#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 0.94 -0.07 4.61 0.00 -1.26 -5.02 120.51 119.71 2k7s n ALA 2 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.33 2k7s n ALA 2 Cb 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.41 2k7s n ALA 2 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2k7s n MET 3 N -2.49 0.40 -3.27 0.00 3.85 -1.26 -5.07 117.12 109.28 2k7s n MET 3 Ca 0.00 0.16 -0.22 0.00 -1.00 0.00 0.00 57.70 56.64 2k7s n MET 3 Cb 0.00 -1.19 0.02 0.00 -1.05 0.00 0.00 33.22 31.00 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 -4.12 -6.51 0.30 3.17 9.92 -1.26 -4.93 116.55 113.12 2k7s n ASP 4 Ca -0.19 -0.02 -0.14 0.00 -0.53 0.00 0.00 54.79 53.91 2k7s n ASP 4 Cb 0.50 -3.35 -0.07 0.00 -0.64 0.00 0.00 41.12 37.55 2k7s n ASP 4 CO 0.00 0.00 0.00 0.78 0.13 0.00 0.00 177.20 178.11 2k7s h ASN 5 N 1.55 -0.66 -2.67 -2.24 2.35 -1.97 -3.46 115.58 108.47 2k7s h ASN 5 Ca -0.32 -0.03 -0.53 0.00 -0.55 0.00 0.00 56.30 54.87 2k7s h ASN 5 Cb 1.22 0.17 -0.14 0.00 0.05 0.00 0.00 38.32 39.63 2k7s h ASN 5 CO 0.25 -0.30 -0.67 0.68 -1.65 0.00 0.00 177.43 175.74 2k7s s VAL 6 N -4.74 1.76 0.00 2.81 -7.23 -1.26 -5.11 120.40 106.63 2k7s s VAL 6 Ca -0.14 -2.12 0.00 0.00 -1.81 0.00 0.00 61.98 57.90 2k7s s VAL 6 Cb 0.02 -2.55 0.00 0.00 0.56 0.00 0.00 36.38 34.40 2k7s s VAL 6 CO 0.47 -0.24 0.42 0.00 -0.31 0.00 0.00 175.10 175.45 2k7s s GLN 8 N -0.85 0.95 0.00 0.00 -0.21 -1.26 -5.01 119.66 113.28 2k7s s GLN 8 Ca 0.00 -1.14 0.00 0.00 0.02 0.00 0.00 55.36 54.24 2k7s s GLN 8 Cb 0.00 -0.85 0.00 0.00 1.00 0.00 0.00 33.01 33.16 2k7s s GLN 8 CO 0.00 0.17 0.00 -0.35 -2.12 0.00 0.00 175.29 172.99 2k7s n PRO 9 N 0.77 1.42 0.00 2.91 -0.04 -1.26 -5.01 135.00 133.79 2k7s n PRO 9 Ca -0.17 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.29 2k7s n PRO 9 Cb 0.56 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 -0.28 0.00 -3.64 0.52 5.66 -1.26 -4.80 114.28 110.48 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 -0.65 118.70 117.18 2k7s s GLU 11 Ca 0.00 0.63 0.03 0.00 -0.15 0.00 0.00 54.97 55.48 2k7s s GLU 11 Cb 0.00 0.17 0.01 0.00 -0.44 0.00 0.00 34.13 33.87 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 0.70 2.26 -0.58 4.83 -0.12 0.13 -4.90 117.98 120.31 2k7s s PHE 12 Ca -0.02 -1.00 -0.28 0.00 -0.05 0.00 0.00 56.93 55.59 2k7s s PHE 12 Cb -0.04 -1.56 0.03 0.00 -0.63 0.00 0.00 43.02 40.82 2k7s s PHE 12 CO -0.10 -0.45 1.17 0.42 -0.05 0.00 0.00 175.22 176.20 2k7s s ILE 13 N 0.64 4.06 -0.14 -4.49 1.01 -1.26 -1.74 121.20 119.27 2k7s s ILE 13 Ca -0.13 0.83 0.01 0.00 0.00 0.00 0.00 60.65 61.36 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 -1.32 -0.17 -0.55 0.00 0.00 0.00 174.94 172.94 2k7s s SER 14 N 2.95 3.59 0.32 3.58 0.15 -0.48 -0.45 113.70 123.36 2k7s s SER 14 Ca 0.42 -0.47 -0.01 0.00 0.70 0.00 0.00 55.95 56.58 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 0.25 0.10 0.53 -0.13 1.20 0.00 0.00 173.24 175.20 2k7s s ARG 15 N 0.69 3.52 0.13 5.44 0.52 0.11 -1.13 118.95 128.24 2k7s s ARG 15 Ca -0.08 -0.25 -0.24 0.00 -0.52 0.00 0.00 55.73 54.64 2k7s s ARG 15 Cb -0.16 -2.68 0.08 0.00 0.52 0.00 0.00 34.95 32.72 2k7s s ARG 15 CO 0.02 0.19 1.10 -3.38 0.02 0.00 0.00 175.30 173.24 2k7s s HIS 16 N -2.22 0.04 0.72 -0.53 -3.43 -0.85 0.07 115.29 109.08 2k7s s HIS 16 Ca 0.41 -0.35 -0.02 0.00 -0.80 0.00 0.00 55.06 54.30 2k7s s HIS 16 Cb -0.10 0.66 0.12 0.00 -1.43 0.00 0.00 32.58 31.83 2k7s s HIS 16 CO 0.34 -0.74 1.00 0.54 -2.00 0.00 0.00 174.74 173.88 2k7s s ASN 17 N -3.41 4.34 0.34 7.38 2.20 -0.59 -0.39 114.94 124.81 2k7s s ASN 17 Ca 0.22 -0.29 0.09 0.00 -0.94 0.00 0.00 52.86 51.94 2k7s s ASN 17 Cb -0.02 -0.10 0.82 0.00 -2.00 0.00 0.00 41.25 39.96 2k7s s ASN 17 CO 0.03 -1.87 1.81 -0.29 -2.94 0.00 0.00 177.10 173.85 2k7s h ILE 18 N -0.56 0.73 -0.46 0.54 6.09 -1.91 0.45 117.51 122.39 2k7s h ILE 18 Ca -0.37 -0.23 0.03 0.00 -1.37 0.00 0.00 64.86 62.91 2k7s h ILE 18 Cb 1.27 -0.02 -0.02 0.00 0.47 0.00 0.00 36.82 38.52 2k7s h ILE 18 CO 0.41 0.12 0.31 -0.33 -3.07 0.00 0.00 178.15 175.59 2k7s h GLU 19 N 0.68 0.49 0.00 2.19 4.39 -1.97 -3.46 114.58 116.91 2k7s h GLU 19 Ca 0.53 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 60.20 2k7s h GLU 19 Cb 0.93 -0.11 0.00 0.00 -0.10 0.00 0.00 28.75 29.47 2k7s h GLU 19 CO -0.30 0.33 0.00 0.41 -1.16 0.00 0.00 179.01 178.29 2k7s n GLY 20 N -1.49 1.05 3.62 -3.84 0.00 0.16 -4.68 105.19 100.01 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 -0.52 0.47 -1.65 -0.61 2.08 -1.26 -1.31 119.36 116.56 2k7s n ILE 21 Ca 0.00 -0.21 -0.43 0.00 0.56 0.00 0.00 62.75 62.67 2k7s n ILE 21 Cb 0.00 -2.00 -0.03 0.00 -0.75 0.00 0.00 39.64 36.86 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 5.65 1.22 -1.88 1.39 0.08 -0.15 -1.54 117.98 122.75 2k7s s PHE 22 Ca 0.98 0.62 0.27 0.00 0.12 0.00 0.00 56.93 58.92 2k7s s PHE 22 Cb -0.64 -3.93 0.96 0.00 -0.57 0.00 0.00 43.02 38.84 2k7s s PHE 22 CO 0.47 -3.87 1.69 0.25 -0.10 0.00 0.00 175.22 173.67 2k7s n THR 23 N 7.75 0.00 -3.61 0.64 -2.24 0.11 -0.36 114.28 116.57 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 0.46 0.27 -0.04 0.00 -2.10 0.00 0.00 70.33 68.92 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 -2.38 -0.20 -0.13 4.78 5.36 -0.90 -4.91 117.98 119.60 2k7s s PHE 24 Ca 0.29 0.33 -0.06 0.00 -0.96 0.00 0.00 56.93 56.53 2k7s s PHE 24 Cb 0.20 0.47 0.06 0.00 -0.34 0.00 0.00 43.02 43.41 2k7s s PHE 24 CO 0.47 -0.19 0.28 0.08 -1.46 0.00 0.00 175.22 174.40 2k7s s VAL 25 N -1.15 -0.20 0.13 3.12 1.01 -1.26 0.09 120.40 122.14 2k7s s VAL 25 Ca 0.04 0.19 -0.31 0.00 0.00 0.00 0.00 61.98 61.90 2k7s s VAL 25 Cb -0.01 -0.45 -0.07 0.00 0.00 0.00 0.00 36.38 35.85 2k7s s VAL 25 CO -0.03 0.08 1.28 -0.62 0.00 0.00 0.00 175.10 175.81 2k7s s ASP 26 N 1.75 6.96 0.17 3.32 2.15 0.41 -4.63 116.67 126.79 2k7s s ASP 26 Ca -0.05 2.24 0.06 0.00 0.43 0.00 0.00 52.55 55.22 2k7s s ASP 26 Cb -0.11 -2.59 0.31 0.00 -0.30 0.00 0.00 42.92 40.23 2k7s s ASP 26 CO -0.09 -0.52 0.99 0.00 -0.17 0.00 0.00 175.17 175.37 2k7s n HIS 27 N 3.40 0.19 0.24 -5.34 1.44 -1.26 -0.46 115.22 113.44 2k7s n HIS 27 Ca 0.08 0.10 0.10 0.00 -2.01 0.00 0.00 57.72 56.00 2k7s n HIS 27 Cb 0.44 -0.41 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 -0.80 -1.40 3.08 -1.90 -3.08 114.38 110.28 2k7s h ARG 28 Ca 0.00 0.00 0.23 0.00 0.07 0.00 0.00 59.98 60.28 2k7s h ARG 28 Cb 0.63 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.65 2k7s h ARG 28 CO 0.00 0.19 0.72 0.00 -1.07 0.00 0.00 179.97 179.82 2k7s h VAL 30 N 0.00 1.52 0.00 0.00 -1.51 -1.37 0.30 116.25 115.19 2k7s h VAL 30 Ca 0.38 -2.74 -0.14 0.00 -1.23 0.00 0.00 66.70 62.96 2k7s h VAL 30 Cb 1.82 2.55 -0.02 0.00 -2.13 0.00 0.00 31.29 33.51 2k7s h VAL 30 CO -0.00 0.80 -0.70 0.00 -1.23 0.00 0.00 177.57 176.43 2k7s h ALA 31 N 0.96 0.58 0.00 5.19 0.00 -0.88 -0.43 119.26 124.68 2k7s h ALA 31 Ca -0.05 -0.62 -0.01 0.00 0.00 0.00 0.00 54.91 54.24 2k7s h ALA 31 Cb 1.57 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 19.28 2k7s h ALA 31 CO 0.14 0.83 -0.15 1.15 0.00 0.00 0.00 179.25 181.22 2k7s h THR 32 N 0.00 0.18 -0.12 0.00 2.02 -0.96 -3.35 112.91 110.68 2k7s h THR 32 Ca -0.02 -1.15 0.00 0.00 0.77 0.00 0.00 66.41 66.01 2k7s h THR 32 Cb 1.51 0.35 0.00 0.00 -1.74 0.00 0.00 68.15 68.28 2k7s h THR 32 CO 0.08 0.06 0.00 1.33 0.37 0.00 0.00 175.52 177.36 2k7s n VAL 33 N -4.72 1.01 0.00 3.16 0.24 0.99 -4.61 118.33 114.40 2k7s n VAL 33 Ca -0.03 -1.01 0.00 0.00 -2.04 0.00 0.00 64.34 61.26 2k7s n VAL 33 Cb 0.12 0.50 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 -0.17 2.09 3.66 7.63 0.00 -0.17 0.23 105.19 118.46 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 0.00 2.68 0.88 1.61 2.02 -1.21 -4.54 117.35 118.79 2k7s s TYR 35 Ca 0.00 0.83 -0.11 0.00 -0.37 0.00 0.00 57.07 57.42 2k7s s TYR 35 Cb 0.00 -3.60 0.13 0.00 -0.40 0.00 0.00 41.96 38.09 2k7s s TYR 35 CO 0.00 -2.20 1.17 -0.65 -1.57 0.00 0.00 175.55 172.30 2k7s s GLN 36 N 3.45 1.21 0.29 -0.62 -0.21 -1.26 -2.39 119.66 120.13 2k7s s GLN 36 Ca 0.59 1.63 0.04 0.00 0.02 0.00 0.00 55.36 57.65 2k7s s GLN 36 Cb -0.25 -1.74 0.71 0.00 1.00 0.00 0.00 33.01 32.73 2k7s s GLN 36 CO 0.19 -2.51 1.73 -1.35 -2.12 0.00 0.00 175.29 171.23 2k7s h PRO 37 N -1.55 0.53 0.00 2.91 0.11 -1.83 0.66 132.00 132.82 2k7s h PRO 37 Ca -0.44 -0.03 -0.09 0.00 0.11 0.00 0.00 66.00 65.55 2k7s h PRO 37 Cb 1.28 -0.12 -0.01 0.00 0.11 0.00 0.00 31.00 32.26 2k7s h PRO 37 CO 0.43 0.35 -0.42 -0.56 -0.21 0.00 0.00 178.00 177.59 2k7s h GLN 38 N 0.55 0.00 0.00 1.05 3.07 -1.89 0.31 115.11 118.19 2k7s h GLN 38 Ca 0.55 0.00 0.00 0.00 0.09 0.00 0.00 58.65 59.29 2k7s h GLN 38 Cb 0.97 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.53 2k7s h GLN 38 CO -0.45 0.42 0.00 -1.91 0.09 0.00 0.00 178.83 176.98 2k7s n GLU 39 N -3.68 0.04 -0.02 0.06 2.13 0.22 -3.06 120.64 116.33 2k7s n GLU 39 Ca -0.01 0.24 -0.03 0.00 0.66 0.00 0.00 57.16 58.02 2k7s n GLU 39 Cb 0.51 -1.50 -0.02 0.00 0.27 0.00 0.00 31.44 30.69 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 -1.46 2.42 -4.62 4.31 7.99 -0.82 -4.81 117.00 120.01 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 0.16 -0.12 -0.05 0.00 -0.11 0.00 0.00 43.42 43.30 2k7s n LEU 40 CO 0.13 0.49 1.02 0.18 -1.51 0.00 0.00 177.39 177.69 2k7s n LEU 41 N -2.54 2.26 0.00 2.23 4.77 0.10 -0.29 117.00 123.53 2k7s n LEU 41 Ca -0.08 1.11 0.00 0.00 -0.03 0.00 0.00 56.01 57.01 2k7s n LEU 41 Cb 0.60 -1.29 0.00 0.00 -2.33 0.00 0.00 43.42 40.39 2k7s n LEU 41 CO 0.05 -0.73 0.00 0.61 -1.33 0.00 0.00 177.39 175.99 2k7s n GLY 42 N 2.86 1.77 3.85 -0.72 0.00 0.52 -4.91 105.19 108.56 2k7s n GLY 42 Ca 0.18 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 3.33 -0.19 1.61 1.02 0.60 -4.70 119.74 121.18 2k7s s LYS 43 Ca 0.00 -0.26 -0.29 0.00 0.02 0.00 0.00 55.97 55.44 2k7s s LYS 43 Cb 0.00 -3.07 -0.03 0.00 -0.52 0.00 0.00 37.83 34.21 2k7s s LYS 43 CO 0.00 0.73 1.59 1.21 -0.92 0.00 0.00 175.35 177.95 2k7s s ASN 44 N -1.32 6.48 0.31 2.83 3.84 -1.26 -0.98 114.94 124.83 2k7s s ASN 44 Ca 0.19 1.71 0.07 0.00 0.21 0.00 0.00 52.86 55.04 2k7s s ASN 44 Cb -0.12 -2.53 0.81 0.00 -0.55 0.00 0.00 41.25 38.86 2k7s s ASN 44 CO 0.09 -1.16 1.72 -0.29 -2.79 0.00 0.00 177.10 174.66 2k7s h ILE 45 N 6.00 0.51 0.00 -5.21 2.10 -1.48 0.26 117.51 119.69 2k7s h ILE 45 Ca -0.34 -0.17 -0.08 0.00 1.08 0.00 0.00 64.86 65.35 2k7s h ILE 45 Cb 1.15 -0.03 -0.01 0.00 -1.09 0.00 0.00 36.82 36.84 2k7s h ILE 45 CO 0.99 0.09 -0.40 -0.37 -1.08 0.00 0.00 178.15 177.38 2k7s h VAL 46 N 0.50 1.11 -0.75 2.19 -1.51 -1.83 -2.53 116.25 113.43 2k7s h VAL 46 Ca 0.60 -1.48 0.22 0.00 -1.23 0.00 0.00 66.70 64.81 2k7s h VAL 46 Cb 1.14 1.84 -0.03 0.00 -2.13 0.00 0.00 31.29 32.11 2k7s h VAL 46 CO -0.50 0.40 0.55 -0.33 -1.23 0.00 0.00 177.57 176.46 2k7s h GLU 47 N 0.00 0.00 0.08 5.19 5.08 -0.86 0.36 114.58 124.43 2k7s h GLU 47 Ca -0.00 0.00 -0.32 0.00 -1.00 0.00 0.00 59.36 58.03 2k7s h GLU 47 Cb 0.81 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.03 2k7s h GLU 47 CO 0.05 0.00 -1.74 0.74 -1.00 0.00 0.00 179.01 177.06 2k7s h PHE 48 N 0.00 0.32 -3.58 4.33 -1.00 -1.50 -3.47 116.94 112.03 2k7s h PHE 48 Ca 0.35 -0.23 -0.56 0.00 2.81 0.00 0.00 57.97 60.34 2k7s h PHE 48 Cb 1.45 -0.01 0.13 0.00 3.61 0.00 0.00 35.95 41.13 2k7s h PHE 48 CO 0.00 1.40 0.41 0.00 -1.61 0.00 0.00 178.31 178.51 2k7s n HIS 50 N -0.67 2.69 -0.19 0.00 -0.00 0.75 -4.67 115.22 113.12 2k7s n HIS 50 Ca 0.09 0.26 -0.10 0.00 0.46 0.00 0.00 57.72 58.43 2k7s n HIS 50 Cb 0.42 -2.58 -0.06 0.00 -0.12 0.00 0.00 29.99 27.65 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 4.98 -0.26 0.00 1.57 0.11 -1.90 0.44 132.00 136.94 2k7s h PRO 51 Ca -0.46 0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.67 2k7s h PRO 51 Cb 1.23 0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.40 2k7s h PRO 51 CO 0.81 -0.17 0.10 0.93 -0.21 0.00 0.00 178.00 179.46 2k7s h GLU 52 N -0.27 0.00 0.00 1.05 4.39 -2.00 -0.67 114.58 117.08 2k7s h GLU 52 Ca 0.15 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.85 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 -0.67 0.00 -1.56 -0.25 -1.16 0.00 0.00 179.01 175.37 2k7s n ASP 53 N -2.58 0.90 -0.22 1.42 8.00 0.12 -4.46 116.55 119.73 2k7s n ASP 53 Ca -0.02 -0.23 0.03 0.00 0.71 0.00 0.00 54.79 55.28 2k7s n ASP 53 Cb 0.15 1.60 0.28 0.00 -0.02 0.00 0.00 41.12 43.13 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 0.91 -0.10 -1.24 4.20 0.12 0.42 115.11 119.42 2k7s h GLN 54 Ca 0.00 -0.05 0.00 0.00 0.06 0.00 0.00 58.65 58.66 2k7s h GLN 54 Cb 0.71 -0.20 -0.01 0.00 0.30 0.00 0.00 27.48 28.28 2k7s h GLN 54 CO 0.00 0.60 0.07 0.37 -0.67 0.00 0.00 178.83 179.20 2k7s h GLN 55 N 0.94 0.12 0.19 1.46 5.75 -1.78 0.18 115.11 121.97 2k7s h GLN 55 Ca 0.30 -0.01 -0.30 0.00 -0.15 0.00 0.00 58.65 58.49 2k7s h GLN 55 Cb 0.04 -0.03 0.02 0.00 1.07 0.00 0.00 27.48 28.59 2k7s h GLN 55 CO -0.09 0.08 -1.35 1.25 -2.65 0.00 0.00 178.83 176.07 2k7s h LEU 56 N 0.13 0.63 0.58 -2.39 5.85 -1.25 -2.11 115.31 116.74 2k7s h LEU 56 Ca 0.04 -0.67 -0.03 0.00 0.84 0.00 0.00 57.88 58.06 2k7s h LEU 56 Cb 0.00 -0.20 0.01 0.00 0.37 0.00 0.00 40.66 40.84 2k7s h LEU 56 CO -0.01 1.52 -0.28 0.25 -0.34 0.00 0.00 178.44 179.58 2k7s h LEU 57 N 0.11 -0.66 -1.25 2.25 5.85 -0.06 -2.02 115.31 119.52 2k7s h LEU 57 Ca -0.19 -0.04 0.09 0.00 0.84 0.00 0.00 57.88 58.58 2k7s h LEU 57 Cb 2.06 0.17 -0.06 0.00 0.37 0.00 0.00 40.66 43.21 2k7s h LEU 57 CO 0.24 -0.32 0.55 0.03 -0.34 0.00 0.00 178.44 178.60 2k7s h ARG 58 N -1.04 0.83 -0.29 1.25 3.08 -0.82 -1.50 114.38 115.89 2k7s h ARG 58 Ca -0.08 -0.05 0.06 0.00 0.07 0.00 0.00 59.98 59.98 2k7s h ARG 58 Cb 0.66 -0.19 -0.06 0.00 0.08 0.00 0.00 29.97 30.47 2k7s h ARG 58 CO 0.13 0.55 -0.07 0.22 -1.07 0.00 0.00 179.97 179.73 2k7s h ASP 59 N 0.85 -0.27 -0.05 7.04 3.58 -1.21 0.14 116.42 126.51 2k7s h ASP 59 Ca 0.38 0.09 0.04 0.00 0.42 0.00 0.00 57.03 57.96 2k7s h ASP 59 Cb 0.36 0.18 -0.06 0.00 1.72 0.00 0.00 39.33 41.54 2k7s h ASP 59 CO -0.15 -0.10 -0.35 -1.28 -2.88 0.00 0.00 179.24 174.48 2k7s h SER 60 N 0.00 -1.08 -0.83 2.28 0.87 -0.53 0.17 113.55 114.43 2k7s h SER 60 Ca 0.14 0.14 0.16 0.00 -1.23 0.00 0.00 61.79 61.00 2k7s h SER 60 Cb 0.21 0.44 -0.06 0.00 -0.44 0.00 0.00 62.40 62.55 2k7s h SER 60 CO -0.30 -0.40 0.55 -0.26 -0.53 0.00 0.00 176.83 175.89 2k7s h PHE 61 N -0.48 0.61 -0.03 2.24 0.04 -1.00 0.41 116.94 118.73 2k7s h PHE 61 Ca 0.07 0.02 -0.10 0.00 2.80 0.00 0.00 57.97 60.76 2k7s h PHE 61 Cb 0.59 -0.19 -0.01 0.00 2.20 0.00 0.00 35.95 38.53 2k7s h PHE 61 CO -0.40 0.22 -0.44 1.96 -0.60 0.00 0.00 178.31 179.05 2k7s h GLN 62 N 0.51 0.06 0.18 1.51 1.08 0.11 -2.19 115.11 116.36 2k7s h GLN 62 Ca 0.42 -0.03 -0.25 0.00 -1.45 0.00 0.00 58.65 57.34 2k7s h GLN 62 Cb 0.87 -0.00 0.02 0.00 -0.05 0.00 0.00 27.48 28.33 2k7s h GLN 62 CO -0.16 0.49 -1.12 1.96 -0.95 0.00 0.00 178.83 179.04 2k7s h GLN 63 N 0.05 0.37 -0.41 1.46 1.08 0.15 -1.69 115.11 116.12 2k7s h GLN 63 Ca 0.00 -0.64 -0.05 0.00 -1.45 0.00 0.00 58.65 56.52 2k7s h GLN 63 Cb 0.79 0.24 -0.02 0.00 -0.05 0.00 0.00 27.48 28.44 2k7s h GLN 63 CO 0.06 1.30 0.07 -0.39 -0.95 0.00 0.00 178.83 178.92 2k7s h VAL 64 N -0.19 1.20 0.04 -0.54 -1.51 -0.85 0.07 116.25 114.46 2k7s h VAL 64 Ca -0.20 -0.74 -0.23 0.00 -1.23 0.00 0.00 66.70 64.29 2k7s h VAL 64 Cb 1.84 0.81 -0.02 0.00 -2.13 0.00 0.00 31.29 31.79 2k7s h VAL 64 CO 0.18 0.27 -1.12 1.62 -1.23 0.00 0.00 177.57 177.28 2k7s h VAL 65 N 0.61 1.59 -0.31 7.19 3.04 -1.49 0.28 116.25 127.16 2k7s h VAL 65 Ca 0.14 -3.27 -0.11 0.00 -1.01 0.00 0.00 66.70 62.44 2k7s h VAL 65 Cb 0.28 2.84 -0.01 0.00 -2.01 0.00 0.00 31.29 32.40 2k7s h VAL 65 CO 0.00 0.92 -0.24 0.11 -1.01 0.00 0.00 177.57 177.35 2k7s h LYS 66 N 0.02 0.72 -0.09 4.17 1.57 -0.88 -2.83 116.57 119.24 2k7s h LYS 66 Ca -0.07 -0.35 0.00 0.00 -1.87 0.00 0.00 60.65 58.36 2k7s h LYS 66 Cb 1.84 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 34.15 2k7s h LYS 66 CO 0.15 0.97 0.00 1.28 -0.57 0.00 0.00 179.45 181.27 2k7s n LEU 67 N -4.28 2.14 -2.31 2.94 4.77 -0.03 -5.00 117.00 115.23 2k7s n LEU 67 Ca -0.03 -0.78 -0.07 0.00 -0.03 0.00 0.00 56.01 55.09 2k7s n LEU 67 Cb 0.44 -0.05 0.01 0.00 -2.33 0.00 0.00 43.42 41.49 2k7s n LEU 67 CO 0.44 0.39 -0.28 1.17 -1.33 0.00 0.00 177.39 177.79 2k7s n LYS 68 N 0.66 -0.46 0.00 3.23 3.00 0.89 -3.68 118.16 121.79 2k7s n LYS 68 Ca 0.17 0.60 0.00 0.00 -0.00 0.00 0.00 58.31 59.08 2k7s n LYS 68 Cb 0.44 -0.80 0.00 0.00 0.00 0.00 0.00 35.03 34.68 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 0.68 3.03 3.68 3.14 0.00 -0.57 -4.95 105.19 110.20 2k7s n GLY 69 Ca -0.02 -1.07 -0.48 0.00 0.00 0.00 0.00 46.02 44.46 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 2.24 -2.80 1.61 -0.06 -1.24 -4.43 117.38 112.69 2k7s n GLN 70 Ca 0.00 0.82 -0.39 0.00 -2.00 0.00 0.00 57.00 55.42 2k7s n GLN 70 Cb 0.00 -2.66 -0.06 0.00 -4.06 0.00 0.00 30.24 23.46 2k7s n GLN 70 CO 0.00 0.00 0.00 0.54 -0.20 0.00 0.00 177.06 177.40 2k7s s VAL 71 N 3.70 4.14 0.10 1.69 0.11 -1.26 -4.00 120.40 124.89 2k7s s VAL 71 Ca 0.91 1.98 0.06 0.00 -2.93 0.00 0.00 61.98 61.99 2k7s s VAL 71 Cb -0.67 -4.25 -0.04 0.00 -1.53 0.00 0.00 36.38 29.89 2k7s s VAL 71 CO 0.49 0.45 -0.04 -0.76 -3.33 0.00 0.00 175.10 171.92 2k7s s LEU 72 N -1.30 3.30 -0.17 2.54 2.01 0.12 -4.95 118.68 120.23 2k7s s LEU 72 Ca 0.41 -0.27 -0.01 0.00 0.01 0.00 0.00 54.13 54.28 2k7s s LEU 72 Cb -0.24 -2.05 0.05 0.00 0.01 0.00 0.00 46.19 43.95 2k7s s LEU 72 CO 0.30 0.17 -0.03 -0.55 1.01 0.00 0.00 176.35 177.24 2k7s s SER 73 N -2.32 2.83 -0.01 2.29 0.15 -1.24 -1.94 113.70 113.46 2k7s s SER 73 Ca 0.24 -0.69 0.01 0.00 0.70 0.00 0.00 55.95 56.21 2k7s s SER 73 Cb -0.11 -0.85 0.01 0.00 -1.71 0.00 0.00 66.02 63.36 2k7s s SER 73 CO 0.17 -0.21 -0.02 0.68 1.20 0.00 0.00 173.24 175.06 2k7s s VAL 74 N 1.68 0.20 -0.20 4.45 -7.23 -1.11 -4.93 120.40 113.26 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 0.22 -0.04 -0.31 0.00 0.00 175.10 174.99 2k7s s MET 75 N 0.32 4.17 0.14 4.82 -1.94 -1.26 -0.60 119.30 124.96 2k7s s MET 75 Ca -0.03 -0.09 -0.02 0.00 -1.71 0.00 0.00 55.69 53.85 2k7s s MET 75 Cb -0.06 -3.47 -0.04 0.00 2.01 0.00 0.00 34.83 33.27 2k7s s MET 75 CO -0.01 0.17 0.08 -0.59 -0.01 0.00 0.00 175.02 174.66 2k7s s PHE 76 N 0.73 0.87 -0.46 -0.03 -0.71 -0.15 -4.94 117.98 113.29 2k7s s PHE 76 Ca 0.12 -1.22 -0.17 0.00 -1.04 0.00 0.00 56.93 54.61 2k7s s PHE 76 Cb -0.13 -0.46 0.04 0.00 -1.21 0.00 0.00 43.02 41.26 2k7s s PHE 76 CO 0.03 -0.55 0.47 1.03 -1.34 0.00 0.00 175.22 174.86 2k7s s ARG 77 N -4.06 3.07 -0.51 1.99 0.52 -1.26 -0.22 118.95 118.48 2k7s s ARG 77 Ca 0.26 -0.95 -0.22 0.00 -0.52 0.00 0.00 55.73 54.29 2k7s s ARG 77 Cb 0.07 -4.05 0.04 0.00 0.52 0.00 0.00 34.95 31.54 2k7s s ARG 77 CO 0.03 -0.99 0.81 0.12 0.02 0.00 0.00 175.30 175.29 2k7s s PHE 78 N 2.13 2.92 -0.37 -0.53 2.19 0.62 -0.18 117.98 124.75 2k7s s PHE 78 Ca 0.11 -0.13 -0.27 0.00 0.33 0.00 0.00 56.93 56.97 2k7s s PHE 78 Cb -0.20 -3.81 -0.04 0.00 -1.31 0.00 0.00 43.02 37.67 2k7s s PHE 78 CO 0.11 -1.17 2.10 0.50 1.83 0.00 0.00 175.22 178.60 2k7s s ARG 79 N 3.40 2.86 0.15 10.12 3.00 -0.67 -1.04 118.95 136.76 2k7s s ARG 79 Ca 0.26 1.51 -0.02 0.00 -1.00 0.00 0.00 55.73 56.47 2k7s s ARG 79 Cb -0.14 -4.38 0.03 0.00 0.00 0.00 0.00 34.95 30.46 2k7s s ARG 79 CO 0.18 -2.42 0.20 -1.13 0.00 0.00 0.00 175.30 172.13 2k7s n SER 80 N 12.51 0.04 0.31 -2.12 3.41 -0.81 -4.81 113.62 122.15 2k7s n SER 80 Ca 0.28 -1.08 0.19 0.00 -0.26 0.00 0.00 58.87 58.00 2k7s n SER 80 Cb 0.49 -0.15 0.97 0.00 -0.26 0.00 0.00 64.21 65.25 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 -0.60 4.33 1.63 -0.56 0.14 116.57 121.52 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 0.03 0.00 0.09 -3.45 0.00 0.00 179.45 176.16 2k7s n ASN 82 N -3.26 3.40 -3.77 4.20 5.03 -1.26 -4.93 115.26 114.67 2k7s n ASN 82 Ca -0.02 -2.14 -0.24 0.00 0.87 0.00 0.00 54.58 53.05 2k7s n ASN 82 Cb 0.16 -0.44 0.03 0.00 -1.02 0.00 0.00 39.78 38.52 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 1.06 -5.12 -5.12 3.52 3.00 0.51 -4.99 117.38 110.24 2k7s n GLN 83 Ca 0.20 0.61 -0.29 0.00 -0.01 0.00 0.00 57.00 57.51 2k7s n GLN 83 Cb 0.58 -5.27 -0.16 0.00 0.00 0.00 0.00 30.24 25.39 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 -6.21 2.04 -0.96 -1.09 0.41 -1.26 -4.84 118.70 106.79 2k7s s GLU 84 Ca 0.22 -0.81 -0.24 0.00 -0.41 0.00 0.00 54.97 53.74 2k7s s GLU 84 Cb -0.11 -1.85 -0.07 0.00 -1.78 0.00 0.00 34.13 30.31 2k7s s GLU 84 CO 0.82 0.42 1.99 -1.58 -0.49 0.00 0.00 175.26 176.42 2k7s s TRP 85 N -0.33 1.76 -0.70 1.61 0.23 -1.26 -1.92 118.94 118.33 2k7s s TRP 85 Ca 0.03 0.78 -0.27 0.00 -2.03 0.00 0.00 56.10 54.61 2k7s s TRP 85 Cb -0.11 -3.95 0.03 0.00 0.03 0.00 0.00 33.47 29.47 2k7s s TRP 85 CO 0.01 -1.57 1.25 -0.51 0.96 0.00 0.00 176.95 177.09 2k7s s LEU 86 N 10.98 3.27 0.17 2.99 1.43 -0.20 -4.68 118.68 132.63 2k7s s LEU 86 Ca 0.72 -0.33 -0.32 0.00 -1.03 0.00 0.00 54.13 53.18 2k7s s LEU 86 Cb -0.06 -2.70 -0.11 0.00 0.03 0.00 0.00 46.19 43.35 2k7s s LEU 86 CO 0.04 -1.74 1.70 0.26 0.23 0.00 0.00 176.35 176.84 2k7s s TRP 87 N 5.50 2.77 0.10 0.29 0.52 -1.25 -0.27 118.94 126.59 2k7s s TRP 87 Ca 0.37 0.33 -0.00 0.00 0.02 0.00 0.00 56.10 56.82 2k7s s TRP 87 Cb -0.08 -4.09 -0.04 0.00 -1.15 0.00 0.00 33.47 28.11 2k7s s TRP 87 CO 0.17 -4.19 0.00 -1.64 0.02 0.00 0.00 176.95 171.31 2k7s s MET 88 N 1.56 0.83 -0.17 4.98 -1.94 0.70 -1.19 119.30 124.07 2k7s s MET 88 Ca 0.75 -1.36 0.01 0.00 -1.71 0.00 0.00 55.69 53.38 2k7s s MET 88 Cb -0.47 0.10 0.02 0.00 2.01 0.00 0.00 34.83 36.48 2k7s s MET 88 CO 0.33 -0.16 -0.20 1.03 -0.01 0.00 0.00 175.02 176.01 2k7s s ARG 89 N -3.96 3.02 -0.05 2.03 0.52 0.48 -0.98 118.95 120.01 2k7s s ARG 89 Ca 0.17 -0.83 -0.12 0.00 -0.52 0.00 0.00 55.73 54.42 2k7s s ARG 89 Cb 0.07 -2.54 -0.05 0.00 0.52 0.00 0.00 34.95 32.95 2k7s s ARG 89 CO -0.03 -0.14 0.32 0.95 0.02 0.00 0.00 175.30 176.43 2k7s s THR 90 N 1.12 5.19 -0.77 0.02 -4.23 0.23 -1.06 115.64 116.13 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 0.26 0.00 1.34 0.00 0.00 72.50 70.35 2k7s s THR 90 CO -0.09 0.58 0.96 -1.20 -0.54 0.00 0.00 174.62 174.33 2k7s n SER 91 N 2.00 4.54 -4.70 3.99 7.64 -0.75 -2.75 113.62 123.59 2k7s n SER 91 Ca -0.15 -3.43 -0.41 0.00 1.01 0.00 0.00 58.87 55.88 2k7s n SER 91 Cb 0.53 -0.85 -0.04 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 -2.22 7.12 -0.24 6.43 0.01 -0.82 -2.50 113.70 121.47 2k7s s SER 92 Ca 0.37 1.36 -0.26 0.00 1.31 0.00 0.00 55.95 58.73 2k7s s SER 92 Cb 0.11 -2.49 0.10 0.00 0.21 0.00 0.00 66.02 63.95 2k7s s SER 92 CO 0.02 -0.30 0.88 0.00 0.41 0.00 0.00 173.24 174.25 2k7s s GLN 93 N 1.48 0.69 -0.45 12.44 -2.07 -0.52 0.12 119.66 131.36 2k7s s GLN 93 Ca 0.43 0.67 -0.42 0.00 -1.82 0.00 0.00 55.36 54.22 2k7s s GLN 93 Cb -0.18 0.34 -0.18 0.00 -1.09 0.00 0.00 33.01 31.89 2k7s s GLN 93 CO 0.19 -0.11 1.43 0.25 -1.32 0.00 0.00 175.29 175.73 2k7s n THR 94 N 2.11 0.00 -0.53 3.63 -2.24 -1.26 0.15 114.28 116.15 2k7s n THR 94 Ca -0.13 0.00 -0.26 0.00 -2.27 0.00 0.00 64.05 61.38 2k7s n THR 94 Cb 0.56 -0.45 0.19 0.00 -2.10 0.00 0.00 70.33 68.53 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 3.58 -2.93 -1.00 6.98 0.00 -1.18 -4.56 120.51 121.39 2k7s n ALA 95 Ca 0.28 -1.30 0.00 0.00 0.00 0.00 0.00 53.44 52.41 2k7s n ALA 95 Cb -0.05 -1.31 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 -2.78 0.00 -3.61 0.00 1.13 -1.26 -4.01 117.38 106.85 2k7s n GLN 96 Ca 0.05 0.00 -0.07 0.00 -1.94 0.00 0.00 57.00 55.04 2k7s n GLN 96 Cb 0.51 -0.32 -0.06 0.00 0.11 0.00 0.00 30.24 30.48 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 -1.45 -0.27 -0.00 1.08 2.47 -1.26 -3.37 114.94 112.14 2k7s s ASN 97 Ca 0.00 0.37 0.02 0.00 0.42 0.00 0.00 52.86 53.67 2k7s s ASN 97 Cb 0.00 0.33 0.05 0.00 -1.45 0.00 0.00 41.25 40.18 2k7s s ASN 97 CO 0.00 -0.19 0.95 -0.81 -3.72 0.00 0.00 177.10 173.33 2k7s n PRO 98 N 1.10 1.16 -0.20 0.43 -0.04 -1.26 -4.84 135.00 131.34 2k7s n PRO 98 Ca -0.08 -0.20 -0.03 0.00 -0.04 0.00 0.00 63.50 63.15 2k7s n PRO 98 Cb 0.58 -1.15 0.04 0.00 -0.04 0.00 0.00 33.50 32.93 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 -0.26 0.49 -0.02 0.54 4.01 -1.26 -4.23 117.16 116.43 2k7s n TYR 99 Ca 0.02 -0.56 0.07 0.00 -0.16 0.00 0.00 57.90 57.27 2k7s n TYR 99 Cb 0.10 -0.32 0.46 0.00 -0.31 0.00 0.00 39.34 39.28 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 0.33 0.42 0.60 7.72 0.87 -1.69 0.45 113.55 122.24 2k7s h SER 100 Ca 0.08 -0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.64 2k7s h SER 100 Cb 1.17 -0.10 0.00 0.00 -0.44 0.00 0.00 62.40 63.03 2k7s h SER 100 CO 0.16 0.28 0.00 -0.67 -0.53 0.00 0.00 176.83 176.08 2k7s n ASP 101 N -4.48 0.00 -1.58 6.23 2.03 -1.26 -4.00 116.55 113.50 2k7s n ASP 101 Ca 0.05 0.37 0.00 0.00 0.52 0.00 0.00 54.79 55.74 2k7s n ASP 101 Cb 0.18 -0.45 0.00 0.00 -0.72 0.00 0.00 41.12 40.13 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 -1.45 2.48 -3.41 -0.67 -0.58 0.16 -4.80 120.64 112.36 2k7s n GLU 102 Ca 0.06 0.00 -0.13 0.00 -0.42 0.00 0.00 57.16 56.67 2k7s n GLU 102 Cb 0.21 0.00 -0.10 0.00 -0.57 0.00 0.00 31.44 30.98 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 1.11 -0.48 -0.48 -3.67 1.01 0.48 -3.09 121.20 116.08 2k7s s ILE 103 Ca 0.00 -0.12 -0.29 0.00 0.00 0.00 0.00 60.65 60.25 2k7s s ILE 103 Cb 0.00 -0.77 0.02 0.00 0.01 0.00 0.00 42.46 41.72 2k7s s ILE 103 CO 0.00 -0.18 1.26 -0.70 0.00 0.00 0.00 174.94 175.32 2k7s s GLU 104 N 2.44 3.61 -0.26 2.79 2.12 0.12 -2.02 118.70 127.51 2k7s s GLU 104 Ca 0.10 0.63 -0.03 0.00 0.36 0.00 0.00 54.97 56.02 2k7s s GLU 104 Cb -0.15 -3.98 0.02 0.00 0.26 0.00 0.00 34.13 30.28 2k7s s GLU 104 CO -0.15 -1.53 -0.01 0.99 -0.54 0.00 0.00 175.26 174.01 2k7s s THR 105 N 4.98 3.25 -0.58 -1.70 2.01 -0.28 -1.44 115.64 121.87 2k7s s THR 105 Ca 0.52 -0.90 -0.20 0.00 0.31 0.00 0.00 61.69 61.41 2k7s s THR 105 Cb -0.09 -2.66 0.08 0.00 0.01 0.00 0.00 72.50 69.84 2k7s s THR 105 CO 0.31 0.16 0.75 -0.63 -0.69 0.00 0.00 174.62 174.52 2k7s s ILE 106 N 1.38 4.70 -0.47 1.82 1.09 -1.04 -1.38 121.20 127.30 2k7s s ILE 106 Ca 0.01 -0.66 -0.27 0.00 -1.10 0.00 0.00 60.65 58.63 2k7s s ILE 106 Cb -0.17 -4.49 0.03 0.00 -1.06 0.00 0.00 42.46 36.77 2k7s s ILE 106 CO -0.02 -1.12 1.02 -0.63 -0.10 0.00 0.00 174.94 174.10 2k7s s ILE 107 N 3.04 4.35 -0.17 2.92 1.01 -0.71 -1.80 121.20 129.83 2k7s s ILE 107 Ca 0.16 0.97 -0.05 0.00 0.00 0.00 0.00 60.65 61.73 2k7s s ILE 107 Cb -0.21 -4.51 -0.03 0.00 0.01 0.00 0.00 42.46 37.72 2k7s s ILE 107 CO 0.09 -0.91 -0.00 0.00 0.00 0.00 0.00 174.94 174.12 2k7s s THR 109 N 0.55 2.09 0.00 0.00 -4.23 0.17 -0.39 115.64 113.83 2k7s s THR 109 Ca -0.01 0.09 0.00 0.00 -1.18 0.00 0.00 61.69 60.59 2k7s s THR 109 Cb -0.14 -3.06 0.00 0.00 1.34 0.00 0.00 72.50 70.65 2k7s s THR 109 CO 0.02 0.02 0.00 -3.20 -0.54 0.00 0.00 174.62 170.92 2k7s n ASN 110 N 0.51 0.00 -3.58 3.99 2.85 -0.34 -4.84 115.26 113.86 2k7s n ASN 110 Ca 0.01 0.00 -0.14 0.00 -0.11 0.00 0.00 54.58 54.34 2k7s n ASN 110 Cb 0.39 -0.06 -0.06 0.00 1.24 0.00 0.00 39.78 41.30 2k7s n ASN 110 CO 0.00 0.00 0.00 0.28 -2.11 0.00 0.00 177.26 175.43 2k7s s THR 111 N -0.29 0.03 0.10 -0.44 -1.32 -1.26 -5.05 115.64 107.40 2k7s s THR 111 Ca 0.00 -0.22 -0.05 0.00 -1.21 0.00 0.00 61.69 60.20 2k7s s THR 111 Cb 0.00 -0.96 -0.02 0.00 -1.51 0.00 0.00 72.50 70.01 2k7s s THR 111 CO 0.00 -0.12 0.12 0.21 -2.21 0.00 0.00 174.62 172.62 2k7s s ASN 112 N -1.84 0.24 0.21 8.08 2.47 -1.26 -3.92 114.94 118.92 2k7s s ASN 112 Ca -0.06 -0.87 -0.12 0.00 0.42 0.00 0.00 52.86 52.22 2k7s s ASN 112 Cb -0.01 0.31 0.26 0.00 -1.45 0.00 0.00 41.25 40.36 2k7s s ASN 112 CO 0.00 -0.72 1.67 0.58 -3.72 0.00 0.00 177.10 174.90 2k7s h VAL 113 N 2.84 0.52 -3.91 -5.21 2.07 -2.03 -3.42 116.25 107.11 2k7s h VAL 113 Ca -0.34 -0.04 -0.28 0.00 0.82 0.00 0.00 66.70 66.87 2k7s h VAL 113 Cb 1.19 0.40 -0.25 0.00 -1.52 0.00 0.00 31.29 31.10 2k7s h VAL 113 CO 0.58 0.02 -0.74 -1.59 0.02 0.00 0.00 177.57 175.86 2k7s s LYS 114 N -6.16 0.38 -1.13 1.57 -2.85 -1.26 -5.08 119.74 105.21 2k7s s LYS 114 Ca -0.14 -0.39 -0.19 0.00 -1.00 0.00 0.00 55.97 54.26 2k7s s LYS 114 Cb 0.18 -0.26 0.09 0.00 -2.06 0.00 0.00 37.83 35.78 2k7s s LYS 114 CO 0.73 0.06 1.48 -0.80 0.10 0.00 0.00 175.35 176.93 2k7s s ASN 115 N -0.71 6.74 0.00 0.03 -0.87 -1.26 -4.83 114.94 114.04 2k7s s ASN 115 Ca -0.04 -2.17 0.00 0.00 -1.57 0.00 0.00 52.86 49.08 2k7s s ASN 115 Cb -0.05 -2.51 0.00 0.00 -0.02 0.00 0.00 41.25 38.67 2k7s s ASN 115 CO -0.00 -1.18 0.17 -0.24 -2.57 0.00 0.00 177.10 173.29 2k7s n SER 116 N 7.71 0.00 0.00 -1.22 2.88 -1.26 -4.92 113.62 116.82 2k7s n SER 116 Ca 0.37 0.52 0.00 0.00 -1.33 0.00 0.00 58.87 58.43 2k7s n SER 116 Cb 0.47 -0.43 0.00 0.00 -0.75 0.00 0.00 64.21 63.51 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 -1.78 1.00 -3.24 -3.46 7.64 -1.26 -5.10 113.62 107.42 2k7s n SER 117 Ca 0.00 0.00 -0.25 0.00 1.01 0.00 0.00 58.87 59.63 2k7s n SER 117 Cb 0.00 0.00 0.23 0.00 -1.01 0.00 0.00 64.21 63.43 2k7s n SER 117 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2k7s n GLN 118 N -2.34 -3.93 0.00 1.43 0.00 -1.26 -4.83 117.38 106.45 2k7s n GLN 118 Ca 0.00 -1.29 0.00 0.00 0.00 0.00 0.00 57.00 55.71 2k7s n GLN 118 Cb 0.24 -1.52 0.00 0.00 0.00 0.00 0.00 30.24 28.96 2k7s n GLN 118 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.06 176.21