#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 0.56 -0.16 4.61 0.00 -1.26 -5.13 121.76 120.38 2k7s s ALA 2 Ca 0.00 -0.26 -0.04 0.00 0.00 0.00 0.00 51.96 51.66 2k7s s ALA 2 Cb 0.00 -0.16 0.07 0.00 0.00 0.00 0.00 23.12 23.03 2k7s s ALA 2 CO 0.00 0.12 0.19 1.41 0.00 0.00 0.00 175.76 177.48 2k7s s MET 3 N -0.06 0.12 -0.37 0.00 1.75 -1.26 -5.02 119.30 114.46 2k7s s MET 3 Ca 0.01 0.29 0.05 0.00 -1.25 0.00 0.00 55.69 54.79 2k7s s MET 3 Cb -0.04 -0.97 0.26 0.00 2.84 0.00 0.00 34.83 36.93 2k7s s MET 3 CO -0.00 -0.54 1.24 -0.40 -0.65 0.00 0.00 175.02 174.67 2k7s n ASP 4 N 5.32 -1.57 0.00 1.11 5.75 -1.26 -5.07 116.55 120.83 2k7s n ASP 4 Ca -0.05 -2.32 0.00 0.00 -0.01 0.00 0.00 54.79 52.41 2k7s n ASP 4 Cb 0.50 1.25 0.00 0.00 -1.03 0.00 0.00 41.12 41.84 2k7s n ASP 4 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68 2k7s n ASN 5 N -0.03 0.00 -2.72 -1.12 3.02 -1.26 -4.99 115.26 108.16 2k7s n ASN 5 Ca -0.09 0.70 -0.14 0.00 -0.03 0.00 0.00 54.58 55.02 2k7s n ASN 5 Cb 0.73 -0.33 -0.05 0.00 -0.61 0.00 0.00 39.78 39.53 2k7s n ASN 5 CO 0.00 0.00 0.00 1.33 -2.62 0.00 0.00 177.26 175.97 2k7s n VAL 6 N -1.48 0.00 0.00 2.41 0.24 -1.26 -5.10 118.33 113.14 2k7s n VAL 6 Ca 0.00 -1.47 0.00 0.00 -2.04 0.00 0.00 64.34 60.83 2k7s n VAL 6 Cb 0.00 0.61 0.00 0.00 -1.47 0.00 0.00 33.84 32.98 2k7s n VAL 6 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2k7s s GLN 8 N -1.00 0.80 0.00 0.00 -1.52 -1.26 -5.01 119.66 111.67 2k7s s GLN 8 Ca 0.00 -1.12 0.00 0.00 -1.95 0.00 0.00 55.36 52.29 2k7s s GLN 8 Cb 0.00 -0.47 0.00 0.00 -0.22 0.00 0.00 33.01 32.32 2k7s s GLN 8 CO 0.00 0.07 0.00 -0.35 -0.25 0.00 0.00 175.29 174.76 2k7s n PRO 9 N 0.63 1.73 0.00 2.91 -0.04 -1.26 -4.97 135.00 134.01 2k7s n PRO 9 Ca -0.17 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.29 2k7s n PRO 9 Cb 0.58 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.04 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 -0.15 0.00 -3.64 0.52 5.66 -1.26 -2.88 114.28 112.53 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 0.43 -0.10 1.09 -1.05 -1.26 -0.78 118.70 117.03 2k7s s GLU 11 Ca 0.00 0.61 0.03 0.00 -0.15 0.00 0.00 54.97 55.47 2k7s s GLU 11 Cb 0.00 0.16 0.01 0.00 -0.44 0.00 0.00 34.13 33.85 2k7s s GLU 11 CO 0.00 -0.07 -0.21 -0.59 0.95 0.00 0.00 175.26 175.35 2k7s s PHE 12 N 0.74 2.33 -0.58 4.83 -0.12 0.02 -4.90 117.98 120.30 2k7s s PHE 12 Ca -0.02 -1.02 -0.27 0.00 -0.05 0.00 0.00 56.93 55.57 2k7s s PHE 12 Cb -0.04 -1.59 0.03 0.00 -0.63 0.00 0.00 43.02 40.78 2k7s s PHE 12 CO -0.11 -0.45 1.14 0.42 -0.05 0.00 0.00 175.22 176.18 2k7s s ILE 13 N 0.58 4.08 -0.14 -4.49 1.01 -1.26 -1.69 121.20 119.29 2k7s s ILE 13 Ca -0.14 0.76 0.01 0.00 0.00 0.00 0.00 60.65 61.28 2k7s s ILE 13 Cb -0.17 -4.69 -0.00 0.00 0.01 0.00 0.00 42.46 37.61 2k7s s ILE 13 CO 0.04 -1.31 -0.17 -0.55 0.00 0.00 0.00 174.94 172.95 2k7s s SER 14 N 2.96 3.56 0.24 3.58 0.15 -0.63 -0.33 113.70 123.23 2k7s s SER 14 Ca 0.40 -0.48 -0.01 0.00 0.70 0.00 0.00 55.95 56.56 2k7s s SER 14 Cb -0.08 -1.53 -0.04 0.00 -1.71 0.00 0.00 66.02 62.65 2k7s s SER 14 CO 0.24 0.10 0.45 -0.13 1.20 0.00 0.00 173.24 175.10 2k7s s ARG 15 N 0.69 3.54 0.18 5.44 0.52 0.11 -0.95 118.95 128.48 2k7s s ARG 15 Ca -0.08 -0.27 -0.23 0.00 -0.52 0.00 0.00 55.73 54.64 2k7s s ARG 15 Cb -0.16 -2.77 0.07 0.00 0.52 0.00 0.00 34.95 32.61 2k7s s ARG 15 CO 0.02 0.33 1.01 -3.38 0.02 0.00 0.00 175.30 173.30 2k7s s HIS 16 N -1.97 0.01 0.75 -0.53 -3.43 -0.77 -0.13 115.29 109.22 2k7s s HIS 16 Ca 0.40 -0.39 -0.05 0.00 -0.80 0.00 0.00 55.06 54.22 2k7s s HIS 16 Cb -0.11 0.69 0.12 0.00 -1.43 0.00 0.00 32.58 31.85 2k7s s HIS 16 CO 0.30 -0.91 1.04 0.54 -2.00 0.00 0.00 174.74 173.71 2k7s s ASN 17 N -3.25 4.27 0.36 7.38 2.20 -0.70 -0.79 114.94 124.41 2k7s s ASN 17 Ca 0.19 -0.07 0.12 0.00 -0.94 0.00 0.00 52.86 52.16 2k7s s ASN 17 Cb -0.02 -0.34 0.92 0.00 -2.00 0.00 0.00 41.25 39.81 2k7s s ASN 17 CO 0.04 -1.92 1.82 -0.29 -2.94 0.00 0.00 177.10 173.81 2k7s h ILE 18 N -0.70 0.69 -0.45 0.54 6.09 -1.92 0.50 117.51 122.26 2k7s h ILE 18 Ca -0.40 -0.20 0.03 0.00 -1.37 0.00 0.00 64.86 62.92 2k7s h ILE 18 Cb 1.27 0.06 -0.02 0.00 0.47 0.00 0.00 36.82 38.60 2k7s h ILE 18 CO 0.44 0.11 0.30 -0.33 -3.07 0.00 0.00 178.15 175.60 2k7s h GLU 19 N 0.58 0.48 0.00 2.19 4.39 -1.97 -3.46 114.58 116.79 2k7s h GLU 19 Ca 0.53 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 60.20 2k7s h GLU 19 Cb 1.06 -0.11 0.00 0.00 -0.10 0.00 0.00 28.75 29.60 2k7s h GLU 19 CO -0.27 0.32 0.00 0.41 -1.16 0.00 0.00 179.01 178.31 2k7s n GLY 20 N -1.49 1.02 3.63 -3.84 0.00 0.18 -4.68 105.19 100.00 2k7s n GLY 20 Ca 0.05 0.00 -0.48 0.00 0.00 0.00 0.00 46.02 45.59 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 -0.60 0.50 -1.78 -0.61 2.08 -1.26 -1.45 119.36 116.23 2k7s n ILE 21 Ca 0.00 -0.18 -0.40 0.00 0.56 0.00 0.00 62.75 62.73 2k7s n ILE 21 Cb 0.00 -1.94 -0.03 0.00 -0.75 0.00 0.00 39.64 36.92 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 5.19 1.41 -2.22 1.39 0.08 -0.21 -1.73 117.98 121.89 2k7s s PHE 22 Ca 0.97 0.87 0.28 0.00 0.12 0.00 0.00 56.93 59.17 2k7s s PHE 22 Cb -0.67 -3.92 1.15 0.00 -0.57 0.00 0.00 43.02 39.01 2k7s s PHE 22 CO 0.49 -3.05 1.80 0.25 -0.10 0.00 0.00 175.22 174.62 2k7s n THR 23 N 7.63 0.00 -3.61 0.64 -2.24 0.81 -0.19 114.28 117.32 2k7s n THR 23 Ca 0.28 -0.17 -0.08 0.00 -2.27 0.00 0.00 64.05 61.81 2k7s n THR 23 Cb 0.49 0.27 -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 -2.13 -0.28 -0.13 4.78 5.36 -0.81 -4.92 117.98 119.85 2k7s s PHE 24 Ca 0.36 0.54 -0.05 0.00 -0.96 0.00 0.00 56.93 56.82 2k7s s PHE 24 Cb 0.21 0.45 0.06 0.00 -0.34 0.00 0.00 43.02 43.39 2k7s s PHE 24 CO 0.38 -0.23 0.27 0.08 -1.46 0.00 0.00 175.22 174.27 2k7s s VAL 25 N -0.77 -0.25 0.18 3.12 1.01 -1.26 0.05 120.40 122.48 2k7s s VAL 25 Ca 0.02 0.21 -0.30 0.00 0.00 0.00 0.00 61.98 61.91 2k7s s VAL 25 Cb -0.02 -0.44 -0.09 0.00 0.00 0.00 0.00 36.38 35.84 2k7s s VAL 25 CO -0.03 0.09 1.32 -0.62 0.00 0.00 0.00 175.10 175.86 2k7s s ASP 26 N 1.90 6.89 0.16 3.32 2.15 0.55 -4.63 116.67 127.00 2k7s s ASP 26 Ca -0.04 2.38 0.06 0.00 0.43 0.00 0.00 52.55 55.39 2k7s s ASP 26 Cb -0.11 -2.61 0.33 0.00 -0.30 0.00 0.00 42.92 40.24 2k7s s ASP 26 CO -0.09 -0.55 1.03 0.00 -0.17 0.00 0.00 175.17 175.39 2k7s n HIS 27 N 2.86 0.21 0.23 -5.34 1.44 -1.26 -0.58 115.22 112.78 2k7s n HIS 27 Ca 0.07 0.11 0.10 0.00 -2.01 0.00 0.00 57.72 55.99 2k7s n HIS 27 Cb 0.43 -0.46 0.56 0.00 0.12 0.00 0.00 29.99 30.63 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 -0.76 -1.40 3.08 -1.90 -3.08 114.38 110.31 2k7s h ARG 28 Ca 0.00 0.00 0.22 0.00 0.07 0.00 0.00 59.98 60.27 2k7s h ARG 28 Cb 0.53 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.55 2k7s h ARG 28 CO 0.00 0.21 0.71 0.00 -1.07 0.00 0.00 179.97 179.82 2k7s h VAL 30 N 0.00 1.50 0.00 0.00 -1.51 -1.42 0.34 116.25 115.16 2k7s h VAL 30 Ca 0.36 -2.71 -0.13 0.00 -1.23 0.00 0.00 66.70 62.99 2k7s h VAL 30 Cb 1.79 2.54 -0.02 0.00 -2.13 0.00 0.00 31.29 33.47 2k7s h VAL 30 CO -0.00 0.79 -0.66 0.00 -1.23 0.00 0.00 177.57 176.46 2k7s h ALA 31 N 0.90 0.60 0.00 5.19 0.00 -0.80 -0.33 119.26 124.83 2k7s h ALA 31 Ca -0.06 -0.58 -0.01 0.00 0.00 0.00 0.00 54.91 54.26 2k7s h ALA 31 Cb 1.59 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 19.30 2k7s h ALA 31 CO 0.14 0.79 -0.19 1.15 0.00 0.00 0.00 179.25 181.14 2k7s h THR 32 N 0.00 0.17 -0.12 0.00 2.02 -0.90 -3.39 112.91 110.69 2k7s h THR 32 Ca -0.02 -1.15 0.00 0.00 0.77 0.00 0.00 66.41 66.02 2k7s h THR 32 Cb 1.49 0.34 0.00 0.00 -1.74 0.00 0.00 68.15 68.23 2k7s h THR 32 CO 0.08 0.06 0.00 1.33 0.37 0.00 0.00 175.52 177.36 2k7s n VAL 33 N -4.71 1.06 0.00 3.16 0.24 0.11 -4.62 118.33 113.57 2k7s n VAL 33 Ca -0.04 -1.06 0.00 0.00 -2.04 0.00 0.00 64.34 61.20 2k7s n VAL 33 Cb 0.14 0.46 0.00 0.00 -1.47 0.00 0.00 33.84 32.97 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 -0.20 1.90 3.64 7.63 0.00 -0.13 0.23 105.19 118.27 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 2.48 0.88 1.61 2.02 -1.21 -4.56 117.35 118.57 2k7s s TYR 35 Ca 0.00 0.73 -0.11 0.00 -0.37 0.00 0.00 57.07 57.32 2k7s s TYR 35 Cb 0.00 -3.80 0.12 0.00 -0.40 0.00 0.00 41.96 37.87 2k7s s TYR 35 CO 0.00 -2.33 1.14 1.04 -1.57 0.00 0.00 175.55 173.83 2k7s n GLN 36 N 7.17 -0.20 -0.34 -0.62 6.02 -1.26 -2.74 117.38 125.39 2k7s n GLN 36 Ca 0.16 0.01 0.22 0.00 -0.01 0.00 0.00 57.00 57.38 2k7s n GLN 36 Cb 0.45 -2.38 0.45 0.00 1.02 0.00 0.00 30.24 29.79 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 -1.50 0.43 -0.03 -1.09 0.11 -1.83 0.75 132.00 128.84 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 -0.10 -0.02 0.00 0.11 0.00 0.00 31.00 32.28 2k7s h PRO 37 CO 0.43 0.29 -0.56 -0.56 -0.21 0.00 0.00 178.00 177.38 2k7s h GLN 38 N 0.45 0.09 0.00 1.05 3.07 -1.89 0.28 115.11 118.16 2k7s h GLN 38 Ca 0.66 -0.06 0.00 0.00 0.09 0.00 0.00 58.65 59.34 2k7s h GLN 38 Cb 1.48 0.01 0.00 0.00 0.08 0.00 0.00 27.48 29.05 2k7s h GLN 38 CO -0.45 0.63 0.00 -1.91 0.09 0.00 0.00 178.83 177.19 2k7s n GLU 39 N -3.88 0.05 -0.03 0.06 0.00 0.26 -2.92 120.64 114.17 2k7s n GLU 39 Ca -0.02 0.24 -0.04 0.00 0.00 0.00 0.00 57.16 57.34 2k7s n GLU 39 Cb 0.58 -1.50 -0.03 0.00 0.00 0.00 0.00 31.44 30.48 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 -1.44 2.18 -4.66 4.31 7.99 -0.93 -4.85 117.00 119.61 2k7s n LEU 40 Ca 0.04 -0.03 -0.48 0.00 -0.01 0.00 0.00 56.01 55.54 2k7s n LEU 40 Cb 0.14 -0.14 -0.05 0.00 -0.11 0.00 0.00 43.42 43.27 2k7s n LEU 40 CO 0.12 0.48 1.19 0.18 -1.51 0.00 0.00 177.39 177.85 2k7s n LEU 41 N -2.56 2.87 0.00 2.23 4.77 0.93 -0.29 117.00 124.95 2k7s n LEU 41 Ca -0.11 1.07 0.00 0.00 -0.03 0.00 0.00 56.01 56.94 2k7s n LEU 41 Cb 0.64 -1.37 0.00 0.00 -2.33 0.00 0.00 43.42 40.36 2k7s n LEU 41 CO 0.08 -0.39 0.00 0.61 -1.33 0.00 0.00 177.39 176.36 2k7s n GLY 42 N 3.43 1.31 3.75 -0.72 0.00 0.73 -4.92 105.19 108.78 2k7s n GLY 42 Ca 0.18 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.85 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 -0.26 3.12 -0.17 1.61 1.02 0.61 -4.73 119.74 120.94 2k7s s LYS 43 Ca 0.00 -0.35 -0.29 0.00 0.02 0.00 0.00 55.97 55.35 2k7s s LYS 43 Cb 0.00 -2.91 -0.03 0.00 -0.52 0.00 0.00 37.83 34.36 2k7s s LYS 43 CO 0.00 0.71 1.60 1.21 -0.92 0.00 0.00 175.35 177.96 2k7s s ASN 44 N -1.08 6.50 0.29 2.83 3.84 -1.26 -1.05 114.94 125.01 2k7s s ASN 44 Ca 0.15 1.81 0.04 0.00 0.21 0.00 0.00 52.86 55.07 2k7s s ASN 44 Cb -0.12 -2.53 0.72 0.00 -0.55 0.00 0.00 41.25 38.77 2k7s s ASN 44 CO 0.05 -1.13 1.71 -0.29 -2.79 0.00 0.00 177.10 174.65 2k7s h ILE 45 N 5.93 0.51 0.00 -5.21 2.10 -1.53 0.22 117.51 119.54 2k7s h ILE 45 Ca -0.35 -0.15 -0.08 0.00 1.08 0.00 0.00 64.86 65.36 2k7s h ILE 45 Cb 1.16 0.03 -0.01 0.00 -1.09 0.00 0.00 36.82 36.90 2k7s h ILE 45 CO 0.98 0.08 -0.39 -0.37 -1.08 0.00 0.00 178.15 177.37 2k7s h VAL 46 N 0.45 1.10 -0.80 2.19 -1.51 -1.83 -2.49 116.25 113.36 2k7s h VAL 46 Ca 0.56 -1.43 0.21 0.00 -1.23 0.00 0.00 66.70 64.81 2k7s h VAL 46 Cb 1.03 1.81 -0.04 0.00 -2.13 0.00 0.00 31.29 31.96 2k7s h VAL 46 CO -0.50 0.38 0.56 -0.33 -1.23 0.00 0.00 177.57 176.46 2k7s h GLU 47 N 0.00 0.12 0.10 5.19 5.08 -0.94 0.36 114.58 124.48 2k7s h GLU 47 Ca -0.00 -0.01 -0.31 0.00 -1.00 0.00 0.00 59.36 58.04 2k7s h GLU 47 Cb 0.78 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.99 2k7s h GLU 47 CO 0.05 0.08 -1.61 0.74 -1.00 0.00 0.00 179.01 177.27 2k7s h PHE 48 N 0.12 0.37 -3.79 4.33 -1.00 -1.48 -3.47 116.94 112.02 2k7s h PHE 48 Ca 0.39 -0.27 -0.56 0.00 2.81 0.00 0.00 57.97 60.34 2k7s h PHE 48 Cb 1.37 -0.01 0.14 0.00 3.61 0.00 0.00 35.95 41.06 2k7s h PHE 48 CO -0.00 1.37 0.45 0.00 -1.61 0.00 0.00 178.31 178.52 2k7s n HIS 50 N -1.06 2.75 -0.23 0.00 -0.00 0.79 -4.70 115.22 112.79 2k7s n HIS 50 Ca 0.11 0.17 -0.10 0.00 0.46 0.00 0.00 57.72 58.35 2k7s n HIS 50 Cb 0.44 -2.62 -0.06 0.00 -0.12 0.00 0.00 29.99 27.62 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 5.66 -0.23 0.00 1.57 0.11 -1.90 0.44 132.00 137.64 2k7s h PRO 51 Ca -0.45 0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.67 2k7s h PRO 51 Cb 1.22 0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.38 2k7s h PRO 51 CO 0.87 -0.15 0.11 0.93 -0.21 0.00 0.00 178.00 179.54 2k7s h GLU 52 N -0.24 0.00 0.00 1.05 5.08 -2.00 -0.72 114.58 117.75 2k7s h GLU 52 Ca 0.15 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.51 2k7s h GLU 52 Cb 0.55 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.80 2k7s h GLU 52 CO -0.71 0.00 -1.49 -0.25 -1.00 0.00 0.00 179.01 175.56 2k7s n ASP 53 N -2.73 0.80 -0.06 1.42 9.92 0.12 -4.42 116.55 121.60 2k7s n ASP 53 Ca -0.02 -0.33 0.04 0.00 -0.53 0.00 0.00 54.79 53.96 2k7s n ASP 53 Cb 0.16 1.55 0.39 0.00 -0.64 0.00 0.00 41.12 42.58 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 0.63 -0.16 -1.24 4.20 0.11 -0.12 115.11 118.53 2k7s h GLN 54 Ca 0.00 -0.04 -0.00 0.00 0.06 0.00 0.00 58.65 58.67 2k7s h GLN 54 Cb 0.70 -0.14 -0.01 0.00 0.30 0.00 0.00 27.48 28.33 2k7s h GLN 54 CO 0.00 0.42 0.09 0.37 -0.67 0.00 0.00 178.83 179.03 2k7s h GLN 55 N 0.65 0.21 0.20 1.46 5.75 -1.77 0.16 115.11 121.77 2k7s h GLN 55 Ca 0.20 -0.02 -0.31 0.00 -0.15 0.00 0.00 58.65 58.37 2k7s h GLN 55 Cb 0.00 -0.05 0.02 0.00 1.07 0.00 0.00 27.48 28.53 2k7s h GLN 55 CO -0.05 0.16 -1.38 1.25 -2.65 0.00 0.00 178.83 176.16 2k7s h LEU 56 N 0.22 0.67 0.62 -2.39 5.85 -1.34 -2.17 115.31 116.77 2k7s h LEU 56 Ca 0.06 -0.72 -0.03 0.00 0.84 0.00 0.00 57.88 58.03 2k7s h LEU 56 Cb 0.01 -0.22 0.01 0.00 0.37 0.00 0.00 40.66 40.83 2k7s h LEU 56 CO -0.01 1.56 -0.30 0.25 -0.34 0.00 0.00 178.44 179.60 2k7s h LEU 57 N 0.12 -0.70 -1.09 2.25 5.85 -0.39 -1.78 115.31 119.56 2k7s h LEU 57 Ca -0.20 -0.02 0.10 0.00 0.84 0.00 0.00 57.88 58.59 2k7s h LEU 57 Cb 2.09 0.18 -0.07 0.00 0.37 0.00 0.00 40.66 43.23 2k7s h LEU 57 CO 0.25 -0.38 0.61 0.03 -0.34 0.00 0.00 178.44 178.61 2k7s h ARG 58 N -1.03 0.97 -0.40 1.25 3.08 -0.84 -1.48 114.38 115.93 2k7s h ARG 58 Ca -0.09 -0.06 0.07 0.00 0.07 0.00 0.00 59.98 59.97 2k7s h ARG 58 Cb 0.69 -0.22 -0.06 0.00 0.08 0.00 0.00 29.97 30.46 2k7s h ARG 58 CO 0.14 0.64 0.04 0.22 -1.07 0.00 0.00 179.97 179.94 2k7s h ASP 59 N 1.00 -0.07 0.03 7.04 1.82 -1.18 1.00 116.42 126.05 2k7s h ASP 59 Ca 0.44 0.08 0.03 0.00 -0.39 0.00 0.00 57.03 57.19 2k7s h ASP 59 Cb 0.37 0.13 -0.05 0.00 0.68 0.00 0.00 39.33 40.46 2k7s h ASP 59 CO -0.20 -0.00 -0.33 0.77 -1.61 0.00 0.00 179.24 177.86 2k7s h SER 60 N 0.16 -0.99 -0.87 2.28 4.64 -0.38 0.11 113.55 118.51 2k7s h SER 60 Ca 0.19 0.12 0.16 0.00 -0.47 0.00 0.00 61.79 61.80 2k7s h SER 60 Cb 0.26 0.39 -0.07 0.00 -0.31 0.00 0.00 62.40 62.67 2k7s h SER 60 CO -0.29 -0.40 0.57 -0.26 -0.87 0.00 0.00 176.83 175.58 2k7s h PHE 61 N -0.50 0.66 -0.13 4.77 0.04 -0.99 0.35 116.94 121.13 2k7s h PHE 61 Ca 0.05 0.02 -0.10 0.00 2.80 0.00 0.00 57.97 60.74 2k7s h PHE 61 Cb 0.58 -0.21 -0.01 0.00 2.20 0.00 0.00 35.95 38.51 2k7s h PHE 61 CO -0.34 0.22 -0.37 1.96 -0.60 0.00 0.00 178.31 179.18 2k7s h GLN 62 N 0.54 0.28 0.12 1.51 1.08 0.72 -2.19 115.11 117.17 2k7s h GLN 62 Ca 0.44 -0.12 -0.24 0.00 -1.45 0.00 0.00 58.65 57.28 2k7s h GLN 62 Cb 0.90 -0.01 0.02 0.00 -0.05 0.00 0.00 27.48 28.34 2k7s h GLN 62 CO -0.18 0.62 -0.99 1.96 -0.95 0.00 0.00 178.83 179.28 2k7s h GLN 63 N 0.23 0.47 -0.53 1.46 1.08 0.14 -0.93 115.11 117.03 2k7s h GLN 63 Ca 0.03 -0.66 -0.05 0.00 -1.45 0.00 0.00 58.65 56.52 2k7s h GLN 63 Cb 0.77 0.22 -0.02 0.00 -0.05 0.00 0.00 27.48 28.40 2k7s h GLN 63 CO 0.06 1.29 0.13 -0.39 -0.95 0.00 0.00 178.83 178.96 2k7s h VAL 64 N -0.02 1.22 0.00 -0.54 -1.51 -0.87 -0.14 116.25 114.38 2k7s h VAL 64 Ca -0.16 -0.80 -0.19 0.00 -1.23 0.00 0.00 66.70 64.33 2k7s h VAL 64 Cb 1.73 0.68 -0.03 0.00 -2.13 0.00 0.00 31.29 31.54 2k7s h VAL 64 CO 0.19 0.30 -0.92 1.62 -1.23 0.00 0.00 177.57 177.52 2k7s h VAL 65 N 0.78 1.44 -0.30 7.19 3.04 -1.47 0.43 116.25 127.36 2k7s h VAL 65 Ca 0.17 -3.06 -0.14 0.00 -1.01 0.00 0.00 66.70 62.66 2k7s h VAL 65 Cb 0.29 2.70 -0.00 0.00 -2.01 0.00 0.00 31.29 32.27 2k7s h VAL 65 CO -0.00 0.82 -0.36 0.11 -1.01 0.00 0.00 177.57 177.13 2k7s h LYS 66 N 0.00 0.77 -0.06 4.17 1.57 -0.71 -2.93 116.57 119.37 2k7s h LYS 66 Ca -0.03 -0.43 0.00 0.00 -1.87 0.00 0.00 60.65 58.33 2k7s h LYS 66 Cb 1.68 0.03 0.00 0.00 0.08 0.00 0.00 32.23 34.02 2k7s h LYS 66 CO 0.11 1.05 0.00 1.28 -0.57 0.00 0.00 179.45 181.32 2k7s n LEU 67 N -4.19 2.40 -2.21 2.94 4.77 -0.11 -5.02 117.00 115.59 2k7s n LEU 67 Ca -0.04 -0.84 0.00 0.00 -0.03 0.00 0.00 56.01 55.10 2k7s n LEU 67 Cb 0.52 -0.03 0.00 0.00 -2.33 0.00 0.00 43.42 41.58 2k7s n LEU 67 CO 0.46 0.42 -0.28 1.17 -1.33 0.00 0.00 177.39 177.84 2k7s n LYS 68 N 0.86 -0.26 0.00 3.23 3.00 0.14 -3.73 118.16 121.41 2k7s n LYS 68 Ca 0.16 0.54 0.00 0.00 -0.00 0.00 0.00 58.31 59.01 2k7s n LYS 68 Cb 0.49 -0.62 0.00 0.00 0.00 0.00 0.00 35.03 34.91 2k7s n LYS 68 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2k7s n GLY 69 N 1.15 3.04 3.68 3.14 0.00 -0.73 -4.95 105.19 110.52 2k7s n GLY 69 Ca 0.00 -1.11 -0.46 0.00 0.00 0.00 0.00 46.02 44.45 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 2.35 -2.82 1.61 -0.06 -1.24 -4.46 117.38 112.76 2k7s n GLN 70 Ca 0.00 0.86 -0.38 0.00 -2.00 0.00 0.00 57.00 55.48 2k7s n GLN 70 Cb 0.00 -2.72 -0.06 0.00 -4.06 0.00 0.00 30.24 23.40 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 3.57 4.21 0.12 1.69 0.11 -1.26 -4.05 120.40 124.79 2k7s s VAL 71 Ca 0.89 1.84 0.07 0.00 -2.93 0.00 0.00 61.98 61.86 2k7s s VAL 71 Cb -0.63 -4.10 -0.04 0.00 -1.53 0.00 0.00 36.38 30.09 2k7s s VAL 71 CO 0.47 0.28 -0.08 -0.76 -3.33 0.00 0.00 175.10 171.68 2k7s s LEU 72 N -1.73 3.10 -0.17 2.54 2.01 0.13 -4.95 118.68 119.61 2k7s s LEU 72 Ca 0.46 -0.40 -0.01 0.00 0.01 0.00 0.00 54.13 54.19 2k7s s LEU 72 Cb -0.21 -1.86 0.05 0.00 0.01 0.00 0.00 46.19 44.18 2k7s s LEU 72 CO 0.26 0.15 -0.02 -0.55 1.01 0.00 0.00 176.35 177.21 2k7s s SER 73 N -2.41 2.83 -0.01 2.29 0.15 -1.24 -1.93 113.70 113.37 2k7s s SER 73 Ca 0.23 -0.71 0.01 0.00 0.70 0.00 0.00 55.95 56.19 2k7s s SER 73 Cb -0.11 -0.78 0.01 0.00 -1.71 0.00 0.00 66.02 63.43 2k7s s SER 73 CO 0.15 -0.23 -0.03 0.68 1.20 0.00 0.00 173.24 175.01 2k7s s VAL 74 N 1.72 0.31 -0.20 4.45 -7.23 -1.10 -4.93 120.40 113.41 2k7s s VAL 74 Ca -0.00 -0.10 -0.12 0.00 -1.81 0.00 0.00 61.98 59.95 2k7s s VAL 74 Cb -0.16 -0.31 -0.05 0.00 0.56 0.00 0.00 36.38 36.43 2k7s s VAL 74 CO -0.07 0.12 0.22 -0.04 -0.31 0.00 0.00 175.10 175.01 2k7s s MET 75 N 0.29 4.17 0.14 4.82 -1.94 -1.26 -0.61 119.30 124.91 2k7s s MET 75 Ca -0.03 -0.10 -0.01 0.00 -1.71 0.00 0.00 55.69 53.84 2k7s s MET 75 Cb -0.06 -3.48 -0.04 0.00 2.01 0.00 0.00 34.83 33.26 2k7s s MET 75 CO -0.01 0.16 0.07 -0.59 -0.01 0.00 0.00 175.02 174.65 2k7s s PHE 76 N 0.75 0.88 -0.45 -0.03 -0.71 0.02 -4.94 117.98 113.49 2k7s s PHE 76 Ca 0.11 -1.23 -0.18 0.00 -1.04 0.00 0.00 56.93 54.60 2k7s s PHE 76 Cb -0.13 -0.47 0.04 0.00 -1.21 0.00 0.00 43.02 41.25 2k7s s PHE 76 CO 0.03 -0.54 0.49 1.03 -1.34 0.00 0.00 175.22 174.88 2k7s s ARG 77 N -4.06 3.09 -0.52 1.99 0.52 -1.26 -0.29 118.95 118.42 2k7s s ARG 77 Ca 0.25 -0.89 -0.21 0.00 -0.52 0.00 0.00 55.73 54.37 2k7s s ARG 77 Cb 0.07 -4.03 0.05 0.00 0.52 0.00 0.00 34.95 31.56 2k7s s ARG 77 CO 0.03 -0.99 0.75 0.12 0.02 0.00 0.00 175.30 175.23 2k7s s PHE 78 N 2.20 2.95 -0.49 -0.53 2.19 0.51 -0.15 117.98 124.67 2k7s s PHE 78 Ca 0.12 -0.29 -0.27 0.00 0.33 0.00 0.00 56.93 56.82 2k7s s PHE 78 Cb -0.19 -3.73 -0.04 0.00 -1.31 0.00 0.00 43.02 37.75 2k7s s PHE 78 CO 0.12 -1.14 2.06 0.50 1.83 0.00 0.00 175.22 178.59 2k7s s ARG 79 N 3.16 2.62 0.44 10.12 3.00 -0.65 -0.94 118.95 136.70 2k7s s ARG 79 Ca 0.22 1.14 -0.06 0.00 -1.00 0.00 0.00 55.73 56.03 2k7s s ARG 79 Cb -0.16 -4.42 0.10 0.00 0.00 0.00 0.00 34.95 30.47 2k7s s ARG 79 CO 0.15 -2.70 0.60 0.43 0.00 0.00 0.00 175.30 173.78 2k7s n SER 80 N 13.26 0.24 0.31 -2.12 7.64 -0.96 -4.83 113.62 127.15 2k7s n SER 80 Ca 0.27 -1.34 0.19 0.00 1.01 0.00 0.00 58.87 59.00 2k7s n SER 80 Cb 0.51 -0.44 1.04 0.00 -1.01 0.00 0.00 64.21 64.31 2k7s n SER 80 CO 0.00 0.00 0.00 0.50 -3.01 0.00 0.00 175.04 172.53 2k7s h LYS 81 N 0.00 0.00 -0.02 1.43 1.63 -0.55 0.27 116.57 119.33 2k7s h LYS 81 Ca -0.20 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.60 2k7s h LYS 81 Cb 0.59 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.22 2k7s h LYS 81 CO 0.16 0.00 0.00 0.27 -3.45 0.00 0.00 179.45 176.43 2k7s n ASN 82 N -3.41 0.84 -2.58 4.20 0.23 -1.26 -4.91 115.26 108.37 2k7s n ASN 82 Ca -0.02 -1.33 -0.18 0.00 -0.53 0.00 0.00 54.58 52.51 2k7s n ASN 82 Cb 0.14 -0.01 0.03 0.00 -2.08 0.00 0.00 39.78 37.86 2k7s n ASN 82 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2k7s n GLN 83 N -0.32 -4.39 -4.66 -3.83 6.02 0.96 -5.01 117.38 106.14 2k7s n GLN 83 Ca 0.20 0.74 -0.25 0.00 -0.01 0.00 0.00 57.00 57.68 2k7s n GLN 83 Cb 0.24 -5.26 -0.14 0.00 1.02 0.00 0.00 30.24 26.09 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 -5.57 1.38 -0.80 -1.09 2.02 -1.26 -4.89 118.70 108.49 2k7s s GLU 84 Ca 0.28 -0.89 -0.25 0.00 0.02 0.00 0.00 54.97 54.13 2k7s s GLU 84 Cb -0.12 -1.46 -0.04 0.00 0.10 0.00 0.00 34.13 32.61 2k7s s GLU 84 CO 0.35 0.38 1.96 -1.58 0.02 0.00 0.00 175.26 176.38 2k7s s TRP 85 N -0.75 1.71 -0.63 1.61 0.23 -1.26 -2.27 118.94 117.57 2k7s s TRP 85 Ca 0.07 0.77 -0.25 0.00 -2.03 0.00 0.00 56.10 54.66 2k7s s TRP 85 Cb -0.08 -4.01 0.04 0.00 0.03 0.00 0.00 33.47 29.44 2k7s s TRP 85 CO 0.01 -1.93 1.08 -0.51 0.96 0.00 0.00 176.95 176.57 2k7s s LEU 86 N 10.08 3.80 0.15 2.99 1.43 -0.11 -4.71 118.68 132.31 2k7s s LEU 86 Ca 0.71 -0.45 -0.31 0.00 -1.03 0.00 0.00 54.13 53.05 2k7s s LEU 86 Cb -0.09 -2.72 -0.10 0.00 0.03 0.00 0.00 46.19 43.31 2k7s s LEU 86 CO 0.07 -1.49 1.71 0.26 0.23 0.00 0.00 176.35 177.13 2k7s s TRP 87 N 4.64 2.62 0.08 0.29 0.52 -1.26 -0.36 118.94 125.47 2k7s s TRP 87 Ca 0.32 0.29 0.01 0.00 0.02 0.00 0.00 56.10 56.73 2k7s s TRP 87 Cb -0.11 -4.07 -0.04 0.00 -1.15 0.00 0.00 33.47 28.09 2k7s s TRP 87 CO 0.17 -4.21 -0.05 -1.64 0.02 0.00 0.00 176.95 171.24 2k7s s MET 88 N 1.91 0.72 -0.18 4.98 -1.94 0.60 -0.52 119.30 124.88 2k7s s MET 88 Ca 0.75 -1.24 -0.00 0.00 -1.71 0.00 0.00 55.69 53.49 2k7s s MET 88 Cb -0.46 -0.05 0.01 0.00 2.01 0.00 0.00 34.83 36.34 2k7s s MET 88 CO 0.33 -0.05 -0.15 1.03 -0.01 0.00 0.00 175.02 176.18 2k7s s ARG 89 N -3.69 3.16 -0.07 2.03 0.52 0.53 -0.80 118.95 120.64 2k7s s ARG 89 Ca 0.08 -0.75 -0.12 0.00 -0.52 0.00 0.00 55.73 54.42 2k7s s ARG 89 Cb 0.05 -2.69 -0.05 0.00 0.52 0.00 0.00 34.95 32.79 2k7s s ARG 89 CO -0.06 -0.12 0.29 0.95 0.02 0.00 0.00 175.30 176.38 2k7s s THR 90 N 1.14 5.24 -0.80 0.02 -4.23 0.22 -0.93 115.64 116.30 2k7s s THR 90 Ca 0.01 0.57 0.02 0.00 -1.18 0.00 0.00 61.69 61.11 2k7s s THR 90 Cb -0.14 -3.59 0.26 0.00 1.34 0.00 0.00 72.50 70.37 2k7s s THR 90 CO -0.06 0.57 0.96 -1.20 -0.54 0.00 0.00 174.62 174.36 2k7s n SER 91 N 2.12 4.58 -4.70 3.99 7.64 -0.71 -2.73 113.62 123.80 2k7s n SER 91 Ca -0.16 -3.40 -0.41 0.00 1.01 0.00 0.00 58.87 55.91 2k7s n SER 91 Cb 0.53 -0.89 -0.04 0.00 -1.01 0.00 0.00 64.21 62.81 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 -2.02 7.16 -0.21 6.43 0.01 -0.81 -2.54 113.70 121.71 2k7s s SER 92 Ca 0.36 1.41 -0.27 0.00 1.31 0.00 0.00 55.95 58.75 2k7s s SER 92 Cb 0.09 -2.50 0.11 0.00 0.21 0.00 0.00 66.02 63.93 2k7s s SER 92 CO 0.01 -0.26 0.91 0.00 0.41 0.00 0.00 173.24 174.31 2k7s s GLN 93 N 1.26 0.67 -0.48 12.44 -2.07 -0.41 0.17 119.66 131.24 2k7s s GLN 93 Ca 0.44 0.50 -0.46 0.00 -1.82 0.00 0.00 55.36 54.03 2k7s s GLN 93 Cb -0.19 0.32 -0.19 0.00 -1.09 0.00 0.00 33.01 31.86 2k7s s GLN 93 CO 0.21 -0.14 1.77 0.25 -1.32 0.00 0.00 175.29 176.06 2k7s n THR 94 N 1.72 0.02 -0.48 3.63 -2.24 -1.26 0.24 114.28 115.91 2k7s n THR 94 Ca -0.13 -0.01 -0.20 0.00 -2.27 0.00 0.00 64.05 61.44 2k7s n THR 94 Cb 0.56 -0.56 0.17 0.00 -2.10 0.00 0.00 70.33 68.40 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 5.16 -1.51 -2.59 6.98 0.00 -1.18 -4.59 120.51 122.77 2k7s n ALA 95 Ca 0.38 -1.18 -0.31 0.00 0.00 0.00 0.00 53.44 52.33 2k7s n ALA 95 Cb -0.04 -1.01 -0.01 0.00 0.00 0.00 0.00 19.45 18.39 2k7s n ALA 95 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2k7s n GLN 96 N -2.43 3.59 -1.50 0.00 6.02 -1.26 -4.24 117.38 117.54 2k7s n GLN 96 Ca 0.07 -4.52 0.00 0.00 -0.01 0.00 0.00 57.00 52.54 2k7s n GLN 96 Cb 0.40 -2.28 0.00 0.00 1.02 0.00 0.00 30.24 29.37 2k7s n GLN 96 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 177.06 174.34 2k7s n ASN 97 N -0.34 -8.15 0.00 1.08 2.85 -1.26 -4.79 115.26 104.65 2k7s n ASN 97 Ca 0.40 1.40 0.10 0.00 -0.11 0.00 0.00 54.58 56.36 2k7s n ASN 97 Cb 0.44 -4.61 0.45 0.00 1.24 0.00 0.00 39.78 37.30 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 -1.50 0.06 -0.67 1.20 -0.04 -1.26 -4.69 135.00 128.10 2k7s n PRO 98 Ca 0.00 0.14 -0.11 0.00 -0.04 0.00 0.00 63.50 63.49 2k7s n PRO 98 Cb 0.16 -1.50 0.04 0.00 -0.04 0.00 0.00 33.50 32.17 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 -1.46 1.18 -0.29 0.54 4.01 -1.26 -4.50 117.16 115.38 2k7s n TYR 99 Ca 0.06 -1.47 0.01 0.00 -0.16 0.00 0.00 57.90 56.34 2k7s n TYR 99 Cb 0.22 -0.72 0.14 0.00 -0.31 0.00 0.00 39.34 38.67 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 0.99 0.71 -0.01 7.72 0.87 -1.84 0.39 113.55 122.38 2k7s h SER 100 Ca 0.23 0.03 0.00 0.00 -1.23 0.00 0.00 61.79 60.82 2k7s h SER 100 Cb 1.22 -0.11 0.00 0.00 -0.44 0.00 0.00 62.40 63.07 2k7s h SER 100 CO 0.52 0.43 0.00 0.47 -0.53 0.00 0.00 176.83 177.73 2k7s n ASP 101 N -4.71 0.09 -0.06 6.23 9.92 -1.26 -3.90 116.55 122.86 2k7s n ASP 101 Ca 0.12 -1.59 0.00 0.00 -0.53 0.00 0.00 54.79 52.79 2k7s n ASP 101 Cb 0.22 -0.01 0.00 0.00 -0.64 0.00 0.00 41.12 40.69 2k7s n ASP 101 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 2k7s n GLU 102 N -0.66 3.97 -3.46 -1.24 1.02 0.14 -4.91 120.64 115.51 2k7s n GLU 102 Ca 0.10 0.00 -0.17 0.00 -0.02 0.00 0.00 57.16 57.08 2k7s n GLU 102 Cb 0.06 0.00 -0.12 0.00 -0.02 0.00 0.00 31.44 31.36 2k7s n GLU 102 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 2k7s s ILE 103 N 2.96 -0.38 -0.37 -3.67 1.01 0.03 -3.11 121.20 117.66 2k7s s ILE 103 Ca 0.00 -0.14 -0.29 0.00 0.00 0.00 0.00 60.65 60.22 2k7s s ILE 103 Cb 0.00 -0.73 0.02 0.00 0.01 0.00 0.00 42.46 41.76 2k7s s ILE 103 CO 0.00 -0.21 1.16 -0.70 0.00 0.00 0.00 174.94 175.19 2k7s s GLU 104 N 2.37 3.89 -0.26 2.79 2.12 0.14 -1.85 118.70 127.90 2k7s s GLU 104 Ca 0.08 0.94 -0.01 0.00 0.36 0.00 0.00 54.97 56.34 2k7s s GLU 104 Cb -0.16 -3.84 0.04 0.00 0.26 0.00 0.00 34.13 30.43 2k7s s GLU 104 CO -0.15 -1.15 -0.06 0.99 -0.54 0.00 0.00 175.26 174.36 2k7s s THR 105 N 4.18 2.76 -0.61 -1.70 2.01 -0.13 -1.29 115.64 120.86 2k7s s THR 105 Ca 0.49 -1.19 -0.22 0.00 0.31 0.00 0.00 61.69 61.09 2k7s s THR 105 Cb -0.12 -2.47 0.07 0.00 0.01 0.00 0.00 72.50 70.00 2k7s s THR 105 CO 0.23 0.11 0.87 -0.63 -0.69 0.00 0.00 174.62 174.51 2k7s s ILE 106 N 1.27 4.50 -0.50 1.82 1.09 -1.05 -1.60 121.20 126.73 2k7s s ILE 106 Ca -0.02 -0.41 -0.27 0.00 -1.10 0.00 0.00 60.65 58.85 2k7s s ILE 106 Cb -0.18 -4.58 0.03 0.00 -1.06 0.00 0.00 42.46 36.68 2k7s s ILE 106 CO -0.04 -1.26 1.03 -0.63 -0.10 0.00 0.00 174.94 173.94 2k7s s ILE 107 N 3.59 4.30 -0.17 2.92 1.01 -0.68 -1.74 121.20 130.43 2k7s s ILE 107 Ca 0.20 0.83 -0.06 0.00 0.00 0.00 0.00 60.65 61.61 2k7s s ILE 107 Cb -0.18 -4.55 -0.04 0.00 0.01 0.00 0.00 42.46 37.70 2k7s s ILE 107 CO 0.11 -1.02 0.04 0.00 0.00 0.00 0.00 174.94 174.07 2k7s s THR 109 N 0.26 2.30 0.00 0.00 -4.23 0.04 -0.34 115.64 113.66 2k7s s THR 109 Ca 0.03 0.28 0.00 0.00 -1.18 0.00 0.00 61.69 60.82 2k7s s THR 109 Cb -0.13 -3.17 0.00 0.00 1.34 0.00 0.00 72.50 70.54 2k7s s THR 109 CO 0.01 0.05 0.00 -3.20 -0.54 0.00 0.00 174.62 170.94 2k7s n ASN 110 N 0.21 0.00 -1.68 3.99 2.85 0.32 -4.83 115.26 116.13 2k7s n ASN 110 Ca 0.03 0.00 -0.11 0.00 -0.11 0.00 0.00 54.58 54.39 2k7s n ASN 110 Cb 0.42 0.00 -0.03 0.00 1.24 0.00 0.00 39.78 41.40 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 -1.05 -0.17 -2.17 -0.44 -2.24 -1.16 -4.45 114.28 102.60 2k7s n THR 111 Ca 0.00 0.00 0.10 0.00 -2.27 0.00 0.00 64.05 61.88 2k7s n THR 111 Cb 0.00 -1.18 -0.03 0.00 -2.10 0.00 0.00 70.33 67.02 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 -0.72 -6.24 0.00 3.42 5.03 -1.26 -4.68 115.26 110.81 2k7s n ASN 112 Ca -0.11 0.83 0.00 0.00 0.87 0.00 0.00 54.58 56.16 2k7s n ASN 112 Cb 0.43 -2.39 0.00 0.00 -1.02 0.00 0.00 39.78 36.81 2k7s n ASN 112 CO 0.00 0.00 0.00 0.52 -1.83 0.00 0.00 177.26 175.95 2k7s n VAL 113 N -2.87 0.00 -3.22 2.41 0.31 -1.26 -4.67 118.33 109.03 2k7s n VAL 113 Ca 0.01 0.00 -0.33 0.00 -0.01 0.00 0.00 64.34 64.00 2k7s n VAL 113 Cb 0.35 0.00 -0.06 0.00 -0.91 0.00 0.00 33.84 33.22 2k7s n VAL 113 CO 0.00 0.00 0.00 -0.75 -1.32 0.00 0.00 176.83 174.76 2k7s s LYS 114 N 0.00 3.99 0.00 5.55 2.47 -1.26 -4.98 119.74 125.51 2k7s s LYS 114 Ca 0.00 0.59 0.00 0.00 -1.56 0.00 0.00 55.97 55.00 2k7s s LYS 114 Cb 0.00 -2.61 0.00 0.00 -1.46 0.00 0.00 37.83 33.76 2k7s s LYS 114 CO 0.00 0.27 0.00 0.09 0.16 0.00 0.00 175.35 175.87 2k7s n ASN 115 N -0.01 1.12 -4.08 1.43 5.03 -1.26 -4.68 115.26 112.81 2k7s n ASN 115 Ca 0.01 -0.26 -0.31 0.00 0.87 0.00 0.00 54.58 54.89 2k7s n ASN 115 Cb 0.52 0.74 -0.16 0.00 -1.02 0.00 0.00 39.78 39.86 2k7s n ASN 115 CO 0.00 0.00 0.00 -0.44 -1.83 0.00 0.00 177.26 174.99 2k7s s SER 116 N -0.97 2.84 -0.27 6.41 0.01 -1.26 -4.91 113.70 115.56 2k7s s SER 116 Ca 0.00 -0.54 -0.01 0.00 1.31 0.00 0.00 55.95 56.71 2k7s s SER 116 Cb 0.00 -1.29 0.00 0.00 0.21 0.00 0.00 66.02 64.94 2k7s s SER 116 CO 0.00 -0.00 0.01 -1.20 0.41 0.00 0.00 173.24 172.46 2k7s n SER 117 N 4.51 -7.48 0.00 2.44 7.64 -1.14 -5.02 113.62 114.56 2k7s n SER 117 Ca -0.19 1.32 0.00 0.00 1.01 0.00 0.00 58.87 61.01 2k7s n SER 117 Cb 0.50 -4.91 0.00 0.00 -1.01 0.00 0.00 64.21 58.80 2k7s n SER 117 CO 0.00 0.00 0.00 1.67 -3.01 0.00 0.00 175.04 173.70 2k7s n GLN 118 N 0.84 0.00 0.00 1.43 0.00 -1.26 -4.96 117.38 113.44 2k7s n GLN 118 Ca -0.02 0.15 0.10 0.00 -0.00 0.00 0.00 57.00 57.23 2k7s n GLN 118 Cb 0.09 -0.56 0.62 0.00 0.00 0.00 0.00 30.24 30.39 2k7s n GLN 118 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.06 175.15