#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 -0.79 -0.42 4.61 0.00 -1.26 -5.03 121.76 118.87 2k7s s ALA 2 Ca 0.00 -0.97 0.08 0.00 0.00 0.00 0.00 51.96 51.07 2k7s s ALA 2 Cb 0.00 -2.24 0.27 0.00 0.00 0.00 0.00 23.12 21.15 2k7s s ALA 2 CO 0.00 -2.15 0.73 -0.12 0.00 0.00 0.00 175.76 174.22 2k7s n MET 3 N 3.59 0.81 -3.51 0.00 0.00 -1.26 -5.06 117.12 111.69 2k7s n MET 3 Ca 0.17 -2.69 -0.27 0.00 -0.00 0.00 0.00 57.70 54.91 2k7s n MET 3 Cb 0.50 -1.35 -0.14 0.00 0.00 0.00 0.00 33.22 32.24 2k7s n MET 3 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 175.97 176.31 2k7s s ASP 4 N -1.56 3.16 -0.10 6.12 -1.08 -1.26 -4.99 116.67 116.96 2k7s s ASP 4 Ca 0.34 -1.33 -0.08 0.00 -0.52 0.00 0.00 52.55 50.95 2k7s s ASP 4 Cb 0.23 -0.22 -0.03 0.00 -1.46 0.00 0.00 42.92 41.45 2k7s s ASP 4 CO -0.14 -0.41 -0.16 0.59 0.52 0.00 0.00 175.17 175.57 2k7s n ASN 5 N 5.09 1.23 -4.11 -0.34 3.02 -1.26 -5.04 115.26 113.85 2k7s n ASN 5 Ca -0.03 0.39 -0.16 0.00 -0.03 0.00 0.00 54.58 54.75 2k7s n ASN 5 Cb 0.42 -0.71 0.03 0.00 -0.61 0.00 0.00 39.78 38.91 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 -3.81 0.00 0.00 2.41 0.24 -1.26 -5.10 118.33 110.81 2k7s n VAL 6 Ca -0.07 -1.49 0.00 0.00 -2.04 0.00 0.00 64.34 60.75 2k7s n VAL 6 Cb 0.24 -0.44 0.00 0.00 -1.47 0.00 0.00 33.84 32.18 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 -0.35 0.58 0.00 0.00 -0.21 -1.26 -4.96 119.66 113.46 2k7s s GLN 8 Ca 0.00 -0.95 0.00 0.00 0.02 0.00 0.00 55.36 54.43 2k7s s GLN 8 Cb 0.00 -0.12 0.00 0.00 1.00 0.00 0.00 33.01 33.89 2k7s s GLN 8 CO 0.00 -0.01 0.00 -0.35 -2.12 0.00 0.00 175.29 172.81 2k7s n PRO 9 N 0.89 1.86 0.00 2.91 -0.04 -1.26 -4.95 135.00 134.41 2k7s n PRO 9 Ca -0.19 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.27 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 -0.02 0.00 -3.64 0.52 5.66 -1.26 -4.58 114.28 110.96 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 -0.43 118.70 117.41 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 0.19 0.01 0.00 -0.44 0.00 0.00 34.13 33.88 2k7s s GLU 11 CO 0.00 -0.06 -0.17 -0.59 0.95 0.00 0.00 175.26 175.38 2k7s s PHE 12 N 0.55 2.05 -0.57 4.83 -0.12 0.14 -4.89 117.98 119.96 2k7s s PHE 12 Ca -0.00 -0.88 -0.28 0.00 -0.05 0.00 0.00 56.93 55.72 2k7s s PHE 12 Cb -0.05 -1.43 0.03 0.00 -0.63 0.00 0.00 43.02 40.94 2k7s s PHE 12 CO -0.09 -0.41 1.16 0.42 -0.05 0.00 0.00 175.22 176.24 2k7s s ILE 13 N 0.69 4.07 -0.14 -4.49 1.01 -1.26 -1.70 121.20 119.38 2k7s s ILE 13 Ca -0.13 0.83 0.01 0.00 0.00 0.00 0.00 60.65 61.37 2k7s s ILE 13 Cb -0.16 -4.70 -0.00 0.00 0.01 0.00 0.00 42.46 37.61 2k7s s ILE 13 CO 0.03 -1.30 -0.18 -0.55 0.00 0.00 0.00 174.94 172.94 2k7s s SER 14 N 2.93 3.49 0.30 3.58 0.15 -0.49 -0.43 113.70 123.23 2k7s s SER 14 Ca 0.41 -0.50 -0.02 0.00 0.70 0.00 0.00 55.95 56.55 2k7s s SER 14 Cb -0.08 -1.52 -0.04 0.00 -1.71 0.00 0.00 66.02 62.67 2k7s s SER 14 CO 0.25 0.10 0.52 -0.13 1.20 0.00 0.00 173.24 175.18 2k7s s ARG 15 N 0.71 3.54 0.15 5.44 0.52 0.11 -1.27 118.95 128.15 2k7s s ARG 15 Ca -0.08 -0.21 -0.24 0.00 -0.52 0.00 0.00 55.73 54.68 2k7s s ARG 15 Cb -0.16 -2.69 0.08 0.00 0.52 0.00 0.00 34.95 32.71 2k7s s ARG 15 CO 0.01 0.21 1.07 -3.38 0.02 0.00 0.00 175.30 173.23 2k7s s HIS 16 N -2.16 0.03 0.70 -0.53 -3.43 -0.82 -0.07 115.29 109.00 2k7s s HIS 16 Ca 0.41 -0.37 -0.01 0.00 -0.80 0.00 0.00 55.06 54.29 2k7s s HIS 16 Cb -0.10 0.67 0.11 0.00 -1.43 0.00 0.00 32.58 31.83 2k7s s HIS 16 CO 0.33 -0.80 0.96 0.54 -2.00 0.00 0.00 174.74 173.77 2k7s s ASN 17 N -3.35 4.49 0.36 7.38 2.20 -0.74 -0.55 114.94 124.73 2k7s s ASN 17 Ca 0.21 -0.28 0.12 0.00 -0.94 0.00 0.00 52.86 51.97 2k7s s ASN 17 Cb -0.02 -0.18 0.91 0.00 -2.00 0.00 0.00 41.25 39.96 2k7s s ASN 17 CO 0.04 -1.75 1.82 -0.29 -2.94 0.00 0.00 177.10 173.97 2k7s h ILE 18 N -0.45 0.69 -0.49 0.54 6.09 -1.92 0.51 117.51 122.49 2k7s h ILE 18 Ca -0.37 -0.20 0.04 0.00 -1.37 0.00 0.00 64.86 62.95 2k7s h ILE 18 Cb 1.27 0.05 -0.03 0.00 0.47 0.00 0.00 36.82 38.59 2k7s h ILE 18 CO 0.43 0.11 0.33 -0.33 -3.07 0.00 0.00 178.15 175.61 2k7s h GLU 19 N 0.59 0.52 0.00 2.19 4.39 -1.97 -3.46 114.58 116.83 2k7s h GLU 19 Ca 0.53 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 60.19 2k7s h GLU 19 Cb 1.05 -0.12 0.00 0.00 -0.10 0.00 0.00 28.75 29.58 2k7s h GLU 19 CO -0.27 0.34 0.00 0.41 -1.16 0.00 0.00 179.01 178.33 2k7s n GLY 20 N -1.48 1.03 3.61 -3.84 0.00 0.18 -4.68 105.19 100.01 2k7s n GLY 20 Ca 0.06 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 -0.58 0.44 -1.69 -0.61 2.08 -1.25 -1.35 119.36 116.40 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 -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 5.62 1.27 -1.89 1.39 0.08 0.18 -1.79 117.98 122.83 2k7s s PHE 22 Ca 0.98 1.06 0.30 0.00 0.12 0.00 0.00 56.93 59.39 2k7s s PHE 22 Cb -0.67 -3.81 1.39 0.00 -0.57 0.00 0.00 43.02 39.35 2k7s s PHE 22 CO 0.48 -2.97 1.95 0.25 -0.10 0.00 0.00 175.22 174.83 2k7s n THR 23 N 7.75 0.00 -3.61 0.64 -2.24 0.90 -0.26 114.28 117.47 2k7s n THR 23 Ca 0.31 -0.08 -0.07 0.00 -2.27 0.00 0.00 64.05 61.94 2k7s n THR 23 Cb 0.51 -0.11 -0.05 0.00 -2.10 0.00 0.00 70.33 68.58 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 -2.26 -0.23 -0.13 4.78 5.36 -0.85 -4.91 117.98 119.73 2k7s s PHE 24 Ca 0.36 0.40 -0.06 0.00 -0.96 0.00 0.00 56.93 56.67 2k7s s PHE 24 Cb 0.21 0.47 0.06 0.00 -0.34 0.00 0.00 43.02 43.41 2k7s s PHE 24 CO 0.42 -0.21 0.30 0.08 -1.46 0.00 0.00 175.22 174.35 2k7s s VAL 25 N -1.02 -0.21 0.17 3.12 1.01 -1.26 0.09 120.40 122.30 2k7s s VAL 25 Ca 0.03 0.18 -0.30 0.00 0.00 0.00 0.00 61.98 61.89 2k7s s VAL 25 Cb -0.01 -0.47 -0.08 0.00 0.00 0.00 0.00 36.38 35.83 2k7s s VAL 25 CO -0.03 0.08 1.21 -0.62 0.00 0.00 0.00 175.10 175.74 2k7s s ASP 26 N 1.78 7.07 0.20 3.32 2.15 0.43 -4.63 116.67 126.98 2k7s s ASP 26 Ca -0.05 2.23 0.06 0.00 0.43 0.00 0.00 52.55 55.22 2k7s s ASP 26 Cb -0.11 -2.60 0.35 0.00 -0.30 0.00 0.00 42.92 40.26 2k7s s ASP 26 CO -0.10 -0.40 1.02 0.00 -0.17 0.00 0.00 175.17 175.52 2k7s n HIS 27 N 2.67 0.22 0.24 -5.34 1.44 -1.26 -0.61 115.22 112.58 2k7s n HIS 27 Ca 0.05 0.12 0.10 0.00 -2.01 0.00 0.00 57.72 55.97 2k7s n HIS 27 Cb 0.45 -0.42 0.59 0.00 0.12 0.00 0.00 29.99 30.73 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 -0.77 -1.40 2.47 -1.90 -3.04 114.38 109.74 2k7s h ARG 28 Ca 0.00 0.00 0.22 0.00 -1.26 0.00 0.00 59.98 58.94 2k7s h ARG 28 Cb 0.68 0.00 -0.03 0.00 -1.65 0.00 0.00 29.97 28.97 2k7s h ARG 28 CO 0.00 0.19 0.65 0.00 0.56 0.00 0.00 179.97 181.37 2k7s h VAL 30 N 0.00 1.49 0.00 0.00 -1.51 -1.37 0.28 116.25 115.13 2k7s h VAL 30 Ca 0.36 -2.66 -0.15 0.00 -1.23 0.00 0.00 66.70 63.02 2k7s h VAL 30 Cb 1.65 2.50 -0.02 0.00 -2.13 0.00 0.00 31.29 33.29 2k7s h VAL 30 CO -0.00 0.78 -0.80 0.00 -1.23 0.00 0.00 177.57 176.31 2k7s h ALA 31 N 0.92 0.56 0.00 5.19 0.00 -1.04 -0.46 119.26 124.43 2k7s h ALA 31 Ca -0.05 -0.69 -0.00 0.00 0.00 0.00 0.00 54.91 54.17 2k7s h ALA 31 Cb 1.55 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 19.29 2k7s h ALA 31 CO 0.14 0.90 -0.07 1.15 0.00 0.00 0.00 179.25 181.38 2k7s h THR 32 N 0.00 0.22 -0.09 0.00 2.02 -0.81 -3.40 112.91 110.84 2k7s h THR 32 Ca -0.03 -1.17 0.00 0.00 0.77 0.00 0.00 66.41 65.98 2k7s h THR 32 Cb 1.56 0.43 0.00 0.00 -1.74 0.00 0.00 68.15 68.40 2k7s h THR 32 CO 0.09 0.08 0.00 1.33 0.37 0.00 0.00 175.52 177.38 2k7s n VAL 33 N -4.74 0.97 0.00 3.16 0.24 0.89 -4.58 118.33 114.27 2k7s n VAL 33 Ca -0.02 -0.98 0.00 0.00 -2.04 0.00 0.00 64.34 61.29 2k7s n VAL 33 Cb 0.09 0.52 0.00 0.00 -1.47 0.00 0.00 33.84 32.98 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 -0.22 2.15 3.65 7.63 0.00 -0.18 0.46 105.19 118.68 2k7s n GLY 34 Ca 0.03 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.62 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 2.52 0.86 1.61 2.02 -1.20 -4.54 117.35 118.63 2k7s s TYR 35 Ca 0.00 0.75 -0.12 0.00 -0.37 0.00 0.00 57.07 57.32 2k7s s TYR 35 Cb 0.00 -3.74 0.09 0.00 -0.40 0.00 0.00 41.96 37.90 2k7s s TYR 35 CO 0.00 -2.32 0.99 1.04 -1.57 0.00 0.00 175.55 173.69 2k7s n GLN 36 N 7.03 -0.09 -0.35 -0.62 6.02 -1.26 -2.58 117.38 125.53 2k7s n GLN 36 Ca 0.16 0.04 0.17 0.00 -0.01 0.00 0.00 57.00 57.36 2k7s n GLN 36 Cb 0.45 -2.27 0.38 0.00 1.02 0.00 0.00 30.24 29.82 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 -1.28 0.59 0.00 -1.09 0.11 -1.83 0.81 132.00 129.30 2k7s h PRO 37 Ca -0.45 -0.04 -0.11 0.00 0.11 0.00 0.00 66.00 65.51 2k7s h PRO 37 Cb 1.29 -0.13 -0.02 0.00 0.11 0.00 0.00 31.00 32.25 2k7s h PRO 37 CO 0.42 0.39 -0.54 -0.56 -0.21 0.00 0.00 178.00 177.50 2k7s h GLN 38 N 0.61 0.00 0.00 1.05 3.07 -1.88 0.33 115.11 118.28 2k7s h GLN 38 Ca 0.64 0.00 0.00 0.00 0.09 0.00 0.00 58.65 59.38 2k7s h GLN 38 Cb 1.17 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.73 2k7s h GLN 38 CO -0.46 0.54 0.00 0.39 0.09 0.00 0.00 178.83 179.39 2k7s n GLU 39 N -3.77 0.18 -0.01 0.06 1.02 0.27 -2.92 120.64 115.47 2k7s n GLU 39 Ca -0.01 0.16 -0.01 0.00 -0.02 0.00 0.00 57.16 57.29 2k7s n GLU 39 Cb 0.57 -1.50 -0.01 0.00 -0.02 0.00 0.00 31.44 30.48 2k7s n GLU 39 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 2k7s n LEU 40 N -1.32 1.83 -4.66 -4.62 7.99 -0.80 -4.79 117.00 110.63 2k7s n LEU 40 Ca 0.06 -0.00 -0.47 0.00 -0.01 0.00 0.00 56.01 55.59 2k7s n LEU 40 Cb 0.12 -0.02 -0.04 0.00 -0.11 0.00 0.00 43.42 43.38 2k7s n LEU 40 CO 0.12 0.33 1.14 0.18 -1.51 0.00 0.00 177.39 177.64 2k7s n LEU 41 N -2.34 2.90 0.00 2.23 4.77 0.11 -0.44 117.00 124.23 2k7s n LEU 41 Ca -0.02 1.09 0.00 0.00 -0.03 0.00 0.00 56.01 57.05 2k7s n LEU 41 Cb 0.53 -1.39 0.00 0.00 -2.33 0.00 0.00 43.42 40.22 2k7s n LEU 41 CO 0.01 -0.40 0.00 0.61 -1.33 0.00 0.00 177.39 176.28 2k7s n GLY 42 N 3.22 1.16 3.75 -0.72 0.00 0.64 -4.91 105.19 108.34 2k7s n GLY 42 Ca 0.17 0.00 -0.34 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 -0.15 3.02 -0.21 1.61 1.02 0.42 -4.73 119.74 120.72 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 -2.83 -0.02 0.00 -0.52 0.00 0.00 37.83 34.46 2k7s s LYS 43 CO 0.00 0.66 1.48 1.21 -0.92 0.00 0.00 175.35 177.78 2k7s s ASN 44 N -1.47 6.58 0.30 2.83 3.84 -1.26 -0.65 114.94 125.11 2k7s s ASN 44 Ca 0.20 1.59 0.05 0.00 0.21 0.00 0.00 52.86 54.90 2k7s s ASN 44 Cb -0.12 -2.54 0.76 0.00 -0.55 0.00 0.00 41.25 38.81 2k7s s ASN 44 CO 0.10 -1.09 1.71 -0.29 -2.79 0.00 0.00 177.10 174.74 2k7s h ILE 45 N 5.93 0.51 0.00 -5.21 2.10 -1.49 0.23 117.51 119.58 2k7s h ILE 45 Ca -0.31 -0.16 -0.08 0.00 1.08 0.00 0.00 64.86 65.38 2k7s h ILE 45 Cb 1.13 0.00 -0.01 0.00 -1.09 0.00 0.00 36.82 36.85 2k7s h ILE 45 CO 1.00 0.09 -0.40 -0.37 -1.08 0.00 0.00 178.15 177.38 2k7s h VAL 46 N 0.47 1.08 -0.76 2.19 -1.51 -1.83 -2.50 116.25 113.38 2k7s h VAL 46 Ca 0.58 -1.49 0.22 0.00 -1.23 0.00 0.00 66.70 64.78 2k7s h VAL 46 Cb 1.08 1.85 -0.03 0.00 -2.13 0.00 0.00 31.29 32.06 2k7s h VAL 46 CO -0.50 0.40 0.55 -0.33 -1.23 0.00 0.00 177.57 176.45 2k7s h GLU 47 N 0.00 0.01 0.08 5.19 5.08 -0.91 0.37 114.58 124.40 2k7s h GLU 47 Ca -0.00 -0.00 -0.31 0.00 -1.00 0.00 0.00 59.36 58.04 2k7s h GLU 47 Cb 0.82 -0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.04 2k7s h GLU 47 CO 0.05 0.01 -1.69 0.74 -1.00 0.00 0.00 179.01 177.12 2k7s h PHE 48 N 0.01 0.30 -3.73 4.33 -1.00 -1.49 -3.47 116.94 111.90 2k7s h PHE 48 Ca 0.36 -0.22 -0.56 0.00 2.81 0.00 0.00 57.97 60.36 2k7s h PHE 48 Cb 1.44 -0.01 0.14 0.00 3.61 0.00 0.00 35.95 41.13 2k7s h PHE 48 CO -0.00 1.36 0.42 0.00 -1.61 0.00 0.00 178.31 178.48 2k7s s HIS 50 N -1.32 2.75 0.14 0.00 2.46 0.45 -4.69 115.29 115.07 2k7s s HIS 50 Ca 0.70 0.70 -0.32 0.00 0.47 0.00 0.00 55.06 56.61 2k7s s HIS 50 Cb -0.45 -4.10 -0.08 0.00 -0.13 0.00 0.00 32.58 27.81 2k7s s HIS 50 CO 0.51 -3.78 1.55 -1.35 -2.47 0.00 0.00 174.74 169.20 2k7s h PRO 51 N 5.09 -0.28 0.00 2.88 0.11 -1.90 0.41 132.00 138.31 2k7s h PRO 51 Ca -0.47 0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.66 2k7s h PRO 51 Cb 1.22 0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.39 2k7s h PRO 51 CO 0.82 -0.19 0.17 0.93 -0.21 0.00 0.00 178.00 179.52 2k7s h GLU 52 N -0.29 0.00 0.00 1.05 5.08 -2.00 -0.23 114.58 118.19 2k7s h GLU 52 Ca 0.10 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.46 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 -0.68 0.00 -1.87 -0.25 -1.00 0.00 0.00 179.01 175.20 2k7s n ASP 53 N -2.91 0.12 -0.12 1.42 8.00 0.11 -4.35 116.55 118.82 2k7s n ASP 53 Ca -0.02 -0.09 0.05 0.00 0.71 0.00 0.00 54.79 55.43 2k7s n ASP 53 Cb 0.23 1.86 0.37 0.00 -0.02 0.00 0.00 41.12 43.56 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 0.69 -0.28 -1.24 4.20 0.15 0.45 115.11 119.08 2k7s h GLN 54 Ca 0.00 -0.04 0.01 0.00 0.06 0.00 0.00 58.65 58.68 2k7s h GLN 54 Cb 0.95 -0.16 -0.01 0.00 0.30 0.00 0.00 27.48 28.56 2k7s h GLN 54 CO 0.00 0.46 0.19 0.37 -0.67 0.00 0.00 178.83 179.17 2k7s h GLN 55 N 0.71 0.33 0.24 1.46 5.75 -1.76 0.20 115.11 122.05 2k7s h GLN 55 Ca 0.25 -0.02 -0.33 0.00 -0.15 0.00 0.00 58.65 58.40 2k7s h GLN 55 Cb 0.10 -0.07 0.03 0.00 1.07 0.00 0.00 27.48 28.61 2k7s h GLN 55 CO -0.07 0.22 -1.45 1.25 -2.65 0.00 0.00 178.83 176.13 2k7s h LEU 56 N 0.34 0.80 0.64 -2.39 5.85 -1.24 -2.20 115.31 117.11 2k7s h LEU 56 Ca 0.11 -0.85 -0.03 0.00 0.84 0.00 0.00 57.88 57.94 2k7s h LEU 56 Cb 0.02 -0.26 0.01 0.00 0.37 0.00 0.00 40.66 40.79 2k7s h LEU 56 CO -0.02 1.67 -0.31 0.25 -0.34 0.00 0.00 178.44 179.69 2k7s h LEU 57 N 0.14 -0.73 -1.14 2.25 5.85 -0.30 -1.65 115.31 119.73 2k7s h LEU 57 Ca -0.24 -0.02 0.10 0.00 0.84 0.00 0.00 57.88 58.56 2k7s h LEU 57 Cb 2.15 0.19 -0.07 0.00 0.37 0.00 0.00 40.66 43.30 2k7s h LEU 57 CO 0.27 -0.42 0.60 0.03 -0.34 0.00 0.00 178.44 178.58 2k7s h ARG 58 N -1.02 0.91 -0.38 1.25 3.08 -0.76 -1.29 114.38 116.15 2k7s h ARG 58 Ca -0.09 -0.05 0.07 0.00 0.07 0.00 0.00 59.98 59.97 2k7s h ARG 58 Cb 0.70 -0.20 -0.06 0.00 0.08 0.00 0.00 29.97 30.49 2k7s h ARG 58 CO 0.14 0.60 0.03 0.22 -1.07 0.00 0.00 179.97 179.89 2k7s h ASP 59 N 0.94 -0.09 0.02 7.04 1.82 -1.14 0.13 116.42 125.14 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 0.42 0.13 -0.05 0.00 0.68 0.00 0.00 39.33 40.51 2k7s h ASP 59 CO -0.20 -0.01 -0.39 -1.28 -1.61 0.00 0.00 179.24 175.75 2k7s h SER 60 N 0.14 -1.18 -0.82 2.28 0.87 -0.27 0.59 113.55 115.16 2k7s h SER 60 Ca 0.19 0.14 0.15 0.00 -1.23 0.00 0.00 61.79 61.04 2k7s h SER 60 Cb 0.25 0.46 -0.06 0.00 -0.44 0.00 0.00 62.40 62.61 2k7s h SER 60 CO -0.29 -0.45 0.54 -0.26 -0.53 0.00 0.00 176.83 175.85 2k7s h PHE 61 N -0.56 0.62 -0.01 2.24 0.04 -1.03 0.50 116.94 118.73 2k7s h PHE 61 Ca 0.05 0.02 -0.08 0.00 2.80 0.00 0.00 57.97 60.75 2k7s h PHE 61 Cb 0.64 -0.20 -0.01 0.00 2.20 0.00 0.00 35.95 38.58 2k7s h PHE 61 CO -0.39 0.23 -0.39 1.96 -0.60 0.00 0.00 178.31 179.12 2k7s h GLN 62 N 0.53 0.03 0.18 1.51 1.08 0.90 -1.81 115.11 117.53 2k7s h GLN 62 Ca 0.41 -0.01 -0.25 0.00 -1.45 0.00 0.00 58.65 57.34 2k7s h GLN 62 Cb 0.82 -0.00 0.02 0.00 -0.05 0.00 0.00 27.48 28.27 2k7s h GLN 62 CO -0.16 0.42 -1.14 1.96 -0.95 0.00 0.00 178.83 178.96 2k7s h GLN 63 N 0.03 0.38 -0.31 1.46 1.08 0.20 -2.09 115.11 115.84 2k7s h GLN 63 Ca -0.00 -0.64 -0.06 0.00 -1.45 0.00 0.00 58.65 56.50 2k7s h GLN 63 Cb 0.70 0.24 -0.02 0.00 -0.05 0.00 0.00 27.48 28.36 2k7s h GLN 63 CO 0.05 1.31 -0.05 -0.39 -0.95 0.00 0.00 178.83 178.80 2k7s h VAL 64 N -0.18 1.21 0.03 -0.54 -1.51 -0.68 0.30 116.25 114.88 2k7s h VAL 64 Ca -0.21 -0.88 -0.22 0.00 -1.23 0.00 0.00 66.70 64.16 2k7s h VAL 64 Cb 1.85 1.03 -0.02 0.00 -2.13 0.00 0.00 31.29 32.02 2k7s h VAL 64 CO 0.18 0.29 -1.05 1.62 -1.23 0.00 0.00 177.57 177.38 2k7s h VAL 65 N 0.48 1.67 -0.19 7.19 3.04 -1.43 0.22 116.25 127.23 2k7s h VAL 65 Ca 0.10 -3.35 -0.18 0.00 -1.01 0.00 0.00 66.70 62.25 2k7s h VAL 65 Cb 0.40 2.87 0.01 0.00 -2.01 0.00 0.00 31.29 32.55 2k7s h VAL 65 CO 0.02 0.96 -0.60 0.11 -1.01 0.00 0.00 177.57 177.05 2k7s h LYS 66 N 0.02 0.74 -0.22 4.17 1.57 -0.99 -3.06 116.57 118.81 2k7s h LYS 66 Ca -0.04 -0.54 0.00 0.00 -1.87 0.00 0.00 60.65 58.20 2k7s h LYS 66 Cb 1.82 0.09 0.00 0.00 0.08 0.00 0.00 32.23 34.22 2k7s h LYS 66 CO 0.15 1.16 0.00 1.28 -0.57 0.00 0.00 179.45 181.47 2k7s n LEU 67 N -4.06 2.20 -2.52 2.94 4.77 0.06 -5.00 117.00 115.39 2k7s n LEU 67 Ca -0.06 -0.92 -0.15 0.00 -0.03 0.00 0.00 56.01 54.85 2k7s n LEU 67 Cb 0.65 -0.14 0.02 0.00 -2.33 0.00 0.00 43.42 41.62 2k7s n LEU 67 CO 0.50 0.46 -0.25 0.29 -1.33 0.00 0.00 177.39 177.05 2k7s n LYS 68 N 0.68 -0.80 0.00 3.23 4.76 0.01 -3.54 118.16 122.50 2k7s n LYS 68 Ca 0.17 0.76 0.00 0.00 -2.87 0.00 0.00 58.31 56.37 2k7s n LYS 68 Cb 0.42 -1.04 0.00 0.00 -1.84 0.00 0.00 35.03 32.57 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 0.38 3.16 3.65 0.72 0.00 -0.88 -4.95 105.19 107.28 2k7s n GLY 69 Ca -0.03 -1.11 -0.51 0.00 0.00 0.00 0.00 46.02 44.37 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 1.63 -2.82 1.61 -0.06 -1.23 -4.31 117.38 112.19 2k7s n GLN 70 Ca 0.00 0.59 -0.38 0.00 -2.00 0.00 0.00 57.00 55.21 2k7s n GLN 70 Cb 0.00 -2.31 -0.06 0.00 -4.06 0.00 0.00 30.24 23.80 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 1.86 4.22 0.02 1.69 1.01 -1.26 -4.16 120.40 123.78 2k7s s VAL 71 Ca 0.87 1.83 0.05 0.00 0.00 0.00 0.00 61.98 64.74 2k7s s VAL 71 Cb -0.85 -4.10 -0.03 0.00 0.00 0.00 0.00 36.38 31.40 2k7s s VAL 71 CO 0.49 0.28 -0.12 -0.76 0.00 0.00 0.00 175.10 174.99 2k7s s LEU 72 N -1.72 2.88 -0.20 3.92 2.01 0.11 -4.94 118.68 120.74 2k7s s LEU 72 Ca 0.46 -0.29 0.01 0.00 0.01 0.00 0.00 54.13 54.31 2k7s s LEU 72 Cb -0.21 -1.67 0.05 0.00 0.01 0.00 0.00 46.19 44.37 2k7s s LEU 72 CO 0.26 0.27 -0.08 -0.55 1.01 0.00 0.00 176.35 177.26 2k7s s SER 73 N -1.44 3.39 -0.01 2.29 0.15 -1.24 -1.90 113.70 114.95 2k7s s SER 73 Ca 0.16 -0.91 0.01 0.00 0.70 0.00 0.00 55.95 55.90 2k7s s SER 73 Cb -0.11 -1.15 0.01 0.00 -1.71 0.00 0.00 66.02 63.06 2k7s s SER 73 CO 0.07 -0.18 -0.02 0.68 1.20 0.00 0.00 173.24 174.99 2k7s s VAL 74 N 1.44 0.22 -0.19 4.45 -7.23 -1.12 -4.93 120.40 113.05 2k7s s VAL 74 Ca -0.02 -0.05 -0.11 0.00 -1.81 0.00 0.00 61.98 59.98 2k7s s VAL 74 Cb -0.17 -0.24 -0.05 0.00 0.56 0.00 0.00 36.38 36.49 2k7s s VAL 74 CO -0.08 0.10 0.19 -0.04 -0.31 0.00 0.00 175.10 174.96 2k7s s MET 75 N 0.33 4.21 0.11 4.82 -1.94 -1.26 -0.61 119.30 124.96 2k7s s MET 75 Ca -0.03 -0.11 -0.03 0.00 -1.71 0.00 0.00 55.69 53.80 2k7s s MET 75 Cb -0.06 -3.43 -0.03 0.00 2.01 0.00 0.00 34.83 33.32 2k7s s MET 75 CO -0.01 0.26 0.10 -0.59 -0.01 0.00 0.00 175.02 174.76 2k7s s PHE 76 N 0.47 0.60 -0.49 -0.03 -0.71 -0.23 -4.94 117.98 112.65 2k7s s PHE 76 Ca 0.11 -1.02 -0.20 0.00 -1.04 0.00 0.00 56.93 54.78 2k7s s PHE 76 Cb -0.12 -0.33 0.05 0.00 -1.21 0.00 0.00 43.02 41.42 2k7s s PHE 76 CO 0.01 -0.53 0.63 1.03 -1.34 0.00 0.00 175.22 175.02 2k7s s ARG 77 N -3.98 3.16 -0.53 1.99 0.52 -1.26 -0.32 118.95 118.53 2k7s s ARG 77 Ca 0.16 -0.77 -0.22 0.00 -0.52 0.00 0.00 55.73 54.38 2k7s s ARG 77 Cb 0.06 -4.06 0.04 0.00 0.52 0.00 0.00 34.95 31.51 2k7s s ARG 77 CO -0.03 -1.18 0.83 0.12 0.02 0.00 0.00 175.30 175.06 2k7s s PHE 78 N 2.70 2.89 -0.39 -0.53 2.19 0.57 -0.41 117.98 125.01 2k7s s PHE 78 Ca 0.17 -0.15 -0.27 0.00 0.33 0.00 0.00 56.93 57.01 2k7s s PHE 78 Cb -0.18 -3.86 -0.04 0.00 -1.31 0.00 0.00 43.02 37.63 2k7s s PHE 78 CO 0.13 -1.21 2.13 0.50 1.83 0.00 0.00 175.22 178.60 2k7s s ARG 79 N 3.47 2.77 0.15 10.12 3.00 -0.61 -1.12 118.95 136.73 2k7s s ARG 79 Ca 0.26 1.48 -0.02 0.00 -1.00 0.00 0.00 55.73 56.44 2k7s s ARG 79 Cb -0.14 -4.40 0.03 0.00 0.00 0.00 0.00 34.95 30.43 2k7s s ARG 79 CO 0.17 -2.52 0.20 -1.13 0.00 0.00 0.00 175.30 172.02 2k7s n SER 80 N 12.89 0.02 0.27 -2.12 3.41 -0.80 -4.80 113.62 122.49 2k7s n SER 80 Ca 0.29 -1.08 0.14 0.00 -0.26 0.00 0.00 58.87 57.96 2k7s n SER 80 Cb 0.50 -0.15 0.78 0.00 -0.26 0.00 0.00 64.21 65.07 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 -0.30 4.33 1.63 -0.33 0.14 116.57 122.05 2k7s h LYS 81 Ca -0.06 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.74 2k7s h LYS 81 Cb 0.18 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 31.81 2k7s h LYS 81 CO 0.05 0.09 0.00 0.09 -3.45 0.00 0.00 179.45 176.23 2k7s n ASN 82 N -3.61 1.85 -3.65 4.20 3.02 -1.26 -4.91 115.26 110.89 2k7s n ASN 82 Ca -0.02 -1.91 -0.21 0.00 -0.03 0.00 0.00 54.58 52.41 2k7s n ASN 82 Cb 0.21 -0.20 0.05 0.00 -0.61 0.00 0.00 39.78 39.23 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 0.49 -5.51 -4.87 3.52 3.00 0.50 -5.00 117.38 109.50 2k7s n GLN 83 Ca 0.13 0.68 -0.26 0.00 -0.01 0.00 0.00 57.00 57.55 2k7s n GLN 83 Cb 0.31 -5.40 -0.16 0.00 0.00 0.00 0.00 30.24 24.99 2k7s n GLN 83 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.06 175.85 2k7s s GLU 84 N -5.89 1.57 -0.98 -1.09 2.02 -1.26 -4.85 118.70 108.22 2k7s s GLU 84 Ca 0.08 -0.64 -0.24 0.00 0.02 0.00 0.00 54.97 54.18 2k7s s GLU 84 Cb -0.04 -1.47 -0.07 0.00 0.10 0.00 0.00 34.13 32.65 2k7s s GLU 84 CO 0.79 0.35 1.98 -1.58 0.02 0.00 0.00 175.26 176.83 2k7s s TRP 85 N -0.30 1.78 -0.68 1.61 0.23 -1.26 -1.91 118.94 118.41 2k7s s TRP 85 Ca 0.04 0.74 -0.27 0.00 -2.03 0.00 0.00 56.10 54.58 2k7s s TRP 85 Cb -0.08 -3.96 0.02 0.00 0.03 0.00 0.00 33.47 29.48 2k7s s TRP 85 CO 0.00 -1.54 1.32 -0.51 0.96 0.00 0.00 176.95 177.18 2k7s s LEU 86 N 10.94 3.26 0.11 2.99 1.43 -0.28 -4.66 118.68 132.47 2k7s s LEU 86 Ca 0.72 -0.18 -0.31 0.00 -1.03 0.00 0.00 54.13 53.32 2k7s s LEU 86 Cb -0.05 -2.74 -0.10 0.00 0.03 0.00 0.00 46.19 43.32 2k7s s LEU 86 CO 0.04 -1.79 1.74 0.26 0.23 0.00 0.00 176.35 176.84 2k7s s TRP 87 N 5.87 2.35 0.15 0.29 0.52 -1.26 -0.31 118.94 126.55 2k7s s TRP 87 Ca 0.41 0.16 0.02 0.00 0.02 0.00 0.00 56.10 56.71 2k7s s TRP 87 Cb -0.09 -4.09 -0.04 0.00 -1.15 0.00 0.00 33.47 28.10 2k7s s TRP 87 CO 0.19 -4.39 -0.01 -1.64 0.02 0.00 0.00 176.95 171.11 2k7s s MET 88 N 2.49 1.02 -0.17 4.98 -1.94 0.57 -1.27 119.30 124.98 2k7s s MET 88 Ca 0.77 -1.47 0.01 0.00 -1.71 0.00 0.00 55.69 53.29 2k7s s MET 88 Cb -0.44 -0.22 0.02 0.00 2.01 0.00 0.00 34.83 36.20 2k7s s MET 88 CO 0.34 -0.11 -0.20 1.03 -0.01 0.00 0.00 175.02 176.07 2k7s s ARG 89 N -3.90 2.96 -0.04 2.03 0.52 0.44 -1.07 118.95 119.88 2k7s s ARG 89 Ca 0.21 -0.82 -0.13 0.00 -0.52 0.00 0.00 55.73 54.46 2k7s s ARG 89 Cb 0.06 -2.51 -0.05 0.00 0.52 0.00 0.00 34.95 32.97 2k7s s ARG 89 CO 0.01 -0.16 0.35 0.95 0.02 0.00 0.00 175.30 176.47 2k7s s THR 90 N 1.17 5.15 -0.78 0.02 -4.23 0.22 -1.19 115.64 116.00 2k7s s THR 90 Ca 0.02 0.69 0.03 0.00 -1.18 0.00 0.00 61.69 61.25 2k7s s THR 90 Cb -0.14 -3.65 0.26 0.00 1.34 0.00 0.00 72.50 70.32 2k7s s THR 90 CO -0.10 0.56 0.95 -1.20 -0.54 0.00 0.00 174.62 174.29 2k7s n SER 91 N 2.07 4.51 -4.67 3.99 7.64 -0.78 -2.80 113.62 123.58 2k7s n SER 91 Ca -0.15 -3.41 -0.42 0.00 1.01 0.00 0.00 58.87 55.90 2k7s n SER 91 Cb 0.53 -0.86 -0.04 0.00 -1.01 0.00 0.00 64.21 62.83 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 -2.13 6.94 -0.18 6.43 0.01 -0.80 -2.56 113.70 121.42 2k7s s SER 92 Ca 0.36 1.16 -0.21 0.00 1.31 0.00 0.00 55.95 58.57 2k7s s SER 92 Cb 0.10 -2.46 0.06 0.00 0.21 0.00 0.00 66.02 63.93 2k7s s SER 92 CO 0.01 -0.43 0.57 0.00 0.41 0.00 0.00 173.24 173.81 2k7s s GLN 93 N 2.30 0.73 -0.38 12.44 -2.07 -0.49 0.09 119.66 132.27 2k7s s GLN 93 Ca 0.38 0.65 -0.45 0.00 -1.82 0.00 0.00 55.36 54.12 2k7s s GLN 93 Cb -0.16 0.35 -0.20 0.00 -1.09 0.00 0.00 33.01 31.91 2k7s s GLN 93 CO 0.11 -0.12 1.52 0.25 -1.32 0.00 0.00 175.29 175.73 2k7s n THR 94 N 2.39 0.03 -0.68 3.63 -2.24 -1.26 0.03 114.28 116.18 2k7s n THR 94 Ca -0.15 -0.01 -0.31 0.00 -2.27 0.00 0.00 64.05 61.31 2k7s n THR 94 Cb 0.56 -0.49 0.16 0.00 -2.10 0.00 0.00 70.33 68.46 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 3.68 -3.97 -1.00 6.98 0.00 -1.15 -4.58 120.51 120.48 2k7s n ALA 95 Ca 0.28 -1.29 0.00 0.00 0.00 0.00 0.00 53.44 52.43 2k7s n ALA 95 Cb -0.01 -1.35 0.00 0.00 0.00 0.00 0.00 19.45 18.09 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 -1.56 0.00 -3.62 0.00 1.13 -1.26 -3.99 117.38 108.08 2k7s n GLN 96 Ca 0.01 0.00 -0.04 0.00 -1.94 0.00 0.00 57.00 55.03 2k7s n GLN 96 Cb 0.61 -0.42 -0.04 0.00 0.11 0.00 0.00 30.24 30.50 2k7s n GLN 96 CO 0.00 0.00 0.00 1.21 -1.44 0.00 0.00 177.06 176.83 2k7s s ASN 97 N -1.57 -0.13 0.00 1.08 2.47 -1.26 -3.30 114.94 112.24 2k7s s ASN 97 Ca 0.00 0.12 0.00 0.00 0.42 0.00 0.00 52.86 53.40 2k7s s ASN 97 Cb 0.00 0.11 0.00 0.00 -1.45 0.00 0.00 41.25 39.91 2k7s s ASN 97 CO 0.00 -0.13 0.81 -0.81 -3.72 0.00 0.00 177.10 173.25 2k7s n PRO 98 N 0.47 0.89 -0.36 0.43 -0.04 -1.26 -4.83 135.00 130.30 2k7s n PRO 98 Ca -0.02 0.00 -0.06 0.00 -0.04 0.00 0.00 63.50 63.38 2k7s n PRO 98 Cb 0.58 -1.08 0.07 0.00 -0.04 0.00 0.00 33.50 33.03 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 -0.40 0.90 -0.19 0.54 4.01 -1.26 -4.35 117.16 116.41 2k7s n TYR 99 Ca 0.00 -0.81 0.08 0.00 -0.16 0.00 0.00 57.90 57.01 2k7s n TYR 99 Cb 0.04 -0.43 0.38 0.00 -0.31 0.00 0.00 39.34 39.02 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 0.44 0.62 0.37 7.72 0.87 -1.68 0.53 113.55 122.43 2k7s h SER 100 Ca 0.17 0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.74 2k7s h SER 100 Cb 1.48 -0.12 0.00 0.00 -0.44 0.00 0.00 62.40 63.32 2k7s h SER 100 CO 0.31 0.39 0.00 -0.90 -0.53 0.00 0.00 176.83 176.10 2k7s n ASP 101 N -4.49 0.00 -1.54 6.23 5.75 -1.26 -3.95 116.55 117.29 2k7s n ASP 101 Ca 0.12 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.90 2k7s n ASP 101 Cb 0.29 -0.28 0.00 0.00 -1.03 0.00 0.00 41.12 40.10 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 -1.28 2.19 -3.41 0.11 1.02 0.18 -4.81 120.64 114.65 2k7s n GLU 102 Ca 0.09 0.00 -0.14 0.00 -0.02 0.00 0.00 57.16 57.10 2k7s n GLU 102 Cb 0.16 0.00 -0.10 0.00 -0.02 0.00 0.00 31.44 31.48 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 1.04 -0.47 -0.45 -3.67 1.01 0.28 -2.91 121.20 116.03 2k7s s ILE 103 Ca 0.00 -0.15 -0.29 0.00 0.00 0.00 0.00 60.65 60.21 2k7s s ILE 103 Cb 0.00 -0.79 0.03 0.00 0.01 0.00 0.00 42.46 41.70 2k7s s ILE 103 CO 0.00 -0.21 1.18 -0.70 0.00 0.00 0.00 174.94 175.22 2k7s s GLU 104 N 2.44 3.72 -0.25 2.79 2.12 0.11 -1.95 118.70 127.67 2k7s s GLU 104 Ca 0.10 0.67 -0.02 0.00 0.36 0.00 0.00 54.97 56.08 2k7s s GLU 104 Cb -0.15 -3.92 0.02 0.00 0.26 0.00 0.00 34.13 30.34 2k7s s GLU 104 CO -0.17 -1.38 -0.05 0.99 -0.54 0.00 0.00 175.26 174.11 2k7s s THR 105 N 4.58 3.05 -0.58 -1.70 2.01 -0.40 -1.40 115.64 121.20 2k7s s THR 105 Ca 0.50 -0.90 -0.20 0.00 0.31 0.00 0.00 61.69 61.41 2k7s s THR 105 Cb -0.09 -2.51 0.08 0.00 0.01 0.00 0.00 72.50 69.99 2k7s s THR 105 CO 0.31 0.23 0.73 -0.63 -0.69 0.00 0.00 174.62 174.57 2k7s s ILE 106 N 1.37 4.74 -0.50 1.82 1.09 -1.06 -1.40 121.20 127.26 2k7s s ILE 106 Ca 0.02 -0.70 -0.27 0.00 -1.10 0.00 0.00 60.65 58.60 2k7s s ILE 106 Cb -0.16 -4.47 0.03 0.00 -1.06 0.00 0.00 42.46 36.80 2k7s s ILE 106 CO -0.04 -1.09 1.03 -0.63 -0.10 0.00 0.00 174.94 174.12 2k7s s ILE 107 N 2.93 4.31 -0.18 2.92 1.01 -0.69 -1.86 121.20 129.64 2k7s s ILE 107 Ca 0.15 0.84 -0.06 0.00 0.00 0.00 0.00 60.65 61.58 2k7s s ILE 107 Cb -0.21 -4.55 -0.03 0.00 0.01 0.00 0.00 42.46 37.68 2k7s s ILE 107 CO 0.09 -1.01 0.03 0.00 0.00 0.00 0.00 174.94 174.05 2k7s s THR 109 N 0.50 2.17 0.00 0.00 -4.23 0.43 -0.42 115.64 114.09 2k7s s THR 109 Ca 0.01 0.17 0.00 0.00 -1.18 0.00 0.00 61.69 60.69 2k7s s THR 109 Cb -0.13 -3.11 0.00 0.00 1.34 0.00 0.00 72.50 70.60 2k7s s THR 109 CO 0.02 0.04 0.00 -3.20 -0.54 0.00 0.00 174.62 170.94 2k7s n ASN 110 N 0.54 0.00 -1.44 3.99 5.15 -0.40 -4.84 115.26 118.25 2k7s n ASN 110 Ca 0.01 -0.63 0.19 0.00 -0.60 0.00 0.00 54.58 53.55 2k7s n ASN 110 Cb 0.40 0.00 -0.06 0.00 -0.53 0.00 0.00 39.78 39.58 2k7s n ASN 110 CO 0.00 0.00 0.00 0.35 1.40 0.00 0.00 177.26 179.01 2k7s n THR 111 N -0.89 0.00 -2.68 -0.44 -2.24 -1.26 -4.98 114.28 101.78 2k7s n THR 111 Ca 0.00 0.32 -0.02 0.00 -2.27 0.00 0.00 64.05 62.08 2k7s n THR 111 Cb 0.00 -0.81 -0.01 0.00 -2.10 0.00 0.00 70.33 67.41 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 -4.33 -5.79 0.02 3.42 5.03 -1.26 -4.91 115.26 107.43 2k7s n ASN 112 Ca -0.02 1.42 -0.09 0.00 0.87 0.00 0.00 54.58 56.76 2k7s n ASN 112 Cb 0.68 -5.35 -0.13 0.00 -1.02 0.00 0.00 39.78 33.95 2k7s n ASN 112 CO 0.00 0.00 0.00 -0.37 -1.83 0.00 0.00 177.26 175.06 2k7s h VAL 113 N 3.38 1.23 0.00 2.41 -1.51 -2.02 -3.41 116.25 116.33 2k7s h VAL 113 Ca -0.17 -3.01 0.00 0.00 -1.23 0.00 0.00 66.70 62.29 2k7s h VAL 113 Cb 0.38 2.62 0.00 0.00 -2.13 0.00 0.00 31.29 32.17 2k7s h VAL 113 CO 0.07 0.72 0.00 0.29 -1.23 0.00 0.00 177.57 177.42 2k7s n LYS 114 N -3.21 0.00 -3.67 5.19 4.76 -1.26 -4.92 118.16 115.05 2k7s n LYS 114 Ca -0.10 0.08 -0.39 0.00 -2.87 0.00 0.00 58.31 55.03 2k7s n LYS 114 Cb 1.00 -0.46 -0.12 0.00 -1.84 0.00 0.00 35.03 33.62 2k7s n LYS 114 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 2k7s s ASN 115 N -2.89 5.51 0.18 4.39 4.22 -1.26 -5.09 114.94 119.99 2k7s s ASN 115 Ca 0.00 -1.00 0.05 0.00 -2.14 0.00 0.00 52.86 49.77 2k7s s ASN 115 Cb 0.00 -1.95 -0.04 0.00 1.28 0.00 0.00 41.25 40.54 2k7s s ASN 115 CO 0.00 -0.34 0.18 -0.55 -2.04 0.00 0.00 177.10 174.35 2k7s s SER 116 N 1.49 5.70 0.00 3.54 0.15 -1.26 -4.78 113.70 118.54 2k7s s SER 116 Ca 0.01 -0.08 0.00 0.00 0.70 0.00 0.00 55.95 56.58 2k7s s SER 116 Cb -0.19 -1.54 0.00 0.00 -1.71 0.00 0.00 66.02 62.58 2k7s s SER 116 CO 0.05 0.05 0.00 -1.54 1.20 0.00 0.00 173.24 172.99 2k7s n SER 117 N -0.53 0.00 -4.49 5.45 3.41 -1.26 -5.00 113.62 111.20 2k7s n SER 117 Ca -0.08 0.00 -0.47 0.00 -0.26 0.00 0.00 58.87 58.06 2k7s n SER 117 Cb 0.55 0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 64.44 2k7s n SER 117 CO 0.00 0.00 0.00 1.67 -0.16 0.00 0.00 175.04 176.55 2k7s n GLN 118 N 0.00 1.18 0.00 4.33 7.27 -1.26 -4.68 117.38 124.22 2k7s n GLN 118 Ca 0.00 0.29 0.11 0.00 0.07 0.00 0.00 57.00 57.47 2k7s n GLN 118 Cb 0.00 -2.67 0.65 0.00 2.41 0.00 0.00 30.24 30.63 2k7s n GLN 118 CO 0.00 0.00 0.00 -1.91 0.07 0.00 0.00 177.06 175.22