#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3d7s h THR 2 N 0.00 0.43 0.00 2.03 2.02 -2.09 -3.25 112.91 112.05 3d7s h THR 2 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.18 3d7s h THR 2 Cb 0.00 0.53 0.00 0.00 -1.74 0.00 0.00 68.15 66.94 3d7s h THR 2 CO 0.00 0.00 0.00 1.57 0.37 0.00 0.00 175.52 177.46 3d7s n HIS 3 N -3.99 0.00 -4.39 3.16 -0.00 -1.26 -4.82 115.22 103.92 3d7s n HIS 3 Ca 0.16 0.00 -0.26 0.00 -0.00 0.00 0.00 57.72 57.62 3d7s n HIS 3 Cb 0.92 0.00 -0.10 0.00 -0.00 0.00 0.00 29.99 30.81 3d7s n HIS 3 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.34 175.83 3d7s s ASP 4 N -2.72 3.79 0.00 0.26 1.11 -1.23 -5.11 116.67 112.77 3d7s s ASP 4 Ca 0.00 -0.80 0.00 0.00 0.18 0.00 0.00 52.55 51.93 3d7s s ASP 4 Cb 0.00 -0.44 0.00 0.00 1.07 0.00 0.00 42.92 43.55 3d7s s ASP 4 CO 0.00 0.09 0.00 0.59 1.18 0.00 0.00 175.17 177.03 3d7s n ASN 5 N -0.09 0.00 -3.65 0.27 4.13 -1.26 -4.98 115.26 109.68 3d7s n ASN 5 Ca -0.10 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.17 3d7s n ASN 5 Cb 0.57 0.00 -0.06 0.00 -1.54 0.00 0.00 39.78 38.75 3d7s n ASN 5 CO 0.00 0.00 0.00 -0.75 0.28 0.00 0.00 177.26 176.79 3d7s s LYS 6 N 3.58 0.09 -0.02 3.52 2.20 -1.26 -5.07 119.74 122.77 3d7s s LYS 6 Ca 0.00 0.14 -0.24 0.00 -0.36 0.00 0.00 55.97 55.51 3d7s s LYS 6 Cb 0.00 0.03 -0.21 0.00 -1.51 0.00 0.00 37.83 36.14 3d7s s LYS 6 CO 0.00 -0.02 1.15 1.25 -0.36 0.00 0.00 175.35 177.37 3d7s h LEU 7 N 4.67 0.22 0.00 5.43 6.46 -2.03 -3.46 115.31 126.60 3d7s h LEU 7 Ca -0.27 -0.65 -0.34 0.00 -0.12 0.00 0.00 57.88 56.50 3d7s h LEU 7 Cb 1.17 -0.06 0.12 0.00 -0.73 0.00 0.00 40.66 41.15 3d7s h LEU 7 CO 0.21 0.83 0.26 0.00 -0.62 0.00 0.00 178.44 179.12 3d7s n GLN 8 N -4.59 -0.70 -1.14 1.25 1.13 -1.26 -4.87 117.38 107.20 3d7s n GLN 8 Ca -0.09 -1.73 0.00 0.00 -1.94 0.00 0.00 57.00 53.25 3d7s n GLN 8 Cb 0.42 -0.90 0.00 0.00 0.11 0.00 0.00 30.24 29.87 3d7s n GLN 8 CO 0.00 0.00 0.00 0.28 -1.44 0.00 0.00 177.06 175.90 3d7s n VAL 9 N -3.16 -1.52 -0.97 5.09 0.31 -1.26 -5.13 118.33 111.69 3d7s n VAL 9 Ca 0.13 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.46 3d7s n VAL 9 Cb 0.45 -3.04 0.00 0.00 -0.91 0.00 0.00 33.84 30.34 3d7s n VAL 9 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 3d7s n GLU 10 N -0.27 3.97 0.00 5.55 1.02 -1.26 -5.12 120.64 124.53 3d7s n GLU 10 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 3d7s n GLU 10 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.42 3d7s n GLU 10 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3d7s n ALA 11 N -3.00 0.00 -2.49 0.62 0.00 -1.26 -5.18 120.51 109.20 3d7s n ALA 11 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 53.44 53.13 3d7s n ALA 11 Cb 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.33 3d7s n ALA 11 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.50 178.46 3d7s s ILE 12 N 0.00 3.00 0.45 0.00 -5.25 -1.26 -4.26 121.20 113.88 3d7s s ILE 12 Ca 0.00 -1.08 0.00 0.00 -0.99 0.00 0.00 60.65 58.58 3d7s s ILE 12 Cb 0.00 -2.27 0.00 0.00 2.95 0.00 0.00 42.46 43.14 3d7s s ILE 12 CO 0.00 0.35 0.00 1.17 -1.79 0.00 0.00 174.94 174.67 3d7s n LYS 13 N 1.56 -2.56 -1.69 0.37 4.81 -1.26 -4.77 118.16 114.63 3d7s n LYS 13 Ca -0.16 2.07 -0.42 0.00 -0.87 0.00 0.00 58.31 58.93 3d7s n LYS 13 Cb 0.52 -3.01 -0.03 0.00 0.02 0.00 0.00 35.03 32.53 3d7s n LYS 13 CO 0.00 0.00 0.00 2.89 1.17 0.00 0.00 177.40 181.46 3d7s n ARG 14 N -3.69 2.83 0.00 1.64 1.85 -1.26 -3.92 116.66 114.10 3d7s n ARG 14 Ca -0.06 1.03 0.00 0.00 -1.00 0.00 0.00 57.85 57.82 3d7s n ARG 14 Cb 0.47 -2.94 0.00 0.00 -1.05 0.00 0.00 32.46 28.94 3d7s n ARG 14 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 3d7s n GLY 15 N 4.31 2.93 3.66 2.89 0.00 -1.14 -1.33 105.19 116.51 3d7s n GLY 15 Ca 0.18 -0.08 -0.43 0.00 0.00 0.00 0.00 46.02 45.69 3d7s n GLY 15 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3d7s s THR 16 N -0.88 4.73 0.31 2.61 -4.23 -1.26 -3.62 115.64 113.30 3d7s s THR 16 Ca 0.00 1.90 0.05 0.00 -1.18 0.00 0.00 61.69 62.46 3d7s s THR 16 Cb 0.00 -4.25 -0.06 0.00 1.34 0.00 0.00 72.50 69.52 3d7s s THR 16 CO 0.00 -0.14 0.02 0.68 -0.54 0.00 0.00 174.62 174.64 3d7s s VAL 17 N 3.03 1.36 0.00 2.29 -7.23 -1.25 -4.25 120.40 114.36 3d7s s VAL 17 Ca 0.42 -2.04 0.00 0.00 -1.81 0.00 0.00 61.98 58.55 3d7s s VAL 17 Cb -0.15 -2.67 0.00 0.00 0.56 0.00 0.00 36.38 34.12 3d7s s VAL 17 CO 0.07 -0.12 0.00 2.30 -0.31 0.00 0.00 175.10 177.04 3d7s n ILE 18 N -0.65 0.00 0.00 -0.62 -6.64 -1.25 -2.63 119.36 107.57 3d7s n ILE 18 Ca -0.04 0.00 0.00 0.00 -1.77 0.00 0.00 62.75 60.94 3d7s n ILE 18 Cb 0.65 -0.80 0.00 0.00 -1.44 0.00 0.00 39.64 38.06 3d7s n ILE 18 CO 0.00 0.00 0.00 -0.67 -1.77 0.00 0.00 176.55 174.11 3d7s n ASP 19 N 0.00 0.00 -2.30 7.28 4.64 -0.49 -4.83 116.55 120.85 3d7s n ASP 19 Ca 0.00 0.00 -0.04 0.00 -1.38 0.00 0.00 54.79 53.37 3d7s n ASP 19 Cb 0.00 0.00 -0.04 0.00 -1.04 0.00 0.00 41.12 40.04 3d7s n ASP 19 CO 0.00 0.00 0.00 1.41 -0.82 0.00 0.00 177.20 177.79 3d7s n HIS 20 N -0.07 -3.35 -3.70 -0.67 8.25 -1.26 -0.85 115.22 113.56 3d7s n HIS 20 Ca 0.00 1.96 -0.18 0.00 -0.26 0.00 0.00 57.72 59.24 3d7s n HIS 20 Cb 0.00 -3.31 -0.17 0.00 1.12 0.00 0.00 29.99 27.63 3d7s n HIS 20 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 3d7s s ILE 21 N -0.49 -0.11 0.36 1.59 1.01 -1.22 -3.99 121.20 118.36 3d7s s ILE 21 Ca -0.22 0.34 -0.08 0.00 0.00 0.00 0.00 60.65 60.69 3d7s s ILE 21 Cb 0.01 -0.15 -0.07 0.00 0.01 0.00 0.00 42.46 42.26 3d7s s ILE 21 CO 0.58 0.14 -0.24 -0.81 0.00 0.00 0.00 174.94 174.62 3d7s n PRO 22 N 4.89 0.00 -2.67 2.79 -0.04 -1.26 0.12 135.00 138.83 3d7s n PRO 22 Ca -0.12 0.00 -0.41 0.00 -0.04 0.00 0.00 63.50 62.92 3d7s n PRO 22 Cb 0.50 -0.47 -0.04 0.00 -0.04 0.00 0.00 33.50 33.45 3d7s n PRO 22 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3d7s s ALA 23 N -0.94 3.26 -2.14 0.55 0.00 -1.00 -2.94 121.76 118.55 3d7s s ALA 23 Ca 0.22 0.63 0.00 0.00 0.00 0.00 0.00 51.96 52.81 3d7s s ALA 23 Cb -0.15 -3.31 0.00 0.00 0.00 0.00 0.00 23.12 19.66 3d7s s ALA 23 CO 0.35 -0.12 0.00 1.04 0.00 0.00 0.00 175.76 177.03 3d7s n GLN 24 N 3.00 -1.50 -2.46 0.00 1.13 -1.26 -4.81 117.38 111.48 3d7s n GLN 24 Ca 0.04 1.20 -0.03 0.00 -1.94 0.00 0.00 57.00 56.26 3d7s n GLN 24 Cb 0.49 -5.64 0.05 0.00 0.11 0.00 0.00 30.24 25.24 3d7s n GLN 24 CO 0.00 0.00 0.00 -0.89 -1.44 0.00 0.00 177.06 174.73 3d7s n ILE 25 N -2.72 1.33 0.00 5.09 2.08 -1.20 -4.81 119.36 119.14 3d7s n ILE 25 Ca -0.22 -2.88 0.00 0.00 0.56 0.00 0.00 62.75 60.21 3d7s n ILE 25 Cb 0.69 0.83 0.00 0.00 -0.75 0.00 0.00 39.64 40.41 3d7s n ILE 25 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 3d7s n GLY 26 N -0.49 0.00 0.16 7.39 0.00 -1.26 -4.56 105.19 106.44 3d7s n GLY 26 Ca 0.13 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.09 3d7s n GLY 26 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 3d7s h PHE 27 N 0.00 0.24 -0.62 1.61 3.57 -1.93 0.29 116.94 120.11 3d7s h PHE 27 Ca 0.00 0.02 0.18 0.00 3.53 0.00 0.00 57.97 61.70 3d7s h PHE 27 Cb 0.46 -0.06 -0.02 0.00 2.79 0.00 0.00 35.95 39.12 3d7s h PHE 27 CO 0.00 0.11 0.68 -0.22 -2.23 0.00 0.00 178.31 176.64 3d7s h LYS 28 N 0.29 0.00 0.15 1.11 1.63 -1.87 0.69 116.57 118.57 3d7s h LYS 28 Ca 0.16 0.00 -0.31 0.00 -0.85 0.00 0.00 60.65 59.65 3d7s h LYS 28 Cb 0.12 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 31.76 3d7s h LYS 28 CO -0.16 0.00 -1.48 -0.07 -3.45 0.00 0.00 179.45 174.30 3d7s h LEU 29 N 0.00 0.49 -0.13 5.20 3.38 -0.69 -2.86 115.31 120.69 3d7s h LEU 29 Ca 0.29 -0.61 0.03 0.00 0.09 0.00 0.00 57.88 57.68 3d7s h LEU 29 Cb 1.64 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 42.21 3d7s h LEU 29 CO -0.00 1.50 -0.05 -0.07 0.09 0.00 0.00 178.44 179.90 3d7s h LEU 30 N 0.09 -0.19 0.00 1.67 4.07 -0.52 -0.79 115.31 119.64 3d7s h LEU 30 Ca -0.23 0.05 0.00 0.00 0.08 0.00 0.00 57.88 57.78 3d7s h LEU 30 Cb 2.04 0.11 0.00 0.00 1.08 0.00 0.00 40.66 43.88 3d7s h LEU 30 CO 0.19 -0.07 0.00 -1.54 -1.08 0.00 0.00 178.44 175.94 3d7s n SER 31 N -5.19 0.00 -0.30 -0.43 3.41 -1.17 -2.25 113.62 107.69 3d7s n SER 31 Ca -0.04 0.83 0.28 0.00 -0.26 0.00 0.00 58.87 59.69 3d7s n SER 31 Cb 0.12 -0.44 0.51 0.00 -0.26 0.00 0.00 64.21 64.14 3d7s n SER 31 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3d7s n LEU 32 N -1.82 0.25 -3.32 1.04 4.32 -1.08 -0.91 117.00 115.48 3d7s n LEU 32 Ca 0.00 1.30 -0.37 0.00 -0.02 0.00 0.00 56.01 56.92 3d7s n LEU 32 Cb 0.00 -0.64 0.01 0.00 -1.62 0.00 0.00 43.42 41.17 3d7s n LEU 32 CO 0.00 -1.45 1.07 0.49 -1.22 0.00 0.00 177.39 176.28 3d7s n PHE 33 N -4.71 3.15 -0.86 -1.77 3.01 -0.30 -4.87 117.46 111.12 3d7s n PHE 33 Ca 0.32 -2.92 0.00 0.00 1.01 0.00 0.00 57.45 55.86 3d7s n PHE 33 Cb 1.14 -0.97 0.00 0.00 -0.01 0.00 0.00 39.48 39.64 3d7s n PHE 33 CO 0.00 0.00 0.00 0.36 1.01 0.00 0.00 176.76 178.13 3d7s n LYS 34 N -0.18 -0.14 0.00 -1.08 2.85 -0.09 -4.78 118.16 114.74 3d7s n LYS 34 Ca 0.43 -0.07 0.00 0.00 -1.05 0.00 0.00 58.31 57.63 3d7s n LYS 34 Cb 0.31 0.12 0.00 0.00 -0.65 0.00 0.00 35.03 34.81 3d7s n LYS 34 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 177.40 178.63 3d7s n LEU 35 N -0.20 1.56 -0.16 -5.58 4.77 -0.95 -4.23 117.00 112.22 3d7s n LEU 35 Ca 0.00 0.11 0.25 0.00 -0.03 0.00 0.00 56.01 56.34 3d7s n LEU 35 Cb 0.00 -0.15 0.42 0.00 -2.33 0.00 0.00 43.42 41.36 3d7s n LEU 35 CO 0.00 -0.15 1.24 0.74 -1.33 0.00 0.00 177.39 177.89 3d7s h THR 36 N 0.00 0.02 0.00 -5.08 2.02 -1.86 -3.05 112.91 104.96 3d7s h THR 36 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.18 3d7s h THR 36 Cb 0.00 0.04 0.00 0.00 -1.74 0.00 0.00 68.15 66.45 3d7s h THR 36 CO 0.00 0.00 0.00 -0.62 0.37 0.00 0.00 175.52 175.27 3d7s n GLU 37 N -3.21 0.00 -4.13 6.66 1.02 -1.26 -4.42 120.64 115.30 3d7s n GLU 37 Ca 0.21 0.00 -0.11 0.00 -0.02 0.00 0.00 57.16 57.23 3d7s n GLU 37 Cb 1.45 -0.77 -0.10 0.00 -0.02 0.00 0.00 31.44 31.99 3d7s n GLU 37 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 3d7s s THR 38 N -0.46 0.64 -0.79 2.62 -4.23 -1.15 -5.08 115.64 107.19 3d7s s THR 38 Ca 0.00 -1.65 -0.02 0.00 -1.18 0.00 0.00 61.69 58.84 3d7s s THR 38 Cb 0.00 -1.32 0.30 0.00 1.34 0.00 0.00 72.50 72.82 3d7s s THR 38 CO 0.00 -0.71 2.14 -0.90 -0.54 0.00 0.00 174.62 174.62 3d7s n ASP 39 N 0.47 7.37 -4.79 3.99 5.68 -1.26 -4.96 116.55 123.04 3d7s n ASP 39 Ca -0.16 -3.73 -0.23 0.00 -0.50 0.00 0.00 54.79 50.17 3d7s n ASP 39 Cb 0.59 -1.10 -0.06 0.00 -1.14 0.00 0.00 41.12 39.41 3d7s n ASP 39 CO 0.00 0.00 0.00 -1.58 -1.33 0.00 0.00 177.20 174.29 3d7s s GLN 40 N -3.70 2.34 -0.06 0.11 2.00 -1.26 -5.13 119.66 113.96 3d7s s GLN 40 Ca 0.53 -1.73 -0.15 0.00 -2.00 0.00 0.00 55.36 52.01 3d7s s GLN 40 Cb 0.42 -2.13 -0.05 0.00 0.80 0.00 0.00 33.01 32.05 3d7s s GLN 40 CO -0.38 -0.15 0.39 0.50 -0.50 0.00 0.00 175.29 175.15 3d7s s ARG 41 N -3.99 4.04 -0.23 1.67 3.52 -1.26 -5.00 118.95 117.70 3d7s s ARG 41 Ca 0.44 0.33 -0.16 0.00 -0.13 0.00 0.00 55.73 56.21 3d7s s ARG 41 Cb 0.01 -3.30 0.07 0.00 -1.56 0.00 0.00 34.95 30.17 3d7s s ARG 41 CO 0.25 0.50 0.59 0.42 -0.81 0.00 0.00 175.30 176.25 3d7s s ILE 42 N -0.44 -0.01 0.00 4.11 1.09 -1.26 -1.65 121.20 123.05 3d7s s ILE 42 Ca 0.22 0.02 -0.02 0.00 -1.10 0.00 0.00 60.65 59.78 3d7s s ILE 42 Cb -0.15 -0.85 -0.04 0.00 -1.06 0.00 0.00 42.46 40.36 3d7s s ILE 42 CO 0.10 0.01 0.19 -0.89 -0.10 0.00 0.00 174.94 174.26 3d7s s THR 43 N 1.17 5.42 0.02 2.92 2.01 -0.70 -4.96 115.64 121.53 3d7s s THR 43 Ca -0.07 -0.20 0.03 0.00 0.31 0.00 0.00 61.69 61.77 3d7s s THR 43 Cb -0.06 -3.56 -0.02 0.00 0.01 0.00 0.00 72.50 68.88 3d7s s THR 43 CO -0.12 0.29 -0.10 -0.63 -0.69 0.00 0.00 174.62 173.37 3d7s s ILE 44 N -1.36 0.78 -0.21 1.82 1.09 -1.26 -2.24 121.20 119.81 3d7s s ILE 44 Ca 0.29 -0.75 -0.03 0.00 -1.10 0.00 0.00 60.65 59.06 3d7s s ILE 44 Cb -0.13 -0.71 0.07 0.00 -1.06 0.00 0.00 42.46 40.63 3d7s s ILE 44 CO 0.20 -0.02 0.06 -0.83 -0.10 0.00 0.00 174.94 174.26 3d7s s GLY 45 N -0.86 0.65 -0.01 6.18 0.00 0.20 -5.01 107.32 108.47 3d7s s GLY 45 Ca -0.01 -0.77 0.01 0.00 0.00 0.00 0.00 44.72 43.96 3d7s s GLY 45 CO 0.00 1.58 -0.02 1.08 0.00 0.00 0.00 173.10 175.75 3d7s s LEU 46 N 1.92 3.43 -0.55 0.66 1.43 -1.26 -1.38 118.68 122.91 3d7s s LEU 46 Ca 0.02 -0.02 0.00 0.00 -1.03 0.00 0.00 54.13 53.10 3d7s s LEU 46 Cb -0.17 -1.93 0.00 0.00 0.03 0.00 0.00 46.19 44.12 3d7s s LEU 46 CO -0.13 0.30 0.00 0.59 0.23 0.00 0.00 176.35 177.33 3d7s n ASN 47 N 1.55 -3.63 -4.64 2.29 3.02 -1.12 -5.01 115.26 107.72 3d7s n ASN 47 Ca -0.15 0.13 -0.41 0.00 -0.03 0.00 0.00 54.58 54.12 3d7s n ASN 47 Cb 0.53 -1.59 -0.05 0.00 -0.61 0.00 0.00 39.78 38.05 3d7s n ASN 47 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 3d7s s LEU 48 N -1.19 4.09 -0.45 3.41 0.20 -1.03 -4.82 118.68 118.90 3d7s s LEU 48 Ca 0.00 0.87 -0.29 0.00 0.69 0.00 0.00 54.13 55.41 3d7s s LEU 48 Cb 0.00 -3.00 0.03 0.00 -0.43 0.00 0.00 46.19 42.79 3d7s s LEU 48 CO 0.00 -0.41 1.10 -2.84 -0.29 0.00 0.00 176.35 173.92 3d7s s PRO 49 N 2.49 3.76 0.30 0.98 0.02 -1.26 -2.59 135.00 138.69 3d7s s PRO 49 Ca 0.30 0.60 -0.05 0.00 0.02 0.00 0.00 61.00 61.87 3d7s s PRO 49 Cb -0.16 -3.88 0.07 0.00 0.02 0.00 0.00 34.50 30.56 3d7s s PRO 49 CO 0.09 -1.29 0.27 0.45 -0.33 0.00 0.00 177.00 176.19 3d7s n SER 50 N 7.62 -1.24 0.00 2.53 2.88 -1.26 -4.56 113.62 119.59 3d7s n SER 50 Ca 0.11 -0.67 0.03 0.00 -1.33 0.00 0.00 58.87 57.01 3d7s n SER 50 Cb 0.49 -0.25 0.16 0.00 -0.75 0.00 0.00 64.21 63.86 3d7s n SER 50 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3d7s n GLY 51 N 0.76 -0.39 0.00 0.46 0.00 -1.26 -0.06 105.19 104.69 3d7s n GLY 51 Ca 0.04 -0.03 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3d7s n GLY 51 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 3d7s n GLU 52 N -0.71 1.29 0.00 1.61 2.13 -1.26 -5.04 120.64 118.65 3d7s n GLU 52 Ca 0.04 -0.35 0.00 0.00 0.66 0.00 0.00 57.16 57.51 3d7s n GLU 52 Cb 0.02 -0.85 0.00 0.00 0.27 0.00 0.00 31.44 30.88 3d7s n GLU 52 CO 0.00 0.00 0.00 -0.12 -0.41 0.00 0.00 177.13 176.60 3d7s n MET 53 N -0.28 0.00 -1.47 5.31 0.00 0.91 -4.89 117.12 116.70 3d7s n MET 53 Ca 0.00 0.00 -0.18 0.00 -0.00 0.00 0.00 57.70 57.52 3d7s n MET 53 Cb 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 33.22 33.05 3d7s n MET 53 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 3d7s n GLY 54 N 0.00 -0.38 0.00 -5.12 0.00 -1.26 -4.20 105.19 94.22 3d7s n GLY 54 Ca 0.00 0.06 0.00 0.00 0.00 0.00 0.00 46.02 46.08 3d7s n GLY 54 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 3d7s n ARG 55 N 6.16 0.00 -4.09 1.61 1.85 -1.26 -4.76 116.66 116.18 3d7s n ARG 55 Ca 0.57 0.00 -0.09 0.00 -1.00 0.00 0.00 57.85 57.33 3d7s n ARG 55 Cb 0.24 0.00 -0.09 0.00 -1.05 0.00 0.00 32.46 31.56 3d7s n ARG 55 CO 0.00 0.00 0.00 -1.59 -0.01 0.00 0.00 177.63 176.03 3d7s s LYS 56 N 0.00 0.89 0.36 2.89 -2.85 -1.07 -2.39 119.74 117.57 3d7s s LYS 56 Ca 0.00 -1.31 0.05 0.00 -1.00 0.00 0.00 55.97 53.71 3d7s s LYS 56 Cb 0.00 0.26 -0.01 0.00 -2.06 0.00 0.00 37.83 36.03 3d7s s LYS 56 CO 0.00 -0.25 0.52 -0.51 0.10 0.00 0.00 175.35 175.20 3d7s s ASP 57 N -2.99 5.95 -0.20 0.03 -0.00 0.32 -2.46 116.67 117.32 3d7s s ASP 57 Ca 0.18 -0.06 -0.27 0.00 -0.00 0.00 0.00 52.55 52.39 3d7s s ASP 57 Cb 0.07 -1.33 0.10 0.00 -0.00 0.00 0.00 42.92 41.75 3d7s s ASP 57 CO -0.02 -0.49 0.86 -0.22 -0.00 0.00 0.00 175.17 175.30 3d7s s LEU 58 N -4.26 -0.57 0.00 1.23 2.96 -0.48 -3.43 118.68 114.13 3d7s s LEU 58 Ca 0.45 0.91 0.00 0.00 -0.22 0.00 0.00 54.13 55.27 3d7s s LEU 58 Cb -0.10 2.19 0.00 0.00 0.50 0.00 0.00 46.19 48.79 3d7s s LEU 58 CO 0.33 -0.32 0.00 -0.38 -1.32 0.00 0.00 176.35 174.66 3d7s n ILE 59 N 1.77 0.00 0.00 6.68 5.41 -1.26 -0.63 119.36 131.33 3d7s n ILE 59 Ca -0.14 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.61 3d7s n ILE 59 Cb 0.56 0.00 0.00 0.00 -0.71 0.00 0.00 39.64 39.49 3d7s n ILE 59 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 176.55 176.84 3d7s n LYS 60 N 0.00 0.00 -2.69 0.38 5.02 -0.95 -4.29 118.16 115.63 3d7s n LYS 60 Ca 0.00 0.00 -0.31 0.00 -2.02 0.00 0.00 58.31 55.98 3d7s n LYS 60 Cb 0.00 0.00 -0.03 0.00 -0.02 0.00 0.00 35.03 34.98 3d7s n LYS 60 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 3d7s s ILE 61 N 0.00 4.70 -0.08 -0.18 1.09 -1.26 -1.71 121.20 123.76 3d7s s ILE 61 Ca 0.00 0.81 0.02 0.00 -1.10 0.00 0.00 60.65 60.39 3d7s s ILE 61 Cb 0.00 -3.73 -0.02 0.00 -1.06 0.00 0.00 42.46 37.65 3d7s s ILE 61 CO 0.00 -0.59 -0.15 -1.61 -0.10 0.00 0.00 174.94 172.49 3d7s s GLU 62 N -3.95 2.86 -0.17 2.79 0.41 -0.66 -4.13 118.70 115.86 3d7s s GLU 62 Ca 0.54 -0.72 -0.15 0.00 -0.41 0.00 0.00 54.97 54.23 3d7s s GLU 62 Cb -0.10 -2.45 0.02 0.00 -1.78 0.00 0.00 34.13 29.82 3d7s s GLU 62 CO 0.32 0.43 0.25 0.09 -0.49 0.00 0.00 175.26 175.86 3d7s n ASN 63 N 2.87 -2.20 -2.73 -0.19 4.13 -0.44 -4.72 115.26 111.98 3d7s n ASN 63 Ca -0.18 -0.05 -0.06 0.00 1.68 0.00 0.00 54.58 55.97 3d7s n ASN 63 Cb 0.52 -0.63 0.04 0.00 -1.54 0.00 0.00 39.78 38.17 3d7s n ASN 63 CO 0.00 0.00 0.00 0.41 0.28 0.00 0.00 177.26 177.95 3d7s n THR 64 N -0.01 0.00 -1.50 3.41 -1.04 -1.26 -5.02 114.28 108.86 3d7s n THR 64 Ca -0.03 -1.08 -0.55 0.00 -2.04 0.00 0.00 64.05 60.34 3d7s n THR 64 Cb 0.27 1.20 -0.07 0.00 -1.82 0.00 0.00 70.33 69.91 3d7s n THR 64 CO 0.00 0.00 0.00 0.33 -0.64 0.00 0.00 175.07 174.76 3d7s n PHE 65 N 2.07 0.64 -3.99 -1.42 -0.00 -1.26 -4.29 117.46 109.21 3d7s n PHE 65 Ca 0.10 0.95 -0.31 0.00 -0.00 0.00 0.00 57.45 58.20 3d7s n PHE 65 Cb 0.63 -2.12 -0.05 0.00 -0.00 0.00 0.00 39.48 37.93 3d7s n PHE 65 CO 0.00 0.00 0.00 -1.17 -0.00 0.00 0.00 176.76 175.59 3d7s s LEU 66 N 0.60 4.04 0.10 -2.13 1.98 -1.26 -5.01 118.68 117.00 3d7s s LEU 66 Ca 0.84 0.11 0.06 0.00 -2.89 0.00 0.00 54.13 52.25 3d7s s LEU 66 Cb -1.13 -2.69 -0.03 0.00 0.66 0.00 0.00 46.19 43.00 3d7s s LEU 66 CO 0.55 0.17 -0.16 -0.94 -1.89 0.00 0.00 176.35 174.09 3d7s s SER 67 N -2.44 2.01 0.12 3.68 1.04 -1.26 -5.02 113.70 111.83 3d7s s SER 67 Ca 0.32 -0.72 -0.11 0.00 0.48 0.00 0.00 55.95 55.92 3d7s s SER 67 Cb -0.13 -0.08 0.11 0.00 0.10 0.00 0.00 66.02 66.03 3d7s s SER 67 CO 0.25 -0.08 0.87 1.21 0.98 0.00 0.00 173.24 176.47 3d7s n GLU 68 N 0.90 -0.15 0.00 4.02 4.07 -1.26 -0.14 120.64 128.08 3d7s n GLU 68 Ca -0.18 0.87 0.00 0.00 -0.06 0.00 0.00 57.16 57.78 3d7s n GLU 68 Cb 0.55 -1.28 0.00 0.00 -0.06 0.00 0.00 31.44 30.65 3d7s n GLU 68 CO 0.00 0.00 0.00 -0.25 -0.06 0.00 0.00 177.13 176.82 3d7s n ASP 69 N -4.81 0.00 0.20 4.31 8.00 -1.26 0.65 116.55 123.63 3d7s n ASP 69 Ca 0.05 0.51 0.07 0.00 0.71 0.00 0.00 54.79 56.13 3d7s n ASP 69 Cb 0.22 -0.01 0.35 0.00 -0.02 0.00 0.00 41.12 41.66 3d7s n ASP 69 CO 0.00 0.00 0.00 1.56 -0.39 0.00 0.00 177.20 178.37 3d7s h GLN 70 N 0.00 0.00 0.22 -1.24 7.50 -1.93 0.29 115.11 119.95 3d7s h GLN 70 Ca 0.00 0.00 -0.01 0.00 0.50 0.00 0.00 58.65 59.14 3d7s h GLN 70 Cb 0.00 0.00 0.00 0.00 0.05 0.00 0.00 27.48 27.53 3d7s h GLN 70 CO 0.00 0.00 -0.11 0.28 -1.50 0.00 0.00 178.83 177.50 3d7s h VAL 71 N 0.00 0.52 -0.64 -0.54 2.07 0.19 -3.33 116.25 114.51 3d7s h VAL 71 Ca 0.00 -0.97 0.12 0.00 0.82 0.00 0.00 66.70 66.67 3d7s h VAL 71 Cb 0.80 0.88 -0.09 0.00 -1.52 0.00 0.00 31.29 31.36 3d7s h VAL 71 CO 0.00 0.14 0.18 0.44 0.02 0.00 0.00 177.57 178.35 3d7s h ASP 72 N -0.97 0.09 0.00 0.57 3.45 0.40 -0.04 116.42 119.92 3d7s h ASP 72 Ca -0.03 0.11 0.00 0.00 0.43 0.00 0.00 57.03 57.54 3d7s h ASP 72 Cb 0.46 0.13 0.00 0.00 -0.56 0.00 0.00 39.33 39.36 3d7s h ASP 72 CO 0.05 0.04 0.00 0.00 -1.57 0.00 0.00 179.24 177.76 3d7s n GLN 73 N -5.09 0.09 0.00 3.56 1.13 -1.03 -1.91 117.38 114.13 3d7s n GLN 73 Ca 0.10 0.00 0.09 0.00 -1.94 0.00 0.00 57.00 55.25 3d7s n GLN 73 Cb 0.34 -1.00 -0.02 0.00 0.11 0.00 0.00 30.24 29.67 3d7s n GLN 73 CO 0.00 0.00 0.00 1.28 -1.44 0.00 0.00 177.06 176.90 3d7s n LEU 74 N -0.49 1.57 0.00 1.08 4.77 -0.03 -4.90 117.00 119.00 3d7s n LEU 74 Ca 0.00 -0.71 0.00 0.00 -0.03 0.00 0.00 56.01 55.27 3d7s n LEU 74 Cb 0.00 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 3d7s n LEU 74 CO 0.00 0.31 0.00 0.00 -1.33 0.00 0.00 177.39 176.37 3d7s n ALA 75 N -0.37 0.00 0.00 -1.18 0.00 -0.80 -3.48 120.51 114.67 3d7s n ALA 75 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.51 3d7s n ALA 75 Cb 0.36 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.81 3d7s n ALA 75 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 3d7s n LEU 76 N 0.00 0.00 0.05 0.00 7.94 -1.26 -2.36 117.00 121.37 3d7s n LEU 76 Ca 0.00 0.00 -0.03 0.00 -1.11 0.00 0.00 56.01 54.87 3d7s n LEU 76 Cb 0.00 0.00 -0.01 0.00 0.53 0.00 0.00 43.42 43.94 3d7s n LEU 76 CO 0.00 0.00 0.13 1.88 -1.11 0.00 0.00 177.39 178.29 3d7s h TYR 77 N 0.00 -0.15 -2.93 1.96 0.05 -1.95 -3.39 116.97 110.55 3d7s h TYR 77 Ca 0.00 -0.00 -0.70 0.00 0.05 0.00 0.00 58.73 58.08 3d7s h TYR 77 Cb 0.00 0.05 -0.36 0.00 1.01 0.00 0.00 36.73 37.43 3d7s h TYR 77 CO 0.00 -0.10 -0.06 0.00 -1.05 0.00 0.00 178.16 176.95 3d7s n ALA 78 N -2.38 4.14 0.07 3.88 0.00 -0.99 -4.74 120.51 120.49 3d7s n ALA 78 Ca -0.02 -4.69 -0.12 0.00 0.00 0.00 0.00 53.44 48.61 3d7s n ALA 78 Cb 0.07 -1.60 -0.07 0.00 0.00 0.00 0.00 19.45 17.84 3d7s n ALA 78 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 3d7s h PRO 79 N 5.38 -0.53 -5.44 0.00 0.11 -1.77 -3.37 132.00 126.38 3d7s h PRO 79 Ca 0.18 0.04 -0.63 0.00 0.11 0.00 0.00 66.00 65.69 3d7s h PRO 79 Cb 0.73 0.12 -0.15 0.00 0.11 0.00 0.00 31.00 31.81 3d7s h PRO 79 CO 0.94 -0.35 0.49 1.14 -0.21 0.00 0.00 178.00 180.00 3d7s s GLN 80 N -5.06 3.15 0.27 1.05 0.00 -1.26 -4.53 119.66 113.29 3d7s s GLN 80 Ca -0.12 -0.76 -0.18 0.00 -0.00 0.00 0.00 55.36 54.30 3d7s s GLN 80 Cb 0.05 -4.19 0.01 0.00 0.00 0.00 0.00 33.01 28.88 3d7s s GLN 80 CO 0.45 -1.70 0.65 0.00 0.00 0.00 0.00 175.29 174.69 3d7s s ALA 81 N 3.86 -0.89 0.05 2.60 0.00 -1.26 -4.61 121.76 121.51 3d7s s ALA 81 Ca 0.22 -0.51 0.03 0.00 0.00 0.00 0.00 51.96 51.71 3d7s s ALA 81 Cb -0.17 0.91 -0.03 0.00 0.00 0.00 0.00 23.12 23.84 3d7s s ALA 81 CO 0.12 -0.98 -0.10 0.99 0.00 0.00 0.00 175.76 175.79 3d7s s THR 82 N -3.89 0.74 -0.44 0.00 2.01 -0.03 -4.22 115.64 109.81 3d7s s THR 82 Ca 0.15 -1.14 0.03 0.00 0.31 0.00 0.00 61.69 61.03 3d7s s THR 82 Cb -0.04 -0.76 0.12 0.00 0.01 0.00 0.00 72.50 71.83 3d7s s THR 82 CO 0.08 -0.32 0.20 -0.69 -0.69 0.00 0.00 174.62 173.20 3d7s s VAL 83 N -1.32 1.89 -0.38 3.82 1.01 -1.24 -1.40 120.40 122.78 3d7s s VAL 83 Ca -0.07 -2.66 -0.15 0.00 0.00 0.00 0.00 61.98 59.10 3d7s s VAL 83 Cb -0.10 -2.34 0.01 0.00 0.00 0.00 0.00 36.38 33.95 3d7s s VAL 83 CO 0.01 -0.79 0.31 0.54 0.00 0.00 0.00 175.10 175.17 3d7s s ASN 84 N 0.36 6.11 -0.41 3.32 2.20 -1.08 -3.13 114.94 122.32 3d7s s ASN 84 Ca 0.15 -0.66 -0.27 0.00 -0.94 0.00 0.00 52.86 51.14 3d7s s ASN 84 Cb -0.23 -2.17 -0.07 0.00 -2.00 0.00 0.00 41.25 36.78 3d7s s ASN 84 CO -0.04 -0.39 2.35 0.54 -2.94 0.00 0.00 177.10 176.62 3d7s n ARG 85 N 5.23 1.33 -3.88 3.55 1.74 -1.19 -3.89 116.66 119.56 3d7s n ARG 85 Ca -0.11 0.19 -0.26 0.00 -0.77 0.00 0.00 57.85 56.90 3d7s n ARG 85 Cb 0.48 -3.28 -0.03 0.00 -1.02 0.00 0.00 32.46 28.61 3d7s n ARG 85 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 3d7s s ILE 86 N 10.62 5.29 -0.38 0.55 1.01 -1.24 -1.14 121.20 135.92 3d7s s ILE 86 Ca 1.01 -0.62 0.10 0.00 0.00 0.00 0.00 60.65 61.14 3d7s s ILE 86 Cb -0.29 -3.75 0.31 0.00 0.01 0.00 0.00 42.46 38.74 3d7s s ILE 86 CO 0.31 -0.13 0.65 -0.67 0.00 0.00 0.00 174.94 175.09 3d7s n ASP 87 N -0.64 0.55 -1.79 3.58 -0.08 -0.84 -2.87 116.55 114.46 3d7s n ASP 87 Ca -0.06 -2.88 -0.00 0.00 -1.51 0.00 0.00 54.79 50.33 3d7s n ASP 87 Cb 0.54 -0.62 -0.00 0.00 2.34 0.00 0.00 41.12 43.38 3d7s n ASP 87 CO 0.00 0.00 0.00 0.59 0.12 0.00 0.00 177.20 177.91 3d7s n ASN 88 N 0.74 -3.39 -3.75 1.67 4.13 -1.25 -4.13 115.26 109.28 3d7s n ASN 88 Ca 0.23 0.34 -0.27 0.00 1.68 0.00 0.00 54.58 56.57 3d7s n ASN 88 Cb 0.61 -2.03 -0.05 0.00 -1.54 0.00 0.00 39.78 36.77 3d7s n ASN 88 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3d7s n TYR 89 N 0.17 -1.43 -3.88 3.10 4.11 -1.26 -4.86 117.16 113.11 3d7s n TYR 89 Ca -0.00 0.43 -0.33 0.00 -0.00 0.00 0.00 57.90 57.99 3d7s n TYR 89 Cb 0.00 -1.51 -0.13 0.00 -0.00 0.00 0.00 39.34 37.70 3d7s n TYR 89 CO 0.00 0.00 0.00 -1.21 -0.00 0.00 0.00 176.86 175.65 3d7s s GLU 90 N -6.30 1.91 -0.94 -3.48 8.01 -1.26 -5.02 118.70 111.62 3d7s s GLU 90 Ca 0.52 -2.10 -0.18 0.00 0.01 0.00 0.00 54.97 53.22 3d7s s GLU 90 Cb -0.31 -3.44 -0.11 0.00 -4.31 0.00 0.00 34.13 25.97 3d7s s GLU 90 CO 0.64 -1.05 2.04 1.33 0.01 0.00 0.00 175.26 178.23 3d7s n VAL 91 N 4.03 2.27 0.67 2.63 0.24 -1.26 -1.99 118.33 124.91 3d7s n VAL 91 Ca 0.03 -1.84 0.00 0.00 -2.04 0.00 0.00 64.34 60.49 3d7s n VAL 91 Cb 0.39 -2.35 0.00 0.00 -1.47 0.00 0.00 33.84 30.41 3d7s n VAL 91 CO 0.00 0.00 0.00 0.55 -2.14 0.00 0.00 176.83 175.24 3d7s n VAL 92 N 5.50 0.02 -3.59 3.34 3.14 -0.29 -4.86 118.33 121.59 3d7s n VAL 92 Ca 0.50 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.88 3d7s n VAL 92 Cb 0.35 -0.34 0.00 0.00 -1.06 0.00 0.00 33.84 32.79 3d7s n VAL 92 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 3d7s n GLY 93 N 0.18 -0.75 0.00 7.55 0.00 -1.22 -4.87 105.19 106.08 3d7s n GLY 93 Ca 0.00 -1.25 0.00 0.00 0.00 0.00 0.00 46.02 44.77 3d7s n GLY 93 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 3d7s n LYS 94 N 0.00 0.00 -1.75 1.61 2.85 -1.26 -3.16 118.16 116.45 3d7s n LYS 94 Ca 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.26 3d7s n LYS 94 Cb 0.00 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.38 3d7s n LYS 94 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 177.40 176.22 3d7s n SER 95 N 0.00 0.00 -4.00 -5.58 3.41 -1.18 -4.84 113.62 101.43 3d7s n SER 95 Ca 0.00 0.00 -0.09 0.00 -0.26 0.00 0.00 58.87 58.52 3d7s n SER 95 Cb 0.00 0.00 -0.08 0.00 -0.26 0.00 0.00 64.21 63.87 3d7s n SER 95 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 3d7s s ARG 96 N -2.00 1.08 -1.10 4.33 0.52 -1.26 -3.65 118.95 116.87 3d7s s ARG 96 Ca 0.00 -1.22 -0.20 0.00 -0.52 0.00 0.00 55.73 53.79 3d7s s ARG 96 Cb 0.00 0.35 0.08 0.00 0.52 0.00 0.00 34.95 35.90 3d7s s ARG 96 CO 0.00 -0.38 1.47 -1.25 0.02 0.00 0.00 175.30 175.16 3d7s s PRO 97 N -3.98 3.75 0.07 3.54 0.04 -1.26 -4.79 135.00 132.36 3d7s s PRO 97 Ca 0.18 -1.61 -0.30 0.00 0.04 0.00 0.00 61.00 59.31 3d7s s PRO 97 Cb 0.04 -5.30 -0.05 0.00 0.04 0.00 0.00 34.50 29.23 3d7s s PRO 97 CO -0.00 -2.10 0.99 -1.54 0.04 0.00 0.00 177.00 174.38 3d7s s SER 98 N 4.33 7.41 -0.31 6.66 1.04 -1.26 -4.65 113.70 126.92 3d7s s SER 98 Ca 0.45 1.77 -0.38 0.00 0.48 0.00 0.00 55.95 58.27 3d7s s SER 98 Cb -0.00 -2.58 -0.14 0.00 0.10 0.00 0.00 66.02 63.40 3d7s s SER 98 CO -0.04 -0.18 1.94 -0.11 0.98 0.00 0.00 173.24 175.83 3d7s n LEU 99 N 3.29 2.25 -4.31 2.42 0.00 -1.26 -4.37 117.00 115.02 3d7s n LEU 99 Ca 0.04 0.81 -0.30 0.00 0.00 0.00 0.00 56.01 56.57 3d7s n LEU 99 Cb 0.50 -1.18 0.29 0.00 0.00 0.00 0.00 43.42 43.03 3d7s n LEU 99 CO 0.52 -0.53 0.40 -2.16 0.00 0.00 0.00 177.39 175.63 3d7s s PRO 100 N 4.71 -2.69 -0.15 1.96 0.04 -1.26 -5.00 135.00 132.60 3d7s s PRO 100 Ca 1.04 0.35 -0.05 0.00 0.04 0.00 0.00 61.00 62.38 3d7s s PRO 100 Cb -1.01 -1.39 -0.24 0.00 0.04 0.00 0.00 34.50 31.91 3d7s s PRO 100 CO 0.59 -4.77 0.23 0.39 0.04 0.00 0.00 177.00 173.48 3d7s n GLU 101 N -5.59 0.73 0.00 4.56 -0.58 -1.26 -4.79 120.64 113.71 3d7s n GLU 101 Ca 0.10 0.25 0.00 0.00 -0.42 0.00 0.00 57.16 57.08 3d7s n GLU 101 Cb 0.58 -1.67 0.00 0.00 -0.57 0.00 0.00 31.44 29.79 3d7s n GLU 101 CO 0.00 0.00 0.00 2.89 -0.48 0.00 0.00 177.13 179.54 3d7s n ARG 102 N -3.48 3.83 0.00 3.49 1.85 -1.26 -2.59 116.66 118.50 3d7s n ARG 102 Ca -0.35 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.50 3d7s n ARG 102 Cb 1.02 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 32.43 3d7s n ARG 102 CO 0.00 0.00 0.00 1.51 -0.01 0.00 0.00 177.63 179.13 3d7s n ILE 103 N 0.00 0.00 -2.84 8.89 3.06 -1.26 -4.78 119.36 122.43 3d7s n ILE 103 Ca 0.00 0.00 -0.23 0.00 -2.50 0.00 0.00 62.75 60.02 3d7s n ILE 103 Cb 0.00 0.00 0.02 0.00 0.54 0.00 0.00 39.64 40.20 3d7s n ILE 103 CO 0.00 0.00 0.00 -1.81 -2.50 0.00 0.00 176.55 172.24 3d7s s ASP 104 N 0.00 5.70 0.00 9.51 1.01 -1.26 -3.78 116.67 127.85 3d7s s ASP 104 Ca 0.00 0.30 0.00 0.00 0.71 0.00 0.00 52.55 53.56 3d7s s ASP 104 Cb 0.00 -1.45 0.00 0.00 1.01 0.00 0.00 42.92 42.48 3d7s s ASP 104 CO 0.00 -0.83 0.00 0.59 0.21 0.00 0.00 175.17 175.14 3d7s n ASN 105 N -2.20 0.00 -0.00 0.27 4.13 0.45 -4.71 115.26 113.20 3d7s n ASN 105 Ca 0.03 0.00 0.11 0.00 1.68 0.00 0.00 54.58 56.40 3d7s n ASN 105 Cb 0.58 -0.15 -0.15 0.00 -1.54 0.00 0.00 39.78 38.53 3d7s n ASN 105 CO 0.00 0.00 0.00 1.33 0.28 0.00 0.00 177.26 178.87 3d7s n VAL 106 N -0.59 0.01 -3.41 2.41 0.24 -1.26 -4.69 118.33 111.03 3d7s n VAL 106 Ca 0.00 -0.34 -0.23 0.00 -2.04 0.00 0.00 64.34 61.73 3d7s n VAL 106 Cb 0.00 0.31 0.04 0.00 -1.47 0.00 0.00 33.84 32.72 3d7s n VAL 106 CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87 3d7s n LEU 107 N -2.02 0.00 -3.90 1.34 4.77 -1.26 -5.09 117.00 110.84 3d7s n LEU 107 Ca -0.01 -2.74 -0.19 0.00 -0.03 0.00 0.00 56.01 53.04 3d7s n LEU 107 Cb 0.49 -0.27 -0.16 0.00 -2.33 0.00 0.00 43.42 41.15 3d7s n LEU 107 CO 0.45 -0.67 -0.41 -0.69 -1.33 0.00 0.00 177.39 174.75 3d7s s VAL 108 N -2.75 0.50 0.01 4.08 1.01 -1.26 -4.79 120.40 117.20 3d7s s VAL 108 Ca 0.49 -0.12 -0.30 0.00 0.00 0.00 0.00 61.98 62.05 3d7s s VAL 108 Cb -0.04 -0.52 -0.07 0.00 0.00 0.00 0.00 36.38 35.75 3d7s s VAL 108 CO 0.31 0.21 1.63 0.00 0.00 0.00 0.00 175.10 177.25 3d7s n PRO 110 N 6.17 0.60 -2.51 0.00 -0.02 -1.26 -4.69 135.00 133.29 3d7s n PRO 110 Ca 0.16 0.02 -0.43 0.00 -2.02 0.00 0.00 63.50 61.23 3d7s n PRO 110 Cb 0.42 -1.50 -0.02 0.00 -0.02 0.00 0.00 33.50 32.38 3d7s n PRO 110 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 3d7s s ASN 111 N -2.11 6.64 0.55 2.55 3.04 -1.26 -4.88 114.94 119.46 3d7s s ASN 111 Ca 0.30 0.84 0.23 0.00 0.04 0.00 0.00 52.86 54.27 3d7s s ASN 111 Cb 0.15 -2.54 1.45 0.00 -1.54 0.00 0.00 41.25 38.76 3d7s s ASN 111 CO 0.26 -1.17 2.10 -1.28 -3.04 0.00 0.00 177.10 173.97 3d7s h SER 112 N 9.30 0.00 -0.02 -4.21 0.87 -2.03 -2.22 113.55 115.24 3d7s h SER 112 Ca -0.24 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.32 3d7s h SER 112 Cb 1.08 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.04 3d7s h SER 112 CO 1.08 0.00 -0.17 -3.20 -0.53 0.00 0.00 176.83 174.00 3d7s n ASN 113 N -4.25 2.65 -4.68 6.23 4.05 -1.26 -4.94 115.26 113.06 3d7s n ASN 113 Ca 0.02 -1.82 -0.46 0.00 0.45 0.00 0.00 54.58 52.76 3d7s n ASN 113 Cb 0.32 0.17 -0.04 0.00 1.23 0.00 0.00 39.78 41.46 3d7s n ASN 113 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 3d7s h ILE 115 N 4.46 0.74 -0.99 0.00 6.09 -1.92 -3.20 117.51 122.69 3d7s h ILE 115 Ca -0.46 0.00 0.25 0.00 -1.37 0.00 0.00 64.86 63.27 3d7s h ILE 115 Cb 1.26 0.88 -0.19 0.00 0.47 0.00 0.00 36.82 39.24 3d7s h ILE 115 CO 0.92 0.00 -0.06 0.77 -3.07 0.00 0.00 178.15 176.71 3d7s h SER 116 N 0.00 -0.63 0.00 2.19 4.64 -1.94 -3.31 113.55 114.50 3d7s h SER 116 Ca 0.10 0.29 0.00 0.00 -0.47 0.00 0.00 61.79 61.71 3d7s h SER 116 Cb 0.44 0.53 0.00 0.00 -0.31 0.00 0.00 62.40 63.06 3d7s h SER 116 CO -0.00 -0.35 0.00 1.41 -0.87 0.00 0.00 176.83 177.02 3d7s n HIS 117 N -5.54 0.00 1.20 4.77 8.25 -1.21 -2.52 115.22 120.18 3d7s n HIS 117 Ca 0.21 0.00 0.09 0.00 -0.26 0.00 0.00 57.72 57.75 3d7s n HIS 117 Cb 0.67 -0.02 0.51 0.00 1.12 0.00 0.00 29.99 32.28 3d7s n HIS 117 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3d7s n ALA 118 N -1.05 2.20 -2.74 -1.41 0.00 -1.25 -4.86 120.51 111.41 3d7s n ALA 118 Ca 0.00 -0.11 -0.24 0.00 0.00 0.00 0.00 53.44 53.09 3d7s n ALA 118 Cb 0.00 -1.28 -0.06 0.00 0.00 0.00 0.00 19.45 18.11 3d7s n ALA 118 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 3d7s s GLU 119 N -2.00 2.64 -0.48 0.00 0.41 -1.05 -5.02 118.70 113.20 3d7s s GLU 119 Ca 0.26 -1.14 -0.04 0.00 -0.41 0.00 0.00 54.97 53.63 3d7s s GLU 119 Cb 0.12 -2.42 -0.09 0.00 -1.78 0.00 0.00 34.13 29.96 3d7s s GLU 119 CO 0.20 0.41 2.13 -2.30 -0.49 0.00 0.00 175.26 175.21 3d7s n PRO 120 N -0.77 1.59 -4.19 0.39 -0.02 -1.26 -4.86 135.00 125.88 3d7s n PRO 120 Ca -0.08 -1.02 -0.12 0.00 -2.02 0.00 0.00 63.50 60.27 3d7s n PRO 120 Cb 0.57 -2.13 -0.10 0.00 -0.02 0.00 0.00 33.50 31.82 3d7s n PRO 120 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 3d7s s VAL 121 N 2.75 0.14 -0.14 -1.45 -7.23 -1.26 -5.16 120.40 108.06 3d7s s VAL 121 Ca 0.37 -1.96 -0.15 0.00 -1.81 0.00 0.00 61.98 58.43 3d7s s VAL 121 Cb 0.13 -2.30 -0.05 0.00 0.56 0.00 0.00 36.38 34.73 3d7s s VAL 121 CO -0.02 -0.23 0.35 -0.44 -0.31 0.00 0.00 175.10 174.45 3d7s s SER 122 N -3.13 6.53 0.17 4.85 0.01 -1.26 -5.04 113.70 115.83 3d7s s SER 122 Ca 0.32 0.62 -0.32 0.00 1.31 0.00 0.00 55.95 57.88 3d7s s SER 122 Cb 0.07 -2.21 -0.11 0.00 0.21 0.00 0.00 66.02 63.98 3d7s s SER 122 CO 0.07 0.10 1.63 -0.94 0.41 0.00 0.00 173.24 174.51 3d7s s SER 123 N 0.36 6.51 -0.01 2.44 1.04 -1.26 -4.69 113.70 118.09 3d7s s SER 123 Ca 0.19 2.70 0.00 0.00 0.48 0.00 0.00 55.95 59.33 3d7s s SER 123 Cb -0.14 -2.59 0.01 0.00 0.10 0.00 0.00 66.02 63.40 3d7s s SER 123 CO 0.06 -0.88 0.00 -0.55 0.98 0.00 0.00 173.24 172.85 3d7s s SER 124 N 1.26 0.14 0.00 7.02 0.15 -1.26 0.17 113.70 121.17 3d7s s SER 124 Ca 0.72 -0.01 0.00 0.00 0.70 0.00 0.00 55.95 57.37 3d7s s SER 124 Cb -0.46 -0.05 0.00 0.00 -1.71 0.00 0.00 66.02 63.80 3d7s s SER 124 CO 0.32 -0.03 0.00 0.49 1.20 0.00 0.00 173.24 175.21 3d7s n PHE 125 N 3.43 0.00 -3.68 3.44 3.01 -1.25 -0.05 117.46 122.38 3d7s n PHE 125 Ca -0.17 0.00 -0.14 0.00 1.01 0.00 0.00 57.45 58.14 3d7s n PHE 125 Cb 0.56 0.00 -0.08 0.00 -0.01 0.00 0.00 39.48 39.95 3d7s n PHE 125 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 3d7s s ALA 126 N -2.00 -1.29 -0.07 4.37 0.00 -1.25 -4.51 121.76 117.01 3d7s s ALA 126 Ca 0.00 1.25 0.02 0.00 0.00 0.00 0.00 51.96 53.23 3d7s s ALA 126 Cb 0.00 -0.55 -0.03 0.00 0.00 0.00 0.00 23.12 22.54 3d7s s ALA 126 CO 0.00 -0.27 -0.10 0.08 0.00 0.00 0.00 175.76 175.46 3d7s s VAL 127 N -0.26 3.38 -0.02 0.00 1.01 -1.07 -3.28 120.40 120.16 3d7s s VAL 127 Ca -0.04 -0.59 -0.29 0.00 0.00 0.00 0.00 61.98 61.05 3d7s s VAL 127 Cb -0.03 -2.37 0.08 0.00 0.00 0.00 0.00 36.38 34.06 3d7s s VAL 127 CO 0.03 0.58 0.74 -0.60 0.00 0.00 0.00 175.10 175.85 3d7s s ARG 128 N -0.59 1.00 -0.12 2.72 3.52 -0.34 -4.93 118.95 120.20 3d7s s ARG 128 Ca 0.09 0.04 -0.03 0.00 -0.13 0.00 0.00 55.73 55.70 3d7s s ARG 128 Cb -0.12 0.47 -0.03 0.00 -1.56 0.00 0.00 34.95 33.71 3d7s s ARG 128 CO 0.02 -0.35 -0.02 0.21 -0.81 0.00 0.00 175.30 174.34 3d7s s LYS 129 N -1.87 3.37 0.29 5.12 2.47 -1.26 0.13 119.74 127.98 3d7s s LYS 129 Ca -0.06 -0.47 0.05 0.00 -1.56 0.00 0.00 55.97 53.94 3d7s s LYS 129 Cb -0.00 -2.87 -0.06 0.00 -1.46 0.00 0.00 37.83 33.44 3d7s s LYS 129 CO 0.02 0.45 -0.02 1.03 0.16 0.00 0.00 175.35 176.99 3d7s s ARG 130 N -0.20 1.55 0.03 4.03 0.52 -0.53 -4.94 118.95 119.41 3d7s s ARG 130 Ca 0.04 -1.81 -0.05 0.00 -0.52 0.00 0.00 55.73 53.39 3d7s s ARG 130 Cb -0.13 -1.02 -0.01 0.00 0.52 0.00 0.00 34.95 34.31 3d7s s ARG 130 CO 0.02 -0.04 0.36 0.00 0.02 0.00 0.00 175.30 175.66 3d7s n ALA 131 N -0.59 -0.11 0.00 2.13 0.00 -1.26 -2.96 120.51 117.71 3d7s n ALA 131 Ca -0.05 0.15 0.00 0.00 0.00 0.00 0.00 53.44 53.54 3d7s n ALA 131 Cb 0.64 0.02 0.00 0.00 0.00 0.00 0.00 19.45 20.11 3d7s n ALA 131 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3d7s n ASN 132 N -3.62 4.55 -4.76 0.00 4.13 -1.26 -5.08 115.26 109.22 3d7s n ASN 132 Ca 0.00 -0.04 -0.23 0.00 1.68 0.00 0.00 54.58 56.00 3d7s n ASN 132 Cb 0.04 0.98 0.09 0.00 -1.54 0.00 0.00 39.78 39.36 3d7s n ASN 132 CO 0.00 0.00 0.00 -1.81 0.28 0.00 0.00 177.26 175.73 3d7s s ASP 133 N -1.89 4.56 -0.24 6.41 -0.00 -1.16 -5.06 116.67 119.29 3d7s s ASP 133 Ca 0.00 -0.36 -0.02 0.00 -0.00 0.00 0.00 52.55 52.17 3d7s s ASP 133 Cb 0.00 -0.11 0.07 0.00 -0.00 0.00 0.00 42.92 42.88 3d7s s ASP 133 CO 0.00 -1.70 0.05 -0.63 -0.00 0.00 0.00 175.17 172.89 3d7s s ILE 134 N -3.03 0.65 0.10 0.77 1.09 -1.26 -1.46 121.20 118.06 3d7s s ILE 134 Ca 0.64 -0.86 -0.30 0.00 -1.10 0.00 0.00 60.65 59.03 3d7s s ILE 134 Cb -0.06 -1.27 -0.06 0.00 -1.06 0.00 0.00 42.46 40.01 3d7s s ILE 134 CO 0.43 -0.38 1.16 0.00 -0.10 0.00 0.00 174.94 176.05 3d7s s ALA 135 N 1.77 3.38 -0.08 9.38 0.00 0.36 -1.94 121.76 134.62 3d7s s ALA 135 Ca 0.03 0.83 0.00 0.00 0.00 0.00 0.00 51.96 52.82 3d7s s ALA 135 Cb -0.17 -3.41 0.02 0.00 0.00 0.00 0.00 23.12 19.56 3d7s s ALA 135 CO -0.15 -0.36 -0.07 -0.51 0.00 0.00 0.00 175.76 174.67 3d7s s LEU 136 N 0.57 1.19 -0.44 0.00 1.43 -0.83 -1.20 118.68 119.40 3d7s s LEU 136 Ca 0.55 -0.23 -0.08 0.00 -1.03 0.00 0.00 54.13 53.34 3d7s s LEU 136 Cb -0.29 -0.70 0.11 0.00 0.03 0.00 0.00 46.19 45.33 3d7s s LEU 136 CO 0.31 -0.09 0.29 -0.75 0.23 0.00 0.00 176.35 176.34 3d7s s LYS 137 N 1.42 2.42 -0.65 1.70 2.20 -1.21 -0.27 119.74 125.35 3d7s s LYS 137 Ca -0.02 -1.70 -0.38 0.00 -0.36 0.00 0.00 55.97 53.52 3d7s s LYS 137 Cb -0.13 -3.81 -0.19 0.00 -1.51 0.00 0.00 37.83 32.18 3d7s s LYS 137 CO -0.04 -1.11 2.26 0.00 -0.36 0.00 0.00 175.35 176.10 3d7s h LYS 139 N 9.72 0.38 0.00 0.00 3.64 -0.74 0.69 116.57 130.25 3d7s h LYS 139 Ca -0.08 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.28 3d7s h LYS 139 Cb 1.34 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 33.07 3d7s h LYS 139 CO 1.16 0.25 -0.02 1.88 -2.27 0.00 0.00 179.45 180.45 3d7s h TYR 140 N 0.39 0.00 0.00 1.91 0.05 -1.85 -3.37 116.97 114.10 3d7s h TYR 140 Ca 0.62 0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.40 3d7s h TYR 140 Cb 1.56 0.00 0.00 0.00 1.01 0.00 0.00 36.73 39.30 3d7s h TYR 140 CO -0.00 0.00 0.05 0.00 -1.05 0.00 0.00 178.16 177.16 3d7s n GLU 142 N -2.50 -1.40 -3.34 0.00 2.13 0.24 -4.98 120.64 110.80 3d7s n GLU 142 Ca -0.02 0.35 -0.33 0.00 0.66 0.00 0.00 57.16 57.82 3d7s n GLU 142 Cb 0.09 -4.65 -0.06 0.00 0.27 0.00 0.00 31.44 27.09 3d7s n GLU 142 CO 0.00 0.00 0.00 0.15 -0.41 0.00 0.00 177.13 176.87 3d7s s LYS 143 N -1.58 3.92 -0.20 5.31 -0.14 -1.25 -4.78 119.74 121.01 3d7s s LYS 143 Ca 0.00 0.44 -0.06 0.00 -1.36 0.00 0.00 55.97 54.99 3d7s s LYS 143 Cb 0.00 -2.72 -0.03 0.00 -1.68 0.00 0.00 37.83 33.40 3d7s s LYS 143 CO 0.00 0.35 0.02 -2.00 -0.76 0.00 0.00 175.35 172.96 3d7s s GLU 144 N -2.52 3.73 0.43 1.68 2.12 -1.26 -0.86 118.70 122.02 3d7s s GLU 144 Ca 0.45 -0.47 0.05 0.00 0.36 0.00 0.00 54.97 55.36 3d7s s GLU 144 Cb -0.13 -3.14 -0.06 0.00 0.26 0.00 0.00 34.13 31.07 3d7s s GLU 144 CO 0.20 0.08 0.02 -0.06 -0.54 0.00 0.00 175.26 174.96 3d7s s PHE 145 N 0.86 2.26 0.01 5.30 0.40 0.63 -4.93 117.98 122.50 3d7s s PHE 145 Ca 0.02 -0.80 -0.17 0.00 -0.60 0.00 0.00 56.93 55.37 3d7s s PHE 145 Cb -0.14 -1.65 -0.06 0.00 0.51 0.00 0.00 43.02 41.68 3d7s s PHE 145 CO 0.02 0.31 0.49 0.45 0.70 0.00 0.00 175.22 177.20 3d7s s SER 146 N -3.72 6.90 0.32 1.36 0.15 -1.26 -1.97 113.70 115.47 3d7s s SER 146 Ca 0.27 1.07 0.08 0.00 0.70 0.00 0.00 55.95 58.07 3d7s s SER 146 Cb 0.07 -2.31 0.79 0.00 -1.71 0.00 0.00 66.02 62.87 3d7s s SER 146 CO 0.14 0.24 1.78 1.12 1.20 0.00 0.00 173.24 177.72 3d7s h HIS 147 N 5.02 1.01 0.00 3.44 2.07 -1.77 0.92 115.15 125.85 3d7s h HIS 147 Ca -0.49 0.03 0.00 0.00 -2.85 0.00 0.00 60.37 57.06 3d7s h HIS 147 Cb 1.21 -0.30 0.00 0.00 2.57 0.00 0.00 27.41 30.89 3d7s h HIS 147 CO 0.68 0.21 0.00 -2.95 -3.07 0.00 0.00 177.93 172.80 3d7s h ASN 148 N 0.71 0.00 -0.26 3.10 -1.07 -1.94 -1.94 115.58 114.18 3d7s h ASN 148 Ca 0.57 0.00 -0.19 0.00 0.07 0.00 0.00 56.30 56.75 3d7s h ASN 148 Cb 0.97 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 37.22 3d7s h ASN 148 CO -0.36 0.00 -0.58 0.58 0.07 0.00 0.00 177.43 177.13 3d7s h VAL 149 N 0.00 1.28 0.12 6.14 2.07 0.46 -2.75 116.25 123.57 3d7s h VAL 149 Ca 0.00 -1.77 -0.29 0.00 0.82 0.00 0.00 66.70 65.46 3d7s h VAL 149 Cb 0.76 1.70 0.03 0.00 -1.52 0.00 0.00 31.29 32.26 3d7s h VAL 149 CO 0.00 0.57 -1.22 0.58 0.02 0.00 0.00 177.57 177.52 3d7s h VAL 150 N 0.63 1.29 0.00 2.57 2.07 -1.21 -3.33 116.25 118.27 3d7s h VAL 150 Ca 0.00 -2.44 -0.07 0.00 0.82 0.00 0.00 66.70 65.01 3d7s h VAL 150 Cb 1.20 2.69 -0.01 0.00 -1.52 0.00 0.00 31.29 33.65 3d7s h VAL 150 CO 0.13 0.74 -0.31 -0.07 0.02 0.00 0.00 177.57 178.08 3d7s h LEU 151 N 0.26 0.00 -2.12 2.57 4.07 -1.43 -3.04 115.31 115.61 3d7s h LEU 151 Ca -0.19 0.00 0.03 0.00 0.08 0.00 0.00 57.88 57.80 3d7s h LEU 151 Cb 1.90 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 43.64 3d7s h LEU 151 CO 0.24 0.31 0.30 0.00 -1.08 0.00 0.00 178.44 178.21 3d7s h ALA 152 N 1.69 1.48 0.00 1.53 0.00 -1.59 -3.51 119.26 118.86 3d7s h ALA 152 Ca -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3d7s h ALA 152 Cb 0.75 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.55 3d7s h ALA 152 CO 0.04 -0.35 0.00 0.09 0.00 0.00 0.00 179.25 179.03