#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3d0s h ASP 2 N 0.00 0.00 -0.39 7.83 3.32 -2.02 -3.06 116.42 122.10 3d0s h ASP 2 Ca 0.00 0.00 -0.08 0.00 0.02 0.00 0.00 57.03 56.97 3d0s h ASP 2 Cb 0.00 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.54 3d0s h ASP 2 CO 0.00 0.00 -0.06 -0.33 -1.72 0.00 0.00 179.24 177.13 3d0s h GLU 3 N 0.00 0.74 0.08 3.56 3.07 -2.03 -0.34 114.58 119.66 3d0s h GLU 3 Ca 0.00 -0.27 -0.00 0.00 -0.50 0.00 0.00 59.36 58.59 3d0s h GLU 3 Cb 0.54 -0.05 0.00 0.00 -0.84 0.00 0.00 28.75 28.40 3d0s h GLU 3 CO 0.00 0.86 -0.04 0.82 -1.40 0.00 0.00 179.01 179.25 3d0s h ILE 4 N 0.55 1.04 -0.93 3.13 2.04 -1.93 -3.30 117.51 118.11 3d0s h ILE 4 Ca 0.10 -0.44 0.06 0.00 1.00 0.00 0.00 64.86 65.59 3d0s h ILE 4 Cb 0.57 1.32 -0.06 0.00 -0.74 0.00 0.00 36.82 37.91 3d0s h ILE 4 CO 0.03 0.11 0.59 -0.07 0.00 0.00 0.00 178.15 178.81 3d0s h LEU 5 N -0.31 0.94 0.00 1.44 4.07 -1.42 -1.49 115.31 118.54 3d0s h LEU 5 Ca -0.01 0.01 0.00 0.00 0.08 0.00 0.00 57.88 57.96 3d0s h LEU 5 Cb 0.26 -0.19 0.00 0.00 1.08 0.00 0.00 40.66 41.82 3d0s h LEU 5 CO 0.02 0.60 0.00 0.00 -1.08 0.00 0.00 178.44 177.98 3d0s n ALA 6 N -2.36 1.66 1.24 1.53 0.00 -0.15 -0.43 120.51 122.00 3d0s n ALA 6 Ca 0.14 -0.05 0.13 0.00 0.00 0.00 0.00 53.44 53.65 3d0s n ALA 6 Cb 0.17 -1.21 0.33 0.00 0.00 0.00 0.00 19.45 18.74 3d0s n ALA 6 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3d0s n ARG 7 N -1.41 1.20 -2.73 0.00 1.74 -0.56 -3.02 116.66 111.88 3d0s n ARG 7 Ca 0.04 -0.80 -0.40 0.00 -0.77 0.00 0.00 57.85 55.92 3d0s n ARG 7 Cb 0.13 -1.48 -0.05 0.00 -1.02 0.00 0.00 32.46 30.03 3d0s n ARG 7 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3d0s s ALA 8 N -2.34 3.31 0.02 7.54 0.00 0.42 -4.94 121.76 125.76 3d0s s ALA 8 Ca 0.27 0.61 -0.03 0.00 0.00 0.00 0.00 51.96 52.81 3d0s s ALA 8 Cb 0.19 -3.24 -0.01 0.00 0.00 0.00 0.00 23.12 20.07 3d0s s ALA 8 CO 0.47 0.10 0.73 0.41 0.00 0.00 0.00 175.76 177.47 3d0s n GLY 9 N 1.79 -2.07 0.23 0.00 0.00 -1.26 -2.60 105.19 101.28 3d0s n GLY 9 Ca -0.00 0.46 -0.06 0.00 0.00 0.00 0.00 46.02 46.42 3d0s n GLY 9 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 3d0s h ILE 10 N 0.00 0.00 -2.97 -0.61 2.10 -1.87 -3.19 117.51 110.97 3d0s h ILE 10 Ca 0.02 0.00 -0.70 0.00 1.08 0.00 0.00 64.86 65.25 3d0s h ILE 10 Cb 0.04 0.00 -0.35 0.00 -1.09 0.00 0.00 36.82 35.42 3d0s h ILE 10 CO -0.10 0.00 -0.02 2.22 -1.08 0.00 0.00 178.15 179.17 3d0s n PHE 11 N -4.22 3.68 -3.61 2.19 1.16 -1.07 -4.60 117.46 111.00 3d0s n PHE 11 Ca 0.01 -3.81 -0.39 0.00 -1.87 0.00 0.00 57.45 51.39 3d0s n PHE 11 Cb 0.15 -1.03 -0.07 0.00 -1.61 0.00 0.00 39.48 36.91 3d0s n PHE 11 CO 0.00 0.00 0.00 -1.14 -1.87 0.00 0.00 176.76 173.75 3d0s s GLN 12 N -1.95 2.94 -0.40 3.97 0.74 -1.15 -4.32 119.66 119.50 3d0s s GLN 12 Ca 0.31 -2.65 -0.02 0.00 0.05 0.00 0.00 55.36 53.05 3d0s s GLN 12 Cb 0.01 -3.94 -0.02 0.00 1.10 0.00 0.00 33.01 30.16 3d0s s GLN 12 CO -0.05 -1.22 0.35 0.41 -0.55 0.00 0.00 175.29 174.24 3d0s n GLY 13 N 3.39 -0.12 1.09 2.59 0.00 -1.17 -5.02 105.19 105.96 3d0s n GLY 13 Ca 0.12 0.07 0.00 0.00 0.00 0.00 0.00 46.02 46.21 3d0s n GLY 13 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3d0s n VAL 14 N -1.98 1.05 -3.93 1.61 0.31 -1.26 -5.06 118.33 109.07 3d0s n VAL 14 Ca -0.02 0.35 -0.35 0.00 -0.01 0.00 0.00 64.34 64.30 3d0s n VAL 14 Cb 0.54 -1.52 -0.12 0.00 -0.91 0.00 0.00 33.84 31.82 3d0s n VAL 14 CO 0.00 0.00 0.00 -1.61 -1.32 0.00 0.00 176.83 173.90 3d0s s GLU 15 N -2.00 3.64 0.26 5.55 0.41 -1.26 -5.02 118.70 120.27 3d0s s GLU 15 Ca 0.00 -0.50 -0.04 0.00 -0.41 0.00 0.00 54.97 54.02 3d0s s GLU 15 Cb 0.00 -3.18 0.32 0.00 -1.78 0.00 0.00 34.13 29.49 3d0s s GLU 15 CO 0.00 -0.06 1.92 -1.00 -0.49 0.00 0.00 175.26 175.62 3d0s h PRO 16 N 7.77 1.25 0.00 0.39 0.13 -2.02 -3.37 132.00 136.15 3d0s h PRO 16 Ca -0.37 -0.08 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 3d0s h PRO 16 Cb 1.17 -0.28 0.00 0.00 0.13 0.00 0.00 31.00 32.02 3d0s h PRO 16 CO 0.60 0.83 -0.26 0.43 -0.23 0.00 0.00 178.00 179.37 3d0s n SER 17 N -4.42 1.10 -1.08 1.44 7.64 -1.26 -4.84 113.62 112.20 3d0s n SER 17 Ca 0.13 0.00 -0.02 0.00 1.01 0.00 0.00 58.87 59.99 3d0s n SER 17 Cb 0.07 0.04 0.08 0.00 -1.01 0.00 0.00 64.21 63.38 3d0s n SER 17 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3d0s n ALA 18 N -1.52 3.07 0.73 -0.43 0.00 -1.26 -3.42 120.51 117.68 3d0s n ALA 18 Ca 0.00 -0.61 0.09 0.00 0.00 0.00 0.00 53.44 52.92 3d0s n ALA 18 Cb 0.13 -1.07 0.43 0.00 0.00 0.00 0.00 19.45 18.94 3d0s n ALA 18 CO 0.00 0.00 0.00 1.51 0.00 0.00 0.00 177.50 179.01 3d0s n ILE 19 N 0.12 0.61 -0.04 0.00 0.13 -1.26 -4.22 119.36 114.71 3d0s n ILE 19 Ca 0.11 0.15 -0.22 0.00 -1.10 0.00 0.00 62.75 61.70 3d0s n ILE 19 Cb 0.64 -0.82 -0.13 0.00 -0.84 0.00 0.00 39.64 38.49 3d0s n ILE 19 CO 0.00 0.00 0.00 0.00 2.80 0.00 0.00 176.55 179.35 3d0s n ALA 20 N -1.45 0.91 1.10 1.51 0.00 -1.22 -3.64 120.51 117.71 3d0s n ALA 20 Ca 0.06 -0.62 0.04 0.00 0.00 0.00 0.00 53.44 52.92 3d0s n ALA 20 Cb 0.21 -0.58 0.25 0.00 0.00 0.00 0.00 19.45 19.33 3d0s n ALA 20 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3d0s n ALA 21 N -3.18 2.10 -0.07 0.00 0.00 -1.26 -2.11 120.51 115.98 3d0s n ALA 21 Ca -0.34 -0.05 -0.09 0.00 0.00 0.00 0.00 53.44 52.96 3d0s n ALA 21 Cb 0.94 -1.14 -0.08 0.00 0.00 0.00 0.00 19.45 19.18 3d0s n ALA 21 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3d0s n LEU 22 N -0.74 2.05 -0.15 0.00 4.77 -1.26 -4.17 117.00 117.51 3d0s n LEU 22 Ca 0.06 -0.06 0.01 0.00 -0.03 0.00 0.00 56.01 55.99 3d0s n LEU 22 Cb 0.03 -0.27 0.28 0.00 -2.33 0.00 0.00 43.42 41.12 3d0s n LEU 22 CO 0.05 0.61 1.17 0.74 -1.33 0.00 0.00 177.39 178.63 3d0s h THR 23 N 0.00 1.18 0.00 -5.08 2.02 -1.49 -1.37 112.91 108.16 3d0s h THR 23 Ca -0.33 -0.40 0.00 0.00 0.77 0.00 0.00 66.41 66.45 3d0s h THR 23 Cb 1.59 0.29 0.00 0.00 -1.74 0.00 0.00 68.15 68.30 3d0s h THR 23 CO -0.03 0.19 0.00 0.29 0.37 0.00 0.00 175.52 176.34 3d0s n LYS 24 N -4.41 0.17 0.00 6.66 5.02 -0.90 -2.10 118.16 122.61 3d0s n LYS 24 Ca 0.06 0.33 0.10 0.00 -2.02 0.00 0.00 58.31 56.78 3d0s n LYS 24 Cb 0.07 -1.79 0.57 0.00 -0.02 0.00 0.00 35.03 33.86 3d0s n LYS 24 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 3d0s n GLN 25 N -2.11 0.91 -4.07 1.97 6.02 -0.52 -4.56 117.38 115.02 3d0s n GLN 25 Ca 0.03 0.00 -0.28 0.00 -0.01 0.00 0.00 57.00 56.75 3d0s n GLN 25 Cb 0.27 -1.33 -0.17 0.00 1.02 0.00 0.00 30.24 30.04 3d0s n GLN 25 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 3d0s s LEU 26 N -1.66 1.42 0.17 1.08 1.43 -0.89 -5.05 118.68 115.18 3d0s s LEU 26 Ca 0.29 -0.36 -0.29 0.00 -1.03 0.00 0.00 54.13 52.74 3d0s s LEU 26 Cb 0.13 -0.95 -0.08 0.00 0.03 0.00 0.00 46.19 45.32 3d0s s LEU 26 CO 0.22 -0.07 0.91 -1.58 0.23 0.00 0.00 176.35 176.06 3d0s s GLN 27 N 1.45 4.74 1.00 1.70 2.00 -1.26 -4.93 119.66 124.36 3d0s s GLN 27 Ca 0.01 1.40 -0.12 0.00 -2.00 0.00 0.00 55.36 54.65 3d0s s GLN 27 Cb -0.13 -3.31 0.19 0.00 0.80 0.00 0.00 33.01 30.55 3d0s s GLN 27 CO -0.07 0.41 1.08 -2.14 -0.50 0.00 0.00 175.29 174.08 3d0s s PRO 28 N -0.72 0.42 -0.10 1.67 0.02 -1.26 -3.95 135.00 131.07 3d0s s PRO 28 Ca 0.42 0.83 -0.04 0.00 0.02 0.00 0.00 61.00 62.23 3d0s s PRO 28 Cb -0.24 -1.71 0.05 0.00 0.02 0.00 0.00 34.50 32.62 3d0s s PRO 28 CO 0.30 -2.82 0.21 0.08 -0.33 0.00 0.00 177.00 174.44 3d0s s VAL 29 N -2.78 -0.21 -0.18 3.83 1.01 0.80 -4.94 120.40 117.93 3d0s s VAL 29 Ca 0.66 0.25 -0.06 0.00 0.00 0.00 0.00 61.98 62.82 3d0s s VAL 29 Cb -0.21 -0.35 -0.03 0.00 0.00 0.00 0.00 36.38 35.79 3d0s s VAL 29 CO 0.59 0.10 0.03 -1.81 0.00 0.00 0.00 175.10 174.01 3d0s s ASP 30 N 1.86 5.27 -0.03 3.32 1.01 -1.26 0.00 116.67 126.85 3d0s s ASP 30 Ca -0.03 -0.03 0.07 0.00 0.71 0.00 0.00 52.55 53.28 3d0s s ASP 30 Cb -0.11 -1.89 -0.02 0.00 1.01 0.00 0.00 42.92 41.90 3d0s s ASP 30 CO -0.07 0.15 -0.25 -0.36 0.21 0.00 0.00 175.17 174.85 3d0s s PHE 31 N 0.52 2.37 0.96 4.23 0.08 0.81 -4.99 117.98 121.95 3d0s s PHE 31 Ca 0.01 -0.44 -0.12 0.00 0.12 0.00 0.00 56.93 56.50 3d0s s PHE 31 Cb -0.13 -1.52 0.16 0.00 -0.57 0.00 0.00 43.02 40.96 3d0s s PHE 31 CO 0.02 -0.03 1.09 -1.25 -0.10 0.00 0.00 175.22 174.94 3d0s s PRO 32 N -0.58 0.76 0.42 0.24 0.04 -1.26 -0.68 135.00 133.94 3d0s s PRO 32 Ca 0.09 0.78 -0.26 0.00 0.04 0.00 0.00 61.00 61.65 3d0s s PRO 32 Cb -0.10 -1.75 -0.09 0.00 0.04 0.00 0.00 34.50 32.59 3d0s s PRO 32 CO -0.00 -2.57 1.39 0.50 0.04 0.00 0.00 177.00 176.36 3d0s s ARG 33 N -4.87 3.85 -0.92 4.56 3.52 -1.23 -3.66 118.95 120.19 3d0s s ARG 33 Ca 0.65 2.35 -0.02 0.00 -0.13 0.00 0.00 55.73 58.58 3d0s s ARG 33 Cb -0.19 -2.74 0.00 0.00 -1.56 0.00 0.00 34.95 30.46 3d0s s ARG 33 CO 0.58 -0.66 0.20 0.41 -0.81 0.00 0.00 175.30 175.02 3d0s n GLY 34 N 0.60 -0.04 3.73 8.12 0.00 -0.31 -4.96 105.19 112.33 3d0s n GLY 34 Ca 0.04 -0.33 -0.35 0.00 0.00 0.00 0.00 46.02 45.38 3d0s n GLY 34 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 3d0s s HIS 35 N -2.76 3.38 -0.60 1.61 5.04 -1.24 -4.86 115.29 115.86 3d0s s HIS 35 Ca 0.10 0.28 -0.27 0.00 -1.54 0.00 0.00 55.06 53.63 3d0s s HIS 35 Cb -0.04 -2.07 0.03 0.00 0.04 0.00 0.00 32.58 30.54 3d0s s HIS 35 CO 0.12 0.35 1.13 0.99 -2.34 0.00 0.00 174.74 174.99 3d0s s THR 36 N 0.03 4.08 0.11 0.89 2.01 -1.26 -1.22 115.64 120.27 3d0s s THR 36 Ca 0.08 0.61 -0.15 0.00 0.31 0.00 0.00 61.69 62.54 3d0s s THR 36 Cb -0.12 -4.71 -0.05 0.00 0.01 0.00 0.00 72.50 67.63 3d0s s THR 36 CO 0.00 -1.37 1.51 0.58 -0.69 0.00 0.00 174.62 174.65 3d0s h VAL 37 N 6.10 1.28 -2.70 3.82 2.07 -0.93 -3.46 116.25 122.43 3d0s h VAL 37 Ca -0.26 -1.14 -0.06 0.00 0.82 0.00 0.00 66.70 66.05 3d0s h VAL 37 Cb 1.06 1.31 -0.17 0.00 -1.52 0.00 0.00 31.29 31.98 3d0s h VAL 37 CO 1.18 0.37 0.05 0.72 0.02 0.00 0.00 177.57 179.91 3d0s s PHE 38 N -4.78 -0.44 0.17 1.57 -0.12 -1.09 -4.99 117.98 108.29 3d0s s PHE 38 Ca -0.13 0.54 0.09 0.00 -0.05 0.00 0.00 56.93 57.37 3d0s s PHE 38 Cb 0.09 0.34 -0.04 0.00 -0.63 0.00 0.00 43.02 42.78 3d0s s PHE 38 CO 0.80 -0.63 -0.09 0.00 -0.05 0.00 0.00 175.22 175.24 3d0s s ALA 39 N -2.28 2.95 0.00 1.99 0.00 -1.26 -1.22 121.76 121.95 3d0s s ALA 39 Ca -0.06 -1.44 -0.38 0.00 0.00 0.00 0.00 51.96 50.08 3d0s s ALA 39 Cb -0.01 -0.77 -0.18 0.00 0.00 0.00 0.00 23.12 22.17 3d0s s ALA 39 CO -0.00 0.49 1.31 0.39 0.00 0.00 0.00 175.76 177.94 3d0s n GLU 40 N 0.12 0.75 -0.61 0.00 1.02 -1.19 -2.21 120.64 118.52 3d0s n GLU 40 Ca -0.11 0.27 0.00 0.00 -0.02 0.00 0.00 57.16 57.30 3d0s n GLU 40 Cb 0.55 -1.87 0.00 0.00 -0.02 0.00 0.00 31.44 30.10 3d0s n GLU 40 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3d0s n GLY 41 N 2.42 1.19 3.82 0.62 0.00 0.23 -4.98 105.19 108.49 3d0s n GLY 41 Ca 0.20 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.89 3d0s n GLY 41 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3d0s s GLU 42 N -0.23 4.27 0.86 1.61 2.02 -0.94 -4.63 118.70 121.67 3d0s s GLU 42 Ca 0.00 1.14 -0.12 0.00 0.02 0.00 0.00 54.97 56.01 3d0s s GLU 42 Cb 0.00 -2.26 0.10 0.00 0.10 0.00 0.00 34.13 32.07 3d0s s GLU 42 CO 0.00 0.01 1.06 -0.35 0.02 0.00 0.00 175.26 176.01 3d0s n PRO 43 N -0.48 -0.12 -3.59 0.39 -0.04 -1.26 0.01 135.00 129.90 3d0s n PRO 43 Ca 0.06 0.04 -0.11 0.00 -0.04 0.00 0.00 63.50 63.45 3d0s n PRO 43 Cb 0.53 -2.32 -0.06 0.00 -0.04 0.00 0.00 33.50 31.61 3d0s n PRO 43 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 3d0s s GLY 44 N -2.28 -0.25 0.00 0.55 0.00 -1.26 -4.73 107.32 99.35 3d0s s GLY 44 Ca 0.69 2.17 0.13 0.00 0.00 0.00 0.00 44.72 47.71 3d0s s GLY 44 CO 0.56 1.25 1.07 2.09 0.00 0.00 0.00 173.10 178.07 3d0s n ASP 45 N 1.16 0.46 -4.34 1.64 5.75 -1.26 -4.70 116.55 115.25 3d0s n ASP 45 Ca -0.11 -1.97 -0.33 0.00 -0.01 0.00 0.00 54.79 52.37 3d0s n ASP 45 Cb 0.57 -0.22 -0.15 0.00 -1.03 0.00 0.00 41.12 40.29 3d0s n ASP 45 CO 0.00 0.00 0.00 -0.60 -0.11 0.00 0.00 177.20 176.49 3d0s s ARG 46 N 0.00 3.16 0.22 0.11 3.52 -1.26 -1.63 118.95 123.07 3d0s s ARG 46 Ca 0.17 -0.75 0.07 0.00 -0.13 0.00 0.00 55.73 55.09 3d0s s ARG 46 Cb 0.19 -2.49 -0.04 0.00 -1.56 0.00 0.00 34.95 31.05 3d0s s ARG 46 CO -0.08 0.26 0.10 -0.48 -0.81 0.00 0.00 175.30 174.28 3d0s s LEU 47 N 0.20 3.56 0.04 -0.88 -0.00 -0.49 -4.65 118.68 116.46 3d0s s LEU 47 Ca -0.10 -0.35 0.06 0.00 -0.00 0.00 0.00 54.13 53.74 3d0s s LEU 47 Cb -0.16 -2.13 -0.02 0.00 -0.00 0.00 0.00 46.19 43.88 3d0s s LEU 47 CO 0.06 0.02 -0.17 -0.31 -0.00 0.00 0.00 176.35 175.95 3d0s s TYR 48 N -2.03 1.46 -0.12 3.48 1.51 -0.01 -2.07 117.35 119.57 3d0s s TYR 48 Ca 0.31 -0.36 0.02 0.00 -1.01 0.00 0.00 57.07 56.03 3d0s s TYR 48 Cb -0.08 -0.87 0.01 0.00 -0.11 0.00 0.00 41.96 40.91 3d0s s TYR 48 CO 0.22 0.06 -0.18 0.42 -1.11 0.00 0.00 175.55 174.96 3d0s s ILE 49 N -0.82 1.70 0.07 2.71 1.01 0.19 -0.81 121.20 125.26 3d0s s ILE 49 Ca 0.04 -0.77 -0.30 0.00 0.00 0.00 0.00 60.65 59.62 3d0s s ILE 49 Cb -0.08 -1.53 -0.05 0.00 0.01 0.00 0.00 42.46 40.80 3d0s s ILE 49 CO 0.01 0.48 1.07 -0.63 0.00 0.00 0.00 174.94 175.88 3d0s s ILE 50 N 0.91 4.34 -0.20 2.92 1.01 -0.41 -0.68 121.20 129.09 3d0s s ILE 50 Ca -0.07 1.78 -0.13 0.00 0.00 0.00 0.00 60.65 62.23 3d0s s ILE 50 Cb -0.15 -4.14 -0.20 0.00 0.01 0.00 0.00 42.46 37.98 3d0s s ILE 50 CO -0.01 0.20 0.11 -0.38 0.00 0.00 0.00 174.94 174.85 3d0s n ILE 51 N 3.40 1.60 -3.77 2.92 5.41 0.99 -0.43 119.36 129.49 3d0s n ILE 51 Ca 0.06 -0.33 -0.11 0.00 1.00 0.00 0.00 62.75 63.36 3d0s n ILE 51 Cb 0.48 -1.86 -0.07 0.00 -0.71 0.00 0.00 39.64 37.48 3d0s n ILE 51 CO 0.00 0.00 0.00 -0.94 0.00 0.00 0.00 176.55 175.61 3d0s s SER 52 N -6.99 -0.10 0.00 4.38 1.04 -0.84 -4.56 113.70 106.63 3d0s s SER 52 Ca -0.29 -0.24 0.00 0.00 0.48 0.00 0.00 55.95 55.90 3d0s s SER 52 Cb 0.08 0.35 0.00 0.00 0.10 0.00 0.00 66.02 66.55 3d0s s SER 52 CO 0.63 -0.62 0.00 0.61 0.98 0.00 0.00 173.24 174.84 3d0s n GLY 53 N 0.54 0.61 3.24 7.32 0.00 -1.26 -1.40 105.19 114.24 3d0s n GLY 53 Ca -0.18 -2.04 -0.19 0.00 0.00 0.00 0.00 46.02 43.60 3d0s n GLY 53 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3d0s s LYS 54 N -1.37 1.01 -0.04 1.61 1.02 -1.26 -3.70 119.74 117.02 3d0s s LYS 54 Ca 0.00 -1.16 -0.01 0.00 0.02 0.00 0.00 55.97 54.81 3d0s s LYS 54 Cb 0.00 -1.00 0.03 0.00 -0.52 0.00 0.00 37.83 36.34 3d0s s LYS 54 CO 0.00 0.21 0.04 0.08 -0.92 0.00 0.00 175.35 174.76 3d0s s VAL 55 N -1.73 -0.03 -0.01 3.17 1.01 -0.79 -0.98 120.40 121.05 3d0s s VAL 55 Ca 0.06 0.32 -0.16 0.00 0.00 0.00 0.00 61.98 62.20 3d0s s VAL 55 Cb -0.07 -0.18 -0.06 0.00 0.00 0.00 0.00 36.38 36.07 3d0s s VAL 55 CO 0.03 0.16 0.44 -1.59 0.00 0.00 0.00 175.10 174.15 3d0s s LYS 56 N 1.78 4.03 -0.23 2.72 -2.85 0.49 0.11 119.74 125.79 3d0s s LYS 56 Ca 0.00 0.47 -0.04 0.00 -1.00 0.00 0.00 55.97 55.40 3d0s s LYS 56 Cb -0.12 -3.26 -0.01 0.00 -2.06 0.00 0.00 37.83 32.38 3d0s s LYS 56 CO -0.03 0.60 -0.03 0.42 0.10 0.00 0.00 175.35 176.41 3d0s s ILE 57 N -0.82 3.49 0.12 3.79 -1.09 -0.38 -1.50 121.20 124.81 3d0s s ILE 57 Ca 0.25 -0.47 0.03 0.00 -2.23 0.00 0.00 60.65 58.23 3d0s s ILE 57 Cb -0.17 -2.60 -0.04 0.00 -1.58 0.00 0.00 42.46 38.06 3d0s s ILE 57 CO 0.14 0.40 -0.09 -0.83 -1.23 0.00 0.00 174.94 173.33 3d0s s GLY 58 N 1.49 0.91 0.07 6.18 0.00 0.26 -0.29 107.32 115.94 3d0s s GLY 58 Ca 0.06 -1.39 0.06 0.00 0.00 0.00 0.00 44.72 43.45 3d0s s GLY 58 CO -0.02 -1.49 -0.17 0.50 0.00 0.00 0.00 173.10 171.92 3d0s s ARG 59 N -3.66 0.98 -0.08 2.90 1.81 -0.27 -1.13 118.95 119.51 3d0s s ARG 59 Ca 0.13 -0.95 0.04 0.00 -1.72 0.00 0.00 55.73 53.23 3d0s s ARG 59 Cb 0.03 -1.07 0.00 0.00 -0.45 0.00 0.00 34.95 33.46 3d0s s ARG 59 CO -0.02 0.25 -0.21 0.50 -0.68 0.00 0.00 175.30 175.15 3d0s s ARG 60 N -1.56 2.55 0.53 3.54 3.52 -1.26 -0.62 118.95 125.64 3d0s s ARG 60 Ca 0.02 -0.75 -0.15 0.00 -0.13 0.00 0.00 55.73 54.72 3d0s s ARG 60 Cb -0.09 -2.00 -0.07 0.00 -1.56 0.00 0.00 34.95 31.23 3d0s s ARG 60 CO 0.02 0.18 0.97 0.00 -0.81 0.00 0.00 175.30 175.67 3d0s s ALA 61 N 0.31 3.11 0.14 6.12 0.00 0.12 -4.94 121.76 126.62 3d0s s ALA 61 Ca -0.14 0.07 0.02 0.00 0.00 0.00 0.00 51.96 51.91 3d0s s ALA 61 Cb -0.16 -3.06 0.36 0.00 0.00 0.00 0.00 23.12 20.26 3d0s s ALA 61 CO 0.06 -0.31 0.70 -2.30 0.00 0.00 0.00 175.76 173.92 3d0s n PRO 62 N -1.81 -0.04 -1.01 0.00 -0.02 -1.26 -0.23 135.00 130.63 3d0s n PRO 62 Ca 0.06 0.67 -0.04 0.00 -2.02 0.00 0.00 63.50 62.17 3d0s n PRO 62 Cb 0.54 -1.07 0.33 0.00 -0.02 0.00 0.00 33.50 33.27 3d0s n PRO 62 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 3d0s n ASP 63 N -4.45 5.04 0.00 2.55 5.68 -1.26 -4.95 116.55 119.16 3d0s n ASP 63 Ca 0.11 -3.17 0.00 0.00 -0.50 0.00 0.00 54.79 51.23 3d0s n ASP 63 Cb 0.36 -0.74 0.00 0.00 -1.14 0.00 0.00 41.12 39.60 3d0s n ASP 63 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3d0s n GLY 64 N 0.00 1.90 3.74 6.12 0.00 0.68 -5.03 105.19 112.60 3d0s n GLY 64 Ca 0.39 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 46.05 3d0s n GLY 64 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3d0s s ARG 65 N -0.36 2.74 0.05 1.61 0.52 -1.26 -4.73 118.95 117.53 3d0s s ARG 65 Ca 0.00 1.95 0.07 0.00 -0.52 0.00 0.00 55.73 57.23 3d0s s ARG 65 Cb 0.00 -1.88 -0.03 0.00 0.52 0.00 0.00 34.95 33.56 3d0s s ARG 65 CO 0.00 -1.42 -0.21 -1.21 0.02 0.00 0.00 175.30 172.48 3d0s s GLU 66 N -3.37 1.33 0.02 3.54 2.02 -1.26 0.16 118.70 121.13 3d0s s GLU 66 Ca 0.80 -0.98 0.06 0.00 0.02 0.00 0.00 54.97 54.87 3d0s s GLU 66 Cb -0.34 -1.47 -0.02 0.00 0.10 0.00 0.00 34.13 32.40 3d0s s GLU 66 CO 0.37 0.37 -0.19 1.21 0.02 0.00 0.00 175.26 177.04 3d0s s ASN 67 N -1.31 2.20 -0.26 -0.19 3.04 0.21 -4.72 114.94 113.90 3d0s s ASN 67 Ca 0.07 -0.42 -0.06 0.00 0.04 0.00 0.00 52.86 52.48 3d0s s ASN 67 Cb -0.09 -0.21 -0.01 0.00 -1.54 0.00 0.00 41.25 39.40 3d0s s ASN 67 CO 0.02 0.17 0.05 -0.76 -3.04 0.00 0.00 177.10 173.54 3d0s s LEU 68 N -0.83 3.47 0.10 3.21 1.43 -0.39 -1.11 118.68 124.57 3d0s s LEU 68 Ca 0.06 -0.43 -0.14 0.00 -1.03 0.00 0.00 54.13 52.59 3d0s s LEU 68 Cb -0.08 -1.87 -0.10 0.00 0.03 0.00 0.00 46.19 44.17 3d0s s LEU 68 CO 0.01 -0.09 1.39 -0.07 0.23 0.00 0.00 176.35 177.81 3d0s h LEU 69 N 8.21 0.81 -7.31 1.79 4.07 -0.96 -3.39 115.31 118.53 3d0s h LEU 69 Ca -0.36 -0.52 0.09 0.00 0.08 0.00 0.00 57.88 57.16 3d0s h LEU 69 Cb 1.15 -0.23 -0.11 0.00 1.08 0.00 0.00 40.66 42.55 3d0s h LEU 69 CO 0.59 1.17 0.38 0.28 -1.08 0.00 0.00 178.44 179.78 3d0s s THR 70 N -4.18 0.00 -0.16 0.22 -1.32 -1.23 -5.04 115.64 103.94 3d0s s THR 70 Ca -0.12 -0.31 -0.00 0.00 -1.21 0.00 0.00 61.69 60.05 3d0s s THR 70 Cb 0.09 -1.39 -0.00 0.00 -1.51 0.00 0.00 72.50 69.68 3d0s s THR 70 CO 0.85 0.00 -0.14 -0.63 -2.21 0.00 0.00 174.62 172.49 3d0s s ILE 71 N -3.44 2.77 0.12 5.08 -1.09 -1.26 -1.25 121.20 122.13 3d0s s ILE 71 Ca 0.07 -0.73 -0.02 0.00 -2.23 0.00 0.00 60.65 57.74 3d0s s ILE 71 Cb -0.02 -2.18 -0.05 0.00 -1.58 0.00 0.00 42.46 38.64 3d0s s ILE 71 CO -0.05 0.51 0.30 -0.04 -1.23 0.00 0.00 174.94 174.43 3d0s s MET 72 N 0.86 3.51 0.12 2.79 -1.94 0.12 -4.95 119.30 119.81 3d0s s MET 72 Ca -0.04 -0.32 0.02 0.00 -1.71 0.00 0.00 55.69 53.64 3d0s s MET 72 Cb -0.15 -2.93 -0.01 0.00 2.01 0.00 0.00 34.83 33.75 3d0s s MET 72 CO -0.01 0.52 0.12 0.41 -0.01 0.00 0.00 175.02 176.05 3d0s n GLY 73 N -0.01 3.38 3.49 -0.03 0.00 -1.26 -1.89 105.19 108.87 3d0s n GLY 73 Ca -0.04 -1.65 -0.52 0.00 0.00 0.00 0.00 46.02 43.80 3d0s n GLY 73 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3d0s n PRO 74 N -0.21 0.37 0.00 1.61 -0.02 -1.24 -0.68 135.00 134.82 3d0s n PRO 74 Ca 0.02 0.13 0.00 0.00 -2.02 0.00 0.00 63.50 61.63 3d0s n PRO 74 Cb 0.21 -1.47 0.00 0.00 -0.02 0.00 0.00 33.50 32.22 3d0s n PRO 74 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 3d0s n SER 75 N 1.81 0.00 -4.76 2.55 7.64 0.43 -4.97 113.62 116.32 3d0s n SER 75 Ca 0.18 0.00 -0.39 0.00 1.01 0.00 0.00 58.87 59.66 3d0s n SER 75 Cb 0.19 -0.19 -0.04 0.00 -1.01 0.00 0.00 64.21 63.15 3d0s n SER 75 CO 0.00 0.00 0.00 -1.81 -3.01 0.00 0.00 175.04 170.22 3d0s s ASP 76 N -2.41 7.19 -0.09 6.43 1.01 0.15 -4.30 116.67 124.65 3d0s s ASP 76 Ca 0.00 2.19 -0.05 0.00 0.71 0.00 0.00 52.55 55.39 3d0s s ASP 76 Cb 0.00 -2.62 -0.04 0.00 1.01 0.00 0.00 42.92 41.27 3d0s s ASP 76 CO 0.00 -0.19 0.13 -0.32 0.21 0.00 0.00 175.17 175.00 3d0s s MET 77 N -1.65 3.37 0.21 8.23 -2.45 -1.26 -1.29 119.30 124.47 3d0s s MET 77 Ca 0.47 -0.22 -0.05 0.00 -1.25 0.00 0.00 55.69 54.65 3d0s s MET 77 Cb -0.29 -3.11 -0.03 0.00 1.25 0.00 0.00 34.83 32.65 3d0s s MET 77 CO 0.37 0.74 0.23 -0.59 1.05 0.00 0.00 175.02 176.83 3d0s s PHE 78 N -1.09 0.91 -0.95 4.11 -0.12 0.01 -4.88 117.98 115.98 3d0s s PHE 78 Ca 0.18 -1.18 0.00 0.00 -0.05 0.00 0.00 56.93 55.88 3d0s s PHE 78 Cb -0.12 -0.33 0.00 0.00 -0.63 0.00 0.00 43.02 41.94 3d0s s PHE 78 CO 0.07 -0.74 0.00 0.41 -0.05 0.00 0.00 175.22 174.91 3d0s n GLY 79 N -0.30 0.74 0.09 1.99 0.00 -1.26 -0.83 105.19 105.62 3d0s n GLY 79 Ca 0.01 -0.56 0.12 0.00 0.00 0.00 0.00 46.02 45.58 3d0s n GLY 79 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 3d0s h GLU 80 N 0.00 0.00 -0.34 1.61 9.09 -1.90 -3.36 114.58 119.68 3d0s h GLU 80 Ca -0.21 0.00 -0.09 0.00 0.05 0.00 0.00 59.36 59.12 3d0s h GLU 80 Cb 0.80 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 27.89 3d0s h GLU 80 CO 0.28 0.00 -0.13 -0.07 0.05 0.00 0.00 179.01 179.14 3d0s h LEU 81 N 0.00 0.70 0.00 3.06 3.38 -1.94 -1.94 115.31 118.57 3d0s h LEU 81 Ca 0.00 -0.39 0.00 0.00 0.09 0.00 0.00 57.88 57.58 3d0s h LEU 81 Cb 0.81 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.37 3d0s h LEU 81 CO 0.00 0.93 0.00 -1.20 0.09 0.00 0.00 178.44 178.26 3d0s n SER 82 N -4.37 0.00 0.05 -0.43 7.64 -1.26 -0.69 113.62 114.56 3d0s n SER 82 Ca -0.02 0.15 -0.20 0.00 1.01 0.00 0.00 58.87 59.81 3d0s n SER 82 Cb 0.37 -0.35 -0.14 0.00 -1.01 0.00 0.00 64.21 63.08 3d0s n SER 82 CO 0.00 0.00 0.00 0.40 -3.01 0.00 0.00 175.04 172.43 3d0s h ILE 83 N 0.00 1.46 0.00 0.44 1.08 -1.53 -3.29 117.51 115.67 3d0s h ILE 83 Ca 0.00 -2.46 0.00 0.00 -0.39 0.00 0.00 64.86 62.01 3d0s h ILE 83 Cb 0.24 3.04 0.00 0.00 -3.07 0.00 0.00 36.82 37.03 3d0s h ILE 83 CO 0.00 0.71 -1.21 0.49 -0.69 0.00 0.00 178.15 177.45 3d0s n PHE 84 N -4.09 0.66 -3.28 1.37 0.99 -0.99 -4.45 117.46 107.68 3d0s n PHE 84 Ca -0.13 0.19 -0.25 0.00 -0.00 0.00 0.00 57.45 57.25 3d0s n PHE 84 Cb 0.83 -0.78 -0.08 0.00 -1.00 0.00 0.00 39.48 38.44 3d0s n PHE 84 CO 0.00 0.00 0.00 -3.47 -0.00 0.00 0.00 176.76 173.29 3d0s n ASP 85 N -2.48 -0.11 -4.50 4.37 4.64 0.13 -5.11 116.55 113.49 3d0s n ASP 85 Ca -0.01 -2.55 -0.56 0.00 -1.38 0.00 0.00 54.79 50.30 3d0s n ASP 85 Cb 0.54 -0.60 -0.07 0.00 -1.04 0.00 0.00 41.12 39.95 3d0s n ASP 85 CO 0.00 0.00 0.00 -2.65 -0.82 0.00 0.00 177.20 173.73 3d0s n PRO 86 N 2.04 0.24 -3.95 -0.67 -0.02 -1.24 -4.23 135.00 127.18 3d0s n PRO 86 Ca 0.25 0.09 0.00 0.00 -2.02 0.00 0.00 63.50 61.82 3d0s n PRO 86 Cb 0.51 -1.53 0.00 0.00 -0.02 0.00 0.00 33.50 32.46 3d0s n PRO 86 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3d0s n GLY 87 N 1.75 -2.48 3.83 -1.23 0.00 -1.26 -5.02 105.19 100.78 3d0s n GLY 87 Ca 0.19 -1.29 -0.31 0.00 0.00 0.00 0.00 46.02 44.61 3d0s n GLY 87 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3d0s s PRO 88 N -1.97 3.10 0.24 1.61 0.04 -1.26 -4.26 135.00 132.50 3d0s s PRO 88 Ca 0.00 0.88 -0.31 0.00 0.04 0.00 0.00 61.00 61.61 3d0s s PRO 88 Cb 0.00 -2.01 -0.13 0.00 0.04 0.00 0.00 34.50 32.39 3d0s s PRO 88 CO 0.00 -0.96 1.40 0.54 0.04 0.00 0.00 177.00 178.02 3d0s n ARG 89 N -3.03 2.02 0.00 4.56 5.12 0.10 -4.84 116.66 120.59 3d0s n ARG 89 Ca 0.07 0.72 0.10 0.00 -1.93 0.00 0.00 57.85 56.80 3d0s n ARG 89 Cb 0.54 -2.37 0.04 0.00 -1.16 0.00 0.00 32.46 29.50 3d0s n ARG 89 CO 0.00 0.00 0.00 0.25 -1.93 0.00 0.00 177.63 175.95 3d0s n THR 90 N 1.84 0.00 -4.14 0.55 -2.24 -1.26 0.76 114.28 109.79 3d0s n THR 90 Ca 0.11 -0.39 -0.10 0.00 -2.27 0.00 0.00 64.05 61.41 3d0s n THR 90 Cb 0.31 1.31 -0.10 0.00 -2.10 0.00 0.00 70.33 69.75 3d0s n THR 90 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 3d0s s SER 91 N -1.94 0.93 0.05 3.42 0.01 -1.26 -4.83 113.70 110.07 3d0s s SER 91 Ca 0.19 -0.98 -0.03 0.00 1.31 0.00 0.00 55.95 56.44 3d0s s SER 91 Cb 0.16 0.12 -0.04 0.00 0.21 0.00 0.00 66.02 66.47 3d0s s SER 91 CO 0.38 -0.49 0.25 -0.44 0.41 0.00 0.00 173.24 173.35 3d0s s SER 92 N -2.93 6.42 -0.16 2.44 0.01 -0.28 -3.17 113.70 116.02 3d0s s SER 92 Ca 0.09 0.41 0.01 0.00 1.31 0.00 0.00 55.95 57.77 3d0s s SER 92 Cb 0.05 -2.02 0.02 0.00 0.21 0.00 0.00 66.02 64.28 3d0s s SER 92 CO -0.06 0.18 -0.17 0.00 0.41 0.00 0.00 173.24 173.60 3d0s s ALA 93 N -1.46 2.11 -0.07 1.44 0.00 -0.36 -0.57 121.76 122.85 3d0s s ALA 93 Ca 0.33 -1.07 0.02 0.00 0.00 0.00 0.00 51.96 51.24 3d0s s ALA 93 Cb -0.13 -1.11 0.02 0.00 0.00 0.00 0.00 23.12 21.90 3d0s s ALA 93 CO 0.23 -0.35 -0.11 0.99 0.00 0.00 0.00 175.76 176.53 3d0s s THR 94 N 1.35 1.05 0.19 0.00 2.01 -0.56 -0.16 115.64 119.52 3d0s s THR 94 Ca 0.04 -0.41 -0.31 0.00 0.31 0.00 0.00 61.69 61.32 3d0s s THR 94 Cb -0.13 -0.98 -0.10 0.00 0.01 0.00 0.00 72.50 71.29 3d0s s THR 94 CO -0.11 0.34 1.54 -0.89 -0.69 0.00 0.00 174.62 174.81 3d0s s THR 95 N 0.84 2.61 -0.70 -0.82 2.01 -0.35 -0.38 115.64 118.84 3d0s s THR 95 Ca -0.11 0.45 0.12 0.00 0.31 0.00 0.00 61.69 62.46 3d0s s THR 95 Cb -0.15 -3.29 -0.11 0.00 0.01 0.00 0.00 72.50 68.96 3d0s s THR 95 CO 0.02 0.05 0.56 2.30 -0.69 0.00 0.00 174.62 176.85 3d0s n ILE 96 N 3.50 0.00 -4.29 1.82 -5.35 -0.15 -1.16 119.36 113.73 3d0s n ILE 96 Ca 0.12 -0.24 -0.19 0.00 -0.27 0.00 0.00 62.75 62.17 3d0s n ILE 96 Cb 0.39 1.03 -0.08 0.00 -1.74 0.00 0.00 39.64 39.24 3d0s n ILE 96 CO 0.00 0.00 0.00 0.42 -1.76 0.00 0.00 176.55 175.21 3d0s s THR 97 N -2.04 0.05 0.30 7.28 -4.23 -1.23 -4.72 115.64 111.04 3d0s s THR 97 Ca 0.06 -2.00 -0.29 0.00 -1.18 0.00 0.00 61.69 58.28 3d0s s THR 97 Cb 0.09 -2.49 -0.10 0.00 1.34 0.00 0.00 72.50 71.34 3d0s s THR 97 CO 0.46 0.00 1.34 -1.61 -0.54 0.00 0.00 174.62 174.28 3d0s s GLU 98 N -3.57 4.33 -0.05 3.99 2.02 -1.26 -3.54 118.70 120.62 3d0s s GLU 98 Ca 0.39 2.23 0.03 0.00 0.02 0.00 0.00 54.97 57.64 3d0s s GLU 98 Cb 0.03 -3.09 0.01 0.00 0.10 0.00 0.00 34.13 31.18 3d0s s GLU 98 CO 0.24 -0.26 -0.13 0.08 0.02 0.00 0.00 175.26 175.22 3d0s s VAL 99 N -0.73 1.15 -0.21 2.63 1.01 0.15 -4.16 120.40 120.24 3d0s s VAL 99 Ca 0.52 -0.52 -0.08 0.00 0.00 0.00 0.00 61.98 61.91 3d0s s VAL 99 Cb -0.40 -1.03 -0.04 0.00 0.00 0.00 0.00 36.38 34.91 3d0s s VAL 99 CO 0.49 0.35 0.08 -0.13 0.00 0.00 0.00 175.10 175.90 3d0s s ARG 100 N 0.44 3.90 0.32 2.72 0.52 -0.50 -0.14 118.95 126.22 3d0s s ARG 100 Ca -0.10 -0.37 0.04 0.00 -0.52 0.00 0.00 55.73 54.78 3d0s s ARG 100 Cb -0.14 -3.31 -0.04 0.00 0.52 0.00 0.00 34.95 31.99 3d0s s ARG 100 CO 0.03 0.10 0.17 0.00 0.02 0.00 0.00 175.30 175.62 3d0s s ALA 101 N 0.85 2.07 0.10 2.13 0.00 0.10 -0.01 121.76 127.00 3d0s s ALA 101 Ca 0.04 -1.73 0.04 0.00 0.00 0.00 0.00 51.96 50.31 3d0s s ALA 101 Cb -0.13 1.14 -0.04 0.00 0.00 0.00 0.00 23.12 24.09 3d0s s ALA 101 CO 0.02 -0.50 -0.11 0.54 0.00 0.00 0.00 175.76 175.71 3d0s s VAL 102 N -3.54 0.99 0.04 0.00 0.11 0.14 -0.14 120.40 118.00 3d0s s VAL 102 Ca 0.35 -1.64 -0.00 0.00 -2.93 0.00 0.00 61.98 57.75 3d0s s VAL 102 Cb 0.04 -1.37 -0.03 0.00 -1.53 0.00 0.00 36.38 33.49 3d0s s VAL 102 CO 0.18 -0.54 -0.03 -0.55 -3.33 0.00 0.00 175.10 170.83 3d0s s SER 103 N -2.43 0.40 -0.22 3.54 0.15 -1.25 -0.64 113.70 113.25 3d0s s SER 103 Ca 0.06 -0.71 -0.27 0.00 0.70 0.00 0.00 55.95 55.73 3d0s s SER 103 Cb -0.03 0.13 0.08 0.00 -1.71 0.00 0.00 66.02 64.50 3d0s s SER 103 CO 0.00 -0.41 0.79 -0.32 1.20 0.00 0.00 173.24 174.50 3d0s s MET 104 N -2.48 0.80 0.50 5.44 1.75 -0.88 -4.58 119.30 119.86 3d0s s MET 104 Ca -0.06 0.72 0.08 0.00 -1.25 0.00 0.00 55.69 55.18 3d0s s MET 104 Cb -0.03 0.39 0.04 0.00 2.84 0.00 0.00 34.83 38.07 3d0s s MET 104 CO -0.04 -0.14 0.60 0.16 -0.65 0.00 0.00 175.02 174.95 3d0s s ASP 105 N -0.06 5.17 0.20 1.11 1.47 -1.26 -1.40 116.67 121.90 3d0s s ASP 105 Ca -0.02 -0.78 -0.10 0.00 1.18 0.00 0.00 52.55 52.84 3d0s s ASP 105 Cb -0.04 -0.08 0.13 0.00 -0.34 0.00 0.00 42.92 42.59 3d0s s ASP 105 CO 0.01 -1.04 1.78 -0.09 0.68 0.00 0.00 175.17 176.52 3d0s h ARG 106 N 0.53 1.05 -0.42 2.11 2.43 -1.69 -1.66 114.38 116.73 3d0s h ARG 106 Ca -0.35 -0.16 -0.09 0.00 -0.81 0.00 0.00 59.98 58.56 3d0s h ARG 106 Cb 1.28 -0.18 -0.01 0.00 -0.42 0.00 0.00 29.97 30.64 3d0s h ARG 106 CO 0.47 0.83 -0.10 -0.44 -1.51 0.00 0.00 179.97 179.22 3d0s h ASP 107 N 1.01 0.82 0.14 -3.80 3.32 -1.96 0.30 116.42 116.26 3d0s h ASP 107 Ca 0.25 -0.36 0.01 0.00 0.02 0.00 0.00 57.03 56.94 3d0s h ASP 107 Cb 0.14 -0.22 -0.02 0.00 0.22 0.00 0.00 39.33 39.45 3d0s h ASP 107 CO -0.03 0.99 -0.18 0.00 -1.72 0.00 0.00 179.24 178.30 3d0s h ALA 108 N 0.85 -0.33 -0.57 3.45 0.00 -1.93 -0.88 119.26 119.84 3d0s h ALA 108 Ca 0.11 -0.04 0.09 0.00 0.00 0.00 0.00 54.91 55.06 3d0s h ALA 108 Cb 0.64 0.27 -0.07 0.00 0.00 0.00 0.00 17.79 18.63 3d0s h ALA 108 CO 0.04 -0.72 0.20 1.25 0.00 0.00 0.00 179.25 180.03 3d0s h LEU 109 N -0.37 0.19 -1.16 0.00 5.85 -1.11 -1.72 115.31 116.99 3d0s h LEU 109 Ca 0.01 0.07 0.09 0.00 0.84 0.00 0.00 57.88 58.90 3d0s h LEU 109 Cb 0.37 0.06 -0.07 0.00 0.37 0.00 0.00 40.66 41.40 3d0s h LEU 109 CO -0.07 0.12 0.59 -0.09 -0.34 0.00 0.00 178.44 178.65 3d0s h ARG 110 N 0.38 0.92 -0.65 1.25 2.43 -0.12 -2.31 114.38 116.27 3d0s h ARG 110 Ca 0.28 -0.06 0.01 0.00 -0.81 0.00 0.00 59.98 59.41 3d0s h ARG 110 Cb 0.34 -0.21 -0.03 0.00 -0.42 0.00 0.00 29.97 29.65 3d0s h ARG 110 CO -0.29 0.61 0.43 0.77 -1.51 0.00 0.00 179.97 179.97 3d0s h SER 111 N 0.94 0.75 0.00 -3.80 0.02 -0.29 -2.91 113.55 108.27 3d0s h SER 111 Ca 0.42 -0.02 -0.06 0.00 -0.84 0.00 0.00 61.79 61.29 3d0s h SER 111 Cb 0.37 -0.19 -0.02 0.00 0.14 0.00 0.00 62.40 62.70 3d0s h SER 111 CO -0.18 0.54 -0.12 0.79 -1.14 0.00 0.00 176.83 176.72 3d0s n TRP 112 N -4.63 0.00 0.00 3.45 7.02 -0.87 -3.41 117.44 118.99 3d0s n TRP 112 Ca 0.05 -1.13 0.00 0.00 -1.02 0.00 0.00 57.50 55.41 3d0s n TRP 112 Cb 0.02 -0.85 0.00 0.00 -2.42 0.00 0.00 31.31 28.06 3d0s n TRP 112 CO 0.00 0.00 0.00 -0.89 -2.02 0.00 0.00 177.69 174.78 3d0s n ILE 113 N 1.86 0.00 0.33 -0.99 5.41 -1.10 -4.73 119.36 120.14 3d0s n ILE 113 Ca 0.14 0.00 0.15 0.00 1.00 0.00 0.00 62.75 64.04 3d0s n ILE 113 Cb 0.62 0.00 0.63 0.00 -0.71 0.00 0.00 39.64 40.18 3d0s n ILE 113 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3d0s h ALA 114 N 0.00 1.00 0.00 -1.39 0.00 -1.58 0.44 119.26 117.73 3d0s h ALA 114 Ca 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 54.91 54.76 3d0s h ALA 114 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 3d0s h ALA 114 CO 0.00 0.00 -1.39 -0.25 0.00 0.00 0.00 179.25 177.61 3d0s n ASP 115 N -2.73 0.83 -3.23 0.00 8.00 -1.26 -4.93 116.55 113.23 3d0s n ASP 115 Ca 0.01 0.36 -0.22 0.00 0.71 0.00 0.00 54.79 55.65 3d0s n ASP 115 Cb 0.26 0.23 -0.07 0.00 -0.02 0.00 0.00 41.12 41.52 3d0s n ASP 115 CO 0.00 0.00 0.00 -2.11 -0.39 0.00 0.00 177.20 174.70 3d0s n ARG 116 N -2.85 0.35 0.33 -1.24 1.85 0.15 -4.96 116.66 110.29 3d0s n ARG 116 Ca -0.09 -2.94 0.21 0.00 -1.00 0.00 0.00 57.85 54.03 3d0s n ARG 116 Cb 0.81 -1.55 1.13 0.00 -1.05 0.00 0.00 32.46 31.80 3d0s n ARG 116 CO 0.00 0.00 0.00 -1.00 -0.01 0.00 0.00 177.63 176.62 3d0s h PRO 117 N 5.18 0.00 0.00 2.89 0.13 -1.91 -2.53 132.00 135.76 3d0s h PRO 117 Ca 0.18 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.30 3d0s h PRO 117 Cb 0.94 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.07 3d0s h PRO 117 CO 0.33 0.00 -0.05 0.93 -0.23 0.00 0.00 178.00 178.98 3d0s h GLU 118 N 0.00 0.00 -0.23 0.86 5.08 -1.92 -1.66 114.58 116.70 3d0s h GLU 118 Ca 0.00 0.00 -0.11 0.00 -1.00 0.00 0.00 59.36 58.25 3d0s h GLU 118 Cb 0.03 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.28 3d0s h GLU 118 CO -0.00 0.05 -0.28 0.82 -1.00 0.00 0.00 179.01 178.60 3d0s h ILE 119 N 0.00 1.32 -0.69 3.13 2.04 -1.70 -2.61 117.51 119.00 3d0s h ILE 119 Ca -0.00 -1.47 0.01 0.00 1.00 0.00 0.00 64.86 64.40 3d0s h ILE 119 Cb 0.12 1.72 -0.04 0.00 -0.74 0.00 0.00 36.82 37.88 3d0s h ILE 119 CO 0.01 0.46 0.45 0.28 0.00 0.00 0.00 178.15 179.34 3d0s h SER 120 N 0.31 0.77 -0.85 1.72 0.02 -1.52 -1.22 113.55 112.77 3d0s h SER 120 Ca 0.03 -0.01 0.16 0.00 -0.84 0.00 0.00 61.79 61.12 3d0s h SER 120 Cb 0.85 -0.19 -0.10 0.00 0.14 0.00 0.00 62.40 63.11 3d0s h SER 120 CO 0.07 0.55 0.43 -0.08 -1.14 0.00 0.00 176.83 176.66 3d0s h GLU 121 N 0.91 0.57 -0.05 3.45 4.81 -1.25 -0.70 114.58 122.33 3d0s h GLU 121 Ca 0.26 -0.03 -0.16 0.00 -0.13 0.00 0.00 59.36 59.29 3d0s h GLU 121 Cb -0.07 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 29.16 3d0s h GLU 121 CO -0.07 0.38 -0.68 1.96 -0.73 0.00 0.00 179.01 179.87 3d0s h GLN 122 N 0.59 0.22 -0.03 1.92 4.20 -0.99 -1.86 115.11 119.15 3d0s h GLN 122 Ca 0.47 -0.17 -0.19 0.00 0.06 0.00 0.00 58.65 58.82 3d0s h GLN 122 Cb 0.71 0.03 -0.01 0.00 0.30 0.00 0.00 27.48 28.51 3d0s h GLN 122 CO -0.38 0.82 -0.80 -0.07 -0.67 0.00 0.00 178.83 177.72 3d0s h LEU 123 N 0.15 0.39 -0.88 1.46 3.38 -0.67 -2.39 115.31 116.76 3d0s h LEU 123 Ca -0.02 -0.28 -0.11 0.00 0.09 0.00 0.00 57.88 57.56 3d0s h LEU 123 Cb 1.22 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.84 3d0s h LEU 123 CO 0.10 1.04 -0.37 -0.07 0.09 0.00 0.00 178.44 179.24 3d0s h LEU 124 N 0.20 0.40 -0.03 1.67 3.38 -1.07 -1.71 115.31 118.16 3d0s h LEU 124 Ca -0.04 -0.16 0.00 0.00 0.09 0.00 0.00 57.88 57.77 3d0s h LEU 124 Cb 1.40 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 42.03 3d0s h LEU 124 CO 0.13 0.74 -0.00 -0.09 0.09 0.00 0.00 178.44 179.30 3d0s h ARG 125 N 0.33 0.00 -0.17 1.13 2.43 -1.19 -1.43 114.38 115.49 3d0s h ARG 125 Ca 0.04 -0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.20 3d0s h ARG 125 Cb 0.80 -0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.34 3d0s h ARG 125 CO 0.06 0.00 0.10 0.28 -1.51 0.00 0.00 179.97 178.90 3d0s h VAL 126 N 0.00 1.08 -0.81 0.20 2.07 -1.22 0.32 116.25 117.90 3d0s h VAL 126 Ca 0.01 -0.21 -0.01 0.00 0.82 0.00 0.00 66.70 67.32 3d0s h VAL 126 Cb 0.02 0.92 -0.04 0.00 -1.52 0.00 0.00 31.29 30.67 3d0s h VAL 126 CO -0.02 0.08 0.46 -0.07 0.02 0.00 0.00 177.57 178.03 3d0s h LEU 127 N 0.18 0.99 -0.75 2.57 3.38 -1.31 -1.35 115.31 119.02 3d0s h LEU 127 Ca 0.06 -0.08 -0.12 0.00 0.09 0.00 0.00 57.88 57.83 3d0s h LEU 127 Cb 0.04 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.52 3d0s h LEU 127 CO -0.01 0.78 -0.33 0.00 0.09 0.00 0.00 178.44 178.98 3d0s h ALA 128 N 1.25 0.93 -0.18 1.53 0.00 -0.85 0.07 119.26 122.00 3d0s h ALA 128 Ca 0.29 -0.40 0.00 0.00 0.00 0.00 0.00 54.91 54.80 3d0s h ALA 128 Cb -0.00 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 3d0s h ALA 128 CO -0.05 0.62 0.11 -0.09 0.00 0.00 0.00 179.25 179.84 3d0s h ARG 129 N 0.49 0.24 -0.74 0.00 2.43 -0.65 -0.39 114.38 115.76 3d0s h ARG 129 Ca 0.06 -0.02 -0.04 0.00 -0.81 0.00 0.00 59.98 59.17 3d0s h ARG 129 Cb 0.80 -0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 30.27 3d0s h ARG 129 CO 0.07 0.17 0.30 0.00 -1.51 0.00 0.00 179.97 179.00 3d0s h ARG 130 N 0.23 1.11 -0.33 0.20 3.08 -1.11 -1.64 114.38 115.92 3d0s h ARG 130 Ca 0.06 -0.20 0.04 0.00 0.07 0.00 0.00 59.98 59.95 3d0s h ARG 130 Cb -0.01 -0.18 -0.04 0.00 0.08 0.00 0.00 29.97 29.82 3d0s h ARG 130 CO -0.01 0.90 0.12 -0.07 -1.07 0.00 0.00 179.97 179.84 3d0s h LEU 131 N 1.07 0.15 -0.41 3.04 3.38 -0.78 -1.47 115.31 120.29 3d0s h LEU 131 Ca 0.25 0.03 0.03 0.00 0.09 0.00 0.00 57.88 58.28 3d0s h LEU 131 Cb 0.20 0.01 -0.04 0.00 0.09 0.00 0.00 40.66 40.93 3d0s h LEU 131 CO -0.02 0.12 0.20 -0.09 0.09 0.00 0.00 178.44 178.74 3d0s h ARG 132 N 0.27 0.40 -0.58 1.13 2.43 -0.90 -1.63 114.38 115.50 3d0s h ARG 132 Ca 0.15 -0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.29 3d0s h ARG 132 Cb 0.11 -0.09 -0.03 0.00 -0.42 0.00 0.00 29.97 29.54 3d0s h ARG 132 CO -0.15 0.27 0.33 -0.09 -1.51 0.00 0.00 179.97 178.82 3d0s h ARG 133 N 0.41 0.80 -0.78 0.20 2.43 -1.10 0.16 114.38 116.50 3d0s h ARG 133 Ca 0.18 -0.08 -0.05 0.00 -0.81 0.00 0.00 59.98 59.22 3d0s h ARG 133 Cb 0.09 -0.16 -0.03 0.00 -0.42 0.00 0.00 29.97 29.44 3d0s h ARG 133 CO -0.13 0.59 0.29 1.15 -1.51 0.00 0.00 179.97 180.37 3d0s h THR 134 N 0.78 1.26 -0.43 0.20 2.02 -1.07 0.24 112.91 115.90 3d0s h THR 134 Ca 0.21 -0.85 -0.12 0.00 0.77 0.00 0.00 66.41 66.42 3d0s h THR 134 Cb 0.01 0.34 -0.01 0.00 -1.74 0.00 0.00 68.15 66.75 3d0s h THR 134 CO -0.04 0.34 -0.21 0.78 0.37 0.00 0.00 175.52 176.77 3d0s h ASN 135 N 1.14 0.93 -0.48 4.18 2.35 -0.90 0.93 115.58 123.74 3d0s h ASN 135 Ca 0.26 -0.40 -0.02 0.00 -0.55 0.00 0.00 56.30 55.59 3d0s h ASN 135 Cb 0.24 -0.26 -0.02 0.00 0.05 0.00 0.00 38.32 38.33 3d0s h ASN 135 CO -0.02 1.13 0.23 0.78 -1.65 0.00 0.00 177.43 177.90 3d0s h ASN 136 N 0.74 0.63 -0.76 5.81 2.35 -0.25 -1.17 115.58 122.93 3d0s h ASN 136 Ca 0.10 -0.13 0.01 0.00 -0.55 0.00 0.00 56.30 55.72 3d0s h ASN 136 Cb 0.78 -0.16 -0.04 0.00 0.05 0.00 0.00 38.32 38.95 3d0s h ASN 136 CO 0.06 0.59 0.49 0.78 -1.65 0.00 0.00 177.43 177.71 3d0s h ASN 137 N 0.63 0.88 -0.39 5.81 -0.26 -0.27 -1.32 115.58 120.67 3d0s h ASN 137 Ca 0.16 -0.03 -0.03 0.00 -0.56 0.00 0.00 56.30 55.85 3d0s h ASN 137 Cb 0.13 -0.22 -0.02 0.00 -1.06 0.00 0.00 38.32 37.15 3d0s h ASN 137 CO -0.02 0.64 0.13 0.25 -1.06 0.00 0.00 177.43 177.37 3d0s h LEU 138 N 1.03 0.55 -0.88 1.61 6.46 -0.52 -0.67 115.31 122.89 3d0s h LEU 138 Ca 0.28 -0.19 0.00 0.00 -0.12 0.00 0.00 57.88 57.85 3d0s h LEU 138 Cb -0.11 -0.14 -0.04 0.00 -0.73 0.00 0.00 40.66 39.64 3d0s h LEU 138 CO -0.06 0.60 0.56 0.00 -0.62 0.00 0.00 178.44 178.92 3d0s h ALA 139 N 0.98 1.11 -0.42 1.25 0.00 -1.00 -2.77 119.26 118.41 3d0s h ALA 139 Ca 0.13 -0.08 -0.04 0.00 0.00 0.00 0.00 54.91 54.92 3d0s h ALA 139 Cb 0.23 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 3d0s h ALA 139 CO -0.01 0.54 0.11 -0.44 0.00 0.00 0.00 179.25 179.45 3d0s h ASP 140 N 1.20 0.63 -0.60 0.00 3.45 -0.95 -2.01 116.42 118.14 3d0s h ASP 140 Ca 0.32 -0.23 0.10 0.00 0.43 0.00 0.00 57.03 57.65 3d0s h ASP 140 Cb -0.10 -0.17 -0.08 0.00 -0.56 0.00 0.00 39.33 38.43 3d0s h ASP 140 CO -0.07 0.69 0.19 0.25 -1.57 0.00 0.00 179.24 178.74 3d0s h LEU 141 N 0.54 0.15 0.14 1.55 5.85 -0.90 0.54 115.31 123.18 3d0s h LEU 141 Ca 0.13 0.09 -0.30 0.00 0.84 0.00 0.00 57.88 58.64 3d0s h LEU 141 Cb 0.31 0.09 0.03 0.00 0.37 0.00 0.00 40.66 41.45 3d0s h LEU 141 CO 0.00 0.09 -1.30 0.40 -0.34 0.00 0.00 178.44 177.29 3d0s h ILE 142 N 0.35 1.33 -0.00 4.05 1.08 -1.37 -3.40 117.51 119.55 3d0s h ILE 142 Ca 0.31 -2.65 0.00 0.00 -0.39 0.00 0.00 64.86 62.12 3d0s h ILE 142 Cb 0.40 2.83 0.00 0.00 -3.07 0.00 0.00 36.82 36.99 3d0s h ILE 142 CO -0.33 0.80 -0.06 0.49 -0.69 0.00 0.00 178.15 178.35 3d0s n PHE 143 N -3.71 0.00 -5.00 1.37 3.72 -0.77 -4.95 117.46 108.11 3d0s n PHE 143 Ca -0.13 0.00 -0.32 0.00 -0.05 0.00 0.00 57.45 56.95 3d0s n PHE 143 Cb 1.02 0.00 -0.14 0.00 -0.94 0.00 0.00 39.48 39.42 3d0s n PHE 143 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 176.76 177.70 3d0s s THR 144 N -0.71 2.71 0.82 4.37 2.01 0.17 -5.02 115.64 119.99 3d0s s THR 144 Ca 0.05 -0.90 -0.12 0.00 0.31 0.00 0.00 61.69 61.03 3d0s s THR 144 Cb 0.04 -2.04 0.09 0.00 0.01 0.00 0.00 72.50 70.60 3d0s s THR 144 CO 0.10 0.56 1.12 1.51 -0.69 0.00 0.00 174.62 177.22 3d0s s ASP 145 N -0.77 4.31 0.12 3.53 1.47 -1.26 -4.69 116.67 119.38 3d0s s ASP 145 Ca 0.11 1.10 -0.20 0.00 1.18 0.00 0.00 52.55 54.74 3d0s s ASP 145 Cb -0.10 -1.76 -0.05 0.00 -0.34 0.00 0.00 42.92 40.66 3d0s s ASP 145 CO 0.01 -2.06 1.73 0.58 0.68 0.00 0.00 175.17 176.10 3d0s h VAL 146 N -1.15 0.89 -0.81 2.11 2.07 -1.97 -0.92 116.25 116.46 3d0s h VAL 146 Ca -0.48 -0.02 0.06 0.00 0.82 0.00 0.00 66.70 67.08 3d0s h VAL 146 Cb 1.30 0.83 -0.05 0.00 -1.52 0.00 0.00 31.29 31.84 3d0s h VAL 146 CO 0.62 0.01 0.53 -0.65 0.02 0.00 0.00 177.57 178.10 3d0s h PRO 147 N 0.06 0.87 -0.44 1.57 0.11 -1.94 0.22 132.00 132.46 3d0s h PRO 147 Ca 0.08 -0.05 -0.06 0.00 0.11 0.00 0.00 66.00 66.07 3d0s h PRO 147 Cb 0.09 -0.20 -0.02 0.00 0.11 0.00 0.00 31.00 30.98 3d0s h PRO 147 CO -0.12 0.58 0.03 0.78 -0.21 0.00 0.00 178.00 179.05 3d0s h GLY 148 N 0.90 0.76 1.31 -0.55 0.00 -1.53 -0.16 103.07 103.79 3d0s h GLY 148 Ca 0.35 -0.47 -0.16 0.00 0.00 0.00 0.00 47.33 47.05 3d0s h GLY 148 CO -0.12 0.44 -0.45 3.21 0.00 0.00 0.00 176.54 179.62 3d0s h ARG 149 N 0.67 0.75 -0.15 4.80 3.08 -0.11 -0.96 114.38 122.46 3d0s h ARG 149 Ca 0.14 -0.42 0.01 0.00 0.07 0.00 0.00 59.98 59.78 3d0s h ARG 149 Cb 0.37 0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.44 3d0s h ARG 149 CO 0.01 1.04 0.07 0.28 -1.07 0.00 0.00 179.97 180.31 3d0s h VAL 150 N 0.60 1.00 -0.21 2.04 2.07 -0.70 -0.45 116.25 120.60 3d0s h VAL 150 Ca 0.04 -0.06 0.03 0.00 0.82 0.00 0.00 66.70 67.53 3d0s h VAL 150 Cb 1.01 0.82 -0.03 0.00 -1.52 0.00 0.00 31.29 31.57 3d0s h VAL 150 CO 0.10 0.03 0.03 0.00 0.02 0.00 0.00 177.57 177.74 3d0s h ALA 151 N 1.08 0.20 -0.20 1.67 0.00 -0.91 -1.00 119.26 120.10 3d0s h ALA 151 Ca 0.06 0.04 0.03 0.00 0.00 0.00 0.00 54.91 55.05 3d0s h ALA 151 Cb 0.01 0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.83 3d0s h ALA 151 CO -0.04 -0.40 0.00 0.87 0.00 0.00 0.00 179.25 179.68 3d0s h LYS 152 N 0.10 0.07 -0.77 0.00 1.57 -1.04 -1.50 116.57 115.00 3d0s h LYS 152 Ca 0.09 -0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.86 3d0s h LYS 152 Cb 0.10 -0.02 -0.04 0.00 0.08 0.00 0.00 32.23 32.36 3d0s h LYS 152 CO -0.14 0.05 0.45 1.96 -0.57 0.00 0.00 179.45 181.20 3d0s h GLN 153 N 0.07 1.06 -0.61 3.15 1.08 -0.79 0.20 115.11 119.27 3d0s h GLN 153 Ca 0.09 -0.11 0.01 0.00 -1.45 0.00 0.00 58.65 57.20 3d0s h GLN 153 Cb 0.12 -0.22 -0.03 0.00 -0.05 0.00 0.00 27.48 27.30 3d0s h GLN 153 CO -0.16 0.77 0.39 -0.07 -0.95 0.00 0.00 178.83 178.81 3d0s h LEU 154 N 1.06 0.67 -0.95 1.46 3.38 -1.00 0.14 115.31 120.07 3d0s h LEU 154 Ca 0.27 -0.01 -0.09 0.00 0.09 0.00 0.00 57.88 58.14 3d0s h LEU 154 Cb -0.00 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.57 3d0s h LEU 154 CO -0.05 0.48 -0.25 -0.07 0.09 0.00 0.00 178.44 178.64 3d0s h LEU 155 N 0.80 0.47 -0.37 1.67 3.38 -0.91 -1.18 115.31 119.17 3d0s h LEU 155 Ca 0.23 -0.16 -0.10 0.00 0.09 0.00 0.00 57.88 57.94 3d0s h LEU 155 Cb -0.06 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.55 3d0s h LEU 155 CO -0.06 0.72 -0.16 1.56 0.09 0.00 0.00 178.44 180.58 3d0s h GLN 156 N 0.42 0.77 -0.40 1.13 4.20 -0.23 -0.98 115.11 120.02 3d0s h GLN 156 Ca 0.06 -0.33 0.03 0.00 0.06 0.00 0.00 58.65 58.48 3d0s h GLN 156 Cb 0.66 -0.03 -0.04 0.00 0.30 0.00 0.00 27.48 28.38 3d0s h GLN 156 CO 0.05 0.94 0.19 -0.07 -0.67 0.00 0.00 178.83 179.27 3d0s h LEU 157 N 0.56 0.26 -1.75 1.46 3.38 -0.66 -2.42 115.31 116.15 3d0s h LEU 157 Ca 0.09 0.02 -0.00 0.00 0.09 0.00 0.00 57.88 58.08 3d0s h LEU 157 Cb 0.70 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.42 3d0s h LEU 157 CO 0.05 0.19 0.14 0.00 0.09 0.00 0.00 178.44 178.91 3d0s h ALA 158 N 1.22 1.81 -0.12 1.53 0.00 -1.03 0.30 119.26 122.97 3d0s h ALA 158 Ca 0.17 -0.03 -0.09 0.00 0.00 0.00 0.00 54.91 54.97 3d0s h ALA 158 Cb 0.09 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 3d0s h ALA 158 CO -0.13 0.17 -0.32 1.96 0.00 0.00 0.00 179.25 180.92 3d0s h GLN 159 N 0.31 0.24 0.03 0.00 4.20 -0.69 -1.04 115.11 118.17 3d0s h GLN 159 Ca 0.08 -0.10 -0.36 0.00 0.06 0.00 0.00 58.65 58.33 3d0s h GLN 159 Cb -0.01 -0.01 -0.06 0.00 0.30 0.00 0.00 27.48 27.70 3d0s h GLN 159 CO -0.02 0.55 -2.23 -2.13 -0.67 0.00 0.00 178.83 174.33 3d0s n ARG 160 N -4.10 0.68 0.00 1.46 3.00 -0.68 -4.69 116.66 112.34 3d0s n ARG 160 Ca -0.01 0.15 0.00 0.00 -0.00 0.00 0.00 57.85 57.99 3d0s n ARG 160 Cb 0.42 -1.60 0.00 0.00 0.00 0.00 0.00 32.46 31.27 3d0s n ARG 160 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.63 178.82 3d0s n PHE 161 N -3.13 0.00 -2.16 -0.14 3.72 0.99 -5.07 117.46 111.66 3d0s n PHE 161 Ca -0.35 0.00 -0.33 0.00 -0.05 0.00 0.00 57.45 56.72 3d0s n PHE 161 Cb 1.06 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.60 3d0s n PHE 161 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 3d0s s GLY 162 N -0.71 2.29 0.00 1.37 0.00 -0.40 -4.35 107.32 105.53 3d0s s GLY 162 Ca 0.00 0.52 0.02 0.00 0.00 0.00 0.00 44.72 45.26 3d0s s GLY 162 CO 0.00 0.85 -0.06 -0.51 0.00 0.00 0.00 173.10 173.38 3d0s s THR 163 N -2.23 0.44 0.30 0.90 -4.23 0.12 -4.96 115.64 105.97 3d0s s THR 163 Ca 0.66 -0.38 -0.29 0.00 -1.18 0.00 0.00 61.69 60.50 3d0s s THR 163 Cb -0.18 -0.40 -0.10 0.00 1.34 0.00 0.00 72.50 73.17 3d0s s THR 163 CO 0.32 0.03 1.23 -1.58 -0.54 0.00 0.00 174.62 174.08 3d0s s GLN 164 N -0.38 4.47 -0.38 3.99 2.00 -1.26 -0.39 119.66 127.70 3d0s s GLN 164 Ca -0.00 2.04 0.01 0.00 -2.00 0.00 0.00 55.36 55.41 3d0s s GLN 164 Cb -0.03 -3.13 0.14 0.00 0.80 0.00 0.00 33.01 30.78 3d0s s GLN 164 CO -0.00 -0.04 0.22 -2.00 -0.50 0.00 0.00 175.29 172.96 3d0s s GLU 165 N -1.51 0.82 7.73 1.67 2.12 0.14 -4.79 118.70 124.88 3d0s s GLU 165 Ca 0.48 -1.55 0.00 0.00 0.36 0.00 0.00 54.97 54.26 3d0s s GLU 165 Cb -0.36 -1.70 0.00 0.00 0.26 0.00 0.00 34.13 32.33 3d0s s GLU 165 CO 0.47 -1.18 0.00 0.41 -0.54 0.00 0.00 175.26 174.42 3d0s n GLY 166 N 3.91 3.29 1.52 -1.50 0.00 -1.26 -1.75 105.19 109.40 3d0s n GLY 166 Ca 0.10 -0.14 -0.08 0.00 0.00 0.00 0.00 46.02 45.90 3d0s n GLY 166 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3d0s n GLY 167 N 0.00 2.99 3.17 -0.02 0.00 -1.26 -4.89 105.19 105.18 3d0s n GLY 167 Ca 0.00 -0.55 -0.10 0.00 0.00 0.00 0.00 46.02 45.37 3d0s n GLY 167 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d0s s ALA 168 N -1.80 0.96 -0.23 4.61 0.00 -0.72 -4.84 121.76 119.75 3d0s s ALA 168 Ca 0.30 -1.52 -0.01 0.00 0.00 0.00 0.00 51.96 50.73 3d0s s ALA 168 Cb 0.24 0.90 0.02 0.00 0.00 0.00 0.00 23.12 24.28 3d0s s ALA 168 CO 0.07 -0.48 -0.09 -1.17 0.00 0.00 0.00 175.76 174.09 3d0s s LEU 169 N -3.08 2.90 -0.06 0.00 2.96 -0.50 0.24 118.68 121.15 3d0s s LEU 169 Ca 0.26 -0.73 -0.26 0.00 -0.22 0.00 0.00 54.13 53.18 3d0s s LEU 169 Cb 0.07 -1.64 -0.03 0.00 0.50 0.00 0.00 46.19 45.09 3d0s s LEU 169 CO 0.03 -0.08 0.83 -0.60 -1.32 0.00 0.00 176.35 175.22 3d0s s ARG 170 N 1.35 4.46 -0.33 1.98 6.06 0.48 -0.50 118.95 132.45 3d0s s ARG 170 Ca 0.02 1.12 0.02 0.00 -2.50 0.00 0.00 55.73 54.39 3d0s s ARG 170 Cb -0.15 -3.48 0.10 0.00 0.06 0.00 0.00 34.95 31.48 3d0s s ARG 170 CO -0.06 -0.06 0.07 0.08 -2.50 0.00 0.00 175.30 172.83 3d0s s VAL 171 N 1.15 1.73 -0.79 7.11 1.01 0.46 -0.71 120.40 130.36 3d0s s VAL 171 Ca 0.43 -1.97 -0.20 0.00 0.00 0.00 0.00 61.98 60.25 3d0s s VAL 171 Cb -0.19 -2.28 0.11 0.00 0.00 0.00 0.00 36.38 34.02 3d0s s VAL 171 CO 0.21 -0.62 1.00 -0.89 0.00 0.00 0.00 175.10 174.79 3d0s s THR 172 N 1.18 4.67 -0.44 3.92 2.01 -1.26 -1.02 115.64 124.71 3d0s s THR 172 Ca 0.10 -1.18 0.23 0.00 0.31 0.00 0.00 61.69 61.15 3d0s s THR 172 Cb -0.18 -4.69 0.01 0.00 0.01 0.00 0.00 72.50 67.64 3d0s s THR 172 CO -0.15 -1.41 1.15 1.12 -0.69 0.00 0.00 174.62 174.64 3d0s h HIS 173 N 9.05 0.00 -2.26 4.92 2.07 -1.77 -3.48 115.15 123.68 3d0s h HIS 173 Ca -0.04 0.00 -0.40 0.00 -2.85 0.00 0.00 60.37 57.07 3d0s h HIS 173 Cb 1.05 0.00 -0.08 0.00 2.57 0.00 0.00 27.41 30.95 3d0s h HIS 173 CO 1.05 0.00 -0.45 -0.25 -3.07 0.00 0.00 177.93 175.21 3d0s n ASP 174 N -2.37 -5.50 -4.71 3.10 8.00 -0.48 -4.98 116.55 109.60 3d0s n ASP 174 Ca 0.01 0.21 -0.30 0.00 0.71 0.00 0.00 54.79 55.43 3d0s n ASP 174 Cb 0.49 -4.70 -0.07 0.00 -0.02 0.00 0.00 41.12 36.82 3d0s n ASP 174 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3d0s s LEU 175 N -5.43 3.54 0.61 0.64 1.43 -1.26 -4.91 118.68 113.30 3d0s s LEU 175 Ca 0.00 -0.16 -0.08 0.00 -1.03 0.00 0.00 54.13 52.86 3d0s s LEU 175 Cb 0.00 -2.24 -0.00 0.00 0.03 0.00 0.00 46.19 43.97 3d0s s LEU 175 CO 0.00 0.16 0.96 0.28 0.23 0.00 0.00 176.35 177.98 3d0s s THR 176 N -1.39 3.91 0.23 5.49 -1.32 -1.26 -4.63 115.64 116.66 3d0s s THR 176 Ca 0.27 0.29 -0.07 0.00 -1.21 0.00 0.00 61.69 60.96 3d0s s THR 176 Cb -0.11 -3.57 0.23 0.00 -1.51 0.00 0.00 72.50 67.54 3d0s s THR 176 CO 0.19 -0.65 1.67 1.56 -2.21 0.00 0.00 174.62 175.18 3d0s h GLN 177 N -0.29 0.18 -0.54 7.08 4.20 -2.00 -1.02 115.11 122.73 3d0s h GLN 177 Ca -0.45 -0.01 -0.06 0.00 0.06 0.00 0.00 58.65 58.19 3d0s h GLN 177 Cb 1.24 -0.04 -0.02 0.00 0.30 0.00 0.00 27.48 28.96 3d0s h GLN 177 CO 0.62 0.12 0.11 0.93 -0.67 0.00 0.00 178.83 179.93 3d0s h GLU 178 N 0.18 0.89 -0.44 1.46 3.07 -1.98 -2.89 114.58 114.87 3d0s h GLU 178 Ca 0.39 -0.23 -0.10 0.00 -0.50 0.00 0.00 59.36 58.92 3d0s h GLU 178 Cb 0.66 -0.11 -0.02 0.00 -0.84 0.00 0.00 28.75 28.44 3d0s h GLU 178 CO -0.55 0.85 -0.12 0.93 -1.40 0.00 0.00 179.01 178.72 3d0s h GLU 179 N 0.78 0.80 -0.86 2.33 5.08 -1.77 -0.85 114.58 120.09 3d0s h GLU 179 Ca 0.17 -0.27 0.08 0.00 -1.00 0.00 0.00 59.36 58.34 3d0s h GLU 179 Cb 0.38 -0.06 -0.07 0.00 0.50 0.00 0.00 28.75 29.50 3d0s h GLU 179 CO 0.01 0.88 0.51 0.82 -1.00 0.00 0.00 179.01 180.24 3d0s h ILE 180 N 0.72 0.97 -0.09 3.13 2.04 -1.12 0.54 117.51 123.70 3d0s h ILE 180 Ca 0.12 -0.30 -0.20 0.00 1.00 0.00 0.00 64.86 65.47 3d0s h ILE 180 Cb 0.61 -0.00 0.00 0.00 -0.74 0.00 0.00 36.82 36.69 3d0s h ILE 180 CO 0.04 0.16 -0.78 0.00 0.00 0.00 0.00 178.15 177.57 3d0s h ALA 181 N 1.44 0.47 -0.60 1.87 0.00 -1.23 -0.66 119.26 120.56 3d0s h ALA 181 Ca 0.40 -0.62 -0.04 0.00 0.00 0.00 0.00 54.91 54.65 3d0s h ALA 181 Cb 0.30 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.02 3d0s h ALA 181 CO -0.22 0.74 0.21 1.96 0.00 0.00 0.00 179.25 181.94 3d0s h GLN 182 N 0.35 0.89 -0.31 0.00 4.20 -0.88 0.19 115.11 119.55 3d0s h GLN 182 Ca -0.05 -0.15 -0.07 0.00 0.06 0.00 0.00 58.65 58.44 3d0s h GLN 182 Cb 1.38 -0.15 -0.01 0.00 0.30 0.00 0.00 27.48 29.00 3d0s h GLN 182 CO 0.14 0.75 -0.06 1.25 -0.67 0.00 0.00 178.83 180.24 3d0s h LEU 183 N 0.87 0.60 -0.91 1.46 5.85 -0.65 -0.99 115.31 121.54 3d0s h LEU 183 Ca 0.20 -0.35 -0.07 0.00 0.84 0.00 0.00 57.88 58.50 3d0s h LEU 183 Cb 0.22 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.06 3d0s h LEU 183 CO -0.01 0.81 0.08 0.58 -0.34 0.00 0.00 178.44 179.55 3d0s h VAL 184 N 0.37 1.24 -0.68 1.05 2.07 -0.94 -3.44 116.25 115.91 3d0s h VAL 184 Ca 0.08 -0.94 0.00 0.00 0.82 0.00 0.00 66.70 66.66 3d0s h VAL 184 Cb 0.54 0.74 0.00 0.00 -1.52 0.00 0.00 31.29 31.05 3d0s h VAL 184 CO 0.03 0.34 0.00 0.61 0.02 0.00 0.00 177.57 178.57 3d0s n GLY 185 N -0.71 0.96 3.27 2.17 0.00 0.64 -4.97 105.19 106.54 3d0s n GLY 185 Ca 0.04 -0.52 -0.10 0.00 0.00 0.00 0.00 46.02 45.44 3d0s n GLY 185 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d0s s ALA 186 N -2.68 0.29 0.56 4.61 0.00 -1.01 -5.05 121.76 118.48 3d0s s ALA 186 Ca 0.00 -1.08 -0.21 0.00 0.00 0.00 0.00 51.96 50.67 3d0s s ALA 186 Cb 0.00 0.85 -0.04 0.00 0.00 0.00 0.00 23.12 23.93 3d0s s ALA 186 CO 0.00 -0.59 1.33 -1.13 0.00 0.00 0.00 175.76 175.37 3d0s n SER 187 N -0.17 2.52 -0.10 0.00 3.41 -1.26 -4.48 113.62 113.55 3d0s n SER 187 Ca -0.07 0.95 -0.07 0.00 -0.26 0.00 0.00 58.87 59.43 3d0s n SER 187 Cb 0.63 -1.57 0.01 0.00 -0.26 0.00 0.00 64.21 63.02 3d0s n SER 187 CO 0.00 0.00 0.00 0.03 -0.16 0.00 0.00 175.04 174.91 3d0s h ARG 188 N 1.28 0.26 -0.56 4.33 3.08 -1.95 -0.23 114.38 120.61 3d0s h ARG 188 Ca -0.51 -0.02 0.08 0.00 0.07 0.00 0.00 59.98 59.61 3d0s h ARG 188 Cb 1.31 -0.06 -0.07 0.00 0.08 0.00 0.00 29.97 31.24 3d0s h ARG 188 CO 0.56 0.17 0.20 1.49 -1.07 0.00 0.00 179.97 181.32 3d0s h GLU 189 N 0.27 0.36 0.05 0.04 4.81 -1.99 0.11 114.58 118.24 3d0s h GLU 189 Ca 0.15 -0.02 -0.23 0.00 -0.13 0.00 0.00 59.36 59.12 3d0s h GLU 189 Cb 0.11 -0.08 -0.00 0.00 0.63 0.00 0.00 28.75 29.41 3d0s h GLU 189 CO -0.15 0.24 -1.05 1.79 -0.73 0.00 0.00 179.01 179.11 3d0s h THR 190 N 0.37 1.50 -0.57 0.32 1.35 -1.83 -1.33 112.91 112.74 3d0s h THR 190 Ca 0.28 -2.86 -0.08 0.00 -0.55 0.00 0.00 66.41 63.20 3d0s h THR 190 Cb 0.32 2.69 -0.02 0.00 -1.73 0.00 0.00 68.15 69.42 3d0s h THR 190 CO -0.28 0.83 0.06 0.58 -0.25 0.00 0.00 175.52 176.46 3d0s h VAL 191 N 0.10 1.26 -0.54 6.82 2.07 -0.85 -1.97 116.25 123.14 3d0s h VAL 191 Ca -0.08 -1.03 -0.11 0.00 0.82 0.00 0.00 66.70 66.30 3d0s h VAL 191 Cb 1.73 0.82 -0.02 0.00 -1.52 0.00 0.00 31.29 32.30 3d0s h VAL 191 CO 0.17 0.37 -0.08 0.78 0.02 0.00 0.00 177.57 178.83 3d0s h ASN 192 N 0.85 1.00 -0.43 0.57 2.35 -0.72 -1.27 115.58 117.93 3d0s h ASN 192 Ca 0.17 -0.34 0.07 0.00 -0.55 0.00 0.00 56.30 55.65 3d0s h ASN 192 Cb 0.46 -0.27 -0.06 0.00 0.05 0.00 0.00 38.32 38.50 3d0s h ASN 192 CO 0.02 1.11 0.10 0.50 -1.65 0.00 0.00 177.43 177.50 3d0s h LYS 193 N 0.88 0.23 -0.01 0.81 3.64 -1.17 -0.31 116.57 120.64 3d0s h LYS 193 Ca 0.14 -0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 59.51 3d0s h LYS 193 Cb 0.64 -0.05 -0.00 0.00 -0.41 0.00 0.00 32.23 32.41 3d0s h LYS 193 CO 0.04 0.15 0.00 0.00 -2.27 0.00 0.00 179.45 177.38 3d0s h ALA 194 N 1.32 0.01 -0.83 5.00 0.00 -1.19 -2.30 119.26 121.27 3d0s h ALA 194 Ca 0.21 -0.06 0.10 0.00 0.00 0.00 0.00 54.91 55.16 3d0s h ALA 194 Cb 0.26 -0.00 -0.08 0.00 0.00 0.00 0.00 17.79 17.97 3d0s h ALA 194 CO -0.27 -0.43 0.47 -0.07 0.00 0.00 0.00 179.25 178.95 3d0s h LEU 195 N -0.10 0.66 -0.47 0.00 3.38 -1.07 -1.50 115.31 116.20 3d0s h LEU 195 Ca 0.00 0.05 -0.02 0.00 0.09 0.00 0.00 57.88 58.01 3d0s h LEU 195 Cb 0.11 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 40.77 3d0s h LEU 195 CO -0.00 0.37 0.22 0.00 0.09 0.00 0.00 178.44 179.12 3d0s h ALA 196 N 1.47 0.60 -0.36 1.53 0.00 -0.99 -0.85 119.26 120.66 3d0s h ALA 196 Ca 0.40 -0.12 0.03 0.00 0.00 0.00 0.00 54.91 55.23 3d0s h ALA 196 Cb 0.39 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.97 3d0s h ALA 196 CO -0.26 0.17 0.17 -0.44 0.00 0.00 0.00 179.25 178.89 3d0s h ASP 197 N 0.61 0.24 -0.72 0.00 3.45 -1.04 0.18 116.42 119.15 3d0s h ASP 197 Ca 0.16 0.02 -0.04 0.00 0.43 0.00 0.00 57.03 57.60 3d0s h ASP 197 Cb 0.12 -0.02 -0.03 0.00 -0.56 0.00 0.00 39.33 38.83 3d0s h ASP 197 CO -0.02 0.18 0.28 -0.26 -1.57 0.00 0.00 179.24 177.86 3d0s h PHE 198 N 0.35 1.11 -0.67 4.55 0.05 -1.12 -0.56 116.94 120.65 3d0s h PHE 198 Ca 0.15 -0.08 -0.06 0.00 3.82 0.00 0.00 57.97 61.80 3d0s h PHE 198 Cb 0.07 -0.33 -0.03 0.00 2.00 0.00 0.00 35.95 37.66 3d0s h PHE 198 CO -0.11 0.85 0.19 0.00 -0.18 0.00 0.00 178.31 179.06 3d0s h ALA 199 N 1.24 0.88 -0.23 2.45 0.00 -1.00 0.17 119.26 122.76 3d0s h ALA 199 Ca 0.25 -0.23 -0.04 0.00 0.00 0.00 0.00 54.91 54.89 3d0s h ALA 199 Cb 0.22 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 3d0s h ALA 199 CO -0.02 0.58 -0.02 1.25 0.00 0.00 0.00 179.25 181.05 3d0s h HIS 200 N 0.99 0.47 0.00 0.00 -0.00 -0.26 -2.09 115.15 114.26 3d0s h HIS 200 Ca 0.21 -0.09 0.00 0.00 -0.00 0.00 0.00 60.37 60.50 3d0s h HIS 200 Cb 0.33 -0.12 0.00 0.00 -0.00 0.00 0.00 27.41 27.62 3d0s h HIS 200 CO 0.03 0.61 0.00 0.54 -0.00 0.00 0.00 177.93 179.11 3d0s n ARG 201 N -4.63 0.07 -1.30 5.26 1.74 -0.25 -4.86 116.66 112.69 3d0s n ARG 201 Ca -0.04 0.49 -0.01 0.00 -0.77 0.00 0.00 57.85 57.52 3d0s n ARG 201 Cb 0.25 -1.69 -0.00 0.00 -1.02 0.00 0.00 32.46 30.00 3d0s n ARG 201 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3d0s n GLY 202 N -1.00 0.43 0.07 -0.13 0.00 -0.78 -4.94 105.19 98.84 3d0s n GLY 202 Ca 0.00 -0.99 -0.09 0.00 0.00 0.00 0.00 46.02 44.95 3d0s n GLY 202 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 173.32 174.81 3d0s h TRP 203 N 0.00 0.08 -3.94 1.61 6.55 -1.19 -3.43 115.95 115.62 3d0s h TRP 203 Ca -0.02 -0.06 -0.11 0.00 0.95 0.00 0.00 58.89 59.65 3d0s h TRP 203 Cb 0.33 -0.00 -0.16 0.00 -0.86 0.00 0.00 29.16 28.46 3d0s h TRP 203 CO 0.03 1.06 -0.53 0.96 -1.05 0.00 0.00 178.44 178.91 3d0s s ILE 204 N -2.66 0.16 -0.06 1.49 -4.36 -1.16 -0.52 121.20 114.09 3d0s s ILE 204 Ca -0.02 -1.34 0.02 0.00 -0.26 0.00 0.00 60.65 59.05 3d0s s ILE 204 Cb 0.09 -1.20 0.01 0.00 1.25 0.00 0.00 42.46 42.61 3d0s s ILE 204 CO 0.83 -0.74 -0.10 -0.60 0.24 0.00 0.00 174.94 174.57 3d0s s ARG 205 N -3.35 1.46 -0.19 0.37 3.52 -0.12 -4.01 118.95 116.63 3d0s s ARG 205 Ca 0.01 -0.34 -0.17 0.00 -0.13 0.00 0.00 55.73 55.11 3d0s s ARG 205 Cb 0.03 -1.24 -0.04 0.00 -1.56 0.00 0.00 34.95 32.14 3d0s s ARG 205 CO -0.08 0.01 0.44 -0.51 -0.81 0.00 0.00 175.30 174.35 3d0s s LEU 206 N 0.69 4.16 -0.36 -0.88 1.43 -1.26 -0.78 118.68 121.68 3d0s s LEU 206 Ca -0.13 0.59 0.01 0.00 -1.03 0.00 0.00 54.13 53.56 3d0s s LEU 206 Cb -0.15 -2.59 0.14 0.00 0.03 0.00 0.00 46.19 43.62 3d0s s LEU 206 CO 0.03 -0.10 0.23 -1.61 0.23 0.00 0.00 176.35 175.12 3d0s s GLU 207 N 1.35 0.61 6.80 1.70 2.02 0.22 -5.00 118.70 126.40 3d0s s GLU 207 Ca 0.21 -1.44 0.00 0.00 0.02 0.00 0.00 54.97 53.76 3d0s s GLU 207 Cb -0.15 -1.34 0.00 0.00 0.10 0.00 0.00 34.13 32.74 3d0s s GLU 207 CO 0.09 -1.23 0.00 0.41 0.02 0.00 0.00 175.26 174.54 3d0s n GLY 208 N 3.88 1.58 2.29 -1.39 0.00 -1.26 -2.28 105.19 108.00 3d0s n GLY 208 Ca 0.14 -0.47 -0.32 0.00 0.00 0.00 0.00 46.02 45.37 3d0s n GLY 208 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3d0s n LYS 209 N 12.72 2.60 -3.94 1.61 5.02 -1.26 -4.90 118.16 130.00 3d0s n LYS 209 Ca 0.00 -3.24 -0.10 0.00 -2.02 0.00 0.00 58.31 52.95 3d0s n LYS 209 Cb 0.00 -2.26 -0.10 0.00 -0.02 0.00 0.00 35.03 32.65 3d0s n LYS 209 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 3d0s s SER 210 N -1.75 0.17 0.00 4.39 1.04 -0.97 -1.39 113.70 115.20 3d0s s SER 210 Ca 0.63 -0.45 0.07 0.00 0.48 0.00 0.00 55.95 56.67 3d0s s SER 210 Cb 0.50 0.18 -0.02 0.00 0.10 0.00 0.00 66.02 66.78 3d0s s SER 210 CO 0.02 -0.41 -0.22 0.54 0.98 0.00 0.00 173.24 174.15 3d0s s VAL 211 N -1.97 1.75 -0.29 5.02 0.11 -0.19 -0.61 120.40 124.23 3d0s s VAL 211 Ca -0.11 -1.03 -0.09 0.00 -2.93 0.00 0.00 61.98 57.82 3d0s s VAL 211 Cb -0.05 -1.47 -0.02 0.00 -1.53 0.00 0.00 36.38 33.31 3d0s s VAL 211 CO -0.02 0.41 0.14 -0.22 -3.33 0.00 0.00 175.10 172.09 3d0s s LEU 212 N -0.73 3.95 -0.42 2.54 2.96 0.04 -0.40 118.68 126.62 3d0s s LEU 212 Ca 0.09 -0.37 -0.17 0.00 -0.22 0.00 0.00 54.13 53.46 3d0s s LEU 212 Cb -0.09 -2.00 0.02 0.00 0.50 0.00 0.00 46.19 44.62 3d0s s LEU 212 CO 0.00 -0.14 0.40 -0.63 -1.32 0.00 0.00 176.35 174.67 3d0s s ILE 213 N 1.64 5.13 -0.28 6.68 1.01 0.35 -0.94 121.20 134.79 3d0s s ILE 213 Ca 0.05 -0.44 0.23 0.00 0.00 0.00 0.00 60.65 60.49 3d0s s ILE 213 Cb -0.16 -4.01 -0.11 0.00 0.01 0.00 0.00 42.46 38.18 3d0s s ILE 213 CO 0.06 -0.40 0.91 -1.20 0.00 0.00 0.00 174.94 174.31 3d0s n SER 214 N 5.49 0.58 -3.25 3.58 7.64 0.32 -1.41 113.62 126.57 3d0s n SER 214 Ca -0.08 0.13 -0.25 0.00 1.01 0.00 0.00 58.87 59.67 3d0s n SER 214 Cb 0.47 0.90 -0.08 0.00 -1.01 0.00 0.00 64.21 64.49 3d0s n SER 214 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 3d0s n ASP 215 N -2.40 -0.09 0.17 6.43 -0.08 -0.96 -4.86 116.55 114.76 3d0s n ASP 215 Ca -0.01 -2.59 0.14 0.00 -1.51 0.00 0.00 54.79 50.83 3d0s n ASP 215 Cb 0.53 -0.58 0.72 0.00 2.34 0.00 0.00 41.12 44.12 3d0s n ASP 215 CO 0.00 0.00 0.00 0.28 0.12 0.00 0.00 177.20 177.60 3d0s h SER 216 N 4.54 0.00 0.52 1.67 0.02 -1.84 -2.45 113.55 116.00 3d0s h SER 216 Ca 0.13 0.00 -0.03 0.00 -0.84 0.00 0.00 61.79 61.06 3d0s h SER 216 Cb 0.89 0.00 0.01 0.00 0.14 0.00 0.00 62.40 63.44 3d0s h SER 216 CO 0.43 0.00 -0.25 -0.08 -1.14 0.00 0.00 176.83 175.79 3d0s h GLU 217 N 0.00 -0.67 0.00 3.45 4.81 -1.98 -1.67 114.58 118.52 3d0s h GLU 217 Ca 0.09 0.05 -0.11 0.00 -0.13 0.00 0.00 59.36 59.26 3d0s h GLU 217 Cb 0.41 0.15 -0.02 0.00 0.63 0.00 0.00 28.75 29.92 3d0s h GLU 217 CO -0.00 -0.39 -0.52 0.00 -0.73 0.00 0.00 179.01 177.36 3d0s h ARG 218 N -0.84 0.00 -0.72 1.92 3.08 -1.97 -2.57 114.38 113.29 3d0s h ARG 218 Ca -0.07 0.00 -0.07 0.00 0.07 0.00 0.00 59.98 59.91 3d0s h ARG 218 Cb 0.59 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.61 3d0s h ARG 218 CO 0.12 0.52 0.19 1.25 -1.07 0.00 0.00 179.97 180.98 3d0s h LEU 219 N 0.00 1.07 -0.46 3.04 5.85 -1.42 -2.63 115.31 120.76 3d0s h LEU 219 Ca -0.01 -0.22 -0.16 0.00 0.84 0.00 0.00 57.88 58.34 3d0s h LEU 219 Cb 1.07 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 41.82 3d0s h LEU 219 CO 0.07 1.01 -0.41 0.00 -0.34 0.00 0.00 178.44 178.77 3d0s h ALA 220 N 1.12 0.64 -0.66 1.25 0.00 -1.16 -2.35 119.26 118.09 3d0s h ALA 220 Ca 0.23 -0.46 -0.02 0.00 0.00 0.00 0.00 54.91 54.65 3d0s h ALA 220 Cb 0.35 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.00 3d0s h ALA 220 CO -0.00 0.67 0.31 -0.09 0.00 0.00 0.00 179.25 180.14 3d0s h ARG 221 N 0.67 0.93 -0.02 0.00 2.43 -1.39 -2.20 114.38 114.81 3d0s h ARG 221 Ca 0.05 -0.13 -0.12 0.00 -0.81 0.00 0.00 59.98 58.97 3d0s h ARG 221 Cb 0.99 -0.17 -0.02 0.00 -0.42 0.00 0.00 29.97 30.35 3d0s h ARG 221 CO 0.09 0.73 -0.57 -0.09 -1.51 0.00 0.00 179.97 178.62 3d0s h ARG 222 N 0.93 0.06 0.00 0.20 9.65 -1.23 -2.99 114.38 121.00 3d0s h ARG 222 Ca 0.23 -0.04 0.00 0.00 -1.10 0.00 0.00 59.98 59.07 3d0s h ARG 222 Cb 0.11 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.69 3d0s h ARG 222 CO -0.03 0.61 0.00 0.00 2.80 0.00 0.00 179.97 183.35 3d0s n ALA 223 N -2.44 1.96 0.32 2.80 0.00 -0.85 -4.29 120.51 118.01 3d0s n ALA 223 Ca -0.01 -0.02 0.03 0.00 0.00 0.00 0.00 53.44 53.43 3d0s n ALA 223 Cb 0.58 -1.39 0.15 0.00 0.00 0.00 0.00 19.45 18.80 3d0s n ALA 223 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04