#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 4.19 -0.10 1.64 0.04 -1.26 -5.07 135.00 134.44 1j88 s PRO 5 Ca 0.00 1.06 -0.01 0.00 0.04 0.00 0.00 61.00 62.08 1j88 s PRO 5 Cb 0.00 -2.21 0.03 0.00 0.04 0.00 0.00 34.50 32.36 1j88 s PRO 5 CO 0.00 -0.02 -0.02 0.21 0.04 0.00 0.00 177.00 177.21 1j88 s LYS 6 N -3.20 0.91 -0.03 4.56 2.20 -1.26 -4.26 119.74 118.66 1j88 s LYS 6 Ca 0.61 -0.06 -0.30 0.00 -0.36 0.00 0.00 55.97 55.86 1j88 s LYS 6 Cb -0.09 -1.27 -0.04 0.00 -1.51 0.00 0.00 37.83 34.92 1j88 s LYS 6 CO 0.14 -0.32 1.32 0.08 -0.36 0.00 0.00 175.35 176.22 1j88 s VAL 7 N 1.88 3.94 0.29 4.02 1.01 -1.26 -3.54 120.40 126.74 1j88 s VAL 7 Ca 0.04 1.29 0.09 0.00 0.00 0.00 0.00 61.98 63.40 1j88 s VAL 7 Cb -0.13 -3.83 -0.04 0.00 0.00 0.00 0.00 36.38 32.38 1j88 s VAL 7 CO -0.06 -0.01 0.07 -0.94 0.00 0.00 0.00 175.10 174.16 1j88 s SER 8 N 1.76 4.70 0.14 3.32 1.04 -0.52 -4.99 113.70 119.15 1j88 s SER 8 Ca 0.61 -0.65 0.08 0.00 0.48 0.00 0.00 55.95 56.46 1j88 s SER 8 Cb -0.28 -0.86 -0.04 0.00 0.10 0.00 0.00 66.02 64.94 1j88 s SER 8 CO 0.24 -0.12 -0.17 -0.76 0.98 0.00 0.00 173.24 173.41 1j88 s LEU 9 N -3.76 2.41 -0.26 2.42 1.43 -1.26 -2.22 118.68 117.44 1j88 s LEU 9 Ca 0.34 -0.82 -0.03 0.00 -1.03 0.00 0.00 54.13 52.59 1j88 s LEU 9 Cb -0.05 -0.76 0.14 0.00 0.03 0.00 0.00 46.19 45.56 1j88 s LEU 9 CO 0.21 -0.05 0.46 0.21 0.23 0.00 0.00 176.35 177.41 1j88 s ASN 10 N -2.48 -0.36 1.02 2.29 2.47 -0.94 -3.76 114.94 113.18 1j88 s ASN 10 Ca 0.12 0.57 -0.14 0.00 0.42 0.00 0.00 52.86 53.83 1j88 s ASN 10 Cb -0.06 1.51 0.09 0.00 -1.45 0.00 0.00 41.25 41.34 1j88 s ASN 10 CO 0.05 -0.28 0.42 -2.65 -3.72 0.00 0.00 177.10 170.93 1j88 n PRO 11 N 5.39 -0.88 0.25 0.43 -0.02 -1.26 -1.83 135.00 137.07 1j88 n PRO 11 Ca -0.04 -0.22 0.12 0.00 -2.02 0.00 0.00 63.50 61.34 1j88 n PRO 11 Cb 0.50 -1.90 0.63 0.00 -0.02 0.00 0.00 33.50 32.71 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 -1.85 0.00 -6.24 0.52 0.11 -1.95 -3.45 132.00 119.14 1j88 h PRO 12 Ca -0.48 0.00 -0.68 0.00 0.11 0.00 0.00 66.00 64.95 1j88 h PRO 12 Cb 1.31 0.00 0.03 0.00 0.11 0.00 0.00 31.00 32.44 1j88 h PRO 12 CO 0.37 0.15 0.86 0.91 -0.21 0.00 0.00 178.00 180.09 1j88 n TRP 13 N -3.47 2.05 -0.62 0.65 5.03 -1.26 -4.86 117.44 114.96 1j88 n TRP 13 Ca -0.01 0.39 0.08 0.00 3.03 0.00 0.00 57.50 60.99 1j88 n TRP 13 Cb 0.32 -2.50 0.27 0.00 -1.03 0.00 0.00 31.31 28.37 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 5.00 3.96 -3.72 -0.99 6.94 -1.26 -4.80 115.26 120.39 1j88 n ASN 14 Ca 0.23 -2.51 -0.27 0.00 -0.02 0.00 0.00 54.58 52.01 1j88 n ASN 14 Cb 0.20 -0.47 -0.17 0.00 -2.36 0.00 0.00 39.78 36.99 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 -1.94 0.57 0.25 -3.83 0.52 -1.26 -2.42 118.95 110.84 1j88 s ARG 15 Ca 0.40 -0.32 0.05 0.00 -0.52 0.00 0.00 55.73 55.34 1j88 s ARG 15 Cb 0.27 -1.95 -0.05 0.00 0.52 0.00 0.00 34.95 33.74 1j88 s ARG 15 CO 0.17 -0.61 -0.04 0.96 0.02 0.00 0.00 175.30 175.80 1j88 s ILE 16 N 1.91 1.33 0.58 1.52 -4.36 0.03 -4.88 121.20 117.32 1j88 s ILE 16 Ca 0.00 -2.08 -0.12 0.00 -0.26 0.00 0.00 60.65 58.19 1j88 s ILE 16 Cb -0.16 -2.36 -0.05 0.00 1.25 0.00 0.00 42.46 41.14 1j88 s ILE 16 CO -0.08 -0.34 1.00 -0.36 0.24 0.00 0.00 174.94 175.40 1j88 s PHE 17 N -3.22 3.57 0.14 1.37 2.99 -1.26 0.99 117.98 122.55 1j88 s PHE 17 Ca 0.28 1.32 -0.31 0.00 0.00 0.00 0.00 56.93 58.22 1j88 s PHE 17 Cb 0.04 -2.72 -0.10 0.00 0.00 0.00 0.00 43.02 40.25 1j88 s PHE 17 CO 0.10 -0.56 1.68 0.21 -0.00 0.00 0.00 175.22 176.65 1j88 s LYS 18 N -4.78 4.18 0.00 0.44 2.20 0.94 -2.50 119.74 120.22 1j88 s LYS 18 Ca 0.56 2.45 0.00 0.00 -0.36 0.00 0.00 55.97 58.62 1j88 s LYS 18 Cb -0.11 -3.36 0.00 0.00 -1.51 0.00 0.00 37.83 32.85 1j88 s LYS 18 CO 0.46 -0.72 0.00 0.41 -0.36 0.00 0.00 175.35 175.13 1j88 n GLY 19 N 3.97 0.39 3.93 5.54 0.00 0.43 -4.85 105.19 114.59 1j88 n GLY 19 Ca 0.16 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.89 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 -0.88 1.37 0.02 1.61 2.02 -1.04 -3.86 118.70 117.95 1j88 s GLU 20 Ca 0.00 -0.30 0.07 0.00 0.02 0.00 0.00 54.97 54.77 1j88 s GLU 20 Cb 0.00 -1.97 -0.02 0.00 0.10 0.00 0.00 34.13 32.24 1j88 s GLU 20 CO 0.00 -1.90 -0.22 -0.80 0.02 0.00 0.00 175.26 172.37 1j88 s ASN 21 N -4.73 2.56 -0.03 -0.19 0.01 -1.26 -1.91 114.94 109.39 1j88 s ASN 21 Ca 0.68 -0.48 -0.11 0.00 -0.71 0.00 0.00 52.86 52.23 1j88 s ASN 21 Cb -0.07 -0.24 0.02 0.00 0.41 0.00 0.00 41.25 41.36 1j88 s ASN 21 CO 0.50 0.21 0.24 0.54 -1.51 0.00 0.00 177.10 177.08 1j88 s VAL 22 N -0.69 0.05 -0.15 1.60 0.11 -1.00 -4.68 120.40 115.64 1j88 s VAL 22 Ca 0.08 -0.42 0.00 0.00 -2.93 0.00 0.00 61.98 58.72 1j88 s VAL 22 Cb -0.09 -0.50 -0.00 0.00 -1.53 0.00 0.00 36.38 34.26 1j88 s VAL 22 CO 0.01 -0.23 -0.15 -0.89 -3.33 0.00 0.00 175.10 170.51 1j88 s THR 23 N -0.96 2.70 -0.50 5.04 2.01 -0.76 -1.82 115.64 121.35 1j88 s THR 23 Ca -0.10 -0.76 -0.12 0.00 0.31 0.00 0.00 61.69 61.01 1j88 s THR 23 Cb -0.05 -2.14 0.12 0.00 0.01 0.00 0.00 72.50 70.44 1j88 s THR 23 CO 0.02 0.52 0.41 -0.76 -0.69 0.00 0.00 174.62 174.12 1j88 s LEU 24 N 0.71 5.87 -0.01 4.42 1.43 -0.71 -2.22 118.68 128.16 1j88 s LEU 24 Ca -0.07 -1.82 -0.27 0.00 -1.03 0.00 0.00 54.13 50.94 1j88 s LEU 24 Cb -0.16 -2.10 -0.04 0.00 0.03 0.00 0.00 46.19 43.93 1j88 s LEU 24 CO 0.02 -0.75 0.87 -0.89 0.23 0.00 0.00 176.35 175.83 1j88 s THR 25 N 1.47 4.90 -1.02 5.49 2.01 -0.94 -2.22 115.64 125.32 1j88 s THR 25 Ca 0.04 1.83 0.00 0.00 0.31 0.00 0.00 61.69 63.87 1j88 s THR 25 Cb -0.28 -4.21 0.00 0.00 0.01 0.00 0.00 72.50 68.02 1j88 s THR 25 CO 0.01 0.21 0.41 0.00 -0.69 0.00 0.00 174.62 174.57 1j88 n ASN 27 N 0.08 0.00 0.00 0.00 6.94 -1.23 -4.23 115.26 116.82 1j88 n ASN 27 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 54.58 54.56 1j88 n ASN 27 Cb 0.20 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.62 1j88 n ASN 27 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1j88 n GLY 28 N -0.20 0.00 3.94 4.83 0.00 -1.26 -4.65 105.19 107.85 1j88 n GLY 28 Ca 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.75 1j88 n GLY 28 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1j88 s ASN 29 N 0.00 6.35 0.00 1.61 0.01 -1.26 -4.99 114.94 116.66 1j88 s ASN 29 Ca 0.00 0.21 0.01 0.00 -0.71 0.00 0.00 52.86 52.37 1j88 s ASN 29 Cb 0.00 -1.93 0.08 0.00 0.41 0.00 0.00 41.25 39.82 1j88 s ASN 29 CO 0.00 0.06 1.03 -3.20 -1.51 0.00 0.00 177.10 173.48 1j88 n ASN 30 N -0.43 0.00 0.07 -1.22 2.85 -1.26 -2.75 115.26 112.52 1j88 n ASN 30 Ca -0.06 -1.91 0.12 0.00 -0.11 0.00 0.00 54.58 52.62 1j88 n ASN 30 Cb 0.54 0.00 0.20 0.00 1.24 0.00 0.00 39.78 41.75 1j88 n ASN 30 CO 0.00 0.00 0.00 0.33 -2.11 0.00 0.00 177.26 175.48 1j88 n PHE 31 N -0.52 0.62 -3.97 1.20 7.35 -1.26 -4.87 117.46 116.01 1j88 n PHE 31 Ca 0.01 0.18 -0.35 0.00 -0.76 0.00 0.00 57.45 56.53 1j88 n PHE 31 Cb 0.00 -0.70 -0.06 0.00 0.35 0.00 0.00 39.48 39.07 1j88 n PHE 31 CO 0.00 0.00 0.00 -0.06 -0.76 0.00 0.00 176.76 175.94 1j88 s PHE 32 N -3.16 3.49 0.22 -5.13 0.08 -1.11 -5.12 117.98 107.25 1j88 s PHE 32 Ca 0.07 0.39 0.08 0.00 0.12 0.00 0.00 56.93 57.58 1j88 s PHE 32 Cb 0.13 -1.85 -0.05 0.00 -0.57 0.00 0.00 43.02 40.68 1j88 s PHE 32 CO 0.71 0.65 -0.13 -1.21 -0.10 0.00 0.00 175.22 175.14 1j88 s GLU 33 N -1.47 1.37 0.06 0.44 2.02 -1.26 -4.99 118.70 114.87 1j88 s GLU 33 Ca 0.21 -1.62 -0.27 0.00 0.02 0.00 0.00 54.97 53.30 1j88 s GLU 33 Cb -0.12 -1.12 0.09 0.00 0.10 0.00 0.00 34.13 33.08 1j88 s GLU 33 CO 0.11 0.16 0.82 0.08 0.02 0.00 0.00 175.26 176.45 1j88 s VAL 34 N -2.98 0.00 0.35 2.63 1.01 -1.26 -5.10 120.40 115.05 1j88 s VAL 34 Ca 0.24 -0.09 0.05 0.00 0.00 0.00 0.00 61.98 62.18 1j88 s VAL 34 Cb 0.00 -1.12 -0.07 0.00 0.00 0.00 0.00 36.38 35.19 1j88 s VAL 34 CO 0.08 0.00 0.02 -0.94 0.00 0.00 0.00 175.10 174.26 1j88 s SER 35 N -2.60 2.98 -0.91 3.32 1.04 -1.26 -3.55 113.70 112.73 1j88 s SER 35 Ca 0.05 -1.35 -0.05 0.00 0.48 0.00 0.00 55.95 55.08 1j88 s SER 35 Cb -0.01 -0.21 -0.05 0.00 0.10 0.00 0.00 66.02 65.84 1j88 s SER 35 CO -0.09 -0.51 0.80 -1.54 0.98 0.00 0.00 173.24 172.89 1j88 n SER 36 N -0.78 -6.33 -4.59 7.02 3.41 -1.25 -4.98 113.62 106.12 1j88 n SER 36 Ca -0.04 -0.56 -0.29 0.00 -0.26 0.00 0.00 58.87 57.73 1j88 n SER 36 Cb 0.66 -4.77 -0.09 0.00 -0.26 0.00 0.00 64.21 59.75 1j88 n SER 36 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1j88 s THR 37 N -3.30 3.37 -0.10 6.66 2.01 -1.05 -4.26 115.64 118.96 1j88 s THR 37 Ca 0.36 -1.38 0.02 0.00 0.31 0.00 0.00 61.69 61.00 1j88 s THR 37 Cb -0.05 -2.61 -0.01 0.00 0.01 0.00 0.00 72.50 69.84 1j88 s THR 37 CO 0.67 0.03 -0.18 -0.54 -0.69 0.00 0.00 174.62 173.91 1j88 s LYS 38 N -2.45 3.02 -0.10 4.92 1.02 -0.14 -4.44 119.74 121.57 1j88 s LYS 38 Ca 0.23 -0.77 0.04 0.00 0.02 0.00 0.00 55.97 55.49 1j88 s LYS 38 Cb -0.10 -2.44 -0.00 0.00 -0.52 0.00 0.00 37.83 34.77 1j88 s LYS 38 CO 0.15 0.31 -0.22 -1.58 -0.92 0.00 0.00 175.35 173.08 1j88 s TRP 39 N 0.07 2.58 -0.35 3.18 0.52 -1.26 -1.88 118.94 121.80 1j88 s TRP 39 Ca -0.08 -0.93 0.03 0.00 0.02 0.00 0.00 56.10 55.15 1j88 s TRP 39 Cb -0.15 -1.71 0.10 0.00 -1.15 0.00 0.00 33.47 30.56 1j88 s TRP 39 CO 0.05 -0.35 0.08 -0.06 0.02 0.00 0.00 176.95 176.69 1j88 s PHE 40 N 0.25 3.30 -0.52 -1.98 0.40 -0.13 0.92 117.98 120.21 1j88 s PHE 40 Ca -0.15 -2.78 -0.24 0.00 -0.60 0.00 0.00 56.93 53.16 1j88 s PHE 40 Cb -0.17 -2.68 0.04 0.00 0.51 0.00 0.00 43.02 40.72 1j88 s PHE 40 CO 0.08 -0.91 0.92 -1.58 0.70 0.00 0.00 175.22 174.42 1j88 s HIS 41 N 0.91 2.84 -1.13 0.36 2.46 -0.75 -3.23 115.29 116.76 1j88 s HIS 41 Ca 0.11 0.06 0.00 0.00 0.47 0.00 0.00 55.06 55.70 1j88 s HIS 41 Cb -0.19 -4.00 0.00 0.00 -0.13 0.00 0.00 32.58 28.25 1j88 s HIS 41 CO -0.10 -1.26 0.00 0.09 -2.47 0.00 0.00 174.74 171.00 1j88 n ASN 42 N 7.30 -4.26 0.00 9.88 4.13 0.63 -2.65 115.26 130.29 1j88 n ASN 42 Ca 0.02 0.25 0.00 0.00 1.68 0.00 0.00 54.58 56.54 1j88 n ASN 42 Cb 0.48 -2.74 0.00 0.00 -1.54 0.00 0.00 39.78 35.98 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 -1.64 3.01 3.71 7.41 0.00 -1.24 -5.01 105.19 111.42 1j88 n GLY 43 Ca -0.11 -0.44 -0.42 0.00 0.00 0.00 0.00 46.02 45.05 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 0.46 6.92 0.42 1.61 0.01 -1.09 -4.88 113.70 117.15 1j88 s SER 44 Ca 0.00 2.20 -0.26 0.00 1.31 0.00 0.00 55.95 59.20 1j88 s SER 44 Cb 0.00 -2.58 -0.09 0.00 0.21 0.00 0.00 66.02 63.56 1j88 s SER 44 CO 0.00 -0.59 1.44 -0.22 0.41 0.00 0.00 173.24 174.28 1j88 s LEU 45 N 1.14 4.19 0.45 2.44 2.96 -1.26 -1.81 118.68 126.78 1j88 s LEU 45 Ca 0.62 2.96 0.03 0.00 -0.22 0.00 0.00 54.13 57.51 1j88 s LEU 45 Cb -0.34 -3.84 0.01 0.00 0.50 0.00 0.00 46.19 42.52 1j88 s LEU 45 CO 0.30 -1.05 0.64 -0.55 -1.32 0.00 0.00 176.35 174.36 1j88 s SER 46 N -0.39 5.72 0.00 3.68 0.15 0.26 -4.85 113.70 118.27 1j88 s SER 46 Ca 0.58 0.05 0.26 0.00 0.70 0.00 0.00 55.95 57.54 1j88 s SER 46 Cb -0.44 -1.24 0.60 0.00 -1.71 0.00 0.00 66.02 63.23 1j88 s SER 46 CO 0.58 -0.75 1.48 -0.62 1.20 0.00 0.00 173.24 175.13 1j88 n GLU 47 N -2.02 0.17 -2.79 5.44 1.02 -1.26 -4.70 120.64 116.50 1j88 n GLU 47 Ca 0.03 -0.10 -0.31 0.00 -0.02 0.00 0.00 57.16 56.76 1j88 n GLU 47 Cb 0.58 -1.50 -0.04 0.00 -0.02 0.00 0.00 31.44 30.47 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 -2.89 3.89 0.00 3.49 2.56 -1.26 -4.97 118.70 119.51 1j88 s GLU 48 Ca 0.14 0.66 0.00 0.00 0.00 0.00 0.00 54.97 55.77 1j88 s GLU 48 Cb 0.18 -2.32 0.00 0.00 2.00 0.00 0.00 34.13 33.99 1j88 s GLU 48 CO 0.65 -0.06 0.00 0.25 -0.56 0.00 0.00 175.26 175.54 1j88 n THR 49 N -1.17 0.00 -1.56 -1.70 -2.24 -1.26 -4.50 114.28 101.85 1j88 n THR 49 Ca 0.04 0.00 -0.39 0.00 -2.27 0.00 0.00 64.05 61.43 1j88 n THR 49 Cb 0.54 -0.03 0.04 0.00 -2.10 0.00 0.00 70.33 68.78 1j88 n THR 49 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1j88 n ASN 50 N -1.07 0.21 0.16 3.42 2.85 -1.26 -2.54 115.26 117.03 1j88 n ASN 50 Ca 0.00 0.83 0.13 0.00 -0.11 0.00 0.00 54.58 55.43 1j88 n ASN 50 Cb 0.11 -1.30 0.54 0.00 1.24 0.00 0.00 39.78 40.37 1j88 n ASN 50 CO 0.00 0.00 0.00 0.77 -2.11 0.00 0.00 177.26 175.92 1j88 h SER 51 N 0.62 0.00 -3.65 1.20 4.64 -1.94 -3.40 113.55 111.03 1j88 h SER 51 Ca -0.46 0.00 -0.69 0.00 -0.47 0.00 0.00 61.79 60.17 1j88 h SER 51 Cb 1.37 0.00 -0.28 0.00 -0.31 0.00 0.00 62.40 63.18 1j88 h SER 51 CO 0.51 0.00 -0.62 -0.44 -0.87 0.00 0.00 176.83 175.41 1j88 s SER 52 N -4.46 5.21 -0.47 4.97 0.01 -1.26 -1.48 113.70 116.21 1j88 s SER 52 Ca 0.03 -1.03 -0.16 0.00 1.31 0.00 0.00 55.95 56.10 1j88 s SER 52 Cb 0.09 -1.86 0.07 0.00 0.21 0.00 0.00 66.02 64.54 1j88 s SER 52 CO 0.40 -0.28 0.40 -0.22 0.41 0.00 0.00 173.24 173.95 1j88 s LEU 53 N 1.42 5.64 0.67 2.44 2.96 -0.94 -4.95 118.68 125.91 1j88 s LEU 53 Ca -0.01 -1.34 -0.11 0.00 -0.22 0.00 0.00 54.13 52.45 1j88 s LEU 53 Cb -0.19 -2.19 -0.01 0.00 0.50 0.00 0.00 46.19 44.31 1j88 s LEU 53 CO 0.02 -0.65 1.06 0.20 -1.32 0.00 0.00 176.35 175.66 1j88 s ASN 54 N 2.63 5.78 -0.06 3.68 0.01 -1.26 -1.73 114.94 123.99 1j88 s ASN 54 Ca 0.04 1.30 -0.02 0.00 -0.71 0.00 0.00 52.86 53.46 1j88 s ASN 54 Cb -0.24 -2.22 0.04 0.00 0.41 0.00 0.00 41.25 39.24 1j88 s ASN 54 CO 0.07 -1.15 0.10 -0.63 -1.51 0.00 0.00 177.10 173.97 1j88 s ILE 55 N -3.25 -0.16 0.02 0.60 1.01 -0.76 -4.94 121.20 113.73 1j88 s ILE 55 Ca 0.57 0.39 0.00 0.00 0.00 0.00 0.00 60.65 61.61 1j88 s ILE 55 Cb -0.11 -0.20 0.00 0.00 0.01 0.00 0.00 42.46 42.16 1j88 s ILE 55 CO 0.53 0.16 0.03 0.52 0.00 0.00 0.00 174.94 176.18 1j88 n VAL 56 N 5.24 0.00 0.00 2.92 0.31 -1.26 -2.37 118.33 123.17 1j88 n VAL 56 Ca -0.05 -0.09 0.00 0.00 -0.01 0.00 0.00 64.34 64.19 1j88 n VAL 56 Cb 0.50 -0.82 0.00 0.00 -0.91 0.00 0.00 33.84 32.61 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 -2.65 0.00 -4.59 4.52 3.02 -1.25 -4.58 115.26 109.72 1j88 n ASN 57 Ca 0.00 0.00 -0.57 0.00 -0.03 0.00 0.00 54.58 53.99 1j88 n ASN 57 Cb 0.03 0.00 -0.07 0.00 -0.61 0.00 0.00 39.78 39.12 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 -1.92 -2.71 5.41 0.00 -0.80 -4.47 120.51 116.02 1j88 n ALA 58 Ca 0.00 0.53 -0.25 0.00 0.00 0.00 0.00 53.44 53.72 1j88 n ALA 58 Cb 0.00 -1.96 -0.07 0.00 0.00 0.00 0.00 19.45 17.42 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 0.91 2.58 0.41 0.00 1.02 -1.26 -0.43 119.74 122.96 1j88 s LYS 59 Ca 0.91 -1.09 0.17 0.00 0.02 0.00 0.00 55.97 55.98 1j88 s LYS 59 Cb -1.14 -2.43 1.06 0.00 -0.52 0.00 0.00 37.83 34.80 1j88 s LYS 59 CO 0.56 0.44 1.84 0.74 -0.92 0.00 0.00 175.35 178.01 1j88 h PHE 60 N 2.35 0.59 0.00 3.18 0.05 -1.93 0.71 116.94 121.90 1j88 h PHE 60 Ca -0.47 0.02 -0.00 0.00 3.82 0.00 0.00 57.97 61.34 1j88 h PHE 60 Cb 1.21 -0.18 -0.00 0.00 2.00 0.00 0.00 35.95 38.98 1j88 h PHE 60 CO 0.61 0.14 -0.00 0.93 -0.18 0.00 0.00 178.31 179.81 1j88 h GLU 61 N 0.44 0.00 0.00 1.51 3.07 -1.99 -0.42 114.58 117.19 1j88 h GLU 61 Ca 0.49 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.35 1j88 h GLU 61 Cb 1.19 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.10 1j88 h GLU 61 CO -0.20 0.00 0.00 -0.44 -1.40 0.00 0.00 179.01 176.97 1j88 h ASP 62 N 0.00 0.00 -3.77 1.42 3.32 -1.24 -3.43 116.42 112.71 1j88 h ASP 62 Ca -0.00 0.00 -0.55 0.00 0.02 0.00 0.00 57.03 56.50 1j88 h ASP 62 Cb 0.02 0.00 0.12 0.00 0.22 0.00 0.00 39.33 39.69 1j88 h ASP 62 CO 0.00 0.00 0.65 -1.20 -1.72 0.00 0.00 179.24 176.97 1j88 n SER 63 N -3.08 3.21 0.00 6.45 7.64 -0.17 -4.88 113.62 122.79 1j88 n SER 63 Ca 0.02 1.16 0.00 0.00 1.01 0.00 0.00 58.87 61.06 1j88 n SER 63 Cb 0.37 -1.57 0.00 0.00 -1.01 0.00 0.00 64.21 62.00 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 0.62 -1.35 3.58 0.23 0.00 0.18 -4.97 105.19 103.49 1j88 n GLY 64 Ca 0.04 -1.18 -0.36 0.00 0.00 0.00 0.00 46.02 44.53 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 -1.76 3.90 0.17 1.61 2.12 -1.26 -0.60 118.70 122.89 1j88 s GLU 65 Ca 0.00 -0.37 0.10 0.00 0.36 0.00 0.00 54.97 55.06 1j88 s GLU 65 Cb 0.00 -3.35 -0.04 0.00 0.26 0.00 0.00 34.13 31.00 1j88 s GLU 65 CO 0.00 0.06 -0.21 0.71 -0.54 0.00 0.00 175.26 175.27 1j88 s TYR 66 N 0.99 2.05 0.00 5.30 1.51 -0.06 -0.27 117.35 126.88 1j88 s TYR 66 Ca 0.05 -0.41 -0.28 0.00 -1.01 0.00 0.00 57.07 55.42 1j88 s TYR 66 Cb -0.14 -1.03 0.09 0.00 -0.11 0.00 0.00 41.96 40.77 1j88 s TYR 66 CO 0.03 0.40 0.77 -1.59 -1.11 0.00 0.00 175.55 174.05 1j88 s LYS 67 N -2.63 0.97 0.21 -0.62 -2.85 -1.20 -0.81 119.74 112.82 1j88 s LYS 67 Ca 0.17 -0.12 0.05 0.00 -1.00 0.00 0.00 55.97 55.07 1j88 s LYS 67 Cb -0.07 0.45 -0.05 0.00 -2.06 0.00 0.00 37.83 36.10 1j88 s LYS 67 CO 0.08 -0.38 -0.07 0.00 0.10 0.00 0.00 175.35 175.08 1j88 s GLN 69 N -3.76 1.01 0.10 0.00 0.74 -0.79 -0.94 119.66 116.02 1j88 s GLN 69 Ca 0.24 -0.58 0.01 0.00 0.05 0.00 0.00 55.36 55.08 1j88 s GLN 69 Cb 0.03 0.45 0.01 0.00 1.10 0.00 0.00 33.01 34.60 1j88 s GLN 69 CO 0.07 -0.38 0.06 0.72 -0.55 0.00 0.00 175.29 175.21 1j88 n HIS 70 N 0.05 -1.02 0.17 1.67 8.25 -1.26 -0.97 115.22 122.12 1j88 n HIS 70 Ca -0.17 -0.42 -0.14 0.00 -0.26 0.00 0.00 57.72 56.73 1j88 n HIS 70 Cb 0.62 -0.08 -0.07 0.00 1.12 0.00 0.00 29.99 31.59 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 -0.57 -2.21 -0.41 5.75 -1.94 -3.30 115.11 112.42 1j88 h GLN 71 Ca -0.06 0.04 -0.58 0.00 -0.15 0.00 0.00 58.65 57.89 1j88 h GLN 71 Cb 0.23 0.13 -0.42 0.00 1.07 0.00 0.00 27.48 28.49 1j88 h GLN 71 CO 0.10 -0.38 -0.70 0.94 -2.65 0.00 0.00 178.83 176.14 1j88 n GLN 72 N -5.41 2.66 -3.71 1.69 7.27 -1.26 -5.05 117.38 113.57 1j88 n GLN 72 Ca -0.08 -4.57 -0.12 0.00 0.07 0.00 0.00 57.00 52.29 1j88 n GLN 72 Cb 0.32 -2.14 -0.07 0.00 2.41 0.00 0.00 30.24 30.76 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 -3.46 0.07 0.17 1.69 1.01 -1.24 -5.02 120.40 113.61 1j88 s VAL 73 Ca 0.44 -0.55 -0.26 0.00 0.00 0.00 0.00 61.98 61.62 1j88 s VAL 73 Cb 0.24 -0.90 -0.08 0.00 0.00 0.00 0.00 36.38 35.64 1j88 s VAL 73 CO -0.09 -0.30 0.80 0.20 0.00 0.00 0.00 175.10 175.71 1j88 s ASN 74 N -1.92 7.42 0.59 3.32 0.01 -1.26 -4.31 114.94 118.79 1j88 s ASN 74 Ca -0.06 1.69 -0.18 0.00 -0.71 0.00 0.00 52.86 53.59 1j88 s ASN 74 Cb -0.01 -2.52 -0.08 0.00 0.41 0.00 0.00 41.25 39.05 1j88 s ASN 74 CO -0.02 0.19 0.56 -1.84 -1.51 0.00 0.00 177.10 174.49 1j88 n GLU 75 N 1.66 0.52 -1.54 -0.60 0.28 -1.26 -4.40 120.64 115.30 1j88 n GLU 75 Ca -0.05 0.21 -0.31 0.00 -0.16 0.00 0.00 57.16 56.85 1j88 n GLU 75 Cb 0.48 -1.76 0.06 0.00 1.43 0.00 0.00 31.44 31.66 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 -1.22 5.11 0.24 -1.84 1.04 -0.11 -4.85 113.70 112.08 1j88 s SER 76 Ca 0.69 1.57 -0.30 0.00 0.48 0.00 0.00 55.95 58.39 1j88 s SER 76 Cb -0.43 -2.41 -0.10 0.00 0.10 0.00 0.00 66.02 63.18 1j88 s SER 76 CO 0.54 -1.61 1.48 -1.61 0.98 0.00 0.00 173.24 173.02 1j88 s GLU 77 N -5.05 4.24 0.79 4.02 0.41 -1.26 -4.70 118.70 117.15 1j88 s GLU 77 Ca 0.59 2.36 -0.14 0.00 -0.41 0.00 0.00 54.97 57.37 1j88 s GLU 77 Cb -0.14 -3.10 0.08 0.00 -1.78 0.00 0.00 34.13 29.18 1j88 s GLU 77 CO 0.55 -0.48 1.21 -2.14 -0.49 0.00 0.00 175.26 173.91 1j88 s PRO 78 N -0.18 1.71 -0.05 0.39 0.02 -1.26 -4.66 135.00 130.97 1j88 s PRO 78 Ca 0.61 1.78 0.01 0.00 0.02 0.00 0.00 61.00 63.42 1j88 s PRO 78 Cb -0.43 -1.78 0.02 0.00 0.02 0.00 0.00 34.50 32.33 1j88 s PRO 78 CO 0.42 -2.17 -0.05 0.08 -0.33 0.00 0.00 177.00 174.96 1j88 s VAL 79 N -2.09 0.58 -0.22 3.83 1.01 0.01 -4.93 120.40 118.58 1j88 s VAL 79 Ca 0.74 -0.13 -0.12 0.00 0.00 0.00 0.00 61.98 62.47 1j88 s VAL 79 Cb -0.29 -0.61 -0.05 0.00 0.00 0.00 0.00 36.38 35.43 1j88 s VAL 79 CO 0.50 0.24 0.21 -0.31 0.00 0.00 0.00 175.10 175.74 1j88 s TYR 80 N 1.02 3.35 -0.13 5.22 2.02 -1.26 -0.88 117.35 126.69 1j88 s TYR 80 Ca -0.09 0.35 -0.02 0.00 -0.37 0.00 0.00 57.07 56.93 1j88 s TYR 80 Cb -0.14 -2.31 -0.02 0.00 -0.40 0.00 0.00 41.96 39.08 1j88 s TYR 80 CO -0.00 0.10 -0.07 -1.17 -1.57 0.00 0.00 175.55 172.83 1j88 s LEU 81 N 0.96 3.06 -0.08 -1.29 2.96 0.24 -4.87 118.68 119.66 1j88 s LEU 81 Ca 0.11 -0.17 0.04 0.00 -0.22 0.00 0.00 54.13 53.88 1j88 s LEU 81 Cb -0.13 -1.71 -0.00 0.00 0.50 0.00 0.00 46.19 44.85 1j88 s LEU 81 CO 0.04 0.20 -0.22 -0.70 -1.32 0.00 0.00 176.35 174.35 1j88 s GLU 82 N 0.14 2.67 -0.14 1.98 2.12 -1.02 -0.64 118.70 123.81 1j88 s GLU 82 Ca -0.03 -0.80 -0.06 0.00 0.36 0.00 0.00 54.97 54.44 1j88 s GLU 82 Cb -0.14 -2.09 -0.04 0.00 0.26 0.00 0.00 34.13 32.12 1j88 s GLU 82 CO 0.04 0.20 0.09 0.08 -0.54 0.00 0.00 175.26 175.13 1j88 s VAL 83 N 0.27 5.08 0.25 3.70 1.01 -1.26 -0.79 120.40 128.66 1j88 s VAL 83 Ca -0.14 0.05 0.08 0.00 0.00 0.00 0.00 61.98 61.97 1j88 s VAL 83 Cb -0.16 -3.23 -0.05 0.00 0.00 0.00 0.00 36.38 32.94 1j88 s VAL 83 CO 0.07 0.56 -0.12 -0.36 0.00 0.00 0.00 175.10 175.24 1j88 s PHE 84 N -0.53 1.94 -0.19 5.22 0.40 0.28 -4.90 117.98 120.20 1j88 s PHE 84 Ca 0.11 -0.56 -0.03 0.00 -0.60 0.00 0.00 56.93 55.85 1j88 s PHE 84 Cb -0.12 -0.97 0.06 0.00 0.51 0.00 0.00 43.02 42.50 1j88 s PHE 84 CO 0.02 0.42 0.04 0.45 0.70 0.00 0.00 175.22 176.85 1j88 s SER 85 N -3.41 2.88 -0.09 1.36 0.15 -1.26 -0.04 113.70 113.28 1j88 s SER 85 Ca 0.27 -0.81 -0.33 0.00 0.70 0.00 0.00 55.95 55.78 1j88 s SER 85 Cb 0.00 -0.57 0.13 0.00 -1.71 0.00 0.00 66.02 63.87 1j88 s SER 85 CO 0.11 -0.31 1.28 -0.62 1.20 0.00 0.00 173.24 174.90 1j88 s ASP 86 N 1.87 -0.08 0.03 5.45 -1.08 -1.26 -5.05 116.67 116.55 1j88 s ASP 86 Ca -0.01 -0.08 -0.25 0.00 -0.52 0.00 0.00 52.55 51.70 1j88 s ASP 86 Cb -0.17 0.14 -0.18 0.00 -1.46 0.00 0.00 42.92 41.25 1j88 s ASP 86 CO -0.08 -0.24 1.47 -0.50 0.52 0.00 0.00 175.17 176.34 1j88 h TRP 87 N 2.00 -0.03 -4.19 -5.34 6.55 -1.95 -3.40 115.95 109.59 1j88 h TRP 87 Ca -0.22 -0.00 -0.60 0.00 0.95 0.00 0.00 58.89 59.02 1j88 h TRP 87 Cb 1.19 0.01 -0.26 0.00 -0.86 0.00 0.00 29.16 29.24 1j88 h TRP 87 CO 0.31 0.24 -0.85 -0.51 -1.05 0.00 0.00 178.44 176.58 1j88 s LEU 88 N -9.66 2.17 -0.06 -4.49 1.43 -1.26 -0.79 118.68 106.02 1j88 s LEU 88 Ca -0.15 -0.54 0.00 0.00 -1.03 0.00 0.00 54.13 52.42 1j88 s LEU 88 Cb 0.04 -1.03 0.02 0.00 0.03 0.00 0.00 46.19 45.25 1j88 s LEU 88 CO 0.66 0.18 -0.05 -0.22 0.23 0.00 0.00 176.35 177.15 1j88 s LEU 89 N -1.20 1.17 -0.29 1.79 2.96 0.79 -4.37 118.68 119.53 1j88 s LEU 89 Ca 0.08 -0.16 -0.23 0.00 -0.22 0.00 0.00 54.13 53.60 1j88 s LEU 89 Cb -0.09 -0.55 -0.00 0.00 0.50 0.00 0.00 46.19 46.05 1j88 s LEU 89 CO 0.02 -0.09 0.77 -0.22 -1.32 0.00 0.00 176.35 175.51 1j88 s LEU 90 N 1.26 4.08 -0.05 -0.68 2.96 -1.26 -0.91 118.68 124.09 1j88 s LEU 90 Ca -0.05 0.74 -0.02 0.00 -0.22 0.00 0.00 54.13 54.58 1j88 s LEU 90 Cb -0.14 -3.07 -0.04 0.00 0.50 0.00 0.00 46.19 43.45 1j88 s LEU 90 CO -0.02 -0.56 0.09 -1.10 -1.32 0.00 0.00 176.35 173.44 1j88 s GLN 91 N 2.87 3.17 0.01 1.98 -0.21 0.11 -4.93 119.66 122.66 1j88 s GLN 91 Ca 0.32 -0.37 0.05 0.00 0.02 0.00 0.00 55.36 55.38 1j88 s GLN 91 Cb -0.15 -2.94 -0.02 0.00 1.00 0.00 0.00 33.01 30.91 1j88 s GLN 91 CO 0.11 0.69 -0.17 0.00 -2.12 0.00 0.00 175.29 173.80 1j88 s ALA 92 N -1.11 1.41 0.08 6.09 0.00 -1.26 -0.63 121.76 126.33 1j88 s ALA 92 Ca 0.20 -0.80 -0.35 0.00 0.00 0.00 0.00 51.96 51.01 1j88 s ALA 92 Cb -0.12 -0.32 -0.18 0.00 0.00 0.00 0.00 23.12 22.51 1j88 s ALA 92 CO 0.10 0.33 1.59 0.66 0.00 0.00 0.00 175.76 178.44 1j88 h SER 93 N 5.42 -1.07 -4.35 0.00 4.64 -1.32 -3.39 113.55 113.48 1j88 h SER 93 Ca -0.38 0.06 -0.29 0.00 -0.47 0.00 0.00 61.79 60.71 1j88 h SER 93 Cb 1.16 0.32 -0.25 0.00 -0.31 0.00 0.00 62.40 63.32 1j88 h SER 93 CO 0.47 -0.65 -0.74 0.00 -0.87 0.00 0.00 176.83 175.04 1j88 s ALA 94 N -5.98 0.48 -0.26 5.18 0.00 -1.26 -4.74 121.76 115.17 1j88 s ALA 94 Ca -0.18 -0.49 0.22 0.00 0.00 0.00 0.00 51.96 51.50 1j88 s ALA 94 Cb 0.04 -0.02 0.06 0.00 0.00 0.00 0.00 23.12 23.19 1j88 s ALA 94 CO 0.61 0.03 1.15 0.93 0.00 0.00 0.00 175.76 178.49 1j88 h GLU 95 N 5.24 0.00 -4.65 0.00 5.08 -1.92 -3.45 114.58 114.89 1j88 h GLU 95 Ca -0.32 0.00 -0.54 0.00 -1.00 0.00 0.00 59.36 57.50 1j88 h GLU 95 Cb 1.20 0.00 -0.34 0.00 0.50 0.00 0.00 28.75 30.11 1j88 h GLU 95 CO 0.45 0.05 -0.82 0.08 -1.00 0.00 0.00 179.01 177.77 1j88 s VAL 96 N -3.27 1.28 -0.02 3.13 1.01 -1.26 -1.98 120.40 119.29 1j88 s VAL 96 Ca 0.01 -0.55 0.02 0.00 0.00 0.00 0.00 61.98 61.46 1j88 s VAL 96 Cb 0.08 -1.16 0.00 0.00 0.00 0.00 0.00 36.38 35.31 1j88 s VAL 96 CO 0.77 0.39 -0.07 -0.69 0.00 0.00 0.00 175.10 175.49 1j88 s VAL 97 N 0.69 0.63 -0.04 2.92 1.01 0.10 -4.99 120.40 120.73 1j88 s VAL 97 Ca -0.14 -0.29 -0.30 0.00 0.00 0.00 0.00 61.98 61.26 1j88 s VAL 97 Cb -0.16 -0.57 -0.03 0.00 0.00 0.00 0.00 36.38 35.63 1j88 s VAL 97 CO 0.03 0.20 1.03 -0.04 0.00 0.00 0.00 175.10 176.33 1j88 s MET 98 N 0.17 4.47 -0.25 2.72 -1.94 -1.26 -1.03 119.30 122.18 1j88 s MET 98 Ca -0.02 1.47 -0.41 0.00 -1.71 0.00 0.00 55.69 55.02 1j88 s MET 98 Cb -0.07 -3.49 -0.19 0.00 2.01 0.00 0.00 34.83 33.09 1j88 s MET 98 CO 0.00 -0.22 1.26 -1.91 -0.01 0.00 0.00 175.02 174.15 1j88 n GLU 99 N 4.48 0.00 0.00 2.03 2.13 0.17 -1.08 120.64 128.37 1j88 n GLU 99 Ca 0.08 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.90 1j88 n GLU 99 Cb 0.49 -1.39 0.00 0.00 0.27 0.00 0.00 31.44 30.81 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 2.66 2.59 3.94 8.31 0.00 0.09 -4.93 105.19 117.85 1j88 n GLY 100 Ca 0.24 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 46.01 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 -0.60 2.05 0.46 1.61 -1.52 -0.24 -3.95 119.66 117.46 1j88 s GLN 101 Ca 0.00 -0.41 -0.14 0.00 -1.95 0.00 0.00 55.36 52.86 1j88 s GLN 101 Cb 0.00 -2.19 -0.07 0.00 -0.22 0.00 0.00 33.01 30.52 1j88 s GLN 101 CO 0.00 -1.30 0.89 -1.25 -0.25 0.00 0.00 175.29 173.38 1j88 s PRO 102 N -5.24 3.90 -0.03 2.91 0.04 -1.02 -1.48 135.00 134.08 1j88 s PRO 102 Ca 0.62 0.76 -0.01 0.00 0.04 0.00 0.00 61.00 62.41 1j88 s PRO 102 Cb -0.10 -2.25 0.03 0.00 0.04 0.00 0.00 34.50 32.23 1j88 s PRO 102 CO 0.45 -0.15 0.05 -1.17 0.04 0.00 0.00 177.00 176.21 1j88 s LEU 103 N -3.90 0.67 -0.13 -3.56 2.96 0.29 -4.92 118.68 110.09 1j88 s LEU 103 Ca 0.56 0.07 0.02 0.00 -0.22 0.00 0.00 54.13 54.56 1j88 s LEU 103 Cb -0.10 -0.08 0.01 0.00 0.50 0.00 0.00 46.19 46.52 1j88 s LEU 103 CO 0.30 -0.18 -0.20 -0.36 -1.32 0.00 0.00 176.35 174.59 1j88 s PHE 104 N 1.53 2.46 0.02 5.38 0.40 -1.26 -1.01 117.98 125.50 1j88 s PHE 104 Ca -0.03 -1.23 0.05 0.00 -0.60 0.00 0.00 56.93 55.12 1j88 s PHE 104 Cb -0.13 -1.70 -0.03 0.00 0.51 0.00 0.00 43.02 41.67 1j88 s PHE 104 CO -0.03 -0.58 -0.12 -0.51 0.70 0.00 0.00 175.22 174.68 1j88 s LEU 105 N 0.88 2.89 -0.03 -0.37 1.43 -0.19 -0.84 118.68 122.44 1j88 s LEU 105 Ca -0.07 -0.27 -0.00 0.00 -1.03 0.00 0.00 54.13 52.76 1j88 s LEU 105 Cb -0.15 -1.67 0.03 0.00 0.03 0.00 0.00 46.19 44.42 1j88 s LEU 105 CO -0.02 0.27 0.02 -0.60 0.23 0.00 0.00 176.35 176.25 1j88 s ARG 106 N -1.38 0.15 -0.49 1.70 3.52 0.19 -1.95 118.95 120.69 1j88 s ARG 106 Ca 0.16 0.15 -0.22 0.00 -0.13 0.00 0.00 55.73 55.69 1j88 s ARG 106 Cb -0.11 -0.41 0.04 0.00 -1.56 0.00 0.00 34.95 32.91 1j88 s ARG 106 CO 0.06 -0.17 0.74 0.00 -0.81 0.00 0.00 175.30 175.12 1j88 s HIS 108 N 3.15 3.29 0.19 0.00 2.46 -0.09 -4.95 115.29 119.35 1j88 s HIS 108 Ca 0.24 0.14 -0.08 0.00 0.47 0.00 0.00 55.06 55.82 1j88 s HIS 108 Cb -0.15 -2.14 -0.07 0.00 -0.13 0.00 0.00 32.58 30.10 1j88 s HIS 108 CO 0.18 0.15 0.49 0.20 -2.47 0.00 0.00 174.74 173.28 1j88 s GLY 109 N 0.54 2.27 0.77 1.59 0.00 -1.26 -0.15 107.32 111.08 1j88 s GLY 109 Ca 0.05 -0.37 -0.15 0.00 0.00 0.00 0.00 44.72 44.26 1j88 s GLY 109 CO 0.00 -0.24 0.98 1.87 0.00 0.00 0.00 173.10 175.72 1j88 n TRP 110 N -0.01 0.63 -0.91 1.90 -0.00 0.03 -1.93 117.44 117.16 1j88 n TRP 110 Ca -0.01 0.38 -0.04 0.00 -0.00 0.00 0.00 57.50 57.84 1j88 n TRP 110 Cb 0.52 -2.06 -0.02 0.00 -0.00 0.00 0.00 31.31 29.76 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 -2.29 -1.34 -1.67 5.87 1.74 -1.26 0.17 116.66 117.87 1j88 n ARG 111 Ca 0.13 0.26 -0.13 0.00 -0.77 0.00 0.00 57.85 57.33 1j88 n ARG 111 Cb 0.50 -4.06 -0.04 0.00 -1.02 0.00 0.00 32.46 27.84 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 0.84 -4.47 -2.93 0.55 2.85 -0.81 -4.99 115.26 106.29 1j88 n ASN 112 Ca -0.04 0.22 -0.04 0.00 -0.11 0.00 0.00 54.58 54.61 1j88 n ASN 112 Cb 0.16 -3.32 0.04 0.00 1.24 0.00 0.00 39.78 37.89 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 -3.07 -2.45 -4.30 1.20 8.01 0.13 -4.97 117.44 111.99 1j88 n TRP 113 Ca -0.14 -0.11 -0.34 0.00 -1.31 0.00 0.00 57.50 55.60 1j88 n TRP 113 Cb 0.50 -0.16 -0.09 0.00 -2.01 0.00 0.00 31.31 29.56 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 -2.07 5.24 0.05 -0.99 1.01 -1.26 -4.68 116.67 113.96 1j88 s ASP 114 Ca 0.09 0.07 0.09 0.00 0.71 0.00 0.00 52.55 53.51 1j88 s ASP 114 Cb -0.01 -1.43 -0.03 0.00 1.01 0.00 0.00 42.92 42.46 1j88 s ASP 114 CO 0.07 0.32 -0.25 -0.69 0.21 0.00 0.00 175.17 174.83 1j88 s VAL 115 N -1.02 2.04 0.28 -1.27 1.01 -1.26 -4.52 120.40 115.67 1j88 s VAL 115 Ca 0.17 -1.37 0.05 0.00 0.00 0.00 0.00 61.98 60.83 1j88 s VAL 115 Cb -0.11 -1.76 -0.06 0.00 0.00 0.00 0.00 36.38 34.45 1j88 s VAL 115 CO 0.07 0.32 -0.01 -0.31 0.00 0.00 0.00 175.10 175.17 1j88 s TYR 116 N -0.82 1.83 -1.24 5.22 1.51 -0.76 -2.74 117.35 120.36 1j88 s TYR 116 Ca 0.11 -0.84 -0.15 0.00 -1.01 0.00 0.00 57.07 55.18 1j88 s TYR 116 Cb -0.10 -1.10 -0.00 0.00 -0.11 0.00 0.00 41.96 40.65 1j88 s TYR 116 CO 0.02 0.10 0.66 1.63 -1.11 0.00 0.00 175.55 176.85 1j88 n LYS 117 N -0.56 -1.88 -3.15 -0.62 5.02 0.32 -1.30 118.16 115.99 1j88 n LYS 117 Ca -0.04 0.41 -0.39 0.00 -2.02 0.00 0.00 58.31 56.26 1j88 n LYS 117 Cb 0.64 -4.12 -0.06 0.00 -0.02 0.00 0.00 35.03 31.47 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 -3.64 4.75 -0.05 -0.18 1.01 -0.14 -4.27 120.40 117.88 1j88 s VAL 118 Ca 0.31 1.37 -0.01 0.00 0.00 0.00 0.00 61.98 63.66 1j88 s VAL 118 Cb -0.12 -3.98 0.03 0.00 0.00 0.00 0.00 36.38 32.30 1j88 s VAL 118 CO 0.88 0.46 0.01 -0.63 0.00 0.00 0.00 175.10 175.82 1j88 s ILE 119 N -0.58 0.25 0.00 2.22 1.01 -0.27 -1.33 121.20 122.51 1j88 s ILE 119 Ca 0.32 0.14 -0.15 0.00 0.00 0.00 0.00 60.65 60.96 1j88 s ILE 119 Cb -0.20 -0.39 -0.06 0.00 0.01 0.00 0.00 42.46 41.82 1j88 s ILE 119 CO 0.20 0.21 0.43 -0.31 0.00 0.00 0.00 174.94 175.47 1j88 s TYR 120 N 1.59 3.73 -0.04 3.97 1.51 -0.94 -1.03 117.35 126.15 1j88 s TYR 120 Ca -0.01 1.02 0.07 0.00 -1.01 0.00 0.00 57.07 57.14 1j88 s TYR 120 Cb -0.13 -2.33 -0.02 0.00 -0.11 0.00 0.00 41.96 39.38 1j88 s TYR 120 CO -0.03 0.61 -0.24 0.71 -1.11 0.00 0.00 175.55 175.49 1j88 s TYR 121 N -1.00 2.41 -0.16 2.71 1.51 0.26 -1.04 117.35 122.03 1j88 s TYR 121 Ca 0.24 -0.49 0.00 0.00 -1.01 0.00 0.00 57.07 55.81 1j88 s TYR 121 Cb -0.17 -1.55 0.03 0.00 -0.11 0.00 0.00 41.96 40.17 1j88 s TYR 121 CO 0.14 -0.07 -0.09 0.21 -1.11 0.00 0.00 175.55 174.63 1j88 s LYS 122 N -0.48 1.80 -1.36 -0.62 2.20 -0.59 -1.60 119.74 119.09 1j88 s LYS 122 Ca 0.06 -0.57 -0.08 0.00 -0.36 0.00 0.00 55.97 55.02 1j88 s LYS 122 Cb -0.11 -2.07 0.02 0.00 -1.51 0.00 0.00 37.83 34.16 1j88 s LYS 122 CO 0.01 -0.36 1.10 -0.25 -0.36 0.00 0.00 175.35 175.48 1j88 n ASP 123 N 4.81 -5.16 0.00 1.43 8.00 -0.21 -1.89 116.55 123.54 1j88 n ASP 123 Ca -0.14 -0.61 0.00 0.00 0.71 0.00 0.00 54.79 54.75 1j88 n ASP 123 Cb 0.48 -4.81 0.00 0.00 -0.02 0.00 0.00 41.12 36.77 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 -1.80 2.16 3.86 0.44 0.00 -1.26 -5.00 105.19 103.60 1j88 n GLY 124 Ca -0.05 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.61 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 3.76 0.65 1.61 0.41 -0.79 -5.07 118.70 119.23 1j88 s GLU 125 Ca 0.00 0.19 -0.17 0.00 -0.41 0.00 0.00 54.97 54.58 1j88 s GLU 125 Cb 0.00 -3.09 -0.00 0.00 -1.78 0.00 0.00 34.13 29.25 1j88 s GLU 125 CO 0.00 0.63 1.18 0.00 -0.49 0.00 0.00 175.26 176.58 1j88 s ALA 126 N -1.25 2.40 0.03 5.21 0.00 -1.26 -1.54 121.76 125.34 1j88 s ALA 126 Ca 0.28 0.84 0.00 0.00 0.00 0.00 0.00 51.96 53.08 1j88 s ALA 126 Cb -0.15 -3.42 0.00 0.00 0.00 0.00 0.00 23.12 19.56 1j88 s ALA 126 CO 0.15 -1.40 0.00 -0.11 0.00 0.00 0.00 175.76 174.40 1j88 n LEU 127 N -2.14 0.03 -3.97 0.00 7.94 -0.21 -4.76 117.00 113.89 1j88 n LEU 127 Ca 0.13 0.05 -0.09 0.00 -1.11 0.00 0.00 56.01 54.99 1j88 n LEU 127 Cb 0.50 0.02 -0.10 0.00 0.53 0.00 0.00 43.42 44.38 1j88 n LEU 127 CO 0.46 -0.39 -0.27 -0.54 -1.11 0.00 0.00 177.39 175.54 1j88 s LYS 128 N -2.00 0.56 -0.06 1.96 -0.14 -1.22 -4.98 119.74 113.85 1j88 s LYS 128 Ca 0.00 -0.85 -0.05 0.00 -1.36 0.00 0.00 55.97 53.71 1j88 s LYS 128 Cb 0.00 0.21 0.02 0.00 -1.68 0.00 0.00 37.83 36.38 1j88 s LYS 128 CO 0.00 -0.13 0.17 -0.47 -0.76 0.00 0.00 175.35 174.16 1j88 s TYR 129 N -2.78 -0.19 0.03 3.18 5.04 -1.26 -2.21 117.35 119.17 1j88 s TYR 129 Ca -0.04 0.46 -0.04 0.00 -2.44 0.00 0.00 57.07 55.01 1j88 s TYR 129 Cb -0.00 0.05 -0.01 0.00 0.35 0.00 0.00 41.96 42.34 1j88 s TYR 129 CO -0.06 -0.10 0.07 -1.58 -1.34 0.00 0.00 175.55 172.54 1j88 s TRP 130 N 0.24 0.20 0.00 4.97 0.52 -0.44 -5.00 118.94 119.44 1j88 s TRP 130 Ca -0.01 -0.47 0.00 0.00 0.02 0.00 0.00 56.10 55.63 1j88 s TRP 130 Cb -0.03 -0.15 0.00 0.00 -1.15 0.00 0.00 33.47 32.14 1j88 s TRP 130 CO -0.01 -0.32 0.11 0.98 0.02 0.00 0.00 176.95 177.74 1j88 n TYR 131 N 1.03 0.00 -2.38 -1.98 9.36 -1.26 -0.97 117.16 120.96 1j88 n TYR 131 Ca -0.20 0.00 -0.43 0.00 3.32 0.00 0.00 57.90 60.59 1j88 n TYR 131 Cb 0.57 0.00 -0.02 0.00 -0.63 0.00 0.00 39.34 39.26 1j88 n TYR 131 CO 0.00 0.00 0.00 -1.21 0.22 0.00 0.00 176.86 175.87 1j88 s GLU 132 N -0.23 4.15 0.88 2.98 2.02 -1.26 -0.52 118.70 126.72 1j88 s GLU 132 Ca 0.00 1.63 -0.14 0.00 0.02 0.00 0.00 54.97 56.47 1j88 s GLU 132 Cb 0.00 -3.82 -0.01 0.00 0.10 0.00 0.00 34.13 30.40 1j88 s GLU 132 CO 0.00 -0.82 0.28 0.27 0.02 0.00 0.00 175.26 175.01 1j88 n ASN 133 N 6.92 -2.33 -3.78 -0.19 6.94 -1.11 -4.98 115.26 116.74 1j88 n ASN 133 Ca 0.15 0.40 -0.13 0.00 -0.02 0.00 0.00 54.58 54.97 1j88 n ASN 133 Cb 0.45 -1.15 -0.09 0.00 -2.36 0.00 0.00 39.78 36.63 1j88 n ASN 133 CO 0.00 0.00 0.00 -2.28 -1.03 0.00 0.00 177.26 173.95 1j88 s HIS 134 N -2.19 -0.20 -0.23 -2.53 2.46 -1.26 -5.07 115.29 106.27 1j88 s HIS 134 Ca 0.57 0.39 -0.23 0.00 0.47 0.00 0.00 55.06 56.26 1j88 s HIS 134 Cb -0.26 0.08 -0.01 0.00 -0.13 0.00 0.00 32.58 32.27 1j88 s HIS 134 CO 0.66 -0.31 0.76 0.54 -2.47 0.00 0.00 174.74 173.92 1j88 s ASN 135 N -0.87 6.77 0.21 9.88 2.20 -1.26 -4.72 114.94 127.14 1j88 s ASN 135 Ca -0.10 0.95 -0.30 0.00 -0.94 0.00 0.00 52.86 52.48 1j88 s ASN 135 Cb -0.05 -2.40 -0.09 0.00 -2.00 0.00 0.00 41.25 36.71 1j88 s ASN 135 CO 0.03 -0.43 1.34 -0.51 -2.94 0.00 0.00 177.10 174.59 1j88 s ILE 136 N 2.53 3.09 0.13 0.54 2.07 -0.82 -4.88 121.20 123.86 1j88 s ILE 136 Ca 0.32 0.90 0.07 0.00 -1.41 0.00 0.00 60.65 60.53 1j88 s ILE 136 Cb -0.16 -3.57 -0.04 0.00 0.13 0.00 0.00 42.46 38.82 1j88 s ILE 136 CO 0.09 0.13 -0.15 -0.55 -1.91 0.00 0.00 174.94 172.55 1j88 s SER 137 N 0.38 2.19 -0.04 4.50 0.15 -1.26 -1.03 113.70 118.59 1j88 s SER 137 Ca 0.58 -0.82 -0.01 0.00 0.70 0.00 0.00 55.95 56.39 1j88 s SER 137 Cb -0.38 -0.09 0.03 0.00 -1.71 0.00 0.00 66.02 63.87 1j88 s SER 137 CO 0.39 -0.11 0.06 -0.63 1.20 0.00 0.00 173.24 174.15 1j88 s ILE 138 N -2.11 -0.10 0.00 6.45 1.01 -0.18 -5.01 121.20 121.27 1j88 s ILE 138 Ca 0.11 0.32 0.00 0.00 0.00 0.00 0.00 60.65 61.08 1j88 s ILE 138 Cb -0.05 -0.14 0.00 0.00 0.01 0.00 0.00 42.46 42.28 1j88 s ILE 138 CO 0.04 0.13 0.00 0.35 0.00 0.00 0.00 174.94 175.46 1j88 n THR 139 N 4.77 0.00 -3.43 2.92 -2.24 -1.26 -0.55 114.28 114.48 1j88 n THR 139 Ca -0.15 0.49 -0.41 0.00 -2.27 0.00 0.00 64.05 61.72 1j88 n THR 139 Cb 0.50 -1.48 -0.10 0.00 -2.10 0.00 0.00 70.33 67.16 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 -2.98 6.15 -0.11 3.42 3.84 -1.26 -2.44 114.94 121.55 1j88 s ASN 140 Ca 0.00 -0.30 -0.22 0.00 0.21 0.00 0.00 52.86 52.55 1j88 s ASN 140 Cb 0.00 -2.18 -0.03 0.00 -0.55 0.00 0.00 41.25 38.49 1j88 s ASN 140 CO 0.00 -0.32 0.65 0.00 -2.79 0.00 0.00 177.10 174.64 1j88 s ALA 141 N 1.94 3.42 0.77 1.71 0.00 -0.55 -4.87 121.76 124.19 1j88 s ALA 141 Ca 0.10 -0.03 -0.08 0.00 0.00 0.00 0.00 51.96 51.95 1j88 s ALA 141 Cb -0.17 -2.92 0.10 0.00 0.00 0.00 0.00 23.12 20.13 1j88 s ALA 141 CO 0.11 -0.23 1.10 0.99 0.00 0.00 0.00 175.76 177.73 1j88 s THR 142 N 1.13 2.16 -1.28 0.00 2.01 -1.26 -0.73 115.64 117.68 1j88 s THR 142 Ca 0.33 -0.23 0.26 0.00 0.31 0.00 0.00 61.69 62.36 1j88 s THR 142 Cb -0.17 -2.93 0.10 0.00 0.01 0.00 0.00 72.50 69.51 1j88 s THR 142 CO 0.14 0.00 1.47 0.55 -0.69 0.00 0.00 174.62 176.10 1j88 n VAL 143 N -3.14 0.00 0.33 3.82 3.14 -1.26 -3.50 118.33 117.72 1j88 n VAL 143 Ca 0.11 -0.05 0.13 0.00 -2.96 0.00 0.00 64.34 61.56 1j88 n VAL 143 Cb 0.60 0.30 0.26 0.00 -1.06 0.00 0.00 33.84 33.94 1j88 n VAL 143 CO 0.00 0.00 0.00 -0.33 -6.46 0.00 0.00 176.83 170.04 1j88 h GLU 144 N 0.44 0.00 0.00 1.45 3.07 -1.93 -3.09 114.58 114.52 1j88 h GLU 144 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1j88 h GLU 144 Cb 0.50 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.41 1j88 h GLU 144 CO 0.00 0.00 0.00 -0.25 -1.40 0.00 0.00 179.01 177.36 1j88 n ASP 145 N -2.87 0.00 -4.76 1.42 8.00 -1.23 -4.74 116.55 112.36 1j88 n ASP 145 Ca 0.04 0.44 -0.38 0.00 0.71 0.00 0.00 54.79 55.60 1j88 n ASP 145 Cb 0.49 -0.47 0.00 0.00 -0.02 0.00 0.00 41.12 41.12 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 -2.94 6.03 0.00 -2.24 0.01 -1.17 -4.93 113.70 108.46 1j88 s SER 146 Ca 0.10 2.54 0.00 0.00 1.31 0.00 0.00 55.95 59.89 1j88 s SER 146 Cb 0.12 -2.62 0.00 0.00 0.21 0.00 0.00 66.02 63.72 1j88 s SER 146 CO 0.32 -1.03 0.00 0.61 0.41 0.00 0.00 173.24 173.55 1j88 n GLY 147 N 0.60 -2.54 3.37 3.44 0.00 -0.47 -5.01 105.19 104.58 1j88 n GLY 147 Ca 0.07 -1.26 -0.36 0.00 0.00 0.00 0.00 46.02 44.46 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 -2.01 3.91 0.32 2.61 -4.23 -1.26 -0.80 115.64 114.18 1j88 s THR 148 Ca 0.00 -0.45 0.07 0.00 -1.18 0.00 0.00 61.69 60.12 1j88 s THR 148 Cb 0.00 -2.89 -0.02 0.00 1.34 0.00 0.00 72.50 70.93 1j88 s THR 148 CO 0.00 0.27 0.37 -0.31 -0.54 0.00 0.00 174.62 174.41 1j88 s TYR 149 N 1.53 3.06 -0.19 3.99 1.51 0.15 -1.04 117.35 126.36 1j88 s TYR 149 Ca 0.05 -0.23 -0.31 0.00 -1.01 0.00 0.00 57.07 55.57 1j88 s TYR 149 Cb -0.16 -1.84 0.15 0.00 -0.11 0.00 0.00 41.96 40.00 1j88 s TYR 149 CO 0.01 0.14 1.15 1.52 -1.11 0.00 0.00 175.55 177.27 1j88 s TYR 150 N -2.21 -0.20 0.18 2.71 -0.85 -0.63 0.63 117.35 116.98 1j88 s TYR 150 Ca 0.42 0.27 0.07 0.00 -0.52 0.00 0.00 57.07 57.31 1j88 s TYR 150 Cb -0.08 0.49 -0.04 0.00 0.38 0.00 0.00 41.96 42.71 1j88 s TYR 150 CO 0.29 -0.23 -0.15 0.00 -1.52 0.00 0.00 175.55 173.94 1j88 s THR 152 N -2.68 1.71 0.08 0.00 -4.23 -0.20 -1.62 115.64 108.70 1j88 s THR 152 Ca 0.18 -1.55 -0.26 0.00 -1.18 0.00 0.00 61.69 58.88 1j88 s THR 152 Cb -0.02 -1.56 0.08 0.00 1.34 0.00 0.00 72.50 72.34 1j88 s THR 152 CO 0.05 -0.07 0.89 -0.83 -0.54 0.00 0.00 174.62 174.13 1j88 s GLY 153 N -1.92 -0.36 -0.16 3.99 0.00 -0.70 -1.11 107.32 107.06 1j88 s GLY 153 Ca 0.06 0.55 -0.03 0.00 0.00 0.00 0.00 44.72 45.30 1j88 s GLY 153 CO 0.04 0.17 -0.04 1.25 0.00 0.00 0.00 173.10 174.51 1j88 s LYS 154 N -3.26 3.62 -0.11 2.90 2.20 -0.42 -0.41 119.74 124.27 1j88 s LYS 154 Ca 0.08 -0.54 0.02 0.00 -0.36 0.00 0.00 55.97 55.16 1j88 s LYS 154 Cb -0.01 -2.90 -0.01 0.00 -1.51 0.00 0.00 37.83 33.39 1j88 s LYS 154 CO -0.04 0.20 -0.16 0.08 -0.36 0.00 0.00 175.35 175.07 1j88 s VAL 155 N 0.46 2.80 0.00 4.02 1.01 0.72 -1.83 120.40 127.57 1j88 s VAL 155 Ca -0.04 -0.77 0.00 0.00 0.00 0.00 0.00 61.98 61.17 1j88 s VAL 155 Cb -0.14 -2.14 0.00 0.00 0.00 0.00 0.00 36.38 34.10 1j88 s VAL 155 CO 0.03 0.54 0.00 0.79 0.00 0.00 0.00 175.10 176.46 1j88 n TRP 156 N 3.32 0.00 -1.38 5.22 5.03 -1.26 -0.92 117.44 127.44 1j88 n TRP 156 Ca -0.18 0.00 0.00 0.00 3.03 0.00 0.00 57.50 60.35 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 -4.42 -0.99 1.13 -1.26 -5.08 117.38 106.75 1j88 n GLN 157 Ca 0.00 -0.51 -0.26 0.00 -1.94 0.00 0.00 57.00 54.29 1j88 n GLN 157 Cb 0.00 -0.41 -0.11 0.00 0.11 0.00 0.00 30.24 29.83 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 2.47 0.07 1.08 1.43 -0.10 -5.11 118.68 118.52 1j88 s LEU 158 Ca 0.00 -0.90 -0.15 0.00 -1.03 0.00 0.00 54.13 52.04 1j88 s LEU 158 Cb 0.00 -1.11 -0.06 0.00 0.03 0.00 0.00 46.19 45.05 1j88 s LEU 158 CO 0.00 0.08 0.49 -1.81 0.23 0.00 0.00 176.35 175.35 1j88 s ASP 159 N -2.86 6.87 0.02 2.29 1.01 -1.26 -0.20 116.67 122.53 1j88 s ASP 159 Ca 0.22 1.06 0.00 0.00 0.71 0.00 0.00 52.55 54.55 1j88 s ASP 159 Cb -0.07 -2.28 -0.02 0.00 1.01 0.00 0.00 42.92 41.56 1j88 s ASP 159 CO 0.11 0.23 -0.03 -0.31 0.21 0.00 0.00 175.17 175.38 1j88 s TYR 160 N -1.23 0.24 0.00 4.23 1.51 0.46 -4.95 117.35 117.60 1j88 s TYR 160 Ca 0.30 -0.46 0.06 0.00 -1.01 0.00 0.00 57.07 55.97 1j88 s TYR 160 Cb -0.17 -0.17 -0.03 0.00 -0.11 0.00 0.00 41.96 41.48 1j88 s TYR 160 CO 0.17 -0.16 -0.19 -2.00 -1.11 0.00 0.00 175.55 172.26 1j88 s GLU 161 N -1.27 2.19 0.48 -0.62 2.12 -1.26 -1.71 118.70 118.63 1j88 s GLU 161 Ca -0.14 -0.89 0.01 0.00 0.36 0.00 0.00 54.97 54.30 1j88 s GLU 161 Cb -0.09 -2.20 0.01 0.00 0.26 0.00 0.00 34.13 32.11 1j88 s GLU 161 CO -0.01 0.57 0.71 -1.54 -0.54 0.00 0.00 175.26 174.45 1j88 s SER 162 N -1.04 5.65 0.34 -1.70 1.04 -0.64 -4.74 113.70 112.61 1j88 s SER 162 Ca 0.12 0.20 -0.28 0.00 0.48 0.00 0.00 55.95 56.47 1j88 s SER 162 Cb -0.10 -1.32 -0.09 0.00 0.10 0.00 0.00 66.02 64.60 1j88 s SER 162 CO 0.02 -0.85 1.22 -1.61 0.98 0.00 0.00 173.24 173.00 1j88 s GLU 163 N -4.63 4.31 0.65 4.02 0.41 -1.26 -4.70 118.70 117.50 1j88 s GLU 163 Ca 0.51 2.01 -0.15 0.00 -0.41 0.00 0.00 54.97 56.93 1j88 s GLU 163 Cb -0.10 -2.96 -0.00 0.00 -1.78 0.00 0.00 34.13 29.28 1j88 s GLU 163 CO 0.38 -0.15 1.09 -1.25 -0.49 0.00 0.00 175.26 174.85 1j88 s PRO 164 N -1.89 2.89 -0.04 0.39 0.04 -1.26 -4.62 135.00 130.51 1j88 s PRO 164 Ca 0.51 1.31 -0.02 0.00 0.04 0.00 0.00 61.00 62.84 1j88 s PRO 164 Cb -0.35 -1.97 0.03 0.00 0.04 0.00 0.00 34.50 32.25 1j88 s PRO 164 CO 0.46 -1.17 0.07 -1.17 0.04 0.00 0.00 177.00 175.23 1j88 s LEU 165 N -4.88 0.37 0.33 -3.56 2.96 0.20 -4.97 118.68 109.13 1j88 s LEU 165 Ca 0.65 0.11 -0.20 0.00 -0.22 0.00 0.00 54.13 54.48 1j88 s LEU 165 Cb -0.19 -0.05 -0.09 0.00 0.50 0.00 0.00 46.19 46.36 1j88 s LEU 165 CO 0.42 -0.21 0.83 0.20 -1.32 0.00 0.00 176.35 176.26 1j88 s ASN 166 N 1.87 6.99 -0.02 3.68 0.01 -1.26 -0.67 114.94 125.54 1j88 s ASN 166 Ca 0.01 1.53 -0.00 0.00 -0.71 0.00 0.00 52.86 53.68 1j88 s ASN 166 Cb -0.12 -2.47 0.03 0.00 0.41 0.00 0.00 41.25 39.10 1j88 s ASN 166 CO -0.03 -0.16 0.03 -0.63 -1.51 0.00 0.00 177.10 174.80 1j88 s ILE 167 N -1.85 -0.06 -0.03 0.60 1.01 0.02 -4.94 121.20 115.95 1j88 s ILE 167 Ca 0.53 0.21 0.07 0.00 0.00 0.00 0.00 60.65 61.45 1j88 s ILE 167 Cb -0.13 -0.08 -0.02 0.00 0.01 0.00 0.00 42.46 42.24 1j88 s ILE 167 CO 0.18 0.08 -0.24 -0.89 0.00 0.00 0.00 174.94 174.08 1j88 s THR 168 N 1.03 1.93 -0.29 2.92 2.01 -0.84 -1.37 115.64 121.03 1j88 s THR 168 Ca -0.09 -1.03 0.03 0.00 0.31 0.00 0.00 61.69 60.91 1j88 s THR 168 Cb -0.12 -1.62 0.07 0.00 0.01 0.00 0.00 72.50 70.84 1j88 s THR 168 CO -0.03 0.54 -0.04 -0.69 -0.69 0.00 0.00 174.62 173.71 1j88 s VAL 169 N -0.41 2.32 0.66 3.82 1.01 -1.25 0.01 120.40 126.56 1j88 s VAL 169 Ca 0.05 -1.84 -0.03 0.00 0.00 0.00 0.00 61.98 60.16 1j88 s VAL 169 Cb -0.11 -2.48 0.08 0.00 0.00 0.00 0.00 36.38 33.87 1j88 s VAL 169 CO 0.01 -0.23 0.93 0.27 0.00 0.00 0.00 175.10 176.08 1j88 s ILE 170 N 1.06 2.37 0.00 2.22 -4.36 -0.20 -4.78 121.20 117.51 1j88 s ILE 170 Ca -0.02 -0.49 0.00 0.00 -0.26 0.00 0.00 60.65 59.88 1j88 s ILE 170 Cb -0.20 -2.88 0.00 0.00 1.25 0.00 0.00 42.46 40.63 1j88 s ILE 170 CO -0.05 0.00 0.32 2.29 0.24 0.00 0.00 174.94 177.74