#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dog n MET 1 N 0.00 2.84 -0.32 1.43 2.81 -1.26 -4.57 117.12 118.05 3dog n MET 1 Ca 0.00 -2.29 0.13 0.00 -1.81 0.00 0.00 57.70 53.73 3dog n MET 1 Cb 0.00 -1.39 0.36 0.00 -0.71 0.00 0.00 33.22 31.48 3dog n MET 1 CO 0.00 0.00 0.00 1.49 1.51 0.00 0.00 175.97 178.97 3dog h GLU 2 N 2.85 0.70 -0.01 0.03 4.81 -2.06 -2.20 114.58 118.71 3dog h GLU 2 Ca 0.00 -0.04 -0.11 0.00 -0.13 0.00 0.00 59.36 59.07 3dog h GLU 2 Cb 0.84 -0.16 -0.02 0.00 0.63 0.00 0.00 28.75 30.05 3dog h GLU 2 CO 0.01 0.46 -0.53 -0.91 -0.73 0.00 0.00 179.01 177.31 3dog h ASN 3 N 0.72 0.03 -3.37 1.04 2.35 -1.96 -3.45 115.58 110.94 3dog h ASN 3 Ca 0.52 -0.02 -0.55 0.00 -0.55 0.00 0.00 56.30 55.70 3dog h ASN 3 Cb 0.85 -0.01 -0.04 0.00 0.05 0.00 0.00 38.32 39.18 3dog h ASN 3 CO -0.29 0.56 -0.01 -0.36 -1.65 0.00 0.00 177.43 175.69 3dog s PHE 4 N -3.82 3.70 -0.19 1.19 0.08 -0.83 -0.94 117.98 117.17 3dog s PHE 4 Ca -0.02 1.25 0.01 0.00 0.12 0.00 0.00 56.93 58.28 3dog s PHE 4 Cb 0.13 -2.50 0.04 0.00 -0.57 0.00 0.00 43.02 40.12 3dog s PHE 4 CO 0.75 0.46 -0.11 -1.14 -0.10 0.00 0.00 175.22 175.08 3dog s GLN 5 N -1.63 2.14 0.30 0.44 2.00 -0.26 -4.94 119.66 117.71 3dog s GLN 5 Ca 0.36 -0.83 -0.29 0.00 -2.00 0.00 0.00 55.36 52.60 3dog s GLN 5 Cb -0.17 -2.40 -0.11 0.00 0.80 0.00 0.00 33.01 31.13 3dog s GLN 5 CO 0.20 -0.39 1.44 0.15 -0.50 0.00 0.00 175.29 176.19 3dog s LYS 6 N 1.39 4.23 -0.10 1.67 1.02 -1.26 -0.98 119.74 125.71 3dog s LYS 6 Ca -0.00 2.38 -0.06 0.00 0.02 0.00 0.00 55.97 58.30 3dog s LYS 6 Cb -0.16 -3.06 -0.05 0.00 -0.52 0.00 0.00 37.83 34.05 3dog s LYS 6 CO -0.09 -0.42 -0.15 0.28 -0.92 0.00 0.00 175.35 174.05 3dog n VAL 7 N 1.53 0.81 -3.63 3.17 0.31 0.25 -4.92 118.33 115.86 3dog n VAL 7 Ca 0.04 -0.06 -0.10 0.00 -0.01 0.00 0.00 64.34 64.21 3dog n VAL 7 Cb 0.40 -1.72 -0.03 0.00 -0.91 0.00 0.00 33.84 31.58 3dog n VAL 7 CO 0.00 0.00 0.00 -1.83 -1.32 0.00 0.00 176.83 173.68 3dog s GLU 8 N -2.26 1.31 -0.04 5.55 -1.05 -1.21 -5.02 118.70 115.98 3dog s GLU 8 Ca -0.16 -0.72 -0.25 0.00 -0.15 0.00 0.00 54.97 53.69 3dog s GLU 8 Cb 0.05 0.54 -0.04 0.00 -0.44 0.00 0.00 34.13 34.24 3dog s GLU 8 CO 0.20 -0.56 0.78 0.21 0.95 0.00 0.00 175.26 176.84 3dog s LYS 9 N -3.82 4.47 -0.11 -4.83 2.20 -1.26 -1.32 119.74 115.07 3dog s LYS 9 Ca 0.05 1.03 -0.01 0.00 -0.36 0.00 0.00 55.97 56.68 3dog s LYS 9 Cb -0.01 -3.45 -0.25 0.00 -1.51 0.00 0.00 37.83 32.62 3dog s LYS 9 CO -0.07 0.05 0.41 -0.89 -0.36 0.00 0.00 175.35 174.48 3dog n ILE 10 N 3.76 1.73 -0.88 5.43 5.41 0.65 -4.86 119.36 130.59 3dog n ILE 10 Ca 0.01 -0.69 0.00 0.00 1.00 0.00 0.00 62.75 63.07 3dog n ILE 10 Cb 0.51 -1.53 0.00 0.00 -0.71 0.00 0.00 39.64 37.91 3dog n ILE 10 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3dog n GLY 11 N 1.90 0.53 2.81 7.39 0.00 -1.09 -5.01 105.19 111.73 3dog n GLY 11 Ca -0.29 -1.61 -0.25 0.00 0.00 0.00 0.00 46.02 43.87 3dog n GLY 11 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3dog s GLU 12 N -2.00 0.95 0.00 1.61 2.02 -1.26 -0.93 118.70 119.10 3dog s GLU 12 Ca 0.00 -0.16 0.00 0.00 0.02 0.00 0.00 54.97 54.83 3dog s GLU 12 Cb 0.00 -1.47 0.00 0.00 0.10 0.00 0.00 34.13 32.76 3dog s GLU 12 CO 0.00 -0.37 0.00 0.41 0.02 0.00 0.00 175.26 175.32 3dog n GLY 13 N 5.04 0.47 0.24 -1.39 0.00 -1.26 -4.92 105.19 103.38 3dog n GLY 13 Ca -0.09 -1.62 0.04 0.00 0.00 0.00 0.00 46.02 44.35 3dog n GLY 13 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 3dog h THR 14 N 0.00 1.13 -3.85 2.61 1.35 -1.98 -3.43 112.91 108.74 3dog h THR 14 Ca 0.00 -0.57 -0.10 0.00 -0.55 0.00 0.00 66.41 65.19 3dog h THR 14 Cb 0.00 1.15 -0.15 0.00 -1.73 0.00 0.00 68.15 67.42 3dog h THR 14 CO 0.00 0.18 -0.45 -0.72 -0.25 0.00 0.00 175.52 174.28 3dog s TYR 15 N -4.82 0.21 0.03 4.73 -0.85 -1.26 -5.08 117.35 110.30 3dog s TYR 15 Ca -0.05 -0.61 0.00 0.00 -0.52 0.00 0.00 57.07 55.89 3dog s TYR 15 Cb 0.16 -0.13 0.00 0.00 0.38 0.00 0.00 41.96 42.37 3dog s TYR 15 CO 0.71 -0.47 0.00 0.41 -1.52 0.00 0.00 175.55 174.68 3dog n GLY 16 N 0.20 -1.71 3.06 5.49 0.00 -1.26 -4.93 105.19 106.04 3dog n GLY 16 Ca -0.16 -1.27 -0.23 0.00 0.00 0.00 0.00 46.02 44.36 3dog n GLY 16 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3dog s VAL 17 N -0.34 1.04 -0.13 1.61 1.01 -0.12 -4.03 120.40 119.45 3dog s VAL 17 Ca 0.00 -0.51 -0.03 0.00 0.00 0.00 0.00 61.98 61.44 3dog s VAL 17 Cb 0.00 -0.91 -0.03 0.00 0.00 0.00 0.00 36.38 35.44 3dog s VAL 17 CO 0.00 0.31 -0.01 -0.69 0.00 0.00 0.00 175.10 174.71 3dog s VAL 18 N 0.09 4.15 0.03 2.92 1.01 -0.10 0.57 120.40 129.08 3dog s VAL 18 Ca -0.03 -0.28 0.07 0.00 0.00 0.00 0.00 61.98 61.74 3dog s VAL 18 Cb -0.09 -2.79 -0.02 0.00 0.00 0.00 0.00 36.38 33.47 3dog s VAL 18 CO 0.01 0.53 -0.20 -0.31 0.00 0.00 0.00 175.10 175.14 3dog s TYR 19 N -0.15 1.72 0.15 5.22 1.51 -0.07 -0.25 117.35 125.48 3dog s TYR 19 Ca 0.04 -0.36 -0.30 0.00 -1.01 0.00 0.00 57.07 55.44 3dog s TYR 19 Cb -0.13 -1.04 -0.07 0.00 -0.11 0.00 0.00 41.96 40.62 3dog s TYR 19 CO 0.02 0.07 0.99 0.21 -1.11 0.00 0.00 175.55 175.73 3dog s LYS 20 N -1.06 4.70 0.10 -0.62 2.20 -0.43 -0.64 119.74 123.99 3dog s LYS 20 Ca 0.07 1.51 -0.11 0.00 -0.36 0.00 0.00 55.97 57.08 3dog s LYS 20 Cb -0.08 -3.34 0.01 0.00 -1.51 0.00 0.00 37.83 32.90 3dog s LYS 20 CO 0.01 0.23 0.26 0.00 -0.36 0.00 0.00 175.35 175.49 3dog s ALA 21 N -0.24 -0.43 -0.04 3.13 0.00 -0.54 -0.58 121.76 123.06 3dog s ALA 21 Ca 0.46 -0.46 0.04 0.00 0.00 0.00 0.00 51.96 52.01 3dog s ALA 21 Cb -0.25 0.56 -0.00 0.00 0.00 0.00 0.00 23.12 23.42 3dog s ALA 21 CO 0.31 -0.55 -0.18 -0.98 0.00 0.00 0.00 175.76 174.36 3dog s ARG 22 N -3.85 1.82 -0.30 0.00 1.70 -0.16 -0.76 118.95 117.40 3dog s ARG 22 Ca 0.05 -0.63 -0.29 0.00 -0.47 0.00 0.00 55.73 54.39 3dog s ARG 22 Cb 0.04 -1.58 -0.00 0.00 -0.57 0.00 0.00 34.95 32.83 3dog s ARG 22 CO -0.11 0.26 1.37 1.21 -1.08 0.00 0.00 175.30 176.94 3dog s ASN 23 N 0.01 6.58 0.53 -2.89 3.84 -0.02 -1.10 114.94 121.89 3dog s ASN 23 Ca -0.03 1.22 0.27 0.00 0.21 0.00 0.00 52.86 54.52 3dog s ASN 23 Cb -0.11 -2.54 1.51 0.00 -0.55 0.00 0.00 41.25 39.55 3dog s ASN 23 CO 0.02 -1.16 2.12 0.11 -2.79 0.00 0.00 177.10 175.40 3dog h LYS 24 N 9.72 0.00 0.11 0.43 1.57 -1.37 0.89 116.57 127.92 3dog h LYS 24 Ca -0.27 0.00 -0.30 0.00 -1.87 0.00 0.00 60.65 58.20 3dog h LYS 24 Cb 1.11 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.41 3dog h LYS 24 CO 1.04 0.09 -1.57 -0.07 -0.57 0.00 0.00 179.45 178.36 3dog h LEU 25 N 0.00 0.37 0.00 2.94 3.38 -1.90 -3.40 115.31 116.71 3dog h LEU 25 Ca -0.00 -0.85 -0.08 0.00 0.09 0.00 0.00 57.88 57.04 3dog h LEU 25 Cb 0.24 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 3dog h LEU 25 CO 0.01 1.68 -1.82 0.35 0.09 0.00 0.00 178.44 178.75 3dog n THR 26 N -3.84 0.46 -0.31 0.22 -2.24 -1.20 -4.98 114.28 102.39 3dog n THR 26 Ca -0.27 -0.59 0.00 0.00 -2.27 0.00 0.00 64.05 60.92 3dog n THR 26 Cb 0.93 -0.21 0.00 0.00 -2.10 0.00 0.00 70.33 68.95 3dog n THR 26 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3dog n GLY 27 N 1.34 1.36 3.74 3.38 0.00 0.30 -5.03 105.19 110.28 3dog n GLY 27 Ca -0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.52 3dog n GLY 27 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3dog s GLU 28 N -0.37 4.29 -0.19 1.61 2.12 -1.25 -4.69 118.70 120.23 3dog s GLU 28 Ca 0.00 2.23 -0.19 0.00 0.36 0.00 0.00 54.97 57.37 3dog s GLU 28 Cb 0.00 -3.15 -0.03 0.00 0.26 0.00 0.00 34.13 31.21 3dog s GLU 28 CO 0.00 -0.41 0.54 0.08 -0.54 0.00 0.00 175.26 174.93 3dog s VAL 29 N 0.29 5.10 0.38 3.70 1.01 -1.26 -0.84 120.40 128.79 3dog s VAL 29 Ca 0.61 1.01 0.05 0.00 0.00 0.00 0.00 61.98 63.65 3dog s VAL 29 Cb -0.40 -3.86 -0.06 0.00 0.00 0.00 0.00 36.38 32.05 3dog s VAL 29 CO 0.39 0.19 0.04 0.68 0.00 0.00 0.00 175.10 176.40 3dog s VAL 30 N 1.54 1.45 -0.12 2.92 -7.23 0.06 -3.60 120.40 115.42 3dog s VAL 30 Ca 0.26 -2.00 0.03 0.00 -1.81 0.00 0.00 61.98 58.45 3dog s VAL 30 Cb -0.16 -2.77 0.00 0.00 0.56 0.00 0.00 36.38 34.01 3dog s VAL 30 CO 0.10 0.00 -0.22 0.00 -0.31 0.00 0.00 175.10 174.68 3dog s ALA 31 N -3.02 2.27 -0.26 1.32 0.00 -0.54 -1.46 121.76 120.06 3dog s ALA 31 Ca 0.32 -1.02 -0.09 0.00 0.00 0.00 0.00 51.96 51.17 3dog s ALA 31 Cb 0.08 -0.95 -0.04 0.00 0.00 0.00 0.00 23.12 22.21 3dog s ALA 31 CO 0.15 0.13 0.13 -0.51 0.00 0.00 0.00 175.76 175.66 3dog s LEU 32 N 0.57 3.74 -0.48 0.00 1.43 0.18 -0.40 118.68 123.73 3dog s LEU 32 Ca -0.12 -0.10 -0.21 0.00 -1.03 0.00 0.00 54.13 52.67 3dog s LEU 32 Cb -0.17 -2.02 0.04 0.00 0.03 0.00 0.00 46.19 44.07 3dog s LEU 32 CO 0.04 -0.04 0.69 -0.75 0.23 0.00 0.00 176.35 176.52 3dog s LYS 33 N 1.67 3.23 -0.17 1.70 2.20 -0.08 -0.89 119.74 127.40 3dog s LYS 33 Ca 0.07 -0.54 -0.18 0.00 -0.36 0.00 0.00 55.97 54.95 3dog s LYS 33 Cb -0.15 -4.02 -0.04 0.00 -1.51 0.00 0.00 37.83 32.11 3dog s LYS 33 CO 0.07 -1.17 0.50 0.21 -0.36 0.00 0.00 175.35 174.60 3dog s LYS 34 N 2.95 4.25 -0.16 4.03 2.36 0.19 -0.84 119.74 132.53 3dog s LYS 34 Ca 0.21 0.42 0.00 0.00 -2.55 0.00 0.00 55.97 54.06 3dog s LYS 34 Cb -0.16 -3.51 0.03 0.00 -1.05 0.00 0.00 37.83 33.14 3dog s LYS 34 CO 0.16 -0.02 -0.13 0.42 1.55 0.00 0.00 175.35 177.34 3dog s ILE 35 N 1.21 1.56 0.14 5.43 1.01 0.13 -0.94 121.20 129.73 3dog s ILE 35 Ca 0.25 -0.72 -0.23 0.00 0.00 0.00 0.00 60.65 59.95 3dog s ILE 35 Cb -0.15 -1.52 -0.08 0.00 0.01 0.00 0.00 42.46 40.72 3dog s ILE 35 CO 0.10 0.37 0.70 -0.60 0.00 0.00 0.00 174.94 175.50 3dog s ARG 36 N 1.48 4.41 -0.07 2.79 3.52 -1.26 0.27 118.95 130.09 3dog s ARG 36 Ca 0.03 0.99 0.03 0.00 -0.13 0.00 0.00 55.73 56.65 3dog s ARG 36 Cb -0.14 -3.22 0.01 0.00 -1.56 0.00 0.00 34.95 30.05 3dog s ARG 36 CO -0.10 0.58 -0.15 -0.51 -0.81 0.00 0.00 175.30 174.32 3dog s LEU 37 N -1.22 1.74 0.00 -0.88 1.43 0.08 -4.93 118.68 114.91 3dog s LEU 37 Ca 0.34 -0.34 0.00 0.00 -1.03 0.00 0.00 54.13 53.10 3dog s LEU 37 Cb -0.21 -0.93 0.00 0.00 0.03 0.00 0.00 46.19 45.08 3dog s LEU 37 CO 0.23 0.06 0.00 -0.67 0.23 0.00 0.00 176.35 176.21 3dog n ASP 38 N 3.70 -0.14 0.02 2.29 -0.08 -1.26 -4.58 116.55 116.50 3dog n ASP 38 Ca -0.22 0.00 0.13 0.00 -1.51 0.00 0.00 54.79 53.19 3dog n ASP 38 Cb 0.52 -0.04 0.35 0.00 2.34 0.00 0.00 41.12 44.29 3dog n ASP 38 CO 0.00 0.00 0.00 0.41 0.12 0.00 0.00 177.20 177.73 3dog n THR 39 N -1.61 0.11 -0.03 5.18 -1.04 -1.26 -1.30 114.28 114.32 3dog n THR 39 Ca 0.00 -0.07 0.02 0.00 -2.04 0.00 0.00 64.05 61.96 3dog n THR 39 Cb 0.02 -0.08 -0.10 0.00 -1.82 0.00 0.00 70.33 68.34 3dog n THR 39 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 3dog n GLU 40 N -1.67 1.03 0.00 -2.82 4.71 -1.26 -4.74 120.64 115.89 3dog n GLU 40 Ca 0.05 -0.08 0.00 0.00 -0.01 0.00 0.00 57.16 57.13 3dog n GLU 40 Cb 0.36 -1.32 0.00 0.00 -1.01 0.00 0.00 31.44 29.47 3dog n GLU 40 CO 0.00 0.00 0.00 0.25 0.09 0.00 0.00 177.13 177.47 3dog n THR 41 N -2.17 0.00 -0.37 2.62 -2.24 -1.26 -5.03 114.28 105.83 3dog n THR 41 Ca -0.10 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.68 3dog n THR 41 Cb 0.58 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.81 3dog n THR 41 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3dog n GLU 42 N 0.00 0.04 0.00 -0.78 -0.58 -0.89 -4.92 120.64 113.52 3dog n GLU 42 Ca 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.74 3dog n GLU 42 Cb 0.00 -0.00 0.00 0.00 -0.57 0.00 0.00 31.44 30.87 3dog n GLU 42 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3dog n GLY 43 N 0.00 -1.58 3.68 0.62 0.00 -0.42 -4.82 105.19 102.68 3dog n GLY 43 Ca 0.00 -1.79 -0.42 0.00 0.00 0.00 0.00 46.02 43.80 3dog n GLY 43 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3dog s VAL 44 N 0.00 4.42 0.38 1.61 1.01 -1.26 -4.79 120.40 121.77 3dog s VAL 44 Ca 0.00 1.73 -0.28 0.00 0.00 0.00 0.00 61.98 63.43 3dog s VAL 44 Cb 0.00 -4.11 -0.10 0.00 0.00 0.00 0.00 36.38 32.17 3dog s VAL 44 CO 0.00 -0.01 1.41 -2.16 0.00 0.00 0.00 175.10 174.34 3dog s PRO 45 N 2.26 4.10 0.58 2.72 0.04 -1.26 -4.87 135.00 138.57 3dog s PRO 45 Ca 0.53 2.42 0.29 0.00 0.04 0.00 0.00 61.00 64.28 3dog s PRO 45 Cb -0.22 -2.93 1.78 0.00 0.04 0.00 0.00 34.50 33.16 3dog s PRO 45 CO 0.20 -0.48 2.24 0.66 0.04 0.00 0.00 177.00 179.66 3dog h SER 46 N 2.97 0.00 -0.66 6.66 4.64 -1.96 -0.87 113.55 124.33 3dog h SER 46 Ca -0.50 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 60.77 3dog h SER 46 Cb 1.24 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.30 3dog h SER 46 CO 0.64 0.01 0.22 0.71 -0.87 0.00 0.00 176.83 177.54 3dog h THR 47 N 0.00 1.25 0.10 2.95 1.35 -1.91 -1.14 112.91 115.50 3dog h THR 47 Ca -0.00 -0.83 -0.00 0.00 -0.55 0.00 0.00 66.41 65.02 3dog h THR 47 Cb 0.03 0.54 0.00 0.00 -1.73 0.00 0.00 68.15 66.98 3dog h THR 47 CO 0.00 0.32 -0.05 0.00 -0.25 0.00 0.00 175.52 175.55 3dog h ALA 48 N 1.09 -0.13 -0.65 6.62 0.00 -1.49 -1.41 119.26 123.29 3dog h ALA 48 Ca 0.22 -0.19 0.12 0.00 0.00 0.00 0.00 54.91 55.06 3dog h ALA 48 Cb 0.27 0.05 -0.09 0.00 0.00 0.00 0.00 17.79 18.02 3dog h ALA 48 CO -0.01 -0.39 0.20 0.82 0.00 0.00 0.00 179.25 179.87 3dog h ILE 49 N -0.50 0.66 0.03 0.00 2.04 -1.36 0.41 117.51 118.79 3dog h ILE 49 Ca -0.01 -0.12 -0.00 0.00 1.00 0.00 0.00 64.86 65.73 3dog h ILE 49 Cb 0.41 0.29 0.00 0.00 -0.74 0.00 0.00 36.82 36.79 3dog h ILE 49 CO 0.02 0.06 -0.01 0.03 0.00 0.00 0.00 178.15 178.25 3dog h ARG 50 N 0.34 -0.04 -0.39 2.37 3.08 -1.21 -1.18 114.38 117.35 3dog h ARG 50 Ca 0.35 0.00 0.04 0.00 0.07 0.00 0.00 59.98 60.44 3dog h ARG 50 Cb 0.51 0.01 -0.04 0.00 0.08 0.00 0.00 29.97 30.53 3dog h ARG 50 CO -0.39 0.41 0.16 1.49 -1.07 0.00 0.00 179.97 180.57 3dog h GLU 51 N -0.50 0.33 0.06 0.04 4.81 -0.90 -0.87 114.58 117.57 3dog h GLU 51 Ca -0.00 -0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 59.20 3dog h GLU 51 Cb 0.46 -0.08 0.00 0.00 0.63 0.00 0.00 28.75 29.77 3dog h GLU 51 CO 0.01 0.22 -0.03 0.82 -0.73 0.00 0.00 179.01 179.30 3dog h ILE 52 N 0.34 1.13 -0.87 2.32 2.04 -0.98 0.17 117.51 121.66 3dog h ILE 52 Ca 0.17 -0.67 0.04 0.00 1.00 0.00 0.00 64.86 65.40 3dog h ILE 52 Cb 0.11 1.57 -0.05 0.00 -0.74 0.00 0.00 36.82 37.71 3dog h ILE 52 CO -0.15 0.17 0.56 0.77 0.00 0.00 0.00 178.15 179.50 3dog h SER 53 N -0.38 0.92 0.01 1.72 4.64 -1.07 -2.10 113.55 117.29 3dog h SER 53 Ca -0.01 -0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 61.20 3dog h SER 53 Cb 0.34 -0.20 0.01 0.00 -0.31 0.00 0.00 62.40 62.24 3dog h SER 53 CO 0.01 0.63 -0.43 -0.07 -0.87 0.00 0.00 176.83 176.10 3dog h LEU 54 N 1.08 0.36 -1.52 5.97 3.38 -1.11 -3.24 115.31 120.22 3dog h LEU 54 Ca 0.35 -0.80 -0.04 0.00 0.09 0.00 0.00 57.88 57.49 3dog h LEU 54 Cb 0.04 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.67 3dog h LEU 54 CO -0.13 1.11 -0.18 0.25 0.09 0.00 0.00 178.44 179.58 3dog h LEU 55 N -0.36 0.00 -0.77 1.67 5.85 -0.89 -0.45 115.31 120.36 3dog h LEU 55 Ca -0.06 0.00 -0.09 0.00 0.84 0.00 0.00 57.88 58.57 3dog h LEU 55 Cb 1.19 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 42.20 3dog h LEU 55 CO 0.08 0.18 -0.02 0.11 -0.34 0.00 0.00 178.44 178.45 3dog h LYS 56 N 0.00 0.91 0.13 1.25 1.57 -1.46 -3.25 116.57 115.71 3dog h LYS 56 Ca -0.00 -0.27 -0.01 0.00 -1.87 0.00 0.00 60.65 58.50 3dog h LYS 56 Cb 0.54 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.77 3dog h LYS 56 CO 0.02 0.92 -0.06 0.93 -0.57 0.00 0.00 179.45 180.69 3dog h GLU 57 N 0.83 -0.16 -6.51 3.15 5.08 -1.24 -3.43 114.58 112.30 3dog h GLU 57 Ca 0.15 0.01 -0.56 0.00 -1.00 0.00 0.00 59.36 57.96 3dog h GLU 57 Cb 0.53 0.04 -0.06 0.00 0.50 0.00 0.00 28.75 29.76 3dog h GLU 57 CO 0.03 0.29 1.07 -0.51 -1.00 0.00 0.00 179.01 178.89 3dog s LEU 58 N -9.13 3.54 -0.32 1.33 1.43 -0.31 -4.97 118.68 110.25 3dog s LEU 58 Ca -0.14 0.66 0.02 0.00 -1.03 0.00 0.00 54.13 53.64 3dog s LEU 58 Cb 0.01 -3.41 0.09 0.00 0.03 0.00 0.00 46.19 42.91 3dog s LEU 58 CO 0.56 -1.50 0.04 0.21 0.23 0.00 0.00 176.35 175.89 3dog s ASN 59 N 4.01 4.48 -0.08 2.29 3.04 -1.26 -4.83 114.94 122.59 3dog s ASN 59 Ca 0.58 -1.89 -0.10 0.00 0.04 0.00 0.00 52.86 51.49 3dog s ASN 59 Cb -0.12 -1.39 0.02 0.00 -1.54 0.00 0.00 41.25 38.22 3dog s ASN 59 CO 0.31 -0.36 0.27 -2.28 -3.04 0.00 0.00 177.10 171.99 3dog s HIS 60 N 1.14 -0.26 0.60 0.43 2.46 -1.26 -5.05 115.29 113.35 3dog s HIS 60 Ca 0.08 0.60 0.28 0.00 0.47 0.00 0.00 55.06 56.50 3dog s HIS 60 Cb -0.19 0.09 1.39 0.00 -0.13 0.00 0.00 32.58 33.74 3dog s HIS 60 CO -0.12 -0.19 1.79 -1.00 -2.47 0.00 0.00 174.74 172.75 3dog h PRO 61 N 5.37 0.00 -0.35 2.88 0.13 -1.99 -2.13 132.00 135.91 3dog h PRO 61 Ca -0.27 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.86 3dog h PRO 61 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 3dog h PRO 61 CO 0.35 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.21 3dog n ASN 62 N -3.57 3.86 -4.17 1.44 5.03 -1.26 -4.84 115.26 111.75 3dog n ASN 62 Ca 0.10 -2.67 -0.30 0.00 0.87 0.00 0.00 54.58 52.58 3dog n ASN 62 Cb 0.80 -0.47 -0.17 0.00 -1.02 0.00 0.00 39.78 38.92 3dog n ASN 62 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 3dog s ILE 63 N -2.22 1.81 0.32 2.41 1.01 -0.80 -0.87 121.20 122.87 3dog s ILE 63 Ca 0.39 -0.87 -0.28 0.00 0.00 0.00 0.00 60.65 59.88 3dog s ILE 63 Cb 0.29 -1.58 -0.13 0.00 0.01 0.00 0.00 42.46 41.05 3dog s ILE 63 CO 0.13 0.50 1.20 0.55 0.00 0.00 0.00 174.94 177.32 3dog n VAL 64 N 3.59 1.97 -3.36 2.92 3.14 -0.38 -4.55 118.33 121.66 3dog n VAL 64 Ca -0.20 -0.49 -0.39 0.00 -2.96 0.00 0.00 64.34 60.30 3dog n VAL 64 Cb 0.53 -1.37 -0.08 0.00 -1.06 0.00 0.00 33.84 31.85 3dog n VAL 64 CO 0.00 0.00 0.00 -0.75 -6.46 0.00 0.00 176.83 169.62 3dog s LYS 65 N -1.73 4.08 -0.29 1.45 2.20 -1.26 -4.99 119.74 119.20 3dog s LYS 65 Ca 0.57 0.15 -0.25 0.00 -0.36 0.00 0.00 55.97 56.08 3dog s LYS 65 Cb -0.62 -3.62 0.00 0.00 -1.51 0.00 0.00 37.83 32.09 3dog s LYS 65 CO 0.61 -0.21 0.85 -1.17 -0.36 0.00 0.00 175.35 175.06 3dog s LEU 66 N 1.87 4.06 -0.17 5.43 2.96 -1.26 -1.73 118.68 129.83 3dog s LEU 66 Ca 0.17 0.84 -0.13 0.00 -0.22 0.00 0.00 54.13 54.80 3dog s LEU 66 Cb -0.15 -3.18 -0.22 0.00 0.50 0.00 0.00 46.19 43.13 3dog s LEU 66 CO 0.09 -0.62 0.23 0.18 -1.32 0.00 0.00 176.35 174.90 3dog n LEU 67 N 6.24 2.28 -3.66 -0.68 4.77 0.19 -4.97 117.00 121.17 3dog n LEU 67 Ca 0.06 0.29 -0.13 0.00 -0.03 0.00 0.00 56.01 56.20 3dog n LEU 67 Cb 0.48 -1.03 -0.06 0.00 -2.33 0.00 0.00 43.42 40.48 3dog n LEU 67 CO 0.51 0.59 0.16 -0.62 -1.33 0.00 0.00 177.39 176.70 3dog s ASP 68 N -6.97 -0.28 -0.19 -1.43 2.15 -0.98 -4.99 116.67 103.97 3dog s ASP 68 Ca -0.27 -0.02 0.01 0.00 0.43 0.00 0.00 52.55 52.70 3dog s ASP 68 Cb 0.07 0.43 0.03 0.00 -0.30 0.00 0.00 42.92 43.15 3dog s ASP 68 CO 0.67 -0.68 -0.14 -0.69 -0.17 0.00 0.00 175.17 174.15 3dog s VAL 69 N -2.60 1.86 -0.23 1.11 1.01 -1.26 -0.22 120.40 120.08 3dog s VAL 69 Ca -0.05 -1.02 -0.04 0.00 0.00 0.00 0.00 61.98 60.87 3dog s VAL 69 Cb -0.01 -1.82 -0.01 0.00 0.00 0.00 0.00 36.38 34.55 3dog s VAL 69 CO -0.03 0.32 -0.03 -0.63 0.00 0.00 0.00 175.10 174.72 3dog s ILE 70 N 1.33 3.39 0.24 2.22 1.01 -0.03 -5.00 121.20 124.36 3dog s ILE 70 Ca 0.01 -0.54 -0.10 0.00 0.00 0.00 0.00 60.65 60.03 3dog s ILE 70 Cb -0.15 -2.57 -0.07 0.00 0.01 0.00 0.00 42.46 39.68 3dog s ILE 70 CO -0.10 0.38 0.57 -1.00 0.00 0.00 0.00 174.94 174.79 3dog s HIS 71 N 1.47 3.43 0.22 3.97 3.76 -1.26 -1.20 115.29 125.67 3dog s HIS 71 Ca 0.05 0.88 0.05 0.00 -0.15 0.00 0.00 55.06 55.89 3dog s HIS 71 Cb -0.15 -2.27 -0.02 0.00 1.11 0.00 0.00 32.58 31.26 3dog s HIS 71 CO -0.03 0.24 0.18 0.25 -0.85 0.00 0.00 174.74 174.53 3dog n THR 72 N -0.25 0.00 0.13 1.30 -2.24 -0.31 -4.98 114.28 107.94 3dog n THR 72 Ca 0.01 -1.58 -0.01 0.00 -2.27 0.00 0.00 64.05 60.19 3dog n THR 72 Cb 0.53 0.78 0.21 0.00 -2.10 0.00 0.00 70.33 69.74 3dog n THR 72 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 3dog h GLU 73 N 0.00 0.07 0.00 -0.78 5.08 -1.99 -3.38 114.58 113.59 3dog h GLU 73 Ca -0.15 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.16 3dog h GLU 73 Cb 0.78 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.03 3dog h GLU 73 CO 0.23 0.60 -1.06 0.09 -1.00 0.00 0.00 179.01 177.86 3dog n ASN 74 N -3.90 4.66 -4.20 1.42 4.13 -1.26 -4.93 115.26 111.17 3dog n ASN 74 Ca -0.02 -0.00 -0.26 0.00 1.68 0.00 0.00 54.58 55.98 3dog n ASN 74 Cb 0.56 1.07 -0.15 0.00 -1.54 0.00 0.00 39.78 39.71 3dog n ASN 74 CO 0.00 0.00 0.00 -0.75 0.28 0.00 0.00 177.26 176.79 3dog s LYS 75 N -2.10 1.52 -0.16 3.52 2.47 -1.26 -0.74 119.74 122.99 3dog s LYS 75 Ca -0.01 -0.72 0.02 0.00 -1.56 0.00 0.00 55.97 53.70 3dog s LYS 75 Cb 0.01 -1.49 0.01 0.00 -1.46 0.00 0.00 37.83 34.90 3dog s LYS 75 CO 0.06 0.41 -0.20 -1.17 0.16 0.00 0.00 175.35 174.60 3dog s LEU 76 N -0.55 2.15 -0.28 5.43 2.96 0.14 -1.16 118.68 127.37 3dog s LEU 76 Ca 0.07 -0.62 -0.03 0.00 -0.22 0.00 0.00 54.13 53.33 3dog s LEU 76 Cb -0.08 -1.47 0.03 0.00 0.50 0.00 0.00 46.19 45.17 3dog s LEU 76 CO -0.00 0.04 -0.00 -0.31 -1.32 0.00 0.00 176.35 174.75 3dog s TYR 77 N 1.06 3.14 -0.10 5.38 2.02 -0.34 0.19 117.35 128.70 3dog s TYR 77 Ca -0.01 -1.48 -0.22 0.00 -0.37 0.00 0.00 57.07 54.98 3dog s TYR 77 Cb -0.14 -2.13 -0.03 0.00 -0.40 0.00 0.00 41.96 39.25 3dog s TYR 77 CO -0.07 -0.71 0.67 -0.51 -1.57 0.00 0.00 175.55 173.35 3dog s LEU 78 N 1.35 4.27 -0.30 -1.29 1.43 -0.02 -0.85 118.68 123.28 3dog s LEU 78 Ca -0.01 1.07 -0.12 0.00 -1.03 0.00 0.00 54.13 54.04 3dog s LEU 78 Cb -0.18 -3.00 -0.04 0.00 0.03 0.00 0.00 46.19 43.00 3dog s LEU 78 CO -0.02 -0.15 0.23 -0.69 0.23 0.00 0.00 176.35 175.95 3dog s VAL 79 N 1.07 5.29 0.24 -1.59 1.01 0.69 -0.91 120.40 126.21 3dog s VAL 79 Ca 0.34 0.11 0.10 0.00 0.00 0.00 0.00 61.98 62.53 3dog s VAL 79 Cb -0.17 -3.60 -0.04 0.00 0.00 0.00 0.00 36.38 32.56 3dog s VAL 79 CO 0.15 0.16 -0.07 -0.36 0.00 0.00 0.00 175.10 174.99 3dog s PHE 80 N 1.79 2.60 0.35 5.22 0.40 0.47 0.55 117.98 129.36 3dog s PHE 80 Ca 0.08 -0.24 -0.28 0.00 -0.60 0.00 0.00 56.93 55.89 3dog s PHE 80 Cb -0.16 -1.18 -0.10 0.00 0.51 0.00 0.00 43.02 42.08 3dog s PHE 80 CO 0.11 0.61 1.27 -1.83 0.70 0.00 0.00 175.22 176.08 3dog s GLU 81 N -3.39 4.28 0.08 0.44 -1.05 -0.71 -1.47 118.70 116.89 3dog s GLU 81 Ca 0.29 2.13 -0.26 0.00 -0.15 0.00 0.00 54.97 56.98 3dog s GLU 81 Cb -0.07 -2.99 -0.06 0.00 -0.44 0.00 0.00 34.13 30.58 3dog s GLU 81 CO 0.18 -0.22 0.81 0.12 0.95 0.00 0.00 175.26 177.09 3dog s PHE 82 N -1.19 3.78 0.08 4.83 5.36 -1.24 -4.41 117.98 125.19 3dog s PHE 82 Ca 0.51 1.57 0.10 0.00 -0.96 0.00 0.00 56.93 58.14 3dog s PHE 82 Cb -0.38 -2.86 -0.03 0.00 -0.34 0.00 0.00 43.02 39.41 3dog s PHE 82 CO 0.50 0.31 -0.26 -0.51 -1.46 0.00 0.00 175.22 173.80 3dog s LEU 83 N -0.26 2.24 0.17 6.12 1.02 -1.26 -4.99 118.68 121.71 3dog s LEU 83 Ca 0.40 -0.65 -0.03 0.00 0.02 0.00 0.00 54.13 53.87 3dog s LEU 83 Cb -0.22 -1.21 0.02 0.00 0.02 0.00 0.00 46.19 44.81 3dog s LEU 83 CO 0.25 0.21 1.41 0.45 0.02 0.00 0.00 176.35 178.68 3dog h HIS 84 N 4.39 0.59 -3.14 0.29 3.86 -1.87 -3.47 115.15 115.80 3dog h HIS 84 Ca -0.48 -0.27 -0.04 0.00 -1.16 0.00 0.00 60.37 58.42 3dog h HIS 84 Cb 1.16 -0.09 -0.01 0.00 1.06 0.00 0.00 27.41 29.53 3dog h HIS 84 CO 0.54 1.04 0.21 1.14 0.86 0.00 0.00 177.93 181.72 3dog s GLN 85 N -3.58 2.17 0.21 2.45 -2.07 -1.05 -5.05 119.66 112.73 3dog s GLN 85 Ca -0.06 -1.45 0.05 0.00 -1.82 0.00 0.00 55.36 52.09 3dog s GLN 85 Cb 0.10 0.60 -0.04 0.00 -1.09 0.00 0.00 33.01 32.59 3dog s GLN 85 CO 0.85 -1.00 0.22 0.16 -1.32 0.00 0.00 175.29 174.20 3dog s ASP 86 N -3.08 5.78 0.41 12.60 1.47 -1.26 0.24 116.67 132.83 3dog s ASP 86 Ca 0.17 -0.09 0.12 0.00 1.18 0.00 0.00 52.55 53.92 3dog s ASP 86 Cb -0.05 -1.57 0.94 0.00 -0.34 0.00 0.00 42.92 41.90 3dog s ASP 86 CO 0.12 0.00 1.95 0.25 0.68 0.00 0.00 175.17 178.17 3dog h LEU 87 N 1.81 0.48 -0.01 2.11 5.85 -0.45 -2.00 115.31 123.10 3dog h LEU 87 Ca -0.49 0.01 -0.00 0.00 0.84 0.00 0.00 57.88 58.24 3dog h LEU 87 Cb 1.22 -0.09 -0.00 0.00 0.37 0.00 0.00 40.66 42.16 3dog h LEU 87 CO 0.63 0.28 0.00 0.50 -0.34 0.00 0.00 178.44 179.51 3dog h LYS 88 N 0.53 0.01 -0.20 1.25 3.11 -1.80 0.83 116.57 120.29 3dog h LYS 88 Ca 0.32 -0.00 -0.07 0.00 -2.81 0.00 0.00 60.65 58.09 3dog h LYS 88 Cb 0.56 -0.00 -0.01 0.00 -1.00 0.00 0.00 32.23 31.77 3dog h LYS 88 CO -0.11 0.12 -0.18 0.87 -2.81 0.00 0.00 179.45 177.34 3dog h LYS 89 N -0.11 0.35 -0.41 1.90 1.57 -1.82 -1.26 116.57 116.78 3dog h LYS 89 Ca 0.00 -0.10 -0.08 0.00 -1.87 0.00 0.00 60.65 58.60 3dog h LYS 89 Cb 0.11 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.37 3dog h LYS 89 CO -0.00 0.53 -0.05 0.35 -0.57 0.00 0.00 179.45 179.71 3dog h PHE 90 N 0.32 0.84 -0.44 -1.35 3.57 -1.09 0.13 116.94 118.92 3dog h PHE 90 Ca 0.06 -0.17 -0.06 0.00 3.53 0.00 0.00 57.97 61.33 3dog h PHE 90 Cb 0.52 -0.21 -0.02 0.00 2.79 0.00 0.00 35.95 39.03 3dog h PHE 90 CO 0.01 0.86 0.05 0.52 -2.23 0.00 0.00 178.31 177.52 3dog h MET 91 N 0.58 0.74 -0.73 1.11 2.86 -0.64 -0.44 114.93 118.43 3dog h MET 91 Ca 0.11 -0.21 -0.05 0.00 -2.06 0.00 0.00 59.70 57.49 3dog h MET 91 Cb 0.56 -0.08 -0.03 0.00 0.06 0.00 0.00 31.60 32.11 3dog h MET 91 CO 0.03 0.79 0.25 -0.44 1.06 0.00 0.00 176.91 178.60 3dog h ASP 92 N 0.60 1.02 0.50 1.22 3.32 -1.16 -1.00 116.42 120.92 3dog h ASP 92 Ca 0.13 -0.17 -0.03 0.00 0.02 0.00 0.00 57.03 56.98 3dog h ASP 92 Cb 0.42 -0.27 -0.00 0.00 0.22 0.00 0.00 39.33 39.70 3dog h ASP 92 CO 0.01 0.93 -0.14 0.00 -1.72 0.00 0.00 179.24 178.33 3dog h ALA 93 N 1.21 1.20 -0.48 3.45 0.00 -0.50 -2.84 119.26 121.30 3dog h ALA 93 Ca 0.24 -0.12 -0.14 0.00 0.00 0.00 0.00 54.91 54.89 3dog h ALA 93 Cb 0.26 -0.02 -0.08 0.00 0.00 0.00 0.00 17.79 17.94 3dog h ALA 93 CO -0.01 0.17 0.10 0.43 0.00 0.00 0.00 179.25 179.93 3dog n SER 94 N -3.54 3.89 -0.30 0.00 7.64 -0.20 -4.67 113.62 116.44 3dog n SER 94 Ca -0.01 -3.30 -0.05 0.00 1.01 0.00 0.00 58.87 56.52 3dog n SER 94 Cb 0.28 -0.65 0.07 0.00 -1.01 0.00 0.00 64.21 62.90 3dog n SER 94 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3dog h ALA 95 N 1.90 1.05 0.08 -0.43 0.00 -1.06 -2.22 119.26 118.57 3dog h ALA 95 Ca 0.17 -0.16 -0.33 0.00 0.00 0.00 0.00 54.91 54.58 3dog h ALA 95 Cb 1.87 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 19.31 3dog h ALA 95 CO 0.48 0.62 -1.85 1.28 0.00 0.00 0.00 179.25 179.78 3dog n LEU 96 N -4.33 2.42 0.03 0.00 4.77 -1.26 -4.44 117.00 114.18 3dog n LEU 96 Ca 0.08 0.25 -0.08 0.00 -0.03 0.00 0.00 56.01 56.23 3dog n LEU 96 Cb 0.15 -1.06 0.08 0.00 -2.33 0.00 0.00 43.42 40.26 3dog n LEU 96 CO 0.40 0.69 0.50 0.71 -1.33 0.00 0.00 177.39 178.35 3dog h THR 97 N -0.27 1.33 0.00 -5.08 1.35 -1.87 -3.50 112.91 104.88 3dog h THR 97 Ca -0.42 -1.81 0.00 0.00 -0.55 0.00 0.00 66.41 63.63 3dog h THR 97 Cb 1.81 1.80 0.00 0.00 -1.73 0.00 0.00 68.15 70.03 3dog h THR 97 CO -0.02 0.55 0.00 0.61 -0.25 0.00 0.00 175.52 176.41 3dog n GLY 98 N 0.21 -0.20 3.58 5.82 0.00 -0.84 -4.95 105.19 108.82 3dog n GLY 98 Ca -0.03 -1.68 -0.35 0.00 0.00 0.00 0.00 46.02 43.96 3dog n GLY 98 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3dog s ILE 99 N -2.87 4.69 0.36 -0.61 1.01 -1.26 -4.90 121.20 117.61 3dog s ILE 99 Ca 0.00 -0.06 -0.28 0.00 0.00 0.00 0.00 60.65 60.31 3dog s ILE 99 Cb 0.00 -3.14 -0.12 0.00 0.01 0.00 0.00 42.46 39.22 3dog s ILE 99 CO 0.00 0.42 1.29 -2.65 0.00 0.00 0.00 174.94 174.00 3dog n PRO 100 N 3.96 2.11 -0.02 2.79 -0.02 -1.26 -4.81 135.00 137.75 3dog n PRO 100 Ca -0.16 0.74 -0.10 0.00 -2.02 0.00 0.00 63.50 61.96 3dog n PRO 100 Cb 0.52 -2.35 -0.04 0.00 -0.02 0.00 0.00 33.50 31.61 3dog n PRO 100 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 3dog h LEU 101 N 2.48 0.14 -2.11 2.45 7.12 -1.99 -1.92 115.31 121.47 3dog h LEU 101 Ca -0.47 -0.00 0.07 0.00 0.13 0.00 0.00 57.88 57.62 3dog h LEU 101 Cb 1.28 -0.03 -0.01 0.00 -0.53 0.00 0.00 40.66 41.37 3dog h LEU 101 CO 0.62 0.11 0.22 1.55 -0.13 0.00 0.00 178.44 180.80 3dog h PRO 102 N 0.18 0.00 -0.27 5.25 0.13 -1.99 0.14 132.00 135.43 3dog h PRO 102 Ca 0.05 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 65.09 3dog h PRO 102 Cb -0.01 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.12 3dog h PRO 102 CO -0.02 0.00 -0.20 1.25 -0.23 0.00 0.00 178.00 178.80 3dog h LEU 103 N 0.00 0.65 -0.18 1.56 5.85 -1.74 -2.19 115.31 119.26 3dog h LEU 103 Ca 0.12 -0.44 0.02 0.00 0.84 0.00 0.00 57.88 58.41 3dog h LEU 103 Cb 0.55 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 41.38 3dog h LEU 103 CO -0.00 0.96 0.06 0.40 -0.34 0.00 0.00 178.44 179.52 3dog h ILE 104 N 0.35 0.96 -0.27 4.05 2.04 -0.14 0.30 117.51 124.80 3dog h ILE 104 Ca 0.05 -0.05 0.06 0.00 1.00 0.00 0.00 64.86 65.92 3dog h ILE 104 Cb 0.74 0.79 -0.06 0.00 -0.74 0.00 0.00 36.82 37.56 3dog h ILE 104 CO 0.05 0.03 -0.11 0.50 0.00 0.00 0.00 178.15 178.62 3dog h LYS 105 N 0.15 -0.06 -0.08 2.37 3.64 -0.97 -0.24 116.57 121.38 3dog h LYS 105 Ca 0.08 0.00 0.03 0.00 -1.27 0.00 0.00 60.65 59.50 3dog h LYS 105 Cb 0.05 0.01 -0.04 0.00 -0.41 0.00 0.00 32.23 31.84 3dog h LYS 105 CO -0.08 -0.04 -0.14 1.03 -2.27 0.00 0.00 179.45 177.95 3dog h SER 106 N -0.06 -0.41 -0.59 4.20 0.87 -0.99 0.76 113.55 117.33 3dog h SER 106 Ca 0.14 0.07 -0.01 0.00 -1.23 0.00 0.00 61.79 60.77 3dog h SER 106 Cb 0.28 0.19 -0.03 0.00 -0.44 0.00 0.00 62.40 62.40 3dog h SER 106 CO -0.32 -0.18 0.34 1.88 -0.53 0.00 0.00 176.83 178.02 3dog h TYR 107 N -0.19 0.79 -0.25 2.24 0.05 -0.40 0.31 116.97 119.53 3dog h TYR 107 Ca 0.07 -0.01 -0.01 0.00 0.05 0.00 0.00 58.73 58.84 3dog h TYR 107 Cb 0.29 -0.26 -0.01 0.00 1.01 0.00 0.00 36.73 37.77 3dog h TYR 107 CO -0.23 0.56 0.13 1.25 -1.05 0.00 0.00 178.16 178.81 3dog h LEU 108 N 0.79 0.32 -0.54 3.88 5.85 -0.91 0.66 115.31 125.36 3dog h LEU 108 Ca 0.21 -0.10 0.10 0.00 0.84 0.00 0.00 57.88 58.92 3dog h LEU 108 Cb 0.01 -0.08 -0.08 0.00 0.37 0.00 0.00 40.66 40.88 3dog h LEU 108 CO -0.04 0.33 0.11 0.15 -0.34 0.00 0.00 178.44 178.65 3dog h PHE 109 N 0.28 0.17 -0.18 1.25 3.57 -0.28 0.26 116.94 122.01 3dog h PHE 109 Ca 0.09 0.03 -0.06 0.00 3.53 0.00 0.00 57.97 61.56 3dog h PHE 109 Cb 0.09 0.01 -0.00 0.00 2.79 0.00 0.00 35.95 38.83 3dog h PHE 109 CO -0.03 -0.02 -0.14 1.96 -2.23 0.00 0.00 178.31 177.86 3dog h GLN 110 N 0.24 0.41 -0.96 1.11 4.20 -0.75 -1.51 115.11 117.86 3dog h GLN 110 Ca 0.28 -0.20 0.06 0.00 0.06 0.00 0.00 58.65 58.85 3dog h GLN 110 Cb 0.39 -0.00 -0.06 0.00 0.30 0.00 0.00 27.48 28.10 3dog h GLN 110 CO -0.36 0.75 0.62 -0.07 -0.67 0.00 0.00 178.83 179.10 3dog h LEU 111 N 0.08 0.99 -0.49 1.46 3.38 -0.41 0.13 115.31 120.44 3dog h LEU 111 Ca 0.03 0.01 -0.14 0.00 0.09 0.00 0.00 57.88 57.87 3dog h LEU 111 Cb 0.65 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.19 3dog h LEU 111 CO 0.04 0.64 -0.29 -0.07 0.09 0.00 0.00 178.44 178.84 3dog h LEU 112 N 1.12 0.96 -0.27 1.67 3.38 -0.86 -0.12 115.31 121.20 3dog h LEU 112 Ca 0.41 -0.39 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 3dog h LEU 112 Cb 0.16 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 3dog h LEU 112 CO -0.16 1.18 0.13 1.56 0.09 0.00 0.00 178.44 181.24 3dog h GLN 113 N 0.78 0.38 -0.35 1.13 4.20 -0.12 0.37 115.11 121.49 3dog h GLN 113 Ca 0.09 -0.05 -0.01 0.00 0.06 0.00 0.00 58.65 58.73 3dog h GLN 113 Cb 0.86 -0.07 -0.02 0.00 0.30 0.00 0.00 27.48 28.56 3dog h GLN 113 CO 0.08 0.37 0.19 0.78 -0.67 0.00 0.00 178.83 179.57 3dog h GLY 114 N 0.30 0.53 1.35 3.46 0.00 -0.78 -2.15 103.07 105.78 3dog h GLY 114 Ca 0.09 -0.25 -0.11 0.00 0.00 0.00 0.00 47.33 47.06 3dog h GLY 114 CO -0.01 0.24 -0.23 -2.00 0.00 0.00 0.00 176.54 174.54 3dog h LEU 115 N 0.44 0.77 -0.84 3.11 5.85 -0.77 -1.52 115.31 122.35 3dog h LEU 115 Ca 0.12 -0.28 -0.04 0.00 0.84 0.00 0.00 57.88 58.53 3dog h LEU 115 Cb 0.08 -0.21 -0.04 0.00 0.37 0.00 0.00 40.66 40.86 3dog h LEU 115 CO -0.02 0.97 0.39 0.00 -0.34 0.00 0.00 178.44 179.44 3dog h ALA 116 N 1.08 1.08 -0.61 1.25 0.00 -0.22 0.89 119.26 122.74 3dog h ALA 116 Ca 0.09 -0.17 -0.05 0.00 0.00 0.00 0.00 54.91 54.78 3dog h ALA 116 Cb 0.74 -0.33 -0.03 0.00 0.00 0.00 0.00 17.79 18.17 3dog h ALA 116 CO 0.06 0.67 0.19 0.35 0.00 0.00 0.00 179.25 180.51 3dog h PHE 117 N 1.20 0.95 0.62 0.00 3.57 -1.10 0.40 116.94 122.60 3dog h PHE 117 Ca 0.29 -0.08 -0.03 0.00 3.53 0.00 0.00 57.97 61.67 3dog h PHE 117 Cb 0.14 -0.28 0.01 0.00 2.79 0.00 0.00 35.95 38.61 3dog h PHE 117 CO 0.02 0.77 -0.30 0.00 -2.23 0.00 0.00 178.31 176.56 3dog h HIS 119 N -0.89 0.59 0.00 0.00 3.86 -0.62 0.56 115.15 118.65 3dog h HIS 119 Ca -0.09 0.01 0.00 0.00 -1.16 0.00 0.00 60.37 59.14 3dog h HIS 119 Cb 0.66 -0.20 0.00 0.00 1.06 0.00 0.00 27.41 28.93 3dog h HIS 119 CO -0.02 0.37 0.00 0.77 0.86 0.00 0.00 177.93 179.91 3dog h SER 120 N 0.63 0.00 -0.44 2.45 0.02 -0.13 -2.92 113.55 113.17 3dog h SER 120 Ca 0.18 0.00 -0.32 0.00 -0.84 0.00 0.00 61.79 60.80 3dog h SER 120 Cb -0.06 0.00 -0.28 0.00 0.14 0.00 0.00 62.40 62.20 3dog h SER 120 CO -0.04 0.00 -0.75 1.41 -1.14 0.00 0.00 176.83 176.31 3dog n HIS 121 N -2.82 1.57 -4.22 3.45 8.25 0.14 -4.98 115.22 116.61 3dog n HIS 121 Ca -0.02 -1.88 -0.36 0.00 -0.26 0.00 0.00 57.72 55.19 3dog n HIS 121 Cb 0.09 -0.29 -0.03 0.00 1.12 0.00 0.00 29.99 30.89 3dog n HIS 121 CO 0.00 0.00 0.00 2.89 0.64 0.00 0.00 176.34 179.87 3dog n ARG 122 N -0.77 -3.15 -4.07 -0.41 -4.01 -1.10 -4.95 116.66 98.21 3dog n ARG 122 Ca 0.31 0.37 -0.32 0.00 -1.04 0.00 0.00 57.85 57.17 3dog n ARG 122 Cb 0.87 -5.08 -0.16 0.00 -3.04 0.00 0.00 32.46 25.05 3dog n ARG 122 CO 0.00 0.00 0.00 0.08 -3.04 0.00 0.00 177.63 174.67 3dog s VAL 123 N -3.30 1.88 0.10 8.89 1.01 -0.90 -0.61 120.40 127.48 3dog s VAL 123 Ca 0.73 -0.98 -0.24 0.00 0.00 0.00 0.00 61.98 61.49 3dog s VAL 123 Cb -0.40 -1.80 -0.07 0.00 0.00 0.00 0.00 36.38 34.11 3dog s VAL 123 CO 0.93 0.37 0.72 -0.76 0.00 0.00 0.00 175.10 176.37 3dog s LEU 124 N 1.33 4.53 -0.18 3.92 1.43 -0.24 -3.66 118.68 125.82 3dog s LEU 124 Ca 0.02 1.49 -0.25 0.00 -1.03 0.00 0.00 54.13 54.36 3dog s LEU 124 Cb -0.15 -3.18 -0.22 0.00 0.03 0.00 0.00 46.19 42.67 3dog s LEU 124 CO -0.10 0.16 0.48 -0.74 0.23 0.00 0.00 176.35 176.38 3dog h HIS 125 N 4.82 0.00 0.00 0.29 -0.00 -1.90 -1.97 115.15 116.39 3dog h HIS 125 Ca -0.47 -0.00 0.00 0.00 -0.00 0.00 0.00 60.37 59.90 3dog h HIS 125 Cb 1.21 -0.00 0.00 0.00 -0.00 0.00 0.00 27.41 28.62 3dog h HIS 125 CO 0.65 1.26 0.00 0.54 -0.00 0.00 0.00 177.93 180.38 3dog n ARG 126 N -4.52 -0.65 -2.72 5.26 1.74 -1.26 -3.08 116.66 111.43 3dog n ARG 126 Ca -0.22 0.16 -0.05 0.00 -0.77 0.00 0.00 57.85 56.98 3dog n ARG 126 Cb 0.59 -3.82 0.07 0.00 -1.02 0.00 0.00 32.46 28.27 3dog n ARG 126 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 3dog n ASP 127 N -0.32 0.28 -4.58 0.55 2.03 -1.26 -3.60 116.55 109.64 3dog n ASP 127 Ca 0.00 -2.36 -0.42 0.00 0.52 0.00 0.00 54.79 52.53 3dog n ASP 127 Cb 0.16 0.02 -0.02 0.00 -0.72 0.00 0.00 41.12 40.56 3dog n ASP 127 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 3dog s LEU 128 N -3.53 3.46 0.11 -2.67 1.43 -1.26 -4.78 118.68 111.43 3dog s LEU 128 Ca 0.23 0.15 0.02 0.00 -1.03 0.00 0.00 54.13 53.50 3dog s LEU 128 Cb 0.40 -3.20 -0.04 0.00 0.03 0.00 0.00 46.19 43.39 3dog s LEU 128 CO -0.04 -1.47 -0.07 -1.59 0.23 0.00 0.00 176.35 173.40 3dog s LYS 129 N 4.94 0.88 0.62 1.70 -2.85 -1.26 -4.82 119.74 118.96 3dog s LYS 129 Ca 0.44 -1.36 0.35 0.00 -1.00 0.00 0.00 55.97 54.40 3dog s LYS 129 Cb -0.08 -0.29 1.98 0.00 -2.06 0.00 0.00 37.83 37.38 3dog s LYS 129 CO 0.26 0.00 2.23 -1.00 0.10 0.00 0.00 175.35 176.94 3dog h PRO 130 N 2.93 0.00 0.00 1.78 0.13 -1.93 -0.37 132.00 134.54 3dog h PRO 130 Ca -0.36 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 64.72 3dog h PRO 130 Cb 1.17 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.29 3dog h PRO 130 CO 0.64 0.00 -0.28 1.96 -0.23 0.00 0.00 178.00 180.10 3dog h GLN 131 N 0.00 0.00 -0.64 0.86 7.50 -1.94 -2.51 115.11 118.38 3dog h GLN 131 Ca 0.02 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.17 3dog h GLN 131 Cb 0.19 0.00 0.00 0.00 0.05 0.00 0.00 27.48 27.72 3dog h GLN 131 CO -0.00 0.28 0.00 0.09 -1.50 0.00 0.00 178.83 177.70 3dog n ASN 132 N -3.82 3.87 -4.18 1.46 3.02 -0.15 -4.83 115.26 110.63 3dog n ASN 132 Ca -0.01 -2.23 -0.34 0.00 -0.03 0.00 0.00 54.58 51.97 3dog n ASN 132 Cb 0.37 -0.49 -0.15 0.00 -0.61 0.00 0.00 39.78 38.90 3dog n ASN 132 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 3dog s LEU 133 N -1.39 2.83 -0.10 3.41 1.43 -0.97 0.11 118.68 124.01 3dog s LEU 133 Ca 0.44 -0.78 -0.01 0.00 -1.03 0.00 0.00 54.13 52.74 3dog s LEU 133 Cb 0.26 -1.60 -0.03 0.00 0.03 0.00 0.00 46.19 44.84 3dog s LEU 133 CO 0.25 -0.08 -0.04 -0.76 0.23 0.00 0.00 176.35 175.95 3dog s LEU 134 N 1.31 3.32 0.09 1.79 1.43 0.44 -0.46 118.68 126.61 3dog s LEU 134 Ca 0.02 0.00 0.10 0.00 -1.03 0.00 0.00 54.13 53.22 3dog s LEU 134 Cb -0.15 -1.75 -0.04 0.00 0.03 0.00 0.00 46.19 44.28 3dog s LEU 134 CO -0.07 0.32 -0.25 0.27 0.23 0.00 0.00 176.35 176.85 3dog s ILE 135 N -0.54 2.37 0.35 -0.59 -4.36 0.14 0.30 121.20 118.87 3dog s ILE 135 Ca 0.08 -1.55 0.03 0.00 -0.26 0.00 0.00 60.65 58.95 3dog s ILE 135 Cb -0.12 -2.01 0.03 0.00 1.25 0.00 0.00 42.46 41.61 3dog s ILE 135 CO 0.02 0.20 0.22 -0.46 0.24 0.00 0.00 174.94 175.17 3dog n ASN 136 N 1.23 2.26 0.11 4.36 0.23 -0.87 -2.53 115.26 120.05 3dog n ASN 136 Ca -0.17 -2.26 0.12 0.00 -0.53 0.00 0.00 54.58 51.74 3dog n ASN 136 Cb 0.53 0.02 0.12 0.00 -2.08 0.00 0.00 39.78 38.36 3dog n ASN 136 CO 0.00 0.00 0.00 0.71 -0.93 0.00 0.00 177.26 177.04 3dog h THR 137 N 0.70 0.00 -0.13 5.53 1.35 -1.89 -3.29 112.91 115.18 3dog h THR 137 Ca -0.23 -0.79 -0.11 0.00 -0.55 0.00 0.00 66.41 64.72 3dog h THR 137 Cb 0.82 1.45 -0.01 0.00 -1.73 0.00 0.00 68.15 68.68 3dog h THR 137 CO 0.37 0.00 -0.42 -0.33 -0.25 0.00 0.00 175.52 174.89 3dog h GLU 138 N 0.00 0.30 0.00 4.72 4.39 -1.96 -3.40 114.58 118.63 3dog h GLU 138 Ca 0.00 -0.15 0.00 0.00 0.34 0.00 0.00 59.36 59.55 3dog h GLU 138 Cb 0.90 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.55 3dog h GLU 138 CO 0.00 0.68 0.00 0.41 -1.16 0.00 0.00 179.01 178.94 3dog n GLY 139 N -0.12 0.35 3.89 -3.84 0.00 -1.24 -4.51 105.19 99.72 3dog n GLY 139 Ca -0.02 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.70 3dog n GLY 139 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dog s ALA 140 N -1.13 3.66 -0.01 4.61 0.00 -1.26 -4.84 121.76 122.78 3dog s ALA 140 Ca 0.00 -0.44 0.06 0.00 0.00 0.00 0.00 51.96 51.57 3dog s ALA 140 Cb 0.00 -2.29 -0.01 0.00 0.00 0.00 0.00 23.12 20.81 3dog s ALA 140 CO 0.00 0.50 -0.18 -1.50 0.00 0.00 0.00 175.76 174.59 3dog s ILE 141 N -1.82 1.42 0.05 0.00 2.07 -1.26 -2.05 121.20 119.60 3dog s ILE 141 Ca 0.44 -0.77 0.04 0.00 -1.41 0.00 0.00 60.65 58.95 3dog s ILE 141 Cb -0.11 -1.18 -0.02 0.00 0.13 0.00 0.00 42.46 41.27 3dog s ILE 141 CO 0.24 0.39 -0.12 -0.54 -1.91 0.00 0.00 174.94 173.01 3dog s LYS 142 N -0.44 0.74 0.07 3.50 1.02 0.15 -4.61 119.74 120.16 3dog s LYS 142 Ca 0.07 -0.79 -0.30 0.00 0.02 0.00 0.00 55.97 54.96 3dog s LYS 142 Cb -0.07 -0.67 -0.05 0.00 -0.52 0.00 0.00 37.83 36.52 3dog s LYS 142 CO -0.01 0.15 1.07 -0.51 -0.92 0.00 0.00 175.35 175.13 3dog s LEU 143 N -1.43 4.41 0.45 3.17 1.43 -0.05 -0.42 118.68 126.25 3dog s LEU 143 Ca -0.03 1.87 0.03 0.00 -1.03 0.00 0.00 54.13 54.97 3dog s LEU 143 Cb -0.09 -3.58 -0.02 0.00 0.03 0.00 0.00 46.19 42.53 3dog s LEU 143 CO 0.01 -0.29 0.11 0.00 0.23 0.00 0.00 176.35 176.42 3dog s ALA 144 N 0.62 3.28 -0.08 4.21 0.00 0.12 -1.25 121.76 128.65 3dog s ALA 144 Ca 0.53 -0.93 -0.01 0.00 0.00 0.00 0.00 51.96 51.55 3dog s ALA 144 Cb -0.26 0.60 0.00 0.00 0.00 0.00 0.00 23.12 23.47 3dog s ALA 144 CO 0.30 -0.27 0.02 -3.47 0.00 0.00 0.00 175.76 172.34 3dog n ASP 145 N -1.40 -6.87 -1.80 0.00 -0.08 -1.26 -4.83 116.55 100.31 3dog n ASP 145 Ca -0.09 0.61 -0.00 0.00 -1.51 0.00 0.00 54.79 53.79 3dog n ASP 145 Cb 0.65 -2.42 0.31 0.00 2.34 0.00 0.00 41.12 42.00 3dog n ASP 145 CO 0.00 0.00 0.00 0.49 0.12 0.00 0.00 177.20 177.81 3dog n PHE 146 N 1.12 2.02 0.02 -0.67 3.01 -1.26 -4.51 117.46 117.18 3dog n PHE 146 Ca -0.00 -0.88 0.04 0.00 1.01 0.00 0.00 57.45 57.62 3dog n PHE 146 Cb 0.40 -0.56 0.43 0.00 -0.01 0.00 0.00 39.48 39.74 3dog n PHE 146 CO 0.00 0.00 0.00 0.78 1.01 0.00 0.00 176.76 178.55 3dog h GLY 147 N 3.50 0.54 -2.61 1.37 0.00 -1.91 -1.73 103.07 102.22 3dog h GLY 147 Ca 0.13 -0.21 0.00 0.00 0.00 0.00 0.00 47.33 47.26 3dog h GLY 147 CO 0.56 0.20 0.00 1.04 0.00 0.00 0.00 176.54 178.34 3dog n LEU 148 N -4.47 3.82 -4.76 3.11 4.32 -1.26 -4.57 117.00 113.20 3dog n LEU 148 Ca 0.03 -1.84 -0.31 0.00 -0.02 0.00 0.00 56.01 53.87 3dog n LEU 148 Cb 0.07 -0.43 0.10 0.00 -1.62 0.00 0.00 43.42 41.55 3dog n LEU 148 CO 0.35 0.92 0.69 0.00 -1.22 0.00 0.00 177.39 178.14 3dog s ALA 149 N -1.15 2.12 -0.08 -1.18 0.00 -0.65 -4.65 121.76 116.17 3dog s ALA 149 Ca 0.47 0.19 -0.09 0.00 0.00 0.00 0.00 51.96 52.52 3dog s ALA 149 Cb 0.25 -3.25 0.02 0.00 0.00 0.00 0.00 23.12 20.14 3dog s ALA 149 CO 0.33 -1.88 0.25 0.50 0.00 0.00 0.00 175.76 174.96 3dog s ARG 150 N -4.92 0.34 -0.47 0.00 6.06 -0.74 -4.91 118.95 114.32 3dog s ARG 150 Ca 0.62 0.25 -0.23 0.00 -2.50 0.00 0.00 55.73 53.87 3dog s ARG 150 Cb -0.17 0.16 0.03 0.00 0.06 0.00 0.00 34.95 35.03 3dog s ARG 150 CO 0.56 -0.05 0.79 0.00 -2.50 0.00 0.00 175.30 174.09 3dog s ALA 151 N -0.09 3.28 0.68 6.12 0.00 -1.26 -1.08 121.76 129.41 3dog s ALA 151 Ca -0.02 -1.09 -0.06 0.00 0.00 0.00 0.00 51.96 50.78 3dog s ALA 151 Cb -0.02 -3.49 0.05 0.00 0.00 0.00 0.00 23.12 19.66 3dog s ALA 151 CO 0.01 -1.98 0.99 -0.59 0.00 0.00 0.00 175.76 174.19 3dog s PHE 152 N 3.30 2.95 0.41 0.00 -0.71 0.22 -4.99 117.98 119.16 3dog s PHE 152 Ca 0.28 0.44 0.07 0.00 -1.04 0.00 0.00 56.93 56.69 3dog s PHE 152 Cb -0.13 -3.12 -0.06 0.00 -1.21 0.00 0.00 43.02 38.50 3dog s PHE 152 CO 0.21 -1.31 0.11 0.20 -1.34 0.00 0.00 175.22 173.09 3dog s GLY 153 N -4.49 2.40 -0.26 1.99 0.00 -1.26 -4.86 107.32 100.84 3dog s GLY 153 Ca 0.59 -2.19 0.03 0.00 0.00 0.00 0.00 44.72 43.16 3dog s GLY 153 CO 0.44 -1.99 -0.10 0.14 0.00 0.00 0.00 173.10 171.60 3dog s VAL 154 N -2.64 2.14 0.67 1.40 1.01 -1.26 -1.55 120.40 120.17 3dog s VAL 154 Ca 0.39 -1.66 -0.11 0.00 0.00 0.00 0.00 61.98 60.60 3dog s VAL 154 Cb 0.06 -2.27 -0.01 0.00 0.00 0.00 0.00 36.38 34.16 3dog s VAL 154 CO 0.21 -0.07 1.06 -2.16 0.00 0.00 0.00 175.10 174.14 3dog s PRO 155 N 1.11 3.17 0.92 2.72 0.04 -1.26 -5.14 135.00 136.56 3dog s PRO 155 Ca -0.08 0.63 -0.10 0.00 0.04 0.00 0.00 61.00 61.49 3dog s PRO 155 Cb -0.20 -2.04 0.15 0.00 0.04 0.00 0.00 34.50 32.45 3dog s PRO 155 CO -0.05 -0.85 1.14 0.14 0.04 0.00 0.00 177.00 177.42 3dog s VAL 156 N -3.25 2.08 0.44 -0.36 -7.23 -0.59 -5.08 120.40 106.41 3dog s VAL 156 Ca 0.57 0.02 0.02 0.00 -1.81 0.00 0.00 61.98 60.79 3dog s VAL 156 Cb -0.11 -2.05 -0.01 0.00 0.56 0.00 0.00 36.38 34.76 3dog s VAL 156 CO 0.53 -0.03 0.08 -2.11 -0.31 0.00 0.00 175.10 173.26 3dog n ARG 157 N -4.26 0.67 -1.68 4.82 1.85 -1.26 -5.01 116.66 111.79 3dog n ARG 157 Ca 0.11 -3.50 -0.47 0.00 -1.00 0.00 0.00 57.85 52.99 3dog n ARG 157 Cb 0.52 1.49 -0.04 0.00 -1.05 0.00 0.00 32.46 33.37 3dog n ARG 157 CO 0.00 0.00 0.00 2.41 -0.01 0.00 0.00 177.63 180.03 3dog n THR 158 N -1.05 0.48 0.00 8.89 -1.04 -1.26 -4.71 114.28 115.59 3dog n THR 158 Ca -0.12 -0.09 0.00 0.00 -2.04 0.00 0.00 64.05 61.80 3dog n THR 158 Cb 0.62 -1.86 0.00 0.00 -1.82 0.00 0.00 70.33 67.27 3dog n THR 158 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 3dog n TYR 159 N 6.06 0.00 0.01 -1.42 4.01 -1.26 -5.12 117.16 119.44 3dog n TYR 159 Ca 0.21 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.95 3dog n TYR 159 Cb 0.31 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.34 3dog n TYR 159 CO 0.00 0.00 0.00 1.58 -0.46 0.00 0.00 176.86 177.98 3dog n HIS 161 N -1.30 -0.12 -1.60 -0.72 -0.00 -1.26 -5.08 115.22 105.14 3dog n HIS 161 Ca 0.00 0.02 -0.29 0.00 0.46 0.00 0.00 57.72 57.91 3dog n HIS 161 Cb 0.00 0.26 -0.08 0.00 -0.12 0.00 0.00 29.99 30.05 3dog n HIS 161 CO 0.00 0.00 0.00 0.39 0.46 0.00 0.00 176.34 177.19 3dog n GLU 162 N -2.81 0.97 0.00 1.57 4.71 -1.26 -4.56 120.64 119.27 3dog n GLU 162 Ca 0.00 -1.98 0.00 0.00 -0.01 0.00 0.00 57.16 55.17 3dog n GLU 162 Cb 0.22 -3.52 0.00 0.00 -1.01 0.00 0.00 31.44 27.13 3dog n GLU 162 CO 0.00 0.00 0.00 1.55 0.09 0.00 0.00 177.13 178.77 3dog n VAL 163 N 7.79 0.00 -4.71 2.62 3.14 -1.26 -5.06 118.33 120.85 3dog n VAL 163 Ca 0.45 0.00 -0.29 0.00 -2.96 0.00 0.00 64.34 61.54 3dog n VAL 163 Cb 0.45 -1.30 -0.14 0.00 -1.06 0.00 0.00 33.84 31.79 3dog n VAL 163 CO 0.00 0.00 0.00 0.54 -6.46 0.00 0.00 176.83 170.91 3dog s VAL 164 N -1.99 2.11 0.35 1.55 0.11 -1.24 -4.62 120.40 116.67 3dog s VAL 164 Ca 0.00 -1.48 -0.27 0.00 -2.93 0.00 0.00 61.98 57.30 3dog s VAL 164 Cb 0.00 -1.83 -0.12 0.00 -1.53 0.00 0.00 36.38 32.91 3dog s VAL 164 CO 0.00 0.25 1.24 0.35 -3.33 0.00 0.00 175.10 173.62 3dog n THR 165 N 1.51 2.12 -0.35 5.04 -2.24 -1.26 -4.61 114.28 114.49 3dog n THR 165 Ca -0.17 -0.50 -0.03 0.00 -2.27 0.00 0.00 64.05 61.08 3dog n THR 165 Cb 0.52 -1.49 0.01 0.00 -2.10 0.00 0.00 70.33 67.28 3dog n THR 165 CO 0.00 0.00 0.00 -0.11 -0.57 0.00 0.00 175.07 174.39 3dog n LEU 166 N 0.71 -0.64 0.32 3.22 7.94 -1.26 -1.04 117.00 126.25 3dog n LEU 166 Ca 0.06 1.56 0.20 0.00 -1.11 0.00 0.00 56.01 56.72 3dog n LEU 166 Cb 0.36 -0.33 1.08 0.00 0.53 0.00 0.00 43.42 45.06 3dog n LEU 166 CO 0.61 -1.38 1.15 -0.50 -1.11 0.00 0.00 177.39 176.16 3dog h TRP 167 N 0.00 0.00 -0.19 1.96 4.06 -1.89 -2.06 115.95 117.83 3dog h TRP 167 Ca 0.28 0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.23 3dog h TRP 167 Cb 0.50 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.66 3dog h TRP 167 CO -0.81 0.01 0.00 0.66 -3.56 0.00 0.00 178.44 174.74 3dog n TYR 168 N -3.36 0.26 -2.68 0.49 4.01 -0.20 -4.57 117.16 111.10 3dog n TYR 168 Ca -0.03 -0.46 -0.41 0.00 -0.16 0.00 0.00 57.90 56.84 3dog n TYR 168 Cb 0.09 -0.03 -0.04 0.00 -0.31 0.00 0.00 39.34 39.05 3dog n TYR 168 CO 0.00 0.00 0.00 0.50 -0.46 0.00 0.00 176.86 176.90 3dog s ARG 169 N -0.96 4.64 0.50 -0.72 3.52 -0.77 -4.17 118.95 120.98 3dog s ARG 169 Ca 0.14 1.49 -0.19 0.00 -0.13 0.00 0.00 55.73 57.03 3dog s ARG 169 Cb 0.07 -3.39 -0.08 0.00 -1.56 0.00 0.00 34.95 30.00 3dog s ARG 169 CO 0.09 0.10 1.03 0.00 -0.81 0.00 0.00 175.30 175.72 3dog s ALA 170 N 0.29 2.88 0.38 6.12 0.00 -1.26 -4.89 121.76 125.28 3dog s ALA 170 Ca 0.49 0.53 0.10 0.00 0.00 0.00 0.00 51.96 53.09 3dog s ALA 170 Cb -0.24 -3.23 0.88 0.00 0.00 0.00 0.00 23.12 20.53 3dog s ALA 170 CO 0.30 -0.35 1.92 -1.00 0.00 0.00 0.00 175.76 176.63 3dog h PRO 171 N 1.38 0.59 0.00 0.00 0.13 -1.96 -1.21 132.00 130.93 3dog h PRO 171 Ca -0.49 -0.04 -0.02 0.00 -0.87 0.00 0.00 66.00 64.58 3dog h PRO 171 Cb 1.21 -0.13 -0.00 0.00 0.13 0.00 0.00 31.00 32.21 3dog h PRO 171 CO 0.59 0.39 -0.12 1.05 -0.23 0.00 0.00 178.00 179.69 3dog h GLU 172 N 0.61 0.00 0.20 0.86 9.09 -1.93 -0.15 114.58 123.26 3dog h GLU 172 Ca 0.37 0.00 -0.34 0.00 0.05 0.00 0.00 59.36 59.44 3dog h GLU 172 Cb 0.59 0.00 0.02 0.00 -1.65 0.00 0.00 28.75 27.70 3dog h GLU 172 CO -0.14 0.12 -1.61 0.82 0.05 0.00 0.00 179.01 178.25 3dog h ILE 173 N 0.00 1.11 -0.62 -1.06 2.04 -1.59 -1.53 117.51 115.86 3dog h ILE 173 Ca -0.00 -2.64 -0.05 0.00 1.00 0.00 0.00 64.86 63.17 3dog h ILE 173 Cb 0.40 2.87 -0.03 0.00 -0.74 0.00 0.00 36.82 39.32 3dog h ILE 173 CO 0.02 0.84 0.18 -0.07 0.00 0.00 0.00 178.15 179.12 3dog h LEU 174 N 0.12 0.87 -1.30 1.44 3.38 -0.68 -2.40 115.31 116.74 3dog h LEU 174 Ca -0.29 -0.15 0.00 0.00 0.09 0.00 0.00 57.88 57.53 3dog h LEU 174 Cb 2.11 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 42.63 3dog h LEU 174 CO 0.21 0.83 0.00 0.18 0.09 0.00 0.00 178.44 179.75 3dog n LEU 175 N -4.27 1.97 -2.83 1.67 4.77 -0.13 -4.97 117.00 113.22 3dog n LEU 175 Ca 0.05 -0.76 -0.17 0.00 -0.03 0.00 0.00 56.01 55.09 3dog n LEU 175 Cb 0.22 -0.08 0.06 0.00 -2.33 0.00 0.00 43.42 41.29 3dog n LEU 175 CO 0.40 0.38 0.17 0.61 -1.33 0.00 0.00 177.39 177.63 3dog n GLY 176 N 1.21 -0.17 3.72 -0.72 0.00 -0.90 -4.98 105.19 103.34 3dog n GLY 176 Ca 0.17 0.02 -0.42 0.00 0.00 0.00 0.00 46.02 45.79 3dog n GLY 176 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dog h LYS 178 N 6.92 0.40 -6.21 0.00 2.10 -1.94 -3.39 116.57 114.46 3dog h LYS 178 Ca -0.43 -0.02 -0.68 0.00 -2.00 0.00 0.00 60.65 57.52 3dog h LYS 178 Cb 1.20 -0.09 -0.19 0.00 -0.90 0.00 0.00 32.23 32.26 3dog h LYS 178 CO 0.92 0.27 -0.70 0.71 -2.00 0.00 0.00 179.45 178.64 3dog s TYR 179 N -5.41 2.90 0.06 0.07 2.02 -1.26 -4.09 117.35 111.64 3dog s TYR 179 Ca -0.08 -0.01 -0.06 0.00 -0.37 0.00 0.00 57.07 56.55 3dog s TYR 179 Cb 0.21 -1.67 -0.01 0.00 -0.40 0.00 0.00 41.96 40.09 3dog s TYR 179 CO 0.77 0.33 0.12 1.52 -1.57 0.00 0.00 175.55 176.72 3dog s TYR 180 N -0.86 0.22 0.00 2.71 -0.85 -1.26 -4.98 117.35 112.32 3dog s TYR 180 Ca 0.14 -0.59 0.00 0.00 -0.52 0.00 0.00 57.07 56.10 3dog s TYR 180 Cb -0.11 -0.14 0.00 0.00 0.38 0.00 0.00 41.96 42.09 3dog s TYR 180 CO 0.03 -0.43 0.00 0.45 -1.52 0.00 0.00 175.55 174.08 3dog n SER 181 N 0.40 0.00 0.33 -0.18 2.88 -1.26 -4.89 113.62 110.89 3dog n SER 181 Ca -0.17 0.00 0.21 0.00 -1.33 0.00 0.00 58.87 57.58 3dog n SER 181 Cb 0.60 0.00 1.12 0.00 -0.75 0.00 0.00 64.21 65.18 3dog n SER 181 CO 0.00 0.00 0.00 0.71 -1.23 0.00 0.00 175.04 174.52 3dog h THR 182 N 0.00 0.11 -0.39 2.46 1.35 -1.98 -2.23 112.91 112.22 3dog h THR 182 Ca 0.00 0.00 0.02 0.00 -0.55 0.00 0.00 66.41 65.88 3dog h THR 182 Cb 0.00 0.96 -0.02 0.00 -1.73 0.00 0.00 68.15 67.36 3dog h THR 182 CO 0.00 0.00 0.26 0.00 -0.25 0.00 0.00 175.52 175.53 3dog h ALA 183 N 1.93 1.79 -0.30 6.62 0.00 -1.92 -2.45 119.26 124.94 3dog h ALA 183 Ca 0.00 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 3dog h ALA 183 Cb 0.08 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 3dog h ALA 183 CO -0.00 0.17 0.06 -0.39 0.00 0.00 0.00 179.25 179.09 3dog h VAL 184 N 0.47 1.15 -0.09 0.00 -1.51 -1.81 0.32 116.25 114.78 3dog h VAL 184 Ca 0.15 -0.54 -0.17 0.00 -1.23 0.00 0.00 66.70 64.92 3dog h VAL 184 Cb 0.04 0.87 -0.01 0.00 -2.13 0.00 0.00 31.29 30.06 3dog h VAL 184 CO -0.04 0.19 -0.67 0.44 -1.23 0.00 0.00 177.57 176.27 3dog h ASP 185 N 0.42 0.42 0.08 4.19 3.32 -1.64 -2.92 116.42 120.30 3dog h ASP 185 Ca 0.10 -0.26 -0.00 0.00 0.02 0.00 0.00 57.03 56.89 3dog h ASP 185 Cb 0.19 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 39.62 3dog h ASP 185 CO -0.00 0.97 -0.04 0.40 -1.72 0.00 0.00 179.24 178.85 3dog h ILE 186 N 0.26 1.13 -0.88 0.35 1.08 -1.08 -2.09 117.51 116.28 3dog h ILE 186 Ca -0.02 -0.80 0.18 0.00 -0.39 0.00 0.00 64.86 63.83 3dog h ILE 186 Cb 1.21 1.65 -0.17 0.00 -3.07 0.00 0.00 36.82 36.44 3dog h ILE 186 CO 0.11 0.20 -0.20 -0.25 -0.69 0.00 0.00 178.15 177.32 3dog h TRP 187 N -0.47 -0.43 0.52 1.37 2.91 -1.05 0.17 115.95 118.97 3dog h TRP 187 Ca -0.01 0.08 -0.02 0.00 1.13 0.00 0.00 58.89 60.07 3dog h TRP 187 Cb 0.40 0.33 -0.00 0.00 -0.51 0.00 0.00 29.16 29.38 3dog h TRP 187 CO 0.05 -0.37 -0.30 0.77 -1.03 0.00 0.00 178.44 177.55 3dog h SER 188 N 0.00 -0.74 -0.60 2.65 0.02 -1.30 -0.91 113.55 112.67 3dog h SER 188 Ca 0.43 0.04 0.15 0.00 -0.84 0.00 0.00 61.79 61.56 3dog h SER 188 Cb 0.67 0.21 -0.03 0.00 0.14 0.00 0.00 62.40 63.39 3dog h SER 188 CO -0.89 -0.48 0.42 -0.07 -1.14 0.00 0.00 176.83 174.66 3dog h LEU 189 N -0.77 0.14 0.03 5.07 3.38 -0.60 0.01 115.31 122.56 3dog h LEU 189 Ca -0.06 0.01 -0.00 0.00 0.09 0.00 0.00 57.88 57.91 3dog h LEU 189 Cb 0.62 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.35 3dog h LEU 189 CO 0.08 0.07 -0.01 1.23 0.09 0.00 0.00 178.44 179.90 3dog h GLY 190 N 0.15 -0.04 1.44 0.83 0.00 0.01 0.28 103.07 105.74 3dog h GLY 190 Ca 0.29 0.01 -0.04 0.00 0.00 0.00 0.00 47.33 47.59 3dog h GLY 190 CO -0.04 -0.01 0.14 0.00 0.00 0.00 0.00 176.54 176.62 3dog h ILE 192 N 0.69 1.28 0.29 0.00 2.04 -0.90 -1.27 117.51 119.65 3dog h ILE 192 Ca 0.16 -1.84 0.00 0.00 1.00 0.00 0.00 64.86 64.18 3dog h ILE 192 Cb 0.22 1.79 -0.04 0.00 -0.74 0.00 0.00 36.82 38.05 3dog h ILE 192 CO -0.01 0.59 -0.51 0.15 0.00 0.00 0.00 178.15 178.37 3dog h PHE 193 N 0.59 -1.45 -0.91 1.37 3.57 -0.24 -0.10 116.94 119.77 3dog h PHE 193 Ca -0.01 0.03 0.20 0.00 3.53 0.00 0.00 57.97 61.71 3dog h PHE 193 Cb 1.25 0.60 -0.11 0.00 2.79 0.00 0.00 35.95 40.47 3dog h PHE 193 CO 0.07 -0.63 0.46 0.00 -2.23 0.00 0.00 178.31 175.99 3dog h ALA 194 N -0.65 1.46 -0.28 2.41 0.00 -1.43 -1.32 119.26 119.44 3dog h ALA 194 Ca -0.03 0.12 -0.09 0.00 0.00 0.00 0.00 54.91 54.92 3dog h ALA 194 Cb 0.81 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.63 3dog h ALA 194 CO -0.19 -0.21 -0.20 1.49 0.00 0.00 0.00 179.25 180.14 3dog h GLU 195 N 0.54 0.52 -0.09 0.00 4.81 -0.55 -2.40 114.58 117.40 3dog h GLU 195 Ca 0.54 -0.18 -0.05 0.00 -0.13 0.00 0.00 59.36 59.55 3dog h GLU 195 Cb 0.93 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 30.26 3dog h GLU 195 CO -0.45 0.69 -0.15 0.52 -0.73 0.00 0.00 179.01 178.88 3dog h MET 196 N 0.46 0.14 0.03 1.92 2.86 0.16 0.30 114.93 120.80 3dog h MET 196 Ca 0.08 -0.03 -0.00 0.00 -2.06 0.00 0.00 59.70 57.68 3dog h MET 196 Cb 0.60 -0.02 0.00 0.00 0.06 0.00 0.00 31.60 32.24 3dog h MET 196 CO 0.04 0.30 -0.02 0.28 1.06 0.00 0.00 176.91 178.58 3dog h VAL 197 N 0.14 1.29 0.00 -2.22 2.07 -1.28 -3.37 116.25 112.88 3dog h VAL 197 Ca 0.03 -1.75 0.00 0.00 0.82 0.00 0.00 66.70 65.80 3dog h VAL 197 Cb 0.36 2.35 0.00 0.00 -1.52 0.00 0.00 31.29 32.48 3dog h VAL 197 CO 0.02 0.40 -0.92 0.71 0.02 0.00 0.00 177.57 177.81 3dog h THR 198 N -0.91 0.00 -3.61 2.57 1.35 -1.50 -3.45 112.91 107.36 3dog h THR 198 Ca -0.00 -0.96 -0.35 0.00 -0.55 0.00 0.00 66.41 64.54 3dog h THR 198 Cb 0.69 1.49 0.04 0.00 -1.73 0.00 0.00 68.15 68.64 3dog h THR 198 CO 0.01 0.00 -0.51 0.54 -0.25 0.00 0.00 175.52 175.30 3dog n ARG 199 N -2.66 -3.60 -3.68 4.72 1.74 0.10 -5.01 116.66 108.28 3dog n ARG 199 Ca 0.00 0.81 -0.15 0.00 -0.77 0.00 0.00 57.85 57.75 3dog n ARG 199 Cb 0.54 -5.40 -0.08 0.00 -1.02 0.00 0.00 32.46 26.50 3dog n ARG 199 CO 0.00 0.00 0.00 -0.98 -1.52 0.00 0.00 177.63 175.13 3dog s ARG 200 N -5.39 0.74 0.27 5.56 1.70 -1.23 -4.90 118.95 115.70 3dog s ARG 200 Ca 0.20 0.26 -0.28 0.00 -0.47 0.00 0.00 55.73 55.44 3dog s ARG 200 Cb -0.09 0.35 -0.15 0.00 -0.57 0.00 0.00 34.95 34.49 3dog s ARG 200 CO 0.25 -0.18 0.87 0.00 -1.08 0.00 0.00 175.30 175.16 3dog n ALA 201 N 1.75 -0.94 -0.04 7.88 0.00 -1.26 -4.45 120.51 123.45 3dog n ALA 201 Ca -0.18 0.40 -0.14 0.00 0.00 0.00 0.00 53.44 53.52 3dog n ALA 201 Cb 0.56 -1.91 -0.11 0.00 0.00 0.00 0.00 19.45 17.99 3dog n ALA 201 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 3dog h LEU 202 N 1.70 0.10 -7.00 0.00 5.85 -1.92 -3.39 115.31 110.66 3dog h LEU 202 Ca -0.36 -0.76 -0.62 0.00 0.84 0.00 0.00 57.88 56.98 3dog h LEU 202 Cb 1.37 -0.03 -0.42 0.00 0.37 0.00 0.00 40.66 41.95 3dog h LEU 202 CO 0.59 0.85 -0.62 -0.36 -0.34 0.00 0.00 178.44 178.57 3dog s PHE 203 N -3.17 3.30 -1.38 1.25 0.08 -1.26 -5.02 117.98 111.78 3dog s PHE 203 Ca -0.17 -3.23 -0.13 0.00 0.12 0.00 0.00 56.93 53.52 3dog s PHE 203 Cb -0.00 -2.51 0.08 0.00 -0.57 0.00 0.00 43.02 40.02 3dog s PHE 203 CO 0.71 -0.58 2.04 -0.35 -0.10 0.00 0.00 175.22 176.94 3dog n PRO 204 N 2.06 3.11 -2.31 0.24 -0.04 -1.26 -4.49 135.00 132.31 3dog n PRO 204 Ca 0.21 -2.98 -0.36 0.00 -0.04 0.00 0.00 63.50 60.33 3dog n PRO 204 Cb 0.36 -3.22 -0.01 0.00 -0.04 0.00 0.00 33.50 30.60 3dog n PRO 204 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 3dog s GLY 205 N 2.75 2.72 0.12 0.55 0.00 -1.26 -4.96 107.32 107.23 3dog s GLY 205 Ca 0.46 0.86 0.23 0.00 0.00 0.00 0.00 44.72 46.26 3dog s GLY 205 CO -0.04 1.28 0.97 1.22 0.00 0.00 0.00 173.10 176.53 3dog n ASP 206 N -0.67 0.63 -3.66 1.64 10.43 -1.26 -4.85 116.55 118.81 3dog n ASP 206 Ca 0.08 0.11 -0.09 0.00 2.57 0.00 0.00 54.79 57.46 3dog n ASP 206 Cb 0.49 0.77 -0.02 0.00 1.84 0.00 0.00 41.12 44.20 3dog n ASP 206 CO 0.00 0.00 0.00 -0.94 -1.07 0.00 0.00 177.20 175.19 3dog s SER 207 N -4.72 -0.07 0.12 -2.24 1.04 -1.26 -5.01 113.70 101.56 3dog s SER 207 Ca 0.00 -0.88 -0.18 0.00 0.48 0.00 0.00 55.95 55.37 3dog s SER 207 Cb 0.12 0.71 -0.04 0.00 0.10 0.00 0.00 66.02 66.91 3dog s SER 207 CO 0.81 -1.36 1.72 -0.33 0.98 0.00 0.00 173.24 175.06 3dog h GLU 208 N 2.08 0.42 -0.17 4.02 5.08 -1.99 0.23 114.58 124.25 3dog h GLU 208 Ca -0.24 -0.05 0.03 0.00 -1.00 0.00 0.00 59.36 58.10 3dog h GLU 208 Cb 1.25 -0.08 -0.03 0.00 0.50 0.00 0.00 28.75 30.39 3dog h GLU 208 CO 0.31 0.37 -0.04 0.97 -1.00 0.00 0.00 179.01 179.62 3dog h ILE 209 N 0.36 0.83 -0.67 3.13 6.09 -1.97 -1.27 117.51 124.01 3dog h ILE 209 Ca 0.10 -0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.60 3dog h ILE 209 Cb 0.07 0.83 -0.03 0.00 0.47 0.00 0.00 36.82 38.16 3dog h ILE 209 CO -0.02 0.00 0.43 -0.78 -3.07 0.00 0.00 178.15 174.72 3dog h ASP 210 N 0.00 0.78 -0.39 2.19 3.58 -1.90 -0.74 116.42 119.94 3dog h ASP 210 Ca 0.08 -0.03 0.07 0.00 0.42 0.00 0.00 57.03 57.57 3dog h ASP 210 Cb 0.13 -0.19 -0.06 0.00 1.72 0.00 0.00 39.33 40.92 3dog h ASP 210 CO -0.18 0.58 0.03 -0.61 -2.88 0.00 0.00 179.24 176.18 3dog h GLN 211 N 0.91 0.14 -0.33 0.28 5.75 -0.20 -0.44 115.11 121.23 3dog h GLN 211 Ca 0.24 -0.01 0.02 0.00 -0.15 0.00 0.00 58.65 58.76 3dog h GLN 211 Cb -0.08 -0.03 -0.03 0.00 1.07 0.00 0.00 27.48 28.41 3dog h GLN 211 CO -0.05 0.09 0.16 -0.07 -2.65 0.00 0.00 178.83 176.31 3dog h LEU 212 N 0.15 0.23 -0.62 -2.39 3.38 -0.37 -2.48 115.31 113.21 3dog h LEU 212 Ca 0.19 0.02 -0.05 0.00 0.09 0.00 0.00 57.88 58.13 3dog h LEU 212 Cb 0.26 -0.02 -0.03 0.00 0.09 0.00 0.00 40.66 40.96 3dog h LEU 212 CO -0.29 0.17 0.21 -0.26 0.09 0.00 0.00 178.44 178.36 3dog h PHE 213 N 0.33 0.98 -0.84 1.13 0.04 -0.54 -1.32 116.94 116.72 3dog h PHE 213 Ca 0.14 -0.09 0.04 0.00 2.80 0.00 0.00 57.97 60.85 3dog h PHE 213 Cb 0.06 -0.29 -0.05 0.00 2.20 0.00 0.00 35.95 37.87 3dog h PHE 213 CO -0.10 0.80 0.55 0.00 -0.60 0.00 0.00 178.31 178.96 3dog h ARG 214 N 0.88 0.99 -0.40 1.51 3.08 -0.92 -0.13 114.38 119.39 3dog h ARG 214 Ca 0.20 -0.06 -0.10 0.00 0.07 0.00 0.00 59.98 60.09 3dog h ARG 214 Cb 0.27 -0.22 -0.01 0.00 0.08 0.00 0.00 29.97 30.08 3dog h ARG 214 CO -0.01 0.66 -0.15 0.82 -1.07 0.00 0.00 179.97 180.22 3dog h ILE 215 N 1.02 1.28 -0.59 2.04 2.04 -0.94 -3.06 117.51 119.30 3dog h ILE 215 Ca 0.34 -1.27 -0.10 0.00 1.00 0.00 0.00 64.86 64.83 3dog h ILE 215 Cb 0.06 1.25 -0.02 0.00 -0.74 0.00 0.00 36.82 37.37 3dog h ILE 215 CO -0.10 0.43 -0.02 -0.26 0.00 0.00 0.00 178.15 178.19 3dog h PHE 216 N 0.63 1.16 -0.01 1.37 0.04 -0.45 -2.22 116.94 117.46 3dog h PHE 216 Ca 0.10 -0.21 0.01 0.00 2.80 0.00 0.00 57.97 60.67 3dog h PHE 216 Cb 0.70 -0.30 -0.03 0.00 2.20 0.00 0.00 35.95 38.52 3dog h PHE 216 CO 0.05 1.03 -0.31 0.00 -0.60 0.00 0.00 178.31 178.49 3dog h ARG 217 N 0.96 -0.37 0.91 1.51 3.08 -1.08 -0.83 114.38 118.57 3dog h ARG 217 Ca 0.17 0.02 -0.04 0.00 0.07 0.00 0.00 59.98 60.20 3dog h ARG 217 Cb 0.58 0.08 0.01 0.00 0.08 0.00 0.00 29.97 30.72 3dog h ARG 217 CO 0.03 -0.24 -0.44 1.15 -1.07 0.00 0.00 179.97 179.40 3dog h THR 218 N -0.38 0.07 -0.02 2.04 2.02 -1.48 -3.13 112.91 112.03 3dog h THR 218 Ca 0.01 -0.05 0.00 0.00 0.77 0.00 0.00 66.41 67.14 3dog h THR 218 Cb 0.41 0.07 0.00 0.00 -1.74 0.00 0.00 68.15 66.89 3dog h THR 218 CO -0.21 0.00 0.00 0.18 0.37 0.00 0.00 175.52 175.86 3dog n LEU 219 N -5.60 1.16 0.00 2.58 4.77 -0.84 -5.02 117.00 114.04 3dog n LEU 219 Ca -0.16 -0.40 0.00 0.00 -0.03 0.00 0.00 56.01 55.42 3dog n LEU 219 Cb 0.49 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.57 3dog n LEU 219 CO 0.39 0.20 0.00 0.61 -1.33 0.00 0.00 177.39 177.26 3dog n GLY 220 N 1.12 -1.85 0.00 -0.72 0.00 -0.32 -5.04 105.19 98.39 3dog n GLY 220 Ca 0.20 -1.45 0.00 0.00 0.00 0.00 0.00 46.02 44.77 3dog n GLY 220 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 3dog n THR 221 N -1.09 0.00 0.00 2.61 5.66 -1.24 -4.78 114.28 115.44 3dog n THR 221 Ca 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 3dog n THR 221 Cb 0.00 1.14 0.00 0.00 -1.55 0.00 0.00 70.33 69.92 3dog n THR 221 CO 0.00 0.00 0.00 0.52 -3.05 0.00 0.00 175.07 172.54 3dog n VAL 252 N 0.00 0.00 0.00 1.08 0.31 -1.26 -5.14 118.33 113.32 3dog n VAL 252 Ca 0.00 0.00 -0.12 0.00 -0.01 0.00 0.00 64.34 64.21 3dog n VAL 252 Cb 0.26 0.00 -0.07 0.00 -0.91 0.00 0.00 33.84 33.11 3dog n VAL 252 CO 0.00 0.00 0.00 -0.65 -1.32 0.00 0.00 176.83 174.86 3dog h PRO 253 N 0.00 0.07 -0.84 5.55 0.11 -2.00 -3.34 132.00 131.55 3dog h PRO 253 Ca 0.00 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.10 3dog h PRO 253 Cb 0.00 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 31.10 3dog h PRO 253 CO 0.00 0.20 0.00 -0.35 -0.21 0.00 0.00 178.00 177.64 3dog n PRO 254 N -4.97 0.98 -4.10 1.05 -0.05 -1.26 -4.81 135.00 121.83 3dog n PRO 254 Ca -0.07 0.00 -0.36 0.00 -0.05 0.00 0.00 63.50 63.03 3dog n PRO 254 Cb 0.10 -1.42 -0.08 0.00 -0.05 0.00 0.00 33.50 32.05 3dog n PRO 254 CO 0.00 0.00 0.00 -1.17 -0.05 0.00 0.00 175.50 174.28 3dog s LEU 255 N -0.14 3.97 1.12 1.53 2.96 -1.25 -5.10 118.68 121.76 3dog s LEU 255 Ca 0.00 0.28 -0.14 0.00 -0.22 0.00 0.00 54.13 54.06 3dog s LEU 255 Cb 0.00 -1.95 0.25 0.00 0.50 0.00 0.00 46.19 44.99 3dog s LEU 255 CO 0.00 0.37 1.06 1.51 -1.32 0.00 0.00 176.35 177.96 3dog s ASP 256 N -0.79 1.53 0.25 3.68 -4.77 -1.26 -4.73 116.67 110.59 3dog s ASP 256 Ca 0.13 1.23 -0.05 0.00 -3.30 0.00 0.00 52.55 50.56 3dog s ASP 256 Cb -0.12 -1.91 0.34 0.00 -1.09 0.00 0.00 42.92 40.14 3dog s ASP 256 CO 0.03 -3.82 1.88 -0.08 0.70 0.00 0.00 175.17 173.88 3dog h GLU 257 N -2.36 1.10 -0.02 2.11 4.81 -1.99 -1.99 114.58 116.24 3dog h GLU 257 Ca -0.57 -0.07 -0.00 0.00 -0.13 0.00 0.00 59.36 58.59 3dog h GLU 257 Cb 1.33 -0.25 -0.00 0.00 0.63 0.00 0.00 28.75 30.47 3dog h GLU 257 CO 0.52 0.73 0.01 -0.44 -0.73 0.00 0.00 179.01 179.09 3dog h ASP 258 N 1.13 0.02 -0.41 1.04 3.32 -1.98 -2.60 116.42 116.94 3dog h ASP 258 Ca 0.39 -0.13 0.06 0.00 0.02 0.00 0.00 57.03 57.37 3dog h ASP 258 Cb 0.09 -0.01 -0.05 0.00 0.22 0.00 0.00 39.33 39.59 3dog h ASP 258 CO -0.15 0.14 0.12 1.23 -1.72 0.00 0.00 179.24 178.86 3dog h GLY 259 N -0.10 0.51 0.99 2.75 0.00 -1.80 -2.42 103.07 103.00 3dog h GLY 259 Ca 0.01 -0.05 -0.01 0.00 0.00 0.00 0.00 47.33 47.27 3dog h GLY 259 CO -0.00 -0.01 0.32 3.21 0.00 0.00 0.00 176.54 180.06 3dog h ARG 260 N 0.26 0.84 -0.04 4.80 3.08 -1.36 -0.85 114.38 121.11 3dog h ARG 260 Ca 0.20 -0.11 0.03 0.00 0.07 0.00 0.00 59.98 60.18 3dog h ARG 260 Cb 0.21 -0.16 -0.04 0.00 0.08 0.00 0.00 29.97 30.06 3dog h ARG 260 CO -0.23 0.65 -0.21 1.03 -1.07 0.00 0.00 179.97 180.14 3dog h SER 261 N 0.81 -0.64 -0.64 7.04 0.87 -1.05 0.18 113.55 120.12 3dog h SER 261 Ca 0.21 0.09 0.00 0.00 -1.23 0.00 0.00 61.79 60.87 3dog h SER 261 Cb 0.06 0.27 -0.03 0.00 -0.44 0.00 0.00 62.40 62.26 3dog h SER 261 CO -0.03 -0.28 0.41 0.25 -0.53 0.00 0.00 176.83 176.66 3dog h LEU 262 N -0.32 0.75 0.11 2.23 5.85 -1.28 -1.88 115.31 120.77 3dog h LEU 262 Ca 0.07 -0.03 0.02 0.00 0.84 0.00 0.00 57.88 58.77 3dog h LEU 262 Cb 0.42 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 41.23 3dog h LEU 262 CO -0.22 0.56 -0.23 0.25 -0.34 0.00 0.00 178.44 178.46 3dog h LEU 263 N 0.87 -0.66 -2.11 2.25 5.85 -0.62 0.15 115.31 121.04 3dog h LEU 263 Ca 0.23 0.08 0.00 0.00 0.84 0.00 0.00 57.88 59.03 3dog h LEU 263 Cb -0.08 0.25 0.00 0.00 0.37 0.00 0.00 40.66 41.21 3dog h LEU 263 CO -0.05 -0.32 0.00 0.77 -0.34 0.00 0.00 178.44 178.50 3dog h SER 264 N -0.43 0.00 1.31 1.25 4.64 -0.83 0.33 113.55 119.83 3dog h SER 264 Ca 0.03 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 61.27 3dog h SER 264 Cb 0.45 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.53 3dog h SER 264 CO -0.14 0.00 -0.72 1.56 -0.87 0.00 0.00 176.83 176.67 3dog h GLN 265 N 0.00 0.00 0.00 4.77 4.20 -0.50 -2.91 115.11 120.68 3dog h GLN 265 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 3dog h GLN 265 Cb 0.29 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.07 3dog h GLN 265 CO 0.00 0.27 -0.36 0.52 -0.67 0.00 0.00 178.83 178.59 3dog h MET 266 N 0.00 0.00 -0.24 1.46 2.86 0.11 -0.71 114.93 118.42 3dog h MET 266 Ca -0.04 0.00 -0.14 0.00 -2.06 0.00 0.00 59.70 57.45 3dog h MET 266 Cb 1.29 0.00 -0.09 0.00 0.06 0.00 0.00 31.60 32.86 3dog h MET 266 CO 0.04 0.00 -0.34 1.28 1.06 0.00 0.00 176.91 178.94 3dog n LEU 267 N -2.86 3.60 -4.75 1.22 4.77 -0.08 -3.76 117.00 115.15 3dog n LEU 267 Ca 0.03 -3.96 -0.41 0.00 -0.03 0.00 0.00 56.01 51.63 3dog n LEU 267 Cb 0.53 -0.56 -0.03 0.00 -2.33 0.00 0.00 43.42 41.03 3dog n LEU 267 CO 0.36 1.43 1.01 -2.28 -1.33 0.00 0.00 177.39 176.59 3dog s HIS 268 N -3.30 3.14 0.14 -1.77 2.46 -1.10 -4.93 115.29 109.93 3dog s HIS 268 Ca 0.43 1.23 -0.20 0.00 0.47 0.00 0.00 55.06 56.98 3dog s HIS 268 Cb 0.39 -3.68 0.02 0.00 -0.13 0.00 0.00 32.58 29.18 3dog s HIS 268 CO -0.03 -2.07 1.67 1.88 -2.47 0.00 0.00 174.74 173.72 3dog h TYR 269 N 4.68 -0.28 -2.79 3.88 0.05 -1.95 -3.41 116.97 117.14 3dog h TYR 269 Ca -0.46 0.03 -0.56 0.00 0.05 0.00 0.00 58.73 57.78 3dog h TYR 269 Cb 1.22 0.16 -0.03 0.00 1.01 0.00 0.00 36.73 39.09 3dog h TYR 269 CO 0.60 -0.18 1.01 0.34 -1.05 0.00 0.00 178.16 178.87 3dog s ASP 270 N -5.14 6.75 0.47 3.88 -1.08 -1.26 -4.82 116.67 115.47 3dog s ASP 270 Ca -0.14 1.87 0.22 0.00 -0.52 0.00 0.00 52.55 53.97 3dog s ASP 270 Cb 0.12 -2.54 1.16 0.00 -1.46 0.00 0.00 42.92 40.20 3dog s ASP 270 CO 0.69 -0.90 1.98 -0.65 0.52 0.00 0.00 175.17 176.80 3dog h PRO 271 N 9.09 0.00 -0.25 4.34 0.11 -1.95 -0.02 132.00 143.33 3dog h PRO 271 Ca -0.32 0.00 -0.16 0.00 0.11 0.00 0.00 66.00 65.63 3dog h PRO 271 Cb 1.14 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.24 3dog h PRO 271 CO 0.97 0.20 -0.49 -0.91 -0.21 0.00 0.00 178.00 177.56 3dog h ASN 272 N 0.00 0.73 0.91 -2.05 2.35 -1.95 -3.20 115.58 112.37 3dog h ASN 272 Ca -0.00 -0.37 -0.21 0.00 -0.55 0.00 0.00 56.30 55.18 3dog h ASN 272 Cb 0.44 -0.21 -0.03 0.00 0.05 0.00 0.00 38.32 38.58 3dog h ASN 272 CO 0.03 1.10 -0.98 0.11 -1.65 0.00 0.00 177.43 176.03 3dog h LYS 273 N 0.53 0.03 -6.60 0.81 1.79 -1.81 -3.46 116.57 107.85 3dog h LYS 273 Ca 0.03 -0.05 -0.59 0.00 -2.18 0.00 0.00 60.65 57.86 3dog h LYS 273 Cb 1.04 0.02 0.12 0.00 -1.58 0.00 0.00 32.23 31.83 3dog h LYS 273 CO 0.10 0.98 0.22 -2.13 -1.08 0.00 0.00 179.45 177.54 3dog n ARG 274 N -3.42 1.51 -1.92 3.15 0.63 -0.07 -4.92 116.66 111.61 3dog n ARG 274 Ca -0.01 0.53 -0.38 0.00 -0.92 0.00 0.00 57.85 57.07 3dog n ARG 274 Cb 0.91 -2.03 0.03 0.00 0.45 0.00 0.00 32.46 31.82 3dog n ARG 274 CO 0.00 0.00 0.00 -1.50 -2.51 0.00 0.00 177.63 173.62 3dog s ILE 275 N -1.17 2.37 0.37 5.15 2.07 -0.27 -5.00 121.20 124.72 3dog s ILE 275 Ca 0.60 0.28 -0.07 0.00 -1.41 0.00 0.00 60.65 60.04 3dog s ILE 275 Cb -0.61 -3.14 -0.05 0.00 0.13 0.00 0.00 42.46 38.79 3dog s ILE 275 CO 0.59 -0.00 0.68 -0.94 -1.91 0.00 0.00 174.94 173.36 3dog s SER 276 N -1.07 6.45 0.23 4.50 1.04 -1.26 -4.92 113.70 118.68 3dog s SER 276 Ca 0.69 0.92 -0.06 0.00 0.48 0.00 0.00 55.95 57.99 3dog s SER 276 Cb -0.37 -2.23 0.32 0.00 0.10 0.00 0.00 66.02 63.83 3dog s SER 276 CO 0.44 -0.34 1.84 0.00 0.98 0.00 0.00 173.24 176.16 3dog h ALA 277 N 1.28 1.12 -0.85 5.32 0.00 -1.94 0.24 119.26 124.43 3dog h ALA 277 Ca -0.47 -0.00 0.03 0.00 0.00 0.00 0.00 54.91 54.47 3dog h ALA 277 Cb 1.19 -0.20 -0.05 0.00 0.00 0.00 0.00 17.79 18.73 3dog h ALA 277 CO 0.64 0.22 0.55 -0.22 0.00 0.00 0.00 179.25 180.44 3dog h LYS 278 N 0.90 1.04 0.00 0.00 3.64 -1.93 -1.95 116.57 118.26 3dog h LYS 278 Ca 0.36 -0.06 -0.15 0.00 -1.27 0.00 0.00 60.65 59.52 3dog h LYS 278 Cb 0.19 -0.23 -0.02 0.00 -0.41 0.00 0.00 32.23 31.75 3dog h LYS 278 CO -0.18 0.69 -0.73 0.00 -2.27 0.00 0.00 179.45 176.95 3dog h ALA 279 N 1.35 0.68 -0.26 5.00 0.00 -1.79 -3.20 119.26 121.03 3dog h ALA 279 Ca 0.34 -0.67 -0.06 0.00 0.00 0.00 0.00 54.91 54.53 3dog h ALA 279 Cb 0.01 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 3dog h ALA 279 CO -0.12 0.92 -0.08 0.00 0.00 0.00 0.00 179.25 179.97 3dog h ALA 280 N 1.27 1.38 0.00 0.00 0.00 -0.24 -2.59 119.26 119.07 3dog h ALA 280 Ca -0.01 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.68 3dog h ALA 280 Cb 1.39 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 19.06 3dog h ALA 280 CO 0.10 0.43 0.00 -0.07 0.00 0.00 0.00 179.25 179.70 3dog h LEU 281 N 0.40 0.00 -2.31 0.00 3.38 -1.40 -2.56 115.31 112.82 3dog h LEU 281 Ca 0.08 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.05 3dog h LEU 281 Cb 0.39 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.14 3dog h LEU 281 CO 0.02 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.55 3dog n ALA 282 N -1.98 2.42 -1.77 1.53 0.00 -0.98 -4.86 120.51 114.88 3dog n ALA 282 Ca 0.00 -1.02 -0.40 0.00 0.00 0.00 0.00 53.44 52.02 3dog n ALA 282 Cb 0.21 -0.90 -0.02 0.00 0.00 0.00 0.00 19.45 18.74 3dog n ALA 282 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 3dog s HIS 283 N -1.43 3.05 0.64 0.00 5.04 -0.97 -4.90 115.29 116.74 3dog s HIS 283 Ca 0.40 1.44 0.25 0.00 -1.54 0.00 0.00 55.06 55.61 3dog s HIS 283 Cb 0.23 -3.63 1.29 0.00 0.04 0.00 0.00 32.58 30.50 3dog s HIS 283 CO 0.32 -1.76 1.73 -1.35 -2.34 0.00 0.00 174.74 171.33 3dog h PRO 284 N 3.26 0.00 -0.37 2.88 0.11 -1.93 -1.64 132.00 134.31 3dog h PRO 284 Ca -0.49 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.60 3dog h PRO 284 Cb 1.23 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.32 3dog h PRO 284 CO 0.65 0.00 0.14 0.35 -0.21 0.00 0.00 178.00 178.92 3dog h PHE 285 N 0.00 0.52 -0.57 0.65 3.57 -1.90 -2.31 116.94 116.89 3dog h PHE 285 Ca 0.08 -0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.56 3dog h PHE 285 Cb 1.14 -0.16 0.00 0.00 2.79 0.00 0.00 35.95 39.71 3dog h PHE 285 CO 0.00 0.42 0.00 1.19 -2.23 0.00 0.00 178.31 177.69 3dog n PHE 286 N -4.38 0.85 -0.30 0.41 3.72 -0.62 -4.45 117.46 112.70 3dog n PHE 286 Ca 0.02 -0.40 -0.02 0.00 -0.05 0.00 0.00 57.45 57.00 3dog n PHE 286 Cb 0.15 -0.04 0.15 0.00 -0.94 0.00 0.00 39.48 38.80 3dog n PHE 286 CO 0.00 0.00 0.00 -0.56 -0.05 0.00 0.00 176.76 176.15 3dog h GLN 287 N 3.37 1.17 -0.50 -1.08 3.07 -1.51 -2.95 115.11 116.67 3dog h GLN 287 Ca 0.00 -0.10 -0.03 0.00 0.09 0.00 0.00 58.65 58.60 3dog h GLN 287 Cb 0.85 -0.25 -0.02 0.00 0.08 0.00 0.00 27.48 28.15 3dog h GLN 287 CO 0.03 0.81 0.04 -0.40 0.09 0.00 0.00 178.83 179.40 3dog n ASP 288 N -4.37 4.99 -4.77 0.06 5.75 -1.26 -5.03 116.55 111.93 3dog n ASP 288 Ca 0.09 -3.03 -0.40 0.00 -0.01 0.00 0.00 54.79 51.45 3dog n ASP 288 Cb 0.06 -0.65 -0.00 0.00 -1.03 0.00 0.00 41.12 39.50 3dog n ASP 288 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 3dog s VAL 289 N -2.84 2.51 0.00 2.12 0.11 -1.12 -5.04 120.40 116.14 3dog s VAL 289 Ca 0.51 0.47 0.00 0.00 -2.93 0.00 0.00 61.98 60.02 3dog s VAL 289 Cb 0.40 -3.28 0.00 0.00 -1.53 0.00 0.00 36.38 31.97 3dog s VAL 289 CO 0.13 0.08 0.00 0.35 -3.33 0.00 0.00 175.10 172.33 3dog n THR 290 N 0.19 0.00 -3.44 5.04 -2.24 -1.26 -5.10 114.28 107.47 3dog n THR 290 Ca 0.03 0.00 -0.26 0.00 -2.27 0.00 0.00 64.05 61.55 3dog n THR 290 Cb 0.43 0.00 -0.09 0.00 -2.10 0.00 0.00 70.33 68.56 3dog n THR 290 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 3dog n LYS 291 N 0.00 0.85 -1.85 -0.78 4.81 -1.26 -4.48 118.16 115.45 3dog n LYS 291 Ca 0.00 -3.58 -0.33 0.00 -0.87 0.00 0.00 58.31 53.53 3dog n LYS 291 Cb 0.00 -1.74 0.04 0.00 0.02 0.00 0.00 35.03 33.35 3dog n LYS 291 CO 0.00 0.00 0.00 -2.14 1.17 0.00 0.00 177.40 176.43 3dog s PRO 292 N -0.78 2.91 0.02 1.64 0.02 -1.26 -4.93 135.00 132.62 3dog s PRO 292 Ca 0.33 1.42 -0.28 0.00 0.02 0.00 0.00 61.00 62.49 3dog s PRO 292 Cb 0.07 -1.96 -0.04 0.00 0.02 0.00 0.00 34.50 32.58 3dog s PRO 292 CO -0.15 -1.17 0.89 0.08 -0.33 0.00 0.00 177.00 176.32 3dog s VAL 293 N -2.25 4.78 0.10 3.83 1.01 -1.26 -4.52 120.40 122.09 3dog s VAL 293 Ca 0.68 1.88 -0.31 0.00 0.00 0.00 0.00 61.98 64.23 3dog s VAL 293 Cb -0.21 -4.24 -0.08 0.00 0.00 0.00 0.00 36.38 31.85 3dog s VAL 293 CO 0.39 0.25 1.53 -2.16 0.00 0.00 0.00 175.10 175.11 3dog s PRO 294 N 0.53 4.24 0.80 2.72 0.04 -1.26 -4.99 135.00 137.08 3dog s PRO 294 Ca 0.46 2.23 -0.13 0.00 0.04 0.00 0.00 61.00 63.60 3dog s PRO 294 Cb -0.21 -3.36 0.08 0.00 0.04 0.00 0.00 34.50 31.05 3dog s PRO 294 CO 0.26 -0.60 1.21 -3.38 0.04 0.00 0.00 177.00 174.53 3dog s HIS 295 N 1.72 1.82 0.11 0.56 -3.43 -1.26 -4.73 115.29 110.07 3dog s HIS 295 Ca 0.69 1.67 0.00 0.00 -0.80 0.00 0.00 55.06 56.62 3dog s HIS 295 Cb -0.39 -3.49 0.00 0.00 -1.43 0.00 0.00 32.58 27.27 3dog s HIS 295 CO 0.31 -2.85 0.00 1.28 -2.00 0.00 0.00 174.74 171.48 3dog n LEU 296 N -3.25 -0.20 0.00 5.38 4.32 -1.26 -5.12 117.00 116.87 3dog n LEU 296 Ca 0.14 0.43 0.15 0.00 -0.02 0.00 0.00 56.01 56.70 3dog n LEU 296 Cb 0.50 -0.40 0.87 0.00 -1.62 0.00 0.00 43.42 42.77 3dog n LEU 296 CO 0.48 -0.33 1.03 -2.11 -1.22 0.00 0.00 177.39 175.24