -0.06 0.00 0.00 0.10 0.00 0.00 34.13 34.05 2joz s GLU 119 CO -0.04 -0.28 0.00 -1.91 0.02 0.00 0.00 175.26 173.05 2joz n GLU 120 N 5.27 -1.70 -4.42 1.61 2.13 -1.26 -5.03 120.64 117.25 2joz n GLU 120 Ca -0.07 1.32 -0.19 0.00 0.66 0.00 0.00 57.16 58.87 2joz n GLU 120 Cb 0.50 -1.63 -0.15 0.00 0.27 0.00 0.00 31.44 30.43 2joz n GLU 120 CO 0.00 0.00 0.00 -1.59 -0.41 0.00 0.00 177.13 175.13 2joz s LYS 121 N -4.61 0.82 -0.06 5.31 -2.85 -1.26 -5.14 119.74 111.94 2joz s LYS 121 Ca 0.00 -0.35 0.05 0.00 -1.00 0.00 0.00 55.97 54.67 2joz s LYS 121 Cb 0.00 -0.79 -0.01 0.00 -2.06 0.00 0.00 37.83 34.97 2joz s LYS 121 CO 0.00 0.21 -0.23 0.34 0.10 0.00 0.00 175.35 175.76 2joz s ASP 122 N -0.20 2.89 -0.37 0.03 -1.08 -1.26 -5.11 116.67 111.57 2joz s ASP 122 Ca 0.03 -0.49 -0.03 0.00 -0.52 0.00 0.00 52.55 51.54 2joz s ASP 122 Cb -0.04 -0.91 0.09 0.00 -1.46 0.00 0.00 42.92 40.60 2joz s ASP 122 CO -0.00 0.21 0.14 -1.61 0.52 0.00 0.00 175.17 174.43 2joz s GLU 123 N -0.02 2.19 -0.28 4.34 2.02 -1.26 -5.05 118.70 120.64 2joz s GLU 123 Ca -0.07 -1.61 -0.00 0.00 0.02 0.00 0.00 54.97 53.31 2joz s GLU 123 Cb -0.14 -3.47 0.05 0.00 0.10 0.00 0.00 34.13 30.66 2joz s GLU 123 CO 0.04 -0.91 -0.05 0.21 0.02 0.00 0.00 175.26 174.57 2joz s LYS 124 N 1.20 2.46 -0.09 1.61 2.20 -1.26 -5.09 119.74 120.77 2joz s LYS 124 Ca 0.04 -1.23 -0.06 0.00 -0.36 0.00 0.00 55.97 54.36 2joz s LYS 124 Cb -0.22 -3.05 0.04 0.00 -1.51 0.00 0.00 37.83 33.09 2joz s LYS 124 CO -0.03 -0.56 0.23 -1.54 -0.36 0.00 0.00 175.35 173.10 2joz s SER 125 N 1.22 -0.24 -0.08 1.43 1.04 -1.26 -5.15 113.70 110.67 2joz s SER 125 Ca -0.05 0.48 -0.04 0.00 0.48 0.00 0.00 55.95 56.82 2joz s SER 125 Cb -0.19 0.41 0.04 0.00 0.10 0.00 0.00 66.02 66.38 2joz s SER 125 CO -0.03 -0.13 0.18 -0.54 0.98 0.00 0.00 173.24 173.70 2joz s LYS 126 N 0.80 0.14 -0.24 4.02 1.02 -1.26 -5.13 119.74 119.09 2joz s LYS 126 Ca -0.06 0.39 -0.03 0.00 0.02 0.00 0.00 55.97 56.30 2joz s LYS 126 Cb -0.07 -0.11 0.11 0.00 -0.52 0.00 0.00 37.83 37.23 2joz s LYS 126 CO -0.05 -0.14 0.23 -1.54 -0.92 0.00 0.00 175.35 172.93 2joz s SER 127 N 1.01 1.72 -0.29 2.83 1.04 -1.26 -5.12 113.70 113.63 2joz s SER 127 Ca -0.08 -0.50 -0.15 0.00 0.48 0.00 0.00 55.95 55.70 2joz s SER 127 Cb -0.09 0.33 0.15 0.00 0.10 0.00 0.00 66.02 66.51 2joz s SER 127 CO -0.06 -0.36 0.94 -0.22 0.98 0.00 0.00 173.24 174.53 2joz s LEU 128 N 2.31 -0.61 0.53 2.42 2.96 -1.26 -5.18 118.68 119.85 2joz s LEU 128 Ca 0.08 0.90 0.02 0.00 -0.22 0.00 0.00 54.13 54.91 2joz s LEU 128 Cb -0.15 1.78 0.01 0.00 0.50 0.00 0.00 46.19 48.33 2joz s LEU 128 CO -0.21 -0.13 0.13 -1.83 -1.32 0.00 0.00 176.35 172.99 2joz s GLU 129 N 1.94 2.23 0.04 1.98 4.04 -1.26 -5.16 118.70 122.50 2joz s GLU 129 Ca -0.06 -2.32 -0.10 0.00 0.04 0.00 0.00 54.97 52.53 2joz s GLU 129 Cb -0.05 -1.70 0.01 0.00 0.02 0.00 0.00 34.13 32.41 2joz s GLU 129 CO -0.17 -0.48 0.21 -3.38 -1.84 0.00 0.00 175.26 169.61 2joz s HIS 130 N -2.86 0.03 -0.01 4.83 -3.43 -1.26 -5.17 115.29 107.42 2joz s HIS 130 Ca 0.12 -0.22 0.04 0.00 -0.80 0.00 0.00 55.06 54.20 2joz s HIS 130 Cb -0.00 -0.01 -0.01 0.00 -1.43 0.00 0.00 32.58 31.13 2joz s HIS 130 CO 0.07 -0.43 -0.13 -1.01 -2.00 0.00 0.00 174.74 171.24 2joz s HIS 131 N -2.48 1.13 -0.20 0.38 3.76 -1.26 -5.12 115.29 111.50 2joz s HIS 131 Ca -0.06 -0.22 -0.04 0.00 -0.15 0.00 0.00 55.06 54.60 2joz s HIS 131 Cb -0.01 -0.73 0.09 0.00 1.11 0.00 0.00 32.58 33.04 2joz s HIS 131 CO -0.03 -0.02 0.24 -3.38 -0.85 0.00 0.00 174.74 170.70 2joz s HIS 132 N -0.32 -0.36 -0.17 1.40 -3.43 -1.26 -5.13 115.29 106.02 2joz s HIS 132 Ca 0.05 0.40 -0.25 0.00 -0.80 0.00 0.00 55.06 54.47 2joz s HIS 132 Cb -0.05 -0.27 -0.02 0.00 -1.43 0.00 0.00 32.58 30.81 2joz s HIS 132 CO -0.00 -0.58 0.80 -1.58 -2.00 0.00 0.00 174.74 171.38 2joz s HIS 133 N 2.37 3.41 -0.10 0.38 2.46 -1.26 -5.00 115.29 117.54 2joz s HIS 133 Ca 0.07 1.21 -0.29 0.00 0.47 0.00 0.00 55.06 56.51 2joz s HIS 133 Cb -0.15 -2.98 -0.04 0.00 -0.13 0.00 0.00 32.58 29.28 2joz s HIS 133 CO -0.12 -0.23 1.49 -1.58 -2.47 0.00 0.00 174.74 171.83 2joz s HIS 134 N 2.12 2.34 -2.26 3.88 2.46 -1.26 -5.38 115.29 117.19 2joz s HIS 134 Ca 0.37 0.53 0.30 0.00 0.47 0.00 0.00 55.06 56.73 2joz s HIS 134 Cb -0.16 -3.74 1.45 0.00 -0.13 0.00 0.00 32.58 30.00 2joz s HIS 134 CO 0.12 -2.96 1.97 0.72 -2.47 0.00 0.00 174.74 172.13