#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k7s s ALA 2 N 0.00 2.50 -0.33 4.61 0.00 -1.26 -5.04 121.76 122.23 2k7s s ALA 2 Ca 0.00 0.20 0.01 0.00 0.00 0.00 0.00 51.96 52.17 2k7s s ALA 2 Cb 0.00 -3.23 0.10 0.00 0.00 0.00 0.00 23.12 20.00 2k7s s ALA 2 CO 0.00 -1.43 0.10 1.41 0.00 0.00 0.00 175.76 175.85 2k7s s MET 3 N -4.88 0.98 0.17 0.00 -2.45 -1.26 -4.95 119.30 106.91 2k7s s MET 3 Ca 0.60 -1.40 0.26 0.00 -1.25 0.00 0.00 55.69 53.90 2k7s s MET 3 Cb -0.16 -2.35 0.91 0.00 1.25 0.00 0.00 34.83 34.49 2k7s s MET 3 CO 0.54 -1.00 1.79 -3.47 1.05 0.00 0.00 175.02 173.93 2k7s n ASP 4 N 4.54 0.60 0.00 1.11 2.03 -1.26 -4.92 116.55 118.65 2k7s n ASP 4 Ca 0.01 0.57 0.00 0.00 0.52 0.00 0.00 54.79 55.89 2k7s n ASP 4 Cb 0.41 -0.73 0.00 0.00 -0.72 0.00 0.00 41.12 40.08 2k7s n ASP 4 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 2k7s n ASN 5 N -2.08 0.00 -4.28 1.67 3.02 -1.26 -4.57 115.26 107.75 2k7s n ASN 5 Ca 0.05 0.00 -0.22 0.00 -0.03 0.00 0.00 54.58 54.38 2k7s n ASN 5 Cb 0.37 0.00 -0.12 0.00 -0.61 0.00 0.00 39.78 39.42 2k7s n ASN 5 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 2k7s s VAL 6 N 0.00 1.65 -0.79 2.41 0.11 -1.26 -5.06 120.40 117.45 2k7s s VAL 6 Ca 0.00 -1.66 -0.26 0.00 -2.93 0.00 0.00 61.98 57.13 2k7s s VAL 6 Cb 0.00 -1.60 0.02 0.00 -1.53 0.00 0.00 36.38 33.27 2k7s s VAL 6 CO 0.00 -0.20 1.51 0.00 -3.33 0.00 0.00 175.10 173.09 2k7s n GLN 8 N 9.17 -3.13 0.00 0.00 6.02 -1.26 -5.05 117.38 123.13 2k7s n GLN 8 Ca 0.17 2.41 0.00 0.00 -0.01 0.00 0.00 57.00 59.57 2k7s n GLN 8 Cb 0.50 -2.94 0.00 0.00 1.02 0.00 0.00 30.24 28.82 2k7s n GLN 8 CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 177.06 175.70 2k7s n PRO 9 N -2.00 2.98 0.00 -1.09 -0.04 -1.26 -4.96 135.00 128.62 2k7s n PRO 9 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 2k7s n PRO 9 Cb 0.28 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.74 2k7s n PRO 9 CO 0.00 0.00 0.00 -2.37 -0.04 0.00 0.00 175.50 173.09 2k7s n THR 10 N 0.00 0.00 -3.64 0.52 5.66 -1.24 -4.60 114.28 110.97 2k7s n THR 10 Ca 0.00 0.00 -0.06 0.00 -3.05 0.00 0.00 64.05 60.94 2k7s n THR 10 Cb 0.00 0.00 -0.07 0.00 -1.55 0.00 0.00 70.33 68.71 2k7s n THR 10 CO 0.00 0.00 0.00 -1.83 -3.05 0.00 0.00 175.07 170.19 2k7s s GLU 11 N 0.00 0.44 -0.10 1.09 -1.05 -1.26 -0.44 118.70 117.38 2k7s s GLU 11 Ca 0.00 0.60 0.03 0.00 -0.15 0.00 0.00 54.97 55.45 2k7s s GLU 11 Cb 0.00 0.17 0.01 0.00 -0.44 0.00 0.00 34.13 33.87 2k7s s GLU 11 CO 0.00 -0.07 -0.18 -0.59 0.95 0.00 0.00 175.26 175.37 2k7s s PHE 12 N 0.65 2.12 -0.59 4.83 -0.12 0.11 -4.89 117.98 120.10 2k7s s PHE 12 Ca -0.01 -0.91 -0.28 0.00 -0.05 0.00 0.00 56.93 55.68 2k7s s PHE 12 Cb -0.04 -1.47 0.03 0.00 -0.63 0.00 0.00 43.02 40.91 2k7s s PHE 12 CO -0.10 -0.42 1.16 0.42 -0.05 0.00 0.00 175.22 176.23 2k7s s ILE 13 N 0.65 4.05 -0.14 -4.49 1.01 -1.26 -1.71 121.20 119.31 2k7s s ILE 13 Ca -0.13 0.78 0.01 0.00 0.00 0.00 0.00 60.65 61.31 2k7s s ILE 13 Cb -0.16 -4.71 -0.00 0.00 0.01 0.00 0.00 42.46 37.59 2k7s s ILE 13 CO 0.04 -1.35 -0.16 -0.55 0.00 0.00 0.00 174.94 172.92 2k7s s SER 14 N 3.00 3.63 0.30 3.58 0.15 -0.57 -0.36 113.70 123.42 2k7s s SER 14 Ca 0.41 -0.46 -0.01 0.00 0.70 0.00 0.00 55.95 56.59 2k7s s SER 14 Cb -0.08 -1.55 -0.04 0.00 -1.71 0.00 0.00 66.02 62.64 2k7s s SER 14 CO 0.24 0.11 0.51 -0.13 1.20 0.00 0.00 173.24 175.17 2k7s s ARG 15 N 0.66 3.52 0.15 5.44 0.52 0.11 -1.16 118.95 128.21 2k7s s ARG 15 Ca -0.08 -0.27 -0.24 0.00 -0.52 0.00 0.00 55.73 54.62 2k7s s ARG 15 Cb -0.16 -2.70 0.08 0.00 0.52 0.00 0.00 34.95 32.69 2k7s s ARG 15 CO 0.02 0.23 1.06 -3.38 0.02 0.00 0.00 175.30 173.24 2k7s s HIS 16 N -2.16 0.03 0.73 -0.53 -3.43 -0.89 0.05 115.29 109.10 2k7s s HIS 16 Ca 0.40 -0.37 -0.02 0.00 -0.80 0.00 0.00 55.06 54.27 2k7s s HIS 16 Cb -0.10 0.67 0.13 0.00 -1.43 0.00 0.00 32.58 31.85 2k7s s HIS 16 CO 0.33 -0.82 1.01 0.54 -2.00 0.00 0.00 174.74 173.80 2k7s s ASN 17 N -3.33 4.29 0.39 7.38 4.22 -0.69 -0.70 114.94 126.51 2k7s s ASN 17 Ca 0.20 -0.26 0.15 0.00 -2.14 0.00 0.00 52.86 50.81 2k7s s ASN 17 Cb -0.02 -0.12 0.99 0.00 1.28 0.00 0.00 41.25 43.38 2k7s s ASN 17 CO 0.04 -1.90 1.84 -0.29 -2.04 0.00 0.00 177.10 174.74 2k7s h ILE 18 N -0.60 0.69 -0.52 0.54 6.09 -1.92 0.42 117.51 122.21 2k7s h ILE 18 Ca -0.38 -0.17 0.02 0.00 -1.37 0.00 0.00 64.86 62.96 2k7s h ILE 18 Cb 1.27 0.14 -0.03 0.00 0.47 0.00 0.00 36.82 38.67 2k7s h ILE 18 CO 0.41 0.09 0.34 -0.33 -3.07 0.00 0.00 178.15 175.60 2k7s h GLU 19 N 0.50 0.61 0.00 2.19 4.39 -1.97 -3.46 114.58 116.85 2k7s h GLU 19 Ca 0.50 -0.04 0.00 0.00 0.34 0.00 0.00 59.36 60.16 2k7s h GLU 19 Cb 1.09 -0.14 0.00 0.00 -0.10 0.00 0.00 28.75 29.61 2k7s h GLU 19 CO -0.22 0.40 0.00 0.41 -1.16 0.00 0.00 179.01 178.44 2k7s n GLY 20 N -1.47 1.07 3.63 -3.84 0.00 0.15 -4.70 105.19 100.02 2k7s n GLY 20 Ca 0.05 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.61 2k7s n GLY 20 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2k7s n ILE 21 N -0.53 0.50 -1.70 -0.61 2.08 -1.26 -1.24 119.36 116.61 2k7s n ILE 21 Ca 0.00 -0.20 -0.43 0.00 0.56 0.00 0.00 62.75 62.68 2k7s n ILE 21 Cb 0.00 -2.03 -0.03 0.00 -0.75 0.00 0.00 39.64 36.83 2k7s n ILE 21 CO 0.00 0.00 0.00 -0.36 0.56 0.00 0.00 176.55 176.75 2k7s s PHE 22 N 5.45 1.31 -1.85 1.39 0.08 -0.36 -1.71 117.98 122.29 2k7s s PHE 22 Ca 0.96 0.63 0.27 0.00 0.12 0.00 0.00 56.93 58.91 2k7s s PHE 22 Cb -0.62 -3.95 0.91 0.00 -0.57 0.00 0.00 43.02 38.79 2k7s s PHE 22 CO 0.47 -3.71 1.66 0.25 -0.10 0.00 0.00 175.22 173.79 2k7s n THR 23 N 7.70 0.00 -3.60 0.64 -2.24 0.11 -0.36 114.28 116.53 2k7s n THR 23 Ca 0.29 -0.13 -0.08 0.00 -2.27 0.00 0.00 64.05 61.86 2k7s n THR 23 Cb 0.46 0.30 -0.05 0.00 -2.10 0.00 0.00 70.33 68.94 2k7s n THR 23 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 2k7s s PHE 24 N -2.41 -0.26 -0.13 4.78 5.36 -0.91 -4.92 117.98 119.50 2k7s s PHE 24 Ca 0.28 0.44 -0.05 0.00 -0.96 0.00 0.00 56.93 56.63 2k7s s PHE 24 Cb 0.20 0.47 0.06 0.00 -0.34 0.00 0.00 43.02 43.40 2k7s s PHE 24 CO 0.48 -0.24 0.28 0.08 -1.46 0.00 0.00 175.22 174.36 2k7s s VAL 25 N -1.09 -0.22 0.18 3.12 1.01 -1.26 0.08 120.40 122.22 2k7s s VAL 25 Ca 0.02 0.20 -0.30 0.00 0.00 0.00 0.00 61.98 61.89 2k7s s VAL 25 Cb -0.01 -0.44 -0.08 0.00 0.00 0.00 0.00 36.38 35.85 2k7s s VAL 25 CO -0.02 0.08 1.31 -0.62 0.00 0.00 0.00 175.10 175.86 2k7s s ASP 26 N 1.82 6.90 0.18 3.32 2.15 0.51 -4.63 116.67 126.93 2k7s s ASP 26 Ca -0.05 2.37 0.07 0.00 0.43 0.00 0.00 52.55 55.37 2k7s s ASP 26 Cb -0.11 -2.60 0.38 0.00 -0.30 0.00 0.00 42.92 40.28 2k7s s ASP 26 CO -0.09 -0.54 1.05 0.00 -0.17 0.00 0.00 175.17 175.42 2k7s n HIS 27 N 2.89 0.23 0.24 -5.34 1.44 -1.26 -0.50 115.22 112.92 2k7s n HIS 27 Ca 0.07 0.12 0.10 0.00 -2.01 0.00 0.00 57.72 56.01 2k7s n HIS 27 Cb 0.43 -0.48 0.59 0.00 0.12 0.00 0.00 29.99 30.65 2k7s n HIS 27 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2k7s h ARG 28 N 0.00 0.00 -0.63 -1.40 3.08 -1.90 -3.06 114.38 110.48 2k7s h ARG 28 Ca 0.00 0.00 0.18 0.00 0.07 0.00 0.00 59.98 60.23 2k7s h ARG 28 Cb 0.56 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.59 2k7s h ARG 28 CO 0.00 0.19 0.62 0.00 -1.07 0.00 0.00 179.97 179.71 2k7s h VAL 30 N 0.00 1.51 0.00 0.00 -1.51 -1.40 0.30 116.25 115.15 2k7s h VAL 30 Ca 0.30 -2.70 -0.19 0.00 -1.23 0.00 0.00 66.70 62.88 2k7s h VAL 30 Cb 1.53 2.52 -0.03 0.00 -2.13 0.00 0.00 31.29 33.19 2k7s h VAL 30 CO -0.00 0.79 -0.92 0.00 -1.23 0.00 0.00 177.57 176.20 2k7s h ALA 31 N 0.95 0.47 0.00 5.19 0.00 -0.96 -0.49 119.26 124.43 2k7s h ALA 31 Ca -0.05 -0.82 -0.00 0.00 0.00 0.00 0.00 54.91 54.04 2k7s h ALA 31 Cb 1.56 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.26 2k7s h ALA 31 CO 0.14 1.10 -0.00 1.15 0.00 0.00 0.00 179.25 181.63 2k7s h THR 32 N 0.00 0.16 -0.08 0.00 2.02 -0.88 -3.32 112.91 110.82 2k7s h THR 32 Ca -0.03 -1.12 0.00 0.00 0.77 0.00 0.00 66.41 66.03 2k7s h THR 32 Cb 1.68 0.30 0.00 0.00 -1.74 0.00 0.00 68.15 68.39 2k7s h THR 32 CO 0.11 0.05 0.00 1.33 0.37 0.00 0.00 175.52 177.38 2k7s n VAL 33 N -4.77 1.16 0.00 3.16 0.24 0.99 -4.78 118.33 114.34 2k7s n VAL 33 Ca -0.01 -1.19 0.00 0.00 -2.04 0.00 0.00 64.34 61.10 2k7s n VAL 33 Cb 0.04 0.38 0.00 0.00 -1.47 0.00 0.00 33.84 32.80 2k7s n VAL 33 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2k7s n GLY 34 N -0.40 1.80 3.64 7.63 0.00 -0.19 0.03 105.19 117.70 2k7s n GLY 34 Ca 0.05 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.64 2k7s n GLY 34 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2k7s s TYR 35 N 0.00 2.50 0.90 1.61 2.02 -1.20 -4.54 117.35 118.63 2k7s s TYR 35 Ca 0.00 0.75 -0.11 0.00 -0.37 0.00 0.00 57.07 57.34 2k7s s TYR 35 Cb 0.00 -3.82 0.13 0.00 -0.40 0.00 0.00 41.96 37.87 2k7s s TYR 35 CO 0.00 -2.26 1.08 1.04 -1.57 0.00 0.00 175.55 173.84 2k7s n GLN 36 N 7.20 -0.34 -0.33 -0.62 6.02 -1.26 -2.75 117.38 125.30 2k7s n GLN 36 Ca 0.16 -0.03 0.20 0.00 -0.01 0.00 0.00 57.00 57.32 2k7s n GLN 36 Cb 0.45 -2.33 0.45 0.00 1.02 0.00 0.00 30.24 29.83 2k7s n GLN 36 CO 0.00 0.00 0.00 -1.35 -1.01 0.00 0.00 177.06 174.70 2k7s h PRO 37 N -1.69 0.48 -0.00 -1.09 0.11 -1.83 0.65 132.00 128.62 2k7s h PRO 37 Ca -0.44 -0.03 -0.13 0.00 0.11 0.00 0.00 66.00 65.52 2k7s h PRO 37 Cb 1.28 -0.11 -0.02 0.00 0.11 0.00 0.00 31.00 32.26 2k7s h PRO 37 CO 0.41 0.32 -0.60 -0.56 -0.21 0.00 0.00 178.00 177.36 2k7s h GLN 38 N 0.49 0.01 0.00 1.05 3.07 -1.89 0.28 115.11 118.12 2k7s h GLN 38 Ca 0.62 -0.01 0.00 0.00 0.09 0.00 0.00 58.65 59.35 2k7s h GLN 38 Cb 1.35 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.92 2k7s h GLN 38 CO -0.38 0.60 0.00 -1.91 0.09 0.00 0.00 178.83 177.24 2k7s n GLU 39 N -3.83 0.05 -0.04 0.06 0.00 0.22 -3.06 120.64 114.04 2k7s n GLU 39 Ca -0.01 0.21 -0.05 0.00 0.00 0.00 0.00 57.16 57.31 2k7s n GLU 39 Cb 0.60 -1.50 -0.04 0.00 0.00 0.00 0.00 31.44 30.50 2k7s n GLU 39 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.13 178.41 2k7s n LEU 40 N -1.45 2.33 -4.65 4.31 7.99 -0.91 -4.85 117.00 119.78 2k7s n LEU 40 Ca 0.05 -0.03 -0.49 0.00 -0.01 0.00 0.00 56.01 55.52 2k7s n LEU 40 Cb 0.17 -0.18 -0.05 0.00 -0.11 0.00 0.00 43.42 43.25 2k7s n LEU 40 CO 0.14 0.53 1.14 0.18 -1.51 0.00 0.00 177.39 177.86 2k7s n LEU 41 N -2.62 2.62 0.00 2.23 4.77 0.93 -0.22 117.00 124.72 2k7s n LEU 41 Ca -0.13 1.08 0.00 0.00 -0.03 0.00 0.00 56.01 56.93 2k7s n LEU 41 Cb 0.66 -1.33 0.00 0.00 -2.33 0.00 0.00 43.42 40.42 2k7s n LEU 41 CO 0.09 -0.51 0.00 0.61 -1.33 0.00 0.00 177.39 176.24 2k7s n GLY 42 N 3.29 1.59 3.82 -0.72 0.00 0.52 -4.92 105.19 108.77 2k7s n GLY 42 Ca 0.19 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.84 2k7s n GLY 42 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k7s s LYS 43 N -0.28 3.30 -0.15 1.61 1.02 0.70 -4.71 119.74 121.24 2k7s s LYS 43 Ca 0.00 -0.22 -0.29 0.00 0.02 0.00 0.00 55.97 55.48 2k7s s LYS 43 Cb 0.00 -3.07 -0.04 0.00 -0.52 0.00 0.00 37.83 34.20 2k7s s LYS 43 CO 0.00 0.75 1.66 1.21 -0.92 0.00 0.00 175.35 178.05 2k7s s ASN 44 N -1.03 6.47 0.30 2.83 3.84 -1.26 -1.22 114.94 124.87 2k7s s ASN 44 Ca 0.15 1.91 0.06 0.00 0.21 0.00 0.00 52.86 55.19 2k7s s ASN 44 Cb -0.12 -2.53 0.78 0.00 -0.55 0.00 0.00 41.25 38.83 2k7s s ASN 44 CO 0.04 -1.14 1.72 -0.29 -2.79 0.00 0.00 177.10 174.64 2k7s h ILE 45 N 5.93 0.52 0.00 -5.21 2.10 -1.45 0.23 117.51 119.63 2k7s h ILE 45 Ca -0.36 -0.17 -0.09 0.00 1.08 0.00 0.00 64.86 65.32 2k7s h ILE 45 Cb 1.17 -0.02 -0.01 0.00 -1.09 0.00 0.00 36.82 36.87 2k7s h ILE 45 CO 0.98 0.09 -0.42 -0.37 -1.08 0.00 0.00 178.15 177.35 2k7s h VAL 46 N 0.50 1.13 -0.73 2.19 -1.51 -1.84 -2.53 116.25 113.46 2k7s h VAL 46 Ca 0.59 -1.52 0.21 0.00 -1.23 0.00 0.00 66.70 64.75 2k7s h VAL 46 Cb 1.09 1.86 -0.03 0.00 -2.13 0.00 0.00 31.29 32.08 2k7s h VAL 46 CO -0.49 0.41 0.54 -0.33 -1.23 0.00 0.00 177.57 176.47 2k7s h GLU 47 N 0.00 0.00 0.07 5.19 5.08 -0.91 0.37 114.58 124.38 2k7s h GLU 47 Ca -0.00 0.00 -0.32 0.00 -1.00 0.00 0.00 59.36 58.04 2k7s h GLU 47 Cb 0.83 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.05 2k7s h GLU 47 CO 0.05 0.00 -1.74 0.74 -1.00 0.00 0.00 179.01 177.07 2k7s h PHE 48 N 0.00 0.28 -3.79 4.33 -1.00 -1.50 -3.47 116.94 111.79 2k7s h PHE 48 Ca 0.35 -0.20 -0.56 0.00 2.81 0.00 0.00 57.97 60.37 2k7s h PHE 48 Cb 1.43 -0.01 0.13 0.00 3.61 0.00 0.00 35.95 41.11 2k7s h PHE 48 CO 0.00 1.36 0.56 0.00 -1.61 0.00 0.00 178.31 178.62 2k7s n HIS 50 N -0.48 2.37 -0.17 0.00 -0.00 0.71 -4.65 115.22 113.00 2k7s n HIS 50 Ca 0.07 0.38 -0.13 0.00 0.46 0.00 0.00 57.72 58.50 2k7s n HIS 50 Cb 0.42 -2.50 -0.10 0.00 -0.12 0.00 0.00 29.99 27.69 2k7s n HIS 50 CO 0.00 0.00 0.00 -1.35 0.46 0.00 0.00 176.34 175.45 2k7s h PRO 51 N 4.37 -0.33 0.00 1.57 0.11 -1.90 0.38 132.00 136.20 2k7s h PRO 51 Ca -0.46 0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.68 2k7s h PRO 51 Cb 1.26 0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.45 2k7s h PRO 51 CO 0.77 -0.22 0.13 0.93 -0.21 0.00 0.00 178.00 179.40 2k7s h GLU 52 N -0.34 0.00 0.00 1.05 5.08 -2.00 0.13 114.58 118.49 2k7s h GLU 52 Ca 0.08 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.44 2k7s h GLU 52 Cb 0.56 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.81 2k7s h GLU 52 CO -0.62 0.00 -1.65 -0.25 -1.00 0.00 0.00 179.01 175.49 2k7s n ASP 53 N -2.49 0.62 -0.09 1.42 9.92 0.95 -4.40 116.55 122.49 2k7s n ASP 53 Ca -0.02 -0.23 0.02 0.00 -0.53 0.00 0.00 54.79 54.04 2k7s n ASP 53 Cb 0.17 1.68 0.34 0.00 -0.64 0.00 0.00 41.12 42.67 2k7s n ASP 53 CO 0.00 0.00 0.00 1.56 0.13 0.00 0.00 177.20 178.89 2k7s h GLN 54 N 0.00 0.72 -0.25 -1.24 4.20 0.16 -0.52 115.11 118.19 2k7s h GLN 54 Ca 0.00 -0.05 -0.01 0.00 0.06 0.00 0.00 58.65 58.65 2k7s h GLN 54 Cb 0.79 -0.16 -0.01 0.00 0.30 0.00 0.00 27.48 28.39 2k7s h GLN 54 CO 0.00 0.49 0.12 0.37 -0.67 0.00 0.00 178.83 179.15 2k7s h GLN 55 N 0.74 0.34 0.10 1.46 5.75 -1.77 0.19 115.11 121.92 2k7s h GLN 55 Ca 0.20 -0.03 -0.28 0.00 -0.15 0.00 0.00 58.65 58.38 2k7s h GLN 55 Cb -0.05 -0.07 0.03 0.00 1.07 0.00 0.00 27.48 28.45 2k7s h GLN 55 CO -0.04 0.26 -1.17 1.25 -2.65 0.00 0.00 178.83 176.48 2k7s h LEU 56 N 0.34 0.86 0.63 -2.39 5.85 -1.41 -1.98 115.31 117.20 2k7s h LEU 56 Ca 0.09 -0.81 -0.03 0.00 0.84 0.00 0.00 57.88 57.96 2k7s h LEU 56 Cb 0.03 -0.27 0.01 0.00 0.37 0.00 0.00 40.66 40.80 2k7s h LEU 56 CO -0.01 1.58 -0.30 0.25 -0.34 0.00 0.00 178.44 179.61 2k7s h LEU 57 N 0.25 -0.71 -1.63 2.25 5.85 -0.48 -1.15 115.31 119.68 2k7s h LEU 57 Ca -0.17 -0.02 0.08 0.00 0.84 0.00 0.00 57.88 58.61 2k7s h LEU 57 Cb 1.85 0.18 -0.03 0.00 0.37 0.00 0.00 40.66 43.03 2k7s h LEU 57 CO 0.23 -0.42 0.38 0.03 -0.34 0.00 0.00 178.44 178.32 2k7s h ARG 58 N -0.99 0.42 -0.46 1.25 3.08 -0.77 -0.75 114.38 116.16 2k7s h ARG 58 Ca -0.09 -0.03 -0.01 0.00 0.07 0.00 0.00 59.98 59.93 2k7s h ARG 58 Cb 0.69 -0.09 -0.02 0.00 0.08 0.00 0.00 29.97 30.62 2k7s h ARG 58 CO 0.14 0.28 0.25 0.22 -1.07 0.00 0.00 179.97 179.78 2k7s h ASP 59 N 0.43 0.59 0.12 7.04 3.58 -1.03 -0.36 116.42 126.80 2k7s h ASP 59 Ca 0.26 -0.10 0.02 0.00 0.42 0.00 0.00 57.03 57.63 2k7s h ASP 59 Cb 0.45 -0.15 -0.04 0.00 1.72 0.00 0.00 39.33 41.31 2k7s h ASP 59 CO -0.07 0.52 -0.33 0.28 -2.88 0.00 0.00 179.24 176.75 2k7s h SER 60 N 0.61 -0.97 -0.74 2.28 0.02 0.12 0.04 113.55 114.92 2k7s h SER 60 Ca 0.16 0.11 0.12 0.00 -0.84 0.00 0.00 61.79 61.34 2k7s h SER 60 Cb 0.07 0.37 -0.05 0.00 0.14 0.00 0.00 62.40 62.93 2k7s h SER 60 CO -0.02 -0.42 0.49 -0.26 -1.14 0.00 0.00 176.83 175.47 2k7s h PHE 61 N -0.56 0.58 -0.14 3.45 0.04 -1.05 0.24 116.94 119.49 2k7s h PHE 61 Ca 0.03 0.02 -0.10 0.00 2.80 0.00 0.00 57.97 60.72 2k7s h PHE 61 Cb 0.59 -0.18 -0.01 0.00 2.20 0.00 0.00 35.95 38.54 2k7s h PHE 61 CO -0.30 0.25 -0.34 1.96 -0.60 0.00 0.00 178.31 179.28 2k7s h GLN 62 N 0.52 0.29 0.05 1.51 1.08 0.17 -2.15 115.11 116.58 2k7s h GLN 62 Ca 0.35 -0.12 -0.21 0.00 -1.45 0.00 0.00 58.65 57.22 2k7s h GLN 62 Cb 0.65 -0.01 0.02 0.00 -0.05 0.00 0.00 27.48 28.09 2k7s h GLN 62 CO -0.12 0.61 -0.83 1.96 -0.95 0.00 0.00 178.83 179.49 2k7s h GLN 63 N 0.25 0.48 -0.61 1.46 1.08 0.12 -0.74 115.11 117.15 2k7s h GLN 63 Ca 0.03 -0.58 -0.05 0.00 -1.45 0.00 0.00 58.65 56.60 2k7s h GLN 63 Cb 0.73 0.18 -0.03 0.00 -0.05 0.00 0.00 27.48 28.32 2k7s h GLN 63 CO 0.06 1.22 0.17 -0.39 -0.95 0.00 0.00 178.83 178.93 2k7s h VAL 64 N -0.00 1.24 0.00 -0.54 -1.51 -0.97 0.03 116.25 114.50 2k7s h VAL 64 Ca -0.12 -0.85 -0.13 0.00 -1.23 0.00 0.00 66.70 64.37 2k7s h VAL 64 Cb 1.55 0.59 -0.02 0.00 -2.13 0.00 0.00 31.29 31.28 2k7s h VAL 64 CO 0.16 0.32 -0.60 1.62 -1.23 0.00 0.00 177.57 177.85 2k7s h VAL 65 N 0.91 1.03 -0.15 7.19 3.04 -1.46 0.18 116.25 127.00 2k7s h VAL 65 Ca 0.20 -2.43 -0.12 0.00 -1.01 0.00 0.00 66.70 63.34 2k7s h VAL 65 Cb 0.30 2.49 0.00 0.00 -2.01 0.00 0.00 31.29 32.07 2k7s h VAL 65 CO -0.00 0.58 -0.37 0.11 -1.01 0.00 0.00 177.57 176.88 2k7s h LYS 66 N 0.00 0.51 -0.50 4.17 1.57 -0.64 -3.06 116.57 118.63 2k7s h LYS 66 Ca -0.01 -0.35 0.00 0.00 -1.87 0.00 0.00 60.65 58.42 2k7s h LYS 66 Cb 1.44 0.05 0.00 0.00 0.08 0.00 0.00 32.23 33.81 2k7s h LYS 66 CO 0.08 0.97 0.00 1.28 -0.57 0.00 0.00 179.45 181.20 2k7s n LEU 67 N -4.32 2.87 -1.84 2.94 4.77 -0.05 -4.99 117.00 116.38 2k7s n LEU 67 Ca -0.07 -1.40 -0.13 0.00 -0.03 0.00 0.00 56.01 54.39 2k7s n LEU 67 Cb 0.52 -0.33 0.01 0.00 -2.33 0.00 0.00 43.42 41.29 2k7s n LEU 67 CO 0.44 0.70 -0.11 0.29 -1.33 0.00 0.00 177.39 177.39 2k7s n LYS 68 N 1.07 -0.62 0.00 3.23 4.76 0.54 -3.31 118.16 123.84 2k7s n LYS 68 Ca 0.18 0.47 0.00 0.00 -2.87 0.00 0.00 58.31 56.09 2k7s n LYS 68 Cb 0.46 -0.66 0.00 0.00 -1.84 0.00 0.00 35.03 32.99 2k7s n LYS 68 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2k7s n GLY 69 N 0.02 3.72 3.68 0.72 0.00 -0.68 -4.95 105.19 107.69 2k7s n GLY 69 Ca -0.03 -0.97 -0.50 0.00 0.00 0.00 0.00 46.02 44.52 2k7s n GLY 69 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 2k7s n GLN 70 N 0.00 1.94 -2.81 1.61 -0.06 -1.21 -4.40 117.38 112.46 2k7s n GLN 70 Ca 0.00 0.71 -0.37 0.00 -2.00 0.00 0.00 57.00 55.34 2k7s n GLN 70 Cb 0.00 -2.50 -0.06 0.00 -4.06 0.00 0.00 30.24 23.62 2k7s n GLN 70 CO 0.00 0.00 0.00 0.54 -0.20 0.00 0.00 177.06 177.40 2k7s s VAL 71 N 3.09 4.23 0.07 1.69 0.11 -1.26 -4.04 120.40 124.29 2k7s s VAL 71 Ca 0.90 1.80 0.06 0.00 -2.93 0.00 0.00 61.98 61.81 2k7s s VAL 71 Cb -0.77 -4.03 -0.04 0.00 -1.53 0.00 0.00 36.38 30.02 2k7s s VAL 71 CO 0.51 0.18 -0.09 -0.76 -3.33 0.00 0.00 175.10 171.61 2k7s s LEU 72 N -1.96 3.08 -0.17 2.54 2.01 0.12 -4.95 118.68 119.35 2k7s s LEU 72 Ca 0.49 -0.30 -0.00 0.00 0.01 0.00 0.00 54.13 54.32 2k7s s LEU 72 Cb -0.19 -1.84 0.04 0.00 0.01 0.00 0.00 46.19 44.22 2k7s s LEU 72 CO 0.24 0.22 -0.05 -0.55 1.01 0.00 0.00 176.35 177.22 2k7s s SER 73 N -1.91 2.88 -0.01 2.29 0.15 -1.24 -1.81 113.70 114.04 2k7s s SER 73 Ca 0.20 -0.69 0.00 0.00 0.70 0.00 0.00 55.95 56.16 2k7s s SER 73 Cb -0.11 -0.92 0.01 0.00 -1.71 0.00 0.00 66.02 63.29 2k7s s SER 73 CO 0.12 -0.19 -0.00 0.68 1.20 0.00 0.00 173.24 175.04 2k7s s VAL 74 N 1.62 0.08 -0.20 4.45 -7.23 -1.10 -4.93 120.40 113.09 2k7s s VAL 74 Ca 0.00 0.02 -0.12 0.00 -1.81 0.00 0.00 61.98 60.08 2k7s s VAL 74 Cb -0.15 -0.12 -0.05 0.00 0.56 0.00 0.00 36.38 36.62 2k7s s VAL 74 CO -0.08 0.06 0.21 -0.04 -0.31 0.00 0.00 175.10 174.94 2k7s s MET 75 N 0.35 4.17 0.13 4.82 -1.94 -1.26 -0.58 119.30 125.00 2k7s s MET 75 Ca -0.03 -0.11 -0.02 0.00 -1.71 0.00 0.00 55.69 53.82 2k7s s MET 75 Cb -0.05 -3.47 -0.03 0.00 2.01 0.00 0.00 34.83 33.29 2k7s s MET 75 CO -0.01 0.18 0.09 -0.59 -0.01 0.00 0.00 175.02 174.68 2k7s s PHE 76 N 0.68 0.77 -0.43 -0.03 -0.71 -0.17 -4.94 117.98 113.15 2k7s s PHE 76 Ca 0.11 -1.15 -0.18 0.00 -1.04 0.00 0.00 56.93 54.67 2k7s s PHE 76 Cb -0.13 -0.41 0.02 0.00 -1.21 0.00 0.00 43.02 41.30 2k7s s PHE 76 CO 0.02 -0.54 0.48 1.03 -1.34 0.00 0.00 175.22 174.87 2k7s s ARG 77 N -4.03 3.12 -0.50 1.99 0.52 -1.26 -0.29 118.95 118.51 2k7s s ARG 77 Ca 0.22 -0.71 -0.20 0.00 -0.52 0.00 0.00 55.73 54.53 2k7s s ARG 77 Cb 0.07 -3.98 0.05 0.00 0.52 0.00 0.00 34.95 31.61 2k7s s ARG 77 CO 0.01 -0.91 0.64 0.12 0.02 0.00 0.00 175.30 175.18 2k7s s PHE 78 N 2.27 3.04 -0.27 -0.53 2.19 0.56 -0.21 117.98 125.04 2k7s s PHE 78 Ca 0.14 -0.44 -0.28 0.00 0.33 0.00 0.00 56.93 56.68 2k7s s PHE 78 Cb -0.17 -3.51 -0.03 0.00 -1.31 0.00 0.00 43.02 38.00 2k7s s PHE 78 CO 0.14 -1.01 1.97 0.50 1.83 0.00 0.00 175.22 178.65 2k7s s ARG 79 N 2.71 3.29 0.55 10.12 3.00 -0.92 -1.04 118.95 136.66 2k7s s ARG 79 Ca 0.17 1.72 -0.03 0.00 -1.00 0.00 0.00 55.73 56.59 2k7s s ARG 79 Cb -0.18 -4.26 0.12 0.00 0.00 0.00 0.00 34.95 30.62 2k7s s ARG 79 CO 0.13 -1.91 0.75 0.45 0.00 0.00 0.00 175.30 174.73 2k7s n SER 80 N 10.71 0.71 0.20 -2.12 2.88 -0.93 -4.83 113.62 120.24 2k7s n SER 80 Ca 0.26 -1.67 0.13 0.00 -1.33 0.00 0.00 58.87 56.26 2k7s n SER 80 Cb 0.46 -0.52 0.71 0.00 -0.75 0.00 0.00 64.21 64.11 2k7s n SER 80 CO 0.00 0.00 0.00 0.50 -1.23 0.00 0.00 175.04 174.31 2k7s h LYS 81 N 0.00 0.00 -0.07 -1.46 1.63 -0.72 0.31 116.57 116.26 2k7s h LYS 81 Ca -0.25 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.55 2k7s h LYS 81 Cb 0.84 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.47 2k7s h LYS 81 CO 0.24 0.00 0.00 0.09 -3.45 0.00 0.00 179.45 176.33 2k7s n ASN 82 N -2.42 2.22 -3.00 4.20 5.03 -1.26 -4.96 115.26 115.07 2k7s n ASN 82 Ca -0.02 -1.74 -0.13 0.00 0.87 0.00 0.00 54.58 53.55 2k7s n ASN 82 Cb 0.07 -0.03 0.07 0.00 -1.02 0.00 0.00 39.78 38.87 2k7s n ASN 82 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2k7s n GLN 83 N 0.72 -4.07 -3.86 3.52 6.02 0.11 -5.04 117.38 114.78 2k7s n GLN 83 Ca 0.17 0.71 -0.12 0.00 -0.01 0.00 0.00 57.00 57.75 2k7s n GLN 83 Cb 0.46 -5.23 -0.14 0.00 1.02 0.00 0.00 30.24 26.35 2k7s n GLN 83 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 177.06 174.84 2k7s s GLU 84 N -4.75 0.01 -0.92 -1.09 0.41 -1.26 -4.90 118.70 106.20 2k7s s GLU 84 Ca 0.15 0.03 -0.24 0.00 -0.41 0.00 0.00 54.97 54.50 2k7s s GLU 84 Cb -0.02 -0.02 -0.06 0.00 -1.78 0.00 0.00 34.13 32.25 2k7s s GLU 84 CO 0.61 -0.02 1.98 -1.58 -0.49 0.00 0.00 175.26 175.76 2k7s s TRP 85 N 0.11 1.77 -0.64 1.61 0.23 -1.26 -2.18 118.94 118.58 2k7s s TRP 85 Ca -0.01 0.72 -0.28 0.00 -2.03 0.00 0.00 56.10 54.51 2k7s s TRP 85 Cb -0.01 -3.99 0.03 0.00 0.03 0.00 0.00 33.47 29.52 2k7s s TRP 85 CO -0.00 -1.68 1.28 -0.51 0.96 0.00 0.00 176.95 177.00 2k7s s LEU 86 N 10.54 3.33 0.12 2.99 1.43 -0.20 -4.67 118.68 132.22 2k7s s LEU 86 Ca 0.72 -0.07 -0.31 0.00 -1.03 0.00 0.00 54.13 53.44 2k7s s LEU 86 Cb -0.07 -2.90 -0.10 0.00 0.03 0.00 0.00 46.19 43.15 2k7s s LEU 86 CO 0.01 -1.68 1.73 0.26 0.23 0.00 0.00 176.35 176.90 2k7s s TRP 87 N 5.54 2.43 0.13 0.29 0.52 -1.26 -0.32 118.94 126.26 2k7s s TRP 87 Ca 0.42 0.21 0.02 0.00 0.02 0.00 0.00 56.10 56.76 2k7s s TRP 87 Cb -0.08 -4.07 -0.04 0.00 -1.15 0.00 0.00 33.47 28.12 2k7s s TRP 87 CO 0.21 -4.30 -0.03 -1.64 0.02 0.00 0.00 176.95 171.21 2k7s s MET 88 N 2.35 0.94 -0.16 4.98 -1.94 0.60 -1.23 119.30 124.84 2k7s s MET 88 Ca 0.77 -1.41 0.01 0.00 -1.71 0.00 0.00 55.69 53.35 2k7s s MET 88 Cb -0.44 -0.20 0.02 0.00 2.01 0.00 0.00 34.83 36.22 2k7s s MET 88 CO 0.34 -0.07 -0.20 1.03 -0.01 0.00 0.00 175.02 176.11 2k7s s ARG 89 N -3.88 2.88 -0.02 2.03 0.52 0.47 -1.00 118.95 119.96 2k7s s ARG 89 Ca 0.17 -0.79 -0.11 0.00 -0.52 0.00 0.00 55.73 54.48 2k7s s ARG 89 Cb 0.06 -2.45 -0.05 0.00 0.52 0.00 0.00 34.95 33.02 2k7s s ARG 89 CO -0.01 -0.16 0.33 0.95 0.02 0.00 0.00 175.30 176.42 2k7s s THR 90 N 1.19 5.18 -0.74 0.02 -4.23 0.25 -0.96 115.64 116.35 2k7s s THR 90 Ca 0.02 0.55 0.04 0.00 -1.18 0.00 0.00 61.69 61.12 2k7s s THR 90 Cb -0.14 -3.61 0.26 0.00 1.34 0.00 0.00 72.50 70.35 2k7s s THR 90 CO -0.10 0.52 0.88 -1.20 -0.54 0.00 0.00 174.62 174.19 2k7s n SER 91 N 1.64 4.29 -4.66 3.99 7.64 -0.63 -2.73 113.62 123.15 2k7s n SER 91 Ca -0.14 -3.42 -0.42 0.00 1.01 0.00 0.00 58.87 55.90 2k7s n SER 91 Cb 0.53 -0.81 -0.03 0.00 -1.01 0.00 0.00 64.21 62.89 2k7s n SER 91 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2k7s s SER 92 N -2.20 7.01 -0.17 6.43 0.01 -0.75 -2.52 113.70 121.50 2k7s s SER 92 Ca 0.37 1.25 -0.26 0.00 1.31 0.00 0.00 55.95 58.62 2k7s s SER 92 Cb 0.11 -2.49 0.06 0.00 0.21 0.00 0.00 66.02 63.92 2k7s s SER 92 CO -0.00 -0.51 0.65 0.00 0.41 0.00 0.00 173.24 173.80 2k7s s GLN 93 N 2.58 0.88 -0.49 12.44 -2.07 -0.45 0.14 119.66 132.67 2k7s s GLN 93 Ca 0.40 0.63 -0.46 0.00 -1.82 0.00 0.00 55.36 54.11 2k7s s GLN 93 Cb -0.16 0.42 -0.20 0.00 -1.09 0.00 0.00 33.01 31.98 2k7s s GLN 93 CO 0.10 -0.18 1.68 0.25 -1.32 0.00 0.00 175.29 175.82 2k7s n THR 94 N 1.98 0.00 -0.27 3.63 -2.24 -1.26 0.16 114.28 116.28 2k7s n THR 94 Ca -0.16 0.00 -0.18 0.00 -2.27 0.00 0.00 64.05 61.44 2k7s n THR 94 Cb 0.56 -0.49 0.17 0.00 -2.10 0.00 0.00 70.33 68.47 2k7s n THR 94 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2k7s n ALA 95 N 4.59 -3.12 -2.82 6.98 0.00 -1.14 -4.58 120.51 120.42 2k7s n ALA 95 Ca 0.35 -0.91 -0.33 0.00 0.00 0.00 0.00 53.44 52.55 2k7s n ALA 95 Cb -0.06 -0.08 -0.05 0.00 0.00 0.00 0.00 19.45 19.27 2k7s n ALA 95 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 2k7s s GLN 96 N -3.87 3.52 0.32 0.00 -0.21 -1.26 -3.85 119.66 114.31 2k7s s GLN 96 Ca 0.40 -0.23 -0.25 0.00 0.02 0.00 0.00 55.36 55.29 2k7s s GLN 96 Cb -0.07 -3.04 -0.14 0.00 1.00 0.00 0.00 33.01 30.76 2k7s s GLN 96 CO 0.33 0.62 0.66 -1.71 -2.12 0.00 0.00 175.29 173.07 2k7s n ASN 97 N 0.73 -0.42 -0.29 5.90 2.85 -1.26 -0.72 115.26 122.05 2k7s n ASN 97 Ca -0.08 1.04 0.10 0.00 -0.11 0.00 0.00 54.58 55.52 2k7s n ASN 97 Cb 0.52 -1.11 0.44 0.00 1.24 0.00 0.00 39.78 40.87 2k7s n ASN 97 CO 0.00 0.00 0.00 -0.81 -2.11 0.00 0.00 177.26 174.34 2k7s n PRO 98 N 0.77 1.39 -0.48 1.20 -0.04 -1.26 -4.78 135.00 131.80 2k7s n PRO 98 Ca 0.13 -0.58 -0.02 0.00 -0.04 0.00 0.00 63.50 62.98 2k7s n PRO 98 Cb 0.34 -1.33 0.15 0.00 -0.04 0.00 0.00 33.50 32.61 2k7s n PRO 98 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2k7s n TYR 99 N -0.19 1.16 0.14 0.54 4.01 0.10 -4.31 117.16 118.61 2k7s n TYR 99 Ca 0.15 -0.65 0.11 0.00 -0.16 0.00 0.00 57.90 57.34 2k7s n TYR 99 Cb 0.20 -0.41 0.61 0.00 -0.31 0.00 0.00 39.34 39.44 2k7s n TYR 99 CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 2k7s h SER 100 N 1.32 0.09 0.65 7.72 0.87 -1.63 0.50 113.55 123.08 2k7s h SER 100 Ca 0.12 -0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.68 2k7s h SER 100 Cb 1.46 -0.02 0.00 0.00 -0.44 0.00 0.00 62.40 63.40 2k7s h SER 100 CO 0.34 0.06 0.00 -0.90 -0.53 0.00 0.00 176.83 175.80 2k7s n ASP 101 N -4.49 0.00 -1.65 6.23 5.75 -1.26 -3.91 116.55 117.23 2k7s n ASP 101 Ca 0.02 0.21 0.00 0.00 -0.01 0.00 0.00 54.79 55.01 2k7s n ASP 101 Cb 0.23 -0.39 0.00 0.00 -1.03 0.00 0.00 41.12 39.93 2k7s n ASP 101 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 2k7s n GLU 102 N -1.39 2.51 -3.45 0.11 -0.58 0.18 -4.86 120.64 113.16 2k7s n GLU 102 Ca 0.09 0.00 -0.17 0.00 -0.42 0.00 0.00 57.16 56.66 2k7s n GLU 102 Cb 0.24 0.00 -0.11 0.00 -0.57 0.00 0.00 31.44 31.00 2k7s n GLU 102 CO 0.00 0.00 0.00 0.42 -0.48 0.00 0.00 177.13 177.07 2k7s s ILE 103 N 1.08 -0.38 -0.46 -3.67 1.01 0.12 -2.86 121.20 116.03 2k7s s ILE 103 Ca 0.00 -0.22 -0.29 0.00 0.00 0.00 0.00 60.65 60.15 2k7s s ILE 103 Cb 0.00 -0.78 0.02 0.00 0.01 0.00 0.00 42.46 41.71 2k7s s ILE 103 CO 0.00 -0.27 1.27 -0.70 0.00 0.00 0.00 174.94 175.24 2k7s s GLU 104 N 2.36 3.63 -0.27 2.79 2.12 0.12 -2.08 118.70 127.37 2k7s s GLU 104 Ca 0.08 0.69 -0.03 0.00 0.36 0.00 0.00 54.97 56.07 2k7s s GLU 104 Cb -0.15 -3.97 0.02 0.00 0.26 0.00 0.00 34.13 30.29 2k7s s GLU 104 CO -0.18 -1.51 -0.00 0.99 -0.54 0.00 0.00 175.26 174.02 2k7s s THR 105 N 4.97 3.26 -0.56 -1.70 2.01 -0.31 -1.34 115.64 121.97 2k7s s THR 105 Ca 0.53 -0.96 -0.21 0.00 0.31 0.00 0.00 61.69 61.37 2k7s s THR 105 Cb -0.10 -2.69 0.07 0.00 0.01 0.00 0.00 72.50 69.78 2k7s s THR 105 CO 0.32 0.12 0.76 -0.63 -0.69 0.00 0.00 174.62 174.50 2k7s s ILE 106 N 1.38 4.67 -0.48 1.82 1.09 -1.05 -1.52 121.20 127.11 2k7s s ILE 106 Ca 0.00 -0.44 -0.26 0.00 -1.10 0.00 0.00 60.65 58.85 2k7s s ILE 106 Cb -0.17 -4.46 0.03 0.00 -1.06 0.00 0.00 42.46 36.80 2k7s s ILE 106 CO -0.02 -1.05 0.97 -0.63 -0.10 0.00 0.00 174.94 174.11 2k7s s ILE 107 N 3.14 4.40 -0.17 2.92 1.01 -0.69 -1.61 121.20 130.20 2k7s s ILE 107 Ca 0.18 0.73 -0.05 0.00 0.00 0.00 0.00 60.65 61.51 2k7s s ILE 107 Cb -0.19 -4.49 -0.03 0.00 0.01 0.00 0.00 42.46 37.76 2k7s s ILE 107 CO 0.12 -0.93 0.01 0.00 0.00 0.00 0.00 174.94 174.14 2k7s s THR 109 N 0.49 2.34 -0.03 0.00 -4.23 0.41 -0.39 115.64 114.23 2k7s s THR 109 Ca -0.00 0.33 -0.00 0.00 -1.18 0.00 0.00 61.69 60.84 2k7s s THR 109 Cb -0.14 -3.21 -0.02 0.00 1.34 0.00 0.00 72.50 70.48 2k7s s THR 109 CO 0.02 0.07 -0.03 -3.20 -0.54 0.00 0.00 174.62 170.94 2k7s n ASN 110 N 1.02 3.16 -3.94 3.99 2.85 -0.36 -4.86 115.26 117.12 2k7s n ASN 110 Ca 0.02 -0.01 -0.16 0.00 -0.11 0.00 0.00 54.58 54.32 2k7s n ASN 110 Cb 0.40 -0.05 0.08 0.00 1.24 0.00 0.00 39.78 41.44 2k7s n ASN 110 CO 0.00 0.00 0.00 0.35 -2.11 0.00 0.00 177.26 175.50 2k7s n THR 111 N -2.68 0.00 -2.03 -0.44 -2.24 -1.23 -4.95 114.28 100.71 2k7s n THR 111 Ca -0.05 -1.22 0.00 0.00 -2.27 0.00 0.00 64.05 60.51 2k7s n THR 111 Cb 0.55 -0.93 0.00 0.00 -2.10 0.00 0.00 70.33 67.85 2k7s n THR 111 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2k7s n ASN 112 N -2.83 -8.06 -4.07 3.42 5.03 -1.26 -4.73 115.26 102.76 2k7s n ASN 112 Ca 0.12 1.44 -0.34 0.00 0.87 0.00 0.00 54.58 56.67 2k7s n ASN 112 Cb 0.43 -4.40 -0.13 0.00 -1.02 0.00 0.00 39.78 34.67 2k7s n ASN 112 CO 0.00 0.00 0.00 0.68 -1.83 0.00 0.00 177.26 176.11 2k7s s VAL 113 N -0.47 2.83 -0.21 2.41 -7.23 -1.26 -4.39 120.40 112.07 2k7s s VAL 113 Ca 0.00 -2.22 -0.03 0.00 -1.81 0.00 0.00 61.98 57.92 2k7s s VAL 113 Cb 0.00 -3.00 0.01 0.00 0.56 0.00 0.00 36.38 33.95 2k7s s VAL 113 CO 0.00 -0.66 0.07 1.17 -0.31 0.00 0.00 175.10 175.37 2k7s n LYS 114 N 4.41 -3.24 -1.18 4.82 4.81 -1.26 -4.99 118.16 121.52 2k7s n LYS 114 Ca 0.01 2.62 0.03 0.00 -0.87 0.00 0.00 58.31 60.09 2k7s n LYS 114 Cb 0.41 -4.42 0.02 0.00 0.02 0.00 0.00 35.03 31.06 2k7s n LYS 114 CO 0.00 0.00 0.00 0.27 1.17 0.00 0.00 177.40 178.84 2k7s n ASN 115 N 1.19 0.70 -3.57 3.14 6.94 -1.25 -5.01 115.26 117.40 2k7s n ASN 115 Ca -0.12 -2.02 -0.19 0.00 -0.02 0.00 0.00 54.58 52.23 2k7s n ASN 115 Cb 0.25 -0.27 0.06 0.00 -2.36 0.00 0.00 39.78 37.46 2k7s n ASN 115 CO 0.00 0.00 0.00 -1.20 -1.03 0.00 0.00 177.26 175.03 2k7s n SER 116 N 0.33 -1.78 0.00 0.53 7.64 -1.26 -4.73 113.62 114.35 2k7s n SER 116 Ca 0.04 -0.71 0.00 0.00 1.01 0.00 0.00 58.87 59.21 2k7s n SER 116 Cb 1.01 -4.61 0.00 0.00 -1.01 0.00 0.00 64.21 59.60 2k7s n SER 116 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2k7s n SER 117 N -3.09 0.00 -4.57 6.43 3.41 -1.26 -5.16 113.62 109.38 2k7s n SER 117 Ca -0.28 0.00 -0.26 0.00 -0.26 0.00 0.00 58.87 58.07 2k7s n SER 117 Cb 0.67 0.16 -0.11 0.00 -0.26 0.00 0.00 64.21 64.68 2k7s n SER 117 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2k7s s GLN 118 N -0.85 1.86 0.00 4.33 0.00 -1.25 -4.60 119.66 119.15 2k7s s GLN 118 Ca 0.00 -2.02 0.00 0.00 -0.00 0.00 0.00 55.36 53.34 2k7s s GLN 118 Cb 0.00 -1.52 0.00 0.00 0.00 0.00 0.00 33.01 31.49 2k7s s GLN 118 CO 0.00 -0.01 0.00 -1.91 0.00 0.00 0.00 175.29 173.37