#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 2.53 0.00 4.61 0.00 -1.26 -4.57 121.76 123.07 2k7s s ALA 2 Ca 0.00 -2.14 0.00 0.00 0.00 0.00 0.00 51.96 49.82 2k7s s ALA 2 Cb 0.00 -4.54 0.00 0.00 0.00 0.00 0.00 23.12 18.58 2k7s s ALA 2 CO 0.00 -3.84 0.00 -0.12 0.00 0.00 0.00 175.76 171.80 2k7s n MET 3 N 8.87 0.00 -3.08 0.00 0.00 -1.26 -5.11 117.12 116.54 2k7s n MET 3 Ca 0.35 0.00 -0.10 0.00 0.00 0.00 0.00 57.70 57.95 2k7s n MET 3 Cb 0.50 0.00 0.01 0.00 0.00 0.00 0.00 33.22 33.73 2k7s n MET 3 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 175.97 175.72 2k7s n ASP 4 N -0.17 -6.95 -0.27 6.12 8.00 -1.26 -4.88 116.55 117.14 2k7s n ASP 4 Ca 0.00 0.57 -0.06 0.00 0.71 0.00 0.00 54.79 56.01 2k7s n ASP 4 Cb 0.00 -3.22 0.06 0.00 -0.02 0.00 0.00 41.12 37.94 2k7s n ASP 4 CO 0.00 0.00 0.00 0.78 -0.39 0.00 0.00 177.20 177.59 2k7s h ASN 5 N 2.86 0.98 -3.79 -2.24 2.35 -1.96 -3.44 115.58 110.34 2k7s h ASN 5 Ca -0.13 -0.14 -0.44 0.00 -0.55 0.00 0.00 56.30 55.04 2k7s h ASN 5 Cb 0.83 -0.25 -0.17 0.00 0.05 0.00 0.00 38.32 38.78 2k7s h ASN 5 CO 0.11 0.85 -0.76 -0.69 -1.65 0.00 0.00 177.43 175.29 2k7s s VAL 6 N -5.68 1.50 0.00 2.81 1.01 -1.26 -5.09 120.40 113.69 2k7s s VAL 6 Ca -0.13 -1.87 0.00 0.00 0.00 0.00 0.00 61.98 59.98 2k7s s VAL 6 Cb 0.15 -1.71 0.00 0.00 0.00 0.00 0.00 36.38 34.81 2k7s s VAL 6 CO 0.82 -0.44 0.71 0.00 0.00 0.00 0.00 175.10 176.18 2k7s s GLN 8 N -1.86 0.62 0.00 0.00 -0.21 -1.26 -5.01 119.66 111.95 2k7s s GLN 8 Ca 0.00 -0.90 0.00 0.00 0.02 0.00 0.00 55.36 54.48 2k7s s GLN 8 Cb 0.00 -0.31 0.00 0.00 1.00 0.00 0.00 33.01 33.70 2k7s s GLN 8 CO 0.00 0.04 0.00 -0.35 -2.12 0.00 0.00 175.29 172.86 2k7s n PRO 9 N 1.10 1.95 0.00 2.91 -0.04 -1.26 -5.02 135.00 134.65 2k7s n PRO 9 Ca -0.20 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.26 2k7s n PRO 9 Cb 0.56 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.02 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 -5.03 114.28 110.53 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 0.45 -0.10 1.09 -1.05 -1.26 -0.52 118.70 117.30 2k7s s GLU 11 Ca 0.00 0.63 0.03 0.00 -0.15 0.00 0.00 54.97 55.49 2k7s s GLU 11 Cb 0.00 0.16 0.01 0.00 -0.44 0.00 0.00 34.13 33.86 2k7s s GLU 11 CO 0.00 -0.07 -0.20 -0.59 0.95 0.00 0.00 175.26 175.35 2k7s s PHE 12 N 0.76 2.30 -0.57 4.83 -0.12 0.12 -4.92 117.98 120.37 2k7s s PHE 12 Ca -0.03 -1.01 -0.27 0.00 -0.05 0.00 0.00 56.93 55.57 2k7s s PHE 12 Cb -0.04 -1.58 0.03 0.00 -0.63 0.00 0.00 43.02 40.80 2k7s s PHE 12 CO -0.11 -0.45 1.13 0.42 -0.05 0.00 0.00 175.22 176.17 2k7s s ILE 13 N 0.60 4.10 -0.14 -4.49 1.01 -1.26 -1.62 121.20 119.40 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 37.62 2k7s s ILE 13 CO 0.04 -1.29 -0.18 -0.55 0.00 0.00 0.00 174.94 172.96 2k7s s SER 14 N 2.94 3.51 0.31 3.58 0.15 -0.24 -0.39 113.70 123.56 2k7s s SER 14 Ca 0.40 -0.50 -0.00 0.00 0.70 0.00 0.00 55.95 56.55 2k7s s SER 14 Cb -0.09 -1.52 -0.04 0.00 -1.71 0.00 0.00 66.02 62.66 2k7s s SER 14 CO 0.24 0.10 0.52 -0.13 1.20 0.00 0.00 173.24 175.17 2k7s s ARG 15 N 0.72 3.51 0.14 5.44 0.52 0.11 -0.61 118.95 128.78 2k7s s ARG 15 Ca -0.08 -0.29 -0.24 0.00 -0.52 0.00 0.00 55.73 54.60 2k7s s ARG 15 Cb -0.16 -2.69 0.08 0.00 0.52 0.00 0.00 34.95 32.70 2k7s s ARG 15 CO 0.01 0.21 1.08 -3.38 0.02 0.00 0.00 175.30 173.24 2k7s s HIS 16 N -2.20 0.03 0.76 -0.53 -3.43 -0.82 -0.01 115.29 109.09 2k7s s HIS 16 Ca 0.40 -0.36 -0.04 0.00 -0.80 0.00 0.00 55.06 54.26 2k7s s HIS 16 Cb -0.10 0.66 0.13 0.00 -1.43 0.00 0.00 32.58 31.85 2k7s s HIS 16 CO 0.34 -0.78 1.05 0.54 -2.00 0.00 0.00 174.74 173.89 2k7s s ASN 17 N -3.36 4.17 0.33 7.38 2.20 -0.60 -0.42 114.94 124.64 2k7s s ASN 17 Ca 0.21 -0.17 0.08 0.00 -0.94 0.00 0.00 52.86 52.04 2k7s s ASN 17 Cb -0.02 -0.18 0.79 0.00 -2.00 0.00 0.00 41.25 39.84 2k7s s ASN 17 CO 0.03 -1.99 1.81 -0.29 -2.94 0.00 0.00 177.10 173.72 2k7s h ILE 18 N -0.73 0.74 -0.44 0.54 6.09 -1.92 0.43 117.51 122.22 2k7s h ILE 18 Ca -0.39 -0.25 0.04 0.00 -1.37 0.00 0.00 64.86 62.89 2k7s h ILE 18 Cb 1.27 -0.05 -0.02 0.00 0.47 0.00 0.00 36.82 38.48 2k7s h ILE 18 CO 0.42 0.13 0.30 -0.33 -3.07 0.00 0.00 178.15 175.59 2k7s h GLU 19 N 0.72 0.44 0.00 2.19 4.39 -1.97 -3.45 114.58 116.91 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 0.89 -0.10 0.00 0.00 -0.10 0.00 0.00 28.75 29.44 2k7s h GLU 19 CO -0.31 0.29 0.00 0.41 -1.16 0.00 0.00 179.01 178.24 2k7s n GLY 20 N -1.50 1.04 3.61 -3.84 0.00 0.15 -4.67 105.19 99.98 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 -0.55 0.45 -1.60 -0.61 2.08 -1.26 -1.47 119.36 116.41 2k7s n ILE 21 Ca 0.00 -0.23 -0.42 0.00 0.56 0.00 0.00 62.75 62.66 2k7s n ILE 21 Cb 0.00 -2.01 -0.03 0.00 -0.75 0.00 0.00 39.64 36.85 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 5.88 1.15 -2.04 1.39 0.08 -0.35 -1.56 117.98 122.52 2k7s s PHE 22 Ca 0.99 0.64 0.27 0.00 0.12 0.00 0.00 56.93 58.95 2k7s s PHE 22 Cb -0.64 -3.89 0.93 0.00 -0.57 0.00 0.00 43.02 38.85 2k7s s PHE 22 CO 0.47 -3.95 1.67 0.25 -0.10 0.00 0.00 175.22 173.56 2k7s n THR 23 N 7.79 0.00 -3.61 0.64 -2.24 0.98 -0.34 114.28 117.51 2k7s n THR 23 Ca 0.30 -0.17 -0.07 0.00 -2.27 0.00 0.00 64.05 61.85 2k7s n THR 23 Cb 0.46 0.38 -0.05 0.00 -2.10 0.00 0.00 70.33 69.02 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 -2.29 -0.23 -0.13 4.78 5.36 -0.84 -4.91 117.98 119.73 2k7s s PHE 24 Ca 0.31 0.41 -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 0.44 -0.20 0.28 0.08 -1.46 0.00 0.00 175.22 174.35 2k7s s VAL 25 N -0.97 -0.27 0.18 3.12 1.01 -1.26 0.09 120.40 122.30 2k7s s VAL 25 Ca 0.03 0.21 -0.31 0.00 0.00 0.00 0.00 61.98 61.92 2k7s s VAL 25 Cb -0.01 -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 1.41 -0.62 0.00 0.00 0.00 175.10 175.95 2k7s s ASP 26 N 1.94 6.76 0.14 3.32 2.15 0.48 -4.62 116.67 126.84 2k7s s ASP 26 Ca -0.03 2.49 0.06 0.00 0.43 0.00 0.00 52.55 55.49 2k7s s ASP 26 Cb -0.11 -2.60 0.32 0.00 -0.30 0.00 0.00 42.92 40.22 2k7s s ASP 26 CO -0.09 -0.66 1.02 0.00 -0.17 0.00 0.00 175.17 175.27 2k7s n HIS 27 N 3.18 0.20 0.21 -5.34 1.44 -1.26 -0.35 115.22 113.30 2k7s n HIS 27 Ca 0.09 0.10 0.08 0.00 -2.01 0.00 0.00 57.72 55.99 2k7s n HIS 27 Cb 0.41 -0.47 0.47 0.00 0.12 0.00 0.00 29.99 30.52 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 -1.03 -1.40 3.08 -1.92 -3.13 114.38 109.99 2k7s h ARG 28 Ca 0.00 0.00 0.30 0.00 0.07 0.00 0.00 59.98 60.35 2k7s h ARG 28 Cb 0.48 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.49 2k7s h ARG 28 CO 0.00 0.28 0.88 0.00 -1.07 0.00 0.00 179.97 180.05 2k7s h VAL 30 N 0.00 1.54 0.00 0.00 -1.51 -1.43 0.31 116.25 115.16 2k7s h VAL 30 Ca 0.49 -2.74 -0.15 0.00 -1.23 0.00 0.00 66.70 63.07 2k7s h VAL 30 Cb 2.23 2.52 -0.02 0.00 -2.13 0.00 0.00 31.29 33.89 2k7s h VAL 30 CO -0.01 0.79 -0.75 0.00 -1.23 0.00 0.00 177.57 176.38 2k7s h ALA 31 N 1.02 0.55 0.00 5.19 0.00 -0.43 -0.38 119.26 125.21 2k7s h ALA 31 Ca -0.03 -0.67 -0.00 0.00 0.00 0.00 0.00 54.91 54.21 2k7s h ALA 31 Cb 1.52 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 19.22 2k7s h ALA 31 CO 0.13 0.90 -0.11 1.15 0.00 0.00 0.00 179.25 181.32 2k7s h THR 32 N 0.00 0.00 -0.17 0.00 2.02 -0.91 -3.38 112.91 110.48 2k7s h THR 32 Ca -0.02 -1.00 0.00 0.00 0.77 0.00 0.00 66.41 66.16 2k7s h THR 32 Cb 1.55 0.01 0.00 0.00 -1.74 0.00 0.00 68.15 67.97 2k7s h THR 32 CO 0.09 0.00 0.00 1.33 0.37 0.00 0.00 175.52 177.31 2k7s n VAL 33 N -4.74 0.99 0.00 3.16 0.24 0.10 -4.19 118.33 113.89 2k7s n VAL 33 Ca -0.02 -1.00 0.00 0.00 -2.04 0.00 0.00 64.34 61.29 2k7s n VAL 33 Cb 0.06 0.50 0.00 0.00 -1.47 0.00 0.00 33.84 32.93 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 0.01 1.98 3.66 7.63 0.00 -0.15 0.29 105.19 118.61 2k7s n GLY 34 Ca 0.06 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.65 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 0.88 1.61 2.02 -1.22 -4.54 117.35 118.60 2k7s s TYR 35 Ca 0.00 0.70 -0.11 0.00 -0.37 0.00 0.00 57.07 57.29 2k7s s TYR 35 Cb 0.00 -3.69 0.12 0.00 -0.40 0.00 0.00 41.96 37.99 2k7s s TYR 35 CO 0.00 -2.50 1.17 -0.65 -1.57 0.00 0.00 175.55 172.01 2k7s s GLN 36 N 3.79 1.22 0.31 -0.62 -0.21 -1.26 -2.58 119.66 120.31 2k7s s GLN 36 Ca 0.62 1.65 0.07 0.00 0.02 0.00 0.00 55.36 57.72 2k7s s GLN 36 Cb -0.25 -1.74 0.83 0.00 1.00 0.00 0.00 33.01 32.84 2k7s s GLN 36 CO 0.21 -2.50 1.72 -1.35 -2.12 0.00 0.00 175.29 171.25 2k7s h PRO 37 N -1.52 0.53 0.00 2.91 0.11 -1.83 0.78 132.00 132.99 2k7s h PRO 37 Ca -0.44 -0.03 -0.11 0.00 0.11 0.00 0.00 66.00 65.53 2k7s h PRO 37 Cb 1.28 -0.12 -0.02 0.00 0.11 0.00 0.00 31.00 32.26 2k7s h PRO 37 CO 0.43 0.35 -0.51 -0.56 -0.21 0.00 0.00 178.00 177.50 2k7s h GLN 38 N 0.54 0.00 0.00 1.05 3.07 -1.89 0.33 115.11 118.21 2k7s h GLN 38 Ca 0.61 0.00 0.00 0.00 0.09 0.00 0.00 58.65 59.35 2k7s h GLN 38 Cb 1.15 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.71 2k7s h GLN 38 CO -0.48 0.51 0.00 0.39 0.09 0.00 0.00 178.83 179.34 2k7s n GLU 39 N -3.71 0.08 -0.01 0.06 1.02 0.27 -3.01 120.64 115.33 2k7s n GLU 39 Ca -0.01 0.22 -0.02 0.00 -0.02 0.00 0.00 57.16 57.34 2k7s n GLU 39 Cb 0.56 -1.50 -0.01 0.00 -0.02 0.00 0.00 31.44 30.47 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 -1.41 2.35 -4.64 -4.62 7.99 -0.81 -4.80 117.00 111.07 2k7s n LEU 40 Ca 0.05 -0.01 -0.49 0.00 -0.01 0.00 0.00 56.01 55.55 2k7s n LEU 40 Cb 0.14 -0.06 -0.05 0.00 -0.11 0.00 0.00 43.42 43.33 2k7s n LEU 40 CO 0.12 0.44 1.10 0.18 -1.51 0.00 0.00 177.39 177.71 2k7s n LEU 41 N -2.47 2.53 0.00 2.23 4.77 0.11 -0.24 117.00 123.93 2k7s n LEU 41 Ca -0.04 1.09 0.00 0.00 -0.03 0.00 0.00 56.01 57.03 2k7s n LEU 41 Cb 0.55 -1.33 0.00 0.00 -2.33 0.00 0.00 43.42 40.32 2k7s n LEU 41 CO 0.03 -0.57 0.00 0.61 -1.33 0.00 0.00 177.39 176.13 2k7s n GLY 42 N 3.13 1.92 3.88 -0.72 0.00 0.54 -4.91 105.19 109.03 2k7s n GLY 42 Ca 0.18 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.83 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 -0.24 3.48 -0.23 1.61 1.02 0.66 -4.70 119.74 121.36 2k7s s LYS 43 Ca 0.00 -0.11 -0.29 0.00 0.02 0.00 0.00 55.97 55.59 2k7s s LYS 43 Cb 0.00 -3.18 -0.03 0.00 -0.52 0.00 0.00 37.83 34.11 2k7s s LYS 43 CO 0.00 0.76 1.64 1.21 -0.92 0.00 0.00 175.35 178.04 2k7s s ASN 44 N -1.17 6.33 0.28 2.83 3.84 -1.26 -1.22 114.94 124.57 2k7s s ASN 44 Ca 0.18 1.61 0.01 0.00 0.21 0.00 0.00 52.86 54.87 2k7s s ASN 44 Cb -0.12 -2.53 0.66 0.00 -0.55 0.00 0.00 41.25 38.71 2k7s s ASN 44 CO 0.07 -1.30 1.68 -0.29 -2.79 0.00 0.00 177.10 174.47 2k7s h ILE 45 N 6.21 0.44 0.00 -5.21 2.10 -1.53 0.25 117.51 119.76 2k7s h ILE 45 Ca -0.34 -0.11 -0.07 0.00 1.08 0.00 0.00 64.86 65.42 2k7s h ILE 45 Cb 1.16 0.09 -0.01 0.00 -1.09 0.00 0.00 36.82 36.97 2k7s h ILE 45 CO 1.00 0.06 -0.35 -0.37 -1.08 0.00 0.00 178.15 177.41 2k7s h VAL 46 N 0.32 1.09 -0.81 2.19 -1.51 -1.83 -2.46 116.25 113.24 2k7s h VAL 46 Ca 0.53 -1.29 0.19 0.00 -1.23 0.00 0.00 66.70 64.90 2k7s h VAL 46 Cb 1.00 1.73 -0.05 0.00 -2.13 0.00 0.00 31.29 31.84 2k7s h VAL 46 CO -0.56 0.35 0.55 -0.33 -1.23 0.00 0.00 177.57 176.35 2k7s h GLU 47 N 0.00 0.25 0.13 5.19 5.08 -0.87 0.35 114.58 124.71 2k7s h GLU 47 Ca -0.00 -0.02 -0.29 0.00 -1.00 0.00 0.00 59.36 58.05 2k7s h GLU 47 Cb 0.70 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.89 2k7s h GLU 47 CO 0.05 0.17 -1.41 0.74 -1.00 0.00 0.00 179.01 177.55 2k7s h PHE 48 N 0.26 0.50 -3.27 4.33 -1.00 -1.47 -3.46 116.94 112.82 2k7s h PHE 48 Ca 0.40 -0.36 -0.58 0.00 2.81 0.00 0.00 57.97 60.24 2k7s h PHE 48 Cb 1.18 -0.02 0.14 0.00 3.61 0.00 0.00 35.95 40.86 2k7s h PHE 48 CO -0.00 1.35 0.20 0.00 -1.61 0.00 0.00 178.31 178.25 2k7s s HIS 50 N -1.33 2.64 0.22 0.00 2.46 0.75 -4.69 115.29 115.34 2k7s s HIS 50 Ca 0.66 0.31 -0.18 0.00 0.47 0.00 0.00 55.06 56.32 2k7s s HIS 50 Cb -0.51 -4.06 0.22 0.00 -0.13 0.00 0.00 32.58 28.10 2k7s s HIS 50 CO 0.55 -4.14 1.57 -1.35 -2.47 0.00 0.00 174.74 168.89 2k7s h PRO 51 N 7.61 -0.05 -0.03 2.88 0.11 -1.89 0.58 132.00 141.20 2k7s h PRO 51 Ca -0.44 0.00 0.01 0.00 0.11 0.00 0.00 66.00 65.69 2k7s h PRO 51 Cb 1.21 0.01 -0.00 0.00 0.11 0.00 0.00 31.00 32.33 2k7s h PRO 51 CO 0.94 -0.03 0.27 0.93 -0.21 0.00 0.00 178.00 179.89 2k7s h GLU 52 N -0.05 0.00 0.00 1.05 5.08 -2.00 -0.19 114.58 118.46 2k7s h GLU 52 Ca 0.32 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.68 2k7s h GLU 52 Cb 0.59 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.84 2k7s h GLU 52 CO -0.89 0.00 -0.66 -0.25 -1.00 0.00 0.00 179.01 176.21 2k7s n ASP 53 N -3.01 0.87 0.20 1.42 8.00 0.17 -4.55 116.55 119.64 2k7s n ASP 53 Ca -0.02 -0.60 0.07 0.00 0.71 0.00 0.00 54.79 54.95 2k7s n ASP 53 Cb 0.33 1.09 0.57 0.00 -0.02 0.00 0.00 41.12 43.08 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 0.11 0.00 -1.24 4.20 0.14 0.81 115.11 119.13 2k7s h GLN 54 Ca 0.00 -0.01 -0.07 0.00 0.06 0.00 0.00 58.65 58.63 2k7s h GLN 54 Cb 0.28 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 28.03 2k7s h GLN 54 CO 0.00 0.11 -0.32 0.37 -0.67 0.00 0.00 178.83 178.32 2k7s h GLN 55 N 0.11 0.00 0.14 1.46 5.75 -1.80 -0.33 115.11 120.44 2k7s h GLN 55 Ca 0.03 0.00 -0.28 0.00 -0.15 0.00 0.00 58.65 58.25 2k7s h GLN 55 Cb 0.06 0.00 0.01 0.00 1.07 0.00 0.00 27.48 28.62 2k7s h GLN 55 CO -0.00 0.32 -1.26 1.25 -2.65 0.00 0.00 178.83 176.49 2k7s h LEU 56 N 0.00 0.53 0.52 -2.39 5.85 -1.19 -2.10 115.31 116.53 2k7s h LEU 56 Ca -0.00 -0.55 -0.03 0.00 0.84 0.00 0.00 57.88 58.14 2k7s h LEU 56 Cb 0.66 -0.17 0.01 0.00 0.37 0.00 0.00 40.66 41.52 2k7s h LEU 56 CO 0.04 1.42 -0.25 0.25 -0.34 0.00 0.00 178.44 179.56 2k7s h LEU 57 N 0.11 -0.59 -1.06 2.25 5.85 -0.75 -1.83 115.31 119.28 2k7s h LEU 57 Ca -0.15 -0.06 0.11 0.00 0.84 0.00 0.00 57.88 58.62 2k7s h LEU 57 Cb 1.98 0.15 -0.08 0.00 0.37 0.00 0.00 40.66 43.08 2k7s h LEU 57 CO 0.22 -0.25 0.62 0.03 -0.34 0.00 0.00 178.44 178.72 2k7s h ARG 58 N -0.97 0.94 -0.39 1.25 3.08 -1.19 -1.08 114.38 116.02 2k7s h ARG 58 Ca -0.07 -0.06 0.06 0.00 0.07 0.00 0.00 59.98 59.98 2k7s h ARG 58 Cb 0.62 -0.21 -0.05 0.00 0.08 0.00 0.00 29.97 30.40 2k7s h ARG 58 CO 0.12 0.62 0.07 0.22 -1.07 0.00 0.00 179.97 179.93 2k7s h ASP 59 N 0.97 -0.01 0.05 7.04 3.58 -1.21 0.35 116.42 127.17 2k7s h ASP 59 Ca 0.48 0.07 0.03 0.00 0.42 0.00 0.00 57.03 58.02 2k7s h ASP 59 Cb 0.47 0.10 -0.05 0.00 1.72 0.00 0.00 39.33 41.57 2k7s h ASP 59 CO -0.24 0.03 -0.39 -1.28 -2.88 0.00 0.00 179.24 174.48 2k7s h SER 60 N 0.19 -1.15 -0.85 2.28 0.87 -0.33 -0.28 113.55 114.27 2k7s h SER 60 Ca 0.19 0.14 0.17 0.00 -1.23 0.00 0.00 61.79 61.06 2k7s h SER 60 Cb 0.23 0.45 -0.06 0.00 -0.44 0.00 0.00 62.40 62.58 2k7s h SER 60 CO -0.26 -0.45 0.56 -0.26 -0.53 0.00 0.00 176.83 175.90 2k7s h PHE 61 N -0.57 0.62 -0.12 2.24 0.04 -0.99 0.38 116.94 118.54 2k7s h PHE 61 Ca 0.04 0.02 -0.09 0.00 2.80 0.00 0.00 57.97 60.74 2k7s h PHE 61 Cb 0.63 -0.19 -0.01 0.00 2.20 0.00 0.00 35.95 38.58 2k7s h PHE 61 CO -0.37 0.21 -0.35 1.96 -0.60 0.00 0.00 178.31 179.15 2k7s h GLN 62 N 0.51 0.24 0.15 1.51 1.08 0.51 -2.21 115.11 116.89 2k7s h GLN 62 Ca 0.43 -0.10 -0.24 0.00 -1.45 0.00 0.00 58.65 57.29 2k7s h GLN 62 Cb 0.92 -0.01 0.03 0.00 -0.05 0.00 0.00 27.48 28.37 2k7s h GLN 62 CO -0.17 0.57 -1.05 1.96 -0.95 0.00 0.00 178.83 179.19 2k7s h GLN 63 N 0.21 0.45 -0.45 1.46 1.08 0.13 -1.86 115.11 116.12 2k7s h GLN 63 Ca 0.02 -0.68 -0.05 0.00 -1.45 0.00 0.00 58.65 56.49 2k7s h GLN 63 Cb 0.72 0.24 -0.02 0.00 -0.05 0.00 0.00 27.48 28.37 2k7s h GLN 63 CO 0.05 1.31 0.06 -0.39 -0.95 0.00 0.00 178.83 178.91 2k7s h VAL 64 N -0.07 1.21 0.00 -0.54 -1.51 -0.89 -0.19 116.25 114.27 2k7s h VAL 64 Ca -0.17 -0.82 -0.21 0.00 -1.23 0.00 0.00 66.70 64.27 2k7s h VAL 64 Cb 1.79 0.81 -0.03 0.00 -2.13 0.00 0.00 31.29 31.73 2k7s h VAL 64 CO 0.20 0.29 -1.01 1.62 -1.23 0.00 0.00 177.57 177.44 2k7s h VAL 65 N 0.66 1.66 -0.33 7.19 3.04 -1.48 -0.16 116.25 126.83 2k7s h VAL 65 Ca 0.14 -3.37 -0.18 0.00 -1.01 0.00 0.00 66.70 62.29 2k7s h VAL 65 Cb 0.33 2.82 -0.00 0.00 -2.01 0.00 0.00 31.29 32.42 2k7s h VAL 65 CO 0.01 0.95 -0.48 0.11 -1.01 0.00 0.00 177.57 177.14 2k7s h LYS 66 N 0.00 0.90 -0.32 4.17 1.57 -0.93 -2.91 116.57 119.05 2k7s h LYS 66 Ca -0.02 -0.53 0.00 0.00 -1.87 0.00 0.00 60.65 58.23 2k7s h LYS 66 Cb 1.77 0.05 0.00 0.00 0.08 0.00 0.00 32.23 34.12 2k7s h LYS 66 CO 0.13 1.18 0.00 1.28 -0.57 0.00 0.00 179.45 181.46 2k7s n LEU 67 N -4.03 2.54 -2.89 2.94 4.77 -0.12 -4.99 117.00 115.22 2k7s n LEU 67 Ca -0.03 -1.13 -0.21 0.00 -0.03 0.00 0.00 56.01 54.61 2k7s n LEU 67 Cb 0.60 -0.21 0.01 0.00 -2.33 0.00 0.00 43.42 41.49 2k7s n LEU 67 CO 0.50 0.56 -0.17 0.29 -1.33 0.00 0.00 177.39 177.24 2k7s n LYS 68 N 0.89 -1.11 0.00 3.23 4.76 -0.14 -3.42 118.16 122.37 2k7s n LYS 68 Ca 0.17 0.71 0.00 0.00 -2.87 0.00 0.00 58.31 56.33 2k7s n LYS 68 Cb 0.45 -1.31 0.00 0.00 -1.84 0.00 0.00 35.03 32.33 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 -0.58 3.75 3.68 0.72 0.00 -0.79 -4.95 105.19 107.01 2k7s n GLY 69 Ca -0.12 -0.92 -0.53 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 1.53 -2.82 1.61 -0.06 -1.22 -4.34 117.38 112.08 2k7s n GLN 70 Ca 0.00 0.56 -0.38 0.00 -2.00 0.00 0.00 57.00 55.18 2k7s n GLN 70 Cb 0.00 -2.29 -0.06 0.00 -4.06 0.00 0.00 30.24 23.83 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 2.92 4.20 0.09 1.69 0.11 -1.26 -4.08 120.40 124.07 2k7s s VAL 71 Ca 0.93 1.87 0.05 0.00 -2.93 0.00 0.00 61.98 61.90 2k7s s VAL 71 Cb -0.91 -4.14 -0.04 0.00 -1.53 0.00 0.00 36.38 29.76 2k7s s VAL 71 CO 0.56 0.34 -0.04 -0.76 -3.33 0.00 0.00 175.10 171.87 2k7s s LEU 72 N -1.58 3.29 -0.17 2.54 2.01 0.12 -4.94 118.68 119.95 2k7s s LEU 72 Ca 0.44 -0.25 -0.01 0.00 0.01 0.00 0.00 54.13 54.32 2k7s s LEU 72 Cb -0.22 -2.04 0.04 0.00 0.01 0.00 0.00 46.19 43.99 2k7s s LEU 72 CO 0.27 0.18 -0.03 -0.55 1.01 0.00 0.00 176.35 177.23 2k7s s SER 73 N -2.20 2.80 -0.01 2.29 0.15 -1.24 -1.86 113.70 113.63 2k7s s SER 73 Ca 0.23 -0.67 0.01 0.00 0.70 0.00 0.00 55.95 56.22 2k7s s SER 73 Cb -0.11 -0.83 0.01 0.00 -1.71 0.00 0.00 66.02 63.37 2k7s s SER 73 CO 0.16 -0.21 -0.02 0.68 1.20 0.00 0.00 173.24 175.05 2k7s s VAL 74 N 1.69 0.20 -0.20 4.45 -7.23 -1.11 -4.93 120.40 113.27 2k7s s VAL 74 Ca 0.00 -0.04 -0.12 0.00 -1.81 0.00 0.00 61.98 60.01 2k7s s VAL 74 Cb -0.16 -0.22 -0.05 0.00 0.56 0.00 0.00 36.38 36.52 2k7s s VAL 74 CO -0.07 0.09 0.20 -0.04 -0.31 0.00 0.00 175.10 174.97 2k7s s MET 75 N 0.33 4.17 0.18 4.82 -1.94 -1.26 -0.72 119.30 124.89 2k7s s MET 75 Ca -0.03 -0.12 -0.03 0.00 -1.71 0.00 0.00 55.69 53.80 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 0.16 -0.59 -0.01 0.00 0.00 175.02 174.75 2k7s s PHE 76 N 0.69 0.93 -0.42 -0.03 -0.71 -0.22 -4.95 117.98 113.27 2k7s s PHE 76 Ca 0.11 -1.22 -0.16 0.00 -1.04 0.00 0.00 56.93 54.62 2k7s s PHE 76 Cb -0.13 -0.42 0.03 0.00 -1.21 0.00 0.00 43.02 41.30 2k7s s PHE 76 CO 0.02 -0.65 0.36 1.03 -1.34 0.00 0.00 175.22 174.65 2k7s s ARG 77 N -4.10 3.01 -0.53 1.99 0.52 -1.26 -0.29 118.95 118.29 2k7s s ARG 77 Ca 0.31 -0.98 -0.22 0.00 -0.52 0.00 0.00 55.73 54.32 2k7s s ARG 77 Cb 0.06 -4.00 0.05 0.00 0.52 0.00 0.00 34.95 31.58 2k7s s ARG 77 CO 0.08 -0.83 0.82 0.12 0.02 0.00 0.00 175.30 175.50 2k7s s PHE 78 N 1.84 2.89 -0.53 -0.53 2.19 0.57 -0.18 117.98 124.25 2k7s s PHE 78 Ca 0.07 -0.21 -0.26 0.00 0.33 0.00 0.00 56.93 56.86 2k7s s PHE 78 Cb -0.19 -3.86 -0.04 0.00 -1.31 0.00 0.00 43.02 37.62 2k7s s PHE 78 CO 0.11 -1.22 2.09 0.50 1.83 0.00 0.00 175.22 178.53 2k7s s ARG 79 N 3.43 2.48 0.50 10.12 3.00 -0.80 -1.27 118.95 136.40 2k7s s ARG 79 Ca 0.24 1.05 -0.07 0.00 -1.00 0.00 0.00 55.73 55.95 2k7s s ARG 79 Cb -0.15 -4.45 0.11 0.00 0.00 0.00 0.00 34.95 30.46 2k7s s ARG 79 CO 0.16 -2.87 0.68 0.43 0.00 0.00 0.00 175.30 173.70 2k7s n SER 80 N 13.83 0.21 0.33 -2.12 7.64 -0.98 -4.83 113.62 127.71 2k7s n SER 80 Ca 0.28 -1.34 0.21 0.00 1.01 0.00 0.00 58.87 59.02 2k7s n SER 80 Cb 0.53 -0.51 1.12 0.00 -1.01 0.00 0.00 64.21 64.34 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 3.64 -0.49 0.30 116.57 121.43 2k7s h LYS 81 Ca -0.22 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.16 2k7s h LYS 81 Cb 0.65 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.47 2k7s h LYS 81 CO 0.17 0.00 0.00 0.09 -2.27 0.00 0.00 179.45 177.44 2k7s n ASN 82 N -3.14 1.06 -2.69 4.20 3.02 -1.26 -4.91 115.26 111.53 2k7s n ASN 82 Ca -0.03 -1.37 -0.19 0.00 -0.03 0.00 0.00 54.58 52.96 2k7s n ASN 82 Cb 0.13 -0.01 0.04 0.00 -0.61 0.00 0.00 39.78 39.34 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 -0.17 -4.85 -4.94 3.52 6.02 0.10 -5.01 117.38 112.06 2k7s n GLN 83 Ca 0.20 0.74 -0.27 0.00 -0.01 0.00 0.00 57.00 57.65 2k7s n GLN 83 Cb 0.28 -5.30 -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 -5.68 1.65 -0.97 -1.09 0.41 -1.26 -4.89 118.70 106.88 2k7s s GLU 84 Ca 0.32 -0.84 -0.24 0.00 -0.41 0.00 0.00 54.97 53.80 2k7s s GLU 84 Cb -0.14 -1.66 -0.07 0.00 -1.78 0.00 0.00 34.13 30.48 2k7s s GLU 84 CO 0.40 0.45 1.97 -1.58 -0.49 0.00 0.00 175.26 176.00 2k7s s TRP 85 N -0.60 1.80 -0.60 1.61 0.23 -1.26 -2.31 118.94 117.81 2k7s s TRP 85 Ca 0.08 0.68 -0.28 0.00 -2.03 0.00 0.00 56.10 54.56 2k7s s TRP 85 Cb -0.09 -3.99 0.02 0.00 0.03 0.00 0.00 33.47 29.44 2k7s s TRP 85 CO 0.00 -1.57 1.35 -0.51 0.96 0.00 0.00 176.95 177.18 2k7s s LEU 86 N 10.67 3.36 0.09 2.99 1.43 -0.40 -4.67 118.68 132.16 2k7s s LEU 86 Ca 0.71 0.10 -0.31 0.00 -1.03 0.00 0.00 54.13 53.60 2k7s s LEU 86 Cb -0.05 -2.96 -0.09 0.00 0.03 0.00 0.00 46.19 43.12 2k7s s LEU 86 CO 0.04 -1.71 1.70 0.26 0.23 0.00 0.00 176.35 176.86 2k7s s TRP 87 N 5.86 2.40 0.12 0.29 0.52 -1.26 -0.31 118.94 126.55 2k7s s TRP 87 Ca 0.47 0.24 0.02 0.00 0.02 0.00 0.00 56.10 56.86 2k7s s TRP 87 Cb -0.09 -4.03 -0.04 0.00 -1.15 0.00 0.00 33.47 28.16 2k7s s TRP 87 CO 0.23 -4.13 -0.06 -1.64 0.02 0.00 0.00 176.95 171.37 2k7s s MET 88 N 2.54 0.91 -0.19 4.98 -1.94 0.60 -0.81 119.30 125.38 2k7s s MET 88 Ca 0.76 -1.38 0.00 0.00 -1.71 0.00 0.00 55.69 53.36 2k7s s MET 88 Cb -0.42 -0.28 0.02 0.00 2.01 0.00 0.00 34.83 36.16 2k7s s MET 88 CO 0.33 -0.02 -0.17 1.03 -0.01 0.00 0.00 175.02 176.19 2k7s s ARG 89 N -3.83 2.98 -0.03 2.03 0.52 0.24 -1.05 118.95 119.81 2k7s s ARG 89 Ca 0.14 -0.85 -0.15 0.00 -0.52 0.00 0.00 55.73 54.35 2k7s s ARG 89 Cb 0.05 -2.67 -0.05 0.00 0.52 0.00 0.00 34.95 32.80 2k7s s ARG 89 CO -0.03 -0.24 0.41 0.95 0.02 0.00 0.00 175.30 176.41 2k7s s THR 90 N 1.30 5.08 -0.81 0.02 -4.23 0.11 -1.44 115.64 115.67 2k7s s THR 90 Ca 0.04 0.83 0.02 0.00 -1.18 0.00 0.00 61.69 61.40 2k7s s THR 90 Cb -0.14 -3.72 0.27 0.00 1.34 0.00 0.00 72.50 70.25 2k7s s THR 90 CO -0.11 0.52 1.01 -1.20 -0.54 0.00 0.00 174.62 174.30 2k7s n SER 91 N 2.27 4.73 -4.68 3.99 7.64 -0.74 -2.74 113.62 124.10 2k7s n SER 91 Ca -0.13 -3.42 -0.42 0.00 1.01 0.00 0.00 58.87 55.92 2k7s n SER 91 Cb 0.52 -0.91 -0.03 0.00 -1.01 0.00 0.00 64.21 62.78 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 -2.09 7.14 -0.14 6.43 0.01 -0.78 -2.52 113.70 121.76 2k7s s SER 92 Ca 0.36 1.40 -0.29 0.00 1.31 0.00 0.00 55.95 58.73 2k7s s SER 92 Cb 0.10 -2.51 0.08 0.00 0.21 0.00 0.00 66.02 63.90 2k7s s SER 92 CO 0.02 -0.40 0.76 0.00 0.41 0.00 0.00 173.24 174.03 2k7s s GLN 93 N 1.94 0.90 -0.43 12.44 -2.07 -0.78 0.12 119.66 131.78 2k7s s GLN 93 Ca 0.45 0.45 -0.43 0.00 -1.82 0.00 0.00 55.36 54.01 2k7s s GLN 93 Cb -0.18 0.43 -0.18 0.00 -1.09 0.00 0.00 33.01 32.00 2k7s s GLN 93 CO 0.16 -0.23 1.87 0.25 -1.32 0.00 0.00 175.29 176.02 2k7s n THR 94 N 1.42 0.10 -0.67 3.63 -2.24 -1.26 0.09 114.28 115.35 2k7s n THR 94 Ca -0.16 -0.05 -0.32 0.00 -2.27 0.00 0.00 64.05 61.26 2k7s n THR 94 Cb 0.57 -0.82 0.16 0.00 -2.10 0.00 0.00 70.33 68.14 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 6.10 -4.04 -1.00 6.98 0.00 -1.19 -4.62 120.51 122.75 2k7s n ALA 95 Ca 0.38 -1.30 0.00 0.00 0.00 0.00 0.00 53.44 52.52 2k7s n ALA 95 Cb 0.03 -1.41 0.00 0.00 0.00 0.00 0.00 19.45 18.07 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 -1.80 0.00 -3.59 0.00 1.13 -1.26 -3.95 117.38 107.90 2k7s n GLN 96 Ca 0.01 0.00 -0.08 0.00 -1.94 0.00 0.00 57.00 54.99 2k7s n GLN 96 Cb 0.61 -0.66 -0.04 0.00 0.11 0.00 0.00 30.24 30.26 2k7s n GLN 96 CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 2k7s s ASN 97 N -1.37 -0.26 0.00 1.08 4.22 -1.26 -3.41 114.94 113.93 2k7s s ASN 97 Ca 0.00 0.25 0.17 0.00 -2.14 0.00 0.00 52.86 51.14 2k7s s ASN 97 Cb 0.00 0.22 0.96 0.00 1.28 0.00 0.00 41.25 43.71 2k7s s ASN 97 CO 0.00 -0.26 1.63 -0.81 -2.04 0.00 0.00 177.10 175.61 2k7s n PRO 98 N 0.55 1.06 -0.41 3.55 -0.04 -1.26 -4.82 135.00 133.63 2k7s n PRO 98 Ca -0.06 -0.09 -0.06 0.00 -0.04 0.00 0.00 63.50 63.24 2k7s n PRO 98 Cb 0.58 -1.27 0.03 0.00 -0.04 0.00 0.00 33.50 32.80 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 -0.66 0.63 -0.37 0.54 4.01 -1.26 -4.41 117.16 115.64 2k7s n TYR 99 Ca 0.13 -1.02 0.00 0.00 -0.16 0.00 0.00 57.90 56.85 2k7s n TYR 99 Cb 0.08 -0.51 0.14 0.00 -0.31 0.00 0.00 39.34 38.74 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 0.59 1.07 0.23 7.72 0.87 -1.68 0.20 113.55 122.56 2k7s h SER 100 Ca 0.13 -0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.68 2k7s h SER 100 Cb 1.21 -0.24 0.00 0.00 -0.44 0.00 0.00 62.40 62.93 2k7s h SER 100 CO 0.26 0.73 0.00 0.47 -0.53 0.00 0.00 176.83 177.76 2k7s n ASP 101 N -4.46 0.00 -1.40 6.23 8.00 -1.26 -3.76 116.55 119.90 2k7s n ASP 101 Ca 0.13 -0.34 0.00 0.00 0.71 0.00 0.00 54.79 55.29 2k7s n ASP 101 Cb 0.10 -0.16 0.00 0.00 -0.02 0.00 0.00 41.12 41.05 2k7s n ASP 101 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2k7s n GLU 102 N -1.16 3.12 -3.41 -1.24 -0.58 0.69 -4.89 120.64 113.17 2k7s n GLU 102 Ca 0.14 0.00 -0.17 0.00 -0.42 0.00 0.00 57.16 56.71 2k7s n GLU 102 Cb 0.13 0.00 -0.10 0.00 -0.57 0.00 0.00 31.44 30.90 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 1.45 -0.41 -0.43 -3.67 1.01 0.44 -3.16 121.20 116.44 2k7s s ILE 103 Ca 0.00 -0.40 -0.29 0.00 0.00 0.00 0.00 60.65 59.96 2k7s s ILE 103 Cb 0.00 -0.93 0.02 0.00 0.01 0.00 0.00 42.46 41.56 2k7s s ILE 103 CO 0.00 -0.40 1.31 -0.70 0.00 0.00 0.00 174.94 175.15 2k7s s GLU 104 N 2.37 3.64 -0.24 2.79 2.12 0.11 -1.94 118.70 127.55 2k7s s GLU 104 Ca 0.09 0.81 -0.05 0.00 0.36 0.00 0.00 54.97 56.19 2k7s s GLU 104 Cb -0.14 -3.98 -0.01 0.00 0.26 0.00 0.00 34.13 30.26 2k7s s GLU 104 CO -0.29 -1.49 -0.00 0.99 -0.54 0.00 0.00 175.26 173.94 2k7s s THR 105 N 5.06 3.61 -0.58 -1.70 2.01 0.22 -1.86 115.64 122.40 2k7s s THR 105 Ca 0.56 -0.51 -0.19 0.00 0.31 0.00 0.00 61.69 61.86 2k7s s THR 105 Cb -0.11 -2.71 0.09 0.00 0.01 0.00 0.00 72.50 69.77 2k7s s THR 105 CO 0.32 0.33 0.71 -0.63 -0.69 0.00 0.00 174.62 174.66 2k7s s ILE 106 N 1.50 4.78 -0.50 1.82 1.09 -1.05 -1.07 121.20 127.76 2k7s s ILE 106 Ca 0.05 -0.78 -0.26 0.00 -1.10 0.00 0.00 60.65 58.55 2k7s s ILE 106 Cb -0.15 -4.46 0.03 0.00 -1.06 0.00 0.00 42.46 36.82 2k7s s ILE 106 CO -0.01 -1.07 1.01 -0.63 -0.10 0.00 0.00 174.94 174.14 2k7s s ILE 107 N 2.82 4.33 -0.18 2.92 1.01 -0.64 -1.78 121.20 129.68 2k7s s ILE 107 Ca 0.14 0.78 -0.07 0.00 0.00 0.00 0.00 60.65 61.50 2k7s s ILE 107 Cb -0.22 -4.54 -0.04 0.00 0.01 0.00 0.00 42.46 37.68 2k7s s ILE 107 CO 0.08 -1.01 0.04 0.00 0.00 0.00 0.00 174.94 174.06 2k7s s THR 109 N 0.45 2.42 -1.56 0.00 -4.23 0.32 -0.59 115.64 112.45 2k7s s THR 109 Ca 0.02 0.39 0.17 0.00 -1.18 0.00 0.00 61.69 61.09 2k7s s THR 109 Cb -0.13 -3.25 0.57 0.00 1.34 0.00 0.00 72.50 71.03 2k7s s THR 109 CO 0.01 0.08 1.46 -3.20 -0.54 0.00 0.00 174.62 172.43 2k7s n ASN 110 N 1.26 3.65 -4.27 3.99 2.85 0.01 -4.78 115.26 117.99 2k7s n ASN 110 Ca 0.03 -2.20 -0.44 0.00 -0.11 0.00 0.00 54.58 51.86 2k7s n ASN 110 Cb 0.40 -0.47 -0.06 0.00 1.24 0.00 0.00 39.78 40.89 2k7s n ASN 110 CO 0.00 0.00 0.00 0.42 -2.11 0.00 0.00 177.26 175.57 2k7s s THR 111 N -1.53 4.84 0.00 -0.44 -4.23 -1.26 -4.94 115.64 108.08 2k7s s THR 111 Ca 0.41 -1.80 0.00 0.00 -1.18 0.00 0.00 61.69 59.12 2k7s s THR 111 Cb 0.24 -4.11 0.00 0.00 1.34 0.00 0.00 72.50 69.97 2k7s s THR 111 CO 0.23 -0.86 0.00 -0.46 -0.54 0.00 0.00 174.62 173.00 2k7s n ASN 112 N 4.88 2.08 -2.84 3.99 2.04 -1.26 -4.31 115.26 119.84 2k7s n ASN 112 Ca -0.07 0.00 -0.00 0.00 -0.44 0.00 0.00 54.58 54.07 2k7s n ASN 112 Cb 0.41 0.00 -0.00 0.00 -2.53 0.00 0.00 39.78 37.66 2k7s n ASN 112 CO 0.00 0.00 0.00 1.33 -0.44 0.00 0.00 177.26 178.15 2k7s n VAL 113 N 0.00 -1.24 0.00 3.53 0.24 -1.26 -3.46 118.33 116.14 2k7s n VAL 113 Ca 0.00 0.11 0.00 0.00 -2.04 0.00 0.00 64.34 62.41 2k7s n VAL 113 Cb 0.00 -2.44 0.00 0.00 -1.47 0.00 0.00 33.84 29.93 2k7s n VAL 113 CO 0.00 0.00 0.00 1.17 -2.14 0.00 0.00 176.83 175.86 2k7s n LYS 114 N 2.40 0.00 -1.59 7.34 4.81 -1.26 -4.82 118.16 125.05 2k7s n LYS 114 Ca -0.01 0.00 -0.44 0.00 -0.87 0.00 0.00 58.31 56.99 2k7s n LYS 114 Cb 0.02 0.00 -0.04 0.00 0.02 0.00 0.00 35.03 35.03 2k7s n LYS 114 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 2k7s n ASN 115 N 2.22 3.22 -4.57 3.14 4.13 -1.22 -4.84 115.26 117.33 2k7s n ASN 115 Ca 0.00 0.33 -0.27 0.00 1.68 0.00 0.00 54.58 56.32 2k7s n ASN 115 Cb 0.00 -1.51 -0.06 0.00 -1.54 0.00 0.00 39.78 36.68 2k7s n ASN 115 CO 0.00 0.00 0.00 -0.55 0.28 0.00 0.00 177.26 176.99 2k7s s SER 116 N 7.62 5.06 0.07 6.41 0.15 -1.26 -4.24 113.70 127.52 2k7s s SER 116 Ca 1.00 -1.24 0.07 0.00 0.70 0.00 0.00 55.95 56.49 2k7s s SER 116 Cb -0.43 -2.58 -0.03 0.00 -1.71 0.00 0.00 66.02 61.27 2k7s s SER 116 CO 0.38 -2.95 -0.20 -0.55 1.20 0.00 0.00 173.24 171.12 2k7s s SER 117 N 7.17 2.41 -0.11 5.45 0.15 -1.26 -5.08 113.70 122.43 2k7s s SER 117 Ca 0.69 -0.60 -0.29 0.00 0.70 0.00 0.00 55.95 56.45 2k7s s SER 117 Cb -0.03 -0.16 0.07 0.00 -1.71 0.00 0.00 66.02 64.19 2k7s s SER 117 CO 0.07 0.09 0.69 0.00 1.20 0.00 0.00 173.24 175.30 2k7s s GLN 118 N -1.55 1.00 0.00 5.44 1.03 -1.26 -4.31 119.66 120.00 2k7s s GLN 118 Ca 0.06 0.46 0.00 0.00 0.04 0.00 0.00 55.36 55.93 2k7s s GLN 118 Cb -0.09 0.47 0.00 0.00 0.03 0.00 0.00 33.01 33.42 2k7s s GLN 118 CO 0.03 -0.27 0.00 -1.91 -2.54 0.00 0.00 175.29 170.60