#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1j0s s PHE 2 N 0.00 -0.69 0.08 -0.72 0.40 -0.90 -4.86 117.98 111.29 1j0s s PHE 2 Ca 0.00 1.65 0.01 0.00 -0.60 0.00 0.00 56.93 57.98 1j0s s PHE 2 Cb 0.00 0.26 -0.04 0.00 0.51 0.00 0.00 43.02 43.75 1j0s s PHE 2 CO 0.00 -0.34 -0.05 0.20 0.70 0.00 0.00 175.22 175.73 1j0s s GLY 3 N 0.46 0.64 -0.08 4.36 0.00 -1.26 -1.72 107.32 109.73 1j0s s GLY 3 Ca -0.01 -1.26 -0.24 0.00 0.00 0.00 0.00 44.72 43.22 1j0s s GLY 3 CO -0.01 -1.36 0.71 1.25 0.00 0.00 0.00 173.10 173.69 1j0s s LYS 4 N -3.70 4.41 -0.16 2.90 2.20 -0.55 0.02 119.74 124.87 1j0s s LYS 4 Ca 0.08 0.88 -0.13 0.00 -0.36 0.00 0.00 55.97 56.45 1j0s s LYS 4 Cb 0.05 -3.47 -0.06 0.00 -1.51 0.00 0.00 37.83 32.84 1j0s s LYS 4 CO -0.06 0.01 -0.15 -0.11 -0.36 0.00 0.00 175.35 174.68 1j0s n LEU 5 N 3.98 1.84 -3.63 5.43 0.00 0.28 -4.54 117.00 120.35 1j0s n LEU 5 Ca -0.01 0.55 -0.05 0.00 0.00 0.00 0.00 56.01 56.50 1j0s n LEU 5 Cb 0.51 -0.87 -0.06 0.00 0.00 0.00 0.00 43.42 43.01 1j0s n LEU 5 CO 0.47 -0.28 1.04 -1.83 0.00 0.00 0.00 177.39 176.79 1j0s s GLU 6 N -2.37 0.21 -0.11 1.96 -1.05 -0.31 -4.97 118.70 112.05 1j0s s GLU 6 Ca -0.20 0.14 -0.02 0.00 -0.15 0.00 0.00 54.97 54.74 1j0s s GLU 6 Cb 0.03 0.10 -0.03 0.00 -0.44 0.00 0.00 34.13 33.79 1j0s s GLU 6 CO 0.32 -0.05 -0.04 0.45 0.95 0.00 0.00 175.26 176.89 1j0s s SER 7 N -0.48 4.80 0.26 0.83 0.15 -1.26 -0.16 113.70 117.84 1j0s s SER 7 Ca 0.06 -0.05 -0.03 0.00 0.70 0.00 0.00 55.95 56.63 1j0s s SER 7 Cb -0.03 -1.52 0.01 0.00 -1.71 0.00 0.00 66.02 62.78 1j0s s SER 7 CO -0.09 0.27 0.39 2.29 1.20 0.00 0.00 173.24 177.30 1j0s n LYS 8 N 2.84 0.56 -3.79 5.44 2.85 -0.47 -5.00 118.16 120.60 1j0s n LYS 8 Ca -0.18 -1.98 -0.36 0.00 -1.05 0.00 0.00 58.31 54.74 1j0s n LYS 8 Cb 0.53 1.98 -0.13 0.00 -0.65 0.00 0.00 35.03 36.76 1j0s n LYS 8 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 177.40 176.84 1j0s s LEU 9 N 0.00 3.38 -0.05 -5.58 1.43 -1.26 -0.43 118.68 116.18 1j0s s LEU 9 Ca 0.20 -0.22 0.05 0.00 -1.03 0.00 0.00 54.13 53.13 1j0s s LEU 9 Cb -0.01 -1.90 -0.01 0.00 0.03 0.00 0.00 46.19 44.30 1j0s s LEU 9 CO 0.14 -0.02 -0.19 -0.44 0.23 0.00 0.00 176.35 176.07 1j0s s SER 10 N 1.54 2.40 -0.09 2.29 0.01 -1.26 0.22 113.70 118.81 1j0s s SER 10 Ca 0.06 -0.39 -0.28 0.00 1.31 0.00 0.00 55.95 56.64 1j0s s SER 10 Cb -0.15 -0.64 -0.02 0.00 0.21 0.00 0.00 66.02 65.42 1j0s s SER 10 CO 0.03 0.18 0.94 -0.69 0.41 0.00 0.00 173.24 174.11 1j0s s VAL 11 N -0.04 4.85 -0.29 3.43 1.01 0.14 -4.68 120.40 124.82 1j0s s VAL 11 Ca -0.03 1.92 -0.06 0.00 0.00 0.00 0.00 61.98 63.81 1j0s s VAL 11 Cb -0.12 -4.26 0.01 0.00 0.00 0.00 0.00 36.38 32.01 1j0s s VAL 11 CO 0.02 0.07 0.07 -0.63 0.00 0.00 0.00 175.10 174.64 1j0s s ILE 12 N 1.66 3.86 0.31 2.22 1.01 -1.26 0.25 121.20 129.25 1j0s s ILE 12 Ca 0.46 -0.76 0.10 0.00 0.00 0.00 0.00 60.65 60.46 1j0s s ILE 12 Cb -0.19 -3.01 -0.05 0.00 0.01 0.00 0.00 42.46 39.23 1j0s s ILE 12 CO 0.20 0.07 -0.07 -0.13 0.00 0.00 0.00 174.94 175.00 1j0s s ARG 13 N 1.48 1.96 0.00 2.79 0.52 -0.10 -1.22 118.95 124.37 1j0s s ARG 13 Ca 0.02 -1.73 0.00 0.00 -0.52 0.00 0.00 55.73 53.50 1j0s s ARG 13 Cb -0.17 -1.89 0.00 0.00 0.52 0.00 0.00 34.95 33.41 1j0s s ARG 13 CO 0.02 0.23 0.00 0.27 0.02 0.00 0.00 175.30 175.84 1j0s n ASN 14 N -0.82 0.77 0.16 0.23 0.23 0.06 -1.30 115.26 114.58 1j0s n ASN 14 Ca -0.05 -0.23 0.02 0.00 -0.53 0.00 0.00 54.58 53.78 1j0s n ASN 14 Cb 0.61 0.00 0.22 0.00 -2.08 0.00 0.00 39.78 38.54 1j0s n ASN 14 CO 0.00 0.00 0.00 -0.07 -0.93 0.00 0.00 177.26 176.26 1j0s h LEU 15 N 0.00 0.00 -1.45 -4.53 -0.00 -1.88 -2.88 115.31 104.57 1j0s h LEU 15 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.88 1j0s h LEU 15 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.66 1j0s h LEU 15 CO 0.00 0.53 0.00 0.59 -0.00 0.00 0.00 178.44 179.56 1j0s n ASN 16 N -3.64 2.12 -1.67 -0.43 3.02 -1.26 -4.88 115.26 108.52 1j0s n ASN 16 Ca -0.01 -2.07 -0.14 0.00 -0.03 0.00 0.00 54.58 52.34 1j0s n ASN 16 Cb 0.59 -0.29 0.00 0.00 -0.61 0.00 0.00 39.78 39.47 1j0s n ASN 16 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1j0s n ASP 17 N 0.51 -4.27 -4.71 6.41 2.03 -1.09 -5.01 116.55 110.44 1j0s n ASP 17 Ca 0.12 -0.06 -0.35 0.00 0.52 0.00 0.00 54.79 55.02 1j0s n ASP 17 Cb 0.36 -3.36 -0.09 0.00 -0.72 0.00 0.00 41.12 37.31 1j0s n ASP 17 CO 0.00 0.00 0.00 -1.10 -1.92 0.00 0.00 177.20 174.18 1j0s s GLN 18 N -4.83 3.35 0.19 -0.67 -0.21 -1.26 -4.81 119.66 111.41 1j0s s GLN 18 Ca 0.05 -0.33 -0.25 0.00 0.02 0.00 0.00 55.36 54.84 1j0s s GLN 18 Cb -0.02 -2.98 -0.08 0.00 1.00 0.00 0.00 33.01 30.92 1j0s s GLN 18 CO 0.06 0.60 0.80 0.08 -2.12 0.00 0.00 175.29 174.72 1j0s s VAL 19 N -0.57 4.34 -0.09 1.09 1.01 0.12 -0.76 120.40 125.54 1j0s s VAL 19 Ca 0.10 1.72 -0.30 0.00 0.00 0.00 0.00 61.98 63.51 1j0s s VAL 19 Cb -0.12 -4.12 -0.05 0.00 0.00 0.00 0.00 36.38 32.09 1j0s s VAL 19 CO 0.02 0.46 1.58 -0.22 0.00 0.00 0.00 175.10 176.94 1j0s s LEU 20 N -1.31 4.27 0.13 3.92 2.96 -0.36 -1.39 118.68 126.90 1j0s s LEU 20 Ca 0.38 2.09 0.08 0.00 -0.22 0.00 0.00 54.13 56.46 1j0s s LEU 20 Cb -0.22 -3.53 -0.04 0.00 0.50 0.00 0.00 46.19 42.89 1j0s s LEU 20 CO 0.26 -0.91 -0.18 -0.36 -1.32 0.00 0.00 176.35 173.84 1j0s s PHE 21 N 4.01 1.70 0.21 5.38 0.40 -0.07 -4.74 117.98 124.87 1j0s s PHE 21 Ca 0.70 -0.47 -0.07 0.00 -0.60 0.00 0.00 56.93 56.49 1j0s s PHE 21 Cb -0.31 -0.89 -0.06 0.00 0.51 0.00 0.00 43.02 42.28 1j0s s PHE 21 CO 0.27 0.24 0.49 0.42 0.70 0.00 0.00 175.22 177.33 1j0s s ILE 22 N -1.74 5.03 0.54 0.64 -1.09 -1.26 -0.85 121.20 122.47 1j0s s ILE 22 Ca 0.10 0.24 0.06 0.00 -2.23 0.00 0.00 60.65 58.82 1j0s s ILE 22 Cb -0.07 -3.64 0.03 0.00 -1.58 0.00 0.00 42.46 37.20 1j0s s ILE 22 CO 0.05 -0.08 0.40 -0.62 -1.23 0.00 0.00 174.94 173.46 1j0s s ASP 23 N -2.54 4.64 0.66 3.58 2.15 -0.78 -4.91 116.67 119.49 1j0s s ASP 23 Ca 0.44 -1.22 0.43 0.00 0.43 0.00 0.00 52.55 52.63 1j0s s ASP 23 Cb -0.11 0.36 2.34 0.00 -0.30 0.00 0.00 42.92 45.20 1j0s s ASP 23 CO 0.24 -1.08 2.34 1.56 -0.17 0.00 0.00 175.17 178.06 1j0s h GLN 24 N 0.77 0.00 -0.44 4.34 4.20 -1.99 -0.40 115.11 121.59 1j0s h GLN 24 Ca -0.37 0.00 -0.08 0.00 0.06 0.00 0.00 58.65 58.26 1j0s h GLN 24 Cb 1.30 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 29.03 1j0s h GLN 24 CO 0.57 0.00 0.06 0.41 -0.67 0.00 0.00 178.83 179.20 1j0s n GLY 25 N -1.11 3.90 2.71 3.46 0.00 -1.26 -4.93 105.19 107.96 1j0s n GLY 25 Ca -0.03 -1.04 -0.22 0.00 0.00 0.00 0.00 46.02 44.73 1j0s n GLY 25 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1j0s n ASN 26 N -0.33 -6.08 -4.79 1.61 4.13 -0.16 -4.98 115.26 104.67 1j0s n ASN 26 Ca 0.29 -0.15 -0.37 0.00 1.68 0.00 0.00 54.58 56.02 1j0s n ASN 26 Cb 1.08 -4.98 -0.07 0.00 -1.54 0.00 0.00 39.78 34.27 1j0s n ASN 26 CO 0.00 0.00 0.00 -0.13 0.28 0.00 0.00 177.26 177.41 1j0s s ARG 27 N -5.38 3.99 -0.87 3.52 0.52 -1.26 -4.70 118.95 114.77 1j0s s ARG 27 Ca 0.15 0.08 -0.25 0.00 -0.52 0.00 0.00 55.73 55.19 1j0s s ARG 27 Cb -0.07 -3.33 0.03 0.00 0.52 0.00 0.00 34.95 32.11 1j0s s ARG 27 CO 0.19 0.47 1.41 -1.25 0.02 0.00 0.00 175.30 176.14 1j0s s PRO 28 N -0.22 3.33 -0.11 3.54 0.04 -1.26 -1.86 135.00 138.47 1j0s s PRO 28 Ca 0.17 -0.62 -0.00 0.00 0.04 0.00 0.00 61.00 60.58 1j0s s PRO 28 Cb -0.13 -4.78 -0.02 0.00 0.04 0.00 0.00 34.50 29.60 1j0s s PRO 28 CO 0.05 -2.25 -0.09 -0.51 0.04 0.00 0.00 177.00 174.24 1j0s s LEU 29 N 5.69 2.97 -0.12 -3.56 1.43 -0.03 -1.57 118.68 123.50 1j0s s LEU 29 Ca 0.43 -0.18 -0.26 0.00 -1.03 0.00 0.00 54.13 53.09 1j0s s LEU 29 Cb -0.04 -1.66 -0.02 0.00 0.03 0.00 0.00 46.19 44.49 1j0s s LEU 29 CO 0.03 0.25 0.84 -0.36 0.23 0.00 0.00 176.35 177.34 1j0s s PHE 30 N -0.13 3.49 0.28 0.29 0.08 -0.83 -0.89 117.98 120.27 1j0s s PHE 30 Ca 0.00 1.34 0.01 0.00 0.12 0.00 0.00 56.93 58.41 1j0s s PHE 30 Cb -0.13 -3.00 -0.03 0.00 -0.57 0.00 0.00 43.02 39.29 1j0s s PHE 30 CO 0.03 -0.14 0.28 -1.21 -0.10 0.00 0.00 175.22 174.08 1j0s s GLU 31 N 1.71 1.55 0.53 0.44 2.02 -0.49 -4.53 118.70 119.94 1j0s s GLU 31 Ca 0.41 -1.75 -0.16 0.00 0.02 0.00 0.00 54.97 53.48 1j0s s GLU 31 Cb -0.18 0.34 -0.07 0.00 0.10 0.00 0.00 34.13 34.32 1j0s s GLU 31 CO 0.16 -0.58 0.99 0.34 0.02 0.00 0.00 175.26 176.20 1j0s s ASP 32 N -3.23 6.54 -0.52 -0.19 -1.08 -1.26 0.16 116.67 117.08 1j0s s ASP 32 Ca 0.37 1.57 0.04 0.00 -0.52 0.00 0.00 52.55 54.01 1j0s s ASP 32 Cb 0.03 -2.51 0.13 0.00 -1.46 0.00 0.00 42.92 39.12 1j0s s ASP 32 CO 0.19 -0.65 0.26 -0.04 0.52 0.00 0.00 175.17 175.44 1j0s s MET 33 N -4.17 1.95 0.00 4.34 -1.94 -1.26 -4.85 119.30 113.37 1j0s s MET 33 Ca 0.59 -2.60 0.00 0.00 -1.71 0.00 0.00 55.69 51.97 1j0s s MET 33 Cb -0.10 -3.29 0.00 0.00 2.01 0.00 0.00 34.83 33.45 1j0s s MET 33 CO 0.34 -1.11 0.00 0.25 -0.01 0.00 0.00 175.02 174.49 1j0s n THR 34 N 3.13 0.00 -3.13 2.05 -2.24 -1.26 -4.92 114.28 107.91 1j0s n THR 34 Ca 0.05 0.00 -0.15 0.00 -2.27 0.00 0.00 64.05 61.68 1j0s n THR 34 Cb 0.32 -0.32 -0.02 0.00 -2.10 0.00 0.00 70.33 68.21 1j0s n THR 34 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1j0s n ASP 35 N 0.00 -1.76 0.22 3.42 8.00 -1.26 -4.73 116.55 120.43 1j0s n ASP 35 Ca 0.00 -0.08 0.15 0.00 0.71 0.00 0.00 54.79 55.57 1j0s n ASP 35 Cb 0.00 -1.58 0.79 0.00 -0.02 0.00 0.00 41.12 40.31 1j0s n ASP 35 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 1j0s h SER 36 N -0.34 0.00 0.19 -2.24 0.02 -1.99 1.01 113.55 110.20 1j0s h SER 36 Ca -0.23 0.00 -0.35 0.00 -0.84 0.00 0.00 61.79 60.37 1j0s h SER 36 Cb 1.15 0.00 -0.04 0.00 0.14 0.00 0.00 62.40 63.65 1j0s h SER 36 CO 0.32 0.00 -2.04 0.47 -1.14 0.00 0.00 176.83 174.44 1j0s n ASP 37 N -2.56 1.52 0.03 3.07 8.00 -1.26 -4.39 116.55 120.96 1j0s n ASP 37 Ca -0.02 0.19 0.05 0.00 0.71 0.00 0.00 54.79 55.72 1j0s n ASP 37 Cb 0.07 -0.36 -0.09 0.00 -0.02 0.00 0.00 41.12 40.72 1j0s n ASP 37 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1j0s h ARG 39 N 0.00 0.00 0.00 0.00 0.11 0.85 0.58 114.38 115.92 1j0s h ARG 39 Ca -0.11 0.00 -0.02 0.00 0.10 0.00 0.00 59.98 59.94 1j0s h ARG 39 Cb 1.33 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 32.40 1j0s h ARG 39 CO 0.02 0.00 -0.12 0.22 0.10 0.00 0.00 179.97 180.19 1j0s h ASP 40 N 0.00 0.00 -0.15 0.08 3.58 -1.80 -3.18 116.42 114.95 1j0s h ASP 40 Ca 0.38 0.00 -0.20 0.00 0.42 0.00 0.00 57.03 57.63 1j0s h ASP 40 Cb 1.64 0.00 -0.39 0.00 1.72 0.00 0.00 39.33 42.30 1j0s h ASP 40 CO -0.00 0.12 -1.05 0.59 -2.88 0.00 0.00 179.24 176.01 1j0s n ASN 41 N -4.17 1.14 -4.69 2.28 3.02 0.13 -5.09 115.26 107.88 1j0s n ASN 41 Ca -0.02 -2.01 -0.35 0.00 -0.03 0.00 0.00 54.58 52.17 1j0s n ASN 41 Cb 0.20 -0.34 -0.09 0.00 -0.61 0.00 0.00 39.78 38.93 1j0s n ASN 41 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1j0s s ALA 42 N -1.31 3.37 -0.19 5.41 0.00 0.16 -5.01 121.76 124.18 1j0s s ALA 42 Ca 0.31 -0.77 0.19 0.00 0.00 0.00 0.00 51.96 51.69 1j0s s ALA 42 Cb 0.36 -1.62 -0.03 0.00 0.00 0.00 0.00 23.12 21.83 1j0s s ALA 42 CO -0.12 0.50 1.03 -1.00 0.00 0.00 0.00 175.76 176.17 1j0s h PRO 43 N 5.49 0.00 -6.95 0.00 0.13 -1.91 -3.47 132.00 125.29 1j0s h PRO 43 Ca -0.48 0.00 -0.56 0.00 -0.87 0.00 0.00 66.00 64.09 1j0s h PRO 43 Cb 1.19 0.00 0.14 0.00 0.13 0.00 0.00 31.00 32.47 1j0s h PRO 43 CO 0.58 0.18 0.46 0.54 -0.23 0.00 0.00 178.00 179.52 1j0s n ARG 44 N -2.86 1.50 -3.62 0.86 1.74 -1.26 -5.01 116.66 108.00 1j0s n ARG 44 Ca -0.04 0.55 -0.08 0.00 -0.77 0.00 0.00 57.85 57.52 1j0s n ARG 44 Cb 0.69 -2.43 -0.02 0.00 -1.02 0.00 0.00 32.46 29.68 1j0s n ARG 44 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 1j0s s THR 45 N -1.33 0.00 1.29 0.55 2.01 -1.26 -5.10 115.64 111.80 1j0s s THR 45 Ca 0.71 -0.40 -0.17 0.00 0.31 0.00 0.00 61.69 62.13 1j0s s THR 45 Cb -0.44 -1.47 0.32 0.00 0.01 0.00 0.00 72.50 70.92 1j0s s THR 45 CO 0.50 0.00 0.87 0.00 -0.69 0.00 0.00 174.62 175.29 1j0s n ILE 46 N -0.39 0.00 -2.50 1.82 0.00 -1.26 -4.93 119.36 112.10 1j0s n ILE 46 Ca -0.10 -0.31 -0.33 0.00 0.00 0.00 0.00 62.75 62.02 1j0s n ILE 46 Cb 0.62 -0.95 -0.04 0.00 0.00 0.00 0.00 39.64 39.27 1j0s n ILE 46 CO 0.00 0.00 0.00 -0.36 0.00 0.00 0.00 176.55 176.19 1j0s s PHE 47 N -2.27 3.23 0.48 9.51 0.08 -1.26 -4.84 117.98 122.91 1j0s s PHE 47 Ca 0.66 1.54 -0.16 0.00 0.12 0.00 0.00 56.93 59.10 1j0s s PHE 47 Cb -0.20 -2.91 -0.08 0.00 -0.57 0.00 0.00 43.02 39.27 1j0s s PHE 47 CO 0.62 -0.52 0.93 0.42 -0.10 0.00 0.00 175.22 176.57 1j0s s ILE 48 N -2.32 4.56 -0.15 0.64 1.09 0.15 -4.15 121.20 121.02 1j0s s ILE 48 Ca 0.63 1.14 -0.00 0.00 -1.10 0.00 0.00 60.65 61.32 1j0s s ILE 48 Cb -0.12 -3.70 0.03 0.00 -1.06 0.00 0.00 42.46 37.61 1j0s s ILE 48 CO 0.24 -0.59 -0.09 -0.63 -0.10 0.00 0.00 174.94 173.77 1j0s s ILE 49 N -2.49 1.29 -0.24 2.92 -1.09 0.43 -1.18 121.20 120.83 1j0s s ILE 49 Ca 0.58 -0.56 -0.09 0.00 -2.23 0.00 0.00 60.65 58.35 1j0s s ILE 49 Cb -0.10 -1.31 -0.04 0.00 -1.58 0.00 0.00 42.46 39.43 1j0s s ILE 49 CO 0.28 0.32 0.12 -0.44 -1.23 0.00 0.00 174.94 173.99 1j0s s SER 50 N 1.59 5.67 -0.16 3.58 0.01 -0.21 -1.36 113.70 122.80 1j0s s SER 50 Ca 0.03 -0.03 -0.15 0.00 1.31 0.00 0.00 55.95 57.11 1j0s s SER 50 Cb -0.14 -2.02 -0.04 0.00 0.21 0.00 0.00 66.02 64.03 1j0s s SER 50 CO -0.09 0.02 0.36 -0.04 0.41 0.00 0.00 173.24 173.90 1j0s s MET 51 N 1.30 4.25 0.13 12.44 -1.94 0.78 -1.11 119.30 135.15 1j0s s MET 51 Ca 0.06 0.19 -0.03 0.00 -1.71 0.00 0.00 55.69 54.20 1j0s s MET 51 Cb -0.15 -3.46 -0.05 0.00 2.01 0.00 0.00 34.83 33.18 1j0s s MET 51 CO 0.05 0.14 0.33 0.71 -0.01 0.00 0.00 175.02 176.25 1j0s s TYR 52 N 0.74 3.49 -0.59 -0.03 1.51 -0.43 0.10 117.35 122.14 1j0s s TYR 52 Ca 0.19 0.46 -0.23 0.00 -1.01 0.00 0.00 57.07 56.47 1j0s s TYR 52 Cb -0.14 -1.93 0.05 0.00 -0.11 0.00 0.00 41.96 39.84 1j0s s TYR 52 CO 0.06 0.47 0.93 0.21 -1.11 0.00 0.00 175.55 176.12 1j0s s LYS 53 N -2.68 3.23 -0.04 -0.62 2.47 0.10 -4.58 119.74 117.62 1j0s s LYS 53 Ca 0.39 -0.51 -0.03 0.00 -1.56 0.00 0.00 55.97 54.26 1j0s s LYS 53 Cb -0.12 -4.12 0.02 0.00 -1.46 0.00 0.00 37.83 32.15 1j0s s LYS 53 CO 0.26 -1.60 0.11 -0.51 0.16 0.00 0.00 175.35 173.77 1j0s s ASP 54 N 3.14 -0.10 -0.56 1.43 1.01 -1.26 -3.98 116.67 116.35 1j0s s ASP 54 Ca 0.26 0.23 -0.04 0.00 0.71 0.00 0.00 52.55 53.71 1j0s s ASP 54 Cb -0.14 0.20 0.09 0.00 1.01 0.00 0.00 42.92 44.07 1j0s s ASP 54 CO 0.15 -0.07 2.69 -1.20 0.21 0.00 0.00 175.17 176.95 1j0s n SER 55 N 3.34 6.68 -4.78 0.27 7.64 -1.26 -4.96 113.62 120.55 1j0s n SER 55 Ca -0.16 -3.25 -0.35 0.00 1.01 0.00 0.00 58.87 56.12 1j0s n SER 55 Cb 0.57 -1.23 -0.01 0.00 -1.01 0.00 0.00 64.21 62.53 1j0s n SER 55 CO 0.00 0.00 0.00 -1.10 -3.01 0.00 0.00 175.04 170.93 1j0s s GLN 56 N -1.84 3.61 0.07 1.43 -1.52 -1.26 -4.97 119.66 115.18 1j0s s GLN 56 Ca 0.58 1.59 -0.17 0.00 -1.95 0.00 0.00 55.36 55.41 1j0s s GLN 56 Cb 0.37 -2.17 -0.12 0.00 -0.22 0.00 0.00 33.01 30.87 1j0s s GLN 56 CO -0.22 -0.63 1.35 -1.00 -0.25 0.00 0.00 175.29 174.53 1j0s h PRO 57 N 1.59 0.59 -2.07 2.91 0.13 -2.07 -3.42 132.00 129.66 1j0s h PRO 57 Ca -0.50 -0.36 -0.34 0.00 -0.87 0.00 0.00 66.00 63.93 1j0s h PRO 57 Cb 1.25 0.04 -0.32 0.00 0.13 0.00 0.00 31.00 32.09 1j0s h PRO 57 CO 0.59 0.97 -0.66 0.50 -0.23 0.00 0.00 178.00 179.17 1j0s s ARG 58 N -4.13 0.45 0.00 0.86 6.06 -1.26 -5.11 118.95 115.82 1j0s s ARG 58 Ca -0.13 -0.42 0.00 0.00 -2.50 0.00 0.00 55.73 52.68 1j0s s ARG 58 Cb 0.07 -0.68 0.00 0.00 0.06 0.00 0.00 34.95 34.40 1j0s s ARG 58 CO 0.82 -1.10 0.00 0.41 -2.50 0.00 0.00 175.30 172.93 1j0s n GLY 59 N 4.89 3.78 3.67 8.12 0.00 -1.26 -5.04 105.19 119.35 1j0s n GLY 59 Ca 0.03 -0.33 -0.37 0.00 0.00 0.00 0.00 46.02 45.36 1j0s n GLY 59 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1j0s s MET 60 N -1.93 4.09 -0.37 1.61 1.75 -0.31 -4.71 119.30 119.43 1j0s s MET 60 Ca 0.00 -0.22 -0.28 0.00 -1.25 0.00 0.00 55.69 53.94 1j0s s MET 60 Cb 0.00 -3.53 0.02 0.00 2.84 0.00 0.00 34.83 34.16 1j0s s MET 60 CO 0.00 0.07 1.05 0.00 -0.65 0.00 0.00 175.02 175.49 1j0s s ALA 61 N 1.01 3.40 0.24 4.11 0.00 -1.25 -0.53 121.76 128.74 1j0s s ALA 61 Ca 0.09 -0.26 0.01 0.00 0.00 0.00 0.00 51.96 51.79 1j0s s ALA 61 Cb -0.13 -3.69 -0.04 0.00 0.00 0.00 0.00 23.12 19.26 1j0s s ALA 61 CO 0.04 -1.69 0.12 0.14 0.00 0.00 0.00 175.76 174.37 1j0s s VAL 62 N 3.78 0.26 -0.19 0.00 -7.23 -0.28 -1.32 120.40 115.43 1j0s s VAL 62 Ca 0.44 -2.00 -0.06 0.00 -1.81 0.00 0.00 61.98 58.55 1j0s s VAL 62 Cb -0.11 -2.56 0.09 0.00 0.56 0.00 0.00 36.38 34.36 1j0s s VAL 62 CO 0.20 0.00 0.38 0.42 -0.31 0.00 0.00 175.10 175.79 1j0s s THR 63 N -3.92 -0.60 -0.13 5.32 -4.23 -0.26 -0.49 115.64 111.32 1j0s s THR 63 Ca 0.38 0.17 -0.16 0.00 -1.18 0.00 0.00 61.69 60.91 1j0s s THR 63 Cb 0.07 -0.63 -0.04 0.00 1.34 0.00 0.00 72.50 73.23 1j0s s THR 63 CO 0.14 0.06 0.38 -0.63 -0.54 0.00 0.00 174.62 174.03 1j0s s ILE 64 N 2.57 5.24 -0.05 2.99 1.01 -1.26 -1.05 121.20 130.65 1j0s s ILE 64 Ca 0.00 0.74 -0.06 0.00 0.00 0.00 0.00 60.65 61.33 1j0s s ILE 64 Cb -0.12 -3.72 0.01 0.00 0.01 0.00 0.00 42.46 38.64 1j0s s ILE 64 CO -0.12 0.37 0.16 -0.94 0.00 0.00 0.00 174.94 174.41 1j0s s SER 65 N 0.46 -0.12 -0.14 3.58 1.04 -0.33 -0.81 113.70 117.38 1j0s s SER 65 Ca 0.21 0.20 -0.07 0.00 0.48 0.00 0.00 55.95 56.77 1j0s s SER 65 Cb -0.14 0.31 -0.04 0.00 0.10 0.00 0.00 66.02 66.24 1j0s s SER 65 CO 0.07 -0.14 0.10 0.54 0.98 0.00 0.00 173.24 174.80 1j0s s VAL 66 N -0.28 5.16 -0.03 5.02 0.11 0.62 0.30 120.40 131.30 1j0s s VAL 66 Ca -0.04 0.08 0.05 0.00 -2.93 0.00 0.00 61.98 59.14 1j0s s VAL 66 Cb -0.03 -3.27 -0.01 0.00 -1.53 0.00 0.00 36.38 31.55 1j0s s VAL 66 CO 0.01 0.56 -0.16 -0.54 -3.33 0.00 0.00 175.10 171.63 1j0s s LYS 67 N -0.50 1.56 0.00 1.54 1.02 -1.26 -1.37 119.74 120.72 1j0s s LYS 67 Ca 0.11 -0.58 0.00 0.00 0.02 0.00 0.00 55.97 55.52 1j0s s LYS 67 Cb -0.12 -1.41 0.00 0.00 -0.52 0.00 0.00 37.83 35.78 1j0s s LYS 67 CO 0.02 0.28 0.00 0.00 -0.92 0.00 0.00 175.35 174.73 1j0s n GLU 69 N 0.00 0.66 -3.62 0.00 1.02 -1.26 -4.93 120.64 112.51 1j0s n GLU 69 Ca 0.00 0.11 -0.03 0.00 -0.02 0.00 0.00 57.16 57.22 1j0s n GLU 69 Cb 0.00 -1.65 -0.05 0.00 -0.02 0.00 0.00 31.44 29.71 1j0s n GLU 69 CO 0.00 0.00 0.00 -1.59 1.18 0.00 0.00 177.13 176.72 1j0s s LYS 70 N -2.71 0.57 -0.05 3.49 0.00 -1.26 -5.13 119.74 114.66 1j0s s LYS 70 Ca -0.07 1.25 -0.30 0.00 0.00 0.00 0.00 55.97 56.86 1j0s s LYS 70 Cb 0.08 0.56 -0.07 0.00 0.00 0.00 0.00 37.83 38.40 1j0s s LYS 70 CO 0.83 -0.17 1.85 0.42 0.00 0.00 0.00 175.35 178.29 1j0s s ILE 71 N 2.37 3.29 0.06 3.79 1.01 -1.26 -4.66 121.20 125.80 1j0s s ILE 71 Ca -0.07 0.34 0.06 0.00 0.00 0.00 0.00 60.65 60.98 1j0s s ILE 71 Cb -0.09 -3.24 -0.03 0.00 0.01 0.00 0.00 42.46 39.11 1j0s s ILE 71 CO -0.19 -0.06 -0.16 -0.55 0.00 0.00 0.00 174.94 173.98 1j0s s SER 72 N 4.47 1.91 -0.07 3.58 0.15 -0.47 -2.21 113.70 121.07 1j0s s SER 72 Ca 0.83 -0.57 0.05 0.00 0.70 0.00 0.00 55.95 56.96 1j0s s SER 72 Cb -0.36 -0.10 -0.01 0.00 -1.71 0.00 0.00 66.02 63.84 1j0s s SER 72 CO 0.35 0.01 -0.23 -0.89 1.20 0.00 0.00 173.24 173.68 1j0s s THR 73 N -1.07 1.94 -0.51 6.45 2.01 -0.44 -0.27 115.64 123.74 1j0s s THR 73 Ca 0.02 -0.98 -0.27 0.00 0.31 0.00 0.00 61.69 60.76 1j0s s THR 73 Cb -0.09 -1.66 -0.03 0.00 0.01 0.00 0.00 72.50 70.74 1j0s s THR 73 CO 0.02 0.54 1.92 -0.22 -0.69 0.00 0.00 174.62 176.19 1j0s s LEU 74 N 0.05 3.37 0.04 4.42 2.96 0.01 -1.29 118.68 128.25 1j0s s LEU 74 Ca -0.09 0.73 0.04 0.00 -0.22 0.00 0.00 54.13 54.59 1j0s s LEU 74 Cb -0.15 -2.81 -0.04 0.00 0.50 0.00 0.00 46.19 43.69 1j0s s LEU 74 CO 0.05 -2.26 -0.05 -0.94 -1.32 0.00 0.00 176.35 171.84 1j0s s SER 75 N 8.12 4.74 -0.34 3.68 1.04 0.23 -4.45 113.70 126.73 1j0s s SER 75 Ca 0.75 -0.18 -0.00 0.00 0.48 0.00 0.00 55.95 57.00 1j0s s SER 75 Cb -0.16 -1.09 0.08 0.00 0.10 0.00 0.00 66.02 64.94 1j0s s SER 75 CO 0.25 0.23 0.06 0.00 0.98 0.00 0.00 173.24 174.77 1j0s n GLU 77 N 4.51 0.00 0.00 0.00 0.28 -1.13 -4.68 120.64 119.63 1j0s n GLU 77 Ca -0.06 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 56.94 1j0s n GLU 77 Cb 0.42 0.00 0.00 0.00 1.43 0.00 0.00 31.44 33.29 1j0s n GLU 77 CO 0.00 0.00 0.00 -1.71 -0.16 0.00 0.00 177.13 175.26 1j0s n ASN 78 N 0.00 0.00 0.00 -1.84 5.15 -1.26 -4.88 115.26 112.43 1j0s n ASN 78 Ca 0.00 0.05 0.00 0.00 -0.60 0.00 0.00 54.58 54.03 1j0s n ASN 78 Cb 0.00 -0.46 0.00 0.00 -0.53 0.00 0.00 39.78 38.79 1j0s n ASN 78 CO 0.00 0.00 0.00 2.29 1.40 0.00 0.00 177.26 180.95 1j0s n LYS 79 N -2.37 3.48 -3.41 1.20 -0.00 -1.26 -5.06 118.16 110.73 1j0s n LYS 79 Ca 0.00 -0.14 -0.20 0.00 -0.00 0.00 0.00 58.31 57.97 1j0s n LYS 79 Cb 0.00 -0.57 -0.01 0.00 -0.00 0.00 0.00 35.03 34.44 1j0s n LYS 79 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.40 177.82 1j0s s ILE 80 N -0.54 2.64 -0.09 0.58 1.01 -1.26 -4.02 121.20 119.52 1j0s s ILE 80 Ca 0.00 -1.25 0.04 0.00 0.00 0.00 0.00 60.65 59.44 1j0s s ILE 80 Cb 0.00 -2.89 -0.01 0.00 0.01 0.00 0.00 42.46 39.57 1j0s s ILE 80 CO 0.00 0.00 -0.21 -0.63 0.00 0.00 0.00 174.94 174.10 1j0s s ILE 81 N -2.48 2.40 0.02 2.92 -1.09 -1.26 -2.82 121.20 118.90 1j0s s ILE 81 Ca 0.50 -0.92 -0.06 0.00 -2.23 0.00 0.00 60.65 57.94 1j0s s ILE 81 Cb -0.05 -1.93 -0.01 0.00 -1.58 0.00 0.00 42.46 38.89 1j0s s ILE 81 CO 0.29 0.56 0.10 -0.44 -1.23 0.00 0.00 174.94 174.22 1j0s s SER 82 N 0.10 0.11 -0.25 3.58 0.01 0.38 -4.99 113.70 112.64 1j0s s SER 82 Ca -0.10 -0.36 -0.16 0.00 1.31 0.00 0.00 55.95 56.65 1j0s s SER 82 Cb -0.16 0.20 -0.04 0.00 0.21 0.00 0.00 66.02 66.24 1j0s s SER 82 CO 0.06 -0.41 0.41 -0.36 0.41 0.00 0.00 173.24 173.35 1j0s s PHE 83 N -1.82 3.28 -0.31 2.43 0.40 -1.26 -0.60 117.98 120.10 1j0s s PHE 83 Ca -0.12 0.51 -0.08 0.00 -0.60 0.00 0.00 56.93 56.64 1j0s s PHE 83 Cb -0.06 -2.59 0.01 0.00 0.51 0.00 0.00 43.02 40.89 1j0s s PHE 83 CO -0.01 -0.19 0.12 0.15 0.70 0.00 0.00 175.22 176.00 1j0s s LYS 84 N 1.94 3.13 -0.60 0.44 3.01 -0.41 -4.90 119.74 122.35 1j0s s LYS 84 Ca 0.17 -0.85 -0.26 0.00 -1.01 0.00 0.00 55.97 54.02 1j0s s LYS 84 Cb -0.15 -3.49 -0.06 0.00 -1.01 0.00 0.00 37.83 33.11 1j0s s LYS 84 CO 0.09 -0.48 2.21 -1.21 0.51 0.00 0.00 175.35 176.48 1j0s s GLU 85 N 1.54 2.22 -0.29 1.68 8.01 -1.26 -1.33 118.70 129.27 1j0s s GLU 85 Ca 0.03 0.92 -0.20 0.00 0.01 0.00 0.00 54.97 55.73 1j0s s GLU 85 Cb -0.17 -4.59 0.16 0.00 -4.31 0.00 0.00 34.13 25.21 1j0s s GLU 85 CO 0.04 -3.28 1.12 0.00 0.01 0.00 0.00 175.26 173.15 1j0s s MET 86 N 7.89 0.31 0.38 1.61 0.23 -0.94 -4.95 119.30 123.83 1j0s s MET 86 Ca 0.86 0.45 -0.26 0.00 -1.03 0.00 0.00 55.69 55.71 1j0s s MET 86 Cb -0.14 0.11 -0.09 0.00 -1.53 0.00 0.00 34.83 33.18 1j0s s MET 86 CO 0.20 -0.05 1.12 1.21 -2.03 0.00 0.00 175.02 175.47 1j0s s ASN 87 N 0.71 6.74 0.20 -1.18 2.47 -1.26 -4.07 114.94 118.54 1j0s s ASN 87 Ca -0.02 2.23 -0.33 0.00 0.42 0.00 0.00 52.86 55.16 1j0s s ASN 87 Cb -0.04 -2.61 -0.14 0.00 -1.45 0.00 0.00 41.25 37.02 1j0s s ASN 87 CO -0.12 -0.52 1.50 -0.81 -3.72 0.00 0.00 177.10 173.44 1j0s n PRO 88 N 0.23 2.11 -1.63 0.43 -0.04 -1.26 -4.99 135.00 129.85 1j0s n PRO 88 Ca 0.04 0.76 -0.29 0.00 -0.04 0.00 0.00 63.50 63.96 1j0s n PRO 88 Cb 0.47 -2.47 0.17 0.00 -0.04 0.00 0.00 33.50 31.62 1j0s n PRO 88 CO 0.00 0.00 0.00 -1.25 -0.04 0.00 0.00 175.50 174.21 1j0s s PRO 89 N 0.27 0.64 -0.23 0.54 0.04 -1.26 -5.03 135.00 129.97 1j0s s PRO 89 Ca 0.74 -0.04 0.06 0.00 0.04 0.00 0.00 61.00 61.80 1j0s s PRO 89 Cb -0.66 -1.81 -0.18 0.00 0.04 0.00 0.00 34.50 31.89 1j0s s PRO 89 CO 0.44 -2.47 -0.13 -0.25 0.04 0.00 0.00 177.00 174.62 1j0s n ASP 90 N -3.89 1.57 -3.70 6.66 8.00 -1.26 -4.71 116.55 119.22 1j0s n ASP 90 Ca 0.11 -0.09 -0.25 0.00 0.71 0.00 0.00 54.79 55.27 1j0s n ASP 90 Cb 0.60 0.01 -0.17 0.00 -0.02 0.00 0.00 41.12 41.54 1j0s n ASP 90 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1j0s s ASN 91 N -6.07 2.20 -0.23 -2.24 2.20 -1.26 -1.48 114.94 108.06 1j0s s ASN 91 Ca -0.26 -0.46 -0.12 0.00 -0.94 0.00 0.00 52.86 51.08 1j0s s ASN 91 Cb 0.08 -0.41 -0.05 0.00 -2.00 0.00 0.00 41.25 38.87 1j0s s ASN 91 CO 0.63 -0.28 0.24 -0.63 -2.94 0.00 0.00 177.10 174.11 1j0s s ILE 92 N 2.00 5.31 0.00 0.54 1.01 -0.70 -4.97 121.20 124.39 1j0s s ILE 92 Ca 0.02 0.34 -0.25 0.00 0.00 0.00 0.00 60.65 60.77 1j0s s ILE 92 Cb -0.15 -3.57 -0.18 0.00 0.01 0.00 0.00 42.46 38.57 1j0s s ILE 92 CO -0.07 0.31 1.27 0.11 0.00 0.00 0.00 174.94 176.56 1j0s h LYS 93 N 7.49 -0.19 -7.24 2.79 6.56 -1.95 -2.38 116.57 121.65 1j0s h LYS 93 Ca -0.37 0.01 -0.53 0.00 -1.06 0.00 0.00 60.65 58.70 1j0s h LYS 93 Cb 1.17 0.04 0.19 0.00 -0.57 0.00 0.00 32.23 33.06 1j0s h LYS 93 CO 0.67 0.17 0.28 -0.51 -2.06 0.00 0.00 179.45 178.01 1j0s s ASP 94 N -5.36 3.31 0.20 0.86 1.11 -1.26 -4.72 116.67 110.82 1j0s s ASP 94 Ca -0.15 2.26 0.19 0.00 0.18 0.00 0.00 52.55 55.03 1j0s s ASP 94 Cb 0.02 -2.58 0.01 0.00 1.07 0.00 0.00 42.92 41.45 1j0s s ASP 94 CO 0.60 -2.85 1.13 0.74 1.18 0.00 0.00 175.17 175.97 1j0s h THR 95 N -1.37 0.35 -3.00 -1.27 2.02 -1.89 -3.42 112.91 104.33 1j0s h THR 95 Ca -0.45 -1.60 -0.51 0.00 0.77 0.00 0.00 66.41 64.63 1j0s h THR 95 Cb 1.28 1.95 -0.40 0.00 -1.74 0.00 0.00 68.15 69.23 1j0s h THR 95 CO 0.44 0.20 -0.76 -1.59 0.37 0.00 0.00 175.52 174.18 1j0s s LYS 96 N -3.11 0.27 0.30 6.66 0.00 -1.26 -4.90 119.74 117.71 1j0s s LYS 96 Ca 0.01 -0.40 -0.03 0.00 0.00 0.00 0.00 55.97 55.54 1j0s s LYS 96 Cb 0.08 -1.65 -0.05 0.00 0.00 0.00 0.00 37.83 36.22 1j0s s LYS 96 CO 0.77 -0.83 0.55 0.45 0.00 0.00 0.00 175.35 176.29 1j0s s SER 97 N 2.02 6.40 0.52 0.03 0.15 -1.26 -4.75 113.70 116.81 1j0s s SER 97 Ca 0.05 0.64 0.25 0.00 0.70 0.00 0.00 55.95 57.58 1j0s s SER 97 Cb -0.16 -2.11 1.42 0.00 -1.71 0.00 0.00 66.02 63.46 1j0s s SER 97 CO -0.21 -0.22 2.10 -2.24 1.20 0.00 0.00 173.24 173.87 1j0s h ASP 98 N 1.45 0.00 0.49 5.45 3.04 -1.94 -2.52 116.42 122.38 1j0s h ASP 98 Ca -0.48 0.00 -0.30 0.00 -3.24 0.00 0.00 57.03 53.01 1j0s h ASP 98 Cb 1.20 0.00 -0.04 0.00 -1.04 0.00 0.00 39.33 39.45 1j0s h ASP 98 CO 0.65 0.11 -1.66 0.16 -2.04 0.00 0.00 179.24 176.45 1j0s h ILE 99 N 0.00 0.93 -3.25 4.15 3.07 -1.90 0.15 117.51 120.66 1j0s h ILE 99 Ca -0.00 -2.73 -0.54 0.00 1.55 0.00 0.00 64.86 63.14 1j0s h ILE 99 Cb 0.25 2.51 0.09 0.00 -0.27 0.00 0.00 36.82 39.39 1j0s h ILE 99 CO 0.01 0.63 0.85 -0.38 -1.05 0.00 0.00 178.15 178.21 1j0s n ILE 100 N -3.18 1.07 -4.20 0.16 2.08 -0.95 -4.56 119.36 109.79 1j0s n ILE 100 Ca -0.17 -0.27 -0.20 0.00 0.56 0.00 0.00 62.75 62.67 1j0s n ILE 100 Cb 1.04 -1.91 -0.12 0.00 -0.75 0.00 0.00 39.64 37.90 1j0s n ILE 100 CO 0.00 0.00 0.00 -0.36 0.56 0.00 0.00 176.55 176.75 1j0s s PHE 101 N -0.08 1.36 -0.60 1.39 0.08 0.35 -3.79 117.98 116.70 1j0s s PHE 101 Ca 0.64 -0.46 -0.02 0.00 0.12 0.00 0.00 56.93 57.21 1j0s s PHE 101 Cb -0.51 -0.75 0.15 0.00 -0.57 0.00 0.00 43.02 41.34 1j0s s PHE 101 CO 0.50 0.10 0.40 -0.06 -0.10 0.00 0.00 175.22 176.05 1j0s s PHE 102 N -1.33 3.39 0.12 0.36 0.08 -0.31 -1.13 117.98 119.17 1j0s s PHE 102 Ca 0.01 -2.76 -0.30 0.00 0.12 0.00 0.00 56.93 53.99 1j0s s PHE 102 Cb -0.10 -3.15 -0.07 0.00 -0.57 0.00 0.00 43.02 39.14 1j0s s PHE 102 CO 0.03 -0.84 1.15 -1.14 -0.10 0.00 0.00 175.22 174.32 1j0s s GLN 103 N -0.01 4.51 -0.11 0.44 0.74 0.31 -0.23 119.66 125.30 1j0s s GLN 103 Ca 0.16 1.75 -0.02 0.00 0.05 0.00 0.00 55.36 57.30 1j0s s GLN 103 Cb -0.21 -3.31 0.04 0.00 1.10 0.00 0.00 33.01 30.63 1j0s s GLN 103 CO -0.03 -0.10 0.02 1.03 -0.55 0.00 0.00 175.29 175.67 1j0s s ARG 104 N 0.32 0.51 0.64 1.67 1.81 0.60 -1.17 118.95 123.35 1j0s s ARG 104 Ca 0.54 -0.04 -0.18 0.00 -1.72 0.00 0.00 55.73 54.33 1j0s s ARG 104 Cb -0.29 -1.35 -0.02 0.00 -0.45 0.00 0.00 34.95 32.83 1j0s s ARG 104 CO 0.32 -0.44 1.22 -1.13 -0.68 0.00 0.00 175.30 174.59 1j0s n SER 105 N 5.14 1.77 -4.67 0.23 3.41 -1.26 0.24 113.62 118.49 1j0s n SER 105 Ca -0.07 0.82 -0.35 0.00 -0.26 0.00 0.00 58.87 59.01 1j0s n SER 105 Cb 0.49 -1.52 -0.09 0.00 -0.26 0.00 0.00 64.21 62.83 1j0s n SER 105 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1j0s s VAL 106 N -1.42 4.90 0.73 -3.33 1.01 -0.19 -4.82 120.40 117.28 1j0s s VAL 106 Ca 0.81 0.00 -0.09 0.00 0.00 0.00 0.00 61.98 62.70 1j0s s VAL 106 Cb -0.39 -3.20 0.05 0.00 0.00 0.00 0.00 36.38 32.85 1j0s s VAL 106 CO 0.42 0.48 1.07 -2.16 0.00 0.00 0.00 175.10 174.91 1j0s s PRO 107 N 0.19 2.32 -1.41 2.72 0.04 -1.26 -4.29 135.00 133.31 1j0s s PRO 107 Ca 0.05 0.03 -0.10 0.00 0.04 0.00 0.00 61.00 61.02 1j0s s PRO 107 Cb -0.12 -2.08 0.03 0.00 0.04 0.00 0.00 34.50 32.38 1j0s s PRO 107 CO 0.00 -1.26 1.09 0.41 0.04 0.00 0.00 177.00 177.28 1j0s n GLY 108 N -3.04 -0.51 2.39 0.56 0.00 -1.26 -4.95 105.19 98.38 1j0s n GLY 108 Ca 0.07 0.22 -0.05 0.00 0.00 0.00 0.00 46.02 46.26 1j0s n GLY 108 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1j0s n HIS 109 N -4.83 -1.80 0.00 1.61 8.25 -1.26 -5.11 115.22 112.07 1j0s n HIS 109 Ca -0.01 -1.15 0.00 0.00 -0.26 0.00 0.00 57.72 56.30 1j0s n HIS 109 Cb 0.56 0.57 0.00 0.00 1.12 0.00 0.00 29.99 32.24 1j0s n HIS 109 CO 0.00 0.00 0.00 -0.25 0.64 0.00 0.00 176.34 176.73 1j0s n ASP 110 N -1.31 0.00 -2.75 0.41 9.92 -1.26 -4.89 116.55 116.66 1j0s n ASP 110 Ca -0.05 0.30 -0.06 0.00 -0.53 0.00 0.00 54.79 54.45 1j0s n ASP 110 Cb 0.38 -0.00 0.03 0.00 -0.64 0.00 0.00 41.12 40.88 1j0s n ASP 110 CO 0.00 0.00 0.00 -3.20 0.13 0.00 0.00 177.20 174.13 1j0s n ASN 111 N -0.51 -3.19 -4.90 -2.24 5.15 -1.26 -5.07 115.26 103.23 1j0s n ASN 111 Ca 0.00 -3.09 -0.20 0.00 -0.60 0.00 0.00 54.58 50.69 1j0s n ASN 111 Cb 0.00 1.79 -0.02 0.00 -0.53 0.00 0.00 39.78 41.02 1j0s n ASN 111 CO 0.00 0.00 0.00 -0.54 1.40 0.00 0.00 177.26 178.12 1j0s s LYS 112 N 0.79 2.63 0.05 1.20 -0.14 -1.26 -4.61 119.74 118.41 1j0s s LYS 112 Ca 0.31 -1.43 -0.08 0.00 -1.36 0.00 0.00 55.97 53.41 1j0s s LYS 112 Cb 0.11 -2.47 -0.00 0.00 -1.68 0.00 0.00 37.83 33.78 1j0s s LYS 112 CO -0.14 -0.15 0.16 -1.64 -0.76 0.00 0.00 175.35 172.81 1j0s s MET 113 N -4.14 0.69 -0.11 1.68 -1.94 0.53 -1.02 119.30 114.99 1j0s s MET 113 Ca 0.48 -0.76 0.01 0.00 -1.71 0.00 0.00 55.69 53.71 1j0s s MET 113 Cb -0.05 0.28 0.02 0.00 2.01 0.00 0.00 34.83 37.09 1j0s s MET 113 CO 0.29 -0.20 -0.13 -1.14 -0.01 0.00 0.00 175.02 173.83 1j0s s GLN 114 N -2.92 2.05 -0.64 2.03 0.74 0.14 -1.08 119.66 119.97 1j0s s GLN 114 Ca -0.02 -0.49 -0.23 0.00 0.05 0.00 0.00 55.36 54.67 1j0s s GLN 114 Cb 0.01 -1.81 0.07 0.00 1.10 0.00 0.00 33.01 32.38 1j0s s GLN 114 CO -0.06 -0.11 0.95 -0.06 -0.55 0.00 0.00 175.29 175.46 1j0s s PHE 115 N 1.14 2.70 0.43 1.67 0.08 -1.26 -0.29 117.98 122.45 1j0s s PHE 115 Ca -0.04 -0.51 -0.05 0.00 0.12 0.00 0.00 56.93 56.45 1j0s s PHE 115 Cb -0.14 -4.25 -0.04 0.00 -0.57 0.00 0.00 43.02 38.02 1j0s s PHE 115 CO -0.03 -1.60 0.72 -2.00 -0.10 0.00 0.00 175.22 172.21 1j0s s GLU 116 N 3.98 3.58 0.52 0.44 2.12 0.68 -1.38 118.70 128.64 1j0s s GLU 116 Ca 0.22 0.13 -0.21 0.00 0.36 0.00 0.00 54.97 55.48 1j0s s GLU 116 Cb -0.17 -2.45 -0.06 0.00 0.26 0.00 0.00 34.13 31.71 1j0s s GLU 116 CO 0.11 -0.08 1.18 -1.12 -0.54 0.00 0.00 175.26 174.81 1j0s s SER 117 N -3.86 5.78 0.37 -1.70 0.01 -1.04 -1.17 113.70 112.09 1j0s s SER 117 Ca 0.46 2.32 0.06 0.00 1.31 0.00 0.00 55.95 60.10 1j0s s SER 117 Cb -0.10 -2.60 0.71 0.00 0.21 0.00 0.00 66.02 64.24 1j0s s SER 117 CO 0.40 -1.19 1.93 0.77 0.41 0.00 0.00 173.24 175.56 1j0s h SER 118 N 1.52 0.42 0.18 2.44 4.64 -1.80 -3.25 113.55 117.70 1j0s h SER 118 Ca -0.50 -0.06 -0.01 0.00 -0.47 0.00 0.00 61.79 60.75 1j0s h SER 118 Cb 1.27 -0.11 0.00 0.00 -0.31 0.00 0.00 62.40 63.25 1j0s h SER 118 CO 0.58 0.46 -0.09 -1.28 -0.87 0.00 0.00 176.83 175.63 1j0s h SER 119 N 0.45 -0.21 -1.36 4.97 0.87 -1.88 -3.41 113.55 112.99 1j0s h SER 119 Ca 0.10 0.01 -0.01 0.00 -1.23 0.00 0.00 61.79 60.66 1j0s h SER 119 Cb 0.24 0.05 -0.00 0.00 -0.44 0.00 0.00 62.40 62.25 1j0s h SER 119 CO 0.00 -0.10 0.00 0.00 -0.53 0.00 0.00 176.83 176.20 1j0s n TYR 120 N -2.92 -0.81 0.06 2.24 4.11 -1.23 -4.99 117.16 113.62 1j0s n TYR 120 Ca -0.03 -0.10 -0.03 0.00 -0.00 0.00 0.00 57.90 57.73 1j0s n TYR 120 Cb 0.10 0.04 0.14 0.00 -0.00 0.00 0.00 39.34 39.61 1j0s n TYR 120 CO 0.00 0.00 0.00 -0.85 -0.00 0.00 0.00 176.86 176.01 1j0s n GLU 121 N -0.03 2.22 0.02 -3.48 0.28 -1.26 -3.45 120.64 114.94 1j0s n GLU 121 Ca -0.00 -1.41 0.13 0.00 -0.16 0.00 0.00 57.16 55.72 1j0s n GLU 121 Cb 0.03 -1.70 0.54 0.00 1.43 0.00 0.00 31.44 31.73 1j0s n GLU 121 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1j0s n GLY 122 N 0.03 -1.47 3.25 -1.84 0.00 -1.26 -4.81 105.19 99.09 1j0s n GLY 122 Ca 0.20 -0.07 -0.13 0.00 0.00 0.00 0.00 46.02 46.01 1j0s n GLY 122 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1j0s s TYR 123 N -3.03 -0.29 -0.01 1.61 2.02 -1.26 -4.77 117.35 111.63 1j0s s TYR 123 Ca 0.12 0.60 0.02 0.00 -0.37 0.00 0.00 57.07 57.44 1j0s s TYR 123 Cb 0.16 0.12 -0.00 0.00 -0.40 0.00 0.00 41.96 41.84 1j0s s TYR 123 CO 0.50 -0.30 -0.06 -0.06 -1.57 0.00 0.00 175.55 174.06 1j0s s PHE 124 N -0.62 0.56 -0.15 2.71 0.40 -0.20 -2.50 117.98 118.18 1j0s s PHE 124 Ca -0.07 -0.11 -0.29 0.00 -0.60 0.00 0.00 56.93 55.86 1j0s s PHE 124 Cb -0.04 -0.37 -0.05 0.00 0.51 0.00 0.00 43.02 43.07 1j0s s PHE 124 CO 0.03 -0.02 1.94 -0.51 0.70 0.00 0.00 175.22 177.36 1j0s s LEU 125 N -0.08 3.86 0.49 -0.37 1.43 -0.48 -1.29 118.68 122.23 1j0s s LEU 125 Ca 0.02 1.99 0.03 0.00 -1.03 0.00 0.00 54.13 55.14 1j0s s LEU 125 Cb -0.03 -3.52 -0.02 0.00 0.03 0.00 0.00 46.19 42.64 1j0s s LEU 125 CO -0.00 -1.48 0.06 0.00 0.23 0.00 0.00 176.35 175.15 1j0s s ALA 126 N 6.22 3.91 -0.02 4.21 0.00 0.14 -4.70 121.76 131.52 1j0s s ALA 126 Ca 0.87 -1.01 0.03 0.00 0.00 0.00 0.00 51.96 51.85 1j0s s ALA 126 Cb -0.33 -0.05 -0.03 0.00 0.00 0.00 0.00 23.12 22.71 1j0s s ALA 126 CO 0.35 -0.10 -0.10 0.00 0.00 0.00 0.00 175.76 175.91 1j0s s GLU 128 N -1.13 2.23 -0.74 0.00 2.12 0.14 -4.94 118.70 116.39 1j0s s GLU 128 Ca 0.14 -0.58 -0.26 0.00 0.36 0.00 0.00 54.97 54.63 1j0s s GLU 128 Cb -0.11 -1.81 0.04 0.00 0.26 0.00 0.00 34.13 32.51 1j0s s GLU 128 CO 0.04 0.03 1.21 0.21 -0.54 0.00 0.00 175.26 176.21 1j0s s LYS 129 N 0.71 3.20 -0.35 4.30 2.47 -1.26 -0.38 119.74 128.43 1j0s s LYS 129 Ca -0.12 -0.46 -0.07 0.00 -1.56 0.00 0.00 55.97 53.75 1j0s s LYS 129 Cb -0.16 -4.27 0.04 0.00 -1.46 0.00 0.00 37.83 31.98 1j0s s LYS 129 CO 0.03 -2.07 0.13 -1.21 0.16 0.00 0.00 175.35 172.40 1j0s s GLU 130 N 5.24 2.65 5.76 4.03 2.02 0.18 -4.99 118.70 133.59 1j0s s GLU 130 Ca 0.32 -1.19 0.00 0.00 0.02 0.00 0.00 54.97 54.13 1j0s s GLU 130 Cb -0.10 -3.53 0.00 0.00 0.10 0.00 0.00 34.13 30.60 1j0s s GLU 130 CO 0.12 -0.70 0.00 0.54 0.02 0.00 0.00 175.26 175.24 1j0s n ARG 131 N 4.85 0.00 -0.43 1.61 1.74 -1.26 -0.75 116.66 122.42 1j0s n ARG 131 Ca -0.12 0.00 0.08 0.00 -0.77 0.00 0.00 57.85 57.04 1j0s n ARG 131 Cb 0.45 0.00 0.25 0.00 -1.02 0.00 0.00 32.46 32.14 1j0s n ARG 131 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 1j0s n ASP 132 N 10.15 3.85 -4.02 0.55 8.00 -1.26 -4.98 116.55 128.85 1j0s n ASP 132 Ca 0.00 -2.76 -0.15 0.00 0.71 0.00 0.00 54.79 52.59 1j0s n ASP 132 Cb 0.00 -0.49 -0.13 0.00 -0.02 0.00 0.00 41.12 40.48 1j0s n ASP 132 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1j0s s LEU 133 N -2.38 2.13 -0.56 0.64 1.43 0.07 -5.11 118.68 114.90 1j0s s LEU 133 Ca 0.39 -0.32 -0.18 0.00 -1.03 0.00 0.00 54.13 53.00 1j0s s LEU 133 Cb 0.30 -0.25 0.11 0.00 0.03 0.00 0.00 46.19 46.38 1j0s s LEU 133 CO 0.12 -0.05 0.61 -0.36 0.23 0.00 0.00 176.35 176.89 1j0s s PHE 134 N -0.72 3.10 -0.08 0.29 0.40 -1.26 -0.65 117.98 119.06 1j0s s PHE 134 Ca -0.03 -1.04 -0.19 0.00 -0.60 0.00 0.00 56.93 55.07 1j0s s PHE 134 Cb -0.06 -3.86 -0.05 0.00 0.51 0.00 0.00 43.02 39.57 1j0s s PHE 134 CO 0.00 -1.15 0.51 0.15 0.70 0.00 0.00 175.22 175.43 1j0s s LYS 135 N 2.26 4.30 0.09 0.44 1.02 0.48 -1.96 119.74 126.38 1j0s s LYS 135 Ca 0.08 0.54 -0.24 0.00 0.02 0.00 0.00 55.97 56.38 1j0s s LYS 135 Cb -0.26 -3.40 -0.07 0.00 -0.52 0.00 0.00 37.83 33.59 1j0s s LYS 135 CO 0.06 0.25 0.71 -1.17 -0.92 0.00 0.00 175.35 174.28 1j0s s LEU 136 N 0.29 4.52 0.00 3.17 2.96 -0.61 0.25 118.68 129.26 1j0s s LEU 136 Ca 0.28 1.46 -0.02 0.00 -0.22 0.00 0.00 54.13 55.63 1j0s s LEU 136 Cb -0.16 -3.16 0.01 0.00 0.50 0.00 0.00 46.19 43.38 1j0s s LEU 136 CO 0.13 0.16 0.52 2.30 -1.32 0.00 0.00 176.35 178.13 1j0s n ILE 137 N 2.09 0.00 -3.77 6.68 -0.00 0.10 -4.79 119.36 119.66 1j0s n ILE 137 Ca -0.06 -1.82 -0.36 0.00 -0.00 0.00 0.00 62.75 60.51 1j0s n ILE 137 Cb 0.50 1.13 -0.13 0.00 -0.00 0.00 0.00 39.64 41.14 1j0s n ILE 137 CO 0.00 0.00 0.00 -0.22 -0.00 0.00 0.00 176.55 176.33 1j0s s LEU 138 N 0.00 3.40 0.33 7.28 2.96 -1.26 0.27 118.68 131.67 1j0s s LEU 138 Ca 0.30 -0.26 -0.15 0.00 -0.22 0.00 0.00 54.13 53.80 1j0s s LEU 138 Cb -0.01 -1.90 0.03 0.00 0.50 0.00 0.00 46.19 44.81 1j0s s LEU 138 CO 0.21 -0.04 0.69 -1.59 -1.32 0.00 0.00 176.35 174.30 1j0s s LYS 139 N 1.59 1.99 -0.34 1.98 -2.85 -0.41 -4.60 119.74 117.10 1j0s s LYS 139 Ca 0.06 -1.34 0.03 0.00 -1.00 0.00 0.00 55.97 53.71 1j0s s LYS 139 Cb -0.15 0.58 0.10 0.00 -2.06 0.00 0.00 37.83 36.29 1j0s s LYS 139 CO 0.03 -0.90 0.05 0.21 0.10 0.00 0.00 175.35 174.84 1j0s s LYS 140 N -3.05 1.67 1.21 1.78 2.47 -1.26 -1.03 119.74 121.54 1j0s s LYS 140 Ca 0.17 -1.79 -0.13 0.00 -1.56 0.00 0.00 55.97 52.65 1j0s s LYS 140 Cb -0.04 -3.23 0.31 0.00 -1.46 0.00 0.00 37.83 33.41 1j0s s LYS 140 CO 0.11 -0.91 1.01 -1.21 0.16 0.00 0.00 175.35 174.51 1j0s s GLU 141 N 0.97 -1.31 0.12 4.03 0.41 -1.26 -4.94 118.70 116.71 1j0s s GLU 141 Ca 0.08 0.78 0.05 0.00 -0.41 0.00 0.00 54.97 55.48 1j0s s GLU 141 Cb -0.20 -1.51 -0.21 0.00 -1.78 0.00 0.00 34.13 30.44 1j0s s GLU 141 CO -0.07 -3.97 1.27 -0.44 -0.49 0.00 0.00 175.26 171.56 1j0s h ASP 142 N -2.80 0.06 -3.21 -0.19 5.19 -2.01 -3.43 116.42 110.03 1j0s h ASP 142 Ca -0.63 -0.07 -0.62 0.00 -0.62 0.00 0.00 57.03 55.10 1j0s h ASP 142 Cb 1.34 -0.02 -0.35 0.00 0.18 0.00 0.00 39.33 40.48 1j0s h ASP 142 CO 0.49 1.04 -0.84 -1.61 -3.12 0.00 0.00 179.24 175.20 1j0s s GLU 143 N -2.73 2.48 0.53 3.56 2.02 -1.26 -5.00 118.70 118.30 1j0s s GLU 143 Ca 0.00 -0.65 0.30 0.00 0.02 0.00 0.00 54.97 54.65 1j0s s GLU 143 Cb 0.10 -2.11 1.44 0.00 0.10 0.00 0.00 34.13 33.65 1j0s s GLU 143 CO 0.83 -0.10 2.03 -0.07 0.02 0.00 0.00 175.26 177.97 1j0s h LEU 144 N 7.56 0.00 -3.18 1.80 3.38 -2.01 -2.26 115.31 120.59 1j0s h LEU 144 Ca -0.34 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.47 1j0s h LEU 144 Cb 1.17 0.00 -0.10 0.00 0.09 0.00 0.00 40.66 41.82 1j0s h LEU 144 CO 0.52 0.10 0.20 0.61 0.09 0.00 0.00 178.44 179.97 1j0s n GLY 145 N -0.37 3.15 3.65 0.83 0.00 -1.26 -4.90 105.19 106.29 1j0s n GLY 145 Ca -0.01 -0.75 -0.40 0.00 0.00 0.00 0.00 46.02 44.86 1j0s n GLY 145 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1j0s s ASP 146 N -0.65 6.65 0.59 1.61 -1.08 -0.85 -4.94 116.67 118.00 1j0s s ASP 146 Ca 0.42 0.79 0.29 0.00 -0.52 0.00 0.00 52.55 53.53 1j0s s ASP 146 Cb 0.34 -2.34 1.65 0.00 -1.46 0.00 0.00 42.92 41.11 1j0s s ASP 146 CO 0.11 -0.27 2.09 0.08 0.52 0.00 0.00 175.17 177.70 1j0s h ARG 147 N 7.54 0.00 -0.52 4.34 0.11 -1.90 -0.90 114.38 123.06 1j0s h ARG 147 Ca -0.31 0.00 0.15 0.00 0.10 0.00 0.00 59.98 59.92 1j0s h ARG 147 Cb 1.14 0.00 -0.02 0.00 1.11 0.00 0.00 29.97 32.20 1j0s h ARG 147 CO 0.77 0.00 0.39 0.66 0.10 0.00 0.00 179.97 181.89 1j0s h SER 148 N 0.00 0.00 -0.43 0.08 4.64 -1.95 0.28 113.55 116.17 1j0s h SER 148 Ca 0.09 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.41 1j0s h SER 148 Cb 0.51 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.60 1j0s h SER 148 CO -0.00 0.00 0.00 2.30 -0.87 0.00 0.00 176.83 178.26 1j0s n ILE 149 N -4.25 1.85 -4.65 0.95 -5.35 -0.34 -3.64 119.36 103.93 1j0s n ILE 149 Ca 0.09 -1.40 -0.33 0.00 -0.27 0.00 0.00 62.75 60.84 1j0s n ILE 149 Cb 0.61 0.06 -0.13 0.00 -1.74 0.00 0.00 39.64 38.44 1j0s n ILE 149 CO 0.00 0.00 0.00 -0.04 -1.76 0.00 0.00 176.55 174.75 1j0s s MET 150 N -2.04 3.32 0.45 6.28 -1.94 0.98 -4.72 119.30 121.62 1j0s s MET 150 Ca 0.41 -0.61 0.05 0.00 -1.71 0.00 0.00 55.69 53.83 1j0s s MET 150 Cb 0.29 -2.70 -0.05 0.00 2.01 0.00 0.00 34.83 34.38 1j0s s MET 150 CO 0.16 0.32 0.05 -0.06 -0.01 0.00 0.00 175.02 175.48 1j0s s PHE 151 N 0.10 2.28 -0.10 -0.03 0.08 -0.24 -4.43 117.98 115.64 1j0s s PHE 151 Ca -0.04 -0.76 0.03 0.00 0.12 0.00 0.00 56.93 56.29 1j0s s PHE 151 Cb -0.14 -1.76 0.00 0.00 -0.57 0.00 0.00 43.02 40.55 1j0s s PHE 151 CO 0.04 0.30 -0.21 0.95 -0.10 0.00 0.00 175.22 176.20 1j0s s THR 152 N -2.75 1.82 -0.13 0.64 -4.23 -0.42 -0.34 115.64 110.22 1j0s s THR 152 Ca 0.26 -0.87 -0.00 0.00 -1.18 0.00 0.00 61.69 59.90 1j0s s THR 152 Cb 0.06 -1.59 -0.02 0.00 1.34 0.00 0.00 72.50 72.29 1j0s s THR 152 CO 0.14 0.51 -0.13 -0.69 -0.54 0.00 0.00 174.62 173.91 1j0s s VAL 153 N 0.48 3.09 0.26 2.29 1.01 -1.26 -0.92 120.40 125.35 1j0s s VAL 153 Ca -0.16 -0.65 0.09 0.00 0.00 0.00 0.00 61.98 61.25 1j0s s VAL 153 Cb -0.17 -2.30 -0.05 0.00 0.00 0.00 0.00 36.38 33.86 1j0s s VAL 153 CO 0.06 0.52 -0.13 -1.58 0.00 0.00 0.00 175.10 173.98 1j0s s GLN 154 N 0.35 1.54 -0.17 2.72 0.74 0.14 -4.92 119.66 120.05 1j0s s GLN 154 Ca -0.11 -1.73 -0.10 0.00 0.05 0.00 0.00 55.36 53.47 1j0s s GLN 154 Cb -0.16 -1.36 -0.05 0.00 1.10 0.00 0.00 33.01 32.54 1j0s s GLN 154 CO 0.06 0.18 0.17 -0.80 -0.55 0.00 0.00 175.29 174.34 1j0s s ASN 155 N -3.44 6.30 -0.43 6.67 0.02 -1.26 0.28 114.94 123.08 1j0s s ASN 155 Ca 0.27 0.34 -0.10 0.00 -1.02 0.00 0.00 52.86 52.36 1j0s s ASN 155 Cb -0.00 -2.11 0.08 0.00 0.02 0.00 0.00 41.25 39.24 1j0s s ASN 155 CO 0.11 0.21 0.28 -0.70 0.02 0.00 0.00 177.10 177.02 1j0s s GLU 156 N 0.12 2.61 0.00 -0.60 2.12 0.13 -4.78 118.70 118.30 1j0s s GLU 156 Ca 0.11 -1.50 0.00 0.00 0.36 0.00 0.00 54.97 53.94 1j0s s GLU 156 Cb -0.12 -3.83 0.00 0.00 0.26 0.00 0.00 34.13 30.45 1j0s s GLU 156 CO 0.00 -1.00 0.00 -3.47 -0.54 0.00 0.00 175.26 170.26