#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ecs n ASP 3 N 0.00 0.00 -0.30 1.67 9.92 -1.26 -0.47 116.55 126.11 3ecs n ASP 3 Ca 0.00 0.65 0.13 0.00 -0.53 0.00 0.00 54.79 55.04 3ecs n ASP 3 Cb 0.00 -0.32 0.30 0.00 -0.64 0.00 0.00 41.12 40.46 3ecs n ASP 3 CO 0.00 0.00 0.00 0.11 0.13 0.00 0.00 177.20 177.44 3ecs h LYS 4 N 0.00 0.33 -0.18 -1.24 6.56 -2.05 0.49 116.57 120.48 3ecs h LYS 4 Ca 0.00 -0.02 -0.08 0.00 -1.06 0.00 0.00 60.65 59.49 3ecs h LYS 4 Cb 0.00 -0.07 -0.01 0.00 -0.57 0.00 0.00 32.23 31.57 3ecs h LYS 4 CO 0.00 0.22 -0.24 0.93 -2.06 0.00 0.00 179.45 178.30 3ecs h GLU 5 N 0.34 0.33 0.60 3.15 5.08 -1.21 -0.86 114.58 122.01 3ecs h GLU 5 Ca 0.55 -0.11 -0.03 0.00 -1.00 0.00 0.00 59.36 58.77 3ecs h GLU 5 Cb 1.06 -0.03 0.01 0.00 0.50 0.00 0.00 28.75 30.29 3ecs h GLU 5 CO -0.56 0.55 -0.29 -0.07 -1.00 0.00 0.00 179.01 177.65 3ecs h LEU 6 N 0.30 -0.68 -1.07 1.33 3.38 0.24 0.13 115.31 118.93 3ecs h LEU 6 Ca 0.05 0.02 0.28 0.00 0.09 0.00 0.00 57.88 58.32 3ecs h LEU 6 Cb 0.59 0.18 -0.13 0.00 0.09 0.00 0.00 40.66 41.38 3ecs h LEU 6 CO 0.04 -0.48 0.61 0.40 0.09 0.00 0.00 178.44 179.10 3ecs h ILE 7 N -0.81 0.43 -0.07 1.22 2.04 -0.91 0.50 117.51 119.91 3ecs h ILE 7 Ca -0.08 -0.15 -0.09 0.00 1.00 0.00 0.00 64.86 65.54 3ecs h ILE 7 Cb 0.61 -0.05 0.00 0.00 -0.74 0.00 0.00 36.82 36.65 3ecs h ILE 7 CO 0.13 0.08 -0.29 -0.33 0.00 0.00 0.00 178.15 177.75 3ecs h GLU 8 N 0.44 0.32 -0.49 2.37 5.08 -1.03 -1.55 114.58 119.72 3ecs h GLU 8 Ca 0.68 -0.25 0.04 0.00 -1.00 0.00 0.00 59.36 58.83 3ecs h GLU 8 Cb 1.48 0.05 -0.03 0.00 0.50 0.00 0.00 28.75 30.75 3ecs h GLU 8 CO -0.49 0.88 0.33 -0.92 -1.00 0.00 0.00 179.01 177.81 3ecs h TYR 9 N -0.17 0.51 0.23 4.33 3.20 0.19 -0.68 116.97 124.58 3ecs h TYR 9 Ca -0.02 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 61.86 3ecs h TYR 9 Cb 0.93 -0.17 0.00 0.00 1.54 0.00 0.00 36.73 39.03 3ecs h TYR 9 CO 0.13 0.29 -0.11 0.35 -1.64 0.00 0.00 178.16 177.18 3ecs h PHE 10 N 0.53 -0.28 -0.84 -3.82 3.57 -0.05 -2.70 116.94 113.34 3ecs h PHE 10 Ca 0.20 -0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.71 3ecs h PHE 10 Cb 0.15 0.09 -0.04 0.00 2.79 0.00 0.00 35.95 38.94 3ecs h PHE 10 CO -0.00 0.10 0.56 0.87 -2.23 0.00 0.00 178.31 177.61 3ecs h LYS 11 N -0.77 1.09 -0.85 1.11 1.57 -0.95 -1.26 116.57 116.53 3ecs h LYS 11 Ca -0.03 -0.07 -0.00 0.00 -1.87 0.00 0.00 60.65 58.68 3ecs h LYS 11 Cb 0.50 -0.25 -0.04 0.00 0.08 0.00 0.00 32.23 32.53 3ecs h LYS 11 CO 0.05 0.72 0.52 0.77 -0.57 0.00 0.00 179.45 180.95 3ecs h SER 12 N 1.13 1.01 0.00 0.86 0.02 -1.17 -0.48 113.55 114.92 3ecs h SER 12 Ca 0.31 -0.05 0.00 0.00 -0.84 0.00 0.00 61.79 61.21 3ecs h SER 12 Cb -0.10 -0.25 0.00 0.00 0.14 0.00 0.00 62.40 62.18 3ecs h SER 12 CO -0.07 0.76 0.00 0.00 -1.14 0.00 0.00 176.83 176.38 3ecs n GLN 13 N -4.38 0.00 0.00 3.45 1.13 -0.48 -1.68 117.38 115.42 3ecs n GLN 13 Ca 0.09 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.15 3ecs n GLN 13 Cb 0.05 -0.97 0.00 0.00 0.11 0.00 0.00 30.24 29.43 3ecs n GLN 13 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 3ecs n LYS 15 N -0.21 0.00 0.12 -1.09 5.02 -0.19 -2.79 118.16 119.01 3ecs n LYS 15 Ca 0.00 0.00 0.13 0.00 -2.02 0.00 0.00 58.31 56.42 3ecs n LYS 15 Cb 0.00 0.00 0.35 0.00 -0.02 0.00 0.00 35.03 35.36 3ecs n LYS 15 CO 0.00 0.00 0.00 1.05 -0.52 0.00 0.00 177.40 177.93 3ecs h GLU 16 N 0.00 0.00 -1.41 1.97 4.11 -1.58 -3.38 114.58 114.28 3ecs h GLU 16 Ca 0.00 0.00 -0.34 0.00 0.07 0.00 0.00 59.36 59.09 3ecs h GLU 16 Cb 0.00 0.00 -0.25 0.00 0.50 0.00 0.00 28.75 29.00 3ecs h GLU 16 CO 0.00 0.00 -0.71 -3.47 0.07 0.00 0.00 179.01 174.90 3ecs n ASP 17 N -2.38 -2.06 0.32 3.06 2.03 -1.12 -4.99 116.55 111.42 3ecs n ASP 17 Ca 0.05 -2.77 0.20 0.00 0.52 0.00 0.00 54.79 52.79 3ecs n ASP 17 Cb 0.45 0.78 1.10 0.00 -0.72 0.00 0.00 41.12 42.72 3ecs n ASP 17 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 3ecs h PRO 18 N 4.97 0.00 -5.40 -0.67 0.13 -1.84 -3.45 132.00 125.74 3ecs h PRO 18 Ca 0.10 0.00 -0.70 0.00 -0.87 0.00 0.00 66.00 64.53 3ecs h PRO 18 Cb 1.01 0.00 -0.10 0.00 0.13 0.00 0.00 31.00 32.04 3ecs h PRO 18 CO 0.22 0.00 2.07 -3.47 -0.23 0.00 0.00 178.00 176.59 3ecs n ASP 19 N -3.33 4.93 -4.32 1.44 2.03 -1.26 -5.02 116.55 111.01 3ecs n ASP 19 Ca -0.03 -2.93 -0.32 0.00 0.52 0.00 0.00 54.79 52.03 3ecs n ASP 19 Cb 0.09 -1.69 -0.16 0.00 -0.72 0.00 0.00 41.12 38.64 3ecs n ASP 19 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3ecs s ALA 21 N 3.43 2.29 0.20 -1.67 0.00 -1.26 -5.05 121.76 119.69 3ecs s ALA 21 Ca 0.50 -1.04 -0.11 0.00 0.00 0.00 0.00 51.96 51.32 3ecs s ALA 21 Cb 0.03 -0.74 0.20 0.00 0.00 0.00 0.00 23.12 22.62 3ecs s ALA 21 CO 0.05 0.46 1.80 0.66 0.00 0.00 0.00 175.76 178.73 3ecs h SER 22 N 5.85 0.50 -0.72 0.00 4.64 -1.98 -1.25 113.55 120.59 3ecs h SER 22 Ca -0.37 0.03 0.07 0.00 -0.47 0.00 0.00 61.79 61.06 3ecs h SER 22 Cb 1.16 -0.07 -0.06 0.00 -0.31 0.00 0.00 62.40 63.12 3ecs h SER 22 CO 0.48 0.33 0.40 0.00 -0.87 0.00 0.00 176.83 177.17 3ecs h ALA 23 N 1.32 0.99 -0.33 5.18 0.00 -1.96 0.57 119.26 125.03 3ecs h ALA 23 Ca 0.27 0.03 -0.06 0.00 0.00 0.00 0.00 54.91 55.15 3ecs h ALA 23 Cb 0.16 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 3ecs h ALA 23 CO -0.17 0.06 -0.04 0.28 0.00 0.00 0.00 179.25 179.38 3ecs h VAL 24 N 0.71 1.21 -0.18 0.00 2.07 -1.73 0.14 116.25 118.48 3ecs h VAL 24 Ca 0.33 -0.86 -0.11 0.00 0.82 0.00 0.00 66.70 66.88 3ecs h VAL 24 Cb 0.26 1.00 -0.01 0.00 -1.52 0.00 0.00 31.29 31.02 3ecs h VAL 24 CO -0.21 0.29 -0.39 0.00 0.02 0.00 0.00 177.57 177.28 3ecs h ALA 25 N 1.47 1.01 -0.05 1.67 0.00 0.22 -1.87 119.26 121.72 3ecs h ALA 25 Ca 0.10 -0.41 -0.01 0.00 0.00 0.00 0.00 54.91 54.59 3ecs h ALA 25 Cb 0.38 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.07 3ecs h ALA 25 CO 0.02 0.61 -0.00 0.00 0.00 0.00 0.00 179.25 179.87 3ecs h ALA 26 N 1.26 0.07 0.00 0.00 0.00 0.15 -2.94 119.26 117.80 3ecs h ALA 26 Ca 0.03 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.77 3ecs h ALA 26 Cb 0.83 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.60 3ecs h ALA 26 CO 0.07 -0.26 0.00 -0.84 0.00 0.00 0.00 179.25 178.22 3ecs h ILE 27 N -0.21 0.00 0.00 0.00 3.07 -0.72 -2.62 117.51 117.03 3ecs h ILE 27 Ca 0.01 -0.54 -0.12 0.00 1.55 0.00 0.00 64.86 65.76 3ecs h ILE 27 Cb 0.34 1.47 -0.02 0.00 -0.27 0.00 0.00 36.82 38.34 3ecs h ILE 27 CO 0.00 0.00 -0.57 0.03 -1.05 0.00 0.00 178.15 176.56 3ecs h ARG 28 N 0.00 0.00 0.02 0.16 3.08 -1.22 -1.95 114.38 114.46 3ecs h ARG 28 Ca 0.00 0.00 -0.23 0.00 0.07 0.00 0.00 59.98 59.82 3ecs h ARG 28 Cb 0.63 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.65 3ecs h ARG 28 CO 0.00 0.57 -1.14 1.79 -1.07 0.00 0.00 179.97 180.12 3ecs h THR 29 N 0.00 1.56 -0.61 2.04 1.35 -1.31 -2.68 112.91 113.26 3ecs h THR 29 Ca -0.01 -3.27 -0.02 0.00 -0.55 0.00 0.00 66.41 62.56 3ecs h THR 29 Cb 1.02 2.80 -0.03 0.00 -1.73 0.00 0.00 68.15 70.22 3ecs h THR 29 CO 0.07 0.90 0.31 -0.07 -0.25 0.00 0.00 175.52 176.49 3ecs h LEU 30 N 0.01 0.78 -0.70 3.87 -0.00 -1.29 0.56 115.31 118.54 3ecs h LEU 30 Ca -0.07 -0.11 -0.01 0.00 -0.00 0.00 0.00 57.88 57.69 3ecs h LEU 30 Cb 1.83 -0.20 -0.03 0.00 -0.00 0.00 0.00 40.66 42.26 3ecs h LEU 30 CO 0.13 0.67 0.41 -0.07 -0.00 0.00 0.00 178.44 179.58 3ecs h LEU 31 N 0.83 0.85 -0.32 1.67 3.38 -1.34 1.11 115.31 121.50 3ecs h LEU 31 Ca 0.21 -0.07 -0.04 0.00 0.09 0.00 0.00 57.88 58.06 3ecs h LEU 31 Cb 0.08 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.60 3ecs h LEU 31 CO -0.03 0.68 0.03 -0.33 0.09 0.00 0.00 178.44 178.87 3ecs h GLU 32 N 0.96 0.54 -0.68 1.13 4.39 -1.06 -1.07 114.58 118.78 3ecs h GLU 32 Ca 0.25 -0.16 0.00 0.00 0.34 0.00 0.00 59.36 59.79 3ecs h GLU 32 Cb -0.01 -0.06 -0.03 0.00 -0.10 0.00 0.00 28.75 28.55 3ecs h GLU 32 CO -0.04 0.66 0.43 0.35 -1.16 0.00 0.00 179.01 179.24 3ecs h PHE 33 N 0.35 0.88 -0.64 4.33 3.57 0.75 0.68 116.94 126.86 3ecs h PHE 33 Ca 0.09 0.01 -0.07 0.00 3.53 0.00 0.00 57.97 61.54 3ecs h PHE 33 Cb 0.40 -0.29 -0.03 0.00 2.79 0.00 0.00 35.95 38.82 3ecs h PHE 33 CO 0.03 0.57 0.14 1.25 -2.23 0.00 0.00 178.31 178.07 3ecs h LEU 34 N 0.93 0.97 0.11 0.59 6.46 0.16 -0.22 115.31 124.31 3ecs h LEU 34 Ca 0.25 -0.20 -0.01 0.00 -0.12 0.00 0.00 57.88 57.80 3ecs h LEU 34 Cb -0.06 -0.25 0.00 0.00 -0.73 0.00 0.00 40.66 39.61 3ecs h LEU 34 CO -0.05 0.94 -0.05 0.11 -0.62 0.00 0.00 178.44 178.77 3ecs h LYS 35 N 0.97 -0.14 0.00 1.25 1.57 0.14 -3.27 116.57 117.09 3ecs h LYS 35 Ca 0.20 0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.99 3ecs h LYS 35 Cb 0.37 0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.71 3ecs h LYS 35 CO 0.00 -0.09 0.25 0.54 -0.57 0.00 0.00 179.45 179.58 3ecs n ARG 36 N -3.24 0.09 -0.99 3.15 1.74 0.22 -0.17 116.66 117.47 3ecs n ARG 36 Ca -0.02 0.57 -0.21 0.00 -0.77 0.00 0.00 57.85 57.41 3ecs n ARG 36 Cb 0.06 -2.05 0.08 0.00 -1.02 0.00 0.00 32.46 29.52 3ecs n ARG 36 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 3ecs n ASP 37 N -2.04 5.85 -0.15 0.55 2.03 -0.09 -4.43 116.55 118.27 3ecs n ASP 37 Ca -0.01 -3.26 -0.10 0.00 0.52 0.00 0.00 54.79 51.94 3ecs n ASP 37 Cb 0.27 -0.93 -0.01 0.00 -0.72 0.00 0.00 41.12 39.73 3ecs n ASP 37 CO 0.00 0.00 0.00 0.50 -1.92 0.00 0.00 177.20 175.78 3ecs h LYS 38 N 1.36 0.73 -1.77 -0.67 1.63 -0.72 -3.10 116.57 114.03 3ecs h LYS 38 Ca 0.42 -0.23 0.00 0.00 -0.85 0.00 0.00 60.65 60.00 3ecs h LYS 38 Cb 1.32 -0.07 0.00 0.00 -0.60 0.00 0.00 32.23 32.88 3ecs h LYS 38 CO 0.98 0.80 0.00 0.41 -3.45 0.00 0.00 179.45 178.19 3ecs n GLY 39 N -0.40 1.56 3.90 5.01 0.00 -1.26 -4.86 105.19 109.14 3ecs n GLY 39 Ca -0.00 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.74 3ecs n GLY 39 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3ecs s GLU 40 N 0.62 3.61 0.00 1.61 2.56 -1.17 -5.08 118.70 120.85 3ecs s GLU 40 Ca 0.00 0.21 0.00 0.00 0.00 0.00 0.00 54.97 55.18 3ecs s GLU 40 Cb 0.00 -2.43 0.00 0.00 2.00 0.00 0.00 34.13 33.70 3ecs s GLU 40 CO 0.00 -0.09 0.12 -2.37 -0.56 0.00 0.00 175.26 172.36 3ecs n THR 41 N -1.83 0.00 -4.13 -1.70 5.66 -1.26 -4.92 114.28 106.09 3ecs n THR 41 Ca 0.00 0.25 -0.06 0.00 -3.05 0.00 0.00 64.05 61.19 3ecs n THR 41 Cb 0.55 -0.52 -0.02 0.00 -1.55 0.00 0.00 70.33 68.79 3ecs n THR 41 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 3ecs n ILE 42 N -0.43 0.00 0.24 1.09 3.06 -1.25 -2.29 119.36 119.78 3ecs n ILE 42 Ca 0.00 -0.58 -0.15 0.00 -2.50 0.00 0.00 62.75 59.52 3ecs n ILE 42 Cb 0.00 0.20 -0.08 0.00 0.54 0.00 0.00 39.64 40.30 3ecs n ILE 42 CO 0.00 0.00 0.00 1.56 -2.50 0.00 0.00 176.55 175.61 3ecs h GLN 43 N 0.00 -0.59 0.13 9.51 1.08 -1.96 -3.28 115.11 120.00 3ecs h GLN 43 Ca -0.08 0.04 -0.00 0.00 -1.45 0.00 0.00 58.65 57.16 3ecs h GLN 43 Cb 0.30 0.13 -0.01 0.00 -0.05 0.00 0.00 27.48 27.85 3ecs h GLN 43 CO 0.13 -0.30 -0.19 0.78 -0.95 0.00 0.00 178.83 178.30 3ecs h GLY 44 N -0.83 -1.03 -6.11 3.46 0.00 -1.98 0.37 103.07 96.94 3ecs h GLY 44 Ca -0.06 0.48 -0.52 0.00 0.00 0.00 0.00 47.33 47.22 3ecs h GLY 44 CO 0.10 -0.34 2.31 1.04 0.00 0.00 0.00 176.54 179.65 3ecs n LEU 45 N -3.51 4.07 0.00 3.11 4.77 -1.24 -1.33 117.00 122.87 3ecs n LEU 45 Ca -0.04 -2.75 0.00 0.00 -0.03 0.00 0.00 56.01 53.19 3ecs n LEU 45 Cb 0.16 -1.05 0.00 0.00 -2.33 0.00 0.00 43.42 40.20 3ecs n LEU 45 CO 0.08 -0.13 0.00 -2.11 -1.33 0.00 0.00 177.39 173.90 3ecs n ARG 46 N 5.98 0.00 0.23 3.23 1.85 -1.14 -3.89 116.66 122.91 3ecs n ARG 46 Ca 0.45 0.00 0.12 0.00 -1.00 0.00 0.00 57.85 57.42 3ecs n ARG 46 Cb 0.29 0.00 0.45 0.00 -1.05 0.00 0.00 32.46 32.15 3ecs n ARG 46 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 3ecs h ALA 47 N 0.00 0.98 0.07 2.89 0.00 0.11 -0.29 119.26 123.02 3ecs h ALA 47 Ca 0.00 -0.14 -0.35 0.00 0.00 0.00 0.00 54.91 54.42 3ecs h ALA 47 Cb 0.00 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 3ecs h ALA 47 CO 0.00 0.20 -1.99 0.09 0.00 0.00 0.00 179.25 177.55 3ecs n ASN 48 N -3.26 1.64 -0.19 0.00 3.02 -0.98 -3.37 115.26 112.13 3ecs n ASN 48 Ca 0.01 0.22 -0.08 0.00 -0.03 0.00 0.00 54.58 54.70 3ecs n ASN 48 Cb 0.43 -0.49 0.02 0.00 -0.61 0.00 0.00 39.78 39.14 3ecs n ASN 48 CO 0.00 0.00 0.00 0.25 -2.62 0.00 0.00 177.26 174.89 3ecs h LEU 49 N 0.04 0.76 -0.66 3.41 5.85 -1.75 0.33 115.31 123.29 3ecs h LEU 49 Ca -0.41 -0.17 0.00 0.00 0.84 0.00 0.00 57.88 58.14 3ecs h LEU 49 Cb 2.03 -0.20 0.00 0.00 0.37 0.00 0.00 40.66 42.86 3ecs h LEU 49 CO 0.06 0.72 0.00 0.00 -0.34 0.00 0.00 178.44 178.88 3ecs h THR 50 N 0.75 0.00 0.14 1.05 1.03 -1.21 -2.36 112.91 112.31 3ecs h THR 50 Ca 0.18 -0.35 -0.25 0.00 -0.01 0.00 0.00 66.41 65.98 3ecs h THR 50 Cb 0.20 1.18 0.01 0.00 -1.07 0.00 0.00 68.15 68.47 3ecs h THR 50 CO -0.02 0.00 -1.22 -1.28 -0.01 0.00 0.00 175.52 172.99 3ecs h SER 51 N 0.00 0.46 -0.11 0.00 0.87 -1.16 -3.24 113.55 110.37 3ecs h SER 51 Ca 0.00 -0.90 -0.01 0.00 -1.23 0.00 0.00 61.79 59.66 3ecs h SER 51 Cb 0.48 -0.15 -0.01 0.00 -0.44 0.00 0.00 62.40 62.28 3ecs h SER 51 CO 0.00 1.55 0.05 0.00 -0.53 0.00 0.00 176.83 177.90 3ecs h ALA 52 N 0.02 1.82 0.00 6.23 0.00 -0.12 -0.39 119.26 126.82 3ecs h ALA 52 Ca -0.25 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.61 3ecs h ALA 52 Cb 1.76 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 19.49 3ecs h ALA 52 CO 0.11 0.15 -0.01 0.97 0.00 0.00 0.00 179.25 180.47 3ecs h ILE 53 N 0.20 0.03 0.51 0.00 2.10 -1.51 -2.44 117.51 116.39 3ecs h ILE 53 Ca 0.05 -0.57 -0.02 0.00 1.08 0.00 0.00 64.86 65.40 3ecs h ILE 53 Cb 0.06 1.55 0.00 0.00 -1.09 0.00 0.00 36.82 37.34 3ecs h ILE 53 CO -0.00 0.01 -0.24 -0.33 -1.08 0.00 0.00 178.15 176.50 3ecs h GLU 54 N 0.00 -0.66 -0.85 2.19 4.39 -1.09 -1.74 114.58 116.83 3ecs h GLU 54 Ca -0.00 0.04 0.22 0.00 0.34 0.00 0.00 59.36 59.96 3ecs h GLU 54 Cb 0.55 0.15 -0.05 0.00 -0.10 0.00 0.00 28.75 29.30 3ecs h GLU 54 CO 0.00 -0.41 0.58 1.79 -1.16 0.00 0.00 179.01 179.81 3ecs h THR 55 N -1.15 0.64 0.72 1.13 1.35 -1.46 -0.31 112.91 113.83 3ecs h THR 55 Ca -0.07 -0.07 -0.04 0.00 -0.55 0.00 0.00 66.41 65.68 3ecs h THR 55 Cb 0.55 0.42 0.01 0.00 -1.73 0.00 0.00 68.15 67.39 3ecs h THR 55 CO 0.11 0.04 -0.35 -0.07 -0.25 0.00 0.00 175.52 175.01 3ecs h LEU 56 N 0.21 -0.82 -2.13 3.87 3.38 -1.28 -2.46 115.31 116.08 3ecs h LEU 56 Ca 0.42 0.03 0.01 0.00 0.09 0.00 0.00 57.88 58.43 3ecs h LEU 56 Cb 1.34 0.21 -0.00 0.00 0.09 0.00 0.00 40.66 42.30 3ecs h LEU 56 CO -0.09 -0.51 0.30 0.00 0.09 0.00 0.00 178.44 178.22 3ecs h GLY 58 N 0.00 0.95 -7.10 0.00 0.00 -0.59 -3.32 103.07 93.01 3ecs h GLY 58 Ca 0.02 -0.25 -0.26 0.00 0.00 0.00 0.00 47.33 46.84 3ecs h GLY 58 CO -0.00 0.10 0.76 3.33 0.00 0.00 0.00 176.54 180.73 3ecs n VAL 59 N -4.51 0.67 -0.73 4.60 0.24 0.44 0.86 118.33 119.89 3ecs n VAL 59 Ca 0.15 -0.67 0.00 0.00 -2.04 0.00 0.00 64.34 61.78 3ecs n VAL 59 Cb 0.45 -2.07 0.00 0.00 -1.47 0.00 0.00 33.84 30.75 3ecs n VAL 59 CO 0.00 0.00 0.00 -0.67 -2.14 0.00 0.00 176.83 174.02 3ecs n ASP 60 N 15.31 0.00 0.00 -1.34 2.03 -1.25 -4.97 116.55 126.33 3ecs n ASP 60 Ca 0.44 -0.10 0.00 0.00 0.52 0.00 0.00 54.79 55.65 3ecs n ASP 60 Cb 0.45 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.85 3ecs n ASP 60 CO 0.00 0.00 0.00 -1.20 -1.92 0.00 0.00 177.20 174.08 3ecs n SER 61 N 0.00 0.00 -4.61 1.67 7.64 0.25 -4.89 113.62 113.68 3ecs n SER 61 Ca 0.00 0.00 -0.44 0.00 1.01 0.00 0.00 58.87 59.44 3ecs n SER 61 Cb 0.02 -1.20 -0.04 0.00 -1.01 0.00 0.00 64.21 61.99 3ecs n SER 61 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 3ecs n SER 62 N 0.00 3.40 -0.11 6.43 2.88 -1.25 -4.38 113.62 120.59 3ecs n SER 62 Ca 0.00 0.45 0.01 0.00 -1.33 0.00 0.00 58.87 58.00 3ecs n SER 62 Cb 0.00 -1.51 0.29 0.00 -0.75 0.00 0.00 64.21 62.24 3ecs n SER 62 CO 0.00 0.00 0.00 0.58 -1.23 0.00 0.00 175.04 174.39 3ecs h VAL 63 N 6.65 1.18 -0.42 2.46 2.07 -1.89 -2.49 116.25 123.79 3ecs h VAL 63 Ca -0.43 -0.48 -0.02 0.00 0.82 0.00 0.00 66.70 66.60 3ecs h VAL 63 Cb 1.25 0.45 -0.02 0.00 -1.52 0.00 0.00 31.29 31.45 3ecs h VAL 63 CO 0.96 0.20 0.17 0.00 0.02 0.00 0.00 177.57 178.93 3ecs h ALA 64 N 1.54 1.51 -0.89 1.67 0.00 -1.90 -0.61 119.26 120.59 3ecs h ALA 64 Ca 0.20 -0.11 0.10 0.00 0.00 0.00 0.00 54.91 55.10 3ecs h ALA 64 Cb 0.05 -0.18 -0.08 0.00 0.00 0.00 0.00 17.79 17.59 3ecs h ALA 64 CO -0.03 0.38 0.52 0.28 0.00 0.00 0.00 179.25 180.41 3ecs h VAL 65 N 0.60 0.91 -0.26 0.00 2.07 -1.80 0.46 116.25 118.22 3ecs h VAL 65 Ca 0.15 -0.29 -0.15 0.00 0.82 0.00 0.00 66.70 67.23 3ecs h VAL 65 Cb 0.11 -0.02 -0.00 0.00 -1.52 0.00 0.00 31.29 29.86 3ecs h VAL 65 CO -0.02 0.16 -0.41 -1.28 0.02 0.00 0.00 177.57 176.04 3ecs h SER 66 N 0.86 0.80 0.18 0.57 0.87 -1.20 -0.94 113.55 114.69 3ecs h SER 66 Ca 0.43 -0.52 -0.26 0.00 -1.23 0.00 0.00 61.79 60.21 3ecs h SER 66 Cb 0.41 -0.23 0.03 0.00 -0.44 0.00 0.00 62.40 62.17 3ecs h SER 66 CO -0.26 1.17 -1.14 0.77 -0.53 0.00 0.00 176.83 176.85 3ecs h SER 67 N 0.46 0.69 -0.74 6.23 4.64 -0.86 -2.55 113.55 121.42 3ecs h SER 67 Ca 0.02 -0.91 -0.03 0.00 -0.47 0.00 0.00 61.79 60.40 3ecs h SER 67 Cb 1.01 -0.22 -0.03 0.00 -0.31 0.00 0.00 62.40 62.84 3ecs h SER 67 CO 0.09 1.55 0.35 1.23 -0.87 0.00 0.00 176.83 179.18 3ecs h GLY 68 N -0.05 1.14 1.00 -0.77 0.00 0.10 -0.82 103.07 103.67 3ecs h GLY 68 Ca -0.19 -0.57 0.00 0.00 0.00 0.00 0.00 47.33 46.57 3ecs h GLY 68 CO 0.21 0.54 0.19 -1.33 0.00 0.00 0.00 176.54 176.16 3ecs h GLY 69 N 1.03 0.40 1.05 4.60 0.00 -1.22 0.35 103.07 109.29 3ecs h GLY 69 Ca 0.25 -0.15 -0.06 0.00 0.00 0.00 0.00 47.33 47.37 3ecs h GLY 69 CO -0.03 0.15 0.24 -2.09 0.00 0.00 0.00 176.54 174.80 3ecs h GLU 70 N 0.39 1.13 -0.28 4.80 4.81 -1.08 0.11 114.58 124.46 3ecs h GLU 70 Ca 0.10 -0.24 -0.04 0.00 -0.13 0.00 0.00 59.36 59.06 3ecs h GLU 70 Cb -0.04 -0.17 -0.01 0.00 0.63 0.00 0.00 28.75 29.16 3ecs h GLU 70 CO -0.02 0.96 0.02 -0.07 -0.73 0.00 0.00 179.01 179.17 3ecs h LEU 71 N 1.07 0.46 -0.94 1.64 3.38 -0.95 -1.28 115.31 118.70 3ecs h LEU 71 Ca 0.24 -0.28 0.04 0.00 0.09 0.00 0.00 57.88 57.96 3ecs h LEU 71 Cb 0.29 -0.12 -0.06 0.00 0.09 0.00 0.00 40.66 40.86 3ecs h LEU 71 CO -0.01 0.63 0.61 0.15 0.09 0.00 0.00 178.44 179.91 3ecs h PHE 72 N 0.28 1.13 -0.13 1.13 3.57 -0.71 -0.66 116.94 121.55 3ecs h PHE 72 Ca 0.08 0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.59 3ecs h PHE 72 Cb 0.38 -0.38 -0.00 0.00 2.79 0.00 0.00 35.95 38.74 3ecs h PHE 72 CO 0.03 0.64 -0.02 1.25 -2.23 0.00 0.00 178.31 177.98 3ecs h LEU 73 N 1.16 0.24 -0.46 0.59 7.12 -0.75 -1.00 115.31 122.22 3ecs h LEU 73 Ca 0.38 -0.34 -0.13 0.00 0.13 0.00 0.00 57.88 57.92 3ecs h LEU 73 Cb 0.04 -0.07 -0.01 0.00 -0.53 0.00 0.00 40.66 40.09 3ecs h LEU 73 CO -0.13 0.52 -0.22 0.03 -0.13 0.00 0.00 178.44 178.52 3ecs h ARG 74 N -0.05 0.95 -0.69 1.25 3.08 -1.03 -1.06 114.38 116.83 3ecs h ARG 74 Ca 0.04 -0.41 -0.05 0.00 0.07 0.00 0.00 59.98 59.62 3ecs h ARG 74 Cb 0.41 -0.03 -0.03 0.00 0.08 0.00 0.00 29.97 30.40 3ecs h ARG 74 CO 0.01 1.08 0.24 0.35 -1.07 0.00 0.00 179.97 180.58 3ecs h PHE 75 N 0.80 1.09 -0.01 3.04 3.57 -1.13 -3.16 116.94 121.14 3ecs h PHE 75 Ca 0.10 -0.10 -0.00 0.00 3.53 0.00 0.00 57.97 61.50 3ecs h PHE 75 Cb 0.79 -0.32 -0.00 0.00 2.79 0.00 0.00 35.95 39.21 3ecs h PHE 75 CO 0.05 0.86 0.00 0.97 -2.23 0.00 0.00 178.31 177.97 3ecs h ILE 76 N 1.00 1.18 -2.72 1.41 2.10 -0.95 -3.44 117.51 116.10 3ecs h ILE 76 Ca 0.23 -0.52 -0.54 0.00 1.08 0.00 0.00 64.86 65.11 3ecs h ILE 76 Cb 0.27 1.52 0.02 0.00 -1.09 0.00 0.00 36.82 37.53 3ecs h ILE 76 CO -0.01 0.14 0.98 -0.94 -1.08 0.00 0.00 178.15 177.23 3ecs s SER 77 N -5.42 6.65 -0.47 2.19 1.04 -0.42 -4.89 113.70 112.36 3ecs s SER 77 Ca -0.14 2.41 0.06 0.00 0.48 0.00 0.00 55.95 58.76 3ecs s SER 77 Cb 0.04 -2.56 0.26 0.00 0.10 0.00 0.00 66.02 63.87 3ecs s SER 77 CO 0.67 -0.86 0.92 0.18 0.98 0.00 0.00 173.24 175.13 3ecs n LEU 78 N 5.66 -2.45 -0.80 2.42 4.77 -1.26 -4.94 117.00 120.40 3ecs n LEU 78 Ca 0.15 -3.56 0.00 0.00 -0.03 0.00 0.00 56.01 52.58 3ecs n LEU 78 Cb 0.41 0.85 0.00 0.00 -2.33 0.00 0.00 43.42 42.35 3ecs n LEU 78 CO 0.62 2.03 0.23 0.00 -1.33 0.00 0.00 177.39 178.94 3ecs n ALA 79 N 1.25 1.99 -0.56 -1.18 0.00 -1.26 -2.82 120.51 117.94 3ecs n ALA 79 Ca 0.09 0.00 0.09 0.00 0.00 0.00 0.00 53.44 53.63 3ecs n ALA 79 Cb 0.64 -1.00 0.32 0.00 0.00 0.00 0.00 19.45 19.41 3ecs n ALA 79 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 3ecs n SER 80 N 0.51 4.31 -3.26 0.00 7.64 -1.26 -4.59 113.62 116.97 3ecs n SER 80 Ca 0.00 -2.36 -0.25 0.00 1.01 0.00 0.00 58.87 57.27 3ecs n SER 80 Cb 0.23 -0.51 -0.07 0.00 -1.01 0.00 0.00 64.21 62.85 3ecs n SER 80 CO 0.00 0.00 0.00 -0.11 -3.01 0.00 0.00 175.04 171.92 3ecs n LEU 81 N 0.97 1.39 -4.89 -3.43 7.94 -1.13 -5.26 117.00 112.59 3ecs n LEU 81 Ca 0.23 -4.95 -0.28 0.00 -1.11 0.00 0.00 56.01 49.90 3ecs n LEU 81 Cb 0.78 0.21 -0.01 0.00 0.53 0.00 0.00 43.42 44.94 3ecs n LEU 81 CO 0.20 2.08 0.01 -0.70 -1.11 0.00 0.00 177.39 177.87 3ecs s GLU 82 N -1.66 2.23 0.00 1.96 2.56 -1.26 -4.73 118.70 117.79 3ecs s GLU 82 Ca 0.37 -2.14 0.00 0.00 0.00 0.00 0.00 54.97 53.20 3ecs s GLU 82 Cb 0.17 -1.98 0.00 0.00 2.00 0.00 0.00 34.13 34.32 3ecs s GLU 82 CO -0.08 -0.64 0.00 2.48 -0.56 0.00 0.00 175.26 176.46 3ecs n TYR 86 N -1.73 0.00 -4.13 5.30 0.18 -0.97 -5.12 117.16 110.69 3ecs n TYR 86 Ca -0.06 0.00 -0.17 0.00 1.88 0.00 0.00 57.90 59.55 3ecs n TYR 86 Cb 0.65 0.00 -0.15 0.00 -0.38 0.00 0.00 39.34 39.46 3ecs n TYR 86 CO 0.00 0.00 0.00 0.45 -2.08 0.00 0.00 176.86 175.23 3ecs s SER 87 N -2.38 0.69 0.46 9.48 0.15 -1.26 -5.01 113.70 115.83 3ecs s SER 87 Ca 0.00 -0.09 0.22 0.00 0.70 0.00 0.00 55.95 56.78 3ecs s SER 87 Cb 0.00 -0.21 1.13 0.00 -1.71 0.00 0.00 66.02 65.22 3ecs s SER 87 CO 0.00 0.00 1.95 0.11 1.20 0.00 0.00 173.24 176.50 3ecs h LYS 88 N 6.59 0.00 -0.02 5.44 1.57 -2.00 -2.71 116.57 125.43 3ecs h LYS 88 Ca -0.34 0.00 -0.07 0.00 -1.87 0.00 0.00 60.65 58.37 3ecs h LYS 88 Cb 1.17 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.47 3ecs h LYS 88 CO 0.49 0.21 -0.32 0.00 -0.57 0.00 0.00 179.45 179.26 3ecs n LYS 90 N -4.15 0.10 -1.13 0.00 3.00 -1.02 -2.88 118.16 112.08 3ecs n LYS 90 Ca -0.02 0.59 -0.33 0.00 -0.00 0.00 0.00 58.31 58.55 3ecs n LYS 90 Cb 0.37 -1.84 -0.03 0.00 0.00 0.00 0.00 35.03 33.53 3ecs n LYS 90 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.40 179.03 3ecs n LYS 91 N -2.04 3.19 -2.51 1.64 5.02 -0.81 -4.77 118.16 117.89 3ecs n LYS 91 Ca -0.01 -1.95 -0.38 0.00 -2.02 0.00 0.00 58.31 53.95 3ecs n LYS 91 Cb 0.04 -2.68 0.01 0.00 -0.02 0.00 0.00 35.03 32.38 3ecs n LYS 91 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 3ecs n ILE 92 N 3.74 4.78 0.00 -0.18 5.41 -1.14 -4.53 119.36 127.45 3ecs n ILE 92 Ca 0.68 -5.46 0.00 0.00 1.00 0.00 0.00 62.75 58.97 3ecs n ILE 92 Cb 0.21 -1.43 0.00 0.00 -0.71 0.00 0.00 39.64 37.71 3ecs n ILE 92 CO 0.00 0.00 0.00 -0.38 0.00 0.00 0.00 176.55 176.17 3ecs n ILE 94 N -0.23 0.00 -0.14 1.39 5.41 -1.26 -0.74 119.36 123.79 3ecs n ILE 94 Ca 0.45 0.00 -0.08 0.00 1.00 0.00 0.00 62.75 64.12 3ecs n ILE 94 Cb 0.30 0.00 0.07 0.00 -0.71 0.00 0.00 39.64 39.30 3ecs n ILE 94 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 176.55 176.22 3ecs h GLU 95 N 0.00 0.90 -0.45 0.38 5.08 -1.98 0.20 114.58 118.71 3ecs h GLU 95 Ca 0.00 -0.33 -0.14 0.00 -1.00 0.00 0.00 59.36 57.90 3ecs h GLU 95 Cb 0.00 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.18 3ecs h GLU 95 CO 0.00 0.97 -0.25 0.00 -1.00 0.00 0.00 179.01 178.73 3ecs h ARG 96 N 0.80 0.97 -0.36 2.33 3.08 -1.31 -1.21 114.38 118.67 3ecs h ARG 96 Ca 0.13 -0.44 0.00 0.00 0.07 0.00 0.00 59.98 59.74 3ecs h ARG 96 Cb 0.66 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.67 3ecs h ARG 96 CO 0.05 1.10 0.24 0.78 -1.07 0.00 0.00 179.97 181.07 3ecs h GLY 97 N 0.81 0.51 1.72 0.04 0.00 -1.68 -0.52 103.07 103.95 3ecs h GLY 97 Ca 0.10 -0.19 -0.21 0.00 0.00 0.00 0.00 47.33 47.02 3ecs h GLY 97 CO 0.07 0.19 -0.93 0.83 0.00 0.00 0.00 176.54 176.70 3ecs h GLU 98 N 0.49 0.24 -0.79 4.80 5.08 -0.54 -2.34 114.58 121.53 3ecs h GLU 98 Ca 0.13 -0.28 -0.04 0.00 -1.00 0.00 0.00 59.36 58.17 3ecs h GLU 98 Cb -0.05 0.08 -0.04 0.00 0.50 0.00 0.00 28.75 29.25 3ecs h GLU 98 CO -0.03 1.01 0.35 1.25 -1.00 0.00 0.00 179.01 180.59 3ecs h LEU 99 N 0.13 1.06 0.03 1.33 5.85 -0.42 -1.37 115.31 121.92 3ecs h LEU 99 Ca -0.06 -0.16 -0.00 0.00 0.84 0.00 0.00 57.88 58.50 3ecs h LEU 99 Cb 1.57 -0.27 0.00 0.00 0.37 0.00 0.00 40.66 42.33 3ecs h LEU 99 CO 0.15 0.92 -0.01 0.15 -0.34 0.00 0.00 178.44 179.31 3ecs h PHE 100 N 1.13 -0.03 -0.77 1.25 3.04 -1.05 -1.09 116.94 119.42 3ecs h PHE 100 Ca 0.27 -0.00 -0.03 0.00 3.98 0.00 0.00 57.97 62.18 3ecs h PHE 100 Cb 0.17 0.01 -0.03 0.00 2.56 0.00 0.00 35.95 38.65 3ecs h PHE 100 CO 0.02 0.09 0.36 1.25 -2.02 0.00 0.00 178.31 178.00 3ecs h LEU 101 N -0.14 1.01 -1.08 0.59 6.46 -1.21 -0.62 115.31 120.32 3ecs h LEU 101 Ca -0.00 -0.14 -0.03 0.00 -0.12 0.00 0.00 57.88 57.58 3ecs h LEU 101 Cb 0.13 -0.26 -0.03 0.00 -0.73 0.00 0.00 40.66 39.77 3ecs h LEU 101 CO 0.01 0.87 0.27 -0.09 -0.62 0.00 0.00 178.44 178.88 3ecs h ARG 102 N 1.08 0.92 -0.25 1.25 2.43 -1.13 -2.52 114.38 116.17 3ecs h ARG 102 Ca 0.26 -0.14 -0.16 0.00 -0.81 0.00 0.00 59.98 59.13 3ecs h ARG 102 Cb 0.14 -0.16 0.00 0.00 -0.42 0.00 0.00 29.97 29.52 3ecs h ARG 102 CO -0.03 0.74 -0.49 -0.09 -1.51 0.00 0.00 179.97 178.60 3ecs h ARG 103 N 0.91 0.77 -0.16 0.20 2.43 -0.45 -2.96 114.38 115.12 3ecs h ARG 103 Ca 0.22 -0.49 0.00 0.00 -0.81 0.00 0.00 59.98 58.89 3ecs h ARG 103 Cb 0.15 0.06 0.00 0.00 -0.42 0.00 0.00 29.97 29.76 3ecs h ARG 103 CO -0.02 1.12 0.00 0.44 -1.51 0.00 0.00 179.97 180.00 3ecs n ILE 104 N -4.11 0.00 1.03 1.20 -5.35 -0.31 -2.43 119.36 109.38 3ecs n ILE 104 Ca -0.05 0.00 0.11 0.00 -0.27 0.00 0.00 62.75 62.54 3ecs n ILE 104 Cb 0.59 -0.10 0.01 0.00 -1.74 0.00 0.00 39.64 38.40 3ecs n ILE 104 CO 0.00 0.00 0.00 -1.20 -1.76 0.00 0.00 176.55 173.59 3ecs n SER 105 N -0.41 1.31 0.01 7.28 7.64 -0.98 -4.12 113.62 124.35 3ecs n SER 105 Ca 0.00 -1.09 0.11 0.00 1.01 0.00 0.00 58.87 58.90 3ecs n SER 105 Cb 0.04 0.64 -0.12 0.00 -1.01 0.00 0.00 64.21 63.76 3ecs n SER 105 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 3ecs n LEU 106 N -0.89 0.32 0.02 -3.43 4.32 -1.02 -4.60 117.00 111.72 3ecs n LEU 106 Ca 0.07 -0.07 -0.13 0.00 -0.02 0.00 0.00 56.01 55.87 3ecs n LEU 106 Cb 0.38 -0.02 -0.06 0.00 -1.62 0.00 0.00 43.42 42.10 3ecs n LEU 106 CO 0.35 0.03 0.58 0.28 -1.22 0.00 0.00 177.39 177.42 3ecs h SER 107 N 0.00 -1.32 -0.19 -1.43 0.02 -1.72 0.87 113.55 109.79 3ecs h SER 107 Ca 0.00 0.17 0.05 0.00 -0.84 0.00 0.00 61.79 61.17 3ecs h SER 107 Cb 0.88 0.53 -0.06 0.00 0.14 0.00 0.00 62.40 63.88 3ecs h SER 107 CO 0.00 -0.44 -0.22 -0.09 -1.14 0.00 0.00 176.83 174.94 3ecs h ARG 108 N -0.52 -0.24 0.00 3.45 2.43 -1.85 -0.23 114.38 117.43 3ecs h ARG 108 Ca 0.06 0.02 -0.08 0.00 -0.81 0.00 0.00 59.98 59.17 3ecs h ARG 108 Cb 0.64 0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 30.23 3ecs h ARG 108 CO -0.37 -0.16 -0.39 -0.91 -1.51 0.00 0.00 179.97 176.64 3ecs h ASN 109 N -0.25 0.00 0.71 -3.80 2.35 -1.81 -1.89 115.58 110.90 3ecs h ASN 109 Ca 0.12 0.00 -0.03 0.00 -0.55 0.00 0.00 56.30 55.84 3ecs h ASN 109 Cb 0.42 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.79 3ecs h ASN 109 CO -0.33 0.39 -0.14 0.50 -1.65 0.00 0.00 177.43 176.20 3ecs h LYS 110 N 0.00 0.00 0.19 0.81 3.64 0.21 -2.99 116.57 118.43 3ecs h LYS 110 Ca -0.00 0.00 -0.32 0.00 -1.27 0.00 0.00 60.65 59.06 3ecs h LYS 110 Cb 0.82 0.00 0.02 0.00 -0.41 0.00 0.00 32.23 32.66 3ecs h LYS 110 CO 0.05 0.14 -1.49 0.82 -2.27 0.00 0.00 179.45 176.70 3ecs h ILE 111 N 0.00 1.25 0.00 2.00 2.04 -0.26 -3.23 117.51 119.30 3ecs h ILE 111 Ca -0.00 -2.77 -0.04 0.00 1.00 0.00 0.00 64.86 63.04 3ecs h ILE 111 Cb 0.53 2.92 -0.01 0.00 -0.74 0.00 0.00 36.82 39.52 3ecs h ILE 111 CO 0.02 0.84 -0.19 0.00 0.00 0.00 0.00 178.15 178.82 3ecs h ALA 112 N 0.31 1.64 -0.22 1.87 0.00 -1.35 -2.64 119.26 118.88 3ecs h ALA 112 Ca -0.24 -0.18 -0.03 0.00 0.00 0.00 0.00 54.91 54.46 3ecs h ALA 112 Cb 2.08 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 19.83 3ecs h ALA 112 CO 0.22 0.24 0.02 0.22 0.00 0.00 0.00 179.25 179.95 3ecs h ASP 113 N 0.00 0.35 0.03 0.00 1.82 -1.59 -2.55 116.42 114.48 3ecs h ASP 113 Ca -0.00 -0.28 0.00 0.00 -0.39 0.00 0.00 57.03 56.36 3ecs h ASP 113 Cb 0.35 -0.09 0.00 0.00 0.68 0.00 0.00 39.33 40.27 3ecs h ASP 113 CO 0.03 0.54 0.00 0.18 -1.61 0.00 0.00 179.24 178.38 3ecs n LEU 114 N -4.71 0.00 -0.05 2.28 4.77 -1.01 -3.81 117.00 114.48 3ecs n LEU 114 Ca -0.04 0.02 -0.02 0.00 -0.03 0.00 0.00 56.01 55.94 3ecs n LEU 114 Cb 0.21 -0.02 -0.11 0.00 -2.33 0.00 0.00 43.42 41.17 3ecs n LEU 114 CO 0.37 -0.01 -0.86 0.00 -1.33 0.00 0.00 177.39 175.56 3ecs h HIS 116 N 0.00 0.58 -0.79 0.00 2.07 -1.63 -0.29 115.15 115.08 3ecs h HIS 116 Ca -0.25 0.04 0.18 0.00 -2.85 0.00 0.00 60.37 57.49 3ecs h HIS 116 Cb 1.46 -0.13 -0.05 0.00 2.57 0.00 0.00 27.41 31.26 3ecs h HIS 116 CO 0.00 0.04 0.54 1.15 -3.07 0.00 0.00 177.93 176.59 3ecs h THR 117 N 0.45 0.71 0.00 6.12 2.02 -1.85 -1.08 112.91 119.28 3ecs h THR 117 Ca 0.47 -0.10 0.00 0.00 0.77 0.00 0.00 66.41 67.55 3ecs h THR 117 Cb 0.76 0.39 0.00 0.00 -1.74 0.00 0.00 68.15 67.57 3ecs h THR 117 CO -0.44 0.05 -0.13 0.49 0.37 0.00 0.00 175.52 175.86 3ecs n PHE 118 N -4.44 0.65 -3.33 3.16 3.01 -0.13 -4.53 117.46 111.85 3ecs n PHE 118 Ca 0.16 0.19 -0.46 0.00 1.01 0.00 0.00 57.45 58.35 3ecs n PHE 118 Cb 0.66 -0.78 -0.04 0.00 -0.01 0.00 0.00 39.48 39.31 3ecs n PHE 118 CO 0.00 0.00 0.00 0.42 1.01 0.00 0.00 176.76 178.19 3ecs s ILE 119 N -3.09 5.34 0.26 4.37 1.01 -0.41 -5.05 121.20 123.64 3ecs s ILE 119 Ca 0.11 -1.97 -0.24 0.00 0.00 0.00 0.00 60.65 58.54 3ecs s ILE 119 Cb 0.14 -4.37 -0.09 0.00 0.01 0.00 0.00 42.46 38.15 3ecs s ILE 119 CO 0.61 -0.94 0.85 -0.54 0.00 0.00 0.00 174.94 174.92 3ecs s LYS 120 N 0.91 4.51 0.38 2.79 -0.14 -1.26 -4.98 119.74 121.95 3ecs s LYS 120 Ca 0.10 1.18 -0.27 0.00 -1.36 0.00 0.00 55.97 55.62 3ecs s LYS 120 Cb -0.21 -2.94 -0.11 0.00 -1.68 0.00 0.00 37.83 32.90 3ecs s LYS 120 CO -0.03 0.38 1.35 -3.47 -0.76 0.00 0.00 175.35 172.83 3ecs n ASP 121 N 0.85 3.05 0.00 2.83 2.03 -1.26 -1.66 116.55 122.39 3ecs n ASP 121 Ca -0.01 1.19 0.00 0.00 0.52 0.00 0.00 54.79 56.49 3ecs n ASP 121 Cb 0.50 -1.54 0.00 0.00 -0.72 0.00 0.00 41.12 39.36 3ecs n ASP 121 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3ecs n GLY 122 N 0.67 1.35 3.80 0.27 0.00 0.58 -4.94 105.19 106.93 3ecs n GLY 122 Ca 0.04 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.74 3ecs n GLY 122 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ecs s ALA 123 N -3.04 2.66 -0.28 4.61 0.00 -0.67 -4.89 121.76 120.16 3ecs s ALA 123 Ca 0.00 0.27 0.03 0.00 0.00 0.00 0.00 51.96 52.26 3ecs s ALA 123 Cb 0.00 -3.22 0.07 0.00 0.00 0.00 0.00 23.12 19.97 3ecs s ALA 123 CO 0.00 -1.08 -0.07 0.99 0.00 0.00 0.00 175.76 175.60 3ecs s THR 124 N -2.72 2.17 -0.08 0.00 2.01 -1.26 -2.11 115.64 113.64 3ecs s THR 124 Ca 0.61 -1.81 -0.13 0.00 0.31 0.00 0.00 61.69 60.67 3ecs s THR 124 Cb -0.16 -2.37 -0.05 0.00 0.01 0.00 0.00 72.50 69.94 3ecs s THR 124 CO 0.46 -0.19 0.33 -0.63 -0.69 0.00 0.00 174.62 173.90 3ecs s ILE 125 N 1.06 5.22 -0.17 1.82 1.01 -0.31 -0.89 121.20 128.94 3ecs s ILE 125 Ca -0.04 0.64 -0.01 0.00 0.00 0.00 0.00 60.65 61.24 3ecs s ILE 125 Cb -0.20 -3.64 -0.01 0.00 0.01 0.00 0.00 42.46 38.63 3ecs s ILE 125 CO -0.06 0.50 -0.10 -0.22 0.00 0.00 0.00 174.94 175.06 3ecs s LEU 126 N -0.42 2.73 0.32 2.97 1.98 -0.68 -0.33 118.68 125.26 3ecs s LEU 126 Ca 0.20 -0.38 0.03 0.00 -2.89 0.00 0.00 54.13 51.09 3ecs s LEU 126 Cb -0.14 -1.65 -0.05 0.00 0.66 0.00 0.00 46.19 45.01 3ecs s LEU 126 CO 0.08 0.08 0.10 0.28 -1.89 0.00 0.00 176.35 175.00 3ecs s THR 127 N 0.84 0.78 -0.04 3.68 -1.32 0.13 -1.71 115.64 117.99 3ecs s THR 127 Ca -0.03 -2.00 0.03 0.00 -1.21 0.00 0.00 61.69 58.48 3ecs s THR 127 Cb -0.15 -2.61 0.00 0.00 -1.51 0.00 0.00 72.50 68.23 3ecs s THR 127 CO 0.01 0.00 -0.13 -2.28 -2.21 0.00 0.00 174.62 170.00 3ecs s HIS 128 N -3.44 1.36 0.00 9.09 2.46 -1.26 -3.12 115.29 120.39 3ecs s HIS 128 Ca 0.34 -0.39 0.00 0.00 0.47 0.00 0.00 55.06 55.48 3ecs s HIS 128 Cb 0.07 -0.94 0.00 0.00 -0.13 0.00 0.00 32.58 31.57 3ecs s HIS 128 CO 0.15 -0.15 0.00 0.00 -2.47 0.00 0.00 174.74 172.27 3ecs n ALA 129 N 3.29 0.00 -2.88 1.58 0.00 -1.25 -4.71 120.51 116.55 3ecs n ALA 129 Ca -0.19 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 52.90 3ecs n ALA 129 Cb 0.53 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.93 3ecs n ALA 129 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 3ecs s TYR 130 N 0.00 3.56 -0.19 0.00 5.04 -1.24 -4.46 117.35 120.05 3ecs s TYR 130 Ca 0.00 0.44 -0.07 0.00 -2.44 0.00 0.00 57.07 55.00 3ecs s TYR 130 Cb 0.00 -1.89 0.08 0.00 0.35 0.00 0.00 41.96 40.51 3ecs s TYR 130 CO 0.00 0.69 0.42 0.45 -1.34 0.00 0.00 175.55 175.77 3ecs s SER 131 N -1.38 -0.31 0.17 4.32 0.15 -1.26 -4.97 113.70 110.41 3ecs s SER 131 Ca 0.20 0.97 -0.10 0.00 0.70 0.00 0.00 55.95 57.72 3ecs s SER 131 Cb -0.12 1.22 0.06 0.00 -1.71 0.00 0.00 66.02 65.47 3ecs s SER 131 CO 0.10 -0.22 1.66 0.03 1.20 0.00 0.00 173.24 176.00 3ecs h ARG 132 N 7.94 1.00 -0.36 5.44 3.08 -1.98 -0.67 114.38 128.83 3ecs h ARG 132 Ca -0.20 -0.28 -0.13 0.00 0.07 0.00 0.00 59.98 59.43 3ecs h ARG 132 Cb 1.13 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 31.05 3ecs h ARG 132 CO 0.16 0.95 -0.32 0.28 -1.07 0.00 0.00 179.97 179.97 3ecs h VAL 133 N 0.90 1.28 -0.01 2.04 2.07 -1.96 -1.95 116.25 118.61 3ecs h VAL 133 Ca 0.18 -1.47 -0.00 0.00 0.82 0.00 0.00 66.70 66.23 3ecs h VAL 133 Cb 0.45 1.34 -0.00 0.00 -1.52 0.00 0.00 31.29 31.57 3ecs h VAL 133 CO 0.02 0.48 0.00 0.58 0.02 0.00 0.00 177.57 178.67 3ecs h VAL 134 N 0.66 1.22 -0.79 2.57 2.07 -1.84 -1.90 116.25 118.24 3ecs h VAL 134 Ca 0.07 -0.65 0.15 0.00 0.82 0.00 0.00 66.70 67.09 3ecs h VAL 134 Cb 0.86 1.65 -0.10 0.00 -1.52 0.00 0.00 31.29 32.18 3ecs h VAL 134 CO 0.07 0.17 0.33 0.25 0.02 0.00 0.00 177.57 178.41 3ecs h LEU 135 N -0.26 0.31 -0.28 2.57 6.46 -1.03 -1.67 115.31 121.41 3ecs h LEU 135 Ca 0.00 0.11 -0.04 0.00 -0.12 0.00 0.00 57.88 57.84 3ecs h LEU 135 Cb 0.28 0.09 -0.01 0.00 -0.73 0.00 0.00 40.66 40.29 3ecs h LEU 135 CO 0.00 0.10 0.02 0.03 -0.62 0.00 0.00 178.44 177.97 3ecs h ARG 136 N 0.46 0.49 -0.85 1.25 2.47 -1.22 -1.08 114.38 115.90 3ecs h ARG 136 Ca 0.44 -0.15 0.07 0.00 -1.26 0.00 0.00 59.98 59.09 3ecs h ARG 136 Cb 0.69 -0.05 -0.06 0.00 -1.65 0.00 0.00 29.97 28.91 3ecs h ARG 136 CO -0.42 0.63 0.55 0.28 0.56 0.00 0.00 179.97 181.57 3ecs h VAL 137 N 0.28 1.03 0.00 2.04 2.07 -0.54 0.89 116.25 122.03 3ecs h VAL 137 Ca 0.08 -0.31 -0.18 0.00 0.82 0.00 0.00 66.70 67.11 3ecs h VAL 137 Cb 0.39 0.04 -0.02 0.00 -1.52 0.00 0.00 31.29 30.18 3ecs h VAL 137 CO 0.01 0.17 -0.85 -0.07 0.02 0.00 0.00 177.57 176.85 3ecs h LEU 138 N 0.91 0.03 -0.30 2.57 3.38 -1.17 -2.59 115.31 118.14 3ecs h LEU 138 Ca 0.37 -0.02 -0.03 0.00 0.09 0.00 0.00 57.88 58.29 3ecs h LEU 138 Cb 0.26 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 40.99 3ecs h LEU 138 CO -0.14 0.86 0.08 -0.33 0.09 0.00 0.00 178.44 179.00 3ecs h GLU 139 N 0.01 0.49 0.00 1.13 5.08 -0.21 -0.99 114.58 120.09 3ecs h GLU 139 Ca -0.01 -0.12 0.00 0.00 -1.00 0.00 0.00 59.36 58.23 3ecs h GLU 139 Cb 1.50 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 30.68 3ecs h GLU 139 CO 0.11 0.56 0.00 0.00 -1.00 0.00 0.00 179.01 178.68 3ecs h ALA 140 N 0.91 1.00 0.15 3.43 0.00 -0.76 -1.50 119.26 122.49 3ecs h ALA 140 Ca 0.10 0.00 -0.34 0.00 0.00 0.00 0.00 54.91 54.66 3ecs h ALA 140 Cb 0.29 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.08 3ecs h ALA 140 CO 0.00 0.00 -1.78 0.00 0.00 0.00 0.00 179.25 177.47 3ecs h ALA 141 N 2.01 0.26 -0.39 0.00 0.00 -0.88 -3.24 119.26 117.02 3ecs h ALA 141 Ca 0.00 -1.23 -0.06 0.00 0.00 0.00 0.00 54.91 53.62 3ecs h ALA 141 Cb 0.08 0.56 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 3ecs h ALA 141 CO 0.00 1.09 0.00 -0.39 0.00 0.00 0.00 179.25 179.95 3ecs h VAL 142 N -0.00 1.26 0.00 0.00 -1.51 -0.58 -2.26 116.25 113.15 3ecs h VAL 142 Ca -0.37 -1.00 -0.00 0.00 -1.23 0.00 0.00 66.70 64.10 3ecs h VAL 142 Cb 2.00 1.13 -0.00 0.00 -2.13 0.00 0.00 31.29 32.29 3ecs h VAL 142 CO 0.12 0.34 -0.01 0.00 -1.23 0.00 0.00 177.57 176.79 3ecs h ALA 143 N 0.88 1.18 -0.27 5.19 0.00 -1.45 0.86 119.26 125.66 3ecs h ALA 143 Ca 0.11 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.02 3ecs h ALA 143 Cb 0.47 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.26 3ecs h ALA 143 CO 0.02 0.01 0.00 0.00 0.00 0.00 0.00 179.25 179.28 3ecs n ALA 144 N -2.17 2.70 -0.75 0.00 0.00 -0.91 -4.86 120.51 114.52 3ecs n ALA 144 Ca -0.03 -0.61 0.00 0.00 0.00 0.00 0.00 53.44 52.80 3ecs n ALA 144 Cb 0.09 -1.01 0.00 0.00 0.00 0.00 0.00 19.45 18.54 3ecs n ALA 144 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3ecs n LYS 145 N 0.31 -0.42 -1.83 0.00 4.76 0.30 -4.96 118.16 116.32 3ecs n LYS 145 Ca 0.10 0.10 -0.38 0.00 -2.87 0.00 0.00 58.31 55.27 3ecs n LYS 145 Cb 0.40 -4.08 0.04 0.00 -1.84 0.00 0.00 35.03 29.55 3ecs n LYS 145 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 3ecs s LYS 146 N -0.93 3.15 -0.16 1.97 1.02 -0.90 -5.00 119.74 118.89 3ecs s LYS 146 Ca 0.00 2.17 -0.01 0.00 0.02 0.00 0.00 55.97 58.16 3ecs s LYS 146 Cb 0.00 -2.23 -0.01 0.00 -0.52 0.00 0.00 37.83 35.07 3ecs s LYS 146 CO 0.00 -1.16 -0.12 1.03 -0.92 0.00 0.00 175.35 174.17 3ecs s ARG 147 N -2.93 3.30 0.22 1.68 3.00 -1.26 -4.49 118.95 118.46 3ecs s ARG 147 Ca 0.72 -0.70 -0.16 0.00 0.00 0.00 0.00 55.73 55.58 3ecs s ARG 147 Cb -0.39 -2.71 0.02 0.00 0.00 0.00 0.00 34.95 31.87 3ecs s ARG 147 CO 0.46 0.02 0.53 -0.59 0.00 0.00 0.00 175.30 175.72 3ecs s PHE 148 N 0.83 0.03 0.13 -0.53 -0.71 -1.26 0.22 117.98 116.68 3ecs s PHE 148 Ca -0.04 -0.40 0.05 0.00 -1.04 0.00 0.00 56.93 55.50 3ecs s PHE 148 Cb -0.15 0.36 -0.04 0.00 -1.21 0.00 0.00 43.02 41.98 3ecs s PHE 148 CO 0.00 -0.98 -0.13 -1.54 -1.34 0.00 0.00 175.22 171.24 3ecs s SER 149 N -2.93 1.92 0.12 1.98 1.04 -0.90 -4.18 113.70 110.76 3ecs s SER 149 Ca 0.14 -0.84 0.08 0.00 0.48 0.00 0.00 55.95 55.80 3ecs s SER 149 Cb -0.01 -0.05 -0.04 0.00 0.10 0.00 0.00 66.02 66.01 3ecs s SER 149 CO 0.02 -0.18 -0.20 -0.69 0.98 0.00 0.00 173.24 173.17 3ecs s VAL 150 N -2.36 1.73 -0.09 5.02 1.01 0.10 -1.16 120.40 124.65 3ecs s VAL 150 Ca 0.10 -1.67 0.03 0.00 0.00 0.00 0.00 61.98 60.44 3ecs s VAL 150 Cb -0.04 -1.64 0.01 0.00 0.00 0.00 0.00 36.38 34.71 3ecs s VAL 150 CO 0.02 -0.16 -0.17 -0.31 0.00 0.00 0.00 175.10 174.48 3ecs s TYR 151 N -1.48 2.00 -0.02 5.22 2.02 0.55 -0.73 117.35 124.91 3ecs s TYR 151 Ca 0.09 -0.82 0.00 0.00 -0.37 0.00 0.00 57.07 55.98 3ecs s TYR 151 Cb -0.08 -1.39 0.02 0.00 -0.40 0.00 0.00 41.96 40.10 3ecs s TYR 151 CO 0.05 -0.37 -0.00 0.54 -1.57 0.00 0.00 175.55 174.19 3ecs s VAL 152 N 0.60 0.12 0.40 0.71 0.11 -0.69 0.19 120.40 121.84 3ecs s VAL 152 Ca -0.15 0.04 -0.25 0.00 -2.93 0.00 0.00 61.98 58.69 3ecs s VAL 152 Cb -0.16 -0.17 -0.08 0.00 -1.53 0.00 0.00 36.38 34.43 3ecs s VAL 152 CO 0.05 0.09 1.17 0.42 -3.33 0.00 0.00 175.10 173.50 3ecs s THR 153 N 0.56 3.13 0.39 5.04 -4.23 -1.18 -0.90 115.64 118.46 3ecs s THR 153 Ca -0.05 0.95 0.25 0.00 -1.18 0.00 0.00 61.69 61.66 3ecs s THR 153 Cb -0.08 -3.53 0.27 0.00 1.34 0.00 0.00 72.50 70.50 3ecs s THR 153 CO -0.01 0.08 2.03 1.05 -0.54 0.00 0.00 174.62 177.23 3ecs h GLU 154 N 2.62 0.00 -4.89 3.99 4.11 -1.34 -3.32 114.58 115.75 3ecs h GLU 154 Ca -0.49 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.94 3ecs h GLU 154 Cb 1.24 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.49 3ecs h GLU 154 CO 0.62 0.15 -0.14 0.45 0.07 0.00 0.00 179.01 180.16 3ecs n SER 155 N -3.70 -6.74 -4.65 3.06 2.88 -1.26 -1.35 113.62 101.86 3ecs n SER 155 Ca -0.02 0.12 -0.34 0.00 -1.33 0.00 0.00 58.87 57.30 3ecs n SER 155 Cb 0.27 -4.52 0.11 0.00 -0.75 0.00 0.00 64.21 59.32 3ecs n SER 155 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3ecs n GLN 156 N -1.16 0.32 0.04 -1.46 1.13 -1.26 -1.89 117.38 113.10 3ecs n GLN 156 Ca 0.03 0.18 0.11 0.00 -1.94 0.00 0.00 57.00 55.38 3ecs n GLN 156 Cb 0.45 -2.33 -0.02 0.00 0.11 0.00 0.00 30.24 28.45 3ecs n GLN 156 CO 0.00 0.00 0.00 -0.35 -1.44 0.00 0.00 177.06 175.27 3ecs n PRO 157 N -2.61 0.46 0.00 -1.09 -0.04 -1.26 -4.77 135.00 125.69 3ecs n PRO 157 Ca 0.13 0.00 0.14 0.00 -0.04 0.00 0.00 63.50 63.73 3ecs n PRO 157 Cb 0.50 -1.65 0.63 0.00 -0.04 0.00 0.00 33.50 32.93 3ecs n PRO 157 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 3ecs n ASP 158 N -2.25 0.36 -3.08 3.54 5.75 -1.24 -4.95 116.55 114.68 3ecs n ASP 158 Ca 0.00 -0.43 -0.22 0.00 -0.01 0.00 0.00 54.79 54.12 3ecs n ASP 158 Cb 0.50 -0.12 0.02 0.00 -1.03 0.00 0.00 41.12 40.49 3ecs n ASP 158 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 3ecs n LEU 159 N -1.06 -2.35 0.30 -2.12 4.77 -0.79 -4.87 117.00 110.88 3ecs n LEU 159 Ca 0.14 -0.30 0.18 0.00 -0.03 0.00 0.00 56.01 56.00 3ecs n LEU 159 Cb 0.27 -2.75 0.97 0.00 -2.33 0.00 0.00 43.42 39.59 3ecs n LEU 159 CO 0.24 0.20 1.10 0.77 -1.33 0.00 0.00 177.39 178.36 3ecs h SER 160 N -1.23 0.00 -0.39 -1.43 4.64 -1.63 -1.11 113.55 112.41 3ecs h SER 160 Ca -0.50 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 60.71 3ecs h SER 160 Cb 1.34 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.42 3ecs h SER 160 CO 0.56 0.03 -0.14 1.23 -0.87 0.00 0.00 176.83 177.64 3ecs h GLY 161 N 0.52 0.92 2.00 -0.77 0.00 -1.36 -2.44 103.07 101.95 3ecs h GLY 161 Ca -0.00 -0.74 -0.05 0.00 0.00 0.00 0.00 47.33 46.54 3ecs h GLY 161 CO 0.00 0.67 -0.25 0.50 0.00 0.00 0.00 176.54 177.47 3ecs h LYS 162 N 0.76 0.00 -1.31 4.80 1.57 -1.23 -0.27 116.57 120.90 3ecs h LYS 162 Ca 0.12 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.90 3ecs h LYS 162 Cb 0.66 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.97 3ecs h LYS 162 CO 0.05 0.25 0.00 1.17 -0.57 0.00 0.00 179.45 180.35 3ecs n LYS 163 N -4.17 0.70 0.00 3.15 4.81 -0.92 -2.31 118.16 119.43 3ecs n LYS 163 Ca -0.02 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.42 3ecs n LYS 163 Cb 0.31 -1.15 0.00 0.00 0.02 0.00 0.00 35.03 34.21 3ecs n LYS 163 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 3ecs n ALA 165 N 0.66 0.00 -0.21 3.14 0.00 -0.11 -2.42 120.51 121.57 3ecs n ALA 165 Ca 0.00 0.00 0.06 0.00 0.00 0.00 0.00 53.44 53.50 3ecs n ALA 165 Cb 0.35 0.00 0.33 0.00 0.00 0.00 0.00 19.45 20.13 3ecs n ALA 165 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 3ecs h LYS 166 N 0.00 0.80 -0.13 0.00 1.57 -1.74 0.19 116.57 117.25 3ecs h LYS 166 Ca 0.00 -0.05 -0.20 0.00 -1.87 0.00 0.00 60.65 58.53 3ecs h LYS 166 Cb 0.00 -0.18 0.00 0.00 0.08 0.00 0.00 32.23 32.13 3ecs h LYS 166 CO 0.00 0.53 -0.73 0.00 -0.57 0.00 0.00 179.45 178.68 3ecs h ALA 167 N 1.58 0.47 -0.00 3.86 0.00 -1.78 -1.21 119.26 122.18 3ecs h ALA 167 Ca 0.33 -0.59 -0.15 0.00 0.00 0.00 0.00 54.91 54.50 3ecs h ALA 167 Cb 0.23 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 3ecs h ALA 167 CO -0.11 0.72 -0.70 -0.07 0.00 0.00 0.00 179.25 179.08 3ecs h LEU 168 N 0.44 0.01 -1.20 0.00 3.38 -1.74 -2.72 115.31 113.46 3ecs h LEU 168 Ca -0.04 -0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.88 3ecs h LEU 168 Cb 1.33 -0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.06 3ecs h LEU 168 CO 0.14 0.71 -0.01 0.00 0.09 0.00 0.00 178.44 179.37 3ecs n HIS 170 N -4.27 0.39 -0.17 0.00 8.25 -0.48 -0.61 115.22 118.33 3ecs n HIS 170 Ca 0.01 0.13 0.11 0.00 -0.26 0.00 0.00 57.72 57.72 3ecs n HIS 170 Cb 0.25 -0.72 0.28 0.00 1.12 0.00 0.00 29.99 30.93 3ecs n HIS 170 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 3ecs n LEU 171 N -1.84 3.75 -3.86 2.41 4.77 -0.49 -4.95 117.00 116.79 3ecs n LEU 171 Ca 0.05 -1.86 -0.32 0.00 -0.03 0.00 0.00 56.01 53.85 3ecs n LEU 171 Cb 0.28 -0.41 0.01 0.00 -2.33 0.00 0.00 43.42 40.98 3ecs n LEU 171 CO 0.22 0.90 -0.16 -0.46 -1.33 0.00 0.00 177.39 176.56 3ecs n ASN 172 N 1.53 -3.46 -4.45 -1.43 0.23 0.22 -4.96 115.26 102.94 3ecs n ASN 172 Ca 0.22 -0.96 -0.36 0.00 -0.53 0.00 0.00 54.58 52.95 3ecs n ASN 172 Cb 0.60 -1.27 -0.12 0.00 -2.08 0.00 0.00 39.78 36.91 3ecs n ASN 172 CO 0.00 0.00 0.00 -0.69 -0.93 0.00 0.00 177.26 175.64 3ecs s VAL 173 N -3.46 4.12 -0.09 3.53 1.01 -0.61 -5.02 120.40 119.88 3ecs s VAL 173 Ca 0.26 -0.25 -0.32 0.00 0.00 0.00 0.00 61.98 61.67 3ecs s VAL 173 Cb -0.15 -2.89 -0.10 0.00 0.00 0.00 0.00 36.38 33.24 3ecs s VAL 173 CO 0.76 0.39 1.99 -2.65 0.00 0.00 0.00 175.10 175.59 3ecs n PRO 174 N 4.53 2.30 -4.16 2.72 -0.02 -1.26 -4.36 135.00 134.75 3ecs n PRO 174 Ca -0.17 0.81 -0.18 0.00 -2.02 0.00 0.00 63.50 61.94 3ecs n PRO 174 Cb 0.52 -2.84 -0.16 0.00 -0.02 0.00 0.00 33.50 31.00 3ecs n PRO 174 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 3ecs s VAL 175 N 5.08 0.48 -0.05 -1.45 0.11 -1.26 0.01 120.40 123.32 3ecs s VAL 175 Ca 0.94 -0.16 0.04 0.00 -2.93 0.00 0.00 61.98 59.87 3ecs s VAL 175 Cb -0.57 -0.47 -0.02 0.00 -1.53 0.00 0.00 36.38 33.79 3ecs s VAL 175 CO 0.46 0.18 -0.15 -0.89 -3.33 0.00 0.00 175.10 171.37 3ecs s THR 176 N 0.49 2.97 -0.01 5.04 2.01 0.10 -4.98 115.64 121.26 3ecs s THR 176 Ca -0.06 -0.76 -0.05 0.00 0.31 0.00 0.00 61.69 61.14 3ecs s THR 176 Cb -0.10 -2.16 -0.04 0.00 0.01 0.00 0.00 72.50 70.21 3ecs s THR 176 CO -0.00 0.59 0.22 -0.69 -0.69 0.00 0.00 174.62 174.05 3ecs s VAL 177 N -0.66 5.38 0.11 3.82 1.01 -1.26 -1.70 120.40 127.10 3ecs s VAL 177 Ca 0.10 0.03 0.02 0.00 0.00 0.00 0.00 61.98 62.12 3ecs s VAL 177 Cb -0.11 -3.54 -0.04 0.00 0.00 0.00 0.00 36.38 32.69 3ecs s VAL 177 CO 0.01 0.36 -0.05 0.68 0.00 0.00 0.00 175.10 176.10 3ecs s VAL 178 N -1.29 0.68 0.66 2.92 -7.23 -0.07 -4.92 120.40 111.14 3ecs s VAL 178 Ca 0.27 -1.94 -0.15 0.00 -1.81 0.00 0.00 61.98 58.34 3ecs s VAL 178 Cb -0.13 -1.77 0.00 0.00 0.56 0.00 0.00 36.38 35.04 3ecs s VAL 178 CO 0.16 -0.79 1.11 -0.76 -0.31 0.00 0.00 175.10 174.51 3ecs s LEU 179 N -3.07 3.37 0.55 1.32 1.02 -1.26 -0.94 118.68 119.67 3ecs s LEU 179 Ca 0.14 1.99 0.29 0.00 0.02 0.00 0.00 54.13 56.57 3ecs s LEU 179 Cb 0.05 -4.55 1.62 0.00 0.02 0.00 0.00 46.19 43.33 3ecs s LEU 179 CO -0.03 -1.65 2.15 0.44 0.02 0.00 0.00 176.35 177.28 3ecs h ASP 180 N -0.04 0.00 0.60 2.29 3.32 -1.97 -0.06 116.42 120.56 3ecs h ASP 180 Ca -0.47 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.58 3ecs h ASP 180 Cb 1.25 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.80 3ecs h ASP 180 CO 0.54 0.07 -0.03 0.00 -1.72 0.00 0.00 179.24 178.10 3ecs n ALA 181 N -2.28 2.54 -0.69 3.45 0.00 -1.26 -3.84 120.51 118.43 3ecs n ALA 181 Ca -0.02 -0.16 0.08 0.00 0.00 0.00 0.00 53.44 53.34 3ecs n ALA 181 Cb 0.18 -1.45 0.32 0.00 0.00 0.00 0.00 19.45 18.50 3ecs n ALA 181 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3ecs n ALA 182 N -1.27 3.07 -0.07 0.00 0.00 -0.04 -4.56 120.51 117.64 3ecs n ALA 182 Ca 0.13 -1.75 -0.14 0.00 0.00 0.00 0.00 53.44 51.69 3ecs n ALA 182 Cb 0.26 -0.88 -0.06 0.00 0.00 0.00 0.00 19.45 18.77 3ecs n ALA 182 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 3ecs h VAL 183 N 3.30 1.33 0.00 0.00 2.07 -1.69 -0.69 116.25 120.57 3ecs h VAL 183 Ca 0.00 -1.47 -0.07 0.00 0.82 0.00 0.00 66.70 65.98 3ecs h VAL 183 Cb 1.44 1.78 -0.01 0.00 -1.52 0.00 0.00 31.29 32.98 3ecs h VAL 183 CO 0.24 0.45 -0.33 1.23 0.02 0.00 0.00 177.57 179.18 3ecs h GLY 184 N 0.25 0.00 0.99 2.17 0.00 -1.89 -3.04 103.07 101.54 3ecs h GLY 184 Ca 0.03 0.00 -0.21 0.00 0.00 0.00 0.00 47.33 47.15 3ecs h GLY 184 CO 0.07 0.00 -0.81 -1.82 0.00 0.00 0.00 176.54 173.98 3ecs h TYR 185 N 0.00 0.83 -0.83 5.60 3.20 -1.81 -3.42 116.97 120.53 3ecs h TYR 185 Ca -0.00 -0.44 -0.73 0.00 3.14 0.00 0.00 58.73 60.69 3ecs h TYR 185 Cb 0.76 -0.10 -0.09 0.00 1.54 0.00 0.00 36.73 38.84 3ecs h TYR 185 CO 0.00 1.27 2.64 1.51 -1.64 0.00 0.00 178.16 181.94 3ecs n ILE 186 N -4.05 4.42 0.00 1.81 0.13 -0.28 -4.81 119.36 116.59 3ecs n ILE 186 Ca -0.11 -3.82 0.00 0.00 -1.10 0.00 0.00 62.75 57.72 3ecs n ILE 186 Cb 0.77 -2.37 0.00 0.00 -0.84 0.00 0.00 39.64 37.20 3ecs n ILE 186 CO 0.00 0.00 0.00 -1.84 2.80 0.00 0.00 176.55 177.51 3ecs n GLU 188 N 3.65 0.00 0.02 9.51 0.28 -1.26 -3.68 120.64 129.15 3ecs n GLU 188 Ca 0.55 0.00 0.13 0.00 -0.16 0.00 0.00 57.16 57.67 3ecs n GLU 188 Cb 0.31 0.00 0.38 0.00 1.43 0.00 0.00 31.44 33.56 3ecs n GLU 188 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 3ecs n LYS 189 N 0.00 0.08 -3.36 3.44 5.02 -1.26 -4.90 118.16 117.18 3ecs n LYS 189 Ca 0.00 0.04 -0.28 0.00 -2.02 0.00 0.00 58.31 56.04 3ecs n LYS 189 Cb 0.00 -1.56 -0.03 0.00 -0.02 0.00 0.00 35.03 33.42 3ecs n LYS 189 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3ecs s ALA 190 N -3.04 3.64 -0.21 7.82 0.00 -1.24 -4.81 121.76 123.92 3ecs s ALA 190 Ca 0.11 -0.59 0.12 0.00 0.00 0.00 0.00 51.96 51.60 3ecs s ALA 190 Cb 0.17 -2.27 -0.21 0.00 0.00 0.00 0.00 23.12 20.80 3ecs s ALA 190 CO 0.63 0.24 -0.03 -0.25 0.00 0.00 0.00 175.76 176.35 3ecs n ASP 191 N -0.96 0.84 -3.43 0.00 8.00 -0.07 -4.99 116.55 115.93 3ecs n ASP 191 Ca -0.02 -0.05 -0.12 0.00 0.71 0.00 0.00 54.79 55.31 3ecs n ASP 191 Cb 0.54 0.50 -0.02 0.00 -0.02 0.00 0.00 41.12 42.12 3ecs n ASP 191 CO 0.00 0.00 0.00 -1.48 -0.39 0.00 0.00 177.20 175.33 3ecs s LEU 192 N -5.80 -0.56 0.06 0.64 2.34 -1.23 -4.32 118.68 109.81 3ecs s LEU 192 Ca -0.18 0.05 0.09 0.00 0.06 0.00 0.00 54.13 54.15 3ecs s LEU 192 Cb 0.07 2.54 -0.03 0.00 -0.56 0.00 0.00 46.19 48.21 3ecs s LEU 192 CO 0.72 -0.91 -0.25 0.68 -1.06 0.00 0.00 176.35 175.53 3ecs s VAL 193 N -3.52 2.03 -0.07 1.48 -7.23 -0.90 -1.69 120.40 110.50 3ecs s VAL 193 Ca 0.01 -1.41 0.01 0.00 -1.81 0.00 0.00 61.98 58.77 3ecs s VAL 193 Cb -0.01 -1.76 0.02 0.00 0.56 0.00 0.00 36.38 35.19 3ecs s VAL 193 CO -0.11 0.27 -0.08 -0.63 -0.31 0.00 0.00 175.10 174.24 3ecs s ILE 194 N -0.86 0.86 0.16 -0.62 1.01 -0.69 -1.13 121.20 119.92 3ecs s ILE 194 Ca 0.11 -0.28 0.01 0.00 0.00 0.00 0.00 60.65 60.48 3ecs s ILE 194 Cb -0.10 -0.84 -0.04 0.00 0.01 0.00 0.00 42.46 41.49 3ecs s ILE 194 CO 0.03 0.30 0.02 0.68 0.00 0.00 0.00 174.94 175.97 3ecs s VAL 195 N 1.01 0.48 0.00 2.92 -7.23 -0.44 -4.24 120.40 112.90 3ecs s VAL 195 Ca -0.09 -1.95 0.00 0.00 -1.81 0.00 0.00 61.98 58.13 3ecs s VAL 195 Cb -0.15 -2.07 0.00 0.00 0.56 0.00 0.00 36.38 34.72 3ecs s VAL 195 CO -0.00 -0.49 0.00 0.61 -0.31 0.00 0.00 175.10 174.91 3ecs n GLY 196 N -0.18 2.02 3.15 2.32 0.00 -1.26 -1.03 105.19 110.20 3ecs n GLY 196 Ca -0.06 -2.12 -0.12 0.00 0.00 0.00 0.00 46.02 43.71 3ecs n GLY 196 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ecs s ALA 197 N -2.00 -0.54 0.01 4.61 0.00 -1.25 -4.79 121.76 117.80 3ecs s ALA 197 Ca 0.00 0.22 -0.15 0.00 0.00 0.00 0.00 51.96 52.03 3ecs s ALA 197 Cb 0.00 -0.03 -0.35 0.00 0.00 0.00 0.00 23.12 22.74 3ecs s ALA 197 CO 0.00 -0.20 0.92 0.93 0.00 0.00 0.00 175.76 177.41 3ecs h GLU 198 N 4.55 0.51 -2.17 0.00 4.39 -1.29 -3.47 114.58 117.09 3ecs h GLU 198 Ca -0.29 -0.87 -0.06 0.00 0.34 0.00 0.00 59.36 58.47 3ecs h GLU 198 Cb 1.19 0.32 -0.20 0.00 -0.10 0.00 0.00 28.75 29.96 3ecs h GLU 198 CO 0.39 1.42 0.08 0.20 -1.16 0.00 0.00 179.01 179.94 3ecs s GLY 199 N -4.73 -0.50 -0.27 -3.84 0.00 -0.92 -3.55 107.32 93.52 3ecs s GLY 199 Ca -0.11 1.46 -0.07 0.00 0.00 0.00 0.00 44.72 46.00 3ecs s GLY 199 CO 0.93 1.16 0.07 0.14 0.00 0.00 0.00 173.10 175.40 3ecs s VAL 200 N -0.50 4.16 0.60 1.40 1.01 -0.09 0.04 120.40 127.02 3ecs s VAL 200 Ca -0.06 -0.38 -0.07 0.00 0.00 0.00 0.00 61.98 61.47 3ecs s VAL 200 Cb -0.03 -3.02 0.01 0.00 0.00 0.00 0.00 36.38 33.34 3ecs s VAL 200 CO 0.05 0.24 0.93 -0.69 0.00 0.00 0.00 175.10 175.63 3ecs s VAL 201 N 1.57 3.69 -0.59 2.92 1.01 -0.34 -1.24 120.40 127.42 3ecs s VAL 201 Ca 0.05 0.09 0.08 0.00 0.00 0.00 0.00 61.98 62.21 3ecs s VAL 201 Cb -0.16 -3.48 0.08 0.00 0.00 0.00 0.00 36.38 32.83 3ecs s VAL 201 CO 0.03 -0.51 1.22 -0.62 0.00 0.00 0.00 175.10 175.22 3ecs n GLU 202 N -2.64 0.05 -0.20 2.72 1.02 -0.58 -1.16 120.64 119.85 3ecs n GLU 202 Ca 0.05 0.53 0.10 0.00 -0.02 0.00 0.00 57.16 57.81 3ecs n GLU 202 Cb 0.57 -1.73 0.20 0.00 -0.02 0.00 0.00 31.44 30.46 3ecs n GLU 202 CO 0.00 0.00 0.00 0.27 1.18 0.00 0.00 177.13 178.58 3ecs n ASN 203 N -1.78 3.27 0.00 1.62 0.23 -1.26 -3.69 115.26 113.65 3ecs n ASN 203 Ca -0.01 -1.93 0.00 0.00 -0.53 0.00 0.00 54.58 52.11 3ecs n ASN 203 Cb 0.06 -0.27 0.00 0.00 -2.08 0.00 0.00 39.78 37.50 3ecs n ASN 203 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3ecs n GLY 204 N 1.19 0.74 3.94 4.83 0.00 -0.31 -4.49 105.19 111.09 3ecs n GLY 204 Ca 0.17 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.92 3ecs n GLY 204 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3ecs s GLY 205 N -1.62 1.72 0.11 -0.02 0.00 -1.25 -4.58 107.32 101.69 3ecs s GLY 205 Ca 0.00 -1.16 0.04 0.00 0.00 0.00 0.00 44.72 43.60 3ecs s GLY 205 CO 0.00 -0.61 -0.11 -0.26 0.00 0.00 0.00 173.10 172.13 3ecs s ILE 206 N -3.44 1.05 -0.14 0.90 -4.36 -0.31 -1.20 121.20 113.71 3ecs s ILE 206 Ca 0.66 -1.76 -0.03 0.00 -0.26 0.00 0.00 60.65 59.26 3ecs s ILE 206 Cb -0.08 -1.51 -0.03 0.00 1.25 0.00 0.00 42.46 42.10 3ecs s ILE 206 CO 0.47 -0.58 -0.02 -0.63 0.24 0.00 0.00 174.94 174.42 3ecs s ILE 207 N -2.62 4.05 0.29 8.37 1.01 0.11 -0.13 121.20 132.27 3ecs s ILE 207 Ca 0.09 -0.31 -0.17 0.00 0.00 0.00 0.00 60.65 60.26 3ecs s ILE 207 Cb -0.02 -2.76 0.02 0.00 0.01 0.00 0.00 42.46 39.71 3ecs s ILE 207 CO 0.01 0.52 0.64 0.21 0.00 0.00 0.00 174.94 176.32 3ecs s ASN 208 N 0.07 -0.11 0.06 3.58 3.04 -0.85 -0.70 114.94 120.03 3ecs s ASN 208 Ca 0.01 -0.83 -0.38 0.00 0.04 0.00 0.00 52.86 51.70 3ecs s ASN 208 Cb -0.13 0.70 -0.18 0.00 -1.54 0.00 0.00 41.25 40.10 3ecs s ASN 208 CO 0.02 -1.33 1.15 1.17 -3.04 0.00 0.00 177.10 175.07 3ecs n LYS 209 N -0.45 0.51 -1.56 0.43 3.00 -1.26 -0.67 118.16 118.16 3ecs n LYS 209 Ca -0.04 0.18 -0.49 0.00 -0.00 0.00 0.00 58.31 57.97 3ecs n LYS 209 Cb 0.60 -1.71 -0.04 0.00 0.00 0.00 0.00 35.03 33.88 3ecs n LYS 209 CO 0.00 0.00 0.00 1.51 0.00 0.00 0.00 177.40 178.91 3ecs n ILE 210 N 1.79 1.10 0.00 3.15 0.13 0.06 -1.68 119.36 123.91 3ecs n ILE 210 Ca 0.19 -0.28 0.00 0.00 -1.10 0.00 0.00 62.75 61.56 3ecs n ILE 210 Cb 0.14 -0.72 0.00 0.00 -0.84 0.00 0.00 39.64 38.22 3ecs n ILE 210 CO 0.00 0.00 0.00 0.61 2.80 0.00 0.00 176.55 179.96 3ecs n GLY 211 N 1.87 1.82 0.29 4.50 0.00 -1.26 -4.94 105.19 107.46 3ecs n GLY 211 Ca 0.15 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.17 3ecs n GLY 211 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 3ecs h THR 212 N 0.00 1.18 0.29 2.61 2.02 -1.62 -3.17 112.91 114.22 3ecs h THR 212 Ca 0.00 -0.63 -0.01 0.00 0.77 0.00 0.00 66.41 66.54 3ecs h THR 212 Cb 0.00 0.76 0.00 0.00 -1.74 0.00 0.00 68.15 67.18 3ecs h THR 212 CO 0.00 0.23 -0.14 -1.13 0.37 0.00 0.00 175.52 174.85 3ecs h ASN 213 N 0.58 -0.34 0.00 4.18 -0.73 -1.84 -2.51 115.58 114.93 3ecs h ASN 213 Ca 0.14 -0.10 0.00 0.00 1.87 0.00 0.00 56.30 58.20 3ecs h ASN 213 Cb 0.21 0.09 0.00 0.00 0.27 0.00 0.00 38.32 38.89 3ecs h ASN 213 CO -0.00 -0.09 0.00 0.00 -0.37 0.00 0.00 177.43 176.96 3ecs n GLN 214 N -5.19 0.17 0.00 6.67 10.64 -1.20 -1.71 117.38 126.76 3ecs n GLN 214 Ca -0.10 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.07 3ecs n GLN 214 Cb 0.23 -1.41 0.00 0.00 -0.86 0.00 0.00 30.24 28.19 3ecs n GLN 214 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 3ecs n ALA 216 N 1.85 0.00 -0.20 2.61 0.00 -0.95 -1.45 120.51 122.37 3ecs n ALA 216 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.43 3ecs n ALA 216 Cb 0.09 0.00 0.20 0.00 0.00 0.00 0.00 19.45 19.74 3ecs n ALA 216 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 3ecs h VAL 217 N 0.00 1.21 -0.15 0.00 2.07 -1.63 0.18 116.25 117.93 3ecs h VAL 217 Ca 0.00 -0.57 -0.14 0.00 0.82 0.00 0.00 66.70 66.81 3ecs h VAL 217 Cb 0.00 0.30 -0.01 0.00 -1.52 0.00 0.00 31.29 30.06 3ecs h VAL 217 CO 0.00 0.25 -0.51 0.00 0.02 0.00 0.00 177.57 177.33 3ecs h ALA 219 N 1.12 0.42 0.10 0.00 0.00 -1.71 -2.78 119.26 116.39 3ecs h ALA 219 Ca 0.01 -0.69 -0.00 0.00 0.00 0.00 0.00 54.91 54.23 3ecs h ALA 219 Cb 1.01 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.77 3ecs h ALA 219 CO 0.09 0.81 -0.05 -0.22 0.00 0.00 0.00 179.25 179.88 3ecs h LYS 220 N 0.24 -0.13 -0.54 0.00 1.63 -0.87 0.28 116.57 117.18 3ecs h LYS 220 Ca -0.07 0.01 0.14 0.00 -0.85 0.00 0.00 60.65 59.89 3ecs h LYS 220 Cb 1.52 0.03 -0.02 0.00 -0.60 0.00 0.00 32.23 33.15 3ecs h LYS 220 CO 0.15 0.03 0.38 0.00 -3.45 0.00 0.00 179.45 176.57 3ecs h ALA 221 N 0.63 2.41 -0.69 5.00 0.00 -1.42 0.25 119.26 125.44 3ecs h ALA 221 Ca -0.01 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.88 3ecs h ALA 221 Cb 0.21 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.02 3ecs h ALA 221 CO 0.02 -0.56 0.00 1.04 0.00 0.00 0.00 179.25 179.75 3ecs n GLN 222 N -4.40 3.34 -3.73 0.00 6.02 -0.98 -4.95 117.38 112.67 3ecs n GLN 222 Ca 0.10 -2.81 -0.25 0.00 -0.01 0.00 0.00 57.00 54.02 3ecs n GLN 222 Cb 0.56 -1.77 0.05 0.00 1.02 0.00 0.00 30.24 30.11 3ecs n GLN 222 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 177.06 174.34 3ecs n ASN 223 N 1.37 -4.43 -4.68 1.08 5.15 0.87 -4.98 115.26 109.63 3ecs n ASN 223 Ca 0.26 -0.69 -0.35 0.00 -0.60 0.00 0.00 54.58 53.19 3ecs n ASN 223 Cb 0.79 -4.41 -0.09 0.00 -0.53 0.00 0.00 39.78 35.53 3ecs n ASN 223 CO 0.00 0.00 0.00 -0.54 1.40 0.00 0.00 177.26 178.12 3ecs s LYS 224 N -6.29 3.90 0.32 1.20 -0.14 0.87 -5.02 119.74 114.58 3ecs s LYS 224 Ca 0.46 -0.30 -0.29 0.00 -1.36 0.00 0.00 55.97 54.48 3ecs s LYS 224 Cb -0.22 -3.23 -0.11 0.00 -1.68 0.00 0.00 37.83 32.60 3ecs s LYS 224 CO 0.78 0.36 1.46 -1.25 -0.76 0.00 0.00 175.35 175.95 3ecs s PRO 225 N 0.13 4.20 -0.31 -1.68 0.04 -1.26 -4.40 135.00 131.71 3ecs s PRO 225 Ca 0.06 2.44 -0.05 0.00 0.04 0.00 0.00 61.00 63.50 3ecs s PRO 225 Cb -0.12 -3.03 0.04 0.00 0.04 0.00 0.00 34.50 31.43 3ecs s PRO 225 CO 0.00 -0.46 0.05 0.12 0.04 0.00 0.00 177.00 176.76 3ecs s PHE 226 N -0.65 3.22 0.04 0.56 5.36 -1.26 -2.12 117.98 123.12 3ecs s PHE 226 Ca 0.56 -1.50 0.03 0.00 -0.96 0.00 0.00 56.93 55.05 3ecs s PHE 226 Cb -0.44 -2.20 -0.04 0.00 -0.34 0.00 0.00 43.02 40.00 3ecs s PHE 226 CO 0.54 -0.73 0.00 0.71 -1.46 0.00 0.00 175.22 174.28 3ecs s TYR 227 N 1.36 3.05 -0.12 10.12 2.02 -0.28 -1.15 117.35 132.36 3ecs s TYR 227 Ca -0.02 0.04 0.01 0.00 -0.37 0.00 0.00 57.07 56.73 3ecs s TYR 227 Cb -0.19 -1.62 0.02 0.00 -0.40 0.00 0.00 41.96 39.77 3ecs s TYR 227 CO 0.01 0.47 -0.12 0.08 -1.57 0.00 0.00 175.55 174.42 3ecs s VAL 228 N -1.18 1.33 -0.18 0.71 1.01 -0.81 -1.33 120.40 119.96 3ecs s VAL 228 Ca 0.22 -0.51 -0.04 0.00 0.00 0.00 0.00 61.98 61.65 3ecs s VAL 228 Cb -0.12 -1.26 -0.02 0.00 0.00 0.00 0.00 36.38 34.98 3ecs s VAL 228 CO 0.14 0.41 -0.02 0.68 0.00 0.00 0.00 175.10 176.31 3ecs s VAL 229 N 1.32 3.88 -0.27 2.92 -7.23 -0.20 0.84 120.40 121.66 3ecs s VAL 229 Ca -0.01 -0.35 -0.25 0.00 -1.81 0.00 0.00 61.98 59.56 3ecs s VAL 229 Cb -0.14 -2.73 0.10 0.00 0.56 0.00 0.00 36.38 34.18 3ecs s VAL 229 CO -0.06 0.46 0.91 0.00 -0.31 0.00 0.00 175.10 176.10 3ecs s ALA 230 N 0.74 -1.89 0.61 1.32 0.00 -0.86 -3.77 121.76 117.91 3ecs s ALA 230 Ca -0.01 1.91 -0.18 0.00 0.00 0.00 0.00 51.96 53.68 3ecs s ALA 230 Cb -0.14 -1.28 -0.02 0.00 0.00 0.00 0.00 23.12 21.68 3ecs s ALA 230 CO 0.02 -0.28 1.16 -1.21 0.00 0.00 0.00 175.76 175.45 3ecs s GLU 231 N 0.19 2.92 0.29 0.00 8.01 -1.26 -4.20 118.70 124.65 3ecs s GLU 231 Ca 0.01 1.65 0.24 0.00 0.01 0.00 0.00 54.97 56.89 3ecs s GLU 231 Cb -0.05 -1.94 1.03 0.00 -4.31 0.00 0.00 34.13 28.86 3ecs s GLU 231 CO -0.03 -1.20 1.73 0.66 0.01 0.00 0.00 175.26 176.43 3ecs h SER 232 N 0.61 0.00 0.00 -0.19 4.64 -1.96 -2.29 113.55 114.36 3ecs h SER 232 Ca -0.49 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.83 3ecs h SER 232 Cb 1.28 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.37 3ecs h SER 232 CO 0.55 0.00 0.00 2.22 -0.87 0.00 0.00 176.83 178.73 3ecs n PHE 233 N -2.31 0.00 1.04 4.77 1.16 -1.26 -2.06 117.46 118.80 3ecs n PHE 233 Ca 0.02 0.00 0.12 0.00 -1.87 0.00 0.00 57.45 55.72 3ecs n PHE 233 Cb 0.22 0.00 0.11 0.00 -1.61 0.00 0.00 39.48 38.19 3ecs n PHE 233 CO 0.00 0.00 0.00 1.63 -1.87 0.00 0.00 176.76 176.52 3ecs n LYS 234 N -0.82 1.99 -2.14 3.97 5.02 -0.86 -2.75 118.16 122.57 3ecs n LYS 234 Ca 0.14 -1.62 -0.43 0.00 -2.02 0.00 0.00 58.31 54.38 3ecs n LYS 234 Cb 0.06 -1.47 -0.02 0.00 -0.02 0.00 0.00 35.03 33.58 3ecs n LYS 234 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 3ecs s PHE 235 N -2.13 2.04 0.13 2.13 0.40 -0.87 -0.91 117.98 118.78 3ecs s PHE 235 Ca 0.26 0.64 0.07 0.00 -0.60 0.00 0.00 56.93 57.30 3ecs s PHE 235 Cb 0.20 -4.21 -0.04 0.00 0.51 0.00 0.00 43.02 39.48 3ecs s PHE 235 CO 0.37 -2.55 -0.05 0.54 0.70 0.00 0.00 175.22 174.24 3ecs s VAL 236 N 6.35 3.60 -1.13 -0.44 0.11 -0.38 -4.85 120.40 123.66 3ecs s VAL 236 Ca 0.72 -1.31 -0.20 0.00 -2.93 0.00 0.00 61.98 58.26 3ecs s VAL 236 Cb -0.19 -2.75 0.08 0.00 -1.53 0.00 0.00 36.38 31.99 3ecs s VAL 236 CO 0.33 0.01 1.53 -0.13 -3.33 0.00 0.00 175.10 173.51 3ecs s ARG 237 N -2.55 3.79 -0.18 1.54 1.81 -1.26 -3.95 118.95 118.15 3ecs s ARG 237 Ca 0.25 -1.65 -0.19 0.00 -1.72 0.00 0.00 55.73 52.41 3ecs s ARG 237 Cb -0.10 -5.36 0.05 0.00 -0.45 0.00 0.00 34.95 29.09 3ecs s ARG 237 CO 0.16 -2.14 0.54 -0.51 -0.68 0.00 0.00 175.30 172.67 3ecs s LEU 238 N 4.16 -0.05 -0.51 2.53 1.43 -1.26 -5.04 118.68 119.94 3ecs s LEU 238 Ca 0.47 0.99 0.08 0.00 -1.03 0.00 0.00 54.13 54.63 3ecs s LEU 238 Cb 0.01 1.87 0.30 0.00 0.03 0.00 0.00 46.19 48.40 3ecs s LEU 238 CO -0.02 -0.24 0.76 0.33 0.23 0.00 0.00 176.35 177.40 3ecs n PHE 239 N 2.52 2.12 -2.57 0.29 -0.00 -1.26 -1.53 117.46 117.04 3ecs n PHE 239 Ca -0.15 -3.91 -0.37 0.00 -0.00 0.00 0.00 57.45 53.03 3ecs n PHE 239 Cb 0.56 -0.46 -0.04 0.00 -0.00 0.00 0.00 39.48 39.54 3ecs n PHE 239 CO 0.00 0.00 0.00 -1.25 -0.00 0.00 0.00 176.76 175.51 3ecs s PRO 240 N -2.50 4.31 -0.01 -7.13 0.04 -1.26 -4.92 135.00 123.53 3ecs s PRO 240 Ca 0.42 1.53 0.10 0.00 0.04 0.00 0.00 61.00 63.09 3ecs s PRO 240 Cb 0.24 -2.68 -0.13 0.00 0.04 0.00 0.00 34.50 31.97 3ecs s PRO 240 CO -0.09 -0.02 0.37 1.28 0.04 0.00 0.00 177.00 178.59 3ecs n LEU 241 N 0.22 0.32 -3.95 -3.56 4.77 -1.26 -4.95 117.00 108.60 3ecs n LEU 241 Ca 0.04 -0.33 -0.11 0.00 -0.03 0.00 0.00 56.01 55.58 3ecs n LEU 241 Cb 0.49 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.57 3ecs n LEU 241 CO 0.46 0.08 0.33 0.54 -1.33 0.00 0.00 177.39 177.48 3ecs s ASN 242 N -2.41 0.37 0.14 -1.43 2.20 -1.26 -5.03 114.94 107.52 3ecs s ASN 242 Ca 0.01 -1.24 -0.14 0.00 -0.94 0.00 0.00 52.86 50.55 3ecs s ASN 242 Cb 0.08 0.74 0.01 0.00 -2.00 0.00 0.00 41.25 40.08 3ecs s ASN 242 CO 0.43 -1.46 1.66 1.56 -2.94 0.00 0.00 177.10 176.35 3ecs h GLN 243 N 2.07 0.73 -1.16 3.55 1.08 -1.96 -2.56 115.11 116.85 3ecs h GLN 243 Ca -0.29 -0.17 0.34 0.00 -1.45 0.00 0.00 58.65 57.08 3ecs h GLN 243 Cb 1.25 -0.10 -0.05 0.00 -0.05 0.00 0.00 27.48 28.53 3ecs h GLN 243 CO 0.38 0.71 0.88 1.96 -0.95 0.00 0.00 178.83 181.81 3ecs h GLN 244 N 0.61 0.00 0.00 1.46 4.20 -2.03 -0.41 115.11 118.95 3ecs h GLN 244 Ca 0.15 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.86 3ecs h GLN 244 Cb 0.30 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.08 3ecs h GLN 244 CO -0.00 0.00 0.00 -0.44 -0.67 0.00 0.00 178.83 177.72 3ecs h ASP 245 N 0.00 0.00 -2.93 1.46 3.32 -1.87 -3.44 116.42 112.95 3ecs h ASP 245 Ca 0.55 0.00 -0.53 0.00 0.02 0.00 0.00 57.03 57.07 3ecs h ASP 245 Cb 2.30 0.00 0.02 0.00 0.22 0.00 0.00 39.33 41.87 3ecs h ASP 245 CO -0.01 0.00 0.79 -0.69 -1.72 0.00 0.00 179.24 177.62 3ecs s VAL 246 N -3.41 3.30 0.34 -1.35 1.01 -0.16 -4.82 120.40 115.30 3ecs s VAL 246 Ca 0.04 0.87 -0.29 0.00 0.00 0.00 0.00 61.98 62.61 3ecs s VAL 246 Cb 0.07 -3.56 -0.11 0.00 0.00 0.00 0.00 36.38 32.78 3ecs s VAL 246 CO 0.61 0.05 1.47 -2.84 0.00 0.00 0.00 175.10 174.39 3ecs s PRO 247 N 1.54 4.17 0.38 2.72 0.02 -1.26 -4.89 135.00 137.68 3ecs s PRO 247 Ca 0.66 2.49 0.11 0.00 0.02 0.00 0.00 61.00 64.28 3ecs s PRO 247 Cb -0.37 -3.01 0.89 0.00 0.02 0.00 0.00 34.50 32.04 3ecs s PRO 247 CO 0.30 -0.48 1.91 -0.44 -0.33 0.00 0.00 177.00 177.95 3ecs h ASP 248 N 3.57 0.56 -0.47 2.53 5.19 -1.94 -0.42 116.42 125.44 3ecs h ASP 248 Ca -0.49 0.03 0.13 0.00 -0.62 0.00 0.00 57.03 56.08 3ecs h ASP 248 Cb 1.23 -0.09 -0.02 0.00 0.18 0.00 0.00 39.33 40.64 3ecs h ASP 248 CO 0.68 0.30 0.37 0.07 -3.12 0.00 0.00 179.24 177.55 3ecs h LYS 249 N 0.60 0.00 0.00 3.56 2.10 -1.90 -1.94 116.57 118.99 3ecs h LYS 249 Ca 0.39 0.00 -0.22 0.00 -2.00 0.00 0.00 60.65 58.82 3ecs h LYS 249 Cb 0.67 0.00 -0.04 0.00 -0.90 0.00 0.00 32.23 31.96 3ecs h LYS 249 CO -0.15 0.00 -1.69 1.19 -2.00 0.00 0.00 179.45 176.80 3ecs n PHE 250 N -4.16 0.75 1.01 0.07 0.99 -0.18 -4.48 117.46 111.45 3ecs n PHE 250 Ca 0.08 0.26 0.11 0.00 -0.00 0.00 0.00 57.45 57.90 3ecs n PHE 250 Cb 0.58 -1.05 0.01 0.00 -1.00 0.00 0.00 39.48 38.01 3ecs n PHE 250 CO 0.00 0.00 0.00 0.36 -0.00 0.00 0.00 176.76 177.12 3ecs n LYS 251 N -2.85 0.13 -5.13 -1.08 2.85 -0.79 -4.70 118.16 106.59 3ecs n LYS 251 Ca -0.15 -0.10 -0.30 0.00 -1.05 0.00 0.00 58.31 56.71 3ecs n LYS 251 Cb 0.92 -1.50 -0.17 0.00 -0.65 0.00 0.00 35.03 33.64 3ecs n LYS 251 CO 0.00 0.00 0.00 0.71 -0.05 0.00 0.00 177.40 178.06 3ecs s TYR 252 N -2.94 2.30 -0.20 5.58 1.51 -0.86 -0.47 117.35 122.28 3ecs s TYR 252 Ca 0.10 -0.80 -0.01 0.00 -1.01 0.00 0.00 57.07 55.35 3ecs s TYR 252 Cb 0.17 -1.54 0.00 0.00 -0.11 0.00 0.00 41.96 40.48 3ecs s TYR 252 CO 0.79 -0.29 0.09 1.63 -1.11 0.00 0.00 175.55 176.65 3ecs n LYS 253 N 3.27 -0.69 -0.50 -0.62 4.76 -1.26 -4.84 118.16 118.28 3ecs n LYS 253 Ca -0.19 0.12 0.00 0.00 -2.87 0.00 0.00 58.31 55.37 3ecs n LYS 253 Cb 0.52 -3.31 0.00 0.00 -1.84 0.00 0.00 35.03 30.40 3ecs n LYS 253 CO 0.00 0.00 0.00 1.04 -1.37 0.00 0.00 177.40 177.07 3ecs n GLN 264 N -1.17 0.00 -0.81 1.97 6.02 -1.26 -4.80 117.38 117.33 3ecs n GLN 264 Ca -0.01 0.00 -0.28 0.00 -0.01 0.00 0.00 57.00 56.70 3ecs n GLN 264 Cb 0.52 -0.50 0.02 0.00 1.02 0.00 0.00 30.24 31.30 3ecs n GLN 264 CO 0.00 0.00 0.00 -0.40 -1.01 0.00 0.00 177.06 175.65 3ecs n ASP 265 N -3.79 -3.89 -4.48 1.08 5.75 -1.26 -4.88 116.55 105.09 3ecs n ASP 265 Ca 0.00 0.26 -0.43 0.00 -0.01 0.00 0.00 54.79 54.61 3ecs n ASP 265 Cb 0.41 -0.59 -0.05 0.00 -1.03 0.00 0.00 41.12 39.86 3ecs n ASP 265 CO 0.00 0.00 0.00 -0.22 -0.11 0.00 0.00 177.20 176.87 3ecs s LEU 266 N 5.18 4.43 0.69 -2.12 0.20 -1.26 -5.04 118.68 120.76 3ecs s LEU 266 Ca 0.34 -0.67 -0.03 0.00 0.69 0.00 0.00 54.13 54.47 3ecs s LEU 266 Cb -0.22 -2.62 0.09 0.00 -0.43 0.00 0.00 46.19 43.01 3ecs s LEU 266 CO 0.57 -1.18 0.96 -0.75 -0.29 0.00 0.00 176.35 175.66 3ecs s LYS 267 N 3.59 1.94 -0.16 1.98 2.47 -1.26 -5.12 119.74 123.18 3ecs s LYS 267 Ca 0.24 -0.80 -0.09 0.00 -1.56 0.00 0.00 55.97 53.76 3ecs s LYS 267 Cb -0.16 -2.30 0.05 0.00 -1.46 0.00 0.00 37.83 33.96 3ecs s LYS 267 CO 0.15 -1.28 0.39 -2.00 0.16 0.00 0.00 175.35 172.77 3ecs s GLU 268 N -5.12 0.38 -0.12 4.03 2.12 -1.26 -5.15 118.70 113.58 3ecs s GLU 268 Ca 0.63 0.73 0.02 0.00 0.36 0.00 0.00 54.97 56.71 3ecs s GLU 268 Cb -0.08 -0.00 -0.00 0.00 0.26 0.00 0.00 34.13 34.31 3ecs s GLU 268 CO 0.43 -0.15 -0.20 -2.00 -0.54 0.00 0.00 175.26 172.81 3ecs s GLU 269 N 1.23 3.14 -0.52 4.30 2.12 -1.26 -5.08 118.70 122.63 3ecs s GLU 269 Ca -0.08 -0.81 0.05 0.00 0.36 0.00 0.00 54.97 54.48 3ecs s GLU 269 Cb -0.08 -2.45 0.18 0.00 0.26 0.00 0.00 34.13 32.04 3ecs s GLU 269 CO -0.11 0.12 0.43 0.72 -0.54 0.00 0.00 175.26 175.89 3ecs n HIS 270 N 3.72 0.74 -2.86 5.30 8.25 -1.26 -5.10 115.22 124.01 3ecs n HIS 270 Ca -0.19 -3.71 -0.39 0.00 -0.26 0.00 0.00 57.72 53.17 3ecs n HIS 270 Cb 0.52 -0.12 -0.06 0.00 1.12 0.00 0.00 29.99 31.45 3ecs n HIS 270 CO 0.00 0.00 0.00 -1.25 0.64 0.00 0.00 176.34 175.73 3ecs s PRO 271 N -0.69 4.70 0.23 -0.41 0.04 -1.26 -4.79 135.00 132.82 3ecs s PRO 271 Ca 0.31 1.32 0.24 0.00 0.04 0.00 0.00 61.00 62.91 3ecs s PRO 271 Cb 0.03 -3.22 0.41 0.00 0.04 0.00 0.00 34.50 31.76 3ecs s PRO 271 CO -0.17 0.52 1.46 -1.49 0.04 0.00 0.00 177.00 177.36 3ecs h TRP 272 N 4.12 0.00 -4.16 0.56 4.06 -1.09 -3.43 115.95 116.01 3ecs h TRP 272 Ca -0.46 0.00 -0.20 0.00 2.06 0.00 0.00 58.89 60.29 3ecs h TRP 272 Cb 1.20 0.00 -0.15 0.00 -1.00 0.00 0.00 29.16 29.21 3ecs h TRP 272 CO 0.62 0.00 -0.66 0.14 -3.56 0.00 0.00 178.44 174.98 3ecs s VAL 273 N -3.19 0.33 0.19 1.49 -7.23 -1.26 -0.76 120.40 109.97 3ecs s VAL 273 Ca 0.06 -1.91 -0.01 0.00 -1.81 0.00 0.00 61.98 58.32 3ecs s VAL 273 Cb 0.11 -1.90 -0.04 0.00 0.56 0.00 0.00 36.38 35.10 3ecs s VAL 273 CO 0.69 -0.64 0.10 1.51 -0.31 0.00 0.00 175.10 176.45 3ecs s ASP 274 N -3.05 0.34 -0.06 4.85 1.47 0.16 -4.54 116.67 115.84 3ecs s ASP 274 Ca 0.19 -1.34 -0.01 0.00 1.18 0.00 0.00 52.55 52.56 3ecs s ASP 274 Cb 0.07 0.33 -0.03 0.00 -0.34 0.00 0.00 42.92 42.94 3ecs s ASP 274 CO -0.01 -0.79 0.02 -0.47 0.68 0.00 0.00 175.17 174.59 3ecs s TYR 275 N -4.07 3.18 -0.24 2.11 5.04 -1.26 -2.00 117.35 120.11 3ecs s TYR 275 Ca 0.35 0.19 0.02 0.00 -2.44 0.00 0.00 57.07 55.19 3ecs s TYR 275 Cb 0.07 -1.77 0.05 0.00 0.35 0.00 0.00 41.96 40.66 3ecs s TYR 275 CO 0.10 0.49 -0.13 0.99 -1.34 0.00 0.00 175.55 175.66 3ecs s THR 276 N -0.97 2.23 0.68 4.34 2.01 0.81 -4.70 115.64 120.04 3ecs s THR 276 Ca 0.16 -1.37 -0.17 0.00 0.31 0.00 0.00 61.69 60.61 3ecs s THR 276 Cb -0.11 -2.19 0.01 0.00 0.01 0.00 0.00 72.50 70.21 3ecs s THR 276 CO 0.05 0.15 1.27 0.00 -0.69 0.00 0.00 174.62 175.40 3ecs n ALA 277 N 4.51 0.88 -0.05 7.40 0.00 -1.26 -1.16 120.51 130.83 3ecs n ALA 277 Ca -0.16 -0.07 0.11 0.00 0.00 0.00 0.00 53.44 53.32 3ecs n ALA 277 Cb 0.45 -2.30 0.51 0.00 0.00 0.00 0.00 19.45 18.10 3ecs n ALA 277 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 3ecs h PRO 278 N 0.22 0.37 0.00 0.00 0.13 -1.82 -0.91 132.00 129.99 3ecs h PRO 278 Ca -0.50 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.61 3ecs h PRO 278 Cb 1.33 -0.08 0.00 0.00 0.13 0.00 0.00 31.00 32.38 3ecs h PRO 278 CO 0.51 0.24 0.00 0.66 -0.23 0.00 0.00 178.00 179.19 3ecs h SER 279 N 0.38 0.00 -0.00 1.44 4.64 -1.92 -1.51 113.55 116.58 3ecs h SER 279 Ca 0.24 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.56 3ecs h SER 279 Cb 0.46 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.55 3ecs h SER 279 CO -0.06 0.00 -0.18 0.18 -0.87 0.00 0.00 176.83 175.90 3ecs n LEU 280 N -2.49 2.35 -4.48 5.97 4.77 -0.35 -4.92 117.00 117.85 3ecs n LEU 280 Ca -0.01 -0.80 -0.34 0.00 -0.03 0.00 0.00 56.01 54.84 3ecs n LEU 280 Cb 0.11 -0.01 -0.12 0.00 -2.33 0.00 0.00 43.42 41.07 3ecs n LEU 280 CO 0.16 0.41 -0.37 -0.63 -1.33 0.00 0.00 177.39 175.62 3ecs s ILE 281 N -2.20 3.75 -0.12 -0.08 1.01 -0.57 -4.70 121.20 118.29 3ecs s ILE 281 Ca 0.26 -0.41 -0.14 0.00 0.00 0.00 0.00 60.65 60.35 3ecs s ILE 281 Cb 0.19 -2.63 -0.13 0.00 0.01 0.00 0.00 42.46 39.91 3ecs s ILE 281 CO 0.41 0.51 0.36 0.74 0.00 0.00 0.00 174.94 176.95 3ecs h THR 282 N 5.13 0.86 -2.91 2.92 2.02 -1.42 -3.41 112.91 116.10 3ecs h THR 282 Ca -0.31 -1.66 -0.12 0.00 0.77 0.00 0.00 66.41 65.09 3ecs h THR 282 Cb 1.19 1.64 -0.21 0.00 -1.74 0.00 0.00 68.15 69.04 3ecs h THR 282 CO 0.61 0.29 -0.24 -0.76 0.37 0.00 0.00 175.52 175.79 3ecs s LEU 283 N -8.37 0.67 -0.18 2.58 1.43 -1.20 -4.50 118.68 109.12 3ecs s LEU 283 Ca -0.10 0.29 -0.03 0.00 -1.03 0.00 0.00 54.13 53.26 3ecs s LEU 283 Cb -0.01 1.37 -0.01 0.00 0.03 0.00 0.00 46.19 47.56 3ecs s LEU 283 CO 0.34 -0.39 -0.07 -0.76 0.23 0.00 0.00 176.35 175.71 3ecs s LEU 284 N -0.96 2.88 -0.47 1.79 1.02 0.41 -1.92 118.68 121.44 3ecs s LEU 284 Ca -0.10 -0.34 -0.15 0.00 0.02 0.00 0.00 54.13 53.56 3ecs s LEU 284 Cb -0.04 -1.70 0.07 0.00 0.02 0.00 0.00 46.19 44.53 3ecs s LEU 284 CO 0.04 0.07 0.39 -0.36 0.02 0.00 0.00 176.35 176.50 3ecs s PHE 285 N 0.96 3.24 0.44 0.29 0.40 0.25 -1.03 117.98 122.53 3ecs s PHE 285 Ca -0.01 -0.89 0.06 0.00 -0.60 0.00 0.00 56.93 55.49 3ecs s PHE 285 Cb -0.15 -3.13 -0.05 0.00 0.51 0.00 0.00 43.02 40.21 3ecs s PHE 285 CO 0.00 -0.78 0.08 0.95 0.70 0.00 0.00 175.22 176.17 3ecs s THR 286 N 1.66 1.90 -0.79 0.64 -4.23 -0.90 -2.03 115.64 111.90 3ecs s THR 286 Ca 0.04 -1.88 0.22 0.00 -1.18 0.00 0.00 61.69 58.89 3ecs s THR 286 Cb -0.24 -2.78 0.21 0.00 1.34 0.00 0.00 72.50 71.03 3ecs s THR 286 CO 0.07 0.00 1.68 -0.90 -0.54 0.00 0.00 174.62 174.93 3ecs n ASP 287 N -1.15 0.36 -0.06 3.99 5.75 -1.26 -1.56 116.55 122.62 3ecs n ASP 287 Ca -0.06 0.57 0.13 0.00 -0.01 0.00 0.00 54.79 55.41 3ecs n ASP 287 Cb 0.66 -0.65 0.42 0.00 -1.03 0.00 0.00 41.12 40.52 3ecs n ASP 287 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 3ecs n LEU 288 N -1.87 0.45 0.00 -2.12 4.77 -1.26 -5.00 117.00 111.97 3ecs n LEU 288 Ca 0.04 0.08 0.00 0.00 -0.03 0.00 0.00 56.01 56.10 3ecs n LEU 288 Cb 0.27 -0.28 0.00 0.00 -2.33 0.00 0.00 43.42 41.08 3ecs n LEU 288 CO 0.21 0.10 0.00 0.61 -1.33 0.00 0.00 177.39 176.98 3ecs n GLY 289 N 1.43 1.49 3.73 -0.72 0.00 -0.60 -5.04 105.19 105.48 3ecs n GLY 289 Ca 0.09 -2.17 -0.41 0.00 0.00 0.00 0.00 46.02 43.53 3ecs n GLY 289 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3ecs s VAL 290 N -1.31 4.73 0.04 1.61 1.01 -1.26 -2.12 120.40 123.09 3ecs s VAL 290 Ca 0.00 1.80 0.02 0.00 0.00 0.00 0.00 61.98 63.79 3ecs s VAL 290 Cb 0.00 -4.20 -0.02 0.00 0.00 0.00 0.00 36.38 32.16 3ecs s VAL 290 CO 0.00 0.31 -0.07 -0.76 0.00 0.00 0.00 175.10 174.58 3ecs s LEU 291 N 0.22 2.25 0.32 3.92 1.43 -0.20 -4.98 118.68 121.65 3ecs s LEU 291 Ca 0.43 -0.54 -0.10 0.00 -1.03 0.00 0.00 54.13 52.89 3ecs s LEU 291 Cb -0.21 -0.10 -0.07 0.00 0.03 0.00 0.00 46.19 45.84 3ecs s LEU 291 CO 0.25 -0.23 0.66 0.42 0.23 0.00 0.00 176.35 177.69 3ecs s THR 292 N -1.40 4.84 0.44 5.49 -4.23 -1.26 -0.44 115.64 119.07 3ecs s THR 292 Ca -0.11 0.56 0.25 0.00 -1.18 0.00 0.00 61.69 61.20 3ecs s THR 292 Cb -0.10 -3.67 0.45 0.00 1.34 0.00 0.00 72.50 70.52 3ecs s THR 292 CO 0.00 -0.28 1.75 -0.65 -0.54 0.00 0.00 174.62 174.90 3ecs h PRO 293 N 1.93 0.24 0.00 3.99 0.11 -1.80 -0.38 132.00 136.09 3ecs h PRO 293 Ca -0.47 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.62 3ecs h PRO 293 Cb 1.18 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.23 3ecs h PRO 293 CO 0.66 0.16 0.00 -1.13 -0.21 0.00 0.00 178.00 177.48 3ecs n SER 294 N -4.54 0.42 0.08 -2.05 3.41 -1.26 -2.50 113.62 107.18 3ecs n SER 294 Ca 0.28 0.58 0.12 0.00 -0.26 0.00 0.00 58.87 59.58 3ecs n SER 294 Cb 1.06 -0.68 0.14 0.00 -0.26 0.00 0.00 64.21 64.48 3ecs n SER 294 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3ecs h ALA 295 N 2.51 0.58 0.31 7.33 0.00 -1.43 -3.39 119.26 125.17 3ecs h ALA 295 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 3ecs h ALA 295 Cb 0.45 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.23 3ecs h ALA 295 CO 0.00 0.00 -0.17 0.28 0.00 0.00 0.00 179.25 179.36 3ecs h VAL 296 N 0.00 0.64 -0.97 0.00 2.07 -1.52 -2.96 116.25 113.50 3ecs h VAL 296 Ca 0.00 0.00 0.17 0.00 0.82 0.00 0.00 66.70 67.69 3ecs h VAL 296 Cb 0.80 0.64 -0.17 0.00 -1.52 0.00 0.00 31.29 31.04 3ecs h VAL 296 CO 0.00 0.00 -0.31 -0.24 0.02 0.00 0.00 177.57 177.04 3ecs n SER 297 N -5.30 -0.49 -0.04 0.57 2.88 -1.24 -0.54 113.62 109.45 3ecs n SER 297 Ca -0.10 1.68 -0.09 0.00 -1.33 0.00 0.00 58.87 59.03 3ecs n SER 297 Cb 0.21 -0.45 0.06 0.00 -0.75 0.00 0.00 64.21 63.29 3ecs n SER 297 CO 0.00 0.00 0.00 -0.78 -1.23 0.00 0.00 175.04 173.03 3ecs h ASP 298 N 0.00 0.73 -0.46 -3.46 3.58 -1.82 -3.00 116.42 111.99 3ecs h ASP 298 Ca 0.40 -0.33 -0.09 0.00 0.42 0.00 0.00 57.03 57.43 3ecs h ASP 298 Cb 0.64 -0.21 -0.02 0.00 1.72 0.00 0.00 39.33 41.47 3ecs h ASP 298 CO -0.98 1.05 -0.02 -0.33 -2.88 0.00 0.00 179.24 176.07 3ecs h GLU 299 N 0.56 0.89 -0.55 0.28 4.39 -0.97 -2.56 114.58 116.62 3ecs h GLU 299 Ca 0.05 -0.27 -0.01 0.00 0.34 0.00 0.00 59.36 59.47 3ecs h GLU 299 Cb 0.94 -0.09 -0.03 0.00 -0.10 0.00 0.00 28.75 29.48 3ecs h GLU 299 CO 0.09 0.90 0.29 1.25 -1.16 0.00 0.00 179.01 180.38 3ecs h LEU 300 N 0.82 0.70 -0.41 1.33 6.46 -0.72 0.12 115.31 123.61 3ecs h LEU 300 Ca 0.15 -0.10 -0.15 0.00 -0.12 0.00 0.00 57.88 57.66 3ecs h LEU 300 Cb 0.52 -0.18 -0.01 0.00 -0.73 0.00 0.00 40.66 40.27 3ecs h LEU 300 CO 0.03 0.60 -0.32 0.16 -0.62 0.00 0.00 178.44 178.28 3ecs h ILE 301 N 0.74 1.27 -0.48 4.05 3.07 -1.42 0.20 117.51 124.94 3ecs h ILE 301 Ca 0.19 -1.49 0.00 0.00 1.55 0.00 0.00 64.86 65.11 3ecs h ILE 301 Cb 0.06 1.32 -0.02 0.00 -0.27 0.00 0.00 36.82 37.91 3ecs h ILE 301 CO -0.03 0.50 0.31 0.11 -1.05 0.00 0.00 178.15 177.99 3ecs h LYS 302 N 0.76 0.63 -0.59 0.16 1.57 -1.22 -0.74 116.57 117.14 3ecs h LYS 302 Ca 0.08 -0.04 -0.08 0.00 -1.87 0.00 0.00 60.65 58.73 3ecs h LYS 302 Cb 0.91 -0.14 -0.02 0.00 0.08 0.00 0.00 32.23 33.06 3ecs h LYS 302 CO 0.08 0.43 0.03 1.25 -0.57 0.00 0.00 179.45 180.68 3ecs h LEU 303 N 0.65 0.97 -4.50 2.94 5.85 0.12 -2.95 115.31 118.39 3ecs h LEU 303 Ca 0.17 -0.25 -0.49 0.00 0.84 0.00 0.00 57.88 58.16 3ecs h LEU 303 Cb -0.06 -0.26 -0.17 0.00 0.37 0.00 0.00 40.66 40.54 3ecs h LEU 303 CO -0.04 1.01 0.36 -1.22 -0.34 0.00 0.00 178.44 178.21 3ecs n TYR 304 N -4.20 1.54 -3.52 1.25 4.01 -0.02 -4.73 117.16 111.49 3ecs n TYR 304 Ca 0.03 -1.92 -0.16 0.00 -0.16 0.00 0.00 57.90 55.69 3ecs n TYR 304 Cb 0.32 -1.38 -0.12 0.00 -0.31 0.00 0.00 39.34 37.84 3ecs n TYR 304 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 3ecs s LEU 305 N -2.10 -0.23 -0.00 7.72 1.43 -1.12 -4.96 118.68 119.42 3ecs s LEU 305 Ca 0.59 0.06 0.04 0.00 -1.03 0.00 0.00 54.13 53.79 3ecs s LEU 305 Cb 0.38 0.57 -0.03 0.00 0.03 0.00 0.00 46.19 47.14 3ecs s LEU 305 CO -0.21 -0.30 -0.09 0.00 0.23 0.00 0.00 176.35 175.98 3ecs s ALA 306 N 2.38 2.92 0.00 4.21 0.00 -1.26 -5.00 121.76 125.01 3ecs s ALA 306 Ca 0.06 -1.03 0.00 0.00 0.00 0.00 0.00 51.96 50.99 3ecs s ALA 306 Cb -0.15 -1.07 0.00 0.00 0.00 0.00 0.00 23.12 21.91 3ecs s ALA 306 CO -0.12 0.60 0.00 0.00 0.00 0.00 0.00 175.76 176.24