#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2joz n ILE 2 N 0.00 -8.67 -3.08 1.12 2.08 -1.26 -5.01 119.36 104.55 2joz n ILE 2 Ca 0.00 0.81 -0.39 0.00 0.56 0.00 0.00 62.75 63.73 2joz n ILE 2 Cb 0.00 -6.30 -0.06 0.00 -0.75 0.00 0.00 39.64 32.53 2joz n ILE 2 CO 0.00 0.00 0.00 -0.04 0.56 0.00 0.00 176.55 177.07 2joz s MET 3 N -1.91 4.44 -0.67 0.38 -1.94 -1.26 -4.98 119.30 113.36 2joz s MET 3 Ca 0.13 1.00 -0.26 0.00 -1.71 0.00 0.00 55.69 54.86 2joz s MET 3 Cb -0.04 -3.27 -0.02 0.00 2.01 0.00 0.00 34.83 33.51 2joz s MET 3 CO 0.55 0.54 1.80 0.08 -0.01 0.00 0.00 175.02 177.98 2joz s VAL 4 N -0.94 3.42 -0.46 -6.03 1.01 -1.26 -4.93 120.40 111.21 2joz s VAL 4 Ca 0.34 0.13 -0.29 0.00 0.00 0.00 0.00 61.98 62.17 2joz s VAL 4 Cb -0.21 -4.08 0.02 0.00 0.00 0.00 0.00 36.38 32.10 2joz s VAL 4 CO 0.23 -1.04 1.33 -0.44 0.00 0.00 0.00 175.10 175.18 2joz s SER 5 N 7.55 6.40 0.53 3.32 0.01 -1.26 -5.01 113.70 125.24 2joz s SER 5 Ca 0.64 0.63 0.00 0.00 1.31 0.00 0.00 55.95 58.52 2joz s SER 5 Cb -0.11 -2.54 0.02 0.00 0.21 0.00 0.00 66.02 63.60 2joz s SER 5 CO 0.17 -1.42 0.76 -0.83 0.41 0.00 0.00 173.24 172.33 2joz s GLY 6 N 3.55 1.72 -0.68 3.44 0.00 -1.26 -5.04 107.32 109.05 2joz s GLY 6 Ca 0.56 -1.18 0.04 0.00 0.00 0.00 0.00 44.72 44.14 2joz s GLY 6 CO 0.31 -0.93 0.46 0.00 0.00 0.00 0.00 173.10 172.95 2joz s GLN 8 N -1.20 3.91 -1.20 0.00 -0.21 -1.22 -4.85 119.66 114.89 2joz s GLN 8 Ca 0.23 -1.92 -0.06 0.00 0.02 0.00 0.00 55.36 53.63 2joz s GLN 8 Cb -0.09 -5.39 0.22 0.00 1.00 0.00 0.00 33.01 28.74 2joz s GLN 8 CO -0.13 -2.14 1.83 0.94 -2.12 0.00 0.00 175.29 173.66 2joz n GLN 9 N 7.93 4.19 -2.66 2.91 0.00 -1.10 -3.15 117.38 125.50 2joz n GLN 9 Ca 0.43 -3.93 -0.04 0.00 -0.00 0.00 0.00 57.00 53.45 2joz n GLN 9 Cb 0.47 -2.71 0.08 0.00 0.00 0.00 0.00 30.24 28.07 2joz n GLN 9 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.06 178.00 2joz n GLN 10 N 2.42 0.07 -3.63 3.69 7.27 -1.26 -5.03 117.38 120.91 2joz n GLN 10 Ca 0.39 -0.61 -0.10 0.00 0.07 0.00 0.00 57.00 56.76 2joz n GLN 10 Cb 0.33 -0.12 -0.02 0.00 2.41 0.00 0.00 30.24 32.84 2joz n GLN 10 CO 0.00 0.00 0.00 0.15 0.07 0.00 0.00 177.06 177.28 2joz s LYS 11 N 0.05 1.51 -0.38 3.69 1.02 -1.26 -5.10 119.74 119.27 2joz s LYS 11 Ca 0.25 -0.71 0.01 0.00 0.02 0.00 0.00 55.97 55.53 2joz s LYS 11 Cb 0.22 0.60 0.12 0.00 -0.52 0.00 0.00 37.83 38.25 2joz s LYS 11 CO -0.09 -0.68 0.18 -2.00 -0.92 0.00 0.00 175.35 171.84 2joz s GLU 12 N -3.83 1.03 0.31 1.68 2.12 -1.26 -5.06 118.70 113.69 2joz s GLU 12 Ca 0.06 -1.61 0.03 0.00 0.36 0.00 0.00 54.97 53.81 2joz s GLU 12 Cb -0.03 -2.18 -0.05 0.00 0.26 0.00 0.00 34.13 32.13 2joz s GLU 12 CO -0.04 -1.09 0.10 -2.00 -0.54 0.00 0.00 175.26 171.70 2joz s GLU 13 N 0.90 1.59 -0.16 4.30 2.12 -1.26 -5.09 118.70 121.10 2joz s GLU 13 Ca 0.14 -1.90 -0.34 0.00 0.36 0.00 0.00 54.97 53.24 2joz s GLU 13 Cb -0.21 -0.45 -0.11 0.00 0.26 0.00 0.00 34.13 33.62 2joz s GLU 13 CO -0.09 -0.32 1.98 2.41 -0.54 0.00 0.00 175.26 178.69 2joz n THR 14 N -0.62 0.47 -1.94 -1.70 -1.04 -1.26 -4.87 114.28 103.33 2joz n THR 14 Ca -0.01 -0.18 -0.40 0.00 -2.04 0.00 0.00 64.05 61.42 2joz n THR 14 Cb 0.66 -1.90 -0.03 0.00 -1.82 0.00 0.00 70.33 67.24 2joz n THR 14 CO 0.00 0.00 0.00 -2.84 -0.64 0.00 0.00 175.07 171.59 2joz s PRO 15 N 4.77 2.84 0.41 -2.82 0.02 -1.26 -4.86 135.00 134.11 2joz s PRO 15 Ca 0.97 1.08 0.10 0.00 0.02 0.00 0.00 61.00 63.18 2joz s PRO 15 Cb -0.69 -4.34 0.93 0.00 0.02 0.00 0.00 34.50 30.41 2joz s PRO 15 CO 0.50 -2.45 2.00 0.27 -0.33 0.00 0.00 177.00 176.98 2joz h PHE 16 N 14.81 0.52 0.00 6.54 -0.00 -2.01 -1.68 116.94 135.12 2joz h PHE 16 Ca -0.29 0.01 0.00 0.00 -0.00 0.00 0.00 57.97 57.69 2joz h PHE 16 Cb 1.18 -0.17 0.00 0.00 -0.00 0.00 0.00 35.95 36.96 2joz h PHE 16 CO 1.00 0.28 0.00 2.48 -0.00 0.00 0.00 178.31 182.06 2joz n TYR 17 N -4.47 0.00 0.92 6.09 4.11 -1.26 -3.86 117.16 118.68 2joz n TYR 17 Ca 0.08 0.00 -0.00 0.00 -0.00 0.00 0.00 57.90 57.98 2joz n TYR 17 Cb 0.25 -0.48 0.01 0.00 -0.00 0.00 0.00 39.34 39.12 2joz n TYR 17 CO 0.00 0.00 0.00 0.98 -0.00 0.00 0.00 176.86 177.84 2joz n TYR 18 N -1.48 0.10 -4.27 -3.48 9.36 -0.63 -3.39 117.16 113.37 2joz n TYR 18 Ca 0.07 -0.23 -0.24 0.00 3.32 0.00 0.00 57.90 60.82 2joz n TYR 18 Cb 0.31 -0.18 -0.03 0.00 -0.63 0.00 0.00 39.34 38.81 2joz n TYR 18 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 2joz n GLY 19 N 0.18 3.31 3.55 2.98 0.00 -1.25 -4.80 105.19 109.15 2joz n GLY 19 Ca 0.02 -2.31 -0.40 0.00 0.00 0.00 0.00 46.02 43.33 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 -2.36 5.26 -0.11 2.61 2.01 -1.26 -3.76 115.64 118.04 2joz s THR 20 Ca 0.11 -0.02 0.01 0.00 0.31 0.00 0.00 61.69 62.10 2joz s THR 20 Cb -0.01 -3.68 -0.02 0.00 0.01 0.00 0.00 72.50 68.80 2joz s THR 20 CO 0.07 0.05 -0.13 0.26 -0.69 0.00 0.00 174.62 174.18 2joz s TRP 21 N 1.81 2.79 -0.19 4.92 0.52 -0.28 -1.15 118.94 127.36 2joz s TRP 21 Ca 0.08 -0.53 -0.11 0.00 0.02 0.00 0.00 56.10 55.56 2joz s TRP 21 Cb -0.17 -1.79 -0.05 0.00 -1.15 0.00 0.00 33.47 30.31 2joz s TRP 21 CO 0.11 -0.12 0.16 0.34 0.02 0.00 0.00 176.95 177.46 2joz s ASP 22 N 0.10 6.25 0.05 2.95 2.15 -0.07 -0.09 116.67 128.01 2joz s ASP 22 Ca -0.06 0.28 -0.29 0.00 0.43 0.00 0.00 52.55 52.91 2joz s ASP 22 Cb -0.15 -2.11 -0.18 0.00 -0.30 0.00 0.00 42.92 40.19 2joz s ASP 22 CO 0.05 0.16 1.50 -0.33 -0.17 0.00 0.00 175.17 176.38 2joz h GLU 23 N 6.68 -0.66 -1.70 4.34 5.08 -1.75 -0.82 114.58 125.74 2joz h GLU 23 Ca -0.41 0.04 -0.29 0.00 -1.00 0.00 0.00 59.36 57.71 2joz h GLU 23 Cb 1.15 0.15 -0.04 0.00 0.50 0.00 0.00 28.75 30.51 2joz h GLU 23 CO 0.76 -0.39 -0.34 0.41 -1.00 0.00 0.00 179.01 178.45 2joz n GLY 24 N -1.07 0.20 3.40 -3.84 0.00 -1.26 -4.28 105.19 98.34 2joz n GLY 24 Ca -0.12 -0.30 -0.14 0.00 0.00 0.00 0.00 46.02 45.46 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 -4.34 0.73 0.43 1.61 6.06 -1.26 -5.11 118.95 117.07 2joz s ARG 25 Ca 0.00 0.41 0.00 0.00 -2.50 0.00 0.00 55.73 53.64 2joz s ARG 25 Cb 0.00 0.35 0.00 0.00 0.06 0.00 0.00 34.95 35.36 2joz s ARG 25 CO 0.00 -0.16 0.00 0.00 -2.50 0.00 0.00 175.30 172.64 2joz n ALA 26 N 2.00 -2.62 -1.57 6.12 0.00 -1.26 -4.89 120.51 118.29 2joz n ALA 26 Ca -0.17 0.64 -0.34 0.00 0.00 0.00 0.00 53.44 53.58 2joz n ALA 26 Cb 0.56 -1.09 0.04 0.00 0.00 0.00 0.00 19.45 18.96 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 -3.84 2.87 0.00 0.00 0.02 -1.26 -4.98 135.00 127.80 2joz s PRO 27 Ca 0.00 1.49 0.00 0.00 0.02 0.00 0.00 61.00 62.51 2joz s PRO 27 Cb 0.00 -1.95 0.00 0.00 0.02 0.00 0.00 34.50 32.57 2joz s PRO 27 CO 0.00 -1.21 0.00 0.41 -0.33 0.00 0.00 177.00 175.87 2joz n GLY 28 N -0.24 -0.05 3.32 0.52 0.00 -1.23 -5.06 105.19 102.46 2joz n GLY 28 Ca 0.11 -1.83 -0.33 0.00 0.00 0.00 0.00 46.02 43.97 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 -0.97 -0.60 0.00 1.61 -0.02 -1.26 -4.78 135.00 128.98 2joz n PRO 29 Ca 0.00 -0.15 0.07 0.00 -2.02 0.00 0.00 63.50 61.40 2joz n PRO 29 Cb 0.00 -1.70 0.30 0.00 -0.02 0.00 0.00 33.50 32.08 2joz n PRO 29 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 2joz n THR 30 N -3.70 1.00 0.77 3.45 -2.24 -1.26 -2.51 114.28 109.80 2joz n THR 30 Ca 0.04 0.25 0.11 0.00 -2.27 0.00 0.00 64.05 62.18 2joz n THR 30 Cb 0.57 -1.02 0.48 0.00 -2.10 0.00 0.00 70.33 68.26 2joz n THR 30 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 2joz n ASP 31 N -1.47 0.02 0.00 3.42 2.03 -1.26 -4.83 116.55 114.46 2joz n ASP 31 Ca 0.04 0.50 0.00 0.00 0.52 0.00 0.00 54.79 55.85 2joz n ASP 31 Cb 0.15 -0.51 0.00 0.00 -0.72 0.00 0.00 41.12 40.04 2joz n ASP 31 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2joz n GLY 32 N 0.84 1.81 3.73 0.27 0.00 -1.04 -5.08 105.19 105.72 2joz n GLY 32 Ca 0.05 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.66 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 -2.00 3.76 0.08 1.61 1.01 -1.20 -4.85 120.40 118.81 2joz s VAL 33 Ca 0.00 1.46 0.02 0.00 0.00 0.00 0.00 61.98 63.45 2joz s VAL 33 Cb 0.00 -3.93 -0.25 0.00 0.00 0.00 0.00 36.38 32.20 2joz s VAL 33 CO 0.00 0.22 1.14 0.11 0.00 0.00 0.00 175.10 176.57 2joz h LYS 34 N 5.40 0.14 -3.08 2.72 1.79 -1.76 -3.26 116.57 118.51 2joz h LYS 34 Ca -0.44 -0.24 -0.02 0.00 -2.18 0.00 0.00 60.65 57.77 2joz h LYS 34 Cb 1.21 0.09 -0.12 0.00 -1.58 0.00 0.00 32.23 31.83 2joz h LYS 34 CO 0.75 1.07 0.15 -1.12 -1.08 0.00 0.00 179.45 179.22 2joz s SER 35 N -6.88 -0.49 -0.02 0.86 0.01 -1.24 -4.62 113.70 101.32 2joz s SER 35 Ca -0.03 -0.08 0.02 0.00 1.31 0.00 0.00 55.95 57.17 2joz s SER 35 Cb 0.08 0.58 0.00 0.00 0.21 0.00 0.00 66.02 66.89 2joz s SER 35 CO 0.85 -0.96 -0.08 0.00 0.41 0.00 0.00 173.24 173.46 2joz s ALA 36 N -3.77 0.77 -0.05 1.44 0.00 -1.26 -1.18 121.76 117.71 2joz s ALA 36 Ca 0.02 -0.32 0.06 0.00 0.00 0.00 0.00 51.96 51.72 2joz s ALA 36 Cb -0.01 -0.27 -0.02 0.00 0.00 0.00 0.00 23.12 22.83 2joz s ALA 36 CO -0.12 0.14 -0.22 0.95 0.00 0.00 0.00 175.76 176.51 2joz s THR 37 N 0.10 2.33 -0.08 0.00 -4.23 0.11 -2.36 115.64 111.51 2joz s THR 37 Ca -0.01 -0.98 0.04 0.00 -1.18 0.00 0.00 61.69 59.56 2joz s THR 37 Cb -0.07 -1.86 -0.01 0.00 1.34 0.00 0.00 72.50 71.90 2joz s THR 37 CO 0.00 0.57 -0.21 0.54 -0.54 0.00 0.00 174.62 174.99 2joz s VAL 38 N -0.33 2.43 -0.10 2.29 0.11 0.87 -0.18 120.40 125.48 2joz s VAL 38 Ca 0.02 -0.92 0.03 0.00 -2.93 0.00 0.00 61.98 58.18 2joz s VAL 38 Cb -0.12 -1.93 0.01 0.00 -1.53 0.00 0.00 36.38 32.80 2joz s VAL 38 CO 0.02 0.56 -0.19 -0.89 -3.33 0.00 0.00 175.10 171.27 2joz s THR 39 N -0.07 1.71 -0.31 5.04 2.01 0.23 -1.13 115.64 123.12 2joz s THR 39 Ca -0.05 -0.80 -0.11 0.00 0.31 0.00 0.00 61.69 61.04 2joz s THR 39 Cb -0.14 -1.51 -0.02 0.00 0.01 0.00 0.00 72.50 70.83 2joz s THR 39 CO 0.04 0.48 0.18 -0.36 -0.69 0.00 0.00 174.62 174.28 2joz s PHE 40 N 0.63 3.20 0.48 4.92 0.08 -1.22 -0.68 117.98 125.38 2joz s PHE 40 Ca -0.14 -0.29 0.07 0.00 0.12 0.00 0.00 56.93 56.69 2joz s PHE 40 Cb -0.16 -2.39 0.07 0.00 -0.57 0.00 0.00 43.02 39.96 2joz s PHE 40 CO 0.04 -0.35 0.57 0.25 -0.10 0.00 0.00 175.22 175.63 2joz n THR 41 N 5.04 0.00 -0.08 0.64 -2.24 -0.43 -4.17 114.28 113.03 2joz n THR 41 Ca -0.14 -1.69 -0.08 0.00 -2.27 0.00 0.00 64.05 59.87 2joz n THR 41 Cb 0.50 -0.44 -0.06 0.00 -2.10 0.00 0.00 70.33 68.23 2joz n THR 41 CO 0.00 0.00 0.00 -0.08 -0.57 0.00 0.00 175.07 174.42 2joz h GLU 42 N 0.00 -0.23 0.00 -0.78 4.81 -1.99 -3.32 114.58 113.07 2joz h GLU 42 Ca -0.25 0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.00 2joz h GLU 42 Cb 1.06 0.05 0.00 0.00 0.63 0.00 0.00 28.75 30.49 2joz h GLU 42 CO 0.37 -0.15 -0.01 -3.47 -0.73 0.00 0.00 179.01 175.02 2joz n ASP 43 N -4.25 1.19 -3.98 1.04 2.03 -1.26 -5.01 116.55 106.31 2joz n ASP 43 Ca -0.02 -1.62 -0.12 0.00 0.52 0.00 0.00 54.79 53.54 2joz n ASP 43 Cb 0.20 -0.01 -0.12 0.00 -0.72 0.00 0.00 41.12 40.47 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 -0.62 0.33 -0.17 -0.67 1.03 -1.25 -1.16 118.70 116.19 2joz s GLU 44 Ca 0.01 -0.44 -0.08 0.00 0.03 0.00 0.00 54.97 54.48 2joz s GLU 44 Cb 0.00 -0.14 -0.04 0.00 -0.80 0.00 0.00 34.13 33.15 2joz s GLU 44 CO 0.00 0.02 0.11 0.08 -1.33 0.00 0.00 175.26 174.14 2joz s VAL 45 N -0.85 5.20 -0.19 1.83 1.01 0.20 -1.32 120.40 126.27 2joz s VAL 45 Ca -0.07 0.11 -0.03 0.00 0.00 0.00 0.00 61.98 61.99 2joz s VAL 45 Cb -0.06 -3.34 -0.01 0.00 0.00 0.00 0.00 36.38 32.97 2joz s VAL 45 CO -0.00 0.49 -0.06 -0.69 0.00 0.00 0.00 175.10 174.83 2joz s VAL 46 N 0.05 3.34 -0.11 2.92 1.01 0.14 -2.50 120.40 125.25 2joz s VAL 46 Ca 0.08 -0.52 -0.05 0.00 0.00 0.00 0.00 61.98 61.49 2joz s VAL 46 Cb -0.12 -2.49 -0.04 0.00 0.00 0.00 0.00 36.38 33.74 2joz s VAL 46 CO -0.00 0.45 0.06 -1.61 0.00 0.00 0.00 175.10 174.01 2joz s GLU 47 N 1.12 3.32 -0.14 2.72 2.02 -1.26 -0.60 118.70 125.88 2joz s GLU 47 Ca 0.01 -0.29 0.01 0.00 0.02 0.00 0.00 54.97 54.72 2joz s GLU 47 Cb -0.15 -3.01 0.02 0.00 0.10 0.00 0.00 34.13 31.09 2joz s GLU 47 CO -0.01 0.66 -0.15 0.99 0.02 0.00 0.00 175.26 176.77 2joz s THR 48 N -0.73 1.60 -0.28 3.63 2.01 0.75 -1.20 115.64 121.42 2joz s THR 48 Ca 0.12 -0.67 -0.11 0.00 0.31 0.00 0.00 61.69 61.34 2joz s THR 48 Cb -0.12 -1.48 -0.05 0.00 0.01 0.00 0.00 72.50 70.86 2joz s THR 48 CO 0.03 0.46 0.18 -1.61 -0.69 0.00 0.00 174.62 172.99 2joz s GLU 49 N 1.27 3.92 -0.40 4.92 2.02 0.44 -0.71 118.70 130.16 2joz s GLU 49 Ca 0.00 -0.33 -0.23 0.00 0.02 0.00 0.00 54.97 54.43 2joz s GLU 49 Cb -0.14 -3.63 0.02 0.00 0.10 0.00 0.00 34.13 30.48 2joz s GLU 49 CO -0.07 -0.18 0.78 0.08 0.02 0.00 0.00 175.26 175.89 2joz s VAL 50 N 1.74 4.71 -0.14 2.63 1.01 -0.33 0.39 120.40 130.42 2joz s VAL 50 Ca 0.07 0.69 0.00 0.00 0.00 0.00 0.00 61.98 62.74 2joz s VAL 50 Cb -0.16 -4.25 -0.01 0.00 0.00 0.00 0.00 36.38 31.97 2joz s VAL 50 CO 0.10 -0.54 -0.15 -0.32 0.00 0.00 0.00 175.10 174.20 2joz s MET 51 N 3.16 3.28 0.21 2.72 1.75 0.03 -1.98 119.30 128.47 2joz s MET 51 Ca 0.30 -0.73 -0.32 0.00 -1.25 0.00 0.00 55.69 53.69 2joz s MET 51 Cb -0.13 -2.61 -0.13 0.00 2.84 0.00 0.00 34.83 34.80 2joz s MET 51 CO 0.19 0.11 1.54 -0.85 -0.65 0.00 0.00 175.02 175.36 2joz n GLU 52 N 3.81 2.25 0.00 4.11 0.28 -1.26 -0.63 120.64 129.20 2joz n GLU 52 Ca -0.19 0.81 0.00 0.00 -0.16 0.00 0.00 57.16 57.62 2joz n GLU 52 Cb 0.52 -2.55 0.00 0.00 1.43 0.00 0.00 31.44 30.84 2joz n GLU 52 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2joz n GLY 53 N 2.92 2.86 0.05 -1.84 0.00 -1.26 -4.75 105.19 103.16 2joz n GLY 53 Ca 0.14 -0.64 -0.04 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 0.29 0.00 1.61 5.12 -0.75 -5.13 116.66 117.80 2joz n ARG 54 Ca 0.00 0.31 0.00 0.00 -1.93 0.00 0.00 57.85 56.23 2joz n ARG 54 Cb 0.00 -1.22 0.00 0.00 -1.16 0.00 0.00 32.46 30.08 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 1.60 0.65 3.71 -0.13 0.00 0.20 -5.00 105.19 106.21 2joz n GLY 55 Ca -0.06 -2.05 -0.42 0.00 0.00 0.00 0.00 46.02 43.49 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 -0.81 4.44 -0.20 1.61 8.01 -1.26 -0.79 118.70 129.70 2joz s GLU 56 Ca 0.00 1.72 -0.03 0.00 0.01 0.00 0.00 54.97 56.67 2joz s GLU 56 Cb 0.00 -3.38 -0.01 0.00 -4.31 0.00 0.00 34.13 26.43 2joz s GLU 56 CO 0.00 -0.25 -0.05 0.08 0.01 0.00 0.00 175.26 175.05 2joz s VAL 57 N 1.15 3.40 -0.01 2.63 1.01 0.16 -4.89 120.40 123.85 2joz s VAL 57 Ca 0.58 -0.50 -0.25 0.00 0.00 0.00 0.00 61.98 61.81 2joz s VAL 57 Cb -0.28 -2.52 -0.04 0.00 0.00 0.00 0.00 36.38 33.53 2joz s VAL 57 CO 0.28 0.44 0.77 -1.10 0.00 0.00 0.00 175.10 175.50 2joz s GLN 58 N 1.19 4.48 0.55 2.72 -0.21 -1.26 -0.42 119.66 126.71 2joz s GLN 58 Ca 0.02 1.04 -0.04 0.00 0.02 0.00 0.00 55.36 56.41 2joz s GLN 58 Cb -0.14 -3.42 0.01 0.00 1.00 0.00 0.00 33.01 30.45 2joz s GLN 58 CO -0.01 0.12 0.82 -0.51 -2.12 0.00 0.00 175.29 173.60 2joz s LEU 59 N 0.53 3.36 0.69 2.90 1.43 -0.34 -4.99 118.68 122.26 2joz s LEU 59 Ca 0.40 0.55 -0.16 0.00 -1.03 0.00 0.00 54.13 53.89 2joz s LEU 59 Cb -0.19 -3.40 -0.01 0.00 0.03 0.00 0.00 46.19 42.62 2joz s LEU 59 CO 0.22 -0.96 0.94 -2.65 0.23 0.00 0.00 176.35 174.13 2joz n PRO 60 N -2.42 0.59 -2.22 1.29 -0.02 -1.26 -4.69 135.00 126.28 2joz n PRO 60 Ca 0.04 0.25 -0.43 0.00 -2.02 0.00 0.00 63.50 61.34 2joz n PRO 60 Cb 0.58 -2.19 -0.02 0.00 -0.02 0.00 0.00 33.50 31.84 2joz n PRO 60 CO 0.00 0.00 0.00 -0.06 1.98 0.00 0.00 175.50 177.42 2joz s PHE 61 N -1.74 2.29 -0.30 6.00 0.08 -1.26 -4.76 117.98 118.30 2joz s PHE 61 Ca 0.74 0.65 -0.15 0.00 0.12 0.00 0.00 56.93 58.30 2joz s PHE 61 Cb -0.36 -3.97 -0.03 0.00 -0.57 0.00 0.00 43.02 38.08 2joz s PHE 61 CO 0.50 -2.52 0.35 -1.64 -0.10 0.00 0.00 175.22 171.81 2joz s MET 62 N 4.55 3.86 0.29 0.44 -1.94 -1.04 -4.93 119.30 120.52 2joz s MET 62 Ca 0.66 -0.15 -0.29 0.00 -1.71 0.00 0.00 55.69 54.20 2joz s MET 62 Cb -0.22 -3.71 -0.09 0.00 2.01 0.00 0.00 34.83 32.82 2joz s MET 62 CO 0.27 -0.35 1.05 0.00 -0.01 0.00 0.00 175.02 175.98 2joz s ALA 63 N 2.03 3.35 0.00 3.03 0.00 -1.26 0.58 121.76 129.49 2joz s ALA 63 Ca 0.13 0.80 -0.09 0.00 0.00 0.00 0.00 51.96 52.79 2joz s ALA 63 Cb -0.16 -3.29 0.01 0.00 0.00 0.00 0.00 23.12 19.68 2joz s ALA 63 CO 0.11 -0.07 0.18 1.52 0.00 0.00 0.00 175.76 177.50 2joz s TYR 64 N -1.24 -0.01 0.07 0.00 1.13 -0.30 -0.53 117.35 116.46 2joz s TYR 64 Ca 0.45 -0.04 0.04 0.00 -1.41 0.00 0.00 57.07 56.11 2joz s TYR 64 Cb -0.29 -0.01 -0.03 0.00 -1.10 0.00 0.00 41.96 40.53 2joz s TYR 64 CO 0.37 -0.32 -0.11 0.15 -2.51 0.00 0.00 175.55 173.13 2joz s LYS 65 N -1.41 0.74 -0.04 -3.49 1.02 0.21 -4.48 119.74 112.30 2joz s LYS 65 Ca -0.14 -0.96 -0.28 0.00 0.02 0.00 0.00 55.97 54.61 2joz s LYS 65 Cb -0.07 -0.58 -0.03 0.00 -0.52 0.00 0.00 37.83 36.63 2joz s LYS 65 CO 0.02 0.11 0.91 0.08 -0.92 0.00 0.00 175.35 175.55 2joz s VAL 66 N -1.65 4.90 -0.20 3.17 1.01 -1.26 -0.55 120.40 125.83 2joz s VAL 66 Ca -0.02 1.88 -0.18 0.00 0.00 0.00 0.00 61.98 63.66 2joz s VAL 66 Cb -0.08 -4.24 -0.14 0.00 0.00 0.00 0.00 36.38 31.92 2joz s VAL 66 CO 0.01 0.15 0.06 -0.38 0.00 0.00 0.00 175.10 174.95 2joz n ILE 67 N 4.02 1.51 -4.09 2.22 5.41 0.96 -4.92 119.36 124.47 2joz n ILE 67 Ca 0.05 0.01 -0.09 0.00 1.00 0.00 0.00 62.75 63.71 2joz n ILE 67 Cb 0.51 -2.12 -0.10 0.00 -0.71 0.00 0.00 39.64 37.21 2joz n ILE 67 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 176.55 176.11 2joz s SER 68 N -6.62 0.65 0.02 4.38 0.01 -0.62 -4.98 113.70 106.54 2joz s SER 68 Ca -0.26 -0.85 -0.11 0.00 1.31 0.00 0.00 55.95 56.03 2joz s SER 68 Cb 0.06 0.14 0.01 0.00 0.21 0.00 0.00 66.02 66.43 2joz s SER 68 CO 0.49 -0.46 0.23 -1.58 0.41 0.00 0.00 173.24 172.33 2joz s GLN 69 N -3.16 0.67 -0.25 12.44 0.74 -1.26 -0.73 119.66 128.11 2joz s GLN 69 Ca 0.02 -0.47 -0.19 0.00 0.05 0.00 0.00 55.36 54.77 2joz s GLN 69 Cb 0.02 0.28 0.07 0.00 1.10 0.00 0.00 33.01 34.48 2joz s GLN 69 CO -0.06 -0.19 0.63 0.45 -0.55 0.00 0.00 175.29 175.57 2joz s SER 70 N -1.78 -0.75 0.09 6.67 0.15 -0.63 -2.71 113.70 114.73 2joz s SER 70 Ca -0.09 1.33 0.27 0.00 0.70 0.00 0.00 55.95 58.16 2joz s SER 70 Cb -0.03 1.28 1.05 0.00 -1.71 0.00 0.00 66.02 66.61 2joz s SER 70 CO -0.01 -0.23 1.85 0.35 1.20 0.00 0.00 173.24 176.41 2joz n THR 71 N 3.44 0.28 -0.18 6.45 -2.24 -1.19 -3.35 114.28 117.49 2joz n THR 71 Ca -0.17 -0.10 -0.08 0.00 -2.27 0.00 0.00 64.05 61.43 2joz n THR 71 Cb 0.57 -0.56 0.06 0.00 -2.10 0.00 0.00 70.33 68.29 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 0.98 0.00 3.42 3.58 -1.87 -3.47 116.42 119.06 2joz h ASP 72 Ca 0.00 -0.28 0.00 0.00 0.42 0.00 0.00 57.03 57.17 2joz h ASP 72 Cb 0.58 -0.26 0.00 0.00 1.72 0.00 0.00 39.33 41.37 2joz h ASP 72 CO 0.00 1.04 0.00 0.61 -2.88 0.00 0.00 179.24 178.01 2joz n GLY 73 N -0.45 0.13 3.23 -0.78 0.00 -1.21 -4.93 105.19 101.17 2joz n GLY 73 Ca 0.03 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.92 2joz n GLY 73 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2joz s SER 74 N -0.19 -0.39 -0.01 1.61 0.01 -1.25 -0.27 113.70 113.21 2joz s SER 74 Ca 0.00 0.73 0.01 0.00 1.31 0.00 0.00 55.95 58.01 2joz s SER 74 Cb 0.00 0.70 0.00 0.00 0.21 0.00 0.00 66.02 66.93 2joz s SER 74 CO 0.00 -0.14 -0.04 -0.63 0.41 0.00 0.00 173.24 172.83 2joz s ILE 75 N 0.60 0.37 -0.14 1.44 1.01 0.22 -1.61 121.20 123.09 2joz s ILE 75 Ca -0.03 -0.16 -0.00 0.00 0.00 0.00 0.00 60.65 60.45 2joz s ILE 75 Cb -0.05 -0.35 -0.01 0.00 0.01 0.00 0.00 42.46 42.06 2joz s ILE 75 CO -0.04 0.13 -0.13 -0.70 0.00 0.00 0.00 174.94 174.20 2joz s GLU 76 N 0.15 3.38 0.13 2.79 2.12 0.09 -0.27 118.70 127.08 2joz s GLU 76 Ca -0.01 -0.68 0.05 0.00 0.36 0.00 0.00 54.97 54.68 2joz s GLU 76 Cb -0.05 -2.66 -0.04 0.00 0.26 0.00 0.00 34.13 31.65 2joz s GLU 76 CO -0.00 0.18 -0.11 0.96 -0.54 0.00 0.00 175.26 175.74 2joz s ILE 77 N 0.45 1.15 0.07 -3.70 -4.36 -1.17 -0.02 121.20 113.61 2joz s ILE 77 Ca -0.09 -1.86 0.08 0.00 -0.26 0.00 0.00 60.65 58.51 2joz s ILE 77 Cb -0.16 -1.63 -0.03 0.00 1.25 0.00 0.00 42.46 41.89 2joz s ILE 77 CO 0.05 -0.62 -0.21 -1.58 0.24 0.00 0.00 174.94 172.82 2joz s GLN 78 N -3.22 1.31 0.14 0.37 2.00 0.29 -3.26 119.66 117.29 2joz s GLN 78 Ca 0.12 -1.06 -0.03 0.00 -2.00 0.00 0.00 55.36 52.39 2joz s GLN 78 Cb -0.01 -1.51 -0.05 0.00 0.80 0.00 0.00 33.01 32.24 2joz s GLN 78 CO 0.01 0.37 0.35 0.71 -0.50 0.00 0.00 175.29 176.24 2joz s TYR 79 N -0.95 3.48 0.19 1.67 2.02 -1.26 -0.62 117.35 121.89 2joz s TYR 79 Ca 0.08 0.46 0.06 0.00 -0.37 0.00 0.00 57.07 57.30 2joz s TYR 79 Cb -0.09 -1.93 -0.04 0.00 -0.40 0.00 0.00 41.96 39.49 2joz s TYR 79 CO 0.03 0.44 0.10 -0.51 -1.57 0.00 0.00 175.55 174.04 2joz s LEU 80 N -2.79 3.62 0.00 -1.29 1.43 0.30 -3.23 118.68 116.72 2joz s LEU 80 Ca 0.40 -0.27 0.00 0.00 -1.03 0.00 0.00 54.13 53.23 2joz s LEU 80 Cb -0.12 -2.22 0.00 0.00 0.03 0.00 0.00 46.19 43.88 2joz s LEU 80 CO 0.26 0.05 0.00 0.61 0.23 0.00 0.00 176.35 177.50 2joz n GLY 81 N -0.47 -0.87 0.00 -3.19 0.00 -1.26 -4.14 105.19 95.26 2joz n GLY 81 Ca -0.08 -1.68 0.02 0.00 0.00 0.00 0.00 46.02 44.28 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 0.09 -0.40 1.61 -0.02 -1.26 -1.57 135.00 133.44 2joz n PRO 82 Ca 0.00 0.20 0.10 0.00 -2.02 0.00 0.00 63.50 61.78 2joz n PRO 82 Cb 0.00 -1.50 0.30 0.00 -0.02 0.00 0.00 33.50 32.28 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 -1.24 1.03 -0.73 6.00 4.01 -1.26 -4.97 117.16 120.00 2joz n TYR 83 Ca 0.03 -0.47 -0.30 0.00 -0.16 0.00 0.00 57.90 57.00 2joz n TYR 83 Cb 0.04 -0.07 0.26 0.00 -0.31 0.00 0.00 39.34 39.26 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 -1.33 0.23 0.00 -0.72 -0.85 -0.61 -3.54 117.35 110.53 2joz s TYR 84 Ca 0.45 0.63 0.00 0.00 -0.52 0.00 0.00 57.07 57.63 2joz s TYR 84 Cb 0.25 -3.17 0.00 0.00 0.38 0.00 0.00 41.96 39.42 2joz s TYR 84 CO 0.28 -4.29 0.00 -2.30 -1.52 0.00 0.00 175.55 167.72 2joz n PRO 85 N -5.11 0.00 -2.97 -3.49 -0.02 -1.26 -4.78 135.00 117.37 2joz n PRO 85 Ca 0.11 0.00 -0.43 0.00 -2.02 0.00 0.00 63.50 61.16 2joz n PRO 85 Cb 0.59 0.00 -0.05 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 4.61 0.53 2.45 2.96 -1.23 -5.01 118.68 122.98 2joz s LEU 86 Ca 0.00 -0.87 0.03 0.00 -0.22 0.00 0.00 54.13 53.07 2joz s LEU 86 Cb 0.00 -2.52 0.01 0.00 0.50 0.00 0.00 46.19 44.18 2joz s LEU 86 CO 0.00 -1.20 0.18 -1.59 -1.32 0.00 0.00 176.35 172.43 2joz s LYS 87 N 3.46 2.23 0.21 1.98 -2.85 -1.26 -4.57 119.74 118.93 2joz s LYS 87 Ca 0.21 -2.24 0.02 0.00 -1.00 0.00 0.00 55.97 52.97 2joz s LYS 87 Cb -0.17 -1.79 -0.05 0.00 -2.06 0.00 0.00 37.83 33.76 2joz s LYS 87 CO 0.12 -0.49 0.01 -1.12 0.10 0.00 0.00 175.35 173.98 2joz s SER 88 N -4.06 1.46 0.01 0.03 0.01 -1.20 -3.96 113.70 105.98 2joz s SER 88 Ca 0.18 -1.22 0.07 0.00 1.31 0.00 0.00 55.95 56.29 2joz s SER 88 Cb -0.00 0.08 -0.02 0.00 0.21 0.00 0.00 66.02 66.29 2joz s SER 88 CO 0.11 -0.57 -0.21 -0.89 0.41 0.00 0.00 173.24 172.09 2joz s THR 89 N -3.57 1.70 -0.15 1.44 2.01 0.13 -3.02 115.64 114.17 2joz s THR 89 Ca 0.28 -1.05 0.01 0.00 0.31 0.00 0.00 61.69 61.24 2joz s THR 89 Cb 0.06 -1.44 0.00 0.00 0.01 0.00 0.00 72.50 71.14 2joz s THR 89 CO 0.07 0.36 -0.18 -0.76 -0.69 0.00 0.00 174.62 173.42 2joz s LEU 90 N -0.81 2.32 0.06 4.42 1.43 0.63 -0.08 118.68 126.64 2joz s LEU 90 Ca 0.08 -0.53 0.01 0.00 -1.03 0.00 0.00 54.13 52.66 2joz s LEU 90 Cb -0.08 -1.52 -0.03 0.00 0.03 0.00 0.00 46.19 44.59 2joz s LEU 90 CO 0.00 0.07 -0.06 -0.54 0.23 0.00 0.00 176.35 176.06 2joz s LYS 91 N 0.88 0.59 0.44 1.70 1.02 0.21 0.69 119.74 125.27 2joz s LYS 91 Ca -0.05 -0.99 -0.25 0.00 0.02 0.00 0.00 55.97 54.70 2joz s LYS 91 Cb -0.15 -0.09 -0.08 0.00 -0.52 0.00 0.00 37.83 36.99 2joz s LYS 91 CO -0.02 -0.02 1.30 -0.98 -0.92 0.00 0.00 175.35 174.71 2joz s ARG 92 N -2.70 3.80 -0.09 1.68 1.70 0.63 -0.46 118.95 123.51 2joz s ARG 92 Ca -0.01 2.14 0.04 0.00 -0.47 0.00 0.00 55.73 57.42 2joz s ARG 92 Cb -0.02 -2.63 -0.01 0.00 -0.57 0.00 0.00 34.95 31.72 2joz s ARG 92 CO -0.03 -0.63 -0.21 0.20 -1.08 0.00 0.00 175.30 173.55 2joz s GLY 93 N -0.83 1.39 0.75 3.88 0.00 0.62 -4.49 107.32 108.63 2joz s GLY 93 Ca 0.60 -0.98 -0.12 0.00 0.00 0.00 0.00 44.72 44.22 2joz s GLY 93 CO 0.47 -0.46 1.11 -0.54 0.00 0.00 0.00 173.10 173.68 2joz s GLU 94 N 0.05 2.28 0.00 2.90 2.02 -1.26 -0.94 118.70 123.74 2joz s GLU 94 Ca -0.08 1.29 0.00 0.00 0.02 0.00 0.00 54.97 56.19 2joz s GLU 94 Cb -0.15 -1.89 0.00 0.00 0.10 0.00 0.00 34.13 32.19 2joz s GLU 94 CO 0.05 -1.64 0.00 0.09 0.02 0.00 0.00 175.26 173.78 2joz n ASN 95 N -3.27 0.00 0.00 -0.19 5.03 -1.26 -3.66 115.26 111.92 2joz n ASN 95 Ca 0.10 0.00 0.00 0.00 0.87 0.00 0.00 54.58 55.55 2joz n ASN 95 Cb 0.53 -0.39 0.00 0.00 -1.02 0.00 0.00 39.78 38.89 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 -2.00 0.69 3.44 7.41 0.00 -1.10 -5.14 105.19 108.49 2joz n GLY 96 Ca 0.00 -0.38 -0.22 0.00 0.00 0.00 0.00 46.02 45.42 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 -1.30 0.70 -0.07 2.61 -4.23 -0.11 -4.46 115.64 108.77 2joz s THR 97 Ca 0.00 -2.00 0.05 0.00 -1.18 0.00 0.00 61.69 58.56 2joz s THR 97 Cb 0.00 -2.53 -0.00 0.00 1.34 0.00 0.00 72.50 71.30 2joz s THR 97 CO 0.00 0.00 -0.22 -0.22 -0.54 0.00 0.00 174.62 173.64 2joz s LEU 98 N -3.49 2.01 -0.37 4.79 2.96 -0.73 -0.28 118.68 123.58 2joz s LEU 98 Ca 0.31 -0.48 -0.10 0.00 -0.22 0.00 0.00 54.13 53.64 2joz s LEU 98 Cb 0.05 -1.27 0.03 0.00 0.50 0.00 0.00 46.19 45.51 2joz s LEU 98 CO 0.15 0.18 0.19 -0.63 -1.32 0.00 0.00 176.35 174.93 2joz s ILE 99 N 0.10 4.46 -0.32 6.68 1.01 0.39 -1.50 121.20 132.02 2joz s ILE 99 Ca -0.09 -0.90 -0.09 0.00 0.00 0.00 0.00 60.65 59.56 2joz s ILE 99 Cb -0.15 -3.50 0.00 0.00 0.01 0.00 0.00 42.46 38.83 2joz s ILE 99 CO 0.05 -0.23 0.15 0.86 0.00 0.00 0.00 174.94 175.78 2joz s TRP 100 N 1.53 3.19 -0.16 3.97 -0.00 0.11 -0.62 118.94 126.96 2joz s TRP 100 Ca 0.01 -0.73 -0.08 0.00 -0.00 0.00 0.00 56.10 55.30 2joz s TRP 100 Cb -0.19 -2.36 -0.04 0.00 -0.00 0.00 0.00 33.47 30.87 2joz s TRP 100 CO 0.06 -0.52 0.12 -1.21 -0.00 0.00 0.00 176.95 175.40 2joz s GLU 101 N 1.58 3.78 -0.21 5.86 2.02 0.88 0.02 118.70 132.62 2joz s GLU 101 Ca 0.04 -0.21 -0.04 0.00 0.02 0.00 0.00 54.97 54.78 2joz s GLU 101 Cb -0.18 -3.26 0.11 0.00 0.10 0.00 0.00 34.13 30.90 2joz s GLU 101 CO 0.06 0.52 0.31 -1.14 0.02 0.00 0.00 175.26 175.03 2joz s GLN 102 N -0.29 0.27 -1.67 1.61 -0.44 0.24 0.20 119.66 119.57 2joz s GLN 102 Ca 0.11 0.48 -0.01 0.00 -2.50 0.00 0.00 55.36 53.43 2joz s GLN 102 Cb -0.12 -0.62 0.00 0.00 -1.64 0.00 0.00 33.01 30.63 2joz s GLN 102 CO 0.01 -0.58 0.20 -1.71 0.50 0.00 0.00 175.29 173.71 2joz n ASN 103 N 5.35 -5.89 0.00 6.67 5.15 -1.25 -0.31 115.26 124.97 2joz n ASN 103 Ca -0.05 -0.11 0.00 0.00 -0.60 0.00 0.00 54.58 53.83 2joz n ASN 103 Cb 0.50 -4.84 0.00 0.00 -0.53 0.00 0.00 39.78 34.91 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 -1.18 2.47 3.79 8.20 0.00 -1.26 -5.06 105.19 112.15 2joz n GLY 104 Ca -0.20 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.44 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 -0.93 4.13 -0.35 1.61 -0.21 0.57 -5.05 119.66 119.43 2joz s GLN 105 Ca 0.00 0.48 -0.13 0.00 0.02 0.00 0.00 55.36 55.73 2joz s GLN 105 Cb 0.00 -3.30 -0.01 0.00 1.00 0.00 0.00 33.01 30.69 2joz s GLN 105 CO 0.00 0.49 0.25 0.50 -2.12 0.00 0.00 175.29 174.40 2joz s ARG 106 N -0.46 3.46 -0.10 2.91 3.52 -1.26 -0.59 118.95 126.43 2joz s ARG 106 Ca 0.25 -0.67 -0.01 0.00 -0.13 0.00 0.00 55.73 55.18 2joz s ARG 106 Cb -0.17 -3.82 -0.03 0.00 -1.56 0.00 0.00 34.95 29.37 2joz s ARG 106 CO 0.13 -0.47 -0.05 0.15 -0.81 0.00 0.00 175.30 174.25 2joz s LYS 107 N 1.73 3.11 -0.22 5.12 -0.14 0.10 -4.99 119.74 124.45 2joz s LYS 107 Ca 0.06 -0.53 0.02 0.00 -1.36 0.00 0.00 55.97 54.16 2joz s LYS 107 Cb -0.17 -2.72 0.04 0.00 -1.68 0.00 0.00 37.83 33.29 2joz s LYS 107 CO 0.11 0.51 -0.14 0.99 -0.76 0.00 0.00 175.35 176.06 2joz s THR 108 N -0.38 2.02 0.15 2.17 2.01 -1.26 0.07 115.64 120.42 2joz s THR 108 Ca 0.06 -1.28 0.10 0.00 0.31 0.00 0.00 61.69 60.88 2joz s THR 108 Cb -0.12 -2.03 -0.04 0.00 0.01 0.00 0.00 72.50 70.32 2joz s THR 108 CO 0.02 0.19 -0.22 0.00 -0.69 0.00 0.00 174.62 173.93 2joz s MET 109 N 1.22 1.62 0.12 4.92 0.23 -0.56 -4.66 119.30 122.19 2joz s MET 109 Ca -0.03 -1.33 0.06 0.00 -1.03 0.00 0.00 55.69 53.36 2joz s MET 109 Cb -0.17 -1.98 -0.04 0.00 -1.53 0.00 0.00 34.83 31.11 2joz s MET 109 CO -0.08 0.45 0.00 0.99 -2.03 0.00 0.00 175.02 174.35 2joz s THR 110 N -1.30 3.93 0.02 3.16 2.01 -0.31 -1.77 115.64 121.38 2joz s THR 110 Ca 0.18 -1.14 -0.21 0.00 0.31 0.00 0.00 61.69 60.83 2joz s THR 110 Cb -0.10 -2.91 -0.06 0.00 0.01 0.00 0.00 72.50 69.45 2joz s THR 110 CO 0.09 0.03 0.63 -0.60 -0.69 0.00 0.00 174.62 174.09 2joz s ARG 111 N -2.55 4.35 0.44 4.92 3.52 -1.26 -0.89 118.95 127.47 2joz s ARG 111 Ca 0.26 0.82 -0.22 0.00 -0.13 0.00 0.00 55.73 56.45 2joz s ARG 111 Cb -0.11 -3.33 -0.09 0.00 -1.56 0.00 0.00 34.95 29.87 2joz s ARG 111 CO 0.19 0.40 1.05 0.42 -0.81 0.00 0.00 175.30 176.54 2joz s ILE 112 N -0.32 3.71 0.32 4.11 -1.09 -0.30 -4.93 121.20 122.70 2joz s ILE 112 Ca 0.32 1.21 -0.10 0.00 -2.23 0.00 0.00 60.65 59.85 2joz s ILE 112 Cb -0.19 -3.57 -0.07 0.00 -1.58 0.00 0.00 42.46 37.05 2joz s ILE 112 CO 0.19 -0.09 0.67 -0.70 -1.23 0.00 0.00 174.94 173.77 2joz s GLU 113 N -2.80 3.81 -1.26 2.79 2.56 -1.26 -4.84 118.70 117.70 2joz s GLU 113 Ca 0.62 0.38 -0.18 0.00 0.00 0.00 0.00 54.97 55.79 2joz s GLU 113 Cb -0.20 -2.51 0.01 0.00 2.00 0.00 0.00 34.13 33.42 2joz s GLU 113 CO 0.25 0.15 1.92 0.43 -0.56 0.00 0.00 175.26 177.45 2joz n SER 114 N -0.72 4.04 -3.38 -1.70 7.64 -1.26 -4.69 113.62 113.54 2joz n SER 114 Ca 0.01 -2.83 -0.33 0.00 1.01 0.00 0.00 58.87 56.74 2joz n SER 114 Cb 0.53 -1.65 -0.03 0.00 -1.01 0.00 0.00 64.21 62.06 2joz n SER 114 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 2joz n LYS 115 N 7.62 3.78 -2.52 1.43 5.02 -1.26 -5.04 118.16 127.19 2joz n LYS 115 Ca 0.49 -4.73 -0.41 0.00 -2.02 0.00 0.00 58.31 51.64 2joz n LYS 115 Cb 0.44 -2.34 -0.03 0.00 -0.02 0.00 0.00 35.03 33.08 2joz n LYS 115 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 2joz s THR 116 N -3.71 3.81 -1.45 -0.18 -4.23 -1.26 -4.91 115.64 103.71 2joz s THR 116 Ca 0.42 0.59 -0.11 0.00 -1.18 0.00 0.00 61.69 61.41 2joz s THR 116 Cb 0.19 -4.77 0.04 0.00 1.34 0.00 0.00 72.50 69.31 2joz s THR 116 CO -0.07 -1.58 2.35 0.61 -0.54 0.00 0.00 174.62 175.39 2joz n GLY 117 N 5.27 4.54 3.35 3.99 0.00 -1.26 -4.86 105.19 116.22 2joz n GLY 117 Ca 0.06 -1.72 -0.45 0.00 0.00 0.00 0.00 46.02 43.91 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 1.92 4.00 0.14 1.61 1.70 -1.26 -4.98 118.95 122.08 2joz s ARG 118 Ca 0.52 -2.88 0.04 0.00 -0.47 0.00 0.00 55.73 52.94 2joz s ARG 118 Cb 0.15 -4.59 -0.04 0.00 -0.57 0.00 0.00 34.95 29.89 2joz s ARG 118 CO -0.06 -1.33 -0.08 -1.21 -1.08 0.00 0.00 175.30 171.54 2joz s GLU 119 N -0.40 1.04 -0.59 3.89 8.01 -1.26 -5.08 118.70 124.30 2joz s GLU 119 Ca 0.28 -1.45 -0.27 0.00 0.01 0.00 0.00 54.97 53.54 2joz s GLU 119 Cb -0.09 -0.50 0.00 0.00 -4.31 0.00 0.00 34.13 29.24 2joz s GLU 119 CO -0.08 0.02 1.54 -1.21 0.01 0.00 0.00 175.26 175.55 2joz s GLU 120 N -3.79 3.09 0.14 1.61 8.01 -1.26 -4.97 118.70 121.53 2joz s GLU 120 Ca 0.17 0.43 -0.25 0.00 0.01 0.00 0.00 54.97 55.33 2joz s GLU 120 Cb 0.04 -4.21 -0.07 0.00 -4.31 0.00 0.00 34.13 25.57 2joz s GLU 120 CO 0.00 -2.20 0.78 0.15 0.01 0.00 0.00 175.26 174.00 2joz s LYS 121 N 6.00 4.56 0.40 1.61 1.02 -1.26 -5.07 119.74 127.00 2joz s LYS 121 Ca 0.55 1.15 -0.02 0.00 0.02 0.00 0.00 55.97 57.67 2joz s LYS 121 Cb -0.12 -3.28 -0.04 0.00 -0.52 0.00 0.00 37.83 33.87 2joz s LYS 121 CO 0.22 0.51 0.65 0.34 -0.92 0.00 0.00 175.35 176.15 2joz s ASP 122 N -0.92 6.30 0.17 2.83 2.15 -1.26 -5.04 116.67 120.91 2joz s ASP 122 Ca 0.37 0.68 -0.31 0.00 0.43 0.00 0.00 52.55 53.72 2joz s ASP 122 Cb -0.23 -2.13 -0.09 0.00 -0.30 0.00 0.00 42.92 40.17 2joz s ASP 122 CO 0.26 -0.40 1.40 -1.61 -0.17 0.00 0.00 175.17 174.64 2joz s GLU 123 N -4.41 4.32 -0.42 4.34 2.02 -1.26 -4.88 118.70 118.40 2joz s GLU 123 Ca 0.43 2.15 -0.27 0.00 0.02 0.00 0.00 54.97 57.30 2joz s GLU 123 Cb -0.10 -3.19 -0.04 0.00 0.10 0.00 0.00 34.13 30.89 2joz s GLU 123 CO 0.39 -0.40 2.10 -1.59 0.02 0.00 0.00 175.26 175.78 2joz s LYS 124 N 0.48 2.72 -0.57 1.61 -2.85 -1.26 -4.92 119.74 114.95 2joz s LYS 124 Ca 0.62 1.36 -0.23 0.00 -1.00 0.00 0.00 55.97 56.72 2joz s LYS 124 Cb -0.39 -4.41 0.05 0.00 -2.06 0.00 0.00 37.83 31.03 2joz s LYS 124 CO 0.35 -2.58 0.90 0.45 0.10 0.00 0.00 175.35 174.57 2joz s SER 125 N 9.03 6.29 0.00 0.03 0.15 -1.26 -4.74 113.70 123.20 2joz s SER 125 Ca 0.87 -0.57 0.00 0.00 0.70 0.00 0.00 55.95 56.96 2joz s SER 125 Cb -0.21 -2.41 0.00 0.00 -1.71 0.00 0.00 66.02 61.69 2joz s SER 125 CO 0.28 -1.22 0.00 1.17 1.20 0.00 0.00 173.24 174.67 2joz n LYS 126 N 7.32 0.00 -3.64 5.44 4.81 -1.26 -4.54 118.16 126.29 2joz n LYS 126 Ca -0.01 0.00 -0.07 0.00 -0.87 0.00 0.00 58.31 57.36 2joz n LYS 126 Cb 0.47 0.00 -0.07 0.00 0.02 0.00 0.00 35.03 35.45 2joz n LYS 126 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 2joz s SER 127 N -1.83 -0.69 -0.34 3.14 0.15 -1.26 -5.14 113.70 107.73 2joz s SER 127 Ca 0.00 1.17 -0.03 0.00 0.70 0.00 0.00 55.95 57.79 2joz s SER 127 Cb 0.00 1.25 0.06 0.00 -1.71 0.00 0.00 66.02 65.63 2joz s SER 127 CO 0.00 -0.19 0.07 -0.22 1.20 0.00 0.00 173.24 174.11 2joz s LEU 128 N 1.11 4.34 -0.10 3.45 1.98 -1.26 -5.05 118.68 123.15 2joz s LEU 128 Ca -0.06 -1.45 -0.30 0.00 -2.89 0.00 0.00 54.13 49.43 2joz s LEU 128 Cb -0.05 -1.77 0.11 0.00 0.66 0.00 0.00 46.19 45.14 2joz s LEU 128 CO -0.13 -0.35 0.90 -1.83 -1.89 0.00 0.00 176.35 173.06 2joz s GLU 129 N 1.25 0.75 -0.50 1.98 -1.05 -1.26 -5.11 118.70 114.77 2joz s GLU 129 Ca -0.01 0.08 -0.21 0.00 -0.15 0.00 0.00 54.97 54.68 2joz s GLU 129 Cb -0.20 0.35 0.04 0.00 -0.44 0.00 0.00 34.13 33.88 2joz s GLU 129 CO -0.01 -0.25 0.70 -1.01 0.95 0.00 0.00 175.26 175.64 2joz s HIS 130 N -1.54 3.00 -0.32 4.83 3.76 -1.26 -5.00 115.29 118.76 2joz s HIS 130 Ca -0.02 -0.28 -0.28 0.00 -0.15 0.00 0.00 55.06 54.33 2joz s HIS 130 Cb -0.00 -3.60 -0.04 0.00 1.11 0.00 0.00 32.58 30.04 2joz s HIS 130 CO 0.01 -1.06 2.12 -1.58 -0.85 0.00 0.00 174.74 173.39 2joz s HIS 131 N 2.98 1.34 -0.11 1.40 2.46 -1.26 -4.94 115.29 117.17 2joz s HIS 131 Ca 0.21 0.75 0.02 0.00 0.47 0.00 0.00 55.06 56.51 2joz s HIS 131 Cb -0.16 -3.93 -0.01 0.00 -0.13 0.00 0.00 32.58 28.35 2joz s HIS 131 CO 0.16 -3.43 -0.18 -3.38 -2.47 0.00 0.00 174.74 165.44 2joz s HIS 132 N 8.67 2.68 -0.29 3.88 -3.43 -1.26 -5.10 115.29 120.44 2joz s HIS 132 Ca 0.93 -0.78 -0.09 0.00 -0.80 0.00 0.00 55.06 54.32 2joz s HIS 132 Cb -0.26 -1.76 -0.02 0.00 -1.43 0.00 0.00 32.58 29.11 2joz s HIS 132 CO 0.32 -0.27 0.12 -1.58 -2.00 0.00 0.00 174.74 171.34 2joz s HIS 133 N 0.24 3.15 -1.47 0.38 2.46 -1.26 -4.97 115.29 113.82 2joz s HIS 133 Ca -0.12 -0.49 0.29 0.00 0.47 0.00 0.00 55.06 55.20 2joz s HIS 133 Cb -0.16 -2.31 1.32 0.00 -0.13 0.00 0.00 32.58 31.29 2joz s HIS 133 CO 0.07 -0.41 1.93 1.58 -2.47 0.00 0.00 174.74 175.43 2joz n HIS 134 N 4.96 0.00 -1.23 3.88 -0.00 -1.26 -5.34 115.22 116.24 2joz n HIS 134 Ca -0.15 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.03 2joz n HIS 134 Cb 0.50 -0.25 0.00 0.00 -0.12 0.00 0.00 29.99 30.12 2joz n HIS 134 CO 0.00 0.00 0.00 1.58 0.46 0.00 0.00 176.34 178.38