#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1j88 s PRO 5 N 0.00 3.19 -0.11 1.64 0.04 -1.26 -5.08 135.00 133.42 1j88 s PRO 5 Ca 0.00 0.08 -0.04 0.00 0.04 0.00 0.00 61.00 61.09 1j88 s PRO 5 Cb 0.00 -2.32 0.06 0.00 0.04 0.00 0.00 34.50 32.28 1j88 s PRO 5 CO 0.00 -0.49 0.18 0.21 0.04 0.00 0.00 177.00 176.94 1j88 s LYS 6 N -4.88 0.07 0.03 4.56 2.20 -1.17 -4.31 119.74 116.23 1j88 s LYS 6 Ca 0.51 0.50 -0.30 0.00 -0.36 0.00 0.00 55.97 56.32 1j88 s LYS 6 Cb -0.10 -0.46 -0.06 0.00 -1.51 0.00 0.00 37.83 35.70 1j88 s LYS 6 CO 0.45 -0.37 1.42 0.08 -0.36 0.00 0.00 175.35 176.57 1j88 s VAL 7 N 2.30 3.59 0.28 4.02 1.01 -1.25 -4.05 120.40 126.30 1j88 s VAL 7 Ca 0.03 1.01 0.09 0.00 0.00 0.00 0.00 61.98 63.12 1j88 s VAL 7 Cb -0.13 -3.65 -0.04 0.00 0.00 0.00 0.00 36.38 32.56 1j88 s VAL 7 CO -0.07 0.01 0.07 -0.94 0.00 0.00 0.00 175.10 174.17 1j88 s SER 8 N 1.81 4.74 0.15 3.32 1.04 -0.64 -4.99 113.70 119.13 1j88 s SER 8 Ca 0.65 -0.62 0.08 0.00 0.48 0.00 0.00 55.95 56.54 1j88 s SER 8 Cb -0.33 -0.90 -0.04 0.00 0.10 0.00 0.00 66.02 64.85 1j88 s SER 8 CO 0.28 -0.08 -0.18 -0.76 0.98 0.00 0.00 173.24 173.47 1j88 s LEU 9 N -3.75 2.42 -0.27 2.42 1.43 -1.26 -2.29 118.68 117.38 1j88 s LEU 9 Ca 0.33 -0.83 -0.02 0.00 -1.03 0.00 0.00 54.13 52.58 1j88 s LEU 9 Cb -0.06 -0.80 0.16 0.00 0.03 0.00 0.00 46.19 45.52 1j88 s LEU 9 CO 0.21 -0.04 0.49 0.21 0.23 0.00 0.00 176.35 177.46 1j88 s ASN 10 N -2.54 -0.56 1.04 2.29 2.47 -0.97 -3.78 114.94 112.87 1j88 s ASN 10 Ca 0.14 0.61 -0.15 0.00 0.42 0.00 0.00 52.86 53.87 1j88 s ASN 10 Cb -0.06 1.64 0.09 0.00 -1.45 0.00 0.00 41.25 41.48 1j88 s ASN 10 CO 0.06 -0.28 0.36 -2.65 -3.72 0.00 0.00 177.10 170.87 1j88 n PRO 11 N 5.40 -1.02 0.26 0.43 -0.02 -1.26 -1.90 135.00 136.88 1j88 n PRO 11 Ca -0.03 -0.26 0.15 0.00 -2.02 0.00 0.00 63.50 61.33 1j88 n PRO 11 Cb 0.50 -1.86 0.63 0.00 -0.02 0.00 0.00 33.50 32.75 1j88 n PRO 11 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 1j88 h PRO 12 N -1.89 0.00 -6.27 0.52 0.11 -1.95 -3.45 132.00 119.07 1j88 h PRO 12 Ca -0.49 0.00 -0.66 0.00 0.11 0.00 0.00 66.00 64.96 1j88 h PRO 12 Cb 1.32 0.00 0.03 0.00 0.11 0.00 0.00 31.00 32.45 1j88 h PRO 12 CO 0.38 0.08 0.92 0.91 -0.21 0.00 0.00 178.00 180.08 1j88 n TRP 13 N -3.23 2.14 -0.60 0.65 5.03 -1.26 -4.86 117.44 115.31 1j88 n TRP 13 Ca 0.00 0.28 0.08 0.00 3.03 0.00 0.00 57.50 60.89 1j88 n TRP 13 Cb 0.33 -2.54 0.26 0.00 -1.03 0.00 0.00 31.31 28.33 1j88 n TRP 13 CO 0.00 0.00 0.00 0.27 -0.03 0.00 0.00 177.69 177.93 1j88 n ASN 14 N 5.30 3.92 -3.77 -0.99 6.94 -1.26 -4.80 115.26 120.60 1j88 n ASN 14 Ca 0.22 -2.49 -0.25 0.00 -0.02 0.00 0.00 54.58 52.04 1j88 n ASN 14 Cb 0.23 -0.46 -0.17 0.00 -2.36 0.00 0.00 39.78 37.02 1j88 n ASN 14 CO 0.00 0.00 0.00 -0.13 -1.03 0.00 0.00 177.26 176.10 1j88 s ARG 15 N -1.90 0.69 0.21 -3.83 0.52 -1.26 -2.62 118.95 110.76 1j88 s ARG 15 Ca 0.39 -0.09 0.03 0.00 -0.52 0.00 0.00 55.73 55.54 1j88 s ARG 15 Cb 0.27 -1.40 -0.05 0.00 0.52 0.00 0.00 34.95 34.29 1j88 s ARG 15 CO 0.17 -0.41 0.01 0.96 0.02 0.00 0.00 175.30 176.04 1j88 s ILE 16 N 1.92 0.85 0.58 1.52 -4.36 0.23 -4.90 121.20 117.04 1j88 s ILE 16 Ca 0.03 -2.01 -0.13 0.00 -0.26 0.00 0.00 60.65 58.28 1j88 s ILE 16 Cb -0.14 -2.27 -0.05 0.00 1.25 0.00 0.00 42.46 41.25 1j88 s ILE 16 CO -0.06 -0.37 1.01 -0.36 0.24 0.00 0.00 174.94 175.40 1j88 s PHE 17 N -3.54 3.53 0.12 1.37 2.99 -1.26 0.13 117.98 121.31 1j88 s PHE 17 Ca 0.27 1.37 -0.31 0.00 0.00 0.00 0.00 56.93 58.26 1j88 s PHE 17 Cb 0.06 -2.76 -0.09 0.00 0.00 0.00 0.00 43.02 40.23 1j88 s PHE 17 CO 0.07 -0.59 1.62 0.21 -0.00 0.00 0.00 175.22 176.54 1j88 s LYS 18 N -4.70 4.20 0.00 0.44 2.20 0.12 -2.35 119.74 119.65 1j88 s LYS 18 Ca 0.57 2.36 0.00 0.00 -0.36 0.00 0.00 55.97 58.54 1j88 s LYS 18 Cb -0.11 -3.39 0.00 0.00 -1.51 0.00 0.00 37.83 32.82 1j88 s LYS 18 CO 0.44 -0.68 0.00 0.41 -0.36 0.00 0.00 175.35 175.16 1j88 n GLY 19 N 3.90 0.39 3.87 5.54 0.00 0.41 -4.85 105.19 114.45 1j88 n GLY 19 Ca 0.15 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.88 1j88 n GLY 19 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1j88 s GLU 20 N -0.87 1.22 0.09 1.61 2.02 -0.99 -3.81 118.70 117.96 1j88 s GLU 20 Ca 0.00 -0.03 0.09 0.00 0.02 0.00 0.00 54.97 55.05 1j88 s GLU 20 Cb 0.00 -1.88 -0.03 0.00 0.10 0.00 0.00 34.13 32.32 1j88 s GLU 20 CO 0.00 -2.08 -0.23 -0.80 0.02 0.00 0.00 175.26 172.16 1j88 s ASN 21 N -4.53 2.84 -0.07 -0.19 0.01 -1.26 -1.67 114.94 110.07 1j88 s ASN 21 Ca 0.67 -0.66 -0.13 0.00 -0.71 0.00 0.00 52.86 52.03 1j88 s ASN 21 Cb -0.09 -0.20 0.03 0.00 0.41 0.00 0.00 41.25 41.40 1j88 s ASN 21 CO 0.51 0.14 0.31 0.54 -1.51 0.00 0.00 177.10 177.10 1j88 s VAL 22 N -1.01 0.03 -0.17 1.60 0.11 -0.89 -4.69 120.40 115.38 1j88 s VAL 22 Ca 0.10 -0.24 -0.02 0.00 -2.93 0.00 0.00 61.98 58.88 1j88 s VAL 22 Cb -0.10 -0.53 -0.01 0.00 -1.53 0.00 0.00 36.38 34.21 1j88 s VAL 22 CO 0.04 -0.13 -0.08 -0.89 -3.33 0.00 0.00 175.10 170.70 1j88 s THR 23 N -0.57 3.33 -0.53 5.04 2.01 -0.80 -1.84 115.64 122.27 1j88 s THR 23 Ca -0.07 -0.54 -0.11 0.00 0.31 0.00 0.00 61.69 61.28 1j88 s THR 23 Cb -0.04 -2.45 0.13 0.00 0.01 0.00 0.00 72.50 70.15 1j88 s THR 23 CO 0.02 0.48 0.42 -0.76 -0.69 0.00 0.00 174.62 174.10 1j88 s LEU 24 N 0.77 5.88 0.50 4.42 1.43 -0.79 -2.30 118.68 128.59 1j88 s LEU 24 Ca -0.03 -2.01 -0.17 0.00 -1.03 0.00 0.00 54.13 50.88 1j88 s LEU 24 Cb -0.15 -2.07 -0.08 0.00 0.03 0.00 0.00 46.19 43.92 1j88 s LEU 24 CO 0.02 -0.70 0.98 -0.89 0.23 0.00 0.00 176.35 175.98 1j88 s THR 25 N 1.23 4.49 -0.09 5.49 2.01 -0.97 -2.29 115.64 125.50 1j88 s THR 25 Ca 0.07 1.27 0.15 0.00 0.31 0.00 0.00 61.69 63.48 1j88 s THR 25 Cb -0.25 -3.69 -0.22 0.00 0.01 0.00 0.00 72.50 68.34 1j88 s THR 25 CO -0.01 -0.61 0.54 0.00 -0.69 0.00 0.00 174.62 173.86 1j88 n ASN 27 N -2.94 0.00 -3.68 0.00 2.85 -1.26 -3.03 115.26 107.20 1j88 n ASN 27 Ca -0.19 0.00 -0.17 0.00 -0.11 0.00 0.00 54.58 54.10 1j88 n ASN 27 Cb 1.04 0.00 -0.09 0.00 1.24 0.00 0.00 39.78 41.97 1j88 n ASN 27 CO 0.00 0.00 0.00 -0.83 -2.11 0.00 0.00 177.26 174.32 1j88 s GLY 28 N -0.97 2.06 -0.00 8.20 0.00 -1.26 -4.79 107.32 110.56 1j88 s GLY 28 Ca 0.00 -1.91 -0.09 0.00 0.00 0.00 0.00 44.72 42.71 1j88 s GLY 28 CO 0.00 -1.47 0.74 3.43 0.00 0.00 0.00 173.10 175.79 1j88 h ASN 29 N 2.27 -0.29 0.00 1.64 2.35 -2.01 -3.46 115.58 116.08 1j88 h ASN 29 Ca -0.29 0.01 -0.07 0.00 -0.55 0.00 0.00 56.30 55.40 1j88 h ASN 29 Cb 1.24 0.07 -0.01 0.00 0.05 0.00 0.00 38.32 39.67 1j88 h ASN 29 CO 0.43 -0.12 -1.00 0.59 -1.65 0.00 0.00 177.43 175.68 1j88 n ASN 30 N -3.37 1.63 -3.81 5.81 3.02 -1.26 -5.03 115.26 112.25 1j88 n ASN 30 Ca -0.04 0.27 -0.29 0.00 -0.03 0.00 0.00 54.58 54.49 1j88 n ASN 30 Cb 0.13 -0.61 -0.16 0.00 -0.61 0.00 0.00 39.78 38.53 1j88 n ASN 30 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 1j88 s PHE 31 N -2.58 1.54 -0.30 3.10 0.08 -1.26 -5.08 117.98 113.49 1j88 s PHE 31 Ca -0.22 -1.22 -0.01 0.00 0.12 0.00 0.00 56.93 55.60 1j88 s PHE 31 Cb 0.04 -1.26 0.13 0.00 -0.57 0.00 0.00 43.02 41.36 1j88 s PHE 31 CO 0.31 -0.68 0.28 -0.06 -0.10 0.00 0.00 175.22 174.96 1j88 s PHE 32 N 1.68 -0.30 -0.31 0.36 0.08 -1.26 -5.07 117.98 113.16 1j88 s PHE 32 Ca -0.02 -0.38 -0.10 0.00 0.12 0.00 0.00 56.93 56.56 1j88 s PHE 32 Cb -0.18 -0.53 -0.01 0.00 -0.57 0.00 0.00 43.02 41.73 1j88 s PHE 32 CO -0.08 -0.91 0.16 -1.83 -0.10 0.00 0.00 175.22 172.45 1j88 s GLU 33 N 2.20 3.40 0.23 0.44 -1.05 -1.26 -4.97 118.70 117.69 1j88 s GLU 33 Ca 0.10 -0.68 -0.22 0.00 -0.15 0.00 0.00 54.97 54.03 1j88 s GLU 33 Cb -0.15 -3.58 0.04 0.00 -0.44 0.00 0.00 34.13 30.01 1j88 s GLU 33 CO -0.30 -0.39 0.67 0.08 0.95 0.00 0.00 175.26 176.26 1j88 s VAL 34 N 1.63 0.00 -0.03 1.83 1.01 -1.26 -5.15 120.40 118.44 1j88 s VAL 34 Ca 0.05 -0.62 -0.06 0.00 0.00 0.00 0.00 61.98 61.35 1j88 s VAL 34 Cb -0.17 -1.61 -0.02 0.00 0.00 0.00 0.00 36.38 34.58 1j88 s VAL 34 CO 0.07 -0.00 -0.12 -1.54 0.00 0.00 0.00 175.10 173.50 1j88 n SER 35 N -0.42 1.02 -4.55 3.32 3.41 -1.26 -4.29 113.62 110.85 1j88 n SER 35 Ca -0.09 0.16 -0.47 0.00 -0.26 0.00 0.00 58.87 58.21 1j88 n SER 35 Cb 0.61 -0.45 -0.05 0.00 -0.26 0.00 0.00 64.21 64.07 1j88 n SER 35 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 1j88 n SER 36 N -3.49 2.83 -3.83 4.04 2.88 -1.26 -4.20 113.62 110.60 1j88 n SER 36 Ca -0.05 0.38 -0.11 0.00 -1.33 0.00 0.00 58.87 57.77 1j88 n SER 36 Cb 0.18 -1.42 -0.08 0.00 -0.75 0.00 0.00 64.21 62.14 1j88 n SER 36 CO 0.00 0.00 0.00 -0.89 -1.23 0.00 0.00 175.04 172.92 1j88 s THR 37 N 7.41 0.11 -0.04 2.46 2.01 -1.17 -4.58 115.64 121.84 1j88 s THR 37 Ca 1.03 -0.87 0.04 0.00 0.31 0.00 0.00 61.69 62.21 1j88 s THR 37 Cb -0.59 -0.94 -0.00 0.00 0.01 0.00 0.00 72.50 70.98 1j88 s THR 37 CO 0.43 -0.48 -0.17 -0.54 -0.69 0.00 0.00 174.62 173.17 1j88 s LYS 38 N -2.65 1.76 -0.08 4.92 1.02 -0.54 -4.58 119.74 119.59 1j88 s LYS 38 Ca -0.04 -0.59 0.03 0.00 0.02 0.00 0.00 55.97 55.39 1j88 s LYS 38 Cb -0.01 -1.53 0.01 0.00 -0.52 0.00 0.00 37.83 35.78 1j88 s LYS 38 CO -0.04 0.23 -0.19 -1.58 -0.92 0.00 0.00 175.35 172.85 1j88 s TRP 39 N 0.08 2.06 -0.35 3.18 0.52 -1.26 -2.02 118.94 121.14 1j88 s TRP 39 Ca -0.05 -0.80 0.03 0.00 0.02 0.00 0.00 56.10 55.30 1j88 s TRP 39 Cb -0.12 -1.41 0.10 0.00 -1.15 0.00 0.00 33.47 30.89 1j88 s TRP 39 CO 0.02 -0.34 0.08 -0.06 0.02 0.00 0.00 176.95 176.67 1j88 s PHE 40 N 0.45 3.30 -0.42 -1.98 0.40 -0.28 0.87 117.98 120.32 1j88 s PHE 40 Ca -0.16 -2.78 -0.23 0.00 -0.60 0.00 0.00 56.93 53.16 1j88 s PHE 40 Cb -0.17 -2.67 0.02 0.00 0.51 0.00 0.00 43.02 40.71 1j88 s PHE 40 CO 0.06 -0.91 0.76 -1.58 0.70 0.00 0.00 175.22 174.25 1j88 s HIS 41 N 0.91 3.04 -1.29 0.36 2.46 -0.72 -3.30 115.29 116.76 1j88 s HIS 41 Ca 0.11 0.29 -0.08 0.00 0.47 0.00 0.00 55.06 55.85 1j88 s HIS 41 Cb -0.19 -3.52 0.01 0.00 -0.13 0.00 0.00 32.58 28.74 1j88 s HIS 41 CO -0.10 -0.87 1.13 0.09 -2.47 0.00 0.00 174.74 172.51 1j88 n ASN 42 N 6.55 -6.16 0.00 9.88 4.13 -0.03 -2.55 115.26 127.08 1j88 n ASN 42 Ca 0.02 -0.51 0.00 0.00 1.68 0.00 0.00 54.58 55.77 1j88 n ASN 42 Cb 0.48 -4.81 0.00 0.00 -1.54 0.00 0.00 39.78 33.91 1j88 n ASN 42 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1j88 n GLY 43 N -1.94 1.85 3.71 7.41 0.00 -1.25 -4.96 105.19 110.02 1j88 n GLY 43 Ca 0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.61 1j88 n GLY 43 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1j88 s SER 44 N 0.00 6.89 0.42 1.61 0.01 -1.06 -4.88 113.70 116.70 1j88 s SER 44 Ca 0.00 2.24 -0.26 0.00 1.31 0.00 0.00 55.95 59.23 1j88 s SER 44 Cb 0.00 -2.58 -0.09 0.00 0.21 0.00 0.00 66.02 63.55 1j88 s SER 44 CO 0.00 -0.61 1.45 -0.22 0.41 0.00 0.00 173.24 174.27 1j88 s LEU 45 N 1.16 4.19 0.44 2.44 2.96 -1.26 -1.76 118.68 126.85 1j88 s LEU 45 Ca 0.63 2.96 0.03 0.00 -0.22 0.00 0.00 54.13 57.53 1j88 s LEU 45 Cb -0.35 -3.84 0.01 0.00 0.50 0.00 0.00 46.19 42.51 1j88 s LEU 45 CO 0.30 -1.06 0.63 -0.55 -1.32 0.00 0.00 176.35 174.35 1j88 s SER 46 N -0.38 5.71 0.03 3.68 0.15 0.25 -4.85 113.70 118.29 1j88 s SER 46 Ca 0.58 0.00 0.25 0.00 0.70 0.00 0.00 55.95 57.48 1j88 s SER 46 Cb -0.45 -1.19 0.48 0.00 -1.71 0.00 0.00 66.02 63.15 1j88 s SER 46 CO 0.59 -0.75 1.40 -0.62 1.20 0.00 0.00 173.24 175.05 1j88 n GLU 47 N -2.00 0.07 -2.99 5.44 1.02 -1.26 -4.70 120.64 116.22 1j88 n GLU 47 Ca 0.03 0.02 -0.33 0.00 -0.02 0.00 0.00 57.16 56.86 1j88 n GLU 47 Cb 0.58 -1.54 -0.06 0.00 -0.02 0.00 0.00 31.44 30.40 1j88 n GLU 47 CO 0.00 0.00 0.00 -2.00 1.18 0.00 0.00 177.13 176.31 1j88 s GLU 48 N -3.04 4.10 0.00 3.49 2.56 -1.26 -4.99 118.70 119.55 1j88 s GLU 48 Ca 0.10 0.86 0.00 0.00 0.00 0.00 0.00 54.97 55.93 1j88 s GLU 48 Cb 0.17 -2.32 0.00 0.00 2.00 0.00 0.00 34.13 33.98 1j88 s GLU 48 CO 0.70 0.07 0.00 0.25 -0.56 0.00 0.00 175.26 175.72 1j88 n THR 49 N -0.52 0.00 -1.87 -1.70 -2.24 -1.26 -4.53 114.28 102.16 1j88 n THR 49 Ca 0.05 0.00 -0.41 0.00 -2.27 0.00 0.00 64.05 61.42 1j88 n THR 49 Cb 0.54 -0.25 -0.00 0.00 -2.10 0.00 0.00 70.33 68.51 1j88 n THR 49 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1j88 s ASN 50 N -2.39 6.39 0.48 3.42 3.84 -1.26 -3.01 114.94 122.41 1j88 s ASN 50 Ca 0.00 2.96 0.20 0.00 0.21 0.00 0.00 52.86 56.23 1j88 s ASN 50 Cb 0.00 -2.66 1.09 0.00 -0.55 0.00 0.00 41.25 39.13 1j88 s ASN 50 CO 0.00 -0.83 1.56 0.77 -2.79 0.00 0.00 177.10 175.81 1j88 h SER 51 N 3.01 0.00 -3.65 -4.21 4.64 -1.78 -3.36 113.55 108.21 1j88 h SER 51 Ca -0.50 0.00 -0.68 0.00 -0.47 0.00 0.00 61.79 60.14 1j88 h SER 51 Cb 1.24 0.00 -0.31 0.00 -0.31 0.00 0.00 62.40 63.02 1j88 h SER 51 CO 0.64 0.00 -0.70 -0.44 -0.87 0.00 0.00 176.83 175.46 1j88 s SER 52 N -3.85 4.77 -0.47 4.97 0.01 -1.26 -2.20 113.70 115.66 1j88 s SER 52 Ca -0.02 -1.04 -0.15 0.00 1.31 0.00 0.00 55.95 56.04 1j88 s SER 52 Cb 0.06 -1.73 0.07 0.00 0.21 0.00 0.00 66.02 64.63 1j88 s SER 52 CO 0.18 -0.21 0.39 -0.22 0.41 0.00 0.00 173.24 173.79 1j88 s LEU 53 N 1.33 5.62 0.66 2.44 2.96 -0.97 -4.95 118.68 125.76 1j88 s LEU 53 Ca -0.02 -1.34 -0.11 0.00 -0.22 0.00 0.00 54.13 52.43 1j88 s LEU 53 Cb -0.18 -2.18 -0.02 0.00 0.50 0.00 0.00 46.19 44.31 1j88 s LEU 53 CO -0.01 -0.65 1.05 0.20 -1.32 0.00 0.00 176.35 175.62 1j88 s ASN 54 N 2.60 5.88 -0.05 3.68 0.01 -1.26 -1.89 114.94 123.91 1j88 s ASN 54 Ca 0.04 1.34 -0.02 0.00 -0.71 0.00 0.00 52.86 53.51 1j88 s ASN 54 Cb -0.24 -2.29 0.03 0.00 0.41 0.00 0.00 41.25 39.16 1j88 s ASN 54 CO 0.06 -1.09 0.06 -0.63 -1.51 0.00 0.00 177.10 174.00 1j88 s ILE 55 N -3.23 -0.09 0.00 0.60 1.01 -0.77 -4.94 121.20 113.79 1j88 s ILE 55 Ca 0.56 0.36 0.00 0.00 0.00 0.00 0.00 60.65 61.57 1j88 s ILE 55 Cb -0.11 -0.21 0.00 0.00 0.01 0.00 0.00 42.46 42.15 1j88 s ILE 55 CO 0.53 0.14 0.00 0.52 0.00 0.00 0.00 174.94 176.13 1j88 n VAL 56 N 5.29 0.00 0.00 2.92 0.31 -1.26 -2.10 118.33 123.49 1j88 n VAL 56 Ca -0.04 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.29 1j88 n VAL 56 Cb 0.50 -0.92 0.00 0.00 -0.91 0.00 0.00 33.84 32.51 1j88 n VAL 56 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 1j88 n ASN 57 N -2.43 0.00 -4.70 4.52 3.02 -1.26 -4.60 115.26 109.82 1j88 n ASN 57 Ca 0.00 0.00 -0.43 0.00 -0.03 0.00 0.00 54.58 54.12 1j88 n ASN 57 Cb 0.00 0.00 -0.03 0.00 -0.61 0.00 0.00 39.78 39.14 1j88 n ASN 57 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1j88 n ALA 58 N 0.00 2.32 -2.48 5.41 0.00 -0.67 -4.66 120.51 120.43 1j88 n ALA 58 Ca 0.00 0.41 -0.30 0.00 0.00 0.00 0.00 53.44 53.55 1j88 n ALA 58 Cb 0.00 -2.47 -0.12 0.00 0.00 0.00 0.00 19.45 16.86 1j88 n ALA 58 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1j88 s LYS 59 N 1.22 1.84 0.42 0.00 1.02 -1.26 -0.44 119.74 122.54 1j88 s LYS 59 Ca 0.77 -1.14 0.27 0.00 0.02 0.00 0.00 55.97 55.89 1j88 s LYS 59 Cb -0.56 -2.12 1.37 0.00 -0.52 0.00 0.00 37.83 36.00 1j88 s LYS 59 CO 0.34 0.49 1.63 0.74 -0.92 0.00 0.00 175.35 177.64 1j88 h PHE 60 N 3.94 0.58 0.00 3.18 0.05 -1.94 0.87 116.94 123.62 1j88 h PHE 60 Ca -0.49 0.03 -0.00 0.00 3.82 0.00 0.00 57.97 61.32 1j88 h PHE 60 Cb 1.16 -0.15 -0.00 0.00 2.00 0.00 0.00 35.95 38.97 1j88 h PHE 60 CO 0.58 -0.20 -0.01 0.93 -0.18 0.00 0.00 178.31 179.43 1j88 h GLU 61 N 0.12 0.00 0.00 1.51 3.07 -1.99 -0.47 114.58 116.81 1j88 h GLU 61 Ca 0.80 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.66 1j88 h GLU 61 Cb 2.41 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 30.32 1j88 h GLU 61 CO -0.45 0.01 0.00 -0.44 -1.40 0.00 0.00 179.01 176.73 1j88 h ASP 62 N 0.00 0.00 -3.78 1.42 3.32 0.38 -3.43 116.42 114.33 1j88 h ASP 62 Ca -0.00 0.00 -0.54 0.00 0.02 0.00 0.00 57.03 56.51 1j88 h ASP 62 Cb 0.04 0.00 0.11 0.00 0.22 0.00 0.00 39.33 39.70 1j88 h ASP 62 CO 0.00 0.00 0.77 -1.20 -1.72 0.00 0.00 179.24 177.09 1j88 n SER 63 N -3.07 3.74 0.00 6.45 7.64 -0.19 -4.87 113.62 123.32 1j88 n SER 63 Ca 0.01 1.22 0.00 0.00 1.01 0.00 0.00 58.87 61.11 1j88 n SER 63 Cb 0.36 -1.61 0.00 0.00 -1.01 0.00 0.00 64.21 61.95 1j88 n SER 63 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1j88 n GLY 64 N 0.73 -1.20 3.54 0.23 0.00 0.30 -4.97 105.19 103.82 1j88 n GLY 64 Ca 0.03 -1.15 -0.35 0.00 0.00 0.00 0.00 46.02 44.54 1j88 n GLY 64 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1j88 s GLU 65 N -1.74 3.80 0.17 1.61 2.12 -1.26 -0.70 118.70 122.71 1j88 s GLU 65 Ca 0.00 -0.42 0.09 0.00 0.36 0.00 0.00 54.97 54.99 1j88 s GLU 65 Cb 0.00 -3.21 -0.04 0.00 0.26 0.00 0.00 34.13 31.14 1j88 s GLU 65 CO 0.00 0.10 -0.19 0.71 -0.54 0.00 0.00 175.26 175.34 1j88 s TYR 66 N 0.83 1.87 -0.03 5.30 1.51 -0.42 -0.85 117.35 125.57 1j88 s TYR 66 Ca 0.03 -0.46 -0.29 0.00 -1.01 0.00 0.00 57.07 55.34 1j88 s TYR 66 Cb -0.14 -0.93 0.10 0.00 -0.11 0.00 0.00 41.96 40.88 1j88 s TYR 66 CO 0.02 0.35 0.82 -1.59 -1.11 0.00 0.00 175.55 174.05 1j88 s LYS 67 N -2.81 0.89 0.23 -0.62 -2.85 -1.21 0.24 119.74 113.61 1j88 s LYS 67 Ca 0.17 -0.06 0.06 0.00 -1.00 0.00 0.00 55.97 55.13 1j88 s LYS 67 Cb -0.06 0.41 -0.05 0.00 -2.06 0.00 0.00 37.83 36.07 1j88 s LYS 67 CO 0.07 -0.33 -0.07 0.00 0.10 0.00 0.00 175.35 175.11 1j88 s GLN 69 N -3.74 1.05 0.08 0.00 0.74 -0.86 -0.85 119.66 116.09 1j88 s GLN 69 Ca 0.26 -0.61 0.01 0.00 0.05 0.00 0.00 55.36 55.06 1j88 s GLN 69 Cb 0.03 0.46 0.01 0.00 1.10 0.00 0.00 33.01 34.61 1j88 s GLN 69 CO 0.08 -0.40 0.04 0.72 -0.55 0.00 0.00 175.29 175.19 1j88 n HIS 70 N -0.07 -0.92 0.19 1.67 8.25 -1.26 -1.47 115.22 121.62 1j88 n HIS 70 Ca -0.17 -0.37 -0.15 0.00 -0.26 0.00 0.00 57.72 56.78 1j88 n HIS 70 Cb 0.63 -0.06 -0.07 0.00 1.12 0.00 0.00 29.99 31.60 1j88 n HIS 70 CO 0.00 0.00 0.00 0.37 0.64 0.00 0.00 176.34 177.35 1j88 h GLN 71 N 0.00 -0.61 -2.20 -0.41 5.75 -2.00 -3.30 115.11 112.34 1j88 h GLN 71 Ca -0.06 0.04 -0.58 0.00 -0.15 0.00 0.00 58.65 57.90 1j88 h GLN 71 Cb 0.20 0.14 -0.42 0.00 1.07 0.00 0.00 27.48 28.47 1j88 h GLN 71 CO 0.09 -0.40 -0.70 0.94 -2.65 0.00 0.00 178.83 176.10 1j88 n GLN 72 N -5.42 2.59 -3.69 1.69 7.27 -1.26 -5.05 117.38 113.51 1j88 n GLN 72 Ca -0.09 -4.55 -0.11 0.00 0.07 0.00 0.00 57.00 52.32 1j88 n GLN 72 Cb 0.33 -2.13 -0.06 0.00 2.41 0.00 0.00 30.24 30.79 1j88 n GLN 72 CO 0.00 0.00 0.00 0.08 0.07 0.00 0.00 177.06 177.21 1j88 s VAL 73 N -3.28 0.07 -0.01 1.69 1.01 -1.25 -5.01 120.40 113.63 1j88 s VAL 73 Ca 0.44 -0.61 -0.24 0.00 0.00 0.00 0.00 61.98 61.57 1j88 s VAL 73 Cb 0.23 -1.05 -0.05 0.00 0.00 0.00 0.00 36.38 35.51 1j88 s VAL 73 CO -0.08 -0.34 0.72 0.20 0.00 0.00 0.00 175.10 175.60 1j88 s ASN 74 N -2.35 7.09 0.54 3.32 0.01 -1.26 -4.34 114.94 117.94 1j88 s ASN 74 Ca -0.02 1.30 -0.18 0.00 -0.71 0.00 0.00 52.86 53.26 1j88 s ASN 74 Cb 0.01 -2.43 -0.12 0.00 0.41 0.00 0.00 41.25 39.11 1j88 s ASN 74 CO -0.06 -0.03 0.16 -1.84 -1.51 0.00 0.00 177.10 173.82 1j88 n GLU 75 N 3.19 0.22 -1.64 -0.60 0.28 -1.26 -4.36 120.64 116.47 1j88 n GLU 75 Ca -0.03 0.09 -0.30 0.00 -0.16 0.00 0.00 57.16 56.76 1j88 n GLU 75 Cb 0.51 -1.31 0.08 0.00 1.43 0.00 0.00 31.44 32.15 1j88 n GLU 75 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 177.13 175.43 1j88 s SER 76 N -1.08 4.77 0.00 -1.84 1.04 -0.03 -4.83 113.70 111.73 1j88 s SER 76 Ca 0.62 1.27 -0.30 0.00 0.48 0.00 0.00 55.95 58.01 1j88 s SER 76 Cb -0.47 -2.02 -0.06 0.00 0.10 0.00 0.00 66.02 63.57 1j88 s SER 76 CO 0.61 -1.79 1.42 -1.61 0.98 0.00 0.00 173.24 172.85 1j88 s GLU 77 N -5.21 4.27 0.45 4.02 0.41 -1.26 -4.70 118.70 116.68 1j88 s GLU 77 Ca 0.60 1.98 -0.21 0.00 -0.41 0.00 0.00 54.97 56.93 1j88 s GLU 77 Cb -0.13 -3.59 -0.12 0.00 -1.78 0.00 0.00 34.13 28.51 1j88 s GLU 77 CO 0.54 -0.59 0.45 -2.30 -0.49 0.00 0.00 175.26 172.86 1j88 n PRO 78 N 5.44 0.46 -4.26 0.39 -0.02 -1.26 -4.63 135.00 131.12 1j88 n PRO 78 Ca 0.13 0.17 -0.31 0.00 -2.02 0.00 0.00 63.50 61.48 1j88 n PRO 78 Cb 0.43 -1.45 -0.16 0.00 -0.02 0.00 0.00 33.50 32.30 1j88 n PRO 78 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1j88 s VAL 79 N -1.56 1.71 0.00 -1.45 1.01 0.14 -4.90 120.40 115.34 1j88 s VAL 79 Ca 0.63 -0.74 -0.17 0.00 0.00 0.00 0.00 61.98 61.70 1j88 s VAL 79 Cb -0.58 -1.56 -0.06 0.00 0.00 0.00 0.00 36.38 34.18 1j88 s VAL 79 CO 0.59 0.48 0.47 -0.31 0.00 0.00 0.00 175.10 176.33 1j88 s TYR 80 N 1.21 3.72 -0.07 5.22 2.02 -1.26 -1.30 117.35 126.89 1j88 s TYR 80 Ca -0.00 1.06 0.02 0.00 -0.37 0.00 0.00 57.07 57.78 1j88 s TYR 80 Cb -0.14 -2.40 0.01 0.00 -0.40 0.00 0.00 41.96 39.04 1j88 s TYR 80 CO -0.07 0.55 -0.13 -1.17 -1.57 0.00 0.00 175.55 173.16 1j88 s LEU 81 N -0.80 1.66 -0.08 -1.29 2.96 0.13 -4.87 118.68 116.39 1j88 s LEU 81 Ca 0.26 -0.33 0.04 0.00 -0.22 0.00 0.00 54.13 53.88 1j88 s LEU 81 Cb -0.17 -0.89 -0.00 0.00 0.50 0.00 0.00 46.19 45.63 1j88 s LEU 81 CO 0.15 0.03 -0.21 -0.70 -1.32 0.00 0.00 176.35 174.30 1j88 s GLU 82 N 0.72 2.57 -0.13 1.98 2.12 -1.08 -0.54 118.70 124.34 1j88 s GLU 82 Ca -0.13 -0.77 -0.06 0.00 0.36 0.00 0.00 54.97 54.36 1j88 s GLU 82 Cb -0.16 -2.03 -0.04 0.00 0.26 0.00 0.00 34.13 32.16 1j88 s GLU 82 CO 0.03 0.20 0.08 0.08 -0.54 0.00 0.00 175.26 175.11 1j88 s VAL 83 N 0.26 5.00 0.29 3.70 1.01 -1.25 -0.60 120.40 128.81 1j88 s VAL 83 Ca -0.14 0.02 0.08 0.00 0.00 0.00 0.00 61.98 61.94 1j88 s VAL 83 Cb -0.16 -3.19 -0.06 0.00 0.00 0.00 0.00 36.38 32.97 1j88 s VAL 83 CO 0.06 0.56 -0.08 -0.36 0.00 0.00 0.00 175.10 175.28 1j88 s PHE 84 N -0.51 2.04 -0.17 5.22 0.40 0.35 -4.90 117.98 120.41 1j88 s PHE 84 Ca 0.11 -0.63 -0.04 0.00 -0.60 0.00 0.00 56.93 55.77 1j88 s PHE 84 Cb -0.12 -1.14 0.06 0.00 0.51 0.00 0.00 43.02 42.33 1j88 s PHE 84 CO 0.02 0.37 0.07 0.45 0.70 0.00 0.00 175.22 176.83 1j88 s SER 85 N -3.47 2.42 -0.20 1.36 0.15 -1.26 0.16 113.70 112.86 1j88 s SER 85 Ca 0.30 -0.61 -0.36 0.00 0.70 0.00 0.00 55.95 55.97 1j88 s SER 85 Cb 0.03 -0.36 0.15 0.00 -1.71 0.00 0.00 66.02 64.13 1j88 s SER 85 CO 0.13 -0.32 1.36 -0.62 1.20 0.00 0.00 173.24 174.99 1j88 s ASP 86 N 2.04 -0.03 0.06 5.45 -1.08 -1.26 -5.06 116.67 116.80 1j88 s ASP 86 Ca 0.01 -0.02 -0.25 0.00 -0.52 0.00 0.00 52.55 51.77 1j88 s ASP 86 Cb -0.16 0.05 -0.17 0.00 -1.46 0.00 0.00 42.92 41.18 1j88 s ASP 86 CO -0.08 -0.08 1.60 -0.50 0.52 0.00 0.00 175.17 176.63 1j88 h TRP 87 N 2.00 -0.19 -4.17 -5.34 6.55 -1.95 -3.41 115.95 109.43 1j88 h TRP 87 Ca -0.14 -0.00 -0.64 0.00 0.95 0.00 0.00 58.89 59.06 1j88 h TRP 87 Cb 1.16 0.06 -0.25 0.00 -0.86 0.00 0.00 29.16 29.27 1j88 h TRP 87 CO 0.30 -0.04 -0.86 -0.51 -1.05 0.00 0.00 178.44 176.28 1j88 s LEU 88 N -9.96 2.19 -0.07 -4.49 1.43 -1.26 -0.92 118.68 105.60 1j88 s LEU 88 Ca -0.14 -0.59 0.00 0.00 -1.03 0.00 0.00 54.13 52.37 1j88 s LEU 88 Cb 0.05 -1.12 0.02 0.00 0.03 0.00 0.00 46.19 45.17 1j88 s LEU 88 CO 0.64 0.19 -0.04 -0.22 0.23 0.00 0.00 176.35 177.15 1j88 s LEU 89 N -1.36 1.10 -0.23 1.79 2.96 0.57 -4.35 118.68 119.16 1j88 s LEU 89 Ca 0.10 -0.16 -0.24 0.00 -0.22 0.00 0.00 54.13 53.60 1j88 s LEU 89 Cb -0.09 -0.55 -0.01 0.00 0.50 0.00 0.00 46.19 46.03 1j88 s LEU 89 CO 0.03 -0.10 0.80 -0.22 -1.32 0.00 0.00 176.35 175.54 1j88 s LEU 90 N 1.37 4.10 -0.03 -0.68 2.96 -1.26 -1.14 118.68 124.00 1j88 s LEU 90 Ca -0.03 1.03 0.00 0.00 -0.22 0.00 0.00 54.13 54.90 1j88 s LEU 90 Cb -0.13 -3.16 -0.04 0.00 0.50 0.00 0.00 46.19 43.36 1j88 s LEU 90 CO -0.03 -0.47 0.01 -1.10 -1.32 0.00 0.00 176.35 173.44 1j88 s GLN 91 N 2.65 2.86 0.02 1.98 -0.21 0.14 -4.93 119.66 122.18 1j88 s GLN 91 Ca 0.34 -0.54 0.06 0.00 0.02 0.00 0.00 55.36 55.24 1j88 s GLN 91 Cb -0.16 -2.72 -0.02 0.00 1.00 0.00 0.00 33.01 31.12 1j88 s GLN 91 CO 0.08 0.65 -0.17 0.00 -2.12 0.00 0.00 175.29 173.73 1j88 s ALA 92 N -1.03 1.45 0.08 6.09 0.00 -1.26 -0.45 121.76 126.64 1j88 s ALA 92 Ca 0.18 -0.86 -0.35 0.00 0.00 0.00 0.00 51.96 50.93 1j88 s ALA 92 Cb -0.11 -0.30 -0.17 0.00 0.00 0.00 0.00 23.12 22.54 1j88 s ALA 92 CO 0.08 0.32 1.59 0.66 0.00 0.00 0.00 175.76 178.41 1j88 h SER 93 N 5.21 -1.16 -4.48 0.00 4.64 -1.16 -3.38 113.55 113.21 1j88 h SER 93 Ca -0.39 0.08 -0.29 0.00 -0.47 0.00 0.00 61.79 60.72 1j88 h SER 93 Cb 1.16 0.36 -0.24 0.00 -0.31 0.00 0.00 62.40 63.38 1j88 h SER 93 CO 0.46 -0.64 -0.74 0.00 -0.87 0.00 0.00 176.83 175.03 1j88 s ALA 94 N -5.95 0.52 -0.61 5.18 0.00 -1.26 -4.73 121.76 114.91 1j88 s ALA 94 Ca -0.18 -0.58 0.24 0.00 0.00 0.00 0.00 51.96 51.44 1j88 s ALA 94 Cb 0.04 -0.01 0.37 0.00 0.00 0.00 0.00 23.12 23.53 1j88 s ALA 94 CO 0.61 0.02 1.36 0.93 0.00 0.00 0.00 175.76 178.69 1j88 h GLU 95 N 5.01 0.00 -4.09 0.00 5.08 -1.92 -3.45 114.58 115.21 1j88 h GLU 95 Ca -0.33 0.00 -0.38 0.00 -1.00 0.00 0.00 59.36 57.65 1j88 h GLU 95 Cb 1.20 0.00 -0.32 0.00 0.50 0.00 0.00 28.75 30.13 1j88 h GLU 95 CO 0.44 0.00 -0.76 0.08 -1.00 0.00 0.00 179.01 177.76 1j88 s VAL 96 N -3.18 0.46 -0.04 3.13 1.01 -1.26 -1.86 120.40 118.66 1j88 s VAL 96 Ca 0.06 -0.13 -0.04 0.00 0.00 0.00 0.00 61.98 61.88 1j88 s VAL 96 Cb 0.13 -0.47 0.01 0.00 0.00 0.00 0.00 36.38 36.05 1j88 s VAL 96 CO 0.71 0.18 0.10 -0.69 0.00 0.00 0.00 175.10 175.41 1j88 s VAL 97 N 0.61 0.00 0.06 2.92 1.01 0.49 -4.99 120.40 120.50 1j88 s VAL 97 Ca -0.08 -0.03 -0.31 0.00 0.00 0.00 0.00 61.98 61.57 1j88 s VAL 97 Cb -0.11 -0.16 -0.06 0.00 0.00 0.00 0.00 36.38 36.05 1j88 s VAL 97 CO -0.00 -0.02 1.35 -0.04 0.00 0.00 0.00 175.10 176.39 1j88 s MET 98 N 0.00 4.33 -0.08 2.72 -1.94 -1.26 -1.09 119.30 121.98 1j88 s MET 98 Ca -0.01 1.96 -0.40 0.00 -1.71 0.00 0.00 55.69 55.53 1j88 s MET 98 Cb -0.01 -3.40 -0.19 0.00 2.01 0.00 0.00 34.83 33.24 1j88 s MET 98 CO 0.00 -0.45 1.27 -1.91 -0.01 0.00 0.00 175.02 173.92 1j88 n GLU 99 N 4.52 0.37 0.00 2.03 2.13 0.14 -1.34 120.64 128.49 1j88 n GLU 99 Ca 0.12 0.13 0.00 0.00 0.66 0.00 0.00 57.16 58.07 1j88 n GLU 99 Cb 0.44 -1.68 0.00 0.00 0.27 0.00 0.00 31.44 30.46 1j88 n GLU 99 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1j88 n GLY 100 N 2.35 2.70 3.94 8.31 0.00 -0.24 -4.95 105.19 117.30 1j88 n GLY 100 Ca 0.22 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.98 1j88 n GLY 100 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1j88 s GLN 101 N -0.61 1.89 0.43 1.61 -1.52 -0.45 -4.15 119.66 116.85 1j88 s GLN 101 Ca 0.00 -0.46 -0.12 0.00 -1.95 0.00 0.00 55.36 52.83 1j88 s GLN 101 Cb 0.00 -2.17 -0.07 0.00 -0.22 0.00 0.00 33.01 30.55 1j88 s GLN 101 CO 0.00 -1.42 0.82 -1.25 -0.25 0.00 0.00 175.29 173.19 1j88 s PRO 102 N -5.30 3.84 -0.03 2.91 0.04 -0.97 -1.55 135.00 133.93 1j88 s PRO 102 Ca 0.63 0.60 -0.01 0.00 0.04 0.00 0.00 61.00 62.27 1j88 s PRO 102 Cb -0.09 -2.33 0.03 0.00 0.04 0.00 0.00 34.50 32.15 1j88 s PRO 102 CO 0.45 -0.08 0.03 -1.17 0.04 0.00 0.00 177.00 176.28 1j88 s LEU 103 N -3.84 0.82 -0.11 -3.56 2.96 0.29 -4.92 118.68 110.30 1j88 s LEU 103 Ca 0.53 0.04 0.02 0.00 -0.22 0.00 0.00 54.13 54.51 1j88 s LEU 103 Cb -0.10 -0.11 0.01 0.00 0.50 0.00 0.00 46.19 46.49 1j88 s LEU 103 CO 0.30 -0.16 -0.18 -0.36 -1.32 0.00 0.00 176.35 174.63 1j88 s PHE 104 N 1.39 2.22 0.01 5.38 0.40 -1.26 -1.11 117.98 125.01 1j88 s PHE 104 Ca -0.05 -1.03 0.05 0.00 -0.60 0.00 0.00 56.93 55.30 1j88 s PHE 104 Cb -0.13 -1.55 -0.03 0.00 0.51 0.00 0.00 43.02 41.82 1j88 s PHE 104 CO -0.03 -0.49 -0.13 -0.51 0.70 0.00 0.00 175.22 174.77 1j88 s LEU 105 N 0.80 2.87 -0.03 -0.37 1.43 -0.97 -0.56 118.68 121.84 1j88 s LEU 105 Ca -0.10 -0.27 0.00 0.00 -1.03 0.00 0.00 54.13 52.74 1j88 s LEU 105 Cb -0.16 -1.65 0.03 0.00 0.03 0.00 0.00 46.19 44.44 1j88 s LEU 105 CO 0.01 0.28 0.01 -0.60 0.23 0.00 0.00 176.35 176.27 1j88 s ARG 106 N -1.31 0.26 -0.51 1.70 3.52 0.41 -2.74 118.95 120.28 1j88 s ARG 106 Ca 0.15 0.10 -0.21 0.00 -0.13 0.00 0.00 55.73 55.64 1j88 s ARG 106 Cb -0.11 -0.48 0.05 0.00 -1.56 0.00 0.00 34.95 32.85 1j88 s ARG 106 CO 0.05 -0.15 0.75 0.00 -0.81 0.00 0.00 175.30 175.15 1j88 s HIS 108 N 3.18 3.30 0.25 0.00 2.46 -0.29 -4.96 115.29 119.24 1j88 s HIS 108 Ca 0.23 0.15 -0.05 0.00 0.47 0.00 0.00 55.06 55.86 1j88 s HIS 108 Cb -0.16 -2.18 -0.06 0.00 -0.13 0.00 0.00 32.58 30.06 1j88 s HIS 108 CO 0.16 0.12 0.52 0.20 -2.47 0.00 0.00 174.74 173.27 1j88 s GLY 109 N 0.69 1.98 0.72 1.59 0.00 -1.26 -0.31 107.32 110.73 1j88 s GLY 109 Ca 0.06 -0.52 -0.16 0.00 0.00 0.00 0.00 44.72 44.10 1j88 s GLY 109 CO 0.01 -0.42 1.23 1.87 0.00 0.00 0.00 173.10 175.80 1j88 n TRP 110 N -0.64 1.58 -1.08 1.90 -0.00 -0.10 -2.33 117.44 116.77 1j88 n TRP 110 Ca -0.02 0.41 -0.05 0.00 -0.00 0.00 0.00 57.50 57.84 1j88 n TRP 110 Cb 0.53 -2.19 -0.02 0.00 -0.00 0.00 0.00 31.31 29.63 1j88 n TRP 110 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 177.69 178.23 1j88 n ARG 111 N -2.44 -1.24 -1.70 5.87 1.74 -1.26 0.06 116.66 117.69 1j88 n ARG 111 Ca 0.15 0.34 -0.14 0.00 -0.77 0.00 0.00 57.85 57.42 1j88 n ARG 111 Cb 0.49 -4.34 -0.04 0.00 -1.02 0.00 0.00 32.46 27.55 1j88 n ARG 111 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 1j88 n ASN 112 N 0.47 -4.62 -2.98 0.55 2.85 -0.99 -4.99 115.26 105.56 1j88 n ASN 112 Ca -0.05 0.23 -0.07 0.00 -0.11 0.00 0.00 54.58 54.58 1j88 n ASN 112 Cb 0.20 -3.52 0.07 0.00 1.24 0.00 0.00 39.78 37.77 1j88 n ASN 112 CO 0.00 0.00 0.00 0.79 -2.11 0.00 0.00 177.26 175.94 1j88 n TRP 113 N -3.05 -2.59 -4.26 1.20 8.01 0.11 -4.97 117.44 111.89 1j88 n TRP 113 Ca -0.15 -0.20 -0.34 0.00 -1.31 0.00 0.00 57.50 55.50 1j88 n TRP 113 Cb 0.52 -0.28 -0.08 0.00 -2.01 0.00 0.00 31.31 29.46 1j88 n TRP 113 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.69 176.17 1j88 s ASP 114 N -2.24 5.35 0.03 -0.99 1.01 -1.26 -4.68 116.67 113.89 1j88 s ASP 114 Ca 0.16 0.11 0.08 0.00 0.71 0.00 0.00 52.55 53.61 1j88 s ASP 114 Cb -0.02 -1.49 -0.02 0.00 1.01 0.00 0.00 42.92 42.39 1j88 s ASP 114 CO 0.13 0.32 -0.25 -0.69 0.21 0.00 0.00 175.17 174.89 1j88 s VAL 115 N -1.03 1.98 0.29 -1.27 1.01 -1.26 -4.52 120.40 115.59 1j88 s VAL 115 Ca 0.18 -1.25 0.06 0.00 0.00 0.00 0.00 61.98 60.97 1j88 s VAL 115 Cb -0.12 -1.68 -0.06 0.00 0.00 0.00 0.00 36.38 34.52 1j88 s VAL 115 CO 0.08 0.39 -0.02 -0.31 0.00 0.00 0.00 175.10 175.23 1j88 s TYR 116 N -0.73 1.94 -1.21 5.22 1.51 -0.99 -2.73 117.35 120.36 1j88 s TYR 116 Ca 0.10 -0.78 -0.18 0.00 -1.01 0.00 0.00 57.07 55.21 1j88 s TYR 116 Cb -0.10 -1.17 -0.00 0.00 -0.11 0.00 0.00 41.96 40.59 1j88 s TYR 116 CO 0.01 0.20 0.70 1.63 -1.11 0.00 0.00 175.55 176.98 1j88 n LYS 117 N -0.61 -1.63 -3.17 -0.62 5.02 0.27 -1.24 118.16 116.18 1j88 n LYS 117 Ca -0.05 0.41 -0.39 0.00 -2.02 0.00 0.00 58.31 56.26 1j88 n LYS 117 Cb 0.64 -4.06 -0.06 0.00 -0.02 0.00 0.00 35.03 31.54 1j88 n LYS 117 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1j88 s VAL 118 N -3.58 4.70 -0.04 -0.18 1.01 0.53 -4.28 120.40 118.55 1j88 s VAL 118 Ca 0.37 1.36 -0.00 0.00 0.00 0.00 0.00 61.98 63.70 1j88 s VAL 118 Cb -0.14 -3.97 0.03 0.00 0.00 0.00 0.00 36.38 32.29 1j88 s VAL 118 CO 0.88 0.50 0.01 -0.63 0.00 0.00 0.00 175.10 175.86 1j88 s ILE 119 N -0.82 0.17 -0.02 2.22 1.01 -0.29 -1.11 121.20 122.36 1j88 s ILE 119 Ca 0.32 0.15 -0.13 0.00 0.00 0.00 0.00 60.65 60.99 1j88 s ILE 119 Cb -0.20 -0.31 -0.05 0.00 0.01 0.00 0.00 42.46 41.91 1j88 s ILE 119 CO 0.20 0.18 0.35 -0.31 0.00 0.00 0.00 174.94 175.36 1j88 s TYR 120 N 1.43 3.69 -0.02 3.97 1.51 -0.88 -1.00 117.35 126.05 1j88 s TYR 120 Ca -0.04 0.88 0.08 0.00 -1.01 0.00 0.00 57.07 56.98 1j88 s TYR 120 Cb -0.13 -2.20 -0.02 0.00 -0.11 0.00 0.00 41.96 39.50 1j88 s TYR 120 CO -0.03 0.65 -0.25 0.71 -1.11 0.00 0.00 175.55 175.52 1j88 s TYR 121 N -1.10 2.27 -0.18 2.71 1.51 0.27 -1.17 117.35 121.65 1j88 s TYR 121 Ca 0.23 -0.43 -0.00 0.00 -1.01 0.00 0.00 57.07 55.86 1j88 s TYR 121 Cb -0.15 -1.46 0.05 0.00 -0.11 0.00 0.00 41.96 40.29 1j88 s TYR 121 CO 0.12 -0.03 -0.05 0.21 -1.11 0.00 0.00 175.55 174.69 1j88 s LYS 122 N -0.63 1.43 -1.23 -0.62 2.20 -0.58 -1.80 119.74 118.52 1j88 s LYS 122 Ca 0.10 -0.61 -0.08 0.00 -0.36 0.00 0.00 55.97 55.02 1j88 s LYS 122 Cb -0.10 -2.14 0.01 0.00 -1.51 0.00 0.00 37.83 34.09 1j88 s LYS 122 CO -0.01 -0.48 1.07 -0.25 -0.36 0.00 0.00 175.35 175.33 1j88 n ASP 123 N 4.84 -5.74 0.00 1.43 8.00 -0.24 -2.31 116.55 122.54 1j88 n ASP 123 Ca -0.12 -0.50 0.00 0.00 0.71 0.00 0.00 54.79 54.88 1j88 n ASP 123 Cb 0.47 -4.65 0.00 0.00 -0.02 0.00 0.00 41.12 36.92 1j88 n ASP 123 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1j88 n GLY 124 N -1.83 2.12 3.87 0.44 0.00 -1.26 -5.00 105.19 103.52 1j88 n GLY 124 Ca -0.01 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.66 1j88 n GLY 124 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1j88 s GLU 125 N -0.03 3.73 0.58 1.61 0.41 -0.98 -5.07 118.70 118.95 1j88 s GLU 125 Ca 0.00 0.14 -0.18 0.00 -0.41 0.00 0.00 54.97 54.51 1j88 s GLU 125 Cb 0.00 -3.03 -0.04 0.00 -1.78 0.00 0.00 34.13 29.28 1j88 s GLU 125 CO 0.00 0.59 1.15 0.00 -0.49 0.00 0.00 175.26 176.51 1j88 s ALA 126 N -1.35 2.60 0.04 5.21 0.00 -1.26 -1.52 121.76 125.47 1j88 s ALA 126 Ca 0.31 0.84 0.00 0.00 0.00 0.00 0.00 51.96 53.11 1j88 s ALA 126 Cb -0.14 -3.39 0.00 0.00 0.00 0.00 0.00 23.12 19.60 1j88 s ALA 126 CO 0.17 -1.00 0.00 -0.11 0.00 0.00 0.00 175.76 174.83 1j88 n LEU 127 N -1.59 0.06 -3.91 0.00 7.94 -0.32 -4.78 117.00 114.41 1j88 n LEU 127 Ca 0.12 0.06 -0.10 0.00 -1.11 0.00 0.00 56.01 54.98 1j88 n LEU 127 Cb 0.51 0.02 -0.09 0.00 0.53 0.00 0.00 43.42 44.38 1j88 n LEU 127 CO 0.44 -0.37 -0.20 -0.54 -1.11 0.00 0.00 177.39 175.61 1j88 s LYS 128 N -2.00 0.55 -0.01 1.96 -0.14 -1.23 -4.98 119.74 113.90 1j88 s LYS 128 Ca 0.00 -0.63 -0.01 0.00 -1.36 0.00 0.00 55.97 53.97 1j88 s LYS 128 Cb 0.00 0.22 0.00 0.00 -1.68 0.00 0.00 37.83 36.37 1j88 s LYS 128 CO 0.00 -0.14 0.03 -0.47 -0.76 0.00 0.00 175.35 174.01 1j88 s TYR 129 N -2.20 -0.02 0.05 3.18 5.04 -1.26 -2.06 117.35 120.09 1j88 s TYR 129 Ca -0.08 0.05 -0.10 0.00 -2.44 0.00 0.00 57.07 54.49 1j88 s TYR 129 Cb -0.03 0.00 0.01 0.00 0.35 0.00 0.00 41.96 42.29 1j88 s TYR 129 CO -0.03 -0.02 0.22 -1.58 -1.34 0.00 0.00 175.55 172.81 1j88 s TRP 130 N -0.04 0.03 -0.01 4.97 0.52 -0.27 -5.00 118.94 119.15 1j88 s TRP 130 Ca -0.01 -0.28 -0.00 0.00 0.02 0.00 0.00 56.10 55.83 1j88 s TRP 130 Cb -0.01 -0.00 -0.00 0.00 -1.15 0.00 0.00 33.47 32.31 1j88 s TRP 130 CO 0.00 -0.48 -0.00 -0.92 0.02 0.00 0.00 176.95 175.57 1j88 h TYR 131 N 3.22 0.00 -3.41 -1.98 3.20 -1.95 0.15 116.97 116.21 1j88 h TYR 131 Ca -0.32 0.00 -0.55 0.00 3.14 0.00 0.00 58.73 61.00 1j88 h TYR 131 Cb 1.20 0.00 -0.04 0.00 1.54 0.00 0.00 36.73 39.43 1j88 h TYR 131 CO 0.47 0.00 0.22 -1.21 -1.64 0.00 0.00 178.16 176.00 1j88 s GLU 132 N -1.05 4.52 0.71 1.82 0.41 -1.26 -0.56 118.70 123.28 1j88 s GLU 132 Ca -0.00 1.15 -0.14 0.00 -0.41 0.00 0.00 54.97 55.57 1j88 s GLU 132 Cb 0.00 -3.42 0.03 0.00 -1.78 0.00 0.00 34.13 28.95 1j88 s GLU 132 CO 0.00 0.10 1.13 0.54 -0.49 0.00 0.00 175.26 176.54 1j88 s ASN 133 N 0.57 4.70 0.00 -0.19 4.22 -1.11 -4.94 114.94 118.19 1j88 s ASN 133 Ca 0.43 2.04 0.00 0.00 -2.14 0.00 0.00 52.86 53.20 1j88 s ASN 133 Cb -0.20 -2.55 0.00 0.00 1.28 0.00 0.00 41.25 39.78 1j88 s ASN 133 CO 0.24 -1.91 0.00 1.57 -2.04 0.00 0.00 177.10 174.96 1j88 n HIS 134 N -2.78 0.00 -3.44 1.54 -0.00 -1.26 -5.07 115.22 104.21 1j88 n HIS 134 Ca 0.11 0.00 -0.09 0.00 0.46 0.00 0.00 57.72 58.20 1j88 n HIS 134 Cb 0.52 0.00 -0.09 0.00 -0.12 0.00 0.00 29.99 30.30 1j88 n HIS 134 CO 0.00 0.00 0.00 -0.80 0.46 0.00 0.00 176.34 176.00 1j88 s ASN 135 N 0.95 0.14 0.19 0.26 0.01 -1.26 -4.54 114.94 110.69 1j88 s ASN 135 Ca 0.00 0.42 -0.31 0.00 -0.71 0.00 0.00 52.86 52.26 1j88 s ASN 135 Cb 0.00 1.15 -0.09 0.00 0.41 0.00 0.00 41.25 42.72 1j88 s ASN 135 CO 0.00 -0.28 1.42 -0.51 -1.51 0.00 0.00 177.10 176.22 1j88 s ILE 136 N 2.55 2.93 -0.02 0.60 2.07 -1.11 -4.93 121.20 123.31 1j88 s ILE 136 Ca 0.09 0.73 0.03 0.00 -1.41 0.00 0.00 60.65 60.08 1j88 s ILE 136 Cb -0.14 -3.46 -0.00 0.00 0.13 0.00 0.00 42.46 38.98 1j88 s ILE 136 CO -0.15 0.09 -0.09 -0.55 -1.91 0.00 0.00 174.94 172.34 1j88 s SER 137 N 0.68 1.09 -0.12 4.50 0.15 -1.26 -2.30 113.70 116.43 1j88 s SER 137 Ca 0.62 -0.17 -0.00 0.00 0.70 0.00 0.00 55.95 57.10 1j88 s SER 137 Cb -0.40 -0.20 0.02 0.00 -1.71 0.00 0.00 66.02 63.73 1j88 s SER 137 CO 0.37 0.08 -0.10 -0.63 1.20 0.00 0.00 173.24 174.16 1j88 s ILE 138 N -0.01 1.20 0.00 6.45 1.01 -0.26 -5.02 121.20 124.57 1j88 s ILE 138 Ca 0.00 -0.40 0.00 0.00 0.00 0.00 0.00 60.65 60.25 1j88 s ILE 138 Cb -0.06 -1.18 0.00 0.00 0.01 0.00 0.00 42.46 41.24 1j88 s ILE 138 CO -0.00 0.40 0.31 0.35 0.00 0.00 0.00 174.94 175.99 1j88 n THR 139 N 4.84 0.00 -3.63 2.92 -2.24 -1.26 -0.55 114.28 114.36 1j88 n THR 139 Ca -0.14 0.71 -0.39 0.00 -2.27 0.00 0.00 64.05 61.96 1j88 n THR 139 Cb 0.50 -1.51 -0.11 0.00 -2.10 0.00 0.00 70.33 67.11 1j88 n THR 139 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1j88 s ASN 140 N -2.24 5.69 -0.16 3.42 2.47 -1.26 -2.30 114.94 120.55 1j88 s ASN 140 Ca 0.00 -0.38 -0.19 0.00 0.42 0.00 0.00 52.86 52.71 1j88 s ASN 140 Cb 0.00 -2.04 -0.04 0.00 -1.45 0.00 0.00 41.25 37.72 1j88 s ASN 140 CO 0.00 -0.16 0.52 0.00 -3.72 0.00 0.00 177.10 173.74 1j88 s ALA 141 N 1.66 3.51 0.92 1.71 0.00 -0.60 -4.88 121.76 124.08 1j88 s ALA 141 Ca 0.06 -0.29 -0.15 0.00 0.00 0.00 0.00 51.96 51.58 1j88 s ALA 141 Cb -0.17 -2.77 0.16 0.00 0.00 0.00 0.00 23.12 20.34 1j88 s ALA 141 CO 0.08 -0.27 1.27 0.99 0.00 0.00 0.00 175.76 177.82 1j88 s THR 142 N 1.25 1.99 -0.89 0.00 2.01 -1.26 -1.08 115.64 117.66 1j88 s THR 142 Ca 0.26 0.00 0.24 0.00 0.31 0.00 0.00 61.69 62.50 1j88 s THR 142 Cb -0.15 -2.98 -0.03 0.00 0.01 0.00 0.00 72.50 69.35 1j88 s THR 142 CO 0.10 0.00 1.30 0.55 -0.69 0.00 0.00 174.62 175.88 1j88 n VAL 143 N -3.65 0.08 1.04 3.82 3.14 -1.26 -3.53 118.33 117.96 1j88 n VAL 143 Ca 0.13 -0.08 0.14 0.00 -2.96 0.00 0.00 64.34 61.57 1j88 n VAL 143 Cb 0.60 0.25 0.63 0.00 -1.06 0.00 0.00 33.84 34.26 1j88 n VAL 143 CO 0.00 0.00 0.00 -0.62 -6.46 0.00 0.00 176.83 169.75 1j88 n GLU 144 N -1.66 0.04 0.01 1.45 -0.58 -1.26 -3.03 120.64 115.61 1j88 n GLU 144 Ca 0.04 0.00 0.13 0.00 -0.42 0.00 0.00 57.16 56.92 1j88 n GLU 144 Cb 0.37 -1.50 0.57 0.00 -0.57 0.00 0.00 31.44 30.31 1j88 n GLU 144 CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 1j88 n ASP 145 N -1.48 0.08 -4.75 1.62 8.00 -1.23 -4.82 116.55 113.97 1j88 n ASP 145 Ca 0.08 0.51 -0.35 0.00 0.71 0.00 0.00 54.79 55.73 1j88 n ASP 145 Cb 0.33 -0.53 0.05 0.00 -0.02 0.00 0.00 41.12 40.94 1j88 n ASP 145 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 1j88 s SER 146 N -3.15 5.01 0.00 -2.24 0.01 -1.17 -4.91 113.70 107.25 1j88 s SER 146 Ca 0.13 2.36 0.00 0.00 1.31 0.00 0.00 55.95 59.75 1j88 s SER 146 Cb 0.17 -2.59 0.00 0.00 0.21 0.00 0.00 66.02 63.81 1j88 s SER 146 CO 0.51 -1.72 0.00 0.61 0.41 0.00 0.00 173.24 173.05 1j88 n GLY 147 N 0.42 -0.67 3.04 3.44 0.00 -0.29 -5.01 105.19 106.13 1j88 n GLY 147 Ca 0.13 -1.09 -0.31 0.00 0.00 0.00 0.00 46.02 44.75 1j88 n GLY 147 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1j88 s THR 148 N -3.00 1.74 0.37 2.61 -4.23 -1.26 -0.15 115.64 111.72 1j88 s THR 148 Ca 0.00 -0.82 0.07 0.00 -1.18 0.00 0.00 61.69 59.77 1j88 s THR 148 Cb 0.00 -1.65 -0.02 0.00 1.34 0.00 0.00 72.50 72.17 1j88 s THR 148 CO 0.00 0.42 0.36 -0.31 -0.54 0.00 0.00 174.62 174.54 1j88 s TYR 149 N 1.40 2.85 -0.20 3.99 1.51 0.43 -1.08 117.35 126.26 1j88 s TYR 149 Ca 0.03 -0.36 -0.32 0.00 -1.01 0.00 0.00 57.07 55.41 1j88 s TYR 149 Cb -0.14 -1.98 0.15 0.00 -0.11 0.00 0.00 41.96 39.88 1j88 s TYR 149 CO -0.11 0.02 1.19 1.52 -1.11 0.00 0.00 175.55 177.07 1j88 s TYR 150 N -2.35 -0.16 0.15 2.71 -0.85 -0.74 0.58 117.35 116.68 1j88 s TYR 150 Ca 0.45 0.19 0.06 0.00 -0.52 0.00 0.00 57.07 57.25 1j88 s TYR 150 Cb -0.06 0.50 -0.04 0.00 0.38 0.00 0.00 41.96 42.74 1j88 s TYR 150 CO 0.28 -0.20 -0.13 0.00 -1.52 0.00 0.00 175.55 173.98 1j88 s THR 152 N -2.80 1.67 0.05 0.00 -4.23 -0.17 -1.67 115.64 108.49 1j88 s THR 152 Ca 0.15 -1.53 -0.28 0.00 -1.18 0.00 0.00 61.69 58.86 1j88 s THR 152 Cb -0.01 -1.52 0.09 0.00 1.34 0.00 0.00 72.50 72.40 1j88 s THR 152 CO 0.03 -0.07 0.97 -0.83 -0.54 0.00 0.00 174.62 174.18 1j88 s GLY 153 N -1.90 -0.35 -0.24 3.99 0.00 -0.71 -1.14 107.32 106.97 1j88 s GLY 153 Ca 0.06 0.63 -0.05 0.00 0.00 0.00 0.00 44.72 45.36 1j88 s GLY 153 CO 0.04 0.18 0.00 1.25 0.00 0.00 0.00 173.10 174.58 1j88 s LYS 154 N -3.10 3.37 -0.15 2.90 2.20 -0.38 -0.60 119.74 123.98 1j88 s LYS 154 Ca 0.09 -0.65 -0.04 0.00 -0.36 0.00 0.00 55.97 55.01 1j88 s LYS 154 Cb -0.01 -3.14 -0.03 0.00 -1.51 0.00 0.00 37.83 33.14 1j88 s LYS 154 CO -0.03 -0.25 -0.00 0.08 -0.36 0.00 0.00 175.35 174.79 1j88 s VAL 155 N 1.51 4.22 0.00 4.02 1.01 0.40 -2.34 120.40 129.21 1j88 s VAL 155 Ca 0.05 -0.25 0.00 0.00 0.00 0.00 0.00 61.98 61.78 1j88 s VAL 155 Cb -0.15 -2.85 0.00 0.00 0.00 0.00 0.00 36.38 33.38 1j88 s VAL 155 CO -0.01 0.51 0.00 0.79 0.00 0.00 0.00 175.10 176.39 1j88 n TRP 156 N 3.24 0.00 -1.40 5.22 5.03 -1.26 -1.00 117.44 127.27 1j88 n TRP 156 Ca -0.17 0.00 0.00 0.00 3.03 0.00 0.00 57.50 60.36 1j88 n TRP 156 Cb 0.53 0.00 0.00 0.00 -1.03 0.00 0.00 31.31 30.81 1j88 n TRP 156 CO 0.00 0.00 0.00 1.04 -0.03 0.00 0.00 177.69 178.70 1j88 n GLN 157 N 0.00 0.00 -4.43 -0.99 1.13 -1.26 -5.08 117.38 106.75 1j88 n GLN 157 Ca 0.00 -0.50 -0.26 0.00 -1.94 0.00 0.00 57.00 54.30 1j88 n GLN 157 Cb 0.00 -0.40 -0.11 0.00 0.11 0.00 0.00 30.24 29.84 1j88 n GLN 157 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 1j88 s LEU 158 N 0.00 2.46 0.08 1.08 1.43 -0.17 -5.11 118.68 118.44 1j88 s LEU 158 Ca 0.00 -0.90 -0.15 0.00 -1.03 0.00 0.00 54.13 52.05 1j88 s LEU 158 Cb 0.00 -1.14 -0.06 0.00 0.03 0.00 0.00 46.19 45.01 1j88 s LEU 158 CO 0.00 0.10 0.50 -1.81 0.23 0.00 0.00 176.35 175.37 1j88 s ASP 159 N -2.81 6.87 0.01 2.29 1.01 -1.26 -0.46 116.67 122.32 1j88 s ASP 159 Ca 0.22 1.07 -0.01 0.00 0.71 0.00 0.00 52.55 54.54 1j88 s ASP 159 Cb -0.07 -2.29 -0.01 0.00 1.01 0.00 0.00 42.92 41.56 1j88 s ASP 159 CO 0.11 0.23 -0.00 -0.31 0.21 0.00 0.00 175.17 175.40 1j88 s TYR 160 N -1.24 0.20 -0.01 4.23 1.51 0.23 -4.95 117.35 117.32 1j88 s TYR 160 Ca 0.31 -0.41 0.07 0.00 -1.01 0.00 0.00 57.07 56.02 1j88 s TYR 160 Cb -0.17 -0.15 -0.02 0.00 -0.11 0.00 0.00 41.96 41.51 1j88 s TYR 160 CO 0.17 -0.18 -0.21 -2.00 -1.11 0.00 0.00 175.55 172.22 1j88 s GLU 161 N -1.28 2.20 0.52 -0.62 2.12 -1.26 -1.73 118.70 118.64 1j88 s GLU 161 Ca -0.14 -0.88 -0.01 0.00 0.36 0.00 0.00 54.97 54.30 1j88 s GLU 161 Cb -0.09 -2.17 0.01 0.00 0.26 0.00 0.00 34.13 32.15 1j88 s GLU 161 CO -0.01 0.57 0.76 -1.54 -0.54 0.00 0.00 175.26 174.51 1j88 s SER 162 N -0.86 5.57 0.33 -1.70 1.04 -0.67 -4.73 113.70 112.69 1j88 s SER 162 Ca 0.11 0.30 -0.28 0.00 0.48 0.00 0.00 55.95 56.56 1j88 s SER 162 Cb -0.10 -1.37 -0.10 0.00 0.10 0.00 0.00 66.02 64.55 1j88 s SER 162 CO 0.01 -0.94 1.20 -1.61 0.98 0.00 0.00 173.24 172.88 1j88 s GLU 163 N -4.74 4.40 0.66 4.02 0.41 -1.26 -4.71 118.70 117.48 1j88 s GLU 163 Ca 0.52 1.99 -0.15 0.00 -0.41 0.00 0.00 54.97 56.93 1j88 s GLU 163 Cb -0.10 -3.03 -0.00 0.00 -1.78 0.00 0.00 34.13 29.21 1j88 s GLU 163 CO 0.40 -0.07 1.10 -1.25 -0.49 0.00 0.00 175.26 174.94 1j88 s PRO 164 N -1.77 2.87 -0.07 0.39 0.04 -1.26 -4.62 135.00 130.59 1j88 s PRO 164 Ca 0.49 1.32 -0.03 0.00 0.04 0.00 0.00 61.00 62.82 1j88 s PRO 164 Cb -0.35 -1.97 0.04 0.00 0.04 0.00 0.00 34.50 32.26 1j88 s PRO 164 CO 0.46 -1.18 0.13 -1.17 0.04 0.00 0.00 177.00 175.28 1j88 s LEU 165 N -4.90 0.33 0.58 -3.56 2.96 0.20 -4.97 118.68 109.32 1j88 s LEU 165 Ca 0.65 0.26 -0.13 0.00 -0.22 0.00 0.00 54.13 54.69 1j88 s LEU 165 Cb -0.19 0.22 -0.06 0.00 0.50 0.00 0.00 46.19 46.66 1j88 s LEU 165 CO 0.42 -0.20 1.01 0.20 -1.32 0.00 0.00 176.35 176.46 1j88 s ASN 166 N 1.78 6.38 -0.19 3.68 0.01 -1.26 -0.42 114.94 124.91 1j88 s ASN 166 Ca -0.02 1.49 -0.10 0.00 -0.71 0.00 0.00 52.86 53.52 1j88 s ASN 166 Cb -0.12 -2.49 0.07 0.00 0.41 0.00 0.00 41.25 39.12 1j88 s ASN 166 CO -0.05 -0.76 0.46 -0.63 -1.51 0.00 0.00 177.10 174.60 1j88 s ILE 167 N -2.95 -0.13 -0.02 0.60 1.01 0.79 -4.90 121.20 115.60 1j88 s ILE 167 Ca 0.57 0.09 0.08 0.00 0.00 0.00 0.00 60.65 61.38 1j88 s ILE 167 Cb -0.11 -0.68 -0.02 0.00 0.01 0.00 0.00 42.46 41.66 1j88 s ILE 167 CO 0.45 0.04 -0.26 -0.89 0.00 0.00 0.00 174.94 174.28 1j88 s THR 168 N 1.63 2.03 -0.29 2.92 2.01 -0.78 -1.13 115.64 122.04 1j88 s THR 168 Ca -0.08 -1.10 0.03 0.00 0.31 0.00 0.00 61.69 60.85 1j88 s THR 168 Cb -0.08 -1.68 0.08 0.00 0.01 0.00 0.00 72.50 70.82 1j88 s THR 168 CO -0.14 0.57 -0.04 -0.69 -0.69 0.00 0.00 174.62 173.63 1j88 s VAL 169 N -0.59 2.11 0.70 3.82 1.01 -1.26 -0.38 120.40 125.81 1j88 s VAL 169 Ca 0.09 -1.84 -0.03 0.00 0.00 0.00 0.00 61.98 60.20 1j88 s VAL 169 Cb -0.10 -2.36 0.09 0.00 0.00 0.00 0.00 36.38 34.01 1j88 s VAL 169 CO -0.01 -0.25 0.98 0.27 0.00 0.00 0.00 175.10 176.09 1j88 s ILE 170 N 1.07 2.29 0.00 2.22 -4.36 -0.25 -4.79 121.20 117.37 1j88 s ILE 170 Ca -0.01 -0.47 0.00 0.00 -0.26 0.00 0.00 60.65 59.91 1j88 s ILE 170 Cb -0.19 -2.81 0.00 0.00 1.25 0.00 0.00 42.46 40.70 1j88 s ILE 170 CO -0.07 0.00 0.29 2.29 0.24 0.00 0.00 174.94 177.70