#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 4.37 0.00 1.12 -4.36 -1.26 -4.66 121.20 116.41 2joz s ILE 2 Ca 0.00 0.96 0.00 0.00 -0.26 0.00 0.00 60.65 61.35 2joz s ILE 2 Cb 0.00 -4.50 0.00 0.00 1.25 0.00 0.00 42.46 39.21 2joz s ILE 2 CO 0.00 -0.90 0.00 0.23 0.24 0.00 0.00 174.94 174.51 2joz n MET 3 N 7.43 0.00 -3.60 0.37 2.81 -1.26 -5.07 117.12 117.79 2joz n MET 3 Ca 0.09 0.00 -0.26 0.00 -1.81 0.00 0.00 57.70 55.71 2joz n MET 3 Cb 0.49 -0.19 0.05 0.00 -0.71 0.00 0.00 33.22 32.85 2joz n MET 3 CO 0.00 0.00 0.00 0.28 1.51 0.00 0.00 175.97 177.76 2joz n VAL 4 N -2.60 -6.29 -2.09 2.03 0.31 -1.26 -4.86 118.33 103.57 2joz n VAL 4 Ca 0.00 -0.97 -0.42 0.00 -0.01 0.00 0.00 64.34 62.94 2joz n VAL 4 Cb 0.16 -4.68 0.00 0.00 -0.91 0.00 0.00 33.84 28.41 2joz n VAL 4 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 2joz n SER 5 N -2.86 4.47 -4.68 4.52 3.41 -1.26 -4.96 113.62 112.26 2joz n SER 5 Ca -0.12 -2.95 -0.42 0.00 -0.26 0.00 0.00 58.87 55.11 2joz n SER 5 Cb 0.61 -1.60 -0.03 0.00 -0.26 0.00 0.00 64.21 62.94 2joz n SER 5 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2joz s GLY 6 N 2.43 1.66 0.07 5.00 0.00 -1.26 -4.92 107.32 110.29 2joz s GLY 6 Ca 0.45 0.96 -0.29 0.00 0.00 0.00 0.00 44.72 45.84 2joz s GLY 6 CO -0.04 2.79 1.62 0.00 0.00 0.00 0.00 173.10 177.47 2joz n GLN 8 N -5.31 -2.66 -3.19 0.00 7.27 -1.26 -5.06 117.38 107.17 2joz n GLN 8 Ca -0.11 1.94 0.01 0.00 0.07 0.00 0.00 57.00 58.91 2joz n GLN 8 Cb 0.24 -2.15 -0.01 0.00 2.41 0.00 0.00 30.24 30.73 2joz n GLN 8 CO 0.00 0.00 0.00 -1.14 0.07 0.00 0.00 177.06 175.99 2joz s GLN 9 N -3.54 0.63 -0.06 3.69 0.74 -1.26 -5.04 119.66 114.83 2joz s GLN 9 Ca 0.00 0.20 -0.07 0.00 0.05 0.00 0.00 55.36 55.54 2joz s GLN 9 Cb 0.00 0.12 -0.02 0.00 1.10 0.00 0.00 33.01 34.20 2joz s GLN 9 CO 0.00 -1.10 -0.13 0.94 -0.55 0.00 0.00 175.29 174.45 2joz n GLN 10 N 5.05 0.20 -3.25 1.67 -0.06 -1.26 -5.02 117.38 114.72 2joz n GLN 10 Ca 0.07 0.08 -0.02 0.00 -2.00 0.00 0.00 57.00 55.12 2joz n GLN 10 Cb 0.54 -0.79 -0.04 0.00 -4.06 0.00 0.00 30.24 25.88 2joz n GLN 10 CO 0.00 0.00 0.00 0.15 -0.20 0.00 0.00 177.06 177.01 2joz s LYS 11 N -1.86 0.46 0.00 3.69 1.02 -1.26 -5.06 119.74 116.74 2joz s LYS 11 Ca -0.11 0.75 0.00 0.00 0.02 0.00 0.00 55.97 56.63 2joz s LYS 11 Cb 0.02 0.05 0.00 0.00 -0.52 0.00 0.00 37.83 37.38 2joz s LYS 11 CO 0.16 -0.66 0.80 0.39 -0.92 0.00 0.00 175.35 175.12 2joz n GLU 12 N 5.40 0.84 -2.22 1.68 4.71 -1.26 -4.77 120.64 125.01 2joz n GLU 12 Ca -0.02 0.00 -0.38 0.00 -0.01 0.00 0.00 57.16 56.75 2joz n GLU 12 Cb 0.51 -1.11 -0.03 0.00 -1.01 0.00 0.00 31.44 29.79 2joz n GLU 12 CO 0.00 0.00 0.00 -1.21 0.09 0.00 0.00 177.13 176.01 2joz s GLU 13 N 0.06 2.84 -0.28 3.49 2.02 -1.26 -4.88 118.70 120.69 2joz s GLU 13 Ca 0.00 0.13 -0.24 0.00 0.02 0.00 0.00 54.97 54.89 2joz s GLU 13 Cb 0.00 -4.49 0.13 0.00 0.10 0.00 0.00 34.13 29.87 2joz s GLU 13 CO 0.00 -2.62 1.03 -0.08 0.02 0.00 0.00 175.26 173.61 2joz s THR 14 N 8.01 0.00 -1.12 3.63 -1.32 -1.26 -5.08 115.64 118.49 2joz s THR 14 Ca 0.57 0.00 -0.22 0.00 -1.21 0.00 0.00 61.69 60.83 2joz s THR 14 Cb -0.10 -1.00 -0.00 0.00 -1.51 0.00 0.00 72.50 69.89 2joz s THR 14 CO 0.14 0.00 1.78 -2.84 -2.21 0.00 0.00 174.62 171.49 2joz s PRO 15 N 0.39 3.17 0.52 7.08 0.02 -1.26 -4.79 135.00 140.13 2joz s PRO 15 Ca 0.02 -1.21 0.28 0.00 0.02 0.00 0.00 61.00 60.10 2joz s PRO 15 Cb -0.05 -5.32 1.44 0.00 0.02 0.00 0.00 34.50 30.60 2joz s PRO 15 CO -0.08 -2.98 2.06 0.27 -0.33 0.00 0.00 177.00 175.94 2joz h PHE 16 N 9.46 0.00 0.00 6.54 -0.00 -1.97 -2.42 116.94 128.55 2joz h PHE 16 Ca 0.25 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 58.22 2joz h PHE 16 Cb 0.95 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 36.90 2joz h PHE 16 CO 1.29 0.12 -0.23 0.10 -0.00 0.00 0.00 178.31 179.59 2joz h TYR 17 N 0.00 0.00 -3.70 6.09 -0.00 -2.01 -3.46 116.97 113.90 2joz h TYR 17 Ca -0.00 0.00 -0.50 0.00 -0.00 0.00 0.00 58.73 58.23 2joz h TYR 17 Cb 0.36 0.00 -0.02 0.00 -0.00 0.00 0.00 36.73 37.07 2joz h TYR 17 CO 0.00 0.00 0.35 -0.47 -0.00 0.00 0.00 178.16 178.04 2joz s TYR 18 N -3.23 3.94 -2.89 0.10 5.04 -0.91 -4.77 117.35 114.62 2joz s TYR 18 Ca 0.06 1.88 0.00 0.00 -2.44 0.00 0.00 57.07 56.57 2joz s TYR 18 Cb 0.07 -3.00 0.00 0.00 0.35 0.00 0.00 41.96 39.38 2joz s TYR 18 CO 0.69 0.39 0.00 0.41 -1.34 0.00 0.00 175.55 175.71 2joz n GLY 19 N 1.69 0.63 3.21 8.97 0.00 -1.26 -5.00 105.19 113.43 2joz n GLY 19 Ca -0.01 -1.88 -0.32 0.00 0.00 0.00 0.00 46.02 43.81 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 -2.11 2.11 -0.02 2.61 2.01 -1.26 -1.42 115.64 117.56 2joz s THR 20 Ca 0.00 -0.99 0.07 0.00 0.31 0.00 0.00 61.69 61.08 2joz s THR 20 Cb 0.00 -1.82 -0.02 0.00 0.01 0.00 0.00 72.50 70.67 2joz s THR 20 CO 0.00 0.55 -0.24 0.26 -0.69 0.00 0.00 174.62 174.51 2joz s TRP 21 N 0.49 2.14 -0.12 4.92 0.52 0.23 -1.99 118.94 125.14 2joz s TRP 21 Ca -0.15 -0.42 -0.03 0.00 0.02 0.00 0.00 56.10 55.53 2joz s TRP 21 Cb -0.17 -1.38 -0.03 0.00 -1.15 0.00 0.00 33.47 30.74 2joz s TRP 21 CO 0.05 -0.05 -0.02 0.34 0.02 0.00 0.00 176.95 177.30 2joz s ASP 22 N -0.53 5.02 0.21 2.95 -1.08 0.12 0.43 116.67 123.78 2joz s ASP 22 Ca 0.08 0.02 -0.09 0.00 -0.52 0.00 0.00 52.55 52.04 2joz s ASP 22 Cb -0.09 -1.58 0.28 0.00 -1.46 0.00 0.00 42.92 40.07 2joz s ASP 22 CO -0.01 0.29 1.75 -0.33 0.52 0.00 0.00 175.17 177.39 2joz h GLU 23 N 5.84 0.42 -1.71 4.34 5.08 -1.22 0.36 114.58 127.69 2joz h GLU 23 Ca -0.42 -0.03 -0.32 0.00 -1.00 0.00 0.00 59.36 57.59 2joz h GLU 23 Cb 1.19 -0.10 -0.10 0.00 0.50 0.00 0.00 28.75 30.24 2joz h GLU 23 CO 0.58 0.28 -0.31 0.41 -1.00 0.00 0.00 179.01 178.97 2joz n GLY 24 N -1.29 1.08 3.59 -3.84 0.00 -1.26 -3.71 105.19 99.76 2joz n GLY 24 Ca 0.09 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.02 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 -3.67 0.48 0.32 1.61 3.52 -1.26 -4.98 118.95 114.97 2joz s ARG 25 Ca 0.00 0.13 0.00 0.00 -0.13 0.00 0.00 55.73 55.73 2joz s ARG 25 Cb 0.00 0.23 0.00 0.00 -1.56 0.00 0.00 34.95 33.62 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 0.72 -1.54 -1.81 6.12 0.00 -1.26 -4.92 120.51 117.83 2joz n ALA 26 Ca -0.08 0.27 -0.33 0.00 0.00 0.00 0.00 53.44 53.29 2joz n ALA 26 Cb 0.58 -1.03 -0.05 0.00 0.00 0.00 0.00 19.45 18.95 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 -4.74 4.02 0.00 0.00 0.02 -1.26 -4.53 135.00 128.50 2joz s PRO 27 Ca 0.00 1.15 0.00 0.00 0.02 0.00 0.00 61.00 62.17 2joz s PRO 27 Cb 0.00 -2.14 0.00 0.00 0.02 0.00 0.00 34.50 32.38 2joz s PRO 27 CO 0.00 -0.22 0.00 0.41 -0.33 0.00 0.00 177.00 176.86 2joz n GLY 28 N -0.75 2.53 3.37 0.52 0.00 -1.09 -4.91 105.19 104.86 2joz n GLY 28 Ca 0.08 -2.11 -0.38 0.00 0.00 0.00 0.00 46.02 43.61 2joz n GLY 28 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2joz n PRO 29 N -0.55 0.29 0.00 1.61 -0.02 -1.26 -4.69 135.00 130.37 2joz n PRO 29 Ca 0.00 0.11 0.09 0.00 -2.02 0.00 0.00 63.50 61.68 2joz n PRO 29 Cb 0.00 -1.43 0.43 0.00 -0.02 0.00 0.00 33.50 32.48 2joz n PRO 29 CO 0.00 0.00 0.00 -2.37 1.98 0.00 0.00 175.50 175.11 2joz n THR 30 N -1.70 0.59 0.28 3.45 5.66 -1.26 -2.10 114.28 119.19 2joz n THR 30 Ca 0.10 0.15 0.08 0.00 -3.05 0.00 0.00 64.05 61.32 2joz n THR 30 Cb 0.48 -0.84 0.35 0.00 -1.55 0.00 0.00 70.33 68.77 2joz n THR 30 CO 0.00 0.00 0.00 0.47 -3.05 0.00 0.00 175.07 172.49 2joz n ASP 31 N -1.39 0.32 0.00 1.09 8.00 -1.26 -4.75 116.55 118.56 2joz n ASP 31 Ca 0.07 0.61 0.00 0.00 0.71 0.00 0.00 54.79 56.17 2joz n ASP 31 Cb 0.18 -0.66 0.00 0.00 -0.02 0.00 0.00 41.12 40.61 2joz n ASP 31 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2joz n GLY 32 N -0.64 0.98 3.64 0.44 0.00 -1.08 -5.09 105.19 103.45 2joz n GLY 32 Ca 0.01 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.69 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 -1.64 4.58 -0.00 1.61 1.01 -0.89 -4.15 120.40 120.91 2joz s VAL 33 Ca 0.00 -0.12 0.11 0.00 0.00 0.00 0.00 61.98 61.96 2joz s VAL 33 Cb 0.00 -3.01 -0.23 0.00 0.00 0.00 0.00 36.38 33.14 2joz s VAL 33 CO 0.00 0.52 0.81 0.11 0.00 0.00 0.00 175.10 176.54 2joz h LYS 34 N 6.16 0.01 -1.73 2.72 1.57 -1.84 -2.89 116.57 120.58 2joz h LYS 34 Ca -0.41 -0.02 0.34 0.00 -1.87 0.00 0.00 60.65 58.69 2joz h LYS 34 Cb 1.18 0.01 -0.10 0.00 0.08 0.00 0.00 32.23 33.40 2joz h LYS 34 CO 0.64 0.64 0.87 -1.54 -0.57 0.00 0.00 179.45 179.50 2joz s SER 35 N -6.28 -0.02 0.25 0.86 1.04 -1.26 -3.90 113.70 104.39 2joz s SER 35 Ca -0.04 -0.16 0.12 0.00 0.48 0.00 0.00 55.95 56.35 2joz s SER 35 Cb 0.08 0.14 -0.05 0.00 0.10 0.00 0.00 66.02 66.30 2joz s SER 35 CO 0.82 -0.28 -0.22 0.00 0.98 0.00 0.00 173.24 174.55 2joz s ALA 36 N -2.20 2.66 -0.12 5.32 0.00 -1.26 -2.40 121.76 123.76 2joz s ALA 36 Ca 0.21 -1.79 0.02 0.00 0.00 0.00 0.00 51.96 50.41 2joz s ALA 36 Cb 0.03 -0.29 -0.01 0.00 0.00 0.00 0.00 23.12 22.85 2joz s ALA 36 CO -0.03 0.34 -0.19 0.95 0.00 0.00 0.00 175.76 176.83 2joz s THR 37 N -2.18 2.50 -0.14 0.00 -4.23 0.15 -0.80 115.64 110.93 2joz s THR 37 Ca 0.26 -0.86 -0.01 0.00 -1.18 0.00 0.00 61.69 59.90 2joz s THR 37 Cb -0.06 -2.00 -0.02 0.00 1.34 0.00 0.00 72.50 71.76 2joz s THR 37 CO 0.13 0.54 -0.10 0.54 -0.54 0.00 0.00 174.62 175.19 2joz s VAL 38 N 0.39 3.31 -0.13 2.29 0.11 0.17 0.66 120.40 127.19 2joz s VAL 38 Ca -0.14 -0.57 -0.00 0.00 -2.93 0.00 0.00 61.98 58.34 2joz s VAL 38 Cb -0.17 -2.41 -0.01 0.00 -1.53 0.00 0.00 36.38 32.25 2joz s VAL 38 CO 0.07 0.51 -0.13 -0.89 -3.33 0.00 0.00 175.10 171.33 2joz s THR 39 N 0.41 3.04 -0.32 5.04 2.01 0.67 -0.60 115.64 125.89 2joz s THR 39 Ca -0.08 -0.67 -0.12 0.00 0.31 0.00 0.00 61.69 61.14 2joz s THR 39 Cb -0.15 -2.27 -0.02 0.00 0.01 0.00 0.00 72.50 70.06 2joz s THR 39 CO 0.04 0.53 0.21 -0.36 -0.69 0.00 0.00 174.62 174.35 2joz s PHE 40 N 0.34 3.21 0.49 4.92 0.40 -0.51 -0.86 117.98 125.97 2joz s PHE 40 Ca -0.11 -0.26 0.07 0.00 -0.60 0.00 0.00 56.93 56.03 2joz s PHE 40 Cb -0.16 -2.43 0.07 0.00 0.51 0.00 0.00 43.02 41.01 2joz s PHE 40 CO 0.06 -0.36 0.58 2.41 0.70 0.00 0.00 175.22 178.61 2joz n THR 41 N 5.06 0.00 -0.18 0.64 -1.04 0.65 -4.08 114.28 115.34 2joz n THR 41 Ca -0.13 -1.72 -0.03 0.00 -2.04 0.00 0.00 64.05 60.13 2joz n THR 41 Cb 0.50 -0.42 0.04 0.00 -1.82 0.00 0.00 70.33 68.62 2joz n THR 41 CO 0.00 0.00 0.00 -0.08 -0.64 0.00 0.00 175.07 174.35 2joz h GLU 42 N 0.00 -0.06 0.00 -2.82 4.81 -2.03 -3.30 114.58 111.18 2joz h GLU 42 Ca -0.25 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.98 2joz h GLU 42 Cb 1.07 0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.47 2joz h GLU 42 CO 0.38 -0.04 -0.03 -0.25 -0.73 0.00 0.00 179.01 178.34 2joz n ASP 43 N -5.42 0.20 -4.00 1.04 8.00 -1.26 -5.09 116.55 110.03 2joz n ASP 43 Ca 0.05 -1.16 -0.11 0.00 0.71 0.00 0.00 54.79 54.29 2joz n ASP 43 Cb 0.32 -0.01 -0.11 0.00 -0.02 0.00 0.00 41.12 41.29 2joz n ASP 43 CO 0.00 0.00 0.00 -1.83 -0.39 0.00 0.00 177.20 174.98 2joz s GLU 44 N -0.11 0.36 -0.18 -1.24 1.03 -1.24 -3.03 118.70 114.28 2joz s GLU 44 Ca 0.00 -0.60 -0.03 0.00 0.03 0.00 0.00 54.97 54.37 2joz s GLU 44 Cb 0.00 -0.02 -0.01 0.00 -0.80 0.00 0.00 34.13 33.29 2joz s GLU 44 CO 0.00 -0.01 -0.06 0.08 -1.33 0.00 0.00 175.26 173.93 2joz s VAL 45 N -1.31 3.43 -0.20 1.83 1.01 0.21 -0.25 120.40 125.12 2joz s VAL 45 Ca -0.13 -0.50 -0.05 0.00 0.00 0.00 0.00 61.98 61.30 2joz s VAL 45 Cb -0.09 -2.52 -0.02 0.00 0.00 0.00 0.00 36.38 33.75 2joz s VAL 45 CO -0.01 0.46 0.01 -0.69 0.00 0.00 0.00 175.10 174.88 2joz s VAL 46 N 0.92 3.99 -0.13 2.92 1.01 -0.04 -0.37 120.40 128.71 2joz s VAL 46 Ca -0.01 -0.30 -0.12 0.00 0.00 0.00 0.00 61.98 61.55 2joz s VAL 46 Cb -0.15 -2.81 -0.05 0.00 0.00 0.00 0.00 36.38 33.38 2joz s VAL 46 CO 0.01 0.42 0.25 -0.70 0.00 0.00 0.00 175.10 175.08 2joz s GLU 47 N 1.04 3.99 -0.05 2.72 2.12 -1.26 -0.24 118.70 127.02 2joz s GLU 47 Ca 0.02 0.05 0.05 0.00 0.36 0.00 0.00 54.97 55.45 2joz s GLU 47 Cb -0.14 -3.33 -0.00 0.00 0.26 0.00 0.00 34.13 30.91 2joz s GLU 47 CO 0.02 0.46 -0.19 0.99 -0.54 0.00 0.00 175.26 176.00 2joz s THR 48 N -0.18 1.54 -0.21 -1.70 2.01 0.21 -0.87 115.64 116.44 2joz s THR 48 Ca 0.16 -0.78 -0.10 0.00 0.31 0.00 0.00 61.69 61.28 2joz s THR 48 Cb -0.13 -1.32 -0.05 0.00 0.01 0.00 0.00 72.50 71.01 2joz s THR 48 CO 0.05 0.44 0.12 -1.61 -0.69 0.00 0.00 174.62 172.93 2joz s GLU 49 N -0.01 4.09 -0.38 4.92 2.02 0.49 0.33 118.70 130.16 2joz s GLU 49 Ca -0.04 -0.27 -0.16 0.00 0.02 0.00 0.00 54.97 54.52 2joz s GLU 49 Cb -0.12 -3.41 0.00 0.00 0.10 0.00 0.00 34.13 30.70 2joz s GLU 49 CO 0.02 0.20 0.39 0.08 0.02 0.00 0.00 175.26 175.97 2joz s VAL 50 N 0.64 5.14 -0.29 2.63 1.01 -1.01 -0.29 120.40 128.23 2joz s VAL 50 Ca 0.07 -0.14 0.03 0.00 0.00 0.00 0.00 61.98 61.93 2joz s VAL 50 Cb -0.12 -3.92 0.07 0.00 0.00 0.00 0.00 36.38 32.41 2joz s VAL 50 CO 0.01 -0.24 -0.05 -0.04 0.00 0.00 0.00 175.10 174.78 2joz s MET 51 N 2.06 2.06 -0.06 2.72 -1.94 -0.46 -2.78 119.30 120.89 2joz s MET 51 Ca 0.12 -1.49 -0.29 0.00 -1.71 0.00 0.00 55.69 52.32 2joz s MET 51 Cb -0.17 -3.02 -0.07 0.00 2.01 0.00 0.00 34.83 33.58 2joz s MET 51 CO 0.12 -0.68 1.96 -2.00 -0.01 0.00 0.00 175.02 174.41 2joz s GLU 52 N 1.07 3.87 0.00 2.03 2.12 -1.26 -0.29 118.70 126.24 2joz s GLU 52 Ca -0.03 2.33 0.00 0.00 0.36 0.00 0.00 54.97 57.63 2joz s GLU 52 Cb -0.20 -4.18 0.00 0.00 0.26 0.00 0.00 34.13 30.01 2joz s GLU 52 CO -0.05 -1.26 0.00 0.41 -0.54 0.00 0.00 175.26 173.82 2joz n GLY 53 N 4.80 2.01 0.07 -1.50 0.00 -1.26 -4.87 105.19 104.44 2joz n GLY 53 Ca 0.22 -0.69 -0.07 0.00 0.00 0.00 0.00 46.02 45.48 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 0.00 0.41 0.00 1.61 5.12 -0.11 -5.14 116.66 118.54 2joz n ARG 54 Ca 0.00 0.18 0.00 0.00 -1.93 0.00 0.00 57.85 56.10 2joz n ARG 54 Cb 0.00 -1.23 0.00 0.00 -1.16 0.00 0.00 32.46 30.07 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 1.48 0.79 3.69 -0.13 0.00 0.61 -5.01 105.19 106.62 2joz n GLY 55 Ca -0.11 -2.03 -0.42 0.00 0.00 0.00 0.00 46.02 43.46 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 -1.32 4.47 -0.22 1.61 8.01 -1.26 -1.36 118.70 128.63 2joz s GLU 56 Ca 0.00 1.39 -0.04 0.00 0.01 0.00 0.00 54.97 56.33 2joz s GLU 56 Cb 0.00 -3.51 -0.01 0.00 -4.31 0.00 0.00 34.13 26.29 2joz s GLU 56 CO 0.00 -0.22 -0.02 0.08 0.01 0.00 0.00 175.26 175.11 2joz s VAL 57 N 1.66 3.60 0.01 2.63 1.01 0.61 -4.91 120.40 125.01 2joz s VAL 57 Ca 0.49 -0.42 -0.30 0.00 0.00 0.00 0.00 61.98 61.76 2joz s VAL 57 Cb -0.19 -2.64 -0.03 0.00 0.00 0.00 0.00 36.38 33.52 2joz s VAL 57 CO 0.21 0.42 0.96 -1.10 0.00 0.00 0.00 175.10 175.59 2joz s GLN 58 N 1.33 4.57 0.47 2.72 -0.21 -1.26 -0.38 119.66 126.90 2joz s GLN 58 Ca 0.04 1.39 -0.01 0.00 0.02 0.00 0.00 55.36 56.80 2joz s GLN 58 Cb -0.14 -3.45 -0.01 0.00 1.00 0.00 0.00 33.01 30.41 2joz s GLN 58 CO -0.01 -0.01 0.71 -0.51 -2.12 0.00 0.00 175.29 173.35 2joz s LEU 59 N 0.88 3.60 -0.07 2.90 1.43 -0.05 -4.97 118.68 122.41 2joz s LEU 59 Ca 0.51 0.41 -0.38 0.00 -1.03 0.00 0.00 54.13 53.64 2joz s LEU 59 Cb -0.21 -3.29 -0.16 0.00 0.03 0.00 0.00 46.19 42.57 2joz s LEU 59 CO 0.28 -0.72 1.57 -2.65 0.23 0.00 0.00 176.35 175.05 2joz n PRO 60 N -2.15 1.33 -1.80 1.29 -0.02 -1.26 -4.55 135.00 127.83 2joz n PRO 60 Ca 0.01 0.48 -0.41 0.00 -2.02 0.00 0.00 63.50 61.57 2joz n PRO 60 Cb 0.57 -2.17 -0.01 0.00 -0.02 0.00 0.00 33.50 31.87 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 2.05 2.68 -0.22 6.00 -0.71 -1.26 -4.71 117.98 121.81 2joz s PHE 61 Ca 0.90 0.98 -0.06 0.00 -1.04 0.00 0.00 56.93 57.72 2joz s PHE 61 Cb -0.95 -4.03 -0.02 0.00 -1.21 0.00 0.00 43.02 36.80 2joz s PHE 61 CO 0.54 -3.25 0.02 -1.64 -1.34 0.00 0.00 175.22 169.55 2joz s MET 62 N -1.29 3.60 0.45 1.99 -1.94 0.50 -4.93 119.30 117.67 2joz s MET 62 Ca 0.58 -0.52 -0.22 0.00 -1.71 0.00 0.00 55.69 53.82 2joz s MET 62 Cb -0.47 -3.17 -0.08 0.00 2.01 0.00 0.00 34.83 33.12 2joz s MET 62 CO 0.55 -0.10 1.06 0.00 -0.01 0.00 0.00 175.02 176.52 2joz s ALA 63 N 1.33 2.95 0.01 3.03 0.00 -1.26 0.68 121.76 128.50 2joz s ALA 63 Ca 0.04 0.68 -0.10 0.00 0.00 0.00 0.00 51.96 52.58 2joz s ALA 63 Cb -0.15 -3.28 0.01 0.00 0.00 0.00 0.00 23.12 19.71 2joz s ALA 63 CO 0.02 -0.33 0.21 1.52 0.00 0.00 0.00 175.76 177.18 2joz s TYR 64 N -1.81 -0.02 0.23 0.00 1.13 -1.17 -3.94 117.35 111.77 2joz s TYR 64 Ca 0.64 -0.05 0.10 0.00 -1.41 0.00 0.00 57.07 56.34 2joz s TYR 64 Cb -0.20 0.00 -0.05 0.00 -1.10 0.00 0.00 41.96 40.62 2joz s TYR 64 CO 0.24 -0.36 -0.18 -1.59 -2.51 0.00 0.00 175.55 171.15 2joz s LYS 65 N -1.72 1.48 -0.39 -3.49 0.00 0.10 -4.79 119.74 110.93 2joz s LYS 65 Ca -0.12 -1.63 -0.17 0.00 0.00 0.00 0.00 55.97 54.06 2joz s LYS 65 Cb -0.05 -1.46 0.01 0.00 0.00 0.00 0.00 37.83 36.33 2joz s LYS 65 CO 0.01 0.27 0.41 0.08 0.00 0.00 0.00 175.35 176.12 2joz s VAL 66 N -2.57 5.11 -0.09 1.79 1.01 -1.26 -0.73 120.40 123.66 2joz s VAL 66 Ca 0.24 -0.15 -0.19 0.00 0.00 0.00 0.00 61.98 61.88 2joz s VAL 66 Cb -0.04 -3.95 -0.16 0.00 0.00 0.00 0.00 36.38 32.23 2joz s VAL 66 CO 0.10 -0.28 0.65 0.40 0.00 0.00 0.00 175.10 175.97 2joz h ILE 67 N 5.65 0.99 -3.92 2.22 2.04 -0.88 -3.47 117.51 120.14 2joz h ILE 67 Ca -0.28 -1.51 -0.33 0.00 1.00 0.00 0.00 64.86 63.74 2joz h ILE 67 Cb 1.12 1.79 -0.21 0.00 -0.74 0.00 0.00 36.82 38.79 2joz h ILE 67 CO 0.76 0.30 -0.75 -0.44 0.00 0.00 0.00 178.15 178.02 2joz s SER 68 N -5.75 1.26 -0.05 1.72 0.01 -0.88 -4.99 113.70 105.02 2joz s SER 68 Ca -0.12 -0.63 -0.02 0.00 1.31 0.00 0.00 55.95 56.49 2joz s SER 68 Cb -0.01 0.00 0.03 0.00 0.21 0.00 0.00 66.02 66.25 2joz s SER 68 CO 0.44 -0.17 0.11 -1.58 0.41 0.00 0.00 173.24 172.46 2joz s GLN 69 N -1.88 0.07 -0.26 12.44 0.74 -1.26 -0.37 119.66 129.14 2joz s GLN 69 Ca -0.04 0.29 -0.03 0.00 0.05 0.00 0.00 55.36 55.63 2joz s GLN 69 Cb -0.09 -0.15 0.15 0.00 1.10 0.00 0.00 33.01 34.03 2joz s GLN 69 CO 0.01 -0.14 0.48 0.45 -0.55 0.00 0.00 175.29 175.55 2joz s SER 70 N 0.94 -0.52 0.06 6.67 0.15 -0.57 -4.98 113.70 115.44 2joz s SER 70 Ca -0.07 0.64 0.16 0.00 0.70 0.00 0.00 55.95 57.38 2joz s SER 70 Cb -0.10 1.62 0.69 0.00 -1.71 0.00 0.00 66.02 66.53 2joz s SER 70 CO -0.04 -0.27 1.52 0.35 1.20 0.00 0.00 173.24 175.99 2joz n THR 71 N 5.40 0.97 0.08 6.45 -2.24 -1.26 -2.37 114.28 121.31 2joz n THR 71 Ca -0.04 0.25 -0.09 0.00 -2.27 0.00 0.00 64.05 61.90 2joz n THR 71 Cb 0.50 -1.04 -0.06 0.00 -2.10 0.00 0.00 70.33 67.63 2joz n THR 71 CO 0.00 0.00 0.00 -0.78 -0.57 0.00 0.00 175.07 173.72 2joz h ASP 72 N 0.00 -0.24 0.00 3.42 3.58 -1.93 -3.45 116.42 117.79 2joz h ASP 72 Ca 0.00 -0.24 0.00 0.00 0.42 0.00 0.00 57.03 57.21 2joz h ASP 72 Cb 0.27 0.06 0.00 0.00 1.72 0.00 0.00 39.33 41.39 2joz h ASP 72 CO 0.00 0.28 -0.68 0.61 -2.88 0.00 0.00 179.24 176.57 2joz n GLY 73 N 0.64 0.00 3.48 -0.78 0.00 -1.20 -4.96 105.19 102.37 2joz n GLY 73 Ca -0.07 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.81 2joz n GLY 73 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2joz s SER 74 N -4.68 -0.57 -0.03 1.61 0.15 -1.00 -3.40 113.70 105.78 2joz s SER 74 Ca 0.00 0.30 0.05 0.00 0.70 0.00 0.00 55.95 57.00 2joz s SER 74 Cb 0.00 0.54 -0.01 0.00 -1.71 0.00 0.00 66.02 64.84 2joz s SER 74 CO 0.00 -0.76 -0.17 -0.63 1.20 0.00 0.00 173.24 172.88 2joz s ILE 75 N -2.55 1.41 -0.16 6.45 1.01 0.29 -1.52 121.20 126.14 2joz s ILE 75 Ca -0.03 -0.73 0.01 0.00 0.00 0.00 0.00 60.65 59.89 2joz s ILE 75 Cb -0.01 -1.19 0.00 0.00 0.01 0.00 0.00 42.46 41.27 2joz s ILE 75 CO -0.03 0.40 -0.17 -0.70 0.00 0.00 0.00 174.94 174.44 2joz s GLU 76 N -0.18 3.15 0.14 2.79 2.12 0.50 -0.50 118.70 126.72 2joz s GLU 76 Ca 0.01 -0.78 0.06 0.00 0.36 0.00 0.00 54.97 54.62 2joz s GLU 76 Cb -0.09 -2.59 -0.04 0.00 0.26 0.00 0.00 34.13 31.67 2joz s GLU 76 CO 0.01 -0.02 -0.12 0.96 -0.54 0.00 0.00 175.26 175.54 2joz s ILE 77 N 0.89 1.31 -0.03 -3.70 -4.36 0.09 -0.15 121.20 115.24 2joz s ILE 77 Ca -0.04 -1.91 0.03 0.00 -0.26 0.00 0.00 60.65 58.46 2joz s ILE 77 Cb -0.15 -1.71 0.00 0.00 1.25 0.00 0.00 42.46 41.85 2joz s ILE 77 CO -0.02 -0.57 -0.10 -1.58 0.24 0.00 0.00 174.94 172.91 2joz s GLN 78 N -3.22 1.05 0.00 0.37 0.74 0.09 0.25 119.66 118.94 2joz s GLN 78 Ca 0.14 -0.33 0.21 0.00 0.05 0.00 0.00 55.36 55.43 2joz s GLN 78 Cb -0.01 -0.96 1.10 0.00 1.10 0.00 0.00 33.01 34.23 2joz s GLN 78 CO 0.03 0.12 1.73 0.66 -0.55 0.00 0.00 175.29 177.27 2joz n TYR 79 N 3.30 0.05 -3.07 1.67 4.01 -1.25 -0.72 117.16 121.15 2joz n TYR 79 Ca -0.18 -0.03 0.00 0.00 -0.16 0.00 0.00 57.90 57.53 2joz n TYR 79 Cb 0.54 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.57 2joz n TYR 79 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 2joz n LEU 80 N -0.49 0.00 0.00 7.72 4.77 -1.25 -4.38 117.00 123.37 2joz n LEU 80 Ca 0.16 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.14 2joz n LEU 80 Cb 0.15 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.24 2joz n LEU 80 CO 0.12 -0.46 0.00 0.61 -1.33 0.00 0.00 177.39 176.33 2joz n GLY 81 N 0.00 0.91 0.00 -0.72 0.00 -1.26 -1.49 105.19 102.62 2joz n GLY 81 Ca 0.00 -0.68 0.06 0.00 0.00 0.00 0.00 46.02 45.40 2joz n GLY 81 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2joz n PRO 82 N 0.00 0.05 -0.56 1.61 -0.04 -1.26 -2.19 135.00 132.62 2joz n PRO 82 Ca 0.00 0.26 0.08 0.00 -0.04 0.00 0.00 63.50 63.80 2joz n PRO 82 Cb 0.00 -1.50 0.31 0.00 -0.04 0.00 0.00 33.50 32.27 2joz n PRO 82 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2joz n TYR 83 N -1.44 1.34 -0.74 0.54 4.01 -0.56 -4.96 117.16 115.35 2joz n TYR 83 Ca 0.04 -0.52 -0.30 0.00 -0.16 0.00 0.00 57.90 56.95 2joz n TYR 83 Cb 0.13 -0.24 0.26 0.00 -0.31 0.00 0.00 39.34 39.18 2joz n TYR 83 CO 0.00 0.00 0.00 1.52 -0.46 0.00 0.00 176.86 177.92 2joz s TYR 84 N -1.86 -0.03 0.00 -0.72 1.13 -0.72 -2.51 117.35 112.63 2joz s TYR 84 Ca 0.44 0.54 0.00 0.00 -1.41 0.00 0.00 57.07 56.65 2joz s TYR 84 Cb 0.29 -3.19 0.00 0.00 -1.10 0.00 0.00 41.96 37.96 2joz s TYR 84 CO 0.21 -4.41 0.00 -2.30 -2.51 0.00 0.00 175.55 166.54 2joz n PRO 85 N -5.18 0.00 -2.48 -3.49 -0.02 -1.26 -4.83 135.00 117.75 2joz n PRO 85 Ca 0.13 0.00 -0.41 0.00 -2.02 0.00 0.00 63.50 61.19 2joz n PRO 85 Cb 0.60 0.00 -0.03 0.00 -0.02 0.00 0.00 33.50 34.05 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 3.35 0.45 2.45 2.96 -1.04 -4.99 118.68 121.85 2joz s LEU 86 Ca 0.00 0.04 0.08 0.00 -0.22 0.00 0.00 54.13 54.03 2joz s LEU 86 Cb 0.00 -2.93 0.01 0.00 0.50 0.00 0.00 46.19 43.77 2joz s LEU 86 CO 0.00 -1.71 0.50 -1.59 -1.32 0.00 0.00 176.35 172.24 2joz s LYS 87 N 5.47 2.57 0.05 1.98 -2.85 -1.26 -3.87 119.74 121.83 2joz s LYS 87 Ca 0.46 -1.50 0.04 0.00 -1.00 0.00 0.00 55.97 53.96 2joz s LYS 87 Cb -0.09 -2.51 -0.02 0.00 -2.06 0.00 0.00 37.83 33.14 2joz s LYS 87 CO 0.22 -0.36 -0.12 0.45 0.10 0.00 0.00 175.35 175.65 2joz s SER 88 N -4.30 1.37 0.03 0.03 0.15 0.14 -3.85 113.70 107.28 2joz s SER 88 Ca 0.51 -0.53 0.07 0.00 0.70 0.00 0.00 55.95 56.71 2joz s SER 88 Cb -0.06 -0.04 -0.02 0.00 -1.71 0.00 0.00 66.02 64.19 2joz s SER 88 CO 0.31 -0.08 -0.21 -0.89 1.20 0.00 0.00 173.24 173.56 2joz s THR 89 N -1.13 1.72 -0.10 6.45 2.01 0.15 -0.73 115.64 124.01 2joz s THR 89 Ca -0.03 -1.15 0.01 0.00 0.31 0.00 0.00 61.69 60.83 2joz s THR 89 Cb -0.09 -1.47 0.02 0.00 0.01 0.00 0.00 72.50 70.97 2joz s THR 89 CO 0.01 0.29 -0.11 -0.76 -0.69 0.00 0.00 174.62 173.36 2joz s LEU 90 N -1.02 1.47 0.24 4.42 1.43 0.35 0.29 118.68 125.86 2joz s LEU 90 Ca 0.08 -0.34 0.09 0.00 -1.03 0.00 0.00 54.13 52.93 2joz s LEU 90 Cb -0.09 -0.92 -0.05 0.00 0.03 0.00 0.00 46.19 45.17 2joz s LEU 90 CO 0.01 -0.04 -0.16 -0.54 0.23 0.00 0.00 176.35 175.85 2joz s LYS 91 N 1.25 1.49 0.32 1.70 1.02 -0.48 -0.55 119.74 124.50 2joz s LYS 91 Ca -0.03 -1.68 -0.25 0.00 0.02 0.00 0.00 55.97 54.03 2joz s LYS 91 Cb -0.14 -1.40 -0.10 0.00 -0.52 0.00 0.00 37.83 35.67 2joz s LYS 91 CO -0.04 0.24 0.93 -0.98 -0.92 0.00 0.00 175.35 174.58 2joz s ARG 92 N -3.59 4.54 0.34 1.68 1.70 -1.22 0.32 118.95 122.72 2joz s ARG 92 Ca 0.26 1.29 0.05 0.00 -0.47 0.00 0.00 55.73 56.86 2joz s ARG 92 Cb -0.02 -2.77 0.06 0.00 -0.57 0.00 0.00 34.95 31.65 2joz s ARG 92 CO 0.11 0.27 0.47 0.41 -1.08 0.00 0.00 175.30 175.48 2joz n GLY 93 N 0.50 1.82 0.08 3.88 0.00 0.13 -4.73 105.19 106.87 2joz n GLY 93 Ca 0.02 -2.17 -0.09 0.00 0.00 0.00 0.00 46.02 43.78 2joz n GLY 93 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2joz n GLU 94 N -1.76 0.64 -1.00 1.61 0.00 -1.26 -3.89 120.64 114.98 2joz n GLU 94 Ca 0.09 0.26 -0.08 0.00 0.00 0.00 0.00 57.16 57.43 2joz n GLU 94 Cb 0.34 -1.76 0.27 0.00 0.00 0.00 0.00 31.44 30.29 2joz n GLU 94 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 2joz n ASN 95 N -3.01 4.28 -1.27 -1.84 3.02 -1.26 -4.84 115.26 110.33 2joz n ASN 95 Ca -0.19 -3.36 -0.07 0.00 -0.03 0.00 0.00 54.58 50.93 2joz n ASN 95 Cb 1.07 -0.74 0.02 0.00 -0.61 0.00 0.00 39.78 39.51 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 -0.51 0.41 3.94 7.41 0.00 -1.25 -5.03 105.19 110.16 2joz n GLY 96 Ca 0.43 -0.45 -0.22 0.00 0.00 0.00 0.00 46.02 45.78 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 -2.91 2.28 -0.06 2.61 -4.23 -1.26 -4.67 115.64 107.40 2joz s THR 97 Ca 0.14 -1.26 0.05 0.00 -1.18 0.00 0.00 61.69 59.44 2joz s THR 97 Cb -0.06 -2.54 -0.00 0.00 1.34 0.00 0.00 72.50 71.23 2joz s THR 97 CO 0.17 0.00 -0.21 -0.22 -0.54 0.00 0.00 174.62 173.82 2joz s LEU 98 N -4.33 1.98 -0.42 4.79 2.96 -0.96 0.19 118.68 122.89 2joz s LEU 98 Ca 0.48 -0.44 -0.17 0.00 -0.22 0.00 0.00 54.13 53.78 2joz s LEU 98 Cb -0.04 -1.19 0.02 0.00 0.50 0.00 0.00 46.19 45.48 2joz s LEU 98 CO 0.29 0.18 0.42 -0.63 -1.32 0.00 0.00 176.35 175.29 2joz s ILE 99 N 0.09 5.10 -0.37 6.68 1.01 0.15 -0.94 121.20 132.92 2joz s ILE 99 Ca -0.08 -0.35 -0.15 0.00 0.00 0.00 0.00 60.65 60.07 2joz s ILE 99 Cb -0.14 -4.02 -0.00 0.00 0.01 0.00 0.00 42.46 38.31 2joz s ILE 99 CO 0.04 -0.40 0.33 0.86 0.00 0.00 0.00 174.94 175.77 2joz s TRP 100 N 2.10 3.21 -0.13 3.97 -0.00 0.19 -1.38 118.94 126.90 2joz s TRP 100 Ca 0.12 -0.25 -0.02 0.00 -0.00 0.00 0.00 56.10 55.95 2joz s TRP 100 Cb -0.17 -2.65 -0.02 0.00 -0.00 0.00 0.00 33.47 30.62 2joz s TRP 100 CO 0.13 -0.50 -0.07 -1.21 -0.00 0.00 0.00 176.95 175.30 2joz s GLU 101 N 1.90 3.40 -0.21 5.86 2.02 0.15 -0.36 118.70 131.46 2joz s GLU 101 Ca 0.09 -0.58 -0.06 0.00 0.02 0.00 0.00 54.97 54.44 2joz s GLU 101 Cb -0.17 -2.76 0.10 0.00 0.10 0.00 0.00 34.13 31.39 2joz s GLU 101 CO 0.11 0.32 0.42 -1.14 0.02 0.00 0.00 175.26 174.99 2joz s GLN 102 N 0.12 0.33 -1.65 1.61 -0.44 -0.28 0.35 119.66 119.69 2joz s GLN 102 Ca -0.03 0.96 0.00 0.00 -2.50 0.00 0.00 55.36 53.79 2joz s GLN 102 Cb -0.14 0.21 0.00 0.00 -1.64 0.00 0.00 33.01 31.44 2joz s GLN 102 CO 0.03 -0.32 0.00 -1.71 0.50 0.00 0.00 175.29 173.79 2joz n ASN 103 N 5.39 -5.01 0.00 6.67 5.15 -1.25 -0.58 115.26 125.63 2joz n ASN 103 Ca -0.08 0.24 0.00 0.00 -0.60 0.00 0.00 54.58 54.15 2joz n ASN 103 Cb 0.50 -4.04 0.00 0.00 -0.53 0.00 0.00 39.78 35.71 2joz n ASN 103 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2joz n GLY 104 N -0.95 2.38 3.75 8.20 0.00 -1.26 -5.08 105.19 112.24 2joz n GLY 104 Ca -0.18 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.46 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 -0.59 4.23 -0.31 1.61 -0.21 0.25 -5.06 119.66 119.58 2joz s GLN 105 Ca 0.00 0.42 -0.10 0.00 0.02 0.00 0.00 55.36 55.70 2joz s GLN 105 Cb 0.00 -3.37 -0.01 0.00 1.00 0.00 0.00 33.01 30.62 2joz s GLN 105 CO 0.00 0.32 0.16 0.50 -2.12 0.00 0.00 175.29 174.15 2joz s ARG 106 N 0.11 3.44 -0.15 2.91 3.52 -1.26 -1.13 118.95 126.39 2joz s ARG 106 Ca 0.25 -0.65 -0.00 0.00 -0.13 0.00 0.00 55.73 55.19 2joz s ARG 106 Cb -0.15 -3.58 0.03 0.00 -1.56 0.00 0.00 34.95 29.69 2joz s ARG 106 CO 0.11 -0.38 -0.09 0.15 -0.81 0.00 0.00 175.30 174.28 2joz s LYS 107 N 1.64 1.81 -0.36 5.12 1.02 0.51 -4.99 119.74 124.48 2joz s LYS 107 Ca 0.05 -0.51 -0.19 0.00 0.02 0.00 0.00 55.97 55.34 2joz s LYS 107 Cb -0.17 -1.99 0.00 0.00 -0.52 0.00 0.00 37.83 35.15 2joz s LYS 107 CO 0.07 -0.33 0.54 0.99 -0.92 0.00 0.00 175.35 175.70 2joz s THR 108 N 1.57 4.98 0.26 2.17 2.01 -1.26 0.55 115.64 125.92 2joz s THR 108 Ca 0.03 0.33 0.09 0.00 0.31 0.00 0.00 61.69 62.45 2joz s THR 108 Cb -0.14 -4.01 -0.04 0.00 0.01 0.00 0.00 72.50 68.32 2joz s THR 108 CO -0.09 -0.28 0.01 0.00 -0.69 0.00 0.00 174.62 173.58 2joz s MET 109 N 2.48 2.35 0.14 4.92 0.23 -0.12 -4.79 119.30 124.52 2joz s MET 109 Ca 0.20 -1.37 0.04 0.00 -1.03 0.00 0.00 55.69 53.53 2joz s MET 109 Cb -0.15 -2.21 -0.04 0.00 -1.53 0.00 0.00 34.83 30.90 2joz s MET 109 CO 0.14 0.37 0.15 0.99 -2.03 0.00 0.00 175.02 174.65 2joz s THR 110 N -2.28 4.68 0.48 3.16 2.01 0.11 -2.26 115.64 121.56 2joz s THR 110 Ca 0.31 -0.92 -0.04 0.00 0.31 0.00 0.00 61.69 61.35 2joz s THR 110 Cb -0.07 -3.36 -0.03 0.00 0.01 0.00 0.00 72.50 69.05 2joz s THR 110 CO 0.20 -0.05 0.77 0.00 -0.69 0.00 0.00 174.62 174.86 2joz s ARG 111 N -2.96 3.39 0.19 4.92 1.70 -1.26 -0.71 118.95 124.22 2joz s ARG 111 Ca 0.31 0.06 -0.04 0.00 -0.47 0.00 0.00 55.73 55.59 2joz s ARG 111 Cb -0.11 -2.40 -0.05 0.00 -0.57 0.00 0.00 34.95 31.82 2joz s ARG 111 CO 0.24 -0.26 0.42 0.42 -1.08 0.00 0.00 175.30 175.04 2joz s ILE 112 N -2.73 5.13 -0.53 4.99 -1.09 -0.84 -4.76 121.20 121.37 2joz s ILE 112 Ca 0.48 -0.02 -0.28 0.00 -2.23 0.00 0.00 60.65 58.60 2joz s ILE 112 Cb -0.10 -3.67 0.00 0.00 -1.58 0.00 0.00 42.46 37.11 2joz s ILE 112 CO 0.44 -0.08 1.55 -1.61 -1.23 0.00 0.00 174.94 174.00 2joz s GLU 113 N -2.98 3.20 -0.04 2.79 8.01 -1.26 -4.91 118.70 123.50 2joz s GLU 113 Ca 0.41 0.65 -0.02 0.00 0.01 0.00 0.00 54.97 56.03 2joz s GLU 113 Cb -0.12 -4.18 0.03 0.00 -4.31 0.00 0.00 34.13 25.55 2joz s GLU 113 CO 0.26 -2.05 0.09 -1.12 0.01 0.00 0.00 175.26 172.45 2joz s SER 114 N 5.32 -0.04 -0.47 -0.19 0.01 -1.26 -5.07 113.70 112.00 2joz s SER 114 Ca 0.59 0.18 0.06 0.00 1.31 0.00 0.00 55.95 58.09 2joz s SER 114 Cb -0.13 0.09 0.22 0.00 0.21 0.00 0.00 66.02 66.41 2joz s SER 114 CO 0.26 -0.11 0.50 0.29 0.41 0.00 0.00 173.24 174.59 2joz n LYS 115 N 3.93 0.99 -3.68 12.44 4.76 -1.26 -5.08 118.16 130.26 2joz n LYS 115 Ca -0.24 -3.59 -0.09 0.00 -2.87 0.00 0.00 58.31 51.53 2joz n LYS 115 Cb 0.53 -1.63 -0.10 0.00 -1.84 0.00 0.00 35.03 31.99 2joz n LYS 115 CO 0.00 0.00 0.00 0.99 -1.37 0.00 0.00 177.40 177.02 2joz s THR 116 N -1.08 -0.13 0.00 -0.18 2.01 -1.26 -5.07 115.64 109.94 2joz s THR 116 Ca 0.34 0.08 0.00 0.00 0.31 0.00 0.00 61.69 62.42 2joz s THR 116 Cb 0.11 -0.72 0.00 0.00 0.01 0.00 0.00 72.50 71.89 2joz s THR 116 CO -0.13 0.03 0.00 0.61 -0.69 0.00 0.00 174.62 174.45 2joz n GLY 117 N 4.45 -1.81 0.90 4.40 0.00 -1.26 -5.04 105.19 106.84 2joz n GLY 117 Ca -0.20 0.75 0.01 0.00 0.00 0.00 0.00 46.02 46.57 2joz n GLY 117 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2joz n ARG 118 N 0.00 1.83 -2.48 1.61 0.63 -1.26 -4.97 116.66 112.01 2joz n ARG 118 Ca 0.00 -3.14 -0.41 0.00 -0.92 0.00 0.00 57.85 53.38 2joz n ARG 118 Cb 0.00 -1.74 -0.03 0.00 0.45 0.00 0.00 32.46 31.14 2joz n ARG 118 CO 0.00 0.00 0.00 -2.00 -2.51 0.00 0.00 177.63 173.12 2joz s GLU 119 N -3.18 3.29 -0.14 -0.14 -6.30 -1.26 -4.98 118.70 105.99 2joz s GLU 119 Ca 0.42 0.17 0.01 0.00 -2.50 0.00 0.00 54.97 53.07 2joz s GLU 119 Cb 0.38 -4.13 -0.00 0.00 0.00 0.00 0.00 34.13 30.38 2joz s GLU 119 CO -0.01 -1.98 -0.17 -1.21 0.02 0.00 0.00 175.26 171.91 2joz s GLU 120 N 5.51 3.18 0.25 4.30 2.02 -1.26 -5.12 118.70 127.58 2joz s GLU 120 Ca 0.45 -0.78 0.08 0.00 0.02 0.00 0.00 54.97 54.74 2joz s GLU 120 Cb -0.09 -2.54 -0.05 0.00 0.10 0.00 0.00 34.13 31.55 2joz s GLU 120 CO 0.22 0.07 -0.11 -1.59 0.02 0.00 0.00 175.26 173.86 2joz s LYS 121 N 0.67 1.49 0.23 1.61 -2.85 -1.26 -5.14 119.74 114.49 2joz s LYS 121 Ca -0.09 -1.71 -0.15 0.00 -1.00 0.00 0.00 55.97 53.02 2joz s LYS 121 Cb -0.16 -1.23 -0.08 0.00 -2.06 0.00 0.00 37.83 34.30 2joz s LYS 121 CO 0.02 0.13 0.64 -0.51 0.10 0.00 0.00 175.35 175.74 2joz s ASP 122 N -3.41 6.84 0.02 0.03 1.11 -1.26 -5.09 116.67 114.92 2joz s ASP 122 Ca 0.27 1.20 0.01 0.00 0.18 0.00 0.00 52.55 54.21 2joz s ASP 122 Cb 0.01 -2.33 -0.01 0.00 1.07 0.00 0.00 42.92 41.65 2joz s ASP 122 CO 0.10 -0.02 -0.05 -1.61 1.18 0.00 0.00 175.17 174.77 2joz s GLU 123 N -2.37 0.38 -0.65 8.23 2.02 -1.26 -5.09 118.70 119.96 2joz s GLU 123 Ca 0.45 -0.45 -0.01 0.00 0.02 0.00 0.00 54.97 54.98 2joz s GLU 123 Cb -0.14 -0.22 0.16 0.00 0.10 0.00 0.00 34.13 34.04 2joz s GLU 123 CO 0.20 0.05 0.46 0.15 0.02 0.00 0.00 175.26 176.13 2joz s LYS 124 N -0.89 2.56 -0.68 1.61 1.02 -1.26 -5.04 119.74 117.06 2joz s LYS 124 Ca -0.06 -2.72 -0.19 0.00 0.02 0.00 0.00 55.97 53.02 2joz s LYS 124 Cb -0.06 -3.67 0.12 0.00 -0.52 0.00 0.00 37.83 33.70 2joz s LYS 124 CO -0.00 -1.18 0.82 0.45 -0.92 0.00 0.00 175.35 174.52 2joz s SER 125 N 0.22 6.32 -0.05 2.83 0.15 -1.26 -5.02 113.70 116.89 2joz s SER 125 Ca 0.19 -1.60 -0.27 0.00 0.70 0.00 0.00 55.95 54.97 2joz s SER 125 Cb -0.18 -2.33 -0.03 0.00 -1.71 0.00 0.00 66.02 61.77 2joz s SER 125 CO -0.05 -1.10 0.86 -1.59 1.20 0.00 0.00 173.24 172.56 2joz s LYS 126 N 2.63 4.48 -0.24 5.44 -2.85 -1.26 -5.02 119.74 122.92 2joz s LYS 126 Ca 0.17 1.17 -0.04 0.00 -1.00 0.00 0.00 55.97 56.27 2joz s LYS 126 Cb -0.18 -3.47 0.13 0.00 -2.06 0.00 0.00 37.83 32.24 2joz s LYS 126 CO 0.03 -0.05 0.42 0.45 0.10 0.00 0.00 175.35 176.30 2joz s SER 127 N 0.95 -0.12 -0.55 0.03 0.15 -1.26 -5.09 113.70 107.81 2joz s SER 127 Ca 0.45 0.57 -0.12 0.00 0.70 0.00 0.00 55.95 57.55 2joz s SER 127 Cb -0.19 1.33 0.14 0.00 -1.71 0.00 0.00 66.02 65.58 2joz s SER 127 CO 0.22 -0.27 0.46 -0.22 1.20 0.00 0.00 173.24 174.62 2joz s LEU 128 N 2.61 5.97 0.25 3.45 2.96 -1.26 -5.05 118.68 127.61 2joz s LEU 128 Ca 0.09 -2.03 0.01 0.00 -0.22 0.00 0.00 54.13 51.98 2joz s LEU 128 Cb -0.14 -2.09 -0.04 0.00 0.50 0.00 0.00 46.19 44.42 2joz s LEU 128 CO -0.15 -0.71 0.15 -1.83 -1.32 0.00 0.00 176.35 172.48 2joz s GLU 129 N 1.20 1.40 -0.13 1.98 -1.05 -1.26 -5.05 118.70 115.78 2joz s GLU 129 Ca 0.07 -1.77 -0.05 0.00 -0.15 0.00 0.00 54.97 53.07 2joz s GLU 129 Cb -0.25 0.11 0.02 0.00 -0.44 0.00 0.00 34.13 33.57 2joz s GLU 129 CO -0.01 -0.42 0.10 1.58 0.95 0.00 0.00 175.26 177.46 2joz n HIS 130 N -0.42 -2.53 -3.36 4.83 -0.00 -1.26 -5.00 115.22 107.49 2joz n HIS 130 Ca 0.02 1.36 -0.38 0.00 -0.00 0.00 0.00 57.72 58.73 2joz n HIS 130 Cb 0.65 -2.93 -0.06 0.00 -0.00 0.00 0.00 29.99 27.65 2joz n HIS 130 CO 0.00 0.00 0.00 -3.38 -0.00 0.00 0.00 176.34 172.96 2joz s HIS 131 N -0.57 3.48 -0.09 1.57 -3.43 -1.26 -5.07 115.29 109.91 2joz s HIS 131 Ca -0.11 0.79 0.03 0.00 -0.80 0.00 0.00 55.06 54.97 2joz s HIS 131 Cb 0.01 -2.52 -0.01 0.00 -1.43 0.00 0.00 32.58 28.63 2joz s HIS 131 CO 0.46 0.14 -0.19 -3.38 -2.00 0.00 0.00 174.74 169.77 2joz s HIS 132 N 0.76 2.65 -0.33 0.38 -3.43 -1.26 -5.08 115.29 108.97 2joz s HIS 132 Ca 0.23 -0.69 0.03 0.00 -0.80 0.00 0.00 55.06 53.83 2joz s HIS 132 Cb -0.15 -1.72 0.10 0.00 -1.43 0.00 0.00 32.58 29.38 2joz s HIS 132 CO 0.09 -0.20 0.05 -1.58 -2.00 0.00 0.00 174.74 171.10 2joz s HIS 133 N 0.06 3.25 -0.03 0.38 2.46 -1.26 -5.11 115.29 115.05 2joz s HIS 133 Ca -0.08 -2.66 -0.09 0.00 0.47 0.00 0.00 55.06 52.70 2joz s HIS 133 Cb -0.15 -2.58 -0.05 0.00 -0.13 0.00 0.00 32.58 29.67 2joz s HIS 133 CO 0.05 -0.93 0.28 -1.58 -2.47 0.00 0.00 174.74 170.09 2joz s HIS 134 N 1.08 3.62 -2.00 3.88 2.46 -1.26 -5.37 115.29 117.71 2joz s HIS 134 Ca 0.10 0.69 0.31 0.00 0.47 0.00 0.00 55.06 56.62 2joz s HIS 134 Cb -0.19 -2.07 1.85 0.00 -0.13 0.00 0.00 32.58 32.05 2joz s HIS 134 CO -0.12 0.65 2.18 0.72 -2.47 0.00 0.00 174.74 175.70