#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k7s n ALA 2 N 0.00 1.81 -2.86 4.61 0.00 -1.26 -5.10 120.51 117.71 2k7s n ALA 2 Ca 0.00 -0.39 -0.05 0.00 0.00 0.00 0.00 53.44 52.99 2k7s n ALA 2 Cb 0.00 0.27 0.01 0.00 0.00 0.00 0.00 19.45 19.73 2k7s n ALA 2 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.50 177.38 2k7s n MET 3 N -2.70 -2.72 -3.30 0.00 0.00 -1.26 -5.05 117.12 102.10 2k7s n MET 3 Ca -0.15 2.29 -0.06 0.00 -0.00 0.00 0.00 57.70 59.78 2k7s n MET 3 Cb 0.68 -4.85 -0.06 0.00 0.00 0.00 0.00 33.22 28.99 2k7s n MET 3 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 175.97 175.46 2k7s s ASP 4 N -1.90 -0.12 -0.06 6.12 1.01 -1.26 -5.06 116.67 115.40 2k7s s ASP 4 Ca 0.11 0.26 -0.06 0.00 0.71 0.00 0.00 52.55 53.57 2k7s s ASP 4 Cb -0.03 1.35 -0.02 0.00 1.01 0.00 0.00 42.92 45.24 2k7s s ASP 4 CO 0.71 -0.30 -0.11 0.59 0.21 0.00 0.00 175.17 176.27 2k7s n ASN 5 N 5.38 0.63 -4.66 0.27 3.02 -1.26 -5.05 115.26 113.59 2k7s n ASN 5 Ca -0.02 0.11 -0.24 0.00 -0.03 0.00 0.00 54.58 54.39 2k7s n ASN 5 Cb 0.50 -0.57 -0.07 0.00 -0.61 0.00 0.00 39.78 39.03 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 -1.62 3.60 0.00 2.41 0.11 -1.26 -5.09 120.40 118.55 2k7s s VAL 6 Ca -0.09 -1.70 0.00 0.00 -2.93 0.00 0.00 61.98 57.25 2k7s s VAL 6 Cb 0.01 -2.88 0.00 0.00 -1.53 0.00 0.00 36.38 31.98 2k7s s VAL 6 CO 0.14 -0.27 0.48 0.00 -3.33 0.00 0.00 175.10 172.12 2k7s s GLN 8 N -0.97 0.67 0.00 0.00 -0.21 -1.26 -5.01 119.66 112.88 2k7s s GLN 8 Ca 0.00 -1.01 0.00 0.00 0.02 0.00 0.00 55.36 54.37 2k7s s GLN 8 Cb 0.00 -0.29 0.00 0.00 1.00 0.00 0.00 33.01 33.72 2k7s s GLN 8 CO 0.00 0.03 0.00 -0.35 -2.12 0.00 0.00 175.29 172.85 2k7s n PRO 9 N 0.83 1.99 0.00 2.91 -0.04 -1.26 -5.01 135.00 134.42 2k7s n PRO 9 Ca -0.18 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.28 2k7s n PRO 9 Cb 0.57 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.03 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 -1.26 -5.02 114.28 110.54 2k7s n THR 10 Ca 0.00 0.00 -0.07 0.00 -3.05 0.00 0.00 64.05 60.93 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 0.45 -0.10 1.09 -1.05 -1.26 -0.40 118.70 117.43 2k7s s GLU 11 Ca 0.00 0.60 0.03 0.00 -0.15 0.00 0.00 54.97 55.44 2k7s s GLU 11 Cb 0.00 0.18 0.01 0.00 -0.44 0.00 0.00 34.13 33.88 2k7s s GLU 11 CO 0.00 -0.06 -0.18 -0.59 0.95 0.00 0.00 175.26 175.38 2k7s s PHE 12 N 0.55 2.07 -0.59 4.83 -0.12 0.20 -4.88 117.98 120.04 2k7s s PHE 12 Ca -0.00 -0.89 -0.27 0.00 -0.05 0.00 0.00 56.93 55.71 2k7s s PHE 12 Cb -0.05 -1.45 0.03 0.00 -0.63 0.00 0.00 43.02 40.93 2k7s s PHE 12 CO -0.09 -0.42 1.15 0.42 -0.05 0.00 0.00 175.22 176.23 2k7s s ILE 13 N 0.68 4.06 -0.15 -4.49 1.01 -1.26 -1.70 121.20 119.36 2k7s s ILE 13 Ca -0.13 0.70 0.00 0.00 0.00 0.00 0.00 60.65 61.22 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 0.03 -1.36 -0.15 -0.55 0.00 0.00 0.00 174.94 172.91 2k7s s SER 14 N 3.04 3.71 0.24 3.58 0.15 -0.54 -0.43 113.70 123.45 2k7s s SER 14 Ca 0.39 -0.44 -0.03 0.00 0.70 0.00 0.00 55.95 56.57 2k7s s SER 14 Cb -0.09 -1.57 -0.05 0.00 -1.71 0.00 0.00 66.02 62.61 2k7s s SER 14 CO 0.23 0.10 0.47 -0.13 1.20 0.00 0.00 173.24 175.11 2k7s s ARG 15 N 0.71 3.58 0.21 5.44 0.52 0.14 -1.50 118.95 128.06 2k7s s ARG 15 Ca -0.07 -0.16 -0.21 0.00 -0.52 0.00 0.00 55.73 54.77 2k7s s ARG 15 Cb -0.16 -2.75 0.07 0.00 0.52 0.00 0.00 34.95 32.64 2k7s s ARG 15 CO 0.02 0.32 0.98 -3.38 0.02 0.00 0.00 175.30 173.26 2k7s s HIS 16 N -1.96 0.05 0.71 -0.53 -3.43 -0.90 -0.02 115.29 109.21 2k7s s HIS 16 Ca 0.41 -0.48 -0.01 0.00 -0.80 0.00 0.00 55.06 54.18 2k7s s HIS 16 Cb -0.11 0.72 0.12 0.00 -1.43 0.00 0.00 32.58 31.87 2k7s s HIS 16 CO 0.29 -1.02 0.98 0.54 -2.00 0.00 0.00 174.74 173.53 2k7s s ASN 17 N -3.28 4.42 0.34 7.38 2.20 -0.76 -0.83 114.94 124.41 2k7s s ASN 17 Ca 0.19 -0.31 0.10 0.00 -0.94 0.00 0.00 52.86 51.91 2k7s s ASN 17 Cb -0.03 -0.12 0.85 0.00 -2.00 0.00 0.00 41.25 39.95 2k7s s ASN 17 CO 0.06 -1.81 1.81 -0.29 -2.94 0.00 0.00 177.10 173.93 2k7s h ILE 18 N -0.49 0.71 -0.47 0.54 6.09 -1.92 0.48 117.51 122.45 2k7s h ILE 18 Ca -0.37 -0.22 0.04 0.00 -1.37 0.00 0.00 64.86 62.93 2k7s h ILE 18 Cb 1.27 -0.00 -0.03 0.00 0.47 0.00 0.00 36.82 38.53 2k7s h ILE 18 CO 0.42 0.12 0.31 -0.33 -3.07 0.00 0.00 178.15 175.60 2k7s h GLU 19 N 0.65 0.49 0.00 2.19 4.39 -1.97 -3.45 114.58 116.88 2k7s h GLU 19 Ca 0.54 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 60.21 2k7s h GLU 19 Cb 0.98 -0.11 0.00 0.00 -0.10 0.00 0.00 28.75 29.52 2k7s h GLU 19 CO -0.30 0.32 0.00 0.41 -1.16 0.00 0.00 179.01 178.28 2k7s n GLY 20 N -1.49 0.98 3.62 -3.84 0.00 0.17 -4.67 105.19 99.96 2k7s n GLY 20 Ca 0.05 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.60 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 -0.61 0.48 -1.72 -0.61 2.08 -1.26 -1.20 119.36 116.53 2k7s n ILE 21 Ca 0.00 -0.21 -0.39 0.00 0.56 0.00 0.00 62.75 62.71 2k7s n ILE 21 Cb 0.00 -2.02 -0.03 0.00 -0.75 0.00 0.00 39.64 36.84 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 5.61 1.31 -2.17 1.39 0.08 -0.10 -1.83 117.98 122.26 2k7s s PHE 22 Ca 0.97 1.04 0.29 0.00 0.12 0.00 0.00 56.93 59.35 2k7s s PHE 22 Cb -0.62 -3.84 1.35 0.00 -0.57 0.00 0.00 43.02 39.34 2k7s s PHE 22 CO 0.47 -2.94 1.92 0.25 -0.10 0.00 0.00 175.22 174.82 2k7s n THR 23 N 7.71 0.00 -3.62 0.64 -2.24 0.97 -0.27 114.28 117.47 2k7s n THR 23 Ca 0.30 -0.13 -0.06 0.00 -2.27 0.00 0.00 64.05 61.88 2k7s n THR 23 Cb 0.51 0.07 -0.05 0.00 -2.10 0.00 0.00 70.33 68.75 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 -2.10 -0.23 -0.10 4.78 5.36 -0.83 -4.92 117.98 119.95 2k7s s PHE 24 Ca 0.39 0.44 -0.04 0.00 -0.96 0.00 0.00 56.93 56.76 2k7s s PHE 24 Cb 0.21 0.46 0.05 0.00 -0.34 0.00 0.00 43.02 43.40 2k7s s PHE 24 CO 0.38 -0.17 0.22 0.08 -1.46 0.00 0.00 175.22 174.26 2k7s s VAL 25 N -0.70 -0.18 0.07 3.12 1.01 -1.26 0.28 120.40 122.74 2k7s s VAL 25 Ca 0.04 0.23 -0.31 0.00 0.00 0.00 0.00 61.98 61.94 2k7s s VAL 25 Cb -0.02 -0.36 -0.06 0.00 0.00 0.00 0.00 36.38 35.94 2k7s s VAL 25 CO -0.05 0.09 1.28 -0.62 0.00 0.00 0.00 175.10 175.80 2k7s s ASP 26 N 1.74 6.97 0.21 3.32 2.15 0.43 -4.62 116.67 126.87 2k7s s ASP 26 Ca -0.04 2.13 0.08 0.00 0.43 0.00 0.00 52.55 55.14 2k7s s ASP 26 Cb -0.11 -2.58 0.42 0.00 -0.30 0.00 0.00 42.92 40.34 2k7s s ASP 26 CO -0.08 -0.55 1.08 0.00 -0.17 0.00 0.00 175.17 175.45 2k7s n HIS 27 N 4.05 0.26 0.28 -5.34 -0.00 -1.26 -0.37 115.22 112.84 2k7s n HIS 27 Ca 0.10 0.14 0.16 0.00 -0.00 0.00 0.00 57.72 58.11 2k7s n HIS 27 Cb 0.45 -0.49 0.91 0.00 -0.00 0.00 0.00 29.99 30.85 2k7s n HIS 27 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 2k7s h ARG 28 N 0.00 0.00 -0.41 -1.40 2.47 -1.89 -1.99 114.38 111.15 2k7s h ARG 28 Ca 0.00 0.00 0.12 0.00 -1.26 0.00 0.00 59.98 58.84 2k7s h ARG 28 Cb 0.59 0.00 -0.02 0.00 -1.65 0.00 0.00 29.97 28.89 2k7s h ARG 28 CO 0.00 0.00 0.36 0.00 0.56 0.00 0.00 179.97 180.89 2k7s h VAL 30 N 0.00 1.50 0.00 0.00 -1.51 -1.19 0.36 116.25 115.41 2k7s h VAL 30 Ca 0.20 -2.64 -0.18 0.00 -1.23 0.00 0.00 66.70 62.85 2k7s h VAL 30 Cb 0.92 2.48 -0.03 0.00 -2.13 0.00 0.00 31.29 32.54 2k7s h VAL 30 CO -0.00 0.77 -0.92 0.00 -1.23 0.00 0.00 177.57 176.18 2k7s h ALA 31 N 0.96 0.53 0.00 5.19 0.00 -1.25 -0.80 119.26 123.89 2k7s h ALA 31 Ca -0.05 -0.79 -0.00 0.00 0.00 0.00 0.00 54.91 54.07 2k7s h ALA 31 Cb 1.52 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 19.28 2k7s h ALA 31 CO 0.14 1.02 -0.04 1.15 0.00 0.00 0.00 179.25 181.53 2k7s h THR 32 N 0.00 0.16 -0.12 0.00 2.02 -0.65 -3.40 112.91 110.92 2k7s h THR 32 Ca -0.05 -1.12 0.00 0.00 0.77 0.00 0.00 66.41 66.01 2k7s h THR 32 Cb 1.64 0.30 0.00 0.00 -1.74 0.00 0.00 68.15 68.34 2k7s h THR 32 CO 0.09 0.05 0.00 1.33 0.37 0.00 0.00 175.52 177.37 2k7s n VAL 33 N -4.75 1.02 0.00 3.16 0.24 0.12 -4.33 118.33 113.78 2k7s n VAL 33 Ca -0.01 -1.02 0.00 0.00 -2.04 0.00 0.00 64.34 61.27 2k7s n VAL 33 Cb 0.06 0.49 0.00 0.00 -1.47 0.00 0.00 33.84 32.92 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 -0.16 1.92 3.64 7.63 0.00 -0.31 0.43 105.19 118.34 2k7s n GLY 34 Ca 0.04 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.63 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 -0.11 2.50 0.85 1.61 2.02 -1.20 -4.56 117.35 118.46 2k7s s TYR 35 Ca 0.00 0.75 -0.13 0.00 -0.37 0.00 0.00 57.07 57.32 2k7s s TYR 35 Cb 0.00 -3.82 0.06 0.00 -0.40 0.00 0.00 41.96 37.79 2k7s s TYR 35 CO 0.00 -2.25 0.86 1.04 -1.57 0.00 0.00 175.55 173.63 2k7s n GLN 36 N 7.21 -0.02 -0.34 -0.62 6.02 -1.26 -2.81 117.38 125.56 2k7s n GLN 36 Ca 0.16 0.06 0.18 0.00 -0.01 0.00 0.00 57.00 57.39 2k7s n GLN 36 Cb 0.45 -2.16 0.40 0.00 1.02 0.00 0.00 30.24 29.95 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 -1.13 0.55 0.00 -1.09 0.11 -1.84 0.78 132.00 129.37 2k7s h PRO 37 Ca -0.45 -0.03 -0.12 0.00 0.11 0.00 0.00 66.00 65.50 2k7s h PRO 37 Cb 1.30 -0.12 -0.02 0.00 0.11 0.00 0.00 31.00 32.27 2k7s h PRO 37 CO 0.41 0.36 -0.59 -0.56 -0.21 0.00 0.00 178.00 177.42 2k7s h GLN 38 N 0.57 0.00 0.00 1.05 3.07 -1.88 0.30 115.11 118.21 2k7s h GLN 38 Ca 0.63 0.00 0.00 0.00 0.09 0.00 0.00 58.65 59.37 2k7s h GLN 38 Cb 1.25 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.81 2k7s h GLN 38 CO -0.44 0.59 0.00 -1.91 0.09 0.00 0.00 178.83 177.16 2k7s n GLU 39 N -3.74 0.05 -0.04 0.06 2.13 0.26 -2.92 120.64 116.45 2k7s n GLU 39 Ca -0.01 0.34 -0.05 0.00 0.66 0.00 0.00 57.16 58.10 2k7s n GLU 39 Cb 0.61 -1.61 -0.04 0.00 0.27 0.00 0.00 31.44 30.67 2k7s n GLU 39 CO 0.00 0.00 0.00 1.28 -0.41 0.00 0.00 177.13 178.00 2k7s n LEU 40 N -1.71 2.35 -4.64 4.31 7.99 -0.78 -4.82 117.00 119.70 2k7s n LEU 40 Ca 0.02 -0.04 -0.49 0.00 -0.01 0.00 0.00 56.01 55.50 2k7s n LEU 40 Cb 0.15 -0.19 -0.05 0.00 -0.11 0.00 0.00 43.42 43.22 2k7s n LEU 40 CO 0.13 0.54 1.11 0.18 -1.51 0.00 0.00 177.39 177.84 2k7s n LEU 41 N -2.64 2.56 0.00 2.23 4.77 0.10 -0.35 117.00 123.67 2k7s n LEU 41 Ca -0.14 1.09 0.00 0.00 -0.03 0.00 0.00 56.01 56.93 2k7s n LEU 41 Cb 0.67 -1.32 0.00 0.00 -2.33 0.00 0.00 43.42 40.43 2k7s n LEU 41 CO 0.09 -0.56 0.00 0.61 -1.33 0.00 0.00 177.39 176.21 2k7s n GLY 42 N 3.18 1.07 3.70 -0.72 0.00 0.62 -4.91 105.19 108.13 2k7s n GLY 42 Ca 0.18 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.86 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 2.95 -0.21 1.61 1.02 0.53 -4.73 119.74 120.64 2k7s s LYS 43 Ca 0.00 -0.47 -0.29 0.00 0.02 0.00 0.00 55.97 55.23 2k7s s LYS 43 Cb 0.00 -2.78 -0.03 0.00 -0.52 0.00 0.00 37.83 34.51 2k7s s LYS 43 CO 0.00 0.68 1.60 1.21 -0.92 0.00 0.00 175.35 177.91 2k7s s ASN 44 N -1.18 6.43 0.29 2.83 3.84 -1.26 -0.93 114.94 124.96 2k7s s ASN 44 Ca 0.16 1.66 0.03 0.00 0.21 0.00 0.00 52.86 54.93 2k7s s ASN 44 Cb -0.11 -2.53 0.72 0.00 -0.55 0.00 0.00 41.25 38.78 2k7s s ASN 44 CO 0.06 -1.21 1.69 -0.29 -2.79 0.00 0.00 177.10 174.56 2k7s h ILE 45 N 6.07 0.45 0.00 -5.21 2.10 -1.43 0.25 117.51 119.74 2k7s h ILE 45 Ca -0.34 -0.13 -0.08 0.00 1.08 0.00 0.00 64.86 65.40 2k7s h ILE 45 Cb 1.15 0.05 -0.01 0.00 -1.09 0.00 0.00 36.82 36.92 2k7s h ILE 45 CO 1.00 0.07 -0.36 -0.37 -1.08 0.00 0.00 178.15 177.40 2k7s h VAL 46 N 0.36 1.04 -0.81 2.19 -1.51 -1.83 -2.53 116.25 113.17 2k7s h VAL 46 Ca 0.56 -1.35 0.21 0.00 -1.23 0.00 0.00 66.70 64.89 2k7s h VAL 46 Cb 1.07 1.77 -0.05 0.00 -2.13 0.00 0.00 31.29 31.96 2k7s h VAL 46 CO -0.55 0.36 0.56 -0.33 -1.23 0.00 0.00 177.57 176.38 2k7s h GLU 47 N 0.00 0.19 0.11 5.19 5.08 -0.88 0.37 114.58 124.63 2k7s h GLU 47 Ca -0.00 -0.01 -0.29 0.00 -1.00 0.00 0.00 59.36 58.05 2k7s h GLU 47 Cb 0.74 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.94 2k7s h GLU 47 CO 0.05 0.12 -1.47 0.74 -1.00 0.00 0.00 179.01 177.46 2k7s h PHE 48 N 0.19 0.41 -3.33 4.33 -1.00 -1.49 -3.47 116.94 112.58 2k7s h PHE 48 Ca 0.40 -0.30 -0.57 0.00 2.81 0.00 0.00 57.97 60.31 2k7s h PHE 48 Cb 1.28 -0.02 0.14 0.00 3.61 0.00 0.00 35.95 40.97 2k7s h PHE 48 CO -0.00 1.32 0.22 0.00 -1.61 0.00 0.00 178.31 178.24 2k7s s HIS 50 N -1.34 2.73 0.21 0.00 2.46 0.68 -4.69 115.29 115.34 2k7s s HIS 50 Ca 0.67 0.40 -0.20 0.00 0.47 0.00 0.00 55.06 56.39 2k7s s HIS 50 Cb -0.50 -4.01 0.17 0.00 -0.13 0.00 0.00 32.58 28.11 2k7s s HIS 50 CO 0.54 -3.91 1.56 -1.35 -2.47 0.00 0.00 174.74 169.11 2k7s h PRO 51 N 7.48 -0.05 -0.40 2.88 0.11 -1.90 0.55 132.00 140.69 2k7s h PRO 51 Ca -0.43 0.00 0.11 0.00 0.11 0.00 0.00 66.00 65.80 2k7s h PRO 51 Cb 1.20 0.01 -0.02 0.00 0.11 0.00 0.00 31.00 32.31 2k7s h PRO 51 CO 0.93 -0.03 0.46 0.93 -0.21 0.00 0.00 178.00 180.08 2k7s h GLU 52 N -0.05 0.00 0.00 1.05 4.39 -2.00 0.58 114.58 118.55 2k7s h GLU 52 Ca 0.29 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.99 2k7s h GLU 52 Cb 0.57 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.22 2k7s h GLU 52 CO -0.91 0.00 -0.75 -0.25 -1.16 0.00 0.00 179.01 175.94 2k7s n ASP 53 N -3.63 0.75 0.25 1.42 8.00 0.15 -4.47 116.55 119.04 2k7s n ASP 53 Ca 0.07 -0.75 0.09 0.00 0.71 0.00 0.00 54.79 54.90 2k7s n ASP 53 Cb 0.63 1.06 0.65 0.00 -0.02 0.00 0.00 41.12 43.44 2k7s n ASP 53 CO 0.00 0.00 0.00 1.56 -0.39 0.00 0.00 177.20 178.37 2k7s h GLN 54 N 0.00 0.00 0.00 -1.24 4.20 0.20 0.54 115.11 118.81 2k7s h GLN 54 Ca 0.00 0.00 -0.09 0.00 0.06 0.00 0.00 58.65 58.62 2k7s h GLN 54 Cb 0.36 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.13 2k7s h GLN 54 CO 0.00 0.08 -0.45 0.37 -0.67 0.00 0.00 178.83 178.16 2k7s h GLN 55 N 0.00 0.00 0.12 1.46 5.75 -1.78 -0.69 115.11 119.98 2k7s h GLN 55 Ca -0.00 0.00 -0.27 0.00 -0.15 0.00 0.00 58.65 58.23 2k7s h GLN 55 Cb 0.15 0.00 0.01 0.00 1.07 0.00 0.00 27.48 28.70 2k7s h GLN 55 CO 0.01 0.45 -1.23 1.25 -2.65 0.00 0.00 178.83 176.66 2k7s h LEU 56 N 0.00 0.45 0.47 -2.39 5.85 -1.25 -1.96 115.31 116.48 2k7s h LEU 56 Ca -0.00 -0.47 -0.02 0.00 0.84 0.00 0.00 57.88 58.22 2k7s h LEU 56 Cb 0.91 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 41.80 2k7s h LEU 56 CO 0.06 1.36 -0.23 0.25 -0.34 0.00 0.00 178.44 179.54 2k7s h LEU 57 N 0.09 -0.53 -1.18 2.25 5.85 -0.81 -1.90 115.31 119.07 2k7s h LEU 57 Ca -0.13 -0.08 0.10 0.00 0.84 0.00 0.00 57.88 58.60 2k7s h LEU 57 Cb 1.95 0.14 -0.07 0.00 0.37 0.00 0.00 40.66 43.05 2k7s h LEU 57 CO 0.20 -0.17 0.58 0.03 -0.34 0.00 0.00 178.44 178.75 2k7s h ARG 58 N -0.96 0.87 -0.35 1.25 3.08 -1.24 -1.33 114.38 115.69 2k7s h ARG 58 Ca -0.06 -0.05 0.06 0.00 0.07 0.00 0.00 59.98 59.99 2k7s h ARG 58 Cb 0.59 -0.20 -0.05 0.00 0.08 0.00 0.00 29.97 30.39 2k7s h ARG 58 CO 0.11 0.58 0.05 0.22 -1.07 0.00 0.00 179.97 179.86 2k7s h ASP 59 N 0.90 -0.03 -0.01 7.04 1.82 -1.21 0.80 116.42 125.74 2k7s h ASP 59 Ca 0.42 0.06 0.03 0.00 -0.39 0.00 0.00 57.03 57.16 2k7s h ASP 59 Cb 0.41 0.10 -0.05 0.00 0.68 0.00 0.00 39.33 40.47 2k7s h ASP 59 CO -0.18 0.02 -0.34 0.77 -1.61 0.00 0.00 179.24 177.89 2k7s h SER 60 N 0.16 -1.03 -0.78 2.28 4.64 -0.42 0.21 113.55 118.63 2k7s h SER 60 Ca 0.17 0.13 0.13 0.00 -0.47 0.00 0.00 61.79 61.75 2k7s h SER 60 Cb 0.21 0.41 -0.05 0.00 -0.31 0.00 0.00 62.40 62.65 2k7s h SER 60 CO -0.24 -0.40 0.51 -0.26 -0.87 0.00 0.00 176.83 175.57 2k7s h PHE 61 N -0.49 0.63 0.00 4.77 0.04 -1.05 0.33 116.94 121.17 2k7s h PHE 61 Ca 0.06 0.02 -0.08 0.00 2.80 0.00 0.00 57.97 60.77 2k7s h PHE 61 Cb 0.58 -0.20 -0.01 0.00 2.20 0.00 0.00 35.95 38.52 2k7s h PHE 61 CO -0.37 0.26 -0.39 1.96 -0.60 0.00 0.00 178.31 179.18 2k7s h GLN 62 N 0.56 0.00 0.17 1.51 1.08 0.81 -1.93 115.11 117.31 2k7s h GLN 62 Ca 0.38 0.00 -0.22 0.00 -1.45 0.00 0.00 58.65 57.35 2k7s h GLN 62 Cb 0.68 0.00 0.03 0.00 -0.05 0.00 0.00 27.48 28.13 2k7s h GLN 62 CO -0.14 0.39 -0.99 1.96 -0.95 0.00 0.00 178.83 179.10 2k7s h GLN 63 N 0.00 0.36 -0.22 1.46 1.08 0.14 -1.82 115.11 116.11 2k7s h GLN 63 Ca -0.00 -0.61 -0.05 0.00 -1.45 0.00 0.00 58.65 56.53 2k7s h GLN 63 Cb 0.71 0.23 -0.01 0.00 -0.05 0.00 0.00 27.48 28.36 2k7s h GLN 63 CO 0.05 1.29 -0.10 -0.39 -0.95 0.00 0.00 178.83 178.73 2k7s h VAL 64 N -0.25 1.19 0.00 -0.54 -1.51 -0.94 -0.13 116.25 114.07 2k7s h VAL 64 Ca -0.17 -0.82 -0.15 0.00 -1.23 0.00 0.00 66.70 64.32 2k7s h VAL 64 Cb 1.77 1.14 -0.02 0.00 -2.13 0.00 0.00 31.29 32.05 2k7s h VAL 64 CO 0.18 0.26 -0.92 1.62 -1.23 0.00 0.00 177.57 177.48 2k7s h VAL 65 N 0.33 0.90 -0.01 7.19 3.04 -1.44 0.24 116.25 126.50 2k7s h VAL 65 Ca 0.07 -2.38 -0.26 0.00 -1.01 0.00 0.00 66.70 63.11 2k7s h VAL 65 Cb 0.38 2.38 0.02 0.00 -2.01 0.00 0.00 31.29 32.06 2k7s h VAL 65 CO 0.02 0.51 -1.02 0.11 -1.01 0.00 0.00 177.57 176.18 2k7s h LYS 66 N 0.00 0.67 -0.02 4.17 1.57 -0.87 -3.18 116.57 118.91 2k7s h LYS 66 Ca -0.07 -0.71 0.00 0.00 -1.87 0.00 0.00 60.65 58.00 2k7s h LYS 66 Cb 1.54 0.20 0.00 0.00 0.08 0.00 0.00 32.23 34.05 2k7s h LYS 66 CO 0.07 1.30 -0.06 1.28 -0.57 0.00 0.00 179.45 181.47 2k7s n LEU 67 N -3.84 2.25 -2.38 2.94 4.77 -0.10 -5.02 117.00 115.61 2k7s n LEU 67 Ca -0.10 -0.75 0.00 0.00 -0.03 0.00 0.00 56.01 55.13 2k7s n LEU 67 Cb 0.87 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.95 2k7s n LEU 67 CO 0.55 0.38 -0.25 1.17 -1.33 0.00 0.00 177.39 177.91 2k7s n LYS 68 N 0.68 -0.42 0.00 3.23 3.00 0.78 -3.79 118.16 121.64 2k7s n LYS 68 Ca 0.15 0.66 0.00 0.00 -0.00 0.00 0.00 58.31 59.12 2k7s n LYS 68 Cb 0.48 -0.67 0.00 0.00 0.00 0.00 0.00 35.03 34.84 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 1.40 2.65 3.68 3.14 0.00 -0.91 -4.95 105.19 110.20 2k7s n GLY 69 Ca 0.00 -0.85 -0.45 0.00 0.00 0.00 0.00 46.02 44.72 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 2.45 -2.84 1.61 -0.06 -1.25 -4.40 117.38 112.89 2k7s n GLN 70 Ca 0.00 0.89 -0.36 0.00 -2.00 0.00 0.00 57.00 55.53 2k7s n GLN 70 Cb 0.00 -2.73 -0.06 0.00 -4.06 0.00 0.00 30.24 23.38 2k7s n GLN 70 CO 0.00 0.00 0.00 0.08 -0.20 0.00 0.00 177.06 176.94 2k7s s VAL 71 N 2.39 4.31 0.13 1.69 1.01 -1.26 -4.10 120.40 124.58 2k7s s VAL 71 Ca 0.83 1.65 0.10 0.00 0.00 0.00 0.00 61.98 64.56 2k7s s VAL 71 Cb -0.59 -3.89 -0.04 0.00 0.00 0.00 0.00 36.38 31.86 2k7s s VAL 71 CO 0.40 0.04 -0.20 -0.76 0.00 0.00 0.00 175.10 174.58 2k7s s LEU 72 N -2.32 2.60 -0.16 3.92 2.01 0.14 -4.94 118.68 119.92 2k7s s LEU 72 Ca 0.52 -0.64 -0.02 0.00 0.01 0.00 0.00 54.13 54.00 2k7s s LEU 72 Cb -0.16 -1.44 0.05 0.00 0.01 0.00 0.00 46.19 44.65 2k7s s LEU 72 CO 0.21 0.17 -0.00 -0.55 1.01 0.00 0.00 176.35 177.18 2k7s s SER 73 N -2.23 2.65 -0.01 2.29 0.15 -1.24 -1.91 113.70 113.40 2k7s s SER 73 Ca 0.18 -0.64 0.01 0.00 0.70 0.00 0.00 55.95 56.20 2k7s s SER 73 Cb -0.10 -0.68 0.01 0.00 -1.71 0.00 0.00 66.02 63.54 2k7s s SER 73 CO 0.09 -0.25 -0.02 0.68 1.20 0.00 0.00 173.24 174.95 2k7s s VAL 74 N 1.80 0.24 -0.20 4.45 -7.23 -1.12 -4.93 120.40 113.40 2k7s s VAL 74 Ca 0.01 -0.06 -0.11 0.00 -1.81 0.00 0.00 61.98 60.00 2k7s s VAL 74 Cb -0.16 -0.25 -0.05 0.00 0.56 0.00 0.00 36.38 36.49 2k7s s VAL 74 CO -0.07 0.10 0.19 -0.04 -0.31 0.00 0.00 175.10 174.97 2k7s s MET 75 N 0.31 4.17 0.13 4.82 -1.94 -1.26 -0.76 119.30 124.77 2k7s s MET 75 Ca -0.03 -0.14 -0.03 0.00 -1.71 0.00 0.00 55.69 53.79 2k7s s MET 75 Cb -0.06 -3.47 -0.03 0.00 2.01 0.00 0.00 34.83 33.28 2k7s s MET 75 CO -0.01 0.18 0.10 -0.59 -0.01 0.00 0.00 175.02 174.70 2k7s s PHE 76 N 0.68 0.72 -0.45 -0.03 -0.71 -0.17 -4.94 117.98 113.08 2k7s s PHE 76 Ca 0.10 -1.11 -0.19 0.00 -1.04 0.00 0.00 56.93 54.70 2k7s s PHE 76 Cb -0.12 -0.37 0.03 0.00 -1.21 0.00 0.00 43.02 41.35 2k7s s PHE 76 CO 0.02 -0.55 0.55 1.03 -1.34 0.00 0.00 175.22 174.92 2k7s s ARG 77 N -4.02 3.16 -0.52 1.99 0.52 -1.26 -0.29 118.95 118.53 2k7s s ARG 77 Ca 0.21 -0.68 -0.21 0.00 -0.52 0.00 0.00 55.73 54.53 2k7s s ARG 77 Cb 0.07 -4.00 0.05 0.00 0.52 0.00 0.00 34.95 31.59 2k7s s ARG 77 CO 0.00 -0.99 0.74 0.12 0.02 0.00 0.00 175.30 175.19 2k7s s PHE 78 N 2.46 2.96 -0.39 -0.53 2.19 0.63 -0.23 117.98 125.07 2k7s s PHE 78 Ca 0.16 -0.30 -0.27 0.00 0.33 0.00 0.00 56.93 56.84 2k7s s PHE 78 Cb -0.17 -3.72 -0.04 0.00 -1.31 0.00 0.00 43.02 37.78 2k7s s PHE 78 CO 0.15 -1.13 2.09 0.50 1.83 0.00 0.00 175.22 178.66 2k7s s ARG 79 N 3.13 2.82 0.22 10.12 3.00 -0.90 -0.98 118.95 136.37 2k7s s ARG 79 Ca 0.21 1.46 -0.04 0.00 -1.00 0.00 0.00 55.73 56.36 2k7s s ARG 79 Cb -0.16 -4.38 0.05 0.00 0.00 0.00 0.00 34.95 30.45 2k7s s ARG 79 CO 0.15 -2.46 0.30 -1.13 0.00 0.00 0.00 175.30 172.16 2k7s n SER 80 N 12.62 0.03 0.24 -2.12 3.41 -0.64 -4.81 113.62 122.35 2k7s n SER 80 Ca 0.28 -1.11 0.10 0.00 -0.26 0.00 0.00 58.87 57.88 2k7s n SER 80 Cb 0.49 -0.23 0.60 0.00 -0.26 0.00 0.00 64.21 64.81 2k7s n SER 80 CO 0.00 0.00 0.00 0.50 -0.16 0.00 0.00 175.04 175.38 2k7s h LYS 81 N 0.00 0.00 -0.01 4.33 1.63 -0.35 0.67 116.57 122.84 2k7s h LYS 81 Ca -0.10 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.70 2k7s h LYS 81 Cb 0.27 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 31.90 2k7s h LYS 81 CO 0.07 0.19 0.00 0.09 -3.45 0.00 0.00 179.45 176.35 2k7s n ASN 82 N -3.75 0.34 -2.94 4.20 3.02 -1.26 -4.90 115.26 109.97 2k7s n ASN 82 Ca -0.02 -1.18 -0.15 0.00 -0.03 0.00 0.00 54.58 53.20 2k7s n ASN 82 Cb 0.30 -0.00 0.07 0.00 -0.61 0.00 0.00 39.78 39.53 2k7s n ASN 82 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2k7s n GLN 83 N -0.70 -5.58 -4.67 3.52 6.02 0.23 -5.03 117.38 111.17 2k7s n GLN 83 Ca 0.21 0.67 -0.23 0.00 -0.01 0.00 0.00 57.00 57.64 2k7s n GLN 83 Cb 0.16 -5.18 -0.15 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 -5.37 1.19 -1.02 -1.09 0.41 -1.26 -4.86 118.70 106.71 2k7s s GLU 84 Ca 0.14 -0.51 -0.24 0.00 -0.41 0.00 0.00 54.97 53.95 2k7s s GLU 84 Cb -0.06 -1.14 -0.07 0.00 -1.78 0.00 0.00 34.13 31.07 2k7s s GLU 84 CO 0.58 0.30 1.96 -1.58 -0.49 0.00 0.00 175.26 176.03 2k7s s TRP 85 N -0.31 1.83 -0.62 1.61 0.23 -1.26 -1.62 118.94 118.80 2k7s s TRP 85 Ca 0.05 0.64 -0.28 0.00 -2.03 0.00 0.00 56.10 54.49 2k7s s TRP 85 Cb -0.06 -3.99 0.02 0.00 0.03 0.00 0.00 33.47 29.47 2k7s s TRP 85 CO -0.00 -1.48 1.33 -0.51 0.96 0.00 0.00 176.95 177.25 2k7s s LEU 86 N 10.80 3.34 0.14 2.99 1.43 -0.15 -4.66 118.68 132.57 2k7s s LEU 86 Ca 0.70 0.01 -0.31 0.00 -1.03 0.00 0.00 54.13 53.50 2k7s s LEU 86 Cb -0.04 -2.91 -0.10 0.00 0.03 0.00 0.00 46.19 43.16 2k7s s LEU 86 CO 0.06 -1.72 1.71 0.26 0.23 0.00 0.00 176.35 176.89 2k7s s TRP 87 N 5.79 2.56 0.11 0.29 0.52 -1.26 -0.27 118.94 126.69 2k7s s TRP 87 Ca 0.45 0.27 0.01 0.00 0.02 0.00 0.00 56.10 56.85 2k7s s TRP 87 Cb -0.09 -4.07 -0.04 0.00 -1.15 0.00 0.00 33.47 28.12 2k7s s TRP 87 CO 0.22 -4.21 -0.03 -1.64 0.02 0.00 0.00 176.95 171.31 2k7s s MET 88 N 2.06 0.88 -0.17 4.98 -1.94 0.60 -1.45 119.30 124.27 2k7s s MET 88 Ca 0.76 -1.38 0.01 0.00 -1.71 0.00 0.00 55.69 53.37 2k7s s MET 88 Cb -0.45 -0.09 0.02 0.00 2.01 0.00 0.00 34.83 36.31 2k7s s MET 88 CO 0.33 -0.09 -0.20 1.03 -0.01 0.00 0.00 175.02 176.08 2k7s s ARG 89 N -3.90 3.02 -0.06 2.03 0.52 0.29 -1.00 118.95 119.85 2k7s s ARG 89 Ca 0.16 -0.83 -0.13 0.00 -0.52 0.00 0.00 55.73 54.40 2k7s s ARG 89 Cb 0.06 -2.54 -0.05 0.00 0.52 0.00 0.00 34.95 32.94 2k7s s ARG 89 CO -0.03 -0.14 0.34 0.95 0.02 0.00 0.00 175.30 176.44 2k7s s THR 90 N 1.14 5.19 -0.83 0.02 -4.23 0.06 -1.23 115.64 115.75 2k7s s THR 90 Ca 0.01 0.67 0.01 0.00 -1.18 0.00 0.00 61.69 61.21 2k7s s THR 90 Cb -0.14 -3.65 0.25 0.00 1.34 0.00 0.00 72.50 70.30 2k7s s THR 90 CO -0.09 0.53 0.92 -1.20 -0.54 0.00 0.00 174.62 174.23 2k7s n SER 91 N 2.37 4.49 -4.65 3.99 7.64 -0.77 -2.79 113.62 123.89 2k7s n SER 91 Ca -0.14 -3.32 -0.41 0.00 1.01 0.00 0.00 58.87 56.01 2k7s n SER 91 Cb 0.53 -0.94 -0.05 0.00 -1.01 0.00 0.00 64.21 62.73 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 -1.51 6.76 -0.13 6.43 0.01 -0.80 -2.47 113.70 122.00 2k7s s SER 92 Ca 0.33 0.94 -0.21 0.00 1.31 0.00 0.00 55.95 58.31 2k7s s SER 92 Cb 0.04 -2.39 0.05 0.00 0.21 0.00 0.00 66.02 63.93 2k7s s SER 92 CO -0.03 -0.37 0.54 0.00 0.41 0.00 0.00 173.24 173.78 2k7s s GLN 93 N 2.26 0.76 -0.23 12.44 -2.07 -0.73 0.23 119.66 132.32 2k7s s GLN 93 Ca 0.32 0.43 -0.42 0.00 -1.82 0.00 0.00 55.36 53.87 2k7s s GLN 93 Cb -0.16 0.36 -0.19 0.00 -1.09 0.00 0.00 33.01 31.93 2k7s s GLN 93 CO 0.10 -0.17 1.42 0.25 -1.32 0.00 0.00 175.29 175.58 2k7s n THR 94 N 1.97 0.05 -0.70 3.63 -2.24 -1.26 0.12 114.28 115.86 2k7s n THR 94 Ca -0.17 -0.01 -0.20 0.00 -2.27 0.00 0.00 64.05 61.41 2k7s n THR 94 Cb 0.56 -0.51 0.09 0.00 -2.10 0.00 0.00 70.33 68.38 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 3.25 -0.82 -1.47 6.98 0.00 -1.16 -4.55 120.51 122.74 2k7s n ALA 95 Ca 0.25 -0.89 -0.34 0.00 0.00 0.00 0.00 53.44 52.47 2k7s n ALA 95 Cb 0.05 -0.73 0.07 0.00 0.00 0.00 0.00 19.45 18.84 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 -0.03 2.83 -1.50 0.00 1.13 -1.26 -4.45 117.38 114.10 2k7s n GLN 96 Ca 0.02 -3.44 0.00 0.00 -1.94 0.00 0.00 57.00 51.64 2k7s n GLN 96 Cb 0.38 -2.29 0.00 0.00 0.11 0.00 0.00 30.24 28.45 2k7s n GLN 96 CO 0.00 0.00 0.00 0.09 -1.44 0.00 0.00 177.06 175.71 2k7s n ASN 97 N -0.87 -8.07 0.00 1.08 3.02 -1.26 -4.77 115.26 104.39 2k7s n ASN 97 Ca 0.60 1.74 0.11 0.00 -0.03 0.00 0.00 54.58 57.00 2k7s n ASN 97 Cb 0.68 -4.76 0.67 0.00 -0.61 0.00 0.00 39.78 35.76 2k7s n ASN 97 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 2k7s n PRO 98 N -2.42 0.69 -0.19 3.52 -0.04 -1.26 -4.75 135.00 130.55 2k7s n PRO 98 Ca 0.00 0.00 -0.03 0.00 -0.04 0.00 0.00 63.50 63.44 2k7s n PRO 98 Cb 0.42 -1.50 0.02 0.00 -0.04 0.00 0.00 33.50 32.40 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 -1.02 0.31 -0.08 0.54 4.01 -1.26 -4.35 117.16 115.32 2k7s n TYR 99 Ca 0.17 -0.72 0.17 0.00 -0.16 0.00 0.00 57.90 57.36 2k7s n TYR 99 Cb 0.08 -0.36 0.58 0.00 -0.31 0.00 0.00 39.34 39.34 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 0.25 0.22 -0.08 7.72 0.87 -1.85 0.73 113.55 121.40 2k7s h SER 100 Ca 0.06 0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.63 2k7s h SER 100 Cb 1.16 -0.03 0.00 0.00 -0.44 0.00 0.00 62.40 63.09 2k7s h SER 100 CO 0.12 0.12 0.00 -0.90 -0.53 0.00 0.00 176.83 175.64 2k7s n ASP 101 N -4.43 1.13 0.00 6.23 5.75 -1.26 -4.30 116.55 119.66 2k7s n ASP 101 Ca 0.11 -2.07 0.00 0.00 -0.01 0.00 0.00 54.79 52.83 2k7s n ASP 101 Cb 0.53 -0.33 0.00 0.00 -1.03 0.00 0.00 41.12 40.29 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 -0.05 3.73 -3.41 0.11 1.02 0.26 -4.80 120.64 117.49 2k7s n GLU 102 Ca 0.03 0.00 -0.14 0.00 -0.02 0.00 0.00 57.16 57.04 2k7s n GLU 102 Cb 0.25 0.00 -0.10 0.00 -0.02 0.00 0.00 31.44 31.57 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 1.48 -0.47 -0.49 -3.67 1.01 -0.01 -2.99 121.20 116.05 2k7s s ILE 103 Ca 0.00 -0.12 -0.29 0.00 0.00 0.00 0.00 60.65 60.24 2k7s s ILE 103 Cb 0.00 -0.77 0.03 0.00 0.01 0.00 0.00 42.46 41.73 2k7s s ILE 103 CO 0.00 -0.18 1.18 -0.70 0.00 0.00 0.00 174.94 175.24 2k7s s GLU 104 N 2.44 3.66 -0.25 2.79 2.12 0.12 -2.12 118.70 127.47 2k7s s GLU 104 Ca 0.10 0.53 -0.04 0.00 0.36 0.00 0.00 54.97 55.92 2k7s s GLU 104 Cb -0.15 -3.94 0.01 0.00 0.26 0.00 0.00 34.13 30.30 2k7s s GLU 104 CO -0.16 -1.47 -0.02 0.99 -0.54 0.00 0.00 175.26 174.06 2k7s s THR 105 N 4.68 3.37 -0.56 -1.70 2.01 -0.56 -1.78 115.64 121.10 2k7s s THR 105 Ca 0.48 -0.69 -0.19 0.00 0.31 0.00 0.00 61.69 61.61 2k7s s THR 105 Cb -0.08 -2.63 0.09 0.00 0.01 0.00 0.00 72.50 69.89 2k7s s THR 105 CO 0.31 0.28 0.67 -0.63 -0.69 0.00 0.00 174.62 174.56 2k7s s ILE 106 N 1.44 4.84 -0.52 1.82 1.09 -1.03 -1.46 121.20 127.38 2k7s s ILE 106 Ca 0.03 -0.80 -0.26 0.00 -1.10 0.00 0.00 60.65 58.53 2k7s s ILE 106 Cb -0.16 -4.41 0.03 0.00 -1.06 0.00 0.00 42.46 36.86 2k7s s ILE 106 CO -0.02 -1.00 1.03 -0.63 -0.10 0.00 0.00 174.94 174.21 2k7s s ILE 107 N 2.67 4.30 -0.17 2.92 1.01 -0.69 -1.85 121.20 129.39 2k7s s ILE 107 Ca 0.13 0.71 -0.06 0.00 0.00 0.00 0.00 60.65 61.43 2k7s s ILE 107 Cb -0.22 -4.56 -0.04 0.00 0.01 0.00 0.00 42.46 37.65 2k7s s ILE 107 CO 0.08 -1.07 0.04 0.00 0.00 0.00 0.00 174.94 174.00 2k7s s THR 109 N 0.24 2.56 0.00 0.00 -4.23 0.46 -0.55 115.64 114.11 2k7s s THR 109 Ca 0.03 0.56 0.00 0.00 -1.18 0.00 0.00 61.69 61.10 2k7s s THR 109 Cb -0.13 -3.36 0.00 0.00 1.34 0.00 0.00 72.50 70.36 2k7s s THR 109 CO 0.01 0.13 0.00 -3.20 -0.54 0.00 0.00 174.62 171.02 2k7s n ASN 110 N 0.69 0.00 -0.14 3.99 2.85 -0.53 -4.86 115.26 117.26 2k7s n ASN 110 Ca 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.47 2k7s n ASN 110 Cb 0.41 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.43 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 -1.03 0.00 0.26 -0.44 -2.24 -1.25 -3.42 114.28 106.16 2k7s n THR 111 Ca 0.00 0.00 0.14 0.00 -2.27 0.00 0.00 64.05 61.92 2k7s n THR 111 Cb 0.00 0.00 0.41 0.00 -2.10 0.00 0.00 70.33 68.64 2k7s n THR 111 CO 0.00 0.00 0.00 0.78 -0.57 0.00 0.00 175.07 175.28 2k7s h ASN 112 N 0.00 0.00 0.00 3.42 2.35 -1.98 -3.47 115.58 115.90 2k7s h ASN 112 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 2k7s h ASN 112 Cb 0.00 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.37 2k7s h ASN 112 CO 0.00 0.00 0.00 0.52 -1.65 0.00 0.00 177.43 176.30 2k7s n VAL 113 N -3.05 0.00 -0.28 2.81 0.31 -1.22 -3.81 118.33 113.08 2k7s n VAL 113 Ca 0.03 0.00 -0.03 0.00 -0.01 0.00 0.00 64.34 64.33 2k7s n VAL 113 Cb 0.42 0.00 0.09 0.00 -0.91 0.00 0.00 33.84 33.44 2k7s n VAL 113 CO 0.00 0.00 0.00 0.50 -1.32 0.00 0.00 176.83 176.01 2k7s h LYS 114 N 0.00 0.97 -1.26 5.55 3.64 -1.93 -1.96 116.57 121.59 2k7s h LYS 114 Ca 0.00 -0.06 -0.34 0.00 -1.27 0.00 0.00 60.65 58.98 2k7s h LYS 114 Cb 0.00 -0.22 -0.16 0.00 -0.41 0.00 0.00 32.23 31.44 2k7s h LYS 114 CO 0.00 0.64 0.43 0.09 -2.27 0.00 0.00 179.45 178.35 2k7s n ASN 115 N -4.58 5.26 -3.39 4.20 5.03 -1.25 -4.88 115.26 115.65 2k7s n ASN 115 Ca 0.09 -3.05 -0.05 0.00 0.87 0.00 0.00 54.58 52.44 2k7s n ASN 115 Cb 0.06 -0.89 0.01 0.00 -1.02 0.00 0.00 39.78 37.94 2k7s n ASN 115 CO 0.00 0.00 0.00 -0.55 -1.83 0.00 0.00 177.26 174.88 2k7s s SER 116 N -0.18 -0.05 -0.38 6.41 0.15 -0.74 -4.86 113.70 114.04 2k7s s SER 116 Ca 0.34 -0.71 0.12 0.00 0.70 0.00 0.00 55.95 56.40 2k7s s SER 116 Cb 0.27 0.58 0.35 0.00 -1.71 0.00 0.00 66.02 65.52 2k7s s SER 116 CO 0.02 -1.14 0.75 -0.24 1.20 0.00 0.00 173.24 173.83 2k7s n SER 117 N -1.04 1.10 -1.22 5.45 2.88 -1.26 -4.77 113.62 114.76 2k7s n SER 117 Ca -0.05 -3.06 0.15 0.00 -1.33 0.00 0.00 58.87 54.58 2k7s n SER 117 Cb 0.60 -0.62 -0.08 0.00 -0.75 0.00 0.00 64.21 63.37 2k7s n SER 117 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2k7s n GLN 118 N 0.24 -2.81 -0.36 -1.46 1.13 -1.26 -5.02 117.38 107.84 2k7s n GLN 118 Ca 0.25 2.27 0.00 0.00 -1.94 0.00 0.00 57.00 57.59 2k7s n GLN 118 Cb 0.64 -3.29 0.00 0.00 0.11 0.00 0.00 30.24 27.70 2k7s n GLN 118 CO 0.00 0.00 0.00 -1.91 -1.44 0.00 0.00 177.06 173.71