#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ecz n GLU 2 N 0.00 -1.92 -0.14 0.00 0.28 -1.26 -4.78 120.64 112.83 1ecz n GLU 2 Ca 0.00 1.41 0.12 0.00 -0.16 0.00 0.00 57.16 58.52 1ecz n GLU 2 Cb 0.00 -2.54 0.22 0.00 1.43 0.00 0.00 31.44 30.55 1ecz n GLU 2 CO 0.00 0.00 0.00 0.43 -0.16 0.00 0.00 177.13 177.40 1ecz n SER 3 N -0.58 0.10 -4.29 -1.84 7.64 -1.26 -3.98 113.62 109.40 1ecz n SER 3 Ca -0.10 0.70 -0.28 0.00 1.01 0.00 0.00 58.87 60.20 1ecz n SER 3 Cb 0.66 -0.32 -0.15 0.00 -1.01 0.00 0.00 64.21 63.39 1ecz n SER 3 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1ecz s VAL 4 N -4.78 1.90 0.00 0.44 0.11 -1.26 -5.14 120.40 111.67 1ecz s VAL 4 Ca -0.04 -1.22 0.00 0.00 -2.93 0.00 0.00 61.98 57.78 1ecz s VAL 4 Cb 0.14 -1.62 0.00 0.00 -1.53 0.00 0.00 36.38 33.36 1ecz s VAL 4 CO 0.33 0.35 0.00 0.00 -3.33 0.00 0.00 175.10 172.45 1ecz n GLN 5 N 1.99 0.00 -1.60 1.54 3.00 -1.26 -4.97 117.38 116.08 1ecz n GLN 5 Ca -0.17 0.00 -0.62 0.00 -0.01 0.00 0.00 57.00 56.20 1ecz n GLN 5 Cb 0.52 0.00 -0.09 0.00 0.00 0.00 0.00 30.24 30.67 1ecz n GLN 5 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.06 174.76 1ecz n PRO 6 N 0.00 0.38 -0.25 -1.09 -0.02 -1.26 -4.79 135.00 127.96 1ecz n PRO 6 Ca 0.00 0.13 0.16 0.00 -2.02 0.00 0.00 63.50 61.78 1ecz n PRO 6 Cb 0.00 -1.73 0.46 0.00 -0.02 0.00 0.00 33.50 32.21 1ecz n PRO 6 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 1ecz h LEU 7 N 7.09 0.50 -0.70 2.45 5.85 -1.94 0.18 115.31 128.74 1ecz h LEU 7 Ca -0.36 0.05 -0.12 0.00 0.84 0.00 0.00 57.88 58.29 1ecz h LEU 7 Cb 1.36 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 42.33 1ecz h LEU 7 CO 1.00 0.22 -0.34 -0.33 -0.34 0.00 0.00 178.44 178.65 1ecz h GLU 8 N 0.51 0.62 -1.96 1.25 4.39 -1.87 -3.00 114.58 114.52 1ecz h GLU 8 Ca 0.47 -0.29 -0.19 0.00 0.34 0.00 0.00 59.36 59.69 1ecz h GLU 8 Cb 1.01 -0.01 -0.07 0.00 -0.10 0.00 0.00 28.75 29.58 1ecz h GLU 8 CO -0.20 0.87 -0.11 1.63 -1.16 0.00 0.00 179.01 180.04 1ecz n LYS 9 N -4.06 1.75 0.07 2.33 5.02 0.64 -3.12 118.16 120.79 1ecz n LYS 9 Ca -0.01 -0.94 0.00 0.00 -2.02 0.00 0.00 58.31 55.34 1ecz n LYS 9 Cb 0.48 -1.71 0.00 0.00 -0.02 0.00 0.00 35.03 33.79 1ecz n LYS 9 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 1ecz n ILE 10 N 1.83 0.00 -3.56 -0.18 5.41 -1.15 -4.79 119.36 116.92 1ecz n ILE 10 Ca 0.31 0.00 -0.13 0.00 1.00 0.00 0.00 62.75 63.92 1ecz n ILE 10 Cb 0.73 -0.28 -0.06 0.00 -0.71 0.00 0.00 39.64 39.32 1ecz n ILE 10 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1ecz s ALA 11 N -2.00 -1.87 0.00 -1.39 0.00 -1.15 -5.05 121.76 110.30 1ecz s ALA 11 Ca 0.00 1.51 -0.03 0.00 0.00 0.00 0.00 51.96 53.44 1ecz s ALA 11 Cb 0.00 -0.50 -0.13 0.00 0.00 0.00 0.00 23.12 22.50 1ecz s ALA 11 CO 0.00 -0.33 1.98 -0.35 0.00 0.00 0.00 175.76 177.06 1ecz n PRO 12 N 0.88 0.94 -1.76 0.00 -0.04 -1.26 -4.39 135.00 129.37 1ecz n PRO 12 Ca -0.13 -0.47 -0.42 0.00 -0.04 0.00 0.00 63.50 62.43 1ecz n PRO 12 Cb 0.57 -1.73 -0.03 0.00 -0.04 0.00 0.00 33.50 32.27 1ecz n PRO 12 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 1ecz s TYR 13 N 2.05 2.73 0.46 0.54 2.02 -1.26 -4.92 117.35 118.97 1ecz s TYR 13 Ca 0.32 0.29 -0.22 0.00 -0.37 0.00 0.00 57.07 57.09 1ecz s TYR 13 Cb 0.15 -4.12 -0.11 0.00 -0.40 0.00 0.00 41.96 37.49 1ecz s TYR 13 CO 0.00 -4.32 0.66 -2.30 -1.57 0.00 0.00 175.55 168.02 1ecz n PRO 14 N 4.45 0.74 -2.17 -1.71 -0.02 -1.26 -4.97 135.00 130.06 1ecz n PRO 14 Ca 0.16 0.27 -0.32 0.00 -2.02 0.00 0.00 63.50 61.60 1ecz n PRO 14 Cb 0.36 -1.69 -0.01 0.00 -0.02 0.00 0.00 33.50 32.14 1ecz n PRO 14 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 1ecz s GLN 15 N -1.83 3.78 0.14 -0.52 -1.52 -1.26 -4.99 119.66 113.45 1ecz s GLN 15 Ca 0.65 0.88 -0.31 0.00 -1.95 0.00 0.00 55.36 54.63 1ecz s GLN 15 Cb -0.55 -2.11 -0.11 0.00 -0.22 0.00 0.00 33.01 30.03 1ecz s GLN 15 CO 0.56 -0.42 1.80 0.00 -0.25 0.00 0.00 175.29 176.98 1ecz s ALA 16 N -2.85 3.79 1.00 6.09 0.00 -1.26 -4.99 121.76 123.55 1ecz s ALA 16 Ca 0.57 1.46 0.00 0.00 0.00 0.00 0.00 51.96 54.00 1ecz s ALA 16 Cb -0.11 -3.74 0.00 0.00 0.00 0.00 0.00 23.12 19.27 1ecz s ALA 16 CO 0.41 -1.15 0.00 -1.91 0.00 0.00 0.00 175.76 173.10 1ecz n GLU 17 N 5.32 2.15 -3.52 0.00 2.13 -1.17 -5.00 120.64 120.55 1ecz n GLU 17 Ca 0.17 0.00 -0.42 0.00 0.66 0.00 0.00 57.16 57.57 1ecz n GLU 17 Cb 0.38 0.00 -0.10 0.00 0.27 0.00 0.00 31.44 31.99 1ecz n GLU 17 CO 0.00 0.00 0.00 0.21 -0.41 0.00 0.00 177.13 176.93 1ecz s LYS 18 N 0.00 2.87 0.00 5.31 2.20 -1.26 -4.21 119.74 124.65 1ecz s LYS 18 Ca 0.00 -1.16 0.00 0.00 -0.36 0.00 0.00 55.97 54.45 1ecz s LYS 18 Cb 0.00 -3.89 0.00 0.00 -1.51 0.00 0.00 37.83 32.43 1ecz s LYS 18 CO 0.00 -0.81 0.00 0.41 -0.36 0.00 0.00 175.35 174.59 1ecz n GLY 19 N 5.08 1.54 3.59 5.54 0.00 -1.26 -5.05 105.19 114.63 1ecz n GLY 19 Ca -0.11 -0.07 -0.01 0.00 0.00 0.00 0.00 46.02 45.83 1ecz n GLY 19 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 1ecz s MET 20 N -0.82 0.29 0.66 1.61 0.23 -1.26 -1.32 119.30 118.68 1ecz s MET 20 Ca 0.00 0.53 -0.03 0.00 -1.03 0.00 0.00 55.69 55.16 1ecz s MET 20 Cb 0.00 0.12 0.14 0.00 -1.53 0.00 0.00 34.83 33.56 1ecz s MET 20 CO 0.00 -0.07 0.90 0.36 -2.03 0.00 0.00 175.02 174.18 1ecz n LYS 21 N 3.82 -0.23 -3.97 3.16 2.85 -0.71 -3.06 118.16 120.02 1ecz n LYS 21 Ca -0.16 -2.17 -0.31 0.00 -1.05 0.00 0.00 58.31 54.61 1ecz n LYS 21 Cb 0.56 -0.69 -0.15 0.00 -0.65 0.00 0.00 35.03 34.11 1ecz n LYS 21 CO 0.00 0.00 0.00 0.50 -0.05 0.00 0.00 177.40 177.85 1ecz s ARG 22 N -4.84 1.54 -0.17 -1.58 3.52 -1.26 -3.46 118.95 112.69 1ecz s ARG 22 Ca 0.57 -1.50 -0.28 0.00 -0.13 0.00 0.00 55.73 54.40 1ecz s ARG 22 Cb -0.03 -2.86 -0.01 0.00 -1.56 0.00 0.00 34.95 30.50 1ecz s ARG 22 CO 0.39 -0.82 0.95 -0.65 -0.81 0.00 0.00 175.30 174.36 1ecz s GLN 23 N 1.13 4.32 -0.26 5.12 -1.52 0.67 -4.94 119.66 124.19 1ecz s GLN 23 Ca 0.04 1.24 0.03 0.00 -1.95 0.00 0.00 55.36 54.72 1ecz s GLN 23 Cb -0.19 -3.59 0.06 0.00 -0.22 0.00 0.00 33.01 29.08 1ecz s GLN 23 CO -0.10 -0.42 -0.10 0.08 -0.25 0.00 0.00 175.29 174.51 1ecz s VAL 24 N 2.43 2.08 -0.27 1.09 1.01 -1.26 0.04 120.40 125.52 1ecz s VAL 24 Ca 0.43 -1.59 -0.10 0.00 0.00 0.00 0.00 61.98 60.72 1ecz s VAL 24 Cb -0.17 -2.22 -0.05 0.00 0.00 0.00 0.00 36.38 33.95 1ecz s VAL 24 CO 0.12 -0.05 0.16 -0.63 0.00 0.00 0.00 175.10 174.71 1ecz s ILE 25 N 1.14 5.12 -0.26 2.22 1.09 0.18 -4.97 121.20 125.72 1ecz s ILE 25 Ca -0.08 0.11 0.01 0.00 -1.10 0.00 0.00 60.65 59.59 1ecz s ILE 25 Cb -0.20 -3.43 0.05 0.00 -1.06 0.00 0.00 42.46 37.83 1ecz s ILE 25 CO -0.05 0.28 -0.09 -1.58 -0.10 0.00 0.00 174.94 173.40 1ecz s GLN 26 N 1.62 2.37 -0.05 2.79 2.00 -1.26 0.73 119.66 127.86 1ecz s GLN 26 Ca 0.07 -1.27 -0.22 0.00 -2.00 0.00 0.00 55.36 51.94 1ecz s GLN 26 Cb -0.15 -2.94 -0.04 0.00 0.80 0.00 0.00 33.01 30.67 1ecz s GLN 26 CO 0.09 -0.55 0.64 -0.51 -0.50 0.00 0.00 175.29 174.46 1ecz s LEU 27 N 1.16 4.34 0.43 3.68 1.43 -1.26 -4.94 118.68 123.52 1ecz s LEU 27 Ca -0.07 1.13 -0.26 0.00 -1.03 0.00 0.00 54.13 53.91 1ecz s LEU 27 Cb -0.19 -2.98 -0.09 0.00 0.03 0.00 0.00 46.19 42.95 1ecz s LEU 27 CO -0.05 -0.03 1.42 1.07 0.23 0.00 0.00 176.35 178.99 1ecz n THR 28 N 3.43 2.59 -2.55 5.49 5.66 -1.26 -4.37 114.28 123.27 1ecz n THR 28 Ca -0.04 -0.50 -0.42 0.00 -3.05 0.00 0.00 64.05 60.04 1ecz n THR 28 Cb 0.51 -1.83 -0.03 0.00 -1.55 0.00 0.00 70.33 67.43 1ecz n THR 28 CO 0.00 0.00 0.00 -2.16 -3.05 0.00 0.00 175.07 169.86 1ecz s PRO 29 N -2.33 4.45 0.39 1.09 0.04 -1.26 -4.77 135.00 132.61 1ecz s PRO 29 Ca 0.59 1.60 0.08 0.00 0.04 0.00 0.00 61.00 63.31 1ecz s PRO 29 Cb -0.46 -3.45 -0.04 0.00 0.04 0.00 0.00 34.50 30.59 1ecz s PRO 29 CO 0.59 -0.24 0.26 -0.65 0.04 0.00 0.00 177.00 177.00 1ecz s GLN 30 N 1.41 2.43 0.25 4.56 -1.52 -1.26 -5.04 119.66 120.50 1ecz s GLN 30 Ca 0.55 -1.61 0.00 0.00 -1.95 0.00 0.00 55.36 52.36 1ecz s GLN 30 Cb -0.25 -2.23 0.32 0.00 -0.22 0.00 0.00 33.01 30.64 1ecz s GLN 30 CO 0.26 -0.08 1.67 0.93 -0.25 0.00 0.00 175.29 177.82 1ecz h GLU 31 N 1.28 0.55 -3.04 2.91 5.08 -2.06 -3.41 114.58 115.89 1ecz h GLU 31 Ca -0.43 -0.23 -0.44 0.00 -1.00 0.00 0.00 59.36 57.27 1ecz h GLU 31 Cb 1.26 -0.02 -0.40 0.00 0.50 0.00 0.00 28.75 30.08 1ecz h GLU 31 CO 0.62 0.78 -0.74 0.34 -1.00 0.00 0.00 179.01 179.02 1ecz s ASP 32 N -6.81 2.11 0.00 1.42 -1.08 -1.26 -5.00 116.67 106.05 1ecz s ASP 32 Ca -0.07 -0.49 0.15 0.00 -0.52 0.00 0.00 52.55 51.61 1ecz s ASP 32 Cb 0.13 -0.17 0.42 0.00 -1.46 0.00 0.00 42.92 41.84 1ecz s ASP 32 CO 0.81 -0.34 1.35 -0.62 0.52 0.00 0.00 175.17 176.89 1ecz n GLU 33 N 5.29 2.75 0.02 4.34 1.02 -1.26 -4.36 120.64 128.44 1ecz n GLU 33 Ca -0.06 -2.25 -0.08 0.00 -0.02 0.00 0.00 57.16 54.75 1ecz n GLU 33 Cb 0.49 -1.38 -0.13 0.00 -0.02 0.00 0.00 31.44 30.40 1ecz n GLU 33 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 1ecz h SER 34 N 2.88 0.01 0.98 1.62 4.64 -1.95 -3.22 113.55 118.53 1ecz h SER 34 Ca 0.00 -0.02 -0.10 0.00 -0.47 0.00 0.00 61.79 61.20 1ecz h SER 34 Cb 0.82 -0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.89 1ecz h SER 34 CO 0.00 1.02 -0.48 0.71 -0.87 0.00 0.00 176.83 177.20 1ecz h THR 35 N 0.00 1.01 -4.06 2.95 1.35 -1.96 -3.45 112.91 108.75 1ecz h THR 35 Ca -0.15 -1.91 -0.49 0.00 -0.55 0.00 0.00 66.41 63.31 1ecz h THR 35 Cb 1.90 2.14 0.02 0.00 -1.73 0.00 0.00 68.15 70.48 1ecz h THR 35 CO 0.11 0.47 0.30 -0.76 -0.25 0.00 0.00 175.52 175.39 1ecz s LEU 36 N -6.95 3.60 0.02 3.87 1.43 -1.21 -2.30 118.68 117.14 1ecz s LEU 36 Ca 0.01 1.39 -0.12 0.00 -1.03 0.00 0.00 54.13 54.38 1ecz s LEU 36 Cb 0.10 -4.34 0.01 0.00 0.03 0.00 0.00 46.19 42.00 1ecz s LEU 36 CO 0.72 -0.59 0.25 -0.54 0.23 0.00 0.00 176.35 176.42 1ecz s LYS 37 N -4.26 0.71 -0.15 1.70 1.02 -0.82 -3.95 119.74 114.00 1ecz s LYS 37 Ca 0.56 -0.46 0.02 0.00 0.02 0.00 0.00 55.97 56.10 1ecz s LYS 37 Cb -0.10 0.30 0.01 0.00 -0.52 0.00 0.00 37.83 37.52 1ecz s LYS 37 CO 0.36 -0.21 -0.21 0.54 -0.92 0.00 0.00 175.35 174.91 1ecz s VAL 38 N -2.15 2.12 -0.34 3.17 0.11 0.11 -0.86 120.40 122.56 1ecz s VAL 38 Ca -0.08 -0.95 -0.21 0.00 -2.93 0.00 0.00 61.98 57.81 1ecz s VAL 38 Cb -0.03 -1.86 0.00 0.00 -1.53 0.00 0.00 36.38 32.97 1ecz s VAL 38 CO -0.01 0.54 0.65 -0.70 -3.33 0.00 0.00 175.10 172.26 1ecz s GLU 39 N 0.88 3.76 -0.02 1.54 2.12 0.13 -1.38 118.70 125.72 1ecz s GLU 39 Ca -0.05 0.16 -0.24 0.00 0.36 0.00 0.00 54.97 55.20 1ecz s GLU 39 Cb -0.15 -3.78 -0.04 0.00 0.26 0.00 0.00 34.13 30.41 1ecz s GLU 39 CO -0.03 -0.70 0.72 -0.51 -0.54 0.00 0.00 175.26 174.20 1ecz s LEU 40 N 2.73 4.38 -0.21 2.70 1.43 -0.07 -1.55 118.68 128.08 1ecz s LEU 40 Ca 0.26 1.29 0.01 0.00 -1.03 0.00 0.00 54.13 54.66 1ecz s LEU 40 Cb -0.14 -3.14 0.04 0.00 0.03 0.00 0.00 46.19 42.98 1ecz s LEU 40 CO 0.14 -0.05 -0.12 -0.76 0.23 0.00 0.00 176.35 175.79 1ecz s LEU 41 N 0.40 2.56 -0.52 1.79 1.43 -0.17 -4.83 118.68 119.35 1ecz s LEU 41 Ca 0.38 -0.99 0.04 0.00 -1.03 0.00 0.00 54.13 52.53 1ecz s LEU 41 Cb -0.19 -1.35 0.13 0.00 0.03 0.00 0.00 46.19 44.81 1ecz s LEU 41 CO 0.20 -0.13 0.26 -0.63 0.23 0.00 0.00 176.35 176.27 1ecz s ILE 42 N 1.30 2.62 0.00 -0.59 1.01 -1.26 -0.34 121.20 123.94 1ecz s ILE 42 Ca -0.02 -3.28 0.00 0.00 0.00 0.00 0.00 60.65 57.35 1ecz s ILE 42 Cb -0.17 -2.82 0.00 0.00 0.01 0.00 0.00 42.46 39.48 1ecz s ILE 42 CO -0.08 -0.79 0.00 0.61 0.00 0.00 0.00 174.94 174.67 1ecz n GLY 43 N 3.16 4.09 3.25 6.18 0.00 -1.16 -1.02 105.19 119.68 1ecz n GLY 43 Ca 0.05 -1.24 -0.11 0.00 0.00 0.00 0.00 46.02 44.72 1ecz n GLY 43 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1ecz s GLN 44 N 0.22 0.38 -0.20 1.61 -2.07 -0.96 -1.11 119.66 117.54 1ecz s GLN 44 Ca 0.00 0.69 -0.28 0.00 -1.82 0.00 0.00 55.36 53.95 1ecz s GLN 44 Cb 0.00 0.03 -0.05 0.00 -1.09 0.00 0.00 33.01 31.90 1ecz s GLN 44 CO 0.00 -0.13 2.14 0.99 -1.32 0.00 0.00 175.29 176.97 1ecz s THR 45 N 1.07 3.06 0.37 3.63 2.01 -1.26 -2.51 115.64 122.01 1ecz s THR 45 Ca -0.07 0.07 0.05 0.00 0.31 0.00 0.00 61.69 62.04 1ecz s THR 45 Cb -0.07 -3.08 -0.06 0.00 0.01 0.00 0.00 72.50 69.30 1ecz s THR 45 CO -0.09 -0.05 0.05 -0.76 -0.69 0.00 0.00 174.62 173.08 1ecz s LEU 46 N 7.69 2.39 -0.32 4.42 1.43 -0.96 -4.89 118.68 128.43 1ecz s LEU 46 Ca 0.97 -1.42 -0.05 0.00 -1.03 0.00 0.00 54.13 52.59 1ecz s LEU 46 Cb -0.33 -0.54 0.03 0.00 0.03 0.00 0.00 46.19 45.38 1ecz s LEU 46 CO 0.36 -0.61 0.07 -0.70 0.23 0.00 0.00 176.35 175.70 1ecz s GLU 47 N -3.82 2.71 0.27 1.70 2.12 -1.26 -1.02 118.70 119.41 1ecz s GLU 47 Ca 0.33 -1.10 0.01 0.00 0.36 0.00 0.00 54.97 54.56 1ecz s GLU 47 Cb 0.08 -3.36 -0.00 0.00 0.26 0.00 0.00 34.13 31.10 1ecz s GLU 47 CO 0.15 -0.59 0.04 1.33 -0.54 0.00 0.00 175.26 175.65 1ecz n VAL 48 N 4.79 0.00 0.00 3.70 0.24 -1.10 -4.95 118.33 121.01 1ecz n VAL 48 Ca -0.13 -1.37 0.00 0.00 -2.04 0.00 0.00 64.34 60.79 1ecz n VAL 48 Cb 0.45 0.37 0.00 0.00 -1.47 0.00 0.00 33.84 33.19 1ecz n VAL 48 CO 0.00 0.00 0.00 -0.90 -2.14 0.00 0.00 176.83 173.79 1ecz n ASP 49 N -1.42 0.00 0.07 -1.34 5.68 -1.26 -2.63 116.55 115.65 1ecz n ASP 49 Ca -0.08 0.00 -0.22 0.00 -0.50 0.00 0.00 54.79 53.99 1ecz n ASP 49 Cb 0.36 0.00 -0.15 0.00 -1.14 0.00 0.00 41.12 40.19 1ecz n ASP 49 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1ecz s ASN 51 N -7.16 4.81 0.42 0.00 2.20 -1.26 -4.99 114.94 108.96 1ecz s ASN 51 Ca -0.13 2.25 -0.23 0.00 -0.94 0.00 0.00 52.86 53.80 1ecz s ASN 51 Cb 0.02 -2.58 -0.09 0.00 -2.00 0.00 0.00 41.25 36.61 1ecz s ASN 51 CO 0.85 -1.84 1.05 -1.48 -2.94 0.00 0.00 177.10 172.74 1ecz s LEU 52 N -4.71 4.06 0.08 3.54 2.34 -1.26 -4.97 118.68 117.76 1ecz s LEU 52 Ca 0.73 2.01 0.08 0.00 0.06 0.00 0.00 54.13 57.01 1ecz s LEU 52 Cb -0.26 -4.29 -0.03 0.00 -0.56 0.00 0.00 46.19 41.04 1ecz s LEU 52 CO 0.40 -0.58 -0.20 -1.00 -1.06 0.00 0.00 176.35 173.91 1ecz s HIS 53 N -1.74 1.72 -0.04 3.48 3.76 -1.26 -3.74 115.29 117.46 1ecz s HIS 53 Ca 0.60 -0.41 0.04 0.00 -0.15 0.00 0.00 55.06 55.15 1ecz s HIS 53 Cb -0.21 -0.96 -0.00 0.00 1.11 0.00 0.00 32.58 32.52 1ecz s HIS 53 CO 0.26 0.16 -0.16 0.50 -0.85 0.00 0.00 174.74 174.65 1ecz s ARG 54 N -1.70 1.72 0.33 1.40 3.52 -1.15 -4.71 118.95 118.35 1ecz s ARG 54 Ca 0.06 -0.57 -0.16 0.00 -0.13 0.00 0.00 55.73 54.93 1ecz s ARG 54 Cb -0.10 -1.49 -0.09 0.00 -1.56 0.00 0.00 34.95 31.71 1ecz s ARG 54 CO 0.03 0.21 0.75 -1.17 -0.81 0.00 0.00 175.30 174.32 1ecz s LEU 55 N 0.11 4.07 0.14 -0.88 2.96 -0.65 -0.50 118.68 123.94 1ecz s LEU 55 Ca -0.05 1.32 -0.04 0.00 -0.22 0.00 0.00 54.13 55.14 1ecz s LEU 55 Cb -0.12 -4.09 -0.05 0.00 0.50 0.00 0.00 46.19 42.43 1ecz s LEU 55 CO 0.02 -0.20 0.37 -0.83 -1.32 0.00 0.00 176.35 174.38 1ecz s GLY 56 N -2.23 2.20 0.00 7.98 0.00 -1.15 -4.12 107.32 110.00 1ecz s GLY 56 Ca 0.54 -0.60 0.00 0.00 0.00 0.00 0.00 44.72 44.66 1ecz s GLY 56 CO 0.17 -0.53 0.00 0.61 0.00 0.00 0.00 173.10 173.35 1ecz n GLY 57 N 0.03 4.62 3.76 0.20 0.00 -1.18 -1.91 105.19 110.71 1ecz n GLY 57 Ca -0.03 -0.70 -0.35 0.00 0.00 0.00 0.00 46.02 44.94 1ecz n GLY 57 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1ecz s LYS 58 N -3.67 3.97 -0.22 1.61 2.20 -0.89 -4.82 119.74 117.92 1ecz s LYS 58 Ca 0.00 -0.21 -0.09 0.00 -0.36 0.00 0.00 55.97 55.31 1ecz s LYS 58 Cb 0.00 -3.34 -0.04 0.00 -1.51 0.00 0.00 37.83 32.94 1ecz s LYS 58 CO 0.00 0.42 0.12 -1.17 -0.36 0.00 0.00 175.35 174.36 1ecz s LEU 59 N 0.01 3.93 -0.10 5.43 2.96 -1.26 -2.33 118.68 127.32 1ecz s LEU 59 Ca 0.09 0.05 0.02 0.00 -0.22 0.00 0.00 54.13 54.08 1ecz s LEU 59 Cb -0.11 -2.04 0.01 0.00 0.50 0.00 0.00 46.19 44.55 1ecz s LEU 59 CO -0.00 0.08 -0.15 -1.83 -1.32 0.00 0.00 176.35 173.13 1ecz s GLU 60 N 0.94 2.11 0.13 1.98 -1.05 -0.31 -4.95 118.70 117.56 1ecz s GLU 60 Ca 0.06 -0.53 -0.30 0.00 -0.15 0.00 0.00 54.97 54.05 1ecz s GLU 60 Cb -0.13 -1.79 -0.07 0.00 -0.44 0.00 0.00 34.13 31.70 1ecz s GLU 60 CO 0.03 -0.04 1.15 1.21 0.95 0.00 0.00 175.26 178.56 1ecz s ASN 61 N 0.92 7.17 -0.05 0.83 3.84 -1.26 -1.00 114.94 125.39 1ecz s ASN 61 Ca -0.08 2.07 -0.01 0.00 0.21 0.00 0.00 52.86 55.05 1ecz s ASN 61 Cb -0.15 -2.59 0.03 0.00 -0.55 0.00 0.00 41.25 37.98 1ecz s ASN 61 CO -0.00 -0.34 0.02 -0.54 -2.79 0.00 0.00 177.10 173.44 1ecz s LYS 62 N 0.24 0.31 0.43 0.43 1.02 0.15 -4.96 119.74 117.36 1ecz s LYS 62 Ca 0.54 0.16 -0.11 0.00 0.02 0.00 0.00 55.97 56.58 1ecz s LYS 62 Cb -0.30 -0.65 -0.06 0.00 -0.52 0.00 0.00 37.83 36.30 1ecz s LYS 62 CO 0.33 -0.24 0.81 -0.08 -0.92 0.00 0.00 175.35 175.25 1ecz s THR 63 N 1.61 4.76 -0.58 2.17 -1.32 -1.26 -1.61 115.64 119.42 1ecz s THR 63 Ca -0.01 0.68 -0.21 0.00 -1.21 0.00 0.00 61.69 60.93 1ecz s THR 63 Cb -0.13 -3.75 0.06 0.00 -1.51 0.00 0.00 72.50 67.18 1ecz s THR 63 CO -0.03 -0.60 0.82 -0.22 -2.21 0.00 0.00 174.62 172.38 1ecz s LEU 64 N -4.01 4.64 0.44 9.08 2.96 0.48 -4.89 118.68 127.38 1ecz s LEU 64 Ca 0.52 -0.88 -0.24 0.00 -0.22 0.00 0.00 54.13 53.31 1ecz s LEU 64 Cb -0.10 -2.51 -0.09 0.00 0.50 0.00 0.00 46.19 43.98 1ecz s LEU 64 CO 0.33 -1.18 1.15 -1.84 -1.32 0.00 0.00 176.35 173.50 1ecz n GLU 65 N 6.99 1.61 -0.54 1.98 0.28 -1.26 0.15 120.64 129.85 1ecz n GLU 65 Ca -0.04 0.58 0.00 0.00 -0.16 0.00 0.00 57.16 57.54 1ecz n GLU 65 Cb 0.45 -2.24 0.00 0.00 1.43 0.00 0.00 31.44 31.08 1ecz n GLU 65 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1ecz n GLY 66 N 0.99 1.52 0.00 -1.84 0.00 -1.26 -4.59 105.19 100.02 1ecz n GLY 66 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.10 1ecz n GLY 66 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1ecz n TRP 67 N -2.00 0.00 -1.27 1.61 7.02 -0.74 -5.05 117.44 117.01 1ecz n TRP 67 Ca 0.00 0.00 -0.09 0.00 -1.02 0.00 0.00 57.50 56.39 1ecz n TRP 67 Cb 0.00 0.00 -0.04 0.00 -2.42 0.00 0.00 31.31 28.85 1ecz n TRP 67 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1ecz n GLY 68 N 0.63 1.09 3.83 6.99 0.00 0.40 -4.97 105.19 113.16 1ecz n GLY 68 Ca 0.00 -0.43 -0.33 0.00 0.00 0.00 0.00 46.02 45.26 1ecz n GLY 68 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1ecz s TYR 69 N -2.27 3.31 -0.18 1.61 1.51 -1.20 -4.67 117.35 115.46 1ecz s TYR 69 Ca 0.00 1.54 -0.08 0.00 -1.01 0.00 0.00 57.07 57.52 1ecz s TYR 69 Cb 0.00 -2.86 -0.04 0.00 -0.11 0.00 0.00 41.96 38.94 1ecz s TYR 69 CO 0.00 -0.39 0.07 -0.51 -1.11 0.00 0.00 175.55 173.61 1ecz s ASP 70 N -2.59 5.73 0.04 2.29 1.11 -1.26 0.18 116.67 122.17 1ecz s ASP 70 Ca 0.61 0.11 -0.05 0.00 0.18 0.00 0.00 52.55 53.41 1ecz s ASP 70 Cb -0.11 -1.98 -0.01 0.00 1.07 0.00 0.00 42.92 41.88 1ecz s ASP 70 CO 0.24 0.18 0.08 -0.72 1.18 0.00 0.00 175.17 176.12 1ecz s TYR 71 N 0.34 0.22 0.25 4.23 -0.85 -0.63 -4.34 117.35 116.57 1ecz s TYR 71 Ca 0.04 -0.53 0.11 0.00 -0.52 0.00 0.00 57.07 56.17 1ecz s TYR 71 Cb -0.12 -0.16 -0.05 0.00 0.38 0.00 0.00 41.96 42.01 1ecz s TYR 71 CO -0.00 -0.35 -0.14 0.71 -1.52 0.00 0.00 175.55 174.25 1ecz s TYR 72 N -2.53 2.44 -0.01 -3.49 1.51 -0.50 0.30 117.35 115.06 1ecz s TYR 72 Ca -0.06 -0.29 0.05 0.00 -1.01 0.00 0.00 57.07 55.76 1ecz s TYR 72 Cb -0.02 -1.10 -0.01 0.00 -0.11 0.00 0.00 41.96 40.72 1ecz s TYR 72 CO -0.04 0.64 -0.16 0.08 -1.11 0.00 0.00 175.55 174.96 1ecz s VAL 73 N -2.26 1.27 -0.21 0.71 1.01 -0.17 -0.50 120.40 120.25 1ecz s VAL 73 Ca 0.29 -0.70 0.00 0.00 0.00 0.00 0.00 61.98 61.57 1ecz s VAL 73 Cb -0.06 -1.06 0.05 0.00 0.00 0.00 0.00 36.38 35.31 1ecz s VAL 73 CO 0.16 0.35 -0.06 0.12 0.00 0.00 0.00 175.10 175.67 1ecz s PHE 74 N -0.39 2.25 0.00 5.22 5.36 0.72 -1.16 117.98 129.97 1ecz s PHE 74 Ca 0.06 -1.59 0.00 0.00 -0.96 0.00 0.00 56.93 54.45 1ecz s PHE 74 Cb -0.06 -1.53 0.00 0.00 -0.34 0.00 0.00 43.02 41.09 1ecz s PHE 74 CO -0.01 -0.74 0.00 -0.40 -1.46 0.00 0.00 175.22 172.62 1ecz n ASP 75 N 4.72 1.30 -1.35 6.13 5.75 -0.99 -3.86 116.55 128.25 1ecz n ASP 75 Ca -0.12 -0.32 -0.12 0.00 -0.01 0.00 0.00 54.79 54.21 1ecz n ASP 75 Cb 0.45 0.00 -0.05 0.00 -1.03 0.00 0.00 41.12 40.49 1ecz n ASP 75 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 1ecz n LYS 76 N 0.00 -1.27 -1.51 0.11 5.02 -1.26 -2.08 118.16 117.17 1ecz n LYS 76 Ca 0.00 0.71 -0.45 0.00 -2.02 0.00 0.00 58.31 56.55 1ecz n LYS 76 Cb 0.00 -4.94 -0.06 0.00 -0.02 0.00 0.00 35.03 30.01 1ecz n LYS 76 CO 0.00 0.00 0.00 1.55 -0.52 0.00 0.00 177.40 178.43 1ecz n VAL 77 N -1.80 0.16 -3.75 -0.18 3.14 -1.24 -3.12 118.33 111.55 1ecz n VAL 77 Ca -0.12 -0.40 -0.22 0.00 -2.96 0.00 0.00 64.34 60.64 1ecz n VAL 77 Cb 0.40 -2.03 -0.04 0.00 -1.06 0.00 0.00 33.84 31.11 1ecz n VAL 77 CO 0.00 0.00 0.00 -0.94 -6.46 0.00 0.00 176.83 169.43 1ecz s SER 78 N 8.67 4.97 0.24 6.55 1.04 -0.80 -4.90 113.70 129.46 1ecz s SER 78 Ca 1.07 -0.75 -0.31 0.00 0.48 0.00 0.00 55.95 56.44 1ecz s SER 78 Cb -0.62 -0.65 -0.12 0.00 0.10 0.00 0.00 66.02 64.73 1ecz s SER 78 CO 0.41 -0.54 1.66 -0.24 0.98 0.00 0.00 173.24 175.51 1ecz n SER 79 N -1.43 3.84 -4.48 7.02 2.88 -1.26 -2.94 113.62 117.25 1ecz n SER 79 Ca 0.01 1.10 -0.46 0.00 -1.33 0.00 0.00 58.87 58.19 1ecz n SER 79 Cb 0.62 -1.57 -0.07 0.00 -0.75 0.00 0.00 64.21 62.44 1ecz n SER 79 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 1ecz n PRO 80 N 3.21 0.98 -2.12 -1.46 -0.04 -1.26 -4.49 135.00 129.82 1ecz n PRO 80 Ca 0.13 0.21 -0.42 0.00 -0.04 0.00 0.00 63.50 63.38 1ecz n PRO 80 Cb 0.35 -2.58 -0.03 0.00 -0.04 0.00 0.00 33.50 31.21 1ecz n PRO 80 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1ecz s VAL 81 N 8.59 3.59 0.46 0.52 -7.23 0.35 -4.64 120.40 122.05 1ecz s VAL 81 Ca 1.10 0.58 0.02 0.00 -1.81 0.00 0.00 61.98 61.88 1ecz s VAL 81 Cb -0.74 -3.86 -0.02 0.00 0.56 0.00 0.00 36.38 32.31 1ecz s VAL 81 CO 0.44 -0.59 0.05 -0.94 -0.31 0.00 0.00 175.10 173.75 1ecz s SER 82 N 5.63 3.59 0.72 4.85 1.04 -1.26 -2.92 113.70 125.35 1ecz s SER 82 Ca 0.72 -1.65 0.02 0.00 0.48 0.00 0.00 55.95 55.52 1ecz s SER 82 Cb -0.18 0.46 0.14 0.00 0.10 0.00 0.00 66.02 66.54 1ecz s SER 82 CO 0.32 -0.86 0.99 0.35 0.98 0.00 0.00 173.24 175.02 1ecz n THR 83 N -1.11 0.00 -3.45 2.02 -2.24 -1.25 -5.05 114.28 103.21 1ecz n THR 83 Ca -0.13 -1.68 -0.22 0.00 -2.27 0.00 0.00 64.05 59.75 1ecz n THR 83 Cb 0.66 -0.82 -0.12 0.00 -2.10 0.00 0.00 70.33 67.96 1ecz n THR 83 CO 0.00 0.00 0.00 -0.04 -0.57 0.00 0.00 175.07 174.46 1ecz s MET 84 N -5.10 0.29 0.00 -0.78 1.00 -1.26 -4.97 119.30 108.48 1ecz s MET 84 Ca 0.67 -0.33 0.16 0.00 0.00 0.00 0.00 55.69 56.19 1ecz s MET 84 Cb -0.04 -0.86 0.16 0.00 0.00 0.00 0.00 34.83 34.10 1ecz s MET 84 CO 0.44 -1.03 1.05 -1.33 0.00 0.00 0.00 175.02 174.15 1ecz n MET 85 N 5.23 1.41 -2.60 2.03 2.81 -1.26 -5.00 117.12 119.75 1ecz n MET 85 Ca -0.03 -1.55 -0.09 0.00 -1.81 0.00 0.00 57.70 54.22 1ecz n MET 85 Cb 0.44 -1.32 0.04 0.00 -0.71 0.00 0.00 33.22 31.68 1ecz n MET 85 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1ecz n ALA 86 N 0.91 -1.53 -0.39 3.04 0.00 -1.26 -5.03 120.51 116.24 1ecz n ALA 86 Ca 0.10 0.05 -0.27 0.00 0.00 0.00 0.00 53.44 53.32 1ecz n ALA 86 Cb 0.41 -3.06 0.24 0.00 0.00 0.00 0.00 19.45 17.04 1ecz n ALA 86 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ecz n PRO 88 N -4.18 0.13 0.00 0.00 -0.04 -1.26 -4.63 135.00 125.02 1ecz n PRO 88 Ca 0.08 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.54 1ecz n PRO 88 Cb 0.52 -1.03 0.00 0.00 -0.04 0.00 0.00 33.50 32.95 1ecz n PRO 88 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1ecz n ASP 89 N -0.07 0.00 0.00 3.54 -0.08 -1.26 -4.77 116.55 113.90 1ecz n ASP 89 Ca 0.00 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.28 1ecz n ASP 89 Cb 0.01 -0.52 0.00 0.00 2.34 0.00 0.00 41.12 42.95 1ecz n ASP 89 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1ecz n GLY 90 N -1.83 3.59 2.27 0.27 0.00 -1.26 -4.86 105.19 103.37 1ecz n GLY 90 Ca 0.00 -0.60 -0.12 0.00 0.00 0.00 0.00 46.02 45.30 1ecz n GLY 90 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1ecz n LYS 91 N 0.00 -1.92 -2.25 1.61 3.00 -1.26 -4.57 118.16 112.76 1ecz n LYS 91 Ca 0.00 0.62 -0.41 0.00 -0.00 0.00 0.00 58.31 58.52 1ecz n LYS 91 Cb 0.00 -5.09 -0.03 0.00 0.00 0.00 0.00 35.03 29.90 1ecz n LYS 91 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.40 177.55 1ecz s LYS 92 N -4.36 4.44 0.14 1.64 1.02 -1.26 -4.67 119.74 116.69 1ecz s LYS 92 Ca 0.00 2.03 0.05 0.00 0.02 0.00 0.00 55.97 58.07 1ecz s LYS 92 Cb 0.00 -3.16 -0.04 0.00 -0.52 0.00 0.00 37.83 34.10 1ecz s LYS 92 CO 0.00 -0.13 -0.11 -1.21 -0.92 0.00 0.00 175.35 172.98 1ecz s GLU 93 N -0.84 1.05 -0.36 1.68 2.02 -1.08 -4.96 118.70 116.22 1ecz s GLU 93 Ca 0.52 -1.40 -0.20 0.00 0.02 0.00 0.00 54.97 53.91 1ecz s GLU 93 Cb -0.36 -0.70 0.00 0.00 0.10 0.00 0.00 34.13 33.17 1ecz s GLU 93 CO 0.43 0.10 0.61 0.15 0.02 0.00 0.00 175.26 176.56 1ecz s LYS 94 N -3.46 3.65 0.02 1.61 1.02 -1.26 -2.69 119.74 118.62 1ecz s LYS 94 Ca 0.15 -0.02 0.03 0.00 0.02 0.00 0.00 55.97 56.15 1ecz s LYS 94 Cb 0.00 -3.81 -0.01 0.00 -0.52 0.00 0.00 37.83 33.49 1ecz s LYS 94 CO 0.01 -0.72 -0.10 -1.59 -0.92 0.00 0.00 175.35 172.03 1ecz s LYS 95 N 2.63 0.73 -0.68 1.68 -2.85 -0.18 -4.90 119.74 116.17 1ecz s LYS 95 Ca 0.23 -0.51 -0.26 0.00 -1.00 0.00 0.00 55.97 54.43 1ecz s LYS 95 Cb -0.15 -0.68 -0.08 0.00 -2.06 0.00 0.00 37.83 34.86 1ecz s LYS 95 CO 0.15 0.17 2.23 0.12 0.10 0.00 0.00 175.35 178.12 1ecz s PHE 96 N -0.59 1.32 -0.90 1.78 5.36 -1.26 -2.28 117.98 121.41 1ecz s PHE 96 Ca 0.01 1.41 -0.21 0.00 -0.96 0.00 0.00 56.93 57.17 1ecz s PHE 96 Cb -0.06 -3.70 0.09 0.00 -0.34 0.00 0.00 43.02 39.01 1ecz s PHE 96 CO 0.00 -2.05 1.20 0.08 -1.46 0.00 0.00 175.22 172.99 1ecz s VAL 97 N 12.13 4.40 0.71 3.12 1.01 -1.05 -4.83 120.40 135.90 1ecz s VAL 97 Ca 0.86 -1.07 -0.11 0.00 0.00 0.00 0.00 61.98 61.65 1ecz s VAL 97 Cb -0.13 -4.85 0.02 0.00 0.00 0.00 0.00 36.38 31.42 1ecz s VAL 97 CO 0.15 -1.63 1.10 0.42 0.00 0.00 0.00 175.10 175.13 1ecz s THR 98 N 3.67 3.40 0.12 3.92 -4.23 -1.26 -2.28 115.64 118.98 1ecz s THR 98 Ca 0.35 0.46 0.02 0.00 -1.18 0.00 0.00 61.69 61.33 1ecz s THR 98 Cb -0.05 -3.45 -0.04 0.00 1.34 0.00 0.00 72.50 70.30 1ecz s THR 98 CO -0.05 -0.60 0.24 0.00 -0.54 0.00 0.00 174.62 173.67 1ecz s ALA 99 N -3.37 3.93 -0.77 3.99 0.00 -0.19 -1.63 121.76 123.72 1ecz s ALA 99 Ca 0.58 -0.98 -0.22 0.00 0.00 0.00 0.00 51.96 51.34 1ecz s ALA 99 Cb -0.11 -1.75 0.09 0.00 0.00 0.00 0.00 23.12 21.35 1ecz s ALA 99 CO 0.52 0.64 1.06 -0.47 0.00 0.00 0.00 175.76 177.51 1ecz s TYR 100 N -1.65 2.79 -0.39 0.00 5.04 -1.26 -4.65 117.35 117.23 1ecz s TYR 100 Ca 0.34 -0.81 0.22 0.00 -2.44 0.00 0.00 57.07 54.38 1ecz s TYR 100 Cb -0.12 -4.33 0.28 0.00 0.35 0.00 0.00 41.96 38.14 1ecz s TYR 100 CO 0.28 -1.64 1.54 -0.07 -1.34 0.00 0.00 175.55 174.32 1ecz h LEU 101 N 11.23 0.00 0.00 6.97 3.38 -1.92 -3.48 115.31 131.49 1ecz h LEU 101 Ca -0.12 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.85 1ecz h LEU 101 Cb 1.05 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.80 1ecz h LEU 101 CO 1.18 0.06 0.00 0.61 0.09 0.00 0.00 178.44 180.38 1ecz n GLY 102 N 1.12 1.35 0.15 0.83 0.00 -1.26 -2.47 105.19 104.91 1ecz n GLY 102 Ca 0.03 0.22 -0.13 0.00 0.00 0.00 0.00 46.02 46.14 1ecz n GLY 102 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 1ecz h ASP 103 N 0.00 0.50 0.33 1.61 3.58 -2.01 -3.24 116.42 117.21 1ecz h ASP 103 Ca 0.00 -0.41 0.00 0.00 0.42 0.00 0.00 57.03 57.04 1ecz h ASP 103 Cb 0.00 -0.16 0.00 0.00 1.72 0.00 0.00 39.33 40.89 1ecz h ASP 103 CO 0.00 1.22 0.00 0.00 -2.88 0.00 0.00 179.24 177.58 1ecz n ALA 104 N -2.53 1.89 -0.33 -0.78 0.00 -1.03 -3.05 120.51 114.67 1ecz n ALA 104 Ca -0.07 -0.08 0.07 0.00 0.00 0.00 0.00 53.44 53.37 1ecz n ALA 104 Cb 0.85 -1.27 0.31 0.00 0.00 0.00 0.00 19.45 19.34 1ecz n ALA 104 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ecz n GLY 105 N 0.12 2.42 2.54 0.00 0.00 -1.22 -4.42 105.19 104.62 1ecz n GLY 105 Ca 0.07 -0.71 -0.19 0.00 0.00 0.00 0.00 46.02 45.19 1ecz n GLY 105 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1ecz n MET 106 N 0.74 1.95 -1.09 1.61 2.00 -1.17 -0.89 117.12 120.27 1ecz n MET 106 Ca 0.22 -3.85 -0.34 0.00 0.00 0.00 0.00 57.70 53.73 1ecz n MET 106 Cb 0.86 -1.77 0.12 0.00 0.00 0.00 0.00 33.22 32.42 1ecz n MET 106 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 175.97 177.25 1ecz n LEU 107 N -0.08 3.08 -4.70 4.03 4.77 -0.48 -4.56 117.00 119.05 1ecz n LEU 107 Ca 0.24 0.55 -0.42 0.00 -0.03 0.00 0.00 56.01 56.36 1ecz n LEU 107 Cb 0.66 -1.41 -0.03 0.00 -2.33 0.00 0.00 43.42 40.31 1ecz n LEU 107 CO 0.28 -2.24 0.64 -0.60 -1.33 0.00 0.00 177.39 174.13 1ecz s ARG 108 N -3.78 4.49 -0.23 3.23 3.52 -1.26 0.09 118.95 125.01 1ecz s ARG 108 Ca 0.70 1.28 -0.28 0.00 -0.13 0.00 0.00 55.73 57.29 1ecz s ARG 108 Cb -0.29 -3.48 -0.04 0.00 -1.56 0.00 0.00 34.95 29.57 1ecz s ARG 108 CO 0.54 -0.09 2.13 -0.47 -0.81 0.00 0.00 175.30 176.60 1ecz s TYR 109 N 1.21 1.30 -0.35 5.12 6.14 -1.25 -4.82 117.35 124.70 1ecz s TYR 109 Ca 0.48 0.52 -0.00 0.00 0.64 0.00 0.00 57.07 58.71 1ecz s TYR 109 Cb -0.20 -3.97 0.12 0.00 0.42 0.00 0.00 41.96 38.33 1ecz s TYR 109 CO 0.23 -3.91 0.16 1.21 0.64 0.00 0.00 175.55 173.88 1ecz s ASN 110 N 7.72 3.66 0.00 4.32 2.47 -1.26 -4.74 114.94 127.11 1ecz s ASN 110 Ca 0.96 -1.94 0.15 0.00 0.42 0.00 0.00 52.86 52.45 1ecz s ASN 110 Cb -0.31 -0.74 0.65 0.00 -1.45 0.00 0.00 41.25 39.40 1ecz s ASN 110 CO 0.35 -0.36 1.45 -1.54 -3.72 0.00 0.00 177.10 173.28 1ecz n SER 111 N 4.43 0.00 0.10 -4.21 3.41 -1.26 -2.25 113.62 113.84 1ecz n SER 111 Ca 0.03 0.39 0.12 0.00 -0.26 0.00 0.00 58.87 59.16 1ecz n SER 111 Cb 0.39 -0.45 0.45 0.00 -0.26 0.00 0.00 64.21 64.34 1ecz n SER 111 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1ecz n LYS 112 N -1.45 0.20 -3.93 4.33 5.02 -1.26 -4.81 118.16 116.26 1ecz n LYS 112 Ca 0.04 0.28 -0.10 0.00 -2.02 0.00 0.00 58.31 56.51 1ecz n LYS 112 Cb 0.16 -1.79 -0.10 0.00 -0.02 0.00 0.00 35.03 33.28 1ecz n LYS 112 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1ecz s LEU 113 N -4.30 1.90 -0.19 -0.35 1.43 -0.95 -5.15 118.68 111.06 1ecz s LEU 113 Ca 0.08 -0.37 -0.19 0.00 -1.03 0.00 0.00 54.13 52.62 1ecz s LEU 113 Cb 0.12 0.40 -0.03 0.00 0.03 0.00 0.00 46.19 46.70 1ecz s LEU 113 CO 0.50 -0.35 0.56 -2.16 0.23 0.00 0.00 176.35 175.13 1ecz s PRO 114 N -1.50 4.21 -0.01 1.29 0.04 -1.26 -4.58 135.00 133.19 1ecz s PRO 114 Ca -0.15 0.50 -0.30 0.00 0.04 0.00 0.00 61.00 61.10 1ecz s PRO 114 Cb -0.08 -3.56 -0.05 0.00 0.04 0.00 0.00 34.50 30.85 1ecz s PRO 114 CO 0.00 -0.16 1.37 0.42 0.04 0.00 0.00 177.00 178.67 1ecz s ILE 115 N 1.66 3.80 -0.27 0.56 1.01 0.22 -4.87 121.20 123.31 1ecz s ILE 115 Ca 0.26 1.16 0.01 0.00 0.00 0.00 0.00 60.65 62.09 1ecz s ILE 115 Cb -0.16 -3.75 0.07 0.00 0.01 0.00 0.00 42.46 38.64 1ecz s ILE 115 CO 0.10 -0.01 -0.02 -0.69 0.00 0.00 0.00 174.94 174.33 1ecz s VAL 116 N 2.42 1.68 -0.10 2.92 1.01 -1.26 0.52 120.40 127.58 1ecz s VAL 116 Ca 0.63 -1.54 -0.06 0.00 0.00 0.00 0.00 61.98 61.01 1ecz s VAL 116 Cb -0.30 -2.03 -0.04 0.00 0.00 0.00 0.00 36.38 34.01 1ecz s VAL 116 CO 0.26 -0.28 0.12 -0.69 0.00 0.00 0.00 175.10 174.51 1ecz s VAL 117 N 1.28 5.33 -0.39 2.92 1.01 0.11 -1.41 120.40 129.25 1ecz s VAL 117 Ca -0.01 0.11 -0.01 0.00 0.00 0.00 0.00 61.98 62.07 1ecz s VAL 117 Cb -0.19 -3.33 0.10 0.00 0.00 0.00 0.00 36.38 32.97 1ecz s VAL 117 CO -0.09 0.59 0.16 -0.31 0.00 0.00 0.00 175.10 175.45 1ecz s TYR 118 N -1.03 3.61 0.27 5.22 2.02 0.34 -0.24 117.35 127.55 1ecz s TYR 118 Ca 0.16 -2.53 0.10 0.00 -0.37 0.00 0.00 57.07 54.43 1ecz s TYR 118 Cb -0.12 -3.10 -0.05 0.00 -0.40 0.00 0.00 41.96 38.30 1ecz s TYR 118 CO 0.05 -0.96 -0.07 0.95 -1.57 0.00 0.00 175.55 173.95 1ecz s THR 119 N 1.09 3.13 1.34 -0.71 -4.23 -1.22 -0.20 115.64 114.84 1ecz s THR 119 Ca 0.08 -2.07 -0.23 0.00 -1.18 0.00 0.00 61.69 58.29 1ecz s THR 119 Cb -0.22 -2.67 0.34 0.00 1.34 0.00 0.00 72.50 71.29 1ecz s THR 119 CO -0.05 -0.38 1.00 -0.81 -0.54 0.00 0.00 174.62 173.84 1ecz n PRO 120 N -0.81 -3.93 0.10 3.99 -0.04 -1.25 -1.74 135.00 131.32 1ecz n PRO 120 Ca -0.06 -1.63 -0.15 0.00 -0.04 0.00 0.00 63.50 61.61 1ecz n PRO 120 Cb 0.59 -1.76 -0.09 0.00 -0.04 0.00 0.00 33.50 32.20 1ecz n PRO 120 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 1ecz h ASP 121 N -3.14 -1.51 0.07 3.54 3.32 -1.54 -3.15 116.42 114.02 1ecz h ASP 121 Ca -0.41 0.16 -0.01 0.00 0.02 0.00 0.00 57.03 56.79 1ecz h ASP 121 Cb 1.30 0.56 -0.00 0.00 0.22 0.00 0.00 39.33 41.40 1ecz h ASP 121 CO 0.26 -0.52 -0.07 -0.55 -1.72 0.00 0.00 179.24 176.64 1ecz h ASN 122 N -0.69 0.00 -4.14 6.45 7.08 -1.93 -3.46 115.58 118.89 1ecz h ASN 122 Ca -0.00 0.00 -0.47 0.00 -3.08 0.00 0.00 56.30 52.75 1ecz h ASN 122 Cb 0.71 0.00 0.02 0.00 -2.08 0.00 0.00 38.32 36.96 1ecz h ASN 122 CO -0.28 0.07 0.37 -0.69 -2.08 0.00 0.00 177.43 174.82 1ecz s VAL 123 N -4.87 4.26 0.40 6.14 1.01 -1.19 -4.76 120.40 121.39 1ecz s VAL 123 Ca -0.05 1.20 0.05 0.00 0.00 0.00 0.00 61.98 63.18 1ecz s VAL 123 Cb 0.16 -3.59 -0.06 0.00 0.00 0.00 0.00 36.38 32.90 1ecz s VAL 123 CO 0.67 -0.50 0.04 -1.81 0.00 0.00 0.00 175.10 173.50 1ecz s ASP 124 N -2.64 3.26 -0.13 3.32 1.11 -0.26 -4.81 116.67 116.51 1ecz s ASP 124 Ca 0.62 -1.45 -0.04 0.00 0.18 0.00 0.00 52.55 51.86 1ecz s ASP 124 Cb -0.12 -0.04 0.06 0.00 1.07 0.00 0.00 42.92 43.89 1ecz s ASP 124 CO 0.26 -0.62 0.11 -0.69 1.18 0.00 0.00 175.17 175.41 1ecz s VAL 125 N -3.00 -0.15 0.42 -1.27 1.01 -1.25 -3.01 120.40 113.14 1ecz s VAL 125 Ca 0.30 0.06 0.05 0.00 0.00 0.00 0.00 61.98 62.38 1ecz s VAL 125 Cb 0.07 -0.44 -0.05 0.00 0.00 0.00 0.00 36.38 35.96 1ecz s VAL 125 CO 0.14 -0.10 0.03 -0.54 0.00 0.00 0.00 175.10 174.64 1ecz s LYS 126 N 2.20 1.95 0.06 2.72 1.02 0.54 -4.97 119.74 123.25 1ecz s LYS 126 Ca 0.04 -2.15 -0.13 0.00 0.02 0.00 0.00 55.97 53.74 1ecz s LYS 126 Cb -0.14 -1.35 0.02 0.00 -0.52 0.00 0.00 37.83 35.84 1ecz s LYS 126 CO -0.08 -0.20 0.30 1.52 -0.92 0.00 0.00 175.35 175.97 1ecz s TYR 127 N -2.93 -0.08 -0.03 3.18 1.13 -1.26 -0.99 117.35 116.37 1ecz s TYR 127 Ca 0.27 -0.13 0.02 0.00 -1.41 0.00 0.00 57.07 55.82 1ecz s TYR 127 Cb 0.07 0.09 0.01 0.00 -1.10 0.00 0.00 41.96 41.04 1ecz s TYR 127 CO 0.13 -0.54 -0.06 0.50 -2.51 0.00 0.00 175.55 173.08 1ecz s ARG 128 N -2.93 0.79 -0.32 -3.49 3.52 -0.60 -4.97 118.95 110.96 1ecz s ARG 128 Ca -0.02 -0.17 -0.15 0.00 -0.13 0.00 0.00 55.73 55.26 1ecz s ARG 128 Cb 0.00 -0.77 -0.02 0.00 -1.56 0.00 0.00 34.95 32.60 1ecz s ARG 128 CO -0.06 -0.00 0.37 0.08 -0.81 0.00 0.00 175.30 174.88 1ecz s VAL 129 N 0.56 5.16 -0.16 7.11 1.01 -1.26 0.20 120.40 133.03 1ecz s VAL 129 Ca -0.08 0.24 -0.16 0.00 0.00 0.00 0.00 61.98 61.98 1ecz s VAL 129 Cb -0.11 -3.78 -0.04 0.00 0.00 0.00 0.00 36.38 32.44 1ecz s VAL 129 CO 0.00 -0.01 0.40 0.26 0.00 0.00 0.00 175.10 175.75 1ecz s TRP 130 N 2.06 3.45 -0.35 5.22 0.52 -0.04 -4.96 118.94 124.83 1ecz s TRP 130 Ca 0.13 0.72 -0.12 0.00 0.02 0.00 0.00 56.10 56.85 1ecz s TRP 130 Cb -0.16 -2.48 -0.00 0.00 -1.15 0.00 0.00 33.47 29.67 1ecz s TRP 130 CO 0.11 0.13 0.23 0.21 0.02 0.00 0.00 176.95 177.65 1ecz s LYS 131 N 0.80 3.27 0.71 4.98 2.47 -1.26 -1.94 119.74 128.76 1ecz s LYS 131 Ca 0.21 -0.79 -0.11 0.00 -1.56 0.00 0.00 55.97 53.72 1ecz s LYS 131 Cb -0.14 -3.77 0.01 0.00 -1.46 0.00 0.00 37.83 32.47 1ecz s LYS 131 CO 0.08 -0.53 1.06 0.00 0.16 0.00 0.00 175.35 176.12 1ecz s ALA 132 N 1.67 2.63 0.28 3.13 0.00 -0.97 -5.03 121.76 123.46 1ecz s ALA 132 Ca 0.05 0.11 -0.08 0.00 0.00 0.00 0.00 51.96 52.04 1ecz s ALA 132 Cb -0.18 -3.19 -0.06 0.00 0.00 0.00 0.00 23.12 19.69 1ecz s ALA 132 CO 0.09 -1.29 0.59 -1.21 0.00 0.00 0.00 175.76 173.93 1ecz s GLU 133 N -5.02 3.73 0.04 0.00 2.02 -1.26 -4.97 118.70 113.23 1ecz s GLU 133 Ca 0.58 0.19 -0.26 0.00 0.02 0.00 0.00 54.97 55.50 1ecz s GLU 133 Cb -0.14 -2.60 -0.17 0.00 0.10 0.00 0.00 34.13 31.31 1ecz s GLU 133 CO 0.55 0.21 1.43 0.93 0.02 0.00 0.00 175.26 178.40 1ecz h GLU 134 N 1.95 -0.37 -6.39 1.61 3.07 -2.01 -3.44 114.58 109.00 1ecz h GLU 134 Ca -0.47 0.03 -0.54 0.00 -0.50 0.00 0.00 59.36 57.87 1ecz h GLU 134 Cb 1.18 0.09 -0.02 0.00 -0.84 0.00 0.00 28.75 29.16 1ecz h GLU 134 CO 0.67 -0.11 0.51 -1.59 -1.40 0.00 0.00 179.01 177.08 1ecz s LYS 135 N -5.25 4.47 -0.39 2.33 -2.85 -1.26 -5.01 119.74 111.78 1ecz s LYS 135 Ca -0.15 1.56 -0.15 0.00 -1.00 0.00 0.00 55.97 56.23 1ecz s LYS 135 Cb 0.03 -3.46 0.01 0.00 -2.06 0.00 0.00 37.83 32.36 1ecz s LYS 135 CO 0.60 -0.22 0.33 0.42 0.10 0.00 0.00 175.35 176.58 1ecz s ILE 136 N 1.38 5.21 0.51 3.79 1.01 -1.26 -5.07 121.20 126.77 1ecz s ILE 136 Ca 0.54 -0.43 -0.03 0.00 0.00 0.00 0.00 60.65 60.73 1ecz s ILE 136 Cb -0.24 -3.91 0.00 0.00 0.01 0.00 0.00 42.46 38.33 1ecz s ILE 136 CO 0.26 -0.26 0.78 -1.81 0.00 0.00 0.00 174.94 173.91 1ecz s ASP 137 N 1.72 5.75 0.00 3.58 1.01 -1.26 -5.11 116.67 122.36 1ecz s ASP 137 Ca 0.08 0.51 0.03 0.00 0.71 0.00 0.00 52.55 53.88 1ecz s ASP 137 Cb -0.18 -1.65 -0.03 0.00 1.01 0.00 0.00 42.92 42.07 1ecz s ASP 137 CO 0.11 -0.86 -0.07 0.20 0.21 0.00 0.00 175.17 174.77 1ecz s ASN 138 N -4.25 4.63 0.34 0.27 0.01 -1.26 -5.13 114.94 109.55 1ecz s ASN 138 Ca 0.51 -0.14 -0.11 0.00 -0.71 0.00 0.00 52.86 52.41 1ecz s ASN 138 Cb -0.10 -1.08 -0.07 0.00 0.41 0.00 0.00 41.25 40.41 1ecz s ASN 138 CO 0.41 0.28 0.69 0.00 -1.51 0.00 0.00 177.10 176.97 1ecz s ALA 139 N -1.00 3.42 0.37 0.60 0.00 -1.26 -5.08 121.76 118.81 1ecz s ALA 139 Ca 0.17 -0.21 -0.09 0.00 0.00 0.00 0.00 51.96 51.83 1ecz s ALA 139 Cb -0.11 -2.61 -0.06 0.00 0.00 0.00 0.00 23.12 20.34 1ecz s ALA 139 CO 0.08 0.21 0.71 0.14 0.00 0.00 0.00 175.76 176.90 1ecz s VAL 140 N -2.13 4.84 -1.33 0.00 -7.23 -1.26 -5.01 120.40 108.28 1ecz s VAL 140 Ca 0.50 0.49 0.23 0.00 -1.81 0.00 0.00 61.98 61.39 1ecz s VAL 140 Cb -0.10 -3.73 -0.03 0.00 0.56 0.00 0.00 36.38 33.08 1ecz s VAL 140 CO 0.26 -0.46 1.21 0.52 -0.31 0.00 0.00 175.10 176.32 1ecz n VAL 141 N -1.19 0.00 0.00 1.32 0.31 -1.26 -5.37 118.33 112.15 1ecz n VAL 141 Ca 0.01 -0.07 0.00 0.00 -0.01 0.00 0.00 64.34 64.27 1ecz n VAL 141 Cb 0.54 0.71 0.00 0.00 -0.91 0.00 0.00 33.84 34.18 1ecz n VAL 141 CO 0.00 0.00 0.00 -2.11 -1.32 0.00 0.00 176.83 173.40