#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 -0.57 -2.79 4.61 0.00 -1.26 -4.97 120.51 115.54 2k7s n ALA 2 Ca 0.00 0.19 -0.26 0.00 0.00 0.00 0.00 53.44 53.37 2k7s n ALA 2 Cb 0.00 -2.01 -0.06 0.00 0.00 0.00 0.00 19.45 17.38 2k7s n ALA 2 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 2k7s s MET 3 N -4.70 2.86 0.00 0.00 1.00 -1.26 -5.01 119.30 112.20 2k7s s MET 3 Ca 0.00 -0.88 0.00 0.00 0.00 0.00 0.00 55.69 54.81 2k7s s MET 3 Cb 0.00 -2.63 0.00 0.00 0.00 0.00 0.00 34.83 32.20 2k7s s MET 3 CO 0.00 0.48 0.00 -0.25 0.00 0.00 0.00 175.02 175.25 2k7s n ASP 4 N -0.31 0.00 -1.45 3.03 9.92 -1.26 -5.16 116.55 121.32 2k7s n ASP 4 Ca -0.08 0.00 0.19 0.00 -0.53 0.00 0.00 54.79 54.37 2k7s n ASP 4 Cb 0.55 0.00 -0.06 0.00 -0.64 0.00 0.00 41.12 40.97 2k7s n ASP 4 CO 0.00 0.00 0.00 0.59 0.13 0.00 0.00 177.20 177.92 2k7s n ASN 5 N -0.81 -8.62 -4.63 -2.24 3.02 -1.26 -4.93 115.26 95.79 2k7s n ASN 5 Ca 0.00 0.85 -0.26 0.00 -0.03 0.00 0.00 54.58 55.15 2k7s n ASN 5 Cb 0.00 -4.57 -0.08 0.00 -0.61 0.00 0.00 39.78 34.52 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 -2.88 3.50 0.00 2.41 0.11 -1.26 -5.08 120.40 117.19 2k7s s VAL 6 Ca 0.00 -1.60 0.00 0.00 -2.93 0.00 0.00 61.98 57.45 2k7s s VAL 6 Cb 0.00 -2.77 0.00 0.00 -1.53 0.00 0.00 36.38 32.08 2k7s s VAL 6 CO 0.00 -0.16 0.59 0.00 -3.33 0.00 0.00 175.10 172.20 2k7s s GLN 8 N -1.36 2.16 0.00 0.00 -0.21 -1.26 -4.81 119.66 114.18 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 -2.32 0.00 0.00 1.00 0.00 0.00 33.01 31.69 2k7s s GLN 8 CO 0.00 0.51 0.00 -0.35 -2.12 0.00 0.00 175.29 173.33 2k7s n PRO 9 N 0.72 2.80 0.00 2.91 -0.04 -1.26 -5.00 135.00 135.13 2k7s n PRO 9 Ca -0.13 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.33 2k7s n PRO 9 Cb 0.52 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.98 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 -4.92 114.28 110.63 2k7s n THR 10 Ca 0.00 0.00 -0.05 0.00 -3.05 0.00 0.00 64.05 60.95 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 0.42 -0.11 1.09 -1.05 -1.26 -0.66 118.70 117.13 2k7s s GLU 11 Ca 0.00 0.62 0.03 0.00 -0.15 0.00 0.00 54.97 55.48 2k7s s GLU 11 Cb 0.00 0.14 0.00 0.00 -0.44 0.00 0.00 34.13 33.83 2k7s s GLU 11 CO 0.00 -0.07 -0.22 -0.59 0.95 0.00 0.00 175.26 175.33 2k7s s PHE 12 N 0.90 2.47 -0.58 4.83 -0.12 0.29 -4.92 117.98 120.85 2k7s s PHE 12 Ca -0.04 -1.09 -0.28 0.00 -0.05 0.00 0.00 56.93 55.48 2k7s s PHE 12 Cb -0.04 -1.67 0.03 0.00 -0.63 0.00 0.00 43.02 40.71 2k7s s PHE 12 CO -0.12 -0.47 1.16 0.42 -0.05 0.00 0.00 175.22 176.16 2k7s s ILE 13 N 0.54 4.06 -0.14 -4.49 1.01 -1.26 -1.66 121.20 119.26 2k7s s ILE 13 Ca -0.15 0.78 0.01 0.00 0.00 0.00 0.00 60.65 61.29 2k7s s ILE 13 Cb -0.17 -4.71 -0.00 0.00 0.01 0.00 0.00 42.46 37.59 2k7s s ILE 13 CO 0.05 -1.34 -0.17 -0.55 0.00 0.00 0.00 174.94 172.94 2k7s s SER 14 N 2.98 3.59 0.29 3.58 0.15 -0.53 -0.34 113.70 123.42 2k7s s SER 14 Ca 0.41 -0.47 -0.02 0.00 0.70 0.00 0.00 55.95 56.57 2k7s s SER 14 Cb -0.08 -1.54 -0.04 0.00 -1.71 0.00 0.00 66.02 62.65 2k7s s SER 14 CO 0.24 0.11 0.51 -0.13 1.20 0.00 0.00 173.24 175.17 2k7s s ARG 15 N 0.67 3.55 0.15 5.44 0.52 0.11 -1.26 118.95 128.12 2k7s s ARG 15 Ca -0.08 -0.21 -0.24 0.00 -0.52 0.00 0.00 55.73 54.67 2k7s s ARG 15 Cb -0.16 -2.70 0.08 0.00 0.52 0.00 0.00 34.95 32.69 2k7s s ARG 15 CO 0.02 0.23 1.03 -3.38 0.02 0.00 0.00 175.30 173.23 2k7s s HIS 16 N -2.12 -0.03 0.78 -0.53 -3.43 -0.86 0.02 115.29 109.11 2k7s s HIS 16 Ca 0.41 -0.29 -0.06 0.00 -0.80 0.00 0.00 55.06 54.32 2k7s s HIS 16 Cb -0.10 0.66 0.13 0.00 -1.43 0.00 0.00 32.58 31.83 2k7s s HIS 16 CO 0.32 -0.80 1.08 0.54 -2.00 0.00 0.00 174.74 173.87 2k7s s ASN 17 N -3.16 4.13 0.35 7.38 2.20 -0.64 -0.97 114.94 124.23 2k7s s ASN 17 Ca 0.17 -0.05 0.10 0.00 -0.94 0.00 0.00 52.86 52.14 2k7s s ASN 17 Cb -0.01 -0.31 0.86 0.00 -2.00 0.00 0.00 41.25 39.80 2k7s s ASN 17 CO 0.03 -2.02 1.82 -0.29 -2.94 0.00 0.00 177.10 173.70 2k7s h ILE 18 N -0.81 0.73 -0.50 0.54 6.09 -1.92 0.47 117.51 122.10 2k7s h ILE 18 Ca -0.40 -0.22 0.04 0.00 -1.37 0.00 0.00 64.86 62.91 2k7s h ILE 18 Cb 1.27 0.03 -0.03 0.00 0.47 0.00 0.00 36.82 38.56 2k7s h ILE 18 CO 0.43 0.12 0.33 -0.33 -3.07 0.00 0.00 178.15 175.63 2k7s h GLU 19 N 0.64 0.50 0.00 2.19 4.39 -1.97 -3.45 114.58 116.88 2k7s h GLU 19 Ca 0.51 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 60.18 2k7s h GLU 19 Cb 0.95 -0.11 0.00 0.00 -0.10 0.00 0.00 28.75 29.48 2k7s h GLU 19 CO -0.27 0.33 0.00 0.41 -1.16 0.00 0.00 179.01 178.32 2k7s n GLY 20 N -1.49 1.05 3.65 -3.84 0.00 0.16 -4.68 105.19 100.06 2k7s n GLY 20 Ca 0.06 0.00 -0.48 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 -0.54 0.54 -1.74 -0.61 2.08 -1.26 -1.04 119.36 116.79 2k7s n ILE 21 Ca 0.00 -0.15 -0.42 0.00 0.56 0.00 0.00 62.75 62.75 2k7s n ILE 21 Cb 0.00 -1.93 -0.03 0.00 -0.75 0.00 0.00 39.64 36.93 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 4.75 1.37 -2.01 1.39 0.08 0.02 -1.63 117.98 121.96 2k7s s PHE 22 Ca 0.95 0.75 0.28 0.00 0.12 0.00 0.00 56.93 59.03 2k7s s PHE 22 Cb -0.67 -3.94 1.09 0.00 -0.57 0.00 0.00 43.02 38.93 2k7s s PHE 22 CO 0.50 -3.37 1.77 0.25 -0.10 0.00 0.00 175.22 174.26 2k7s n THR 23 N 7.67 0.00 -3.61 0.64 -2.24 0.10 -0.37 114.28 116.47 2k7s n THR 23 Ca 0.28 -0.14 -0.06 0.00 -2.27 0.00 0.00 64.05 61.86 2k7s n THR 23 Cb 0.48 0.22 -0.04 0.00 -2.10 0.00 0.00 70.33 68.88 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 -2.27 -0.20 -0.13 4.78 5.36 -0.88 -4.91 117.98 119.73 2k7s s PHE 24 Ca 0.32 0.33 -0.06 0.00 -0.96 0.00 0.00 56.93 56.57 2k7s s PHE 24 Cb 0.20 0.48 0.06 0.00 -0.34 0.00 0.00 43.02 43.41 2k7s s PHE 24 CO 0.43 -0.20 0.30 0.08 -1.46 0.00 0.00 175.22 174.37 2k7s s VAL 25 N -1.17 -0.16 0.22 3.12 1.01 -1.26 0.08 120.40 122.24 2k7s s VAL 25 Ca 0.04 0.17 -0.30 0.00 0.00 0.00 0.00 61.98 61.89 2k7s s VAL 25 Cb -0.01 -0.46 -0.09 0.00 0.00 0.00 0.00 36.38 35.82 2k7s s VAL 25 CO -0.03 0.07 1.23 -0.62 0.00 0.00 0.00 175.10 175.74 2k7s s ASP 26 N 1.64 7.02 0.19 3.32 2.15 0.54 -4.63 116.67 126.90 2k7s s ASP 26 Ca -0.06 2.33 0.08 0.00 0.43 0.00 0.00 52.55 55.33 2k7s s ASP 26 Cb -0.10 -2.61 0.43 0.00 -0.30 0.00 0.00 42.92 40.33 2k7s s ASP 26 CO -0.10 -0.40 1.11 0.00 -0.17 0.00 0.00 175.17 175.61 2k7s n HIS 27 N 2.18 0.27 0.23 -5.34 1.44 -1.26 -0.49 115.22 112.25 2k7s n HIS 27 Ca 0.04 0.14 0.10 0.00 -2.01 0.00 0.00 57.72 55.99 2k7s n HIS 27 Cb 0.44 -0.54 0.53 0.00 0.12 0.00 0.00 29.99 30.54 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 -0.64 -1.40 3.08 -1.91 -3.10 114.38 110.42 2k7s h ARG 28 Ca 0.00 0.00 0.18 0.00 0.07 0.00 0.00 59.98 60.23 2k7s h ARG 28 Cb 0.48 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.51 2k7s h ARG 28 CO 0.00 0.22 0.60 0.00 -1.07 0.00 0.00 179.97 179.72 2k7s h VAL 30 N 0.00 1.51 0.00 0.00 -1.51 -1.43 0.28 116.25 115.09 2k7s h VAL 30 Ca 0.30 -2.67 -0.17 0.00 -1.23 0.00 0.00 66.70 62.94 2k7s h VAL 30 Cb 1.50 2.49 -0.02 0.00 -2.13 0.00 0.00 31.29 33.13 2k7s h VAL 30 CO -0.00 0.78 -0.84 0.00 -1.23 0.00 0.00 177.57 176.27 2k7s h ALA 31 N 0.97 0.51 0.00 5.19 0.00 -0.98 -0.42 119.26 124.54 2k7s h ALA 31 Ca -0.04 -0.74 -0.00 0.00 0.00 0.00 0.00 54.91 54.12 2k7s h ALA 31 Cb 1.52 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 19.23 2k7s h ALA 31 CO 0.13 1.00 -0.02 1.15 0.00 0.00 0.00 179.25 181.51 2k7s h THR 32 N 0.00 0.17 -0.10 0.00 2.02 -0.89 -3.40 112.91 110.71 2k7s h THR 32 Ca -0.03 -1.13 0.00 0.00 0.77 0.00 0.00 66.41 66.03 2k7s h THR 32 Cb 1.62 0.31 0.00 0.00 -1.74 0.00 0.00 68.15 68.34 2k7s h THR 32 CO 0.10 0.06 0.00 1.33 0.37 0.00 0.00 175.52 177.37 2k7s n VAL 33 N -4.76 1.00 0.00 3.16 0.24 0.91 -4.67 118.33 114.21 2k7s n VAL 33 Ca -0.01 -1.00 0.00 0.00 -2.04 0.00 0.00 64.34 61.29 2k7s n VAL 33 Cb 0.05 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 -0.20 2.09 3.64 7.63 0.00 -0.17 0.48 105.19 118.66 2k7s n GLY 34 Ca 0.03 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 -0.07 2.57 0.88 1.61 2.02 -1.21 -4.56 117.35 118.58 2k7s s TYR 35 Ca 0.00 0.80 -0.12 0.00 -0.37 0.00 0.00 57.07 57.38 2k7s s TYR 35 Cb 0.00 -3.81 0.09 0.00 -0.40 0.00 0.00 41.96 37.83 2k7s s TYR 35 CO 0.00 -2.09 0.93 1.04 -1.57 0.00 0.00 175.55 173.86 2k7s n GLN 36 N 7.18 -0.17 -0.34 -0.62 6.02 -1.26 -2.76 117.38 125.43 2k7s n GLN 36 Ca 0.15 0.02 0.16 0.00 -0.01 0.00 0.00 57.00 57.33 2k7s n GLN 36 Cb 0.46 -2.22 0.37 0.00 1.02 0.00 0.00 30.24 29.86 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 -1.40 0.59 0.00 -1.09 0.11 -1.82 0.75 132.00 129.15 2k7s h PRO 37 Ca -0.44 -0.04 -0.11 0.00 0.11 0.00 0.00 66.00 65.53 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 0.41 0.39 -0.51 -0.56 -0.21 0.00 0.00 178.00 177.52 2k7s h GLN 38 N 0.61 0.00 0.00 1.05 3.07 -1.89 0.30 115.11 118.25 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 1.15 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.71 2k7s h GLN 38 CO -0.46 0.51 0.00 0.39 0.09 0.00 0.00 178.83 179.36 2k7s n GLU 39 N -3.72 0.03 -0.03 0.06 1.02 0.26 -3.04 120.64 115.22 2k7s n GLU 39 Ca -0.01 0.25 -0.03 0.00 -0.02 0.00 0.00 57.16 57.35 2k7s n GLU 39 Cb 0.56 -1.50 -0.03 0.00 -0.02 0.00 0.00 31.44 30.45 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 -1.47 2.41 -4.63 -4.62 7.99 -0.84 -4.82 117.00 111.03 2k7s n LEU 40 Ca 0.04 -0.02 -0.49 0.00 -0.01 0.00 0.00 56.01 55.53 2k7s n LEU 40 Cb 0.15 -0.13 -0.05 0.00 -0.11 0.00 0.00 43.42 43.28 2k7s n LEU 40 CO 0.12 0.49 1.02 0.18 -1.51 0.00 0.00 177.39 177.69 2k7s n LEU 41 N -2.55 2.31 0.00 2.23 4.77 1.00 -0.36 117.00 124.39 2k7s n LEU 41 Ca -0.09 1.11 0.00 0.00 -0.03 0.00 0.00 56.01 57.00 2k7s n LEU 41 Cb 0.61 -1.30 0.00 0.00 -2.33 0.00 0.00 43.42 40.39 2k7s n LEU 41 CO 0.06 -0.72 0.00 0.61 -1.33 0.00 0.00 177.39 176.01 2k7s n GLY 42 N 2.83 1.53 3.79 -0.72 0.00 0.50 -4.91 105.19 108.21 2k7s n GLY 42 Ca 0.17 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.84 2k7s n GLY 42 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k7s s LYS 43 N -0.23 3.18 -0.14 1.61 1.02 0.52 -4.71 119.74 120.98 2k7s s LYS 43 Ca 0.00 -0.34 -0.29 0.00 0.02 0.00 0.00 55.97 55.36 2k7s s LYS 43 Cb 0.00 -2.95 -0.04 0.00 -0.52 0.00 0.00 37.83 34.32 2k7s s LYS 43 CO 0.00 0.71 1.60 1.21 -0.92 0.00 0.00 175.35 177.95 2k7s s ASN 44 N -1.23 6.55 0.30 2.83 3.84 -1.26 -0.80 114.94 125.18 2k7s s ASN 44 Ca 0.17 1.89 0.06 0.00 0.21 0.00 0.00 52.86 55.20 2k7s s ASN 44 Cb -0.12 -2.53 0.78 0.00 -0.55 0.00 0.00 41.25 38.83 2k7s s ASN 44 CO 0.07 -1.07 1.72 -0.29 -2.79 0.00 0.00 177.10 174.74 2k7s h ILE 45 N 5.84 0.54 0.00 -5.21 2.10 -1.36 0.24 117.51 119.66 2k7s h ILE 45 Ca -0.35 -0.18 -0.09 0.00 1.08 0.00 0.00 64.86 65.32 2k7s h ILE 45 Cb 1.16 -0.03 -0.01 0.00 -1.09 0.00 0.00 36.82 36.84 2k7s h ILE 45 CO 0.98 0.10 -0.41 -0.37 -1.08 0.00 0.00 178.15 177.37 2k7s h VAL 46 N 0.52 1.08 -0.74 2.19 -1.51 -1.83 -2.48 116.25 113.49 2k7s h VAL 46 Ca 0.59 -1.50 0.21 0.00 -1.23 0.00 0.00 66.70 64.78 2k7s h VAL 46 Cb 1.09 1.86 -0.03 0.00 -2.13 0.00 0.00 31.29 32.08 2k7s h VAL 46 CO -0.48 0.40 0.54 -0.33 -1.23 0.00 0.00 177.57 176.47 2k7s h GLU 47 N 0.00 0.00 0.07 5.19 5.08 -0.89 0.40 114.58 124.43 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 0.83 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.05 2k7s h GLU 47 CO 0.05 0.00 -1.72 0.74 -1.00 0.00 0.00 179.01 177.08 2k7s h PHE 48 N 0.00 0.27 -3.71 4.33 -1.00 -1.48 -3.47 116.94 111.88 2k7s h PHE 48 Ca 0.35 -0.20 -0.55 0.00 2.81 0.00 0.00 57.97 60.39 2k7s h PHE 48 Cb 1.43 -0.01 0.11 0.00 3.61 0.00 0.00 35.95 41.09 2k7s h PHE 48 CO 0.00 1.34 0.68 0.00 -1.61 0.00 0.00 178.31 178.72 2k7s n HIS 50 N 0.37 2.10 -0.18 0.00 -0.00 0.67 -4.61 115.22 113.57 2k7s n HIS 50 Ca 0.03 0.47 -0.08 0.00 0.46 0.00 0.00 57.72 58.59 2k7s n HIS 50 Cb 0.38 -2.44 -0.03 0.00 -0.12 0.00 0.00 29.99 27.78 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 3.95 -0.23 0.00 1.57 0.11 -1.90 0.41 132.00 135.91 2k7s h PRO 51 Ca -0.45 0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.68 2k7s h PRO 51 Cb 1.28 0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.44 2k7s h PRO 51 CO 0.74 -0.15 0.04 0.93 -0.21 0.00 0.00 178.00 179.35 2k7s h GLU 52 N -0.24 0.00 0.00 1.05 4.39 -2.00 -1.11 114.58 116.68 2k7s h GLU 52 Ca 0.18 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.88 2k7s h GLU 52 Cb 0.56 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.21 2k7s h GLU 52 CO -0.66 0.00 -1.22 -0.25 -1.16 0.00 0.00 179.01 175.72 2k7s n ASP 53 N -2.58 1.05 -0.17 1.42 9.92 0.10 -4.47 116.55 121.83 2k7s n ASP 53 Ca -0.02 -0.43 0.01 0.00 -0.53 0.00 0.00 54.79 53.82 2k7s n ASP 53 Cb 0.09 1.36 0.28 0.00 -0.64 0.00 0.00 41.12 42.21 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 0.90 0.00 -1.24 4.20 0.92 0.78 115.11 120.67 2k7s h GLN 54 Ca 0.00 -0.05 -0.00 0.00 0.06 0.00 0.00 58.65 58.65 2k7s h GLN 54 Cb 0.54 -0.20 -0.00 0.00 0.30 0.00 0.00 27.48 28.12 2k7s h GLN 54 CO 0.00 0.59 -0.02 0.37 -0.67 0.00 0.00 178.83 179.10 2k7s h GLN 55 N 0.92 0.00 0.20 1.46 5.75 -1.78 0.18 115.11 121.84 2k7s h GLN 55 Ca 0.25 0.00 -0.32 0.00 -0.15 0.00 0.00 58.65 58.43 2k7s h GLN 55 Cb -0.11 0.00 0.02 0.00 1.07 0.00 0.00 27.48 28.47 2k7s h GLN 55 CO -0.05 0.02 -1.42 1.25 -2.65 0.00 0.00 178.83 175.97 2k7s h LEU 56 N 0.00 0.67 0.75 -2.39 5.85 -1.17 -1.98 115.31 117.04 2k7s h LEU 56 Ca -0.00 -0.74 -0.04 0.00 0.84 0.00 0.00 57.88 57.94 2k7s h LEU 56 Cb 0.04 -0.22 0.01 0.00 0.37 0.00 0.00 40.66 40.86 2k7s h LEU 56 CO 0.00 1.59 -0.36 0.25 -0.34 0.00 0.00 178.44 179.58 2k7s h LEU 57 N 0.12 -0.86 -0.66 2.25 6.46 -0.11 -2.05 115.31 120.45 2k7s h LEU 57 Ca -0.22 0.02 0.13 0.00 -0.12 0.00 0.00 57.88 57.69 2k7s h LEU 57 Cb 2.10 0.22 -0.10 0.00 -0.73 0.00 0.00 40.66 42.15 2k7s h LEU 57 CO 0.24 -0.50 0.15 0.03 -0.62 0.00 0.00 178.44 177.74 2k7s h ARG 58 N -1.22 0.27 -0.55 1.25 3.08 -0.83 -0.58 114.38 115.80 2k7s h ARG 58 Ca -0.10 -0.02 0.11 0.00 0.07 0.00 0.00 59.98 60.04 2k7s h ARG 58 Cb 0.79 -0.06 -0.09 0.00 0.08 0.00 0.00 29.97 30.69 2k7s h ARG 58 CO 0.17 0.18 0.02 0.22 -1.07 0.00 0.00 179.97 179.49 2k7s h ASP 59 N 0.27 -0.19 0.14 7.04 3.58 -1.25 0.20 116.42 126.21 2k7s h ASP 59 Ca 0.36 0.13 0.02 0.00 0.42 0.00 0.00 57.03 57.95 2k7s h ASP 59 Cb 0.57 0.22 -0.04 0.00 1.72 0.00 0.00 39.33 41.79 2k7s h ASP 59 CO -0.45 -0.07 -0.36 -1.28 -2.88 0.00 0.00 179.24 174.20 2k7s h SER 60 N 0.14 -1.04 -0.73 2.28 0.87 -0.38 0.10 113.55 114.80 2k7s h SER 60 Ca 0.28 0.12 0.14 0.00 -1.23 0.00 0.00 61.79 61.10 2k7s h SER 60 Cb 0.43 0.39 -0.05 0.00 -0.44 0.00 0.00 62.40 62.74 2k7s h SER 60 CO -0.45 -0.45 0.49 -0.26 -0.53 0.00 0.00 176.83 175.63 2k7s h PHE 61 N -0.60 0.44 -0.03 2.24 0.04 -0.64 0.35 116.94 118.74 2k7s h PHE 61 Ca 0.02 0.01 -0.11 0.00 2.80 0.00 0.00 57.97 60.69 2k7s h PHE 61 Cb 0.62 -0.14 -0.01 0.00 2.20 0.00 0.00 35.95 38.62 2k7s h PHE 61 CO -0.31 0.17 -0.51 1.96 -0.60 0.00 0.00 178.31 179.03 2k7s h GLN 62 N 0.38 0.09 0.19 1.51 1.08 0.65 -2.19 115.11 116.82 2k7s h GLN 62 Ca 0.35 -0.05 -0.27 0.00 -1.45 0.00 0.00 58.65 57.24 2k7s h GLN 62 Cb 0.84 0.00 0.03 0.00 -0.05 0.00 0.00 27.48 28.30 2k7s h GLN 62 CO -0.11 0.58 -1.16 1.96 -0.95 0.00 0.00 178.83 179.15 2k7s h GLN 63 N 0.07 0.45 -0.40 1.46 1.08 0.15 -1.52 115.11 116.40 2k7s h GLN 63 Ca -0.00 -0.74 -0.06 0.00 -1.45 0.00 0.00 58.65 56.40 2k7s h GLN 63 Cb 0.92 0.27 -0.02 0.00 -0.05 0.00 0.00 27.48 28.61 2k7s h GLN 63 CO 0.07 1.35 -0.01 -0.39 -0.95 0.00 0.00 178.83 178.90 2k7s h VAL 64 N -0.06 1.22 0.00 -0.54 -1.51 -0.99 0.50 116.25 114.88 2k7s h VAL 64 Ca -0.20 -0.91 -0.20 0.00 -1.23 0.00 0.00 66.70 64.16 2k7s h VAL 64 Cb 1.90 0.93 -0.03 0.00 -2.13 0.00 0.00 31.29 31.96 2k7s h VAL 64 CO 0.22 0.32 -0.96 1.62 -1.23 0.00 0.00 177.57 177.54 2k7s h VAL 65 N 0.62 1.69 -0.13 7.19 3.04 -1.47 0.14 116.25 127.33 2k7s h VAL 65 Ca 0.13 -3.29 -0.18 0.00 -1.01 0.00 0.00 66.70 62.35 2k7s h VAL 65 Cb 0.40 2.78 0.01 0.00 -2.01 0.00 0.00 31.29 32.46 2k7s h VAL 65 CO 0.02 0.94 -0.61 0.11 -1.01 0.00 0.00 177.57 177.02 2k7s h LYS 66 N 0.00 0.63 -0.13 4.17 1.57 -0.88 -3.10 116.57 118.82 2k7s h LYS 66 Ca -0.01 -0.51 0.00 0.00 -1.87 0.00 0.00 60.65 58.26 2k7s h LYS 66 Cb 1.70 0.11 0.00 0.00 0.08 0.00 0.00 32.23 34.11 2k7s h LYS 66 CO 0.12 1.13 0.00 1.28 -0.57 0.00 0.00 179.45 181.42 2k7s n LEU 67 N -4.12 2.01 -2.44 2.94 4.77 0.13 -5.00 117.00 115.29 2k7s n LEU 67 Ca -0.08 -0.78 -0.04 0.00 -0.03 0.00 0.00 56.01 55.09 2k7s n LEU 67 Cb 0.66 -0.08 0.00 0.00 -2.33 0.00 0.00 43.42 41.67 2k7s n LEU 67 CO 0.49 0.39 -0.33 0.29 -1.33 0.00 0.00 177.39 176.90 2k7s n LYS 68 N 0.55 -0.33 0.00 3.23 4.76 0.44 -3.66 118.16 123.16 2k7s n LYS 68 Ca 0.17 0.59 0.00 0.00 -2.87 0.00 0.00 58.31 56.21 2k7s n LYS 68 Cb 0.41 -0.77 0.00 0.00 -1.84 0.00 0.00 35.03 32.82 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 0.91 2.87 3.67 0.72 0.00 -0.88 -4.96 105.19 107.52 2k7s n GLY 69 Ca -0.01 -1.01 -0.46 0.00 0.00 0.00 0.00 46.02 44.54 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 2.22 -2.88 1.61 -0.06 -1.24 -4.38 117.38 112.64 2k7s n GLN 70 Ca 0.00 0.80 -0.36 0.00 -2.00 0.00 0.00 57.00 55.44 2k7s n GLN 70 Cb 0.00 -2.60 -0.06 0.00 -4.06 0.00 0.00 30.24 23.51 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 1.90 4.34 0.01 1.69 1.01 -1.26 -4.08 120.40 124.02 2k7s s VAL 71 Ca 0.83 1.61 0.06 0.00 0.00 0.00 0.00 61.98 64.48 2k7s s VAL 71 Cb -0.66 -3.91 -0.03 0.00 0.00 0.00 0.00 36.38 31.78 2k7s s VAL 71 CO 0.41 0.09 -0.18 -0.76 0.00 0.00 0.00 175.10 174.66 2k7s s LEU 72 N -2.20 2.57 -0.21 3.92 2.01 0.12 -4.95 118.68 119.94 2k7s s LEU 72 Ca 0.50 -0.38 0.01 0.00 0.01 0.00 0.00 54.13 54.27 2k7s s LEU 72 Cb -0.17 -1.51 0.05 0.00 0.01 0.00 0.00 46.19 44.58 2k7s s LEU 72 CO 0.21 0.28 -0.08 -0.55 1.01 0.00 0.00 176.35 177.22 2k7s s SER 73 N -1.19 3.61 -0.01 2.29 0.15 -1.24 -1.84 113.70 115.46 2k7s s SER 73 Ca 0.13 -1.02 0.01 0.00 0.70 0.00 0.00 55.95 55.78 2k7s s SER 73 Cb -0.10 -1.23 0.01 0.00 -1.71 0.00 0.00 66.02 62.98 2k7s s SER 73 CO 0.03 -0.18 -0.04 0.68 1.20 0.00 0.00 173.24 174.94 2k7s s VAL 74 N 1.38 0.36 -0.21 4.45 -7.23 -1.12 -4.93 120.40 113.11 2k7s s VAL 74 Ca -0.03 -0.14 -0.12 0.00 -1.81 0.00 0.00 61.98 59.88 2k7s s VAL 74 Cb -0.17 -0.34 -0.05 0.00 0.56 0.00 0.00 36.38 36.37 2k7s s VAL 74 CO -0.07 0.13 0.21 -0.04 -0.31 0.00 0.00 175.10 175.02 2k7s s MET 75 N 0.23 4.16 0.10 4.82 -1.94 -1.26 -0.56 119.30 124.85 2k7s s MET 75 Ca -0.02 -0.12 -0.01 0.00 -1.71 0.00 0.00 55.69 53.82 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 -0.00 0.15 0.04 -0.59 -0.01 0.00 0.00 175.02 174.61 2k7s s PHE 76 N 0.77 0.70 -0.47 -0.03 -0.71 -0.03 -4.94 117.98 113.27 2k7s s PHE 76 Ca 0.11 -1.14 -0.19 0.00 -1.04 0.00 0.00 56.93 54.67 2k7s s PHE 76 Cb -0.13 -0.42 0.04 0.00 -1.21 0.00 0.00 43.02 41.30 2k7s s PHE 76 CO 0.03 -0.48 0.58 1.03 -1.34 0.00 0.00 175.22 175.04 2k7s s ARG 77 N -3.99 3.14 -0.52 1.99 0.52 -1.26 -0.35 118.95 118.48 2k7s s ARG 77 Ca 0.17 -0.77 -0.21 0.00 -0.52 0.00 0.00 55.73 54.40 2k7s s ARG 77 Cb 0.07 -4.04 0.05 0.00 0.52 0.00 0.00 34.95 31.55 2k7s s ARG 77 CO -0.03 -1.10 0.75 0.12 0.02 0.00 0.00 175.30 175.06 2k7s s PHE 78 N 2.54 2.95 -0.39 -0.53 2.19 0.61 -0.23 117.98 125.12 2k7s s PHE 78 Ca 0.16 -0.29 -0.27 0.00 0.33 0.00 0.00 56.93 56.85 2k7s s PHE 78 Cb -0.18 -3.72 -0.04 0.00 -1.31 0.00 0.00 43.02 37.76 2k7s s PHE 78 CO 0.13 -1.14 2.12 0.50 1.83 0.00 0.00 175.22 178.67 2k7s s ARG 79 N 3.14 2.78 0.16 10.12 3.00 -0.75 -1.07 118.95 136.34 2k7s s ARG 79 Ca 0.22 1.48 -0.03 0.00 -1.00 0.00 0.00 55.73 56.40 2k7s s ARG 79 Cb -0.16 -4.40 0.04 0.00 0.00 0.00 0.00 34.95 30.43 2k7s s ARG 79 CO 0.15 -2.51 0.22 -1.13 0.00 0.00 0.00 175.30 172.03 2k7s n SER 80 N 12.82 0.04 0.27 -2.12 3.41 -0.75 -4.81 113.62 122.48 2k7s n SER 80 Ca 0.29 -1.09 0.14 0.00 -0.26 0.00 0.00 58.87 57.95 2k7s n SER 80 Cb 0.49 -0.16 0.74 0.00 -0.26 0.00 0.00 64.21 65.02 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 -0.02 4.33 1.63 -0.30 0.56 116.57 122.77 2k7s h LYS 81 Ca -0.07 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.73 2k7s h LYS 81 Cb 0.20 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 31.83 2k7s h LYS 81 CO 0.05 0.10 0.00 0.09 -3.45 0.00 0.00 179.45 176.24 2k7s n ASN 82 N -3.45 0.86 -2.92 4.20 5.03 -1.26 -4.91 115.26 112.80 2k7s n ASN 82 Ca -0.01 -1.32 -0.15 0.00 0.87 0.00 0.00 54.58 53.96 2k7s n ASN 82 Cb 0.26 -0.01 0.07 0.00 -1.02 0.00 0.00 39.78 39.08 2k7s n ASN 82 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2k7s n GLN 83 N -0.32 -5.62 -4.69 3.52 6.02 0.19 -5.03 117.38 111.46 2k7s n GLN 83 Ca 0.20 0.66 -0.23 0.00 -0.01 0.00 0.00 57.00 57.63 2k7s n GLN 83 Cb 0.24 -5.16 -0.15 0.00 1.02 0.00 0.00 30.24 26.19 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 -5.43 1.21 -1.07 -1.09 2.02 -1.26 -4.86 118.70 108.22 2k7s s GLU 84 Ca 0.17 -0.53 -0.23 0.00 0.02 0.00 0.00 54.97 54.39 2k7s s GLU 84 Cb -0.08 -1.17 -0.08 0.00 0.10 0.00 0.00 34.13 32.91 2k7s s GLU 84 CO 0.57 0.32 1.95 -1.58 0.02 0.00 0.00 175.26 176.54 2k7s s TRP 85 N -0.35 1.87 -0.55 1.61 0.23 -1.26 -1.80 118.94 118.69 2k7s s TRP 85 Ca 0.06 0.58 -0.28 0.00 -2.03 0.00 0.00 56.10 54.43 2k7s s TRP 85 Cb -0.06 -4.00 0.01 0.00 0.03 0.00 0.00 33.47 29.45 2k7s s TRP 85 CO -0.01 -1.40 1.49 -0.51 0.96 0.00 0.00 176.95 177.48 2k7s s LEU 86 N 10.84 3.40 0.10 2.99 1.43 -0.23 -4.63 118.68 132.56 2k7s s LEU 86 Ca 0.70 0.37 -0.31 0.00 -1.03 0.00 0.00 54.13 53.85 2k7s s LEU 86 Cb -0.03 -3.04 -0.09 0.00 0.03 0.00 0.00 46.19 43.06 2k7s s LEU 86 CO 0.08 -1.77 1.69 0.26 0.23 0.00 0.00 176.35 176.84 2k7s s TRP 87 N 6.41 2.42 0.10 0.29 0.52 -1.26 -0.28 118.94 127.14 2k7s s TRP 87 Ca 0.56 0.26 0.02 0.00 0.02 0.00 0.00 56.10 56.95 2k7s s TRP 87 Cb -0.12 -4.02 -0.04 0.00 -1.15 0.00 0.00 33.47 28.14 2k7s s TRP 87 CO 0.25 -4.10 -0.06 -1.64 0.02 0.00 0.00 176.95 171.42 2k7s s MET 88 N 2.50 0.85 -0.18 4.98 -1.94 0.53 -0.51 119.30 125.53 2k7s s MET 88 Ca 0.75 -1.34 0.00 0.00 -1.71 0.00 0.00 55.69 53.39 2k7s s MET 88 Cb -0.42 -0.21 0.01 0.00 2.01 0.00 0.00 34.83 36.22 2k7s s MET 88 CO 0.33 -0.02 -0.17 1.03 -0.01 0.00 0.00 175.02 176.18 2k7s s ARG 89 N -3.84 3.10 -0.04 2.03 0.52 0.48 -0.85 118.95 120.35 2k7s s ARG 89 Ca 0.12 -0.78 -0.12 0.00 -0.52 0.00 0.00 55.73 54.43 2k7s s ARG 89 Cb 0.05 -2.63 -0.05 0.00 0.52 0.00 0.00 34.95 32.84 2k7s s ARG 89 CO -0.04 -0.13 0.33 0.95 0.02 0.00 0.00 175.30 176.42 2k7s s THR 90 N 1.15 5.18 -0.78 0.02 -4.23 0.28 -0.99 115.64 116.27 2k7s s THR 90 Ca 0.01 0.64 0.03 0.00 -1.18 0.00 0.00 61.69 61.19 2k7s s THR 90 Cb -0.14 -3.62 0.27 0.00 1.34 0.00 0.00 72.50 70.35 2k7s s THR 90 CO -0.07 0.58 0.99 -1.20 -0.54 0.00 0.00 174.62 174.38 2k7s n SER 91 N 1.94 4.63 -4.66 3.99 7.64 -0.68 -2.79 113.62 123.69 2k7s n SER 91 Ca -0.16 -3.44 -0.42 0.00 1.01 0.00 0.00 58.87 55.86 2k7s n SER 91 Cb 0.53 -0.86 -0.03 0.00 -1.01 0.00 0.00 64.21 62.84 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 -2.26 7.04 -0.15 6.43 0.01 -0.77 -2.55 113.70 121.44 2k7s s SER 92 Ca 0.37 1.29 -0.22 0.00 1.31 0.00 0.00 55.95 58.70 2k7s s SER 92 Cb 0.12 -2.50 0.05 0.00 0.21 0.00 0.00 66.02 63.90 2k7s s SER 92 CO 0.03 -0.52 0.56 0.00 0.41 0.00 0.00 173.24 173.72 2k7s s GLN 93 N 2.61 0.75 -0.37 12.44 -2.07 -0.66 0.14 119.66 132.50 2k7s s GLN 93 Ca 0.42 0.55 -0.44 0.00 -1.82 0.00 0.00 55.36 54.07 2k7s s GLN 93 Cb -0.16 0.36 -0.18 0.00 -1.09 0.00 0.00 33.01 31.94 2k7s s GLN 93 CO 0.10 -0.15 1.62 0.25 -1.32 0.00 0.00 175.29 175.80 2k7s n THR 94 N 2.18 0.12 -0.78 3.63 -2.24 -1.26 0.17 114.28 116.10 2k7s n THR 94 Ca -0.16 -0.02 -0.34 0.00 -2.27 0.00 0.00 64.05 61.26 2k7s n THR 94 Cb 0.56 -0.77 0.13 0.00 -2.10 0.00 0.00 70.33 68.15 2k7s n THR 94 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2k7s n ALA 95 N 4.38 -4.45 -1.00 6.98 0.00 -1.16 -4.61 120.51 120.66 2k7s n ALA 95 Ca 0.28 -1.21 0.00 0.00 0.00 0.00 0.00 53.44 52.52 2k7s n ALA 95 Cb 0.03 -1.36 0.00 0.00 0.00 0.00 0.00 19.45 18.12 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 -0.72 0.00 -3.62 0.00 6.02 -1.26 -3.86 117.38 113.94 2k7s n GLN 96 Ca 0.01 0.00 -0.04 0.00 -0.01 0.00 0.00 57.00 56.95 2k7s n GLN 96 Cb 0.64 -0.43 -0.04 0.00 1.02 0.00 0.00 30.24 31.44 2k7s n GLN 96 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 2k7s s ASN 97 N -1.83 -0.13 0.00 1.08 2.20 -1.26 -3.38 114.94 111.61 2k7s s ASN 97 Ca 0.00 0.10 0.00 0.00 -0.94 0.00 0.00 52.86 52.02 2k7s s ASN 97 Cb 0.00 0.11 0.00 0.00 -2.00 0.00 0.00 41.25 39.36 2k7s s ASN 97 CO 0.00 -0.14 0.64 -0.81 -2.94 0.00 0.00 177.10 173.85 2k7s n PRO 98 N 0.40 0.92 -0.60 3.55 -0.04 -1.26 -4.85 135.00 133.12 2k7s n PRO 98 Ca -0.02 0.00 -0.12 0.00 -0.04 0.00 0.00 63.50 63.33 2k7s n PRO 98 Cb 0.58 -1.27 0.08 0.00 -0.04 0.00 0.00 33.50 32.86 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 -0.18 1.47 0.15 0.54 4.01 -1.26 -4.37 117.16 117.53 2k7s n TYR 99 Ca 0.00 -1.17 0.11 0.00 -0.16 0.00 0.00 57.90 56.68 2k7s n TYR 99 Cb 0.14 -0.60 0.62 0.00 -0.31 0.00 0.00 39.34 39.19 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 0.51 0.07 0.53 7.72 0.87 -1.66 0.56 113.55 122.14 2k7s h SER 100 Ca 0.31 -0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.86 2k7s h SER 100 Cb 1.87 -0.01 0.00 0.00 -0.44 0.00 0.00 62.40 63.81 2k7s h SER 100 CO 0.54 0.04 0.00 -0.67 -0.53 0.00 0.00 176.83 176.21 2k7s n ASP 101 N -4.49 0.00 -1.62 6.23 2.03 -1.26 -4.06 116.55 113.37 2k7s n ASP 101 Ca 0.01 0.13 0.00 0.00 0.52 0.00 0.00 54.79 55.46 2k7s n ASP 101 Cb 0.23 -0.35 0.00 0.00 -0.72 0.00 0.00 41.12 40.27 2k7s n ASP 101 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 2k7s n GLU 102 N -1.35 1.88 -3.40 -0.67 1.02 0.19 -4.80 120.64 113.52 2k7s n GLU 102 Ca 0.09 0.00 -0.13 0.00 -0.02 0.00 0.00 57.16 57.10 2k7s n GLU 102 Cb 0.20 0.00 -0.10 0.00 -0.02 0.00 0.00 31.44 31.53 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 0.90 -0.48 -0.53 -3.67 1.01 -0.14 -2.96 121.20 115.32 2k7s s ILE 103 Ca 0.00 -0.19 -0.28 0.00 0.00 0.00 0.00 60.65 60.17 2k7s s ILE 103 Cb 0.00 -0.83 0.02 0.00 0.01 0.00 0.00 42.46 41.67 2k7s s ILE 103 CO 0.00 -0.23 1.25 -0.70 0.00 0.00 0.00 174.94 175.25 2k7s s GLU 104 N 2.44 3.54 -0.27 2.79 2.12 0.13 -2.03 118.70 127.42 2k7s s GLU 104 Ca 0.10 0.46 -0.05 0.00 0.36 0.00 0.00 54.97 55.84 2k7s s GLU 104 Cb -0.15 -4.01 0.01 0.00 0.26 0.00 0.00 34.13 30.25 2k7s s GLU 104 CO -0.20 -1.63 0.03 0.99 -0.54 0.00 0.00 175.26 173.91 2k7s s THR 105 N 5.08 3.65 -0.56 -1.70 2.01 -0.39 -1.66 115.64 122.07 2k7s s THR 105 Ca 0.48 -0.74 -0.20 0.00 0.31 0.00 0.00 61.69 61.55 2k7s s THR 105 Cb -0.09 -2.85 0.08 0.00 0.01 0.00 0.00 72.50 69.65 2k7s s THR 105 CO 0.28 0.15 0.72 -0.63 -0.69 0.00 0.00 174.62 174.45 2k7s s ILE 106 N 1.46 4.75 -0.44 1.82 1.09 -1.06 -1.46 121.20 127.37 2k7s s ILE 106 Ca 0.02 -0.61 -0.27 0.00 -1.10 0.00 0.00 60.65 58.70 2k7s s ILE 106 Cb -0.17 -4.44 0.02 0.00 -1.06 0.00 0.00 42.46 36.82 2k7s s ILE 106 CO 0.00 -1.03 0.99 -0.63 -0.10 0.00 0.00 174.94 174.17 2k7s s ILE 107 N 2.93 4.43 -0.16 2.92 1.01 -0.66 -1.68 121.20 129.98 2k7s s ILE 107 Ca 0.16 1.02 -0.05 0.00 0.00 0.00 0.00 60.65 61.78 2k7s s ILE 107 Cb -0.20 -4.45 -0.03 0.00 0.01 0.00 0.00 42.46 37.78 2k7s s ILE 107 CO 0.10 -0.79 0.00 0.00 0.00 0.00 0.00 174.94 174.25 2k7s s THR 109 N 0.31 2.30 -0.15 0.00 -4.23 0.17 -0.38 115.64 113.65 2k7s s THR 109 Ca -0.01 0.29 -0.01 0.00 -1.18 0.00 0.00 61.69 60.78 2k7s s THR 109 Cb -0.13 -3.19 0.04 0.00 1.34 0.00 0.00 72.50 70.56 2k7s s THR 109 CO 0.02 0.06 -0.03 0.21 -0.54 0.00 0.00 174.62 174.34 2k7s s ASN 110 N -0.08 2.62 0.00 3.99 3.84 0.33 -4.85 114.94 120.80 2k7s s ASN 110 Ca 0.54 -0.58 0.00 0.00 0.21 0.00 0.00 52.86 53.03 2k7s s ASN 110 Cb -0.44 -0.80 0.00 0.00 -0.55 0.00 0.00 41.25 39.46 2k7s s ASN 110 CO 0.56 -0.20 0.00 0.35 -2.79 0.00 0.00 177.10 175.02 2k7s n THR 111 N 4.94 0.00 -2.86 -5.21 -2.24 -1.26 -4.49 114.28 103.16 2k7s n THR 111 Ca -0.11 0.00 -0.20 0.00 -2.27 0.00 0.00 64.05 61.47 2k7s n THR 111 Cb 0.48 0.00 0.08 0.00 -2.10 0.00 0.00 70.33 68.79 2k7s n THR 111 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 2k7s n ASN 112 N 0.29 1.72 -4.79 3.42 0.23 -1.26 -4.99 115.26 109.88 2k7s n ASN 112 Ca 0.00 -2.31 -0.29 0.00 -0.53 0.00 0.00 54.58 51.45 2k7s n ASN 112 Cb 0.00 -0.49 0.13 0.00 -2.08 0.00 0.00 39.78 37.35 2k7s n ASN 112 CO 0.00 0.00 0.00 -0.69 -0.93 0.00 0.00 177.26 175.64 2k7s s VAL 113 N -2.61 2.13 -0.28 3.53 1.01 -1.26 -4.70 120.40 118.22 2k7s s VAL 113 Ca 0.60 0.04 -0.06 0.00 0.00 0.00 0.00 61.98 62.57 2k7s s VAL 113 Cb -0.04 -2.79 0.01 0.00 0.00 0.00 0.00 36.38 33.56 2k7s s VAL 113 CO 0.39 -0.06 0.21 0.29 0.00 0.00 0.00 175.10 175.93 2k7s n LYS 114 N -3.73 -2.34 0.00 2.72 4.76 -1.26 -4.85 118.16 113.46 2k7s n LYS 114 Ca 0.07 2.06 0.00 0.00 -2.87 0.00 0.00 58.31 57.56 2k7s n LYS 114 Cb 0.59 -4.56 0.00 0.00 -1.84 0.00 0.00 35.03 29.22 2k7s n LYS 114 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 2k7s n ASN 115 N 0.15 -2.82 -2.65 4.39 4.13 -1.26 -4.99 115.26 112.22 2k7s n ASN 115 Ca 0.04 0.00 -0.05 0.00 1.68 0.00 0.00 54.58 56.26 2k7s n ASN 115 Cb 0.16 0.00 0.01 0.00 -1.54 0.00 0.00 39.78 38.40 2k7s n ASN 115 CO 0.00 0.00 0.00 -0.24 0.28 0.00 0.00 177.26 177.30 2k7s n SER 116 N -3.25 -7.28 -0.72 6.41 2.88 -1.26 -4.74 113.62 105.66 2k7s n SER 116 Ca 0.00 0.75 0.02 0.00 -1.33 0.00 0.00 58.87 58.31 2k7s n SER 116 Cb 0.00 -4.86 -0.00 0.00 -0.75 0.00 0.00 64.21 58.59 2k7s n SER 116 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 2k7s n SER 117 N -0.00 -4.33 -3.54 -3.46 7.64 -1.26 -4.42 113.62 104.25 2k7s n SER 117 Ca 0.07 0.15 -0.18 0.00 1.01 0.00 0.00 58.87 59.92 2k7s n SER 117 Cb 0.27 -0.44 0.01 0.00 -1.01 0.00 0.00 64.21 63.03 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 -1.60 -1.40 0.00 1.43 7.27 -1.26 -4.93 117.38 116.90 2k7s n GLN 118 Ca 0.00 0.96 0.00 0.00 0.07 0.00 0.00 57.00 58.03 2k7s n GLN 118 Cb 0.06 -3.68 0.00 0.00 2.41 0.00 0.00 30.24 29.03 2k7s n GLN 118 CO 0.00 0.00 0.00 -0.85 0.07 0.00 0.00 177.06 176.28