#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1jx1 s THR 6 N 0.00 3.54 0.86 9.51 -4.23 -1.26 -4.80 115.64 119.26 1jx1 s THR 6 Ca 0.00 -1.39 -0.13 0.00 -1.18 0.00 0.00 61.69 58.99 1jx1 s THR 6 Cb 0.00 -2.73 0.12 0.00 1.34 0.00 0.00 72.50 71.23 1jx1 s THR 6 CO 0.00 -0.03 1.22 0.00 -0.54 0.00 0.00 174.62 175.27 1jx1 s ALA 7 N -1.54 2.50 0.12 3.99 0.00 -1.26 -4.52 121.76 121.04 1jx1 s ALA 7 Ca 0.25 -0.81 0.03 0.00 0.00 0.00 0.00 51.96 51.43 1jx1 s ALA 7 Cb -0.10 -2.91 -0.04 0.00 0.00 0.00 0.00 23.12 20.07 1jx1 s ALA 7 CO 0.16 -1.93 -0.08 0.42 0.00 0.00 0.00 175.76 174.33 1jx1 s ILE 8 N -3.66 0.91 -0.07 0.00 1.01 -1.03 -4.91 121.20 113.44 1jx1 s ILE 8 Ca 0.66 -1.94 -0.02 0.00 0.00 0.00 0.00 60.65 59.35 1jx1 s ILE 8 Cb -0.09 -1.69 0.03 0.00 0.01 0.00 0.00 42.46 40.72 1jx1 s ILE 8 CO 0.50 -0.78 0.02 -0.89 0.00 0.00 0.00 174.94 173.79 1jx1 s THR 9 N -3.33 0.28 -0.52 2.92 2.01 -1.26 -0.57 115.64 115.17 1jx1 s THR 9 Ca 0.13 0.16 -0.14 0.00 0.31 0.00 0.00 61.69 62.14 1jx1 s THR 9 Cb 0.03 -0.47 0.12 0.00 0.01 0.00 0.00 72.50 72.19 1jx1 s THR 9 CO -0.02 0.22 0.45 -0.69 -0.69 0.00 0.00 174.62 173.89 1jx1 s VAL 10 N 2.01 4.94 -1.18 3.82 1.01 0.21 -4.70 120.40 126.51 1jx1 s VAL 10 Ca 0.05 -1.54 -0.35 0.00 0.00 0.00 0.00 61.98 60.14 1jx1 s VAL 10 Cb -0.12 -4.17 0.05 0.00 0.00 0.00 0.00 36.38 32.14 1jx1 s VAL 10 CO -0.05 -0.82 0.66 -0.62 0.00 0.00 0.00 175.10 174.27 1jx1 n GLU 11 N 5.15 -0.21 -1.40 2.72 -0.58 -1.26 -1.54 120.64 123.52 1jx1 n GLU 11 Ca -0.12 0.04 -0.04 0.00 -0.42 0.00 0.00 57.16 56.61 1jx1 n GLU 11 Cb 0.40 -2.32 -0.01 0.00 -0.57 0.00 0.00 31.44 28.94 1jx1 n GLU 11 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 1jx1 n ASN 12 N -2.03 -3.01 -3.93 1.62 3.02 -1.26 -5.02 115.26 104.66 1jx1 n ASN 12 Ca -0.11 0.07 -0.30 0.00 -0.03 0.00 0.00 54.58 54.21 1jx1 n ASN 12 Cb 0.54 -1.32 -0.15 0.00 -0.61 0.00 0.00 39.78 38.24 1jx1 n ASN 12 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1jx1 s LEU 13 N -0.96 2.76 -0.09 3.41 1.43 -0.59 -5.11 118.68 119.53 1jx1 s LEU 13 Ca 0.00 -1.32 -0.17 0.00 -1.03 0.00 0.00 54.13 51.61 1jx1 s LEU 13 Cb 0.00 -1.19 -0.05 0.00 0.03 0.00 0.00 46.19 44.98 1jx1 s LEU 13 CO 0.00 -0.27 0.43 -0.70 0.23 0.00 0.00 176.35 176.04 1jx1 s GLU 14 N 1.37 4.22 -0.64 1.70 2.12 -1.26 -0.62 118.70 125.58 1jx1 s GLU 14 Ca -0.03 0.39 -0.04 0.00 0.36 0.00 0.00 54.97 55.65 1jx1 s GLU 14 Cb -0.19 -3.37 0.17 0.00 0.26 0.00 0.00 34.13 30.99 1jx1 s GLU 14 CO -0.08 0.32 0.47 0.71 -0.54 0.00 0.00 175.26 176.14 1jx1 s TYR 15 N 0.12 3.45 0.74 5.30 1.51 0.27 -5.00 117.35 123.72 1jx1 s TYR 15 Ca 0.24 -2.63 -0.16 0.00 -1.01 0.00 0.00 57.07 53.51 1jx1 s TYR 15 Cb -0.15 -3.27 -0.01 0.00 -0.11 0.00 0.00 41.96 38.43 1jx1 s TYR 15 CO 0.10 -0.86 0.78 -2.30 -1.11 0.00 0.00 175.55 172.17 1jx1 n PRO 16 N 3.56 0.37 -0.34 -1.71 -0.02 -1.26 -2.47 135.00 133.11 1jx1 n PRO 16 Ca 0.08 0.18 0.20 0.00 -2.02 0.00 0.00 63.50 61.94 1jx1 n PRO 16 Cb 0.39 -2.06 0.43 0.00 -0.02 0.00 0.00 33.50 32.23 1jx1 n PRO 16 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1jx1 h ALA 17 N -0.40 1.90 -3.40 3.55 0.00 -1.87 -3.40 119.26 115.65 1jx1 h ALA 17 Ca -0.46 0.13 -0.39 0.00 0.00 0.00 0.00 54.91 54.18 1jx1 h ALA 17 Cb 1.34 0.05 -0.22 0.00 0.00 0.00 0.00 17.79 18.96 1jx1 h ALA 17 CO 0.45 -0.40 -0.77 0.08 0.00 0.00 0.00 179.25 178.60 1jx1 s VAL 18 N -5.71 1.02 0.01 0.00 1.01 -1.26 0.85 120.40 116.33 1jx1 s VAL 18 Ca -0.10 -1.25 -0.03 0.00 0.00 0.00 0.00 61.98 60.60 1jx1 s VAL 18 Cb 0.28 -1.00 -0.01 0.00 0.00 0.00 0.00 36.38 35.65 1jx1 s VAL 18 CO 0.80 -0.23 0.04 0.68 0.00 0.00 0.00 175.10 176.38 1jx1 s VAL 19 N -1.26 0.09 0.02 2.92 -7.23 -0.15 -5.00 120.40 109.80 1jx1 s VAL 19 Ca -0.03 -0.74 0.08 0.00 -1.81 0.00 0.00 61.98 59.48 1jx1 s VAL 19 Cb -0.10 -0.30 -0.03 0.00 0.56 0.00 0.00 36.38 36.51 1jx1 s VAL 19 CO 0.02 -0.40 -0.23 -0.89 -0.31 0.00 0.00 175.10 173.29 1jx1 s THR 20 N -1.27 2.41 -0.15 5.32 2.01 -1.26 -0.96 115.64 121.72 1jx1 s THR 20 Ca -0.14 -1.21 -0.02 0.00 0.31 0.00 0.00 61.69 60.63 1jx1 s THR 20 Cb -0.08 -1.94 -0.02 0.00 0.01 0.00 0.00 72.50 70.47 1jx1 s THR 20 CO 0.00 0.42 -0.09 -0.55 -0.69 0.00 0.00 174.62 173.72 1jx1 s SER 21 N -1.12 4.28 0.32 3.53 0.15 -1.00 -4.91 113.70 114.94 1jx1 s SER 21 Ca 0.12 -0.28 0.16 0.00 0.70 0.00 0.00 55.95 56.64 1jx1 s SER 21 Cb -0.10 -1.68 0.42 0.00 -1.71 0.00 0.00 66.02 62.95 1jx1 s SER 21 CO 0.02 0.13 1.61 -0.65 1.20 0.00 0.00 173.24 175.56 1jx1 h PRO 22 N 6.97 0.00 -0.39 5.44 0.11 -1.87 1.43 132.00 143.70 1jx1 h PRO 22 Ca -0.30 0.00 -0.15 0.00 0.11 0.00 0.00 66.00 65.65 1jx1 h PRO 22 Cb 1.20 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.30 1jx1 h PRO 22 CO 0.59 0.50 -0.37 0.28 -0.21 0.00 0.00 178.00 178.79 1jx1 h VAL 23 N 0.00 1.27 0.00 3.15 2.07 -1.81 -3.37 116.25 117.56 1jx1 h VAL 23 Ca -0.00 -1.54 -0.12 0.00 0.82 0.00 0.00 66.70 65.86 1jx1 h VAL 23 Cb 1.11 1.36 -0.02 0.00 -1.52 0.00 0.00 31.29 32.22 1jx1 h VAL 23 CO 0.06 0.52 -1.48 0.35 0.02 0.00 0.00 177.57 177.05 1jx1 n THR 24 N -4.06 0.43 -0.98 2.57 -2.24 -1.21 -5.01 114.28 103.78 1jx1 n THR 24 Ca -0.02 -0.29 0.00 0.00 -2.27 0.00 0.00 64.05 61.47 1jx1 n THR 24 Cb 0.53 -0.68 0.00 0.00 -2.10 0.00 0.00 70.33 68.09 1jx1 n THR 24 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1jx1 n GLY 25 N 2.50 0.57 3.93 3.38 0.00 0.49 -5.01 105.19 111.05 1jx1 n GLY 25 Ca -0.10 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.66 1jx1 n GLY 25 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1jx1 s LYS 26 N -0.22 2.97 -0.05 1.61 1.02 -1.25 -4.83 119.74 118.99 1jx1 s LYS 26 Ca 0.00 -0.15 0.05 0.00 0.02 0.00 0.00 55.97 55.89 1jx1 s LYS 26 Cb 0.00 -2.36 -0.01 0.00 -0.52 0.00 0.00 37.83 34.94 1jx1 s LYS 26 CO 0.00 -0.57 -0.22 -1.12 -0.92 0.00 0.00 175.35 172.53 1jx1 s SER 27 N -4.28 2.68 0.13 2.83 0.01 -1.26 -2.38 113.70 111.43 1jx1 s SER 27 Ca 0.52 -0.45 0.06 0.00 1.31 0.00 0.00 55.95 57.40 1jx1 s SER 27 Cb -0.10 -0.76 -0.04 0.00 0.21 0.00 0.00 66.02 65.33 1jx1 s SER 27 CO 0.43 0.20 -0.15 -0.31 0.41 0.00 0.00 173.24 173.82 1jx1 s TYR 28 N -0.06 1.50 0.25 2.43 1.51 -0.13 0.11 117.35 122.96 1jx1 s TYR 28 Ca -0.04 -0.54 0.11 0.00 -1.01 0.00 0.00 57.07 55.59 1jx1 s TYR 28 Cb -0.13 -0.77 -0.05 0.00 -0.11 0.00 0.00 41.96 40.90 1jx1 s TYR 28 CO 0.03 0.18 -0.13 -0.59 -1.11 0.00 0.00 175.55 173.94 1jx1 s PHE 29 N -2.11 2.46 -0.10 2.71 -0.12 -0.22 -0.98 117.98 119.63 1jx1 s PHE 29 Ca 0.10 -0.29 -0.30 0.00 -0.05 0.00 0.00 56.93 56.40 1jx1 s PHE 29 Cb -0.05 -1.11 -0.03 0.00 -0.63 0.00 0.00 43.02 41.20 1jx1 s PHE 29 CO 0.04 0.64 1.35 -1.17 -0.05 0.00 0.00 175.22 176.02 1jx1 s LEU 30 N -3.39 4.25 -0.09 -1.99 2.96 0.25 -2.02 118.68 118.65 1jx1 s LEU 30 Ca 0.29 1.89 0.13 0.00 -0.22 0.00 0.00 54.13 56.22 1jx1 s LEU 30 Cb -0.06 -3.54 -0.24 0.00 0.50 0.00 0.00 46.19 42.85 1jx1 s LEU 30 CO 0.16 -0.75 0.48 0.61 -1.32 0.00 0.00 176.35 175.53 1jx1 n GLY 31 N 3.66 -0.98 0.00 7.98 0.00 -0.26 -4.94 105.19 110.66 1jx1 n GLY 31 Ca 0.14 -0.13 0.00 0.00 0.00 0.00 0.00 46.02 46.03 1jx1 n GLY 31 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1jx1 n GLY 32 N 1.63 1.97 3.00 -0.02 0.00 -1.20 -2.56 105.19 108.01 1jx1 n GLY 32 Ca -0.22 -0.64 -0.00 0.00 0.00 0.00 0.00 46.02 45.16 1jx1 n GLY 32 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1jx1 s ALA 33 N -2.00 -2.71 0.00 4.61 0.00 -1.26 -1.68 121.76 118.72 1jx1 s ALA 33 Ca 0.00 0.22 0.00 0.00 0.00 0.00 0.00 51.96 52.18 1jx1 s ALA 33 Cb 0.00 -2.79 0.00 0.00 0.00 0.00 0.00 23.12 20.33 1jx1 s ALA 33 CO 0.00 -2.28 0.05 0.41 0.00 0.00 0.00 175.76 173.94 1jx1 n GLY 34 N 3.83 0.80 0.00 0.00 0.00 -1.25 -4.82 105.19 103.75 1jx1 n GLY 34 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.14 1jx1 n GLY 34 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1jx1 n GLU 35 N -0.24 0.00 -4.03 1.61 2.13 -1.26 -4.75 120.64 114.09 1jx1 n GLU 35 Ca 0.00 0.00 -0.16 0.00 0.66 0.00 0.00 57.16 57.66 1jx1 n GLU 35 Cb 0.00 0.00 -0.05 0.00 0.27 0.00 0.00 31.44 31.66 1jx1 n GLU 35 CO 0.00 0.00 0.00 0.54 -0.41 0.00 0.00 177.13 177.26 1jx1 n ARG 36 N -1.64 0.54 0.00 5.31 5.12 -0.80 -4.90 116.66 120.28 1jx1 n ARG 36 Ca 0.00 -2.96 0.00 0.00 -1.93 0.00 0.00 57.85 52.96 1jx1 n ARG 36 Cb 0.00 2.63 0.00 0.00 -1.16 0.00 0.00 32.46 33.93 1jx1 n ARG 36 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1jx1 n GLY 37 N -0.59 -2.06 0.00 -0.13 0.00 -1.26 -1.91 105.19 99.24 1jx1 n GLY 37 Ca 0.04 0.69 0.00 0.00 0.00 0.00 0.00 46.02 46.75 1jx1 n GLY 37 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1jx1 n LEU 38 N 0.00 0.00 -4.24 0.99 4.77 -1.26 -4.64 117.00 112.62 1jx1 n LEU 38 Ca 0.00 0.00 -0.37 0.00 -0.03 0.00 0.00 56.01 55.61 1jx1 n LEU 38 Cb 0.00 0.00 -0.13 0.00 -2.33 0.00 0.00 43.42 40.96 1jx1 n LEU 38 CO 0.00 0.00 -0.28 -0.36 -1.33 0.00 0.00 177.39 175.42 1jx1 s PHE 44 N 0.00 3.27 -0.37 -1.77 0.40 -1.26 -4.64 117.98 113.62 1jx1 s PHE 44 Ca 0.00 -1.59 0.02 0.00 -0.60 0.00 0.00 56.93 54.77 1jx1 s PHE 44 Cb 0.00 -2.25 0.10 0.00 0.51 0.00 0.00 43.02 41.38 1jx1 s PHE 44 CO 0.00 -0.76 0.10 0.42 0.70 0.00 0.00 175.22 175.68 1jx1 s ILE 45 N 1.35 2.53 0.12 0.64 1.01 -1.26 -5.09 121.20 120.50 1jx1 s ILE 45 Ca -0.03 -2.33 -0.31 0.00 0.00 0.00 0.00 60.65 57.98 1jx1 s ILE 45 Cb -0.20 -2.83 -0.10 0.00 0.01 0.00 0.00 42.46 39.35 1jx1 s ILE 45 CO 0.01 -0.63 1.67 -0.54 0.00 0.00 0.00 174.94 175.45 1jx1 s LYS 46 N 0.89 4.18 -0.06 2.79 1.02 -1.26 -4.61 119.74 122.70 1jx1 s LYS 46 Ca 0.11 2.42 0.00 0.00 0.02 0.00 0.00 55.97 58.52 1jx1 s LYS 46 Cb -0.20 -3.42 -0.04 0.00 -0.52 0.00 0.00 37.83 33.65 1jx1 s LYS 46 CO -0.07 -0.72 -0.05 1.19 -0.92 0.00 0.00 175.35 174.78 1jx1 n PHE 47 N 4.99 0.00 -3.89 3.18 3.01 -1.21 -4.59 117.46 118.95 1jx1 n PHE 47 Ca 0.16 0.00 -0.09 0.00 1.01 0.00 0.00 57.45 58.53 1jx1 n PHE 47 Cb 0.39 -0.21 -0.04 0.00 -0.01 0.00 0.00 39.48 39.61 1jx1 n PHE 47 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1jx1 s ALA 48 N -2.11 -0.63 0.00 4.37 0.00 -0.80 0.54 121.76 123.14 1jx1 s ALA 48 Ca -0.07 -0.57 0.01 0.00 0.00 0.00 0.00 51.96 51.33 1jx1 s ALA 48 Cb 0.02 0.95 -0.04 0.00 0.00 0.00 0.00 23.12 24.05 1jx1 s ALA 48 CO 0.13 -0.86 0.02 0.00 0.00 0.00 0.00 175.76 175.05 1jx1 s ALA 49 N -3.95 3.36 -0.08 0.00 0.00 0.28 -1.91 121.76 119.46 1jx1 s ALA 49 Ca 0.16 -0.94 0.01 0.00 0.00 0.00 0.00 51.96 51.18 1jx1 s ALA 49 Cb -0.02 -1.39 0.02 0.00 0.00 0.00 0.00 23.12 21.73 1jx1 s ALA 49 CO 0.04 0.66 -0.08 -1.50 0.00 0.00 0.00 175.76 174.88 1jx1 s ILE 50 N -1.13 0.94 0.13 0.00 1.10 -1.26 -1.46 121.20 119.52 1jx1 s ILE 50 Ca 0.21 -0.30 0.08 0.00 -0.51 0.00 0.00 60.65 60.13 1jx1 s ILE 50 Cb -0.12 -0.93 -0.04 0.00 0.15 0.00 0.00 42.46 41.53 1jx1 s ILE 50 CO 0.12 0.33 -0.18 -0.83 -2.11 0.00 0.00 174.94 172.27 1jx1 s GLY 51 N 1.22 1.27 -0.18 1.50 0.00 0.62 -3.79 107.32 107.96 1jx1 s GLY 51 Ca -0.05 -1.36 -0.00 0.00 0.00 0.00 0.00 44.72 43.31 1jx1 s GLY 51 CO -0.02 -1.40 -0.05 0.14 0.00 0.00 0.00 173.10 171.77 1jx1 s VAL 52 N -1.78 1.21 -0.08 1.40 1.01 -0.67 -1.80 120.40 119.69 1jx1 s VAL 52 Ca 0.11 -0.78 -0.02 0.00 0.00 0.00 0.00 61.98 61.29 1jx1 s VAL 52 Cb -0.07 -1.41 -0.03 0.00 0.00 0.00 0.00 36.38 34.86 1jx1 s VAL 52 CO 0.05 0.06 0.01 -0.31 0.00 0.00 0.00 175.10 174.91 1jx1 s TYR 53 N 1.58 3.18 0.06 5.22 1.51 0.91 -1.10 117.35 128.70 1jx1 s TYR 53 Ca -0.01 0.20 0.07 0.00 -1.01 0.00 0.00 57.07 56.32 1jx1 s TYR 53 Cb -0.16 -1.78 -0.03 0.00 -0.11 0.00 0.00 41.96 39.87 1jx1 s TYR 53 CO -0.07 0.48 -0.16 -0.51 -1.11 0.00 0.00 175.55 174.18 1jx1 s LEU 54 N -0.97 2.75 0.28 -1.29 1.43 -0.86 -0.44 118.68 119.58 1jx1 s LEU 54 Ca 0.14 -0.40 -0.29 0.00 -1.03 0.00 0.00 54.13 52.54 1jx1 s LEU 54 Cb -0.11 -1.60 -0.10 0.00 0.03 0.00 0.00 46.19 44.41 1jx1 s LEU 54 CO 0.03 0.24 1.36 -0.70 0.23 0.00 0.00 176.35 177.52 1jx1 s GLU 55 N -1.64 4.32 0.35 1.70 2.12 0.55 -1.06 118.70 125.04 1jx1 s GLU 55 Ca 0.16 2.24 0.17 0.00 0.36 0.00 0.00 54.97 57.90 1jx1 s GLU 55 Cb -0.11 -3.10 1.17 0.00 0.26 0.00 0.00 34.13 32.35 1jx1 s GLU 55 CO 0.07 -0.30 1.64 0.38 -0.54 0.00 0.00 175.26 176.52 1jx1 h ASP 56 N 4.29 0.46 0.45 -1.70 -0.00 0.42 0.31 116.42 120.66 1jx1 h ASP 56 Ca -0.47 0.20 0.00 0.00 -0.00 0.00 0.00 57.03 56.76 1jx1 h ASP 56 Cb 1.22 0.16 0.00 0.00 -0.00 0.00 0.00 39.33 40.71 1jx1 h ASP 56 CO 0.72 -0.20 0.00 2.30 -0.00 0.00 0.00 179.24 182.06 1jx1 n ILE 57 N -5.07 1.03 0.33 4.15 -5.35 -1.26 -2.78 119.36 110.40 1jx1 n ILE 57 Ca 0.33 0.37 0.21 0.00 -0.27 0.00 0.00 62.75 63.39 1jx1 n ILE 57 Cb 1.07 -1.28 1.10 0.00 -1.74 0.00 0.00 39.64 38.79 1jx1 n ILE 57 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1jx1 h ALA 58 N 2.23 1.15 0.02 -1.28 0.00 -0.71 -2.05 119.26 118.61 1jx1 h ALA 58 Ca 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 1jx1 h ALA 58 Cb 0.23 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.02 1jx1 h ALA 58 CO 0.00 -0.09 -0.01 0.28 0.00 0.00 0.00 179.25 179.44 1jx1 h VAL 59 N 0.00 1.45 0.00 0.00 2.07 -1.72 -1.07 116.25 116.97 1jx1 h VAL 59 Ca 0.00 -1.49 -0.01 0.00 0.82 0.00 0.00 66.70 66.03 1jx1 h VAL 59 Cb 0.17 2.44 -0.00 0.00 -1.52 0.00 0.00 31.29 32.37 1jx1 h VAL 59 CO -0.00 0.38 -0.05 0.00 0.02 0.00 0.00 177.57 177.92 1jx1 h ALA 60 N 0.28 1.27 0.21 1.67 0.00 -1.62 -1.75 119.26 119.33 1jx1 h ALA 60 Ca -0.00 -0.04 -0.33 0.00 0.00 0.00 0.00 54.91 54.53 1jx1 h ALA 60 Cb 0.64 -0.01 0.02 0.00 0.00 0.00 0.00 17.79 18.44 1jx1 h ALA 60 CO 0.00 0.06 -1.55 1.03 0.00 0.00 0.00 179.25 178.80 1jx1 h SER 61 N 0.00 0.69 1.31 0.00 0.87 -1.33 -3.37 113.55 111.72 1jx1 h SER 61 Ca -0.00 -0.83 -0.02 0.00 -1.23 0.00 0.00 61.79 59.71 1jx1 h SER 61 Cb 0.18 -0.23 -0.00 0.00 -0.44 0.00 0.00 62.40 61.91 1jx1 h SER 61 CO 0.01 1.67 -0.70 -0.07 -0.53 0.00 0.00 176.83 177.21 1jx1 h LEU 62 N 0.12 0.00 -0.74 2.23 3.38 -0.97 -3.40 115.31 115.93 1jx1 h LEU 62 Ca -0.27 0.00 0.07 0.00 0.09 0.00 0.00 57.88 57.77 1jx1 h LEU 62 Cb 2.12 0.00 -0.10 0.00 0.09 0.00 0.00 40.66 42.77 1jx1 h LEU 62 CO 0.23 0.06 -0.54 0.00 0.09 0.00 0.00 178.44 178.29 1jx1 h ALA 63 N 1.94 -0.59 -0.83 1.53 0.00 -1.48 -0.74 119.26 119.08 1jx1 h ALA 63 Ca -0.01 0.07 0.21 0.00 0.00 0.00 0.00 54.91 55.18 1jx1 h ALA 63 Cb 1.06 1.26 -0.14 0.00 0.00 0.00 0.00 17.79 19.97 1jx1 h ALA 63 CO 0.01 -0.93 0.13 0.00 0.00 0.00 0.00 179.25 178.45 1jx1 h ALA 64 N 0.21 1.06 0.00 0.00 0.00 -1.82 0.53 119.26 119.24 1jx1 h ALA 64 Ca 0.12 0.24 -0.25 0.00 0.00 0.00 0.00 54.91 55.02 1jx1 h ALA 64 Cb 0.44 0.37 -0.04 0.00 0.00 0.00 0.00 17.79 18.56 1jx1 h ALA 64 CO -0.76 -0.45 -1.57 0.87 0.00 0.00 0.00 179.25 177.34 1jx1 h LYS 65 N 0.16 0.00 -0.12 0.00 1.57 -1.78 -3.39 116.57 113.01 1jx1 h LYS 65 Ca 0.49 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.27 1jx1 h LYS 65 Cb 0.95 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.26 1jx1 h LYS 65 CO -0.67 0.46 0.00 0.91 -0.57 0.00 0.00 179.45 179.58 1jx1 n TRP 66 N -3.02 0.15 -2.06 -1.35 7.02 -0.32 -4.98 117.44 112.89 1jx1 n TRP 66 Ca -0.14 -0.24 -0.42 0.00 -1.02 0.00 0.00 57.50 55.68 1jx1 n TRP 66 Cb 0.98 -0.02 -0.03 0.00 -2.42 0.00 0.00 31.31 29.82 1jx1 n TRP 66 CO 0.00 0.00 0.00 0.21 -2.02 0.00 0.00 177.69 175.88 1jx1 s LYS 67 N -0.81 4.26 -0.23 -0.99 2.20 0.18 -3.30 119.74 121.05 1jx1 s LYS 67 Ca 0.12 2.19 -0.01 0.00 -0.36 0.00 0.00 55.97 57.91 1jx1 s LYS 67 Cb 0.07 -3.36 0.00 0.00 -1.51 0.00 0.00 37.83 33.03 1jx1 s LYS 67 CO 0.10 -0.57 0.20 0.41 -0.36 0.00 0.00 175.35 175.13 1jx1 n GLY 68 N 3.70 0.58 2.85 5.54 0.00 -1.26 -5.00 105.19 111.59 1jx1 n GLY 68 Ca 0.13 -0.47 -0.17 0.00 0.00 0.00 0.00 46.02 45.51 1jx1 n GLY 68 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1jx1 s LYS 69 N -4.94 0.33 0.85 1.61 1.02 -1.21 -5.14 119.74 112.26 1jx1 s LYS 69 Ca 0.07 0.02 -0.12 0.00 0.02 0.00 0.00 55.97 55.97 1jx1 s LYS 69 Cb -0.03 -0.45 0.11 0.00 -0.52 0.00 0.00 37.83 36.93 1jx1 s LYS 69 CO 0.13 -0.09 1.18 -1.54 -0.92 0.00 0.00 175.35 174.11 1jx1 s SER 70 N 0.77 3.34 0.55 2.83 1.04 -1.26 -4.80 113.70 116.18 1jx1 s SER 70 Ca -0.08 2.27 0.27 0.00 0.48 0.00 0.00 55.95 58.90 1jx1 s SER 70 Cb -0.11 -2.58 1.61 0.00 0.10 0.00 0.00 66.02 65.04 1jx1 s SER 70 CO -0.01 -2.83 2.17 0.28 0.98 0.00 0.00 173.24 173.82 1jx1 h SER 71 N -1.32 0.00 0.01 7.02 0.02 -1.95 -2.16 113.55 115.16 1jx1 h SER 71 Ca -0.45 0.00 -0.08 0.00 -0.84 0.00 0.00 61.79 60.42 1jx1 h SER 71 Cb 1.28 0.00 0.01 0.00 0.14 0.00 0.00 62.40 63.83 1jx1 h SER 71 CO 0.44 0.06 -0.33 -0.33 -1.14 0.00 0.00 176.83 175.53 1jx1 h GLU 72 N 0.00 0.21 -0.70 3.45 3.07 -1.90 -1.74 114.58 116.97 1jx1 h GLU 72 Ca -0.00 -0.24 0.02 0.00 -0.50 0.00 0.00 59.36 58.65 1jx1 h GLU 72 Cb 0.15 0.07 -0.04 0.00 -0.84 0.00 0.00 28.75 28.09 1jx1 h GLU 72 CO 0.01 0.97 0.45 1.49 -1.40 0.00 0.00 179.01 180.53 1jx1 h GLU 73 N -0.46 0.85 -0.41 2.33 4.81 -1.85 -2.53 114.58 117.33 1jx1 h GLU 73 Ca -0.04 -0.05 -0.08 0.00 -0.13 0.00 0.00 59.36 59.05 1jx1 h GLU 73 Cb 1.10 -0.19 -0.02 0.00 0.63 0.00 0.00 28.75 30.26 1jx1 h GLU 73 CO 0.06 0.57 -0.09 -0.07 -0.73 0.00 0.00 179.01 178.75 1jx1 h LEU 74 N 0.88 0.70 -1.97 1.64 3.38 -1.44 -2.00 115.31 116.50 1jx1 h LEU 74 Ca 0.28 -0.19 -0.02 0.00 0.09 0.00 0.00 57.88 58.03 1jx1 h LEU 74 Cb -0.01 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 40.55 1jx1 h LEU 74 CO -0.10 0.83 -0.10 0.25 0.09 0.00 0.00 178.44 179.41 1jx1 h LEU 75 N 0.65 0.00 -1.59 1.67 5.85 -0.88 -2.48 115.31 118.54 1jx1 h LEU 75 Ca 0.12 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.84 1jx1 h LEU 75 Cb 0.54 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.57 1jx1 h LEU 75 CO 0.03 0.10 -0.05 -1.84 -0.34 0.00 0.00 178.44 176.33 1jx1 n GLU 76 N -3.54 1.55 -3.21 1.25 0.28 -1.03 -4.86 120.64 111.08 1jx1 n GLU 76 Ca -0.02 -1.48 -0.45 0.00 -0.16 0.00 0.00 57.16 55.05 1jx1 n GLU 76 Cb 0.23 -1.34 -0.05 0.00 1.43 0.00 0.00 31.44 31.71 1jx1 n GLU 76 CO 0.00 0.00 0.00 0.99 -0.16 0.00 0.00 177.13 177.96 1jx1 s THR 77 N -1.60 5.03 0.46 3.84 2.01 -0.78 -4.92 115.64 119.69 1jx1 s THR 77 Ca 0.20 -1.28 0.13 0.00 0.31 0.00 0.00 61.69 61.05 1jx1 s THR 77 Cb 0.15 -4.42 0.29 0.00 0.01 0.00 0.00 72.50 68.54 1jx1 s THR 77 CO 0.26 -1.00 2.07 -0.07 -0.69 0.00 0.00 174.62 175.19 1jx1 h LEU 78 N 9.39 0.24 -2.17 4.42 3.38 -1.89 -0.93 115.31 127.76 1jx1 h LEU 78 Ca -0.29 -0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.67 1jx1 h LEU 78 Cb 1.09 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 41.78 1jx1 h LEU 78 CO 1.06 0.17 -0.06 -0.78 0.09 0.00 0.00 178.44 178.92 1jx1 h ASP 79 N 0.28 0.00 -0.23 -0.43 1.82 -1.95 -1.81 116.42 114.10 1jx1 h ASP 79 Ca 0.14 0.00 -0.11 0.00 -0.39 0.00 0.00 57.03 56.67 1jx1 h ASP 79 Cb 0.20 0.00 -0.00 0.00 0.68 0.00 0.00 39.33 40.21 1jx1 h ASP 79 CO -0.03 0.06 -0.27 0.15 -1.61 0.00 0.00 179.24 177.54 1jx1 h PHE 80 N 0.00 0.71 0.00 0.28 3.04 -1.50 -2.35 116.94 117.13 1jx1 h PHE 80 Ca -0.00 -0.23 -0.09 0.00 3.98 0.00 0.00 57.97 61.64 1jx1 h PHE 80 Cb 0.17 -0.15 -0.01 0.00 2.56 0.00 0.00 35.95 38.52 1jx1 h PHE 80 CO 0.00 0.94 -0.41 1.88 -2.02 0.00 0.00 178.31 178.70 1jx1 h TYR 81 N 0.28 0.00 -0.51 0.41 -1.99 -1.41 -2.50 116.97 111.25 1jx1 h TYR 81 Ca 0.03 0.00 -0.12 0.00 2.00 0.00 0.00 58.73 60.64 1jx1 h TYR 81 Cb 0.84 0.00 -0.02 0.00 2.00 0.00 0.00 36.73 39.56 1jx1 h TYR 81 CO 0.08 0.41 -0.16 0.00 -0.00 0.00 0.00 178.16 178.49 1jx1 h ARG 82 N 0.00 1.01 -0.38 4.88 3.08 -1.29 0.43 114.38 122.11 1jx1 h ARG 82 Ca -0.00 -0.40 -0.04 0.00 0.07 0.00 0.00 59.98 59.61 1jx1 h ARG 82 Cb 0.83 -0.05 -0.02 0.00 0.08 0.00 0.00 29.97 30.81 1jx1 h ARG 82 CO 0.05 1.08 0.07 -0.44 -1.07 0.00 0.00 179.97 179.66 1jx1 h ASP 83 N 0.88 0.52 -0.01 7.04 3.32 -1.10 0.15 116.42 127.23 1jx1 h ASP 83 Ca 0.13 -0.08 -0.02 0.00 0.02 0.00 0.00 57.03 57.08 1jx1 h ASP 83 Cb 0.73 -0.14 0.00 0.00 0.22 0.00 0.00 39.33 40.15 1jx1 h ASP 83 CO 0.06 0.55 -0.07 0.40 -1.72 0.00 0.00 179.24 178.46 1jx1 h ILE 84 N 0.55 1.52 -0.64 0.35 2.04 -0.97 0.75 117.51 121.11 1jx1 h ILE 84 Ca 0.13 -1.62 -0.04 0.00 1.00 0.00 0.00 64.86 64.33 1jx1 h ILE 84 Cb 0.25 2.57 -0.03 0.00 -0.74 0.00 0.00 36.82 38.87 1jx1 h ILE 84 CO 0.00 0.43 0.26 0.40 0.00 0.00 0.00 178.15 179.24 1jx1 h ILE 85 N -0.57 1.22 -0.15 -0.67 2.04 0.05 -3.14 117.51 116.29 1jx1 h ILE 85 Ca -0.00 -0.70 0.00 0.00 1.00 0.00 0.00 64.86 65.15 1jx1 h ILE 85 Cb 0.74 0.46 0.00 0.00 -0.74 0.00 0.00 36.82 37.27 1jx1 h ILE 85 CO 0.01 0.28 0.00 -1.20 0.00 0.00 0.00 178.15 177.25 1jx1 n SER 86 N -4.31 2.46 -4.56 1.72 7.64 0.52 -4.93 113.62 112.15 1jx1 n SER 86 Ca 0.06 -1.71 -0.40 0.00 1.01 0.00 0.00 58.87 57.83 1jx1 n SER 86 Cb 0.17 -0.09 0.03 0.00 -1.01 0.00 0.00 64.21 63.30 1jx1 n SER 86 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1jx1 n GLY 87 N 0.76 -0.65 2.87 0.23 0.00 0.26 -4.82 105.19 103.83 1jx1 n GLY 87 Ca 0.10 -0.01 -0.36 0.00 0.00 0.00 0.00 46.02 45.75 1jx1 n GLY 87 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1jx1 n PRO 88 N -0.15 1.92 -3.59 1.61 -0.04 -1.26 -4.75 135.00 128.74 1jx1 n PRO 88 Ca 0.11 -1.80 -0.04 0.00 -0.04 0.00 0.00 63.50 61.73 1jx1 n PRO 88 Cb 0.43 -2.79 -0.02 0.00 -0.04 0.00 0.00 33.50 31.08 1jx1 n PRO 88 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 1jx1 s PHE 89 N 4.18 -0.16 0.27 0.54 -0.12 -1.26 -4.89 117.98 116.53 1jx1 s PHE 89 Ca 0.51 0.07 -0.24 0.00 -0.05 0.00 0.00 56.93 57.22 1jx1 s PHE 89 Cb 0.13 0.53 -0.09 0.00 -0.63 0.00 0.00 43.02 42.96 1jx1 s PHE 89 CO 0.04 -0.31 0.86 -2.00 -0.05 0.00 0.00 175.22 173.76 1jx1 s GLU 90 N -2.60 4.50 -0.08 1.99 2.12 -1.26 -4.34 118.70 119.04 1jx1 s GLU 90 Ca 0.09 1.18 0.04 0.00 0.36 0.00 0.00 54.97 56.65 1jx1 s GLU 90 Cb -0.00 -2.91 -0.00 0.00 0.26 0.00 0.00 34.13 31.47 1jx1 s GLU 90 CO -0.05 0.37 -0.22 0.15 -0.54 0.00 0.00 175.26 174.96 1jx1 s LYS 91 N -1.86 2.68 -0.19 4.30 3.01 -0.97 -0.33 119.74 126.37 1jx1 s LYS 91 Ca 0.46 -0.80 -0.02 0.00 -1.01 0.00 0.00 55.97 54.60 1jx1 s LYS 91 Cb -0.19 -2.10 -0.00 0.00 -1.01 0.00 0.00 37.83 34.53 1jx1 s LYS 91 CO 0.24 0.20 -0.10 -1.17 0.51 0.00 0.00 175.35 175.03 1jx1 s LEU 92 N 0.26 2.67 -0.25 3.17 2.96 0.42 0.34 118.68 128.26 1jx1 s LEU 92 Ca -0.14 -0.44 -0.07 0.00 -0.22 0.00 0.00 54.13 53.26 1jx1 s LEU 92 Cb -0.16 -1.65 -0.02 0.00 0.50 0.00 0.00 46.19 44.85 1jx1 s LEU 92 CO 0.07 0.03 0.06 -0.63 -1.32 0.00 0.00 176.35 174.56 1jx1 s ILE 93 N 1.17 4.22 -0.16 6.68 1.09 -0.38 -0.06 121.20 133.75 1jx1 s ILE 93 Ca 0.02 -0.23 -0.03 0.00 -1.10 0.00 0.00 60.65 59.31 1jx1 s ILE 93 Cb -0.14 -2.98 -0.02 0.00 -1.06 0.00 0.00 42.46 38.26 1jx1 s ILE 93 CO -0.03 0.33 -0.06 -0.60 -0.10 0.00 0.00 174.94 174.47 1jx1 s ARG 94 N 1.60 3.52 -0.15 2.79 3.00 -0.74 -0.32 118.95 128.65 1jx1 s ARG 94 Ca 0.06 -0.59 0.02 0.00 -1.00 0.00 0.00 55.73 54.22 1jx1 s ARG 94 Cb -0.15 -2.86 0.02 0.00 0.00 0.00 0.00 34.95 31.95 1jx1 s ARG 94 CO 0.03 0.13 -0.19 0.20 0.00 0.00 0.00 175.30 175.47 1jx1 s GLY 95 N 0.62 1.29 -0.02 8.12 0.00 0.20 -0.27 107.32 117.26 1jx1 s GLY 95 Ca -0.04 -1.06 0.07 0.00 0.00 0.00 0.00 44.72 43.70 1jx1 s GLY 95 CO 0.03 0.20 -0.25 -0.56 0.00 0.00 0.00 173.10 172.51 1jx1 s SER 96 N 1.10 3.16 0.36 1.64 0.01 -0.54 0.15 113.70 119.57 1jx1 s SER 96 Ca -0.01 -0.44 -0.23 0.00 1.31 0.00 0.00 55.95 56.57 1jx1 s SER 96 Cb -0.14 -0.41 -0.10 0.00 0.21 0.00 0.00 66.02 65.57 1jx1 s SER 96 CO -0.07 0.32 0.92 -0.54 0.41 0.00 0.00 173.24 174.28 1jx1 s LYS 97 N -0.61 4.40 -0.02 12.44 3.01 0.49 0.99 119.74 140.44 1jx1 s LYS 97 Ca 0.10 1.19 0.06 0.00 -1.01 0.00 0.00 55.97 56.30 1jx1 s LYS 97 Cb -0.10 -2.56 -0.09 0.00 -1.01 0.00 0.00 37.83 34.07 1jx1 s LYS 97 CO -0.01 0.17 0.10 -0.89 0.51 0.00 0.00 175.35 175.23 1jx1 n ILE 98 N 0.08 0.11 -3.76 2.17 5.41 0.19 0.53 119.36 124.08 1jx1 n ILE 98 Ca 0.04 -0.17 -0.18 0.00 1.00 0.00 0.00 62.75 63.44 1jx1 n ILE 98 Cb 0.52 0.02 -0.17 0.00 -0.71 0.00 0.00 39.64 39.30 1jx1 n ILE 98 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 176.55 176.42 1jx1 s ARG 99 N -2.34 0.09 0.15 0.38 1.81 -0.74 -4.79 118.95 113.51 1jx1 s ARG 99 Ca -0.02 0.23 -0.32 0.00 -1.72 0.00 0.00 55.73 53.90 1jx1 s ARG 99 Cb 0.03 -0.48 -0.17 0.00 -0.45 0.00 0.00 34.95 33.88 1jx1 s ARG 99 CO 0.25 -0.24 0.85 -1.91 -0.68 0.00 0.00 175.30 173.56 1jx1 n GLU 100 N 4.72 0.36 -3.73 3.54 2.13 -1.26 -4.75 120.64 121.66 1jx1 n GLU 100 Ca -0.15 0.13 -0.12 0.00 0.66 0.00 0.00 57.16 57.67 1jx1 n GLU 100 Cb 0.50 -1.40 -0.13 0.00 0.27 0.00 0.00 31.44 30.69 1jx1 n GLU 100 CO 0.00 0.00 0.00 -0.51 -0.41 0.00 0.00 177.13 176.21 1jx1 s LEU 101 N 1.48 0.36 1.04 4.31 1.43 -0.62 -4.97 118.68 121.71 1jx1 s LEU 101 Ca 0.73 0.59 -0.13 0.00 -1.03 0.00 0.00 54.13 54.29 1jx1 s LEU 101 Cb -0.99 0.85 0.21 0.00 0.03 0.00 0.00 46.19 46.30 1jx1 s LEU 101 CO 0.56 -0.17 1.09 -0.94 0.23 0.00 0.00 176.35 177.12 1jx1 s SER 102 N 1.22 2.24 0.08 2.29 1.04 -1.26 -0.24 113.70 119.06 1jx1 s SER 102 Ca -0.09 1.14 -0.29 0.00 0.48 0.00 0.00 55.95 57.19 1jx1 s SER 102 Cb -0.09 -1.79 -0.17 0.00 0.10 0.00 0.00 66.02 64.07 1jx1 s SER 102 CO -0.09 -3.37 1.66 1.23 0.98 0.00 0.00 173.24 173.66 1jx1 h GLY 103 N -2.05 -0.63 1.26 7.32 0.00 -0.19 -2.72 103.07 106.06 1jx1 h GLY 103 Ca -0.55 0.24 -0.02 0.00 0.00 0.00 0.00 47.33 47.00 1jx1 h GLY 103 CO 0.56 -0.23 0.34 -2.55 0.00 0.00 0.00 176.54 174.66 1jx1 h PRO 104 N -0.60 0.97 -0.46 4.80 0.11 -1.82 -1.47 132.00 133.52 1jx1 h PRO 104 Ca -0.06 -0.12 -0.01 0.00 0.11 0.00 0.00 66.00 65.92 1jx1 h PRO 104 Cb 0.47 -0.19 -0.02 0.00 0.11 0.00 0.00 31.00 31.37 1jx1 h PRO 104 CO 0.08 0.73 0.23 0.93 -0.21 0.00 0.00 178.00 179.77 1jx1 h GLU 105 N 0.97 0.65 0.33 1.05 5.08 -1.92 0.45 114.58 121.19 1jx1 h GLU 105 Ca 0.24 -0.09 -0.02 0.00 -1.00 0.00 0.00 59.36 58.50 1jx1 h GLU 105 Cb 0.07 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.21 1jx1 h GLU 105 CO -0.03 0.54 -0.16 -0.92 -1.00 0.00 0.00 179.01 177.44 1jx1 h TYR 106 N 0.60 -0.41 0.00 4.33 3.20 -1.27 -3.15 116.97 120.26 1jx1 h TYR 106 Ca 0.16 -0.01 -0.00 0.00 3.14 0.00 0.00 58.73 62.02 1jx1 h TYR 106 Cb 0.09 0.14 -0.00 0.00 1.54 0.00 0.00 36.73 38.50 1jx1 h TYR 106 CO -0.01 -0.07 -0.01 0.66 -1.64 0.00 0.00 178.16 177.08 1jx1 h SER 107 N -0.84 0.00 0.00 -2.11 4.64 -1.28 -3.27 113.55 110.69 1jx1 h SER 107 Ca -0.05 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.27 1jx1 h SER 107 Cb 0.52 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.61 1jx1 h SER 107 CO 0.07 0.01 0.00 -1.14 -0.87 0.00 0.00 176.83 174.90 1jx1 n ARG 108 N -3.29 0.00 0.01 4.77 3.00 0.15 -0.67 116.66 120.63 1jx1 n ARG 108 Ca -0.03 0.88 -0.04 0.00 -0.00 0.00 0.00 57.85 58.66 1jx1 n ARG 108 Cb 0.10 -1.42 0.17 0.00 0.00 0.00 0.00 32.46 31.31 1jx1 n ARG 108 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.63 177.41 1jx1 h LYS 109 N 0.00 0.49 -0.34 -0.14 3.64 -1.75 -2.62 116.57 115.84 1jx1 h LYS 109 Ca 0.00 -0.21 -0.00 0.00 -1.27 0.00 0.00 60.65 59.17 1jx1 h LYS 109 Cb 0.00 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 31.79 1jx1 h LYS 109 CO 0.00 0.75 0.19 0.28 -2.27 0.00 0.00 179.45 178.40 1jx1 h VAL 110 N 0.42 1.10 0.20 2.00 2.07 -1.52 -2.12 116.25 118.42 1jx1 h VAL 110 Ca 0.05 -0.25 -0.34 0.00 0.82 0.00 0.00 66.70 66.98 1jx1 h VAL 110 Cb 0.75 0.64 0.02 0.00 -1.52 0.00 0.00 31.29 31.18 1jx1 h VAL 110 CO 0.06 0.11 -1.62 0.24 0.02 0.00 0.00 177.57 176.38 1jx1 h MET 111 N 0.46 0.43 -0.67 1.57 2.86 -0.78 -3.12 114.93 115.68 1jx1 h MET 111 Ca 0.12 -0.74 0.07 0.00 -2.06 0.00 0.00 59.70 57.09 1jx1 h MET 111 Cb 0.00 0.28 -0.06 0.00 0.06 0.00 0.00 31.60 31.88 1jx1 h MET 111 CO -0.02 1.34 0.35 0.93 1.06 0.00 0.00 176.91 180.57 1jx1 h GLU 112 N 0.12 0.61 -0.20 1.72 5.08 -1.25 -0.72 114.58 119.94 1jx1 h GLU 112 Ca -0.30 -0.04 -0.06 0.00 -1.00 0.00 0.00 59.36 57.96 1jx1 h GLU 112 Cb 2.12 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 31.22 1jx1 h GLU 112 CO 0.21 0.40 -0.16 -0.91 -1.00 0.00 0.00 179.01 177.56 1jx1 h ASN 113 N 0.63 0.33 -0.18 1.42 2.35 -1.49 -1.59 115.58 117.05 1jx1 h ASN 113 Ca 0.31 -0.08 -0.17 0.00 -0.55 0.00 0.00 56.30 55.82 1jx1 h ASN 113 Cb 0.26 -0.09 -0.00 0.00 0.05 0.00 0.00 38.32 38.54 1jx1 h ASN 113 CO -0.22 0.51 -0.50 0.00 -1.65 0.00 0.00 177.43 175.57 1jx1 h VAL 115 N 0.59 1.28 0.06 0.00 2.07 -0.92 -1.97 116.25 117.36 1jx1 h VAL 115 Ca 0.02 -1.56 -0.00 0.00 0.82 0.00 0.00 66.70 65.98 1jx1 h VAL 115 Cb 1.08 1.43 0.00 0.00 -1.52 0.00 0.00 31.29 32.28 1jx1 h VAL 115 CO 0.11 0.51 -0.03 0.00 0.02 0.00 0.00 177.57 178.18 1jx1 h ALA 116 N 0.90 -0.07 0.22 1.67 0.00 -1.25 -1.31 119.26 119.42 1jx1 h ALA 116 Ca 0.06 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 1jx1 h ALA 116 Cb 0.95 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.76 1jx1 h ALA 116 CO 0.09 -0.51 -0.12 1.25 0.00 0.00 0.00 179.25 179.96 1jx1 h HIS 117 N -0.14 -0.31 -0.91 0.00 6.17 -1.42 -1.13 115.15 117.40 1jx1 h HIS 117 Ca -0.01 -0.01 0.13 0.00 0.71 0.00 0.00 60.37 61.19 1jx1 h HIS 117 Cb 0.12 0.11 -0.09 0.00 2.52 0.00 0.00 27.41 30.07 1jx1 h HIS 117 CO -0.05 -0.19 0.53 -0.07 0.71 0.00 0.00 177.93 178.86 1jx1 h LEU 118 N -0.32 0.73 0.20 0.26 3.38 -1.31 -1.59 115.31 116.67 1jx1 h LEU 118 Ca -0.03 0.06 -0.01 0.00 0.09 0.00 0.00 57.88 58.00 1jx1 h LEU 118 Cb 0.26 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 40.93 1jx1 h LEU 118 CO 0.04 0.37 -0.09 0.11 0.09 0.00 0.00 178.44 178.95 1jx1 h LYS 119 N 0.81 -0.26 0.00 1.13 1.57 -1.02 -1.10 116.57 117.71 1jx1 h LYS 119 Ca 0.47 0.02 0.00 0.00 -1.87 0.00 0.00 60.65 59.26 1jx1 h LYS 119 Cb 0.53 0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.90 1jx1 h LYS 119 CO -0.30 -0.03 0.02 0.43 -0.57 0.00 0.00 179.45 179.00 1jx1 n SER 120 N -5.12 0.00 0.00 0.86 7.64 -0.45 -1.51 113.62 115.04 1jx1 n SER 120 Ca -0.09 0.20 0.00 0.00 1.01 0.00 0.00 58.87 59.98 1jx1 n SER 120 Cb 0.19 -0.20 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 1jx1 n SER 120 CO 0.00 0.00 0.00 1.33 -3.01 0.00 0.00 175.04 173.36 1jx1 n VAL 121 N -1.17 0.00 -0.83 0.44 0.24 -0.99 -5.01 118.33 111.01 1jx1 n VAL 121 Ca 0.00 -0.45 0.00 0.00 -2.04 0.00 0.00 64.34 61.85 1jx1 n VAL 121 Cb 0.02 1.04 0.00 0.00 -1.47 0.00 0.00 33.84 33.43 1jx1 n VAL 121 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1jx1 n GLY 122 N 0.52 0.51 2.36 7.63 0.00 -0.57 -4.97 105.19 110.68 1jx1 n GLY 122 Ca 0.00 -0.66 -0.29 0.00 0.00 0.00 0.00 46.02 45.06 1jx1 n GLY 122 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1jx1 n THR 123 N -2.83 2.83 -3.76 2.61 -2.24 -0.45 -4.86 114.28 105.59 1jx1 n THR 123 Ca 0.00 -4.24 -0.28 0.00 -2.27 0.00 0.00 64.05 57.26 1jx1 n THR 123 Cb 0.00 -1.20 -0.11 0.00 -2.10 0.00 0.00 70.33 66.92 1jx1 n THR 123 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1jx1 n TYR 124 N -0.65 2.58 -2.39 4.78 9.36 -1.24 -4.77 117.16 124.84 1jx1 n TYR 124 Ca 0.47 -4.13 0.00 0.00 3.32 0.00 0.00 57.90 57.56 1jx1 n TYR 124 Cb 0.70 -0.48 0.00 0.00 -0.63 0.00 0.00 39.34 38.94 1jx1 n TYR 124 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 1jx1 n GLY 125 N 1.97 1.78 0.17 2.98 0.00 -1.26 -4.91 105.19 105.91 1jx1 n GLY 125 Ca 0.22 -2.06 0.13 0.00 0.00 0.00 0.00 46.02 44.32 1jx1 n GLY 125 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1jx1 h ASP 126 N 0.00 0.00 0.02 1.61 5.19 -1.99 -2.35 116.42 118.90 1jx1 h ASP 126 Ca 0.00 0.00 -0.00 0.00 -0.62 0.00 0.00 57.03 56.41 1jx1 h ASP 126 Cb 0.00 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.51 1jx1 h ASP 126 CO 0.00 0.00 -0.01 0.00 -3.12 0.00 0.00 179.24 176.11 1jx1 h ALA 127 N 2.22 -0.02 -0.14 3.45 0.00 -1.98 -2.38 119.26 120.41 1jx1 h ALA 127 Ca 0.00 -0.34 0.04 0.00 0.00 0.00 0.00 54.91 54.61 1jx1 h ALA 127 Cb 0.46 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 1jx1 h ALA 127 CO 0.00 -0.04 0.10 0.93 0.00 0.00 0.00 179.25 180.24 1jx1 h GLU 128 N -0.97 0.00 0.01 0.00 3.07 -1.85 0.88 114.58 115.72 1jx1 h GLU 128 Ca -0.00 0.00 -0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1jx1 h GLU 128 Cb 0.68 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.59 1jx1 h GLU 128 CO 0.00 0.00 -0.00 0.00 -1.40 0.00 0.00 179.01 177.61 1jx1 h ALA 129 N 1.93 -0.01 0.00 3.43 0.00 -1.49 -0.76 119.26 122.37 1jx1 h ALA 129 Ca 0.07 -0.30 -0.09 0.00 0.00 0.00 0.00 54.91 54.58 1jx1 h ALA 129 Cb 0.27 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 1jx1 h ALA 129 CO -0.00 -0.20 -0.44 0.93 0.00 0.00 0.00 179.25 179.54 1jx1 h GLU 130 N -0.62 0.00 -0.51 0.00 5.08 -0.86 -1.10 114.58 116.57 1jx1 h GLU 130 Ca -0.00 0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 58.29 1jx1 h GLU 130 Cb 0.60 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.83 1jx1 h GLU 130 CO 0.00 0.44 0.06 0.00 -1.00 0.00 0.00 179.01 178.51 1jx1 h ALA 131 N 1.56 0.69 0.00 3.43 0.00 0.81 -1.01 119.26 124.74 1jx1 h ALA 131 Ca -0.00 -0.26 -0.08 0.00 0.00 0.00 0.00 54.91 54.57 1jx1 h ALA 131 Cb 0.89 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 1jx1 h ALA 131 CO 0.06 0.45 -0.39 0.52 0.00 0.00 0.00 179.25 179.89 1jx1 h MET 132 N 0.75 0.00 -0.16 0.00 2.86 -0.57 -0.68 114.93 117.12 1jx1 h MET 132 Ca 0.15 0.00 -0.18 0.00 -2.06 0.00 0.00 59.70 57.62 1jx1 h MET 132 Cb 0.44 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.10 1jx1 h MET 132 CO 0.02 0.39 -0.63 0.37 1.06 0.00 0.00 176.91 178.11 1jx1 h GLN 133 N 0.00 0.57 0.00 1.72 5.75 -0.75 -1.54 115.11 120.87 1jx1 h GLN 133 Ca -0.00 -0.40 -0.09 0.00 -0.15 0.00 0.00 58.65 58.01 1jx1 h GLN 133 Cb 0.78 0.06 -0.01 0.00 1.07 0.00 0.00 27.48 29.38 1jx1 h GLN 133 CO 0.05 1.02 -0.42 -0.22 -2.65 0.00 0.00 178.83 176.61 1jx1 h LYS 134 N 0.42 0.00 0.39 1.69 3.64 -0.83 -1.75 116.57 120.12 1jx1 h LYS 134 Ca -0.01 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.35 1jx1 h LYS 134 Cb 1.20 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.02 1jx1 h LYS 134 CO 0.12 0.42 -0.19 0.35 -2.27 0.00 0.00 179.45 177.88 1jx1 h PHE 135 N 0.00 -0.48 0.00 1.91 3.57 -0.75 -3.02 116.94 118.16 1jx1 h PHE 135 Ca -0.00 -0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.48 1jx1 h PHE 135 Cb 0.86 0.16 -0.00 0.00 2.79 0.00 0.00 35.95 39.76 1jx1 h PHE 135 CO 0.00 -0.16 -0.04 0.00 -2.23 0.00 0.00 178.31 175.87 1jx1 h ALA 136 N -0.38 1.88 0.00 2.41 0.00 -1.16 -1.86 119.26 120.15 1jx1 h ALA 136 Ca -0.05 -0.04 -0.10 0.00 0.00 0.00 0.00 54.91 54.72 1jx1 h ALA 136 Cb 0.54 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 1jx1 h ALA 136 CO 0.09 0.05 -0.46 1.49 0.00 0.00 0.00 179.25 180.42 1jx1 h GLU 137 N 0.00 0.00 -0.08 0.00 4.57 -1.31 -2.79 114.58 114.97 1jx1 h GLU 137 Ca -0.00 0.00 -0.10 0.00 -1.18 0.00 0.00 59.36 58.08 1jx1 h GLU 137 Cb 0.08 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.65 1jx1 h GLU 137 CO 0.01 0.46 -0.42 0.00 -1.18 0.00 0.00 179.01 177.87 1jx1 h ALA 138 N 1.54 1.15 0.00 2.92 0.00 -1.20 -3.14 119.26 120.52 1jx1 h ALA 138 Ca -0.00 -0.41 0.00 0.00 0.00 0.00 0.00 54.91 54.49 1jx1 h ALA 138 Cb 0.92 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.62 1jx1 h ALA 138 CO 0.06 0.58 -0.57 1.19 0.00 0.00 0.00 179.25 180.51 1jx1 n PHE 139 N -4.02 0.44 -0.16 0.00 3.01 -1.09 -4.43 117.46 111.22 1jx1 n PHE 139 Ca -0.02 0.13 -0.09 0.00 1.01 0.00 0.00 57.45 58.48 1jx1 n PHE 139 Cb 0.48 -0.58 0.00 0.00 -0.01 0.00 0.00 39.48 39.37 1jx1 n PHE 139 CO 0.00 0.00 0.00 0.87 1.01 0.00 0.00 176.76 178.64 1jx1 h LYS 140 N 0.00 0.69 -0.83 -1.08 1.57 -1.45 -3.09 116.57 112.39 1jx1 h LYS 140 Ca 0.00 -0.14 -0.02 0.00 -1.87 0.00 0.00 60.65 58.61 1jx1 h LYS 140 Cb 0.69 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.88 1jx1 h LYS 140 CO 0.00 0.66 0.03 -0.35 -0.57 0.00 0.00 179.45 179.22 1jx1 n PRO 141 N -4.56 2.66 -4.91 3.15 -0.04 -1.26 -4.73 135.00 125.31 1jx1 n PRO 141 Ca 0.01 -1.43 -0.29 0.00 -0.04 0.00 0.00 63.50 61.75 1jx1 n PRO 141 Cb 0.17 -1.82 -0.15 0.00 -0.04 0.00 0.00 33.50 31.67 1jx1 n PRO 141 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1jx1 s VAL 142 N -1.77 1.94 -0.04 0.52 1.01 -1.17 -5.05 120.40 115.84 1jx1 s VAL 142 Ca 0.25 -1.24 0.06 0.00 0.00 0.00 0.00 61.98 61.05 1jx1 s VAL 142 Cb 0.19 -1.66 -0.01 0.00 0.00 0.00 0.00 36.38 34.91 1jx1 s VAL 142 CO 0.07 0.37 -0.22 0.21 0.00 0.00 0.00 175.10 175.53 1jx1 s ASN 143 N -1.04 2.66 -0.81 3.32 2.47 -1.26 0.33 114.94 120.60 1jx1 s ASN 143 Ca 0.10 -0.43 -0.05 0.00 0.42 0.00 0.00 52.86 52.90 1jx1 s ASN 143 Cb -0.09 -0.54 0.21 0.00 -1.45 0.00 0.00 41.25 39.37 1jx1 s ASN 143 CO 0.01 0.24 0.69 -0.36 -3.72 0.00 0.00 177.10 173.96 1jx1 s PHE 144 N -0.27 3.73 0.65 0.43 0.40 0.67 -4.93 117.98 118.66 1jx1 s PHE 144 Ca 0.02 -2.68 -0.16 0.00 -0.60 0.00 0.00 56.93 53.51 1jx1 s PHE 144 Cb -0.11 -3.40 -0.00 0.00 0.51 0.00 0.00 43.02 40.01 1jx1 s PHE 144 CO 0.01 -0.85 1.15 -2.14 0.70 0.00 0.00 175.22 174.10 1jx1 s PRO 145 N -0.58 2.73 0.07 0.24 0.02 -1.26 -1.59 135.00 134.63 1jx1 s PRO 145 Ca 0.22 1.59 -0.37 0.00 0.02 0.00 0.00 61.00 62.46 1jx1 s PRO 145 Cb -0.13 -1.92 -0.18 0.00 0.02 0.00 0.00 34.50 32.29 1jx1 s PRO 145 CO -0.08 -1.34 1.13 -2.30 -0.33 0.00 0.00 177.00 174.08 1jx1 n PRO 146 N -2.20 0.56 0.00 5.54 -0.02 -1.26 -0.69 135.00 136.92 1jx1 n PRO 146 Ca 0.12 0.20 0.00 0.00 -2.02 0.00 0.00 63.50 61.80 1jx1 n PRO 146 Cb 0.51 -1.71 0.00 0.00 -0.02 0.00 0.00 33.50 32.28 1jx1 n PRO 146 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1jx1 n GLY 147 N 1.95 2.86 3.76 -1.23 0.00 0.19 -4.96 105.19 107.76 1jx1 n GLY 147 Ca 0.19 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.90 1jx1 n GLY 147 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1jx1 s ALA 148 N -2.54 2.18 0.19 4.61 0.00 0.14 -3.61 121.76 122.73 1jx1 s ALA 148 Ca 0.00 0.29 0.01 0.00 0.00 0.00 0.00 51.96 52.26 1jx1 s ALA 148 Cb 0.00 -3.29 -0.05 0.00 0.00 0.00 0.00 23.12 19.79 1jx1 s ALA 148 CO 0.00 -1.86 0.03 -1.12 0.00 0.00 0.00 175.76 172.81 1jx1 s SER 149 N -3.33 1.13 -0.07 0.00 0.01 0.38 -0.38 113.70 111.43 1jx1 s SER 149 Ca 0.62 -1.24 0.02 0.00 1.31 0.00 0.00 55.95 56.66 1jx1 s SER 149 Cb -0.18 0.15 0.01 0.00 0.21 0.00 0.00 66.02 66.21 1jx1 s SER 149 CO 0.56 -0.63 -0.13 0.54 0.41 0.00 0.00 173.24 173.99 1jx1 s VAL 150 N -3.72 1.26 -0.18 3.43 0.11 0.40 -1.88 120.40 119.83 1jx1 s VAL 150 Ca 0.28 -0.54 -0.02 0.00 -2.93 0.00 0.00 61.98 58.77 1jx1 s VAL 150 Cb 0.07 -1.14 -0.01 0.00 -1.53 0.00 0.00 36.38 33.76 1jx1 s VAL 150 CO 0.07 0.38 -0.10 -0.36 -3.33 0.00 0.00 175.10 171.76 1jx1 s PHE 151 N 0.70 2.88 -0.57 1.54 0.08 0.76 -0.62 117.98 122.75 1jx1 s PHE 151 Ca -0.14 -0.88 -0.04 0.00 0.12 0.00 0.00 56.93 55.99 1jx1 s PHE 151 Cb -0.16 -1.97 0.15 0.00 -0.57 0.00 0.00 43.02 40.47 1jx1 s PHE 151 CO 0.03 -0.43 0.39 0.71 -0.10 0.00 0.00 175.22 175.82 1jx1 s TYR 152 N 0.96 3.47 -0.43 0.36 1.51 0.56 -1.71 117.35 122.07 1jx1 s TYR 152 Ca -0.01 -2.55 -0.27 0.00 -1.01 0.00 0.00 57.07 53.23 1jx1 s TYR 152 Cb -0.15 -3.26 0.02 0.00 -0.11 0.00 0.00 41.96 38.47 1jx1 s TYR 152 CO -0.01 -0.89 1.00 0.50 -1.11 0.00 0.00 175.55 175.04 1jx1 s ARG 153 N 0.36 3.71 -0.47 -0.62 3.52 -0.46 -1.25 118.95 123.74 1jx1 s ARG 153 Ca 0.14 0.47 -0.21 0.00 -0.13 0.00 0.00 55.73 55.99 1jx1 s ARG 153 Cb -0.21 -3.87 0.03 0.00 -1.56 0.00 0.00 34.95 29.34 1jx1 s ARG 153 CO -0.04 -1.18 0.70 -1.14 -0.81 0.00 0.00 175.30 172.83 1jx1 s GLN 154 N 3.89 3.27 0.11 5.12 0.74 0.15 -1.38 119.66 131.57 1jx1 s GLN 154 Ca 0.41 -0.43 -0.24 0.00 0.05 0.00 0.00 55.36 55.15 1jx1 s GLN 154 Cb -0.10 -3.99 -0.07 0.00 1.10 0.00 0.00 33.01 29.95 1jx1 s GLN 154 CO 0.25 -1.13 0.75 0.45 -0.55 0.00 0.00 175.29 175.06 1jx1 s SER 155 N 2.26 7.28 0.00 6.67 0.15 0.19 -2.30 113.70 127.95 1jx1 s SER 155 Ca 0.23 1.52 0.18 0.00 0.70 0.00 0.00 55.95 58.59 1jx1 s SER 155 Cb -0.15 -2.47 1.03 0.00 -1.71 0.00 0.00 66.02 62.72 1jx1 s SER 155 CO 0.18 0.14 1.53 -0.81 1.20 0.00 0.00 173.24 175.48 1jx1 n PRO 156 N 2.10 0.44 -1.22 5.44 -0.04 -1.26 -2.56 135.00 137.90 1jx1 n PRO 156 Ca -0.05 0.05 -0.26 0.00 -0.04 0.00 0.00 63.50 63.20 1jx1 n PRO 156 Cb 0.49 -1.50 0.15 0.00 -0.04 0.00 0.00 33.50 32.60 1jx1 n PRO 156 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1jx1 n ASP 157 N -1.12 4.82 -3.57 3.54 8.00 -1.26 -4.92 116.55 122.04 1jx1 n ASP 157 Ca 0.12 -3.60 -0.20 0.00 0.71 0.00 0.00 54.79 51.82 1jx1 n ASP 157 Cb 0.10 -0.87 0.06 0.00 -0.02 0.00 0.00 41.12 40.38 1jx1 n ASP 157 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1jx1 n GLY 158 N -1.01 -0.43 3.00 0.44 0.00 -1.06 -4.95 105.19 101.18 1jx1 n GLY 158 Ca 0.59 0.17 -0.13 0.00 0.00 0.00 0.00 46.02 46.65 1jx1 n GLY 158 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1jx1 s ILE 159 N -3.53 -0.03 -0.21 -0.61 1.01 -1.24 -3.15 121.20 113.45 1jx1 s ILE 159 Ca 0.06 0.11 -0.02 0.00 0.00 0.00 0.00 60.65 60.81 1jx1 s ILE 159 Cb -0.01 -0.27 0.01 0.00 0.01 0.00 0.00 42.46 42.19 1jx1 s ILE 159 CO 0.78 0.04 -0.11 -0.22 0.00 0.00 0.00 174.94 175.43 1jx1 s LEU 160 N 0.82 2.61 -0.20 2.97 2.96 -0.21 -0.64 118.68 126.98 1jx1 s LEU 160 Ca -0.06 -0.56 -0.07 0.00 -0.22 0.00 0.00 54.13 53.22 1jx1 s LEU 160 Cb -0.08 -1.62 -0.04 0.00 0.50 0.00 0.00 46.19 44.95 1jx1 s LEU 160 CO -0.04 -0.02 0.07 -0.83 -1.32 0.00 0.00 176.35 174.20 1jx1 s GLY 161 N 1.38 1.88 -0.19 7.98 0.00 -0.48 0.03 107.32 117.93 1jx1 s GLY 161 Ca 0.05 -0.82 -0.07 0.00 0.00 0.00 0.00 44.72 43.88 1jx1 s GLY 161 CO -0.08 0.15 0.05 1.08 0.00 0.00 0.00 173.10 174.31 1jx1 s LEU 162 N 0.62 3.70 0.03 0.66 1.43 0.13 -1.36 118.68 123.89 1jx1 s LEU 162 Ca 0.03 0.02 0.04 0.00 -1.03 0.00 0.00 54.13 53.18 1jx1 s LEU 162 Cb -0.13 -1.94 -0.02 0.00 0.03 0.00 0.00 46.19 44.13 1jx1 s LEU 162 CO 0.01 0.14 -0.11 -0.44 0.23 0.00 0.00 176.35 176.19 1jx1 s SER 163 N 0.55 1.25 -0.05 2.29 0.01 -0.70 0.92 113.70 117.98 1jx1 s SER 163 Ca 0.02 -0.43 0.03 0.00 1.31 0.00 0.00 55.95 56.89 1jx1 s SER 163 Cb -0.13 -0.06 0.00 0.00 0.21 0.00 0.00 66.02 66.05 1jx1 s SER 163 CO 0.01 -0.03 -0.14 -0.36 0.41 0.00 0.00 173.24 173.13 1jx1 s PHE 164 N -0.89 1.47 0.03 2.43 0.40 -1.26 -0.17 117.98 119.99 1jx1 s PHE 164 Ca -0.02 -0.46 0.05 0.00 -0.60 0.00 0.00 56.93 55.91 1jx1 s PHE 164 Cb -0.08 -1.03 -0.02 0.00 0.51 0.00 0.00 43.02 42.40 1jx1 s PHE 164 CO 0.01 -0.19 -0.16 0.45 0.70 0.00 0.00 175.22 176.03 1jx1 s SER 165 N 0.28 1.88 0.42 1.36 0.15 -0.78 -4.86 113.70 112.15 1jx1 s SER 165 Ca -0.07 -0.43 0.21 0.00 0.70 0.00 0.00 55.95 56.35 1jx1 s SER 165 Cb -0.12 -0.15 0.92 0.00 -1.71 0.00 0.00 66.02 64.96 1jx1 s SER 165 CO 0.02 0.10 1.85 -0.65 1.20 0.00 0.00 173.24 175.76 1jx1 h PRO 166 N 5.11 0.00 0.00 5.44 0.11 -1.91 0.11 132.00 140.86 1jx1 h PRO 166 Ca -0.38 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.73 1jx1 h PRO 166 Cb 1.17 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.28 1jx1 h PRO 166 CO 0.45 0.29 0.00 -0.40 -0.21 0.00 0.00 178.00 178.13 1jx1 n ASP 167 N -3.64 0.00 -1.20 -2.05 5.68 -1.26 -2.77 116.55 111.31 1jx1 n ASP 167 Ca -0.01 0.00 0.08 0.00 -0.50 0.00 0.00 54.79 54.36 1jx1 n ASP 167 Cb 0.41 0.00 0.30 0.00 -1.14 0.00 0.00 41.12 40.69 1jx1 n ASP 167 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 1jx1 n THR 168 N 0.00 2.31 -3.83 2.12 -2.24 -1.24 -2.27 114.28 109.13 1jx1 n THR 168 Ca 0.00 -1.65 -0.37 0.00 -2.27 0.00 0.00 64.05 59.76 1jx1 n THR 168 Cb 0.00 -0.18 -0.06 0.00 -2.10 0.00 0.00 70.33 67.98 1jx1 n THR 168 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1jx1 s SER 169 N -1.49 6.40 -0.09 3.42 1.04 -1.26 -5.04 113.70 116.68 1jx1 s SER 169 Ca 0.45 0.48 -0.29 0.00 0.48 0.00 0.00 55.95 57.07 1jx1 s SER 169 Cb 0.35 -2.09 -0.07 0.00 0.10 0.00 0.00 66.02 64.31 1jx1 s SER 169 CO 0.12 0.38 2.04 -0.63 0.98 0.00 0.00 173.24 176.13 1jx1 s ILE 170 N -0.87 3.07 0.50 -1.02 1.01 -1.26 -4.82 121.20 117.81 1jx1 s ILE 170 Ca 0.15 0.08 -0.22 0.00 0.00 0.00 0.00 60.65 60.65 1jx1 s ILE 170 Cb -0.12 -3.07 -0.07 0.00 0.01 0.00 0.00 42.46 39.21 1jx1 s ILE 170 CO 0.04 -0.03 1.20 -2.65 0.00 0.00 0.00 174.94 173.51 1jx1 n PRO 171 N 8.05 1.55 0.23 2.79 -0.02 -1.26 -4.81 135.00 141.54 1jx1 n PRO 171 Ca 0.24 0.57 0.11 0.00 -2.02 0.00 0.00 63.50 62.40 1jx1 n PRO 171 Cb 0.43 -2.36 0.54 0.00 -0.02 0.00 0.00 33.50 32.08 1jx1 n PRO 171 CO 0.00 0.00 0.00 1.05 1.98 0.00 0.00 175.50 178.53 1jx1 h GLU 172 N 1.45 0.00 -5.56 -0.52 4.11 -1.96 -3.42 114.58 108.68 1jx1 h GLU 172 Ca -0.49 0.00 -0.45 0.00 0.07 0.00 0.00 59.36 58.50 1jx1 h GLU 172 Cb 1.32 0.00 -0.15 0.00 0.50 0.00 0.00 28.75 30.42 1jx1 h GLU 172 CO 0.57 0.19 -0.74 0.15 0.07 0.00 0.00 179.01 179.24 1jx1 s LYS 173 N -3.76 1.28 0.14 1.06 1.02 -1.26 -4.16 119.74 114.06 1jx1 s LYS 173 Ca -0.00 -1.53 0.03 0.00 0.02 0.00 0.00 55.97 54.49 1jx1 s LYS 173 Cb 0.11 -1.09 -0.04 0.00 -0.52 0.00 0.00 37.83 36.29 1jx1 s LYS 173 CO 0.62 0.19 0.21 -1.21 -0.92 0.00 0.00 175.35 174.23 1jx1 s GLU 174 N -3.47 3.21 -0.07 1.68 2.02 -1.26 -4.79 118.70 116.02 1jx1 s GLU 174 Ca 0.20 -0.69 -0.10 0.00 0.02 0.00 0.00 54.97 54.40 1jx1 s GLU 174 Cb -0.01 -2.84 -0.30 0.00 0.10 0.00 0.00 34.13 31.08 1jx1 s GLU 174 CO 0.06 0.52 0.59 0.00 0.02 0.00 0.00 175.26 176.45 1jx1 h ALA 175 N 2.40 0.22 -2.39 5.21 0.00 0.16 -3.49 119.26 121.37 1jx1 h ALA 175 Ca -0.48 -1.20 -0.10 0.00 0.00 0.00 0.00 54.91 53.13 1jx1 h ALA 175 Cb 1.19 0.52 -0.20 0.00 0.00 0.00 0.00 17.79 19.30 1jx1 h ALA 175 CO 0.67 1.09 -0.16 0.00 0.00 0.00 0.00 179.25 180.85 1jx1 s ALA 176 N -2.57 -1.04 -0.31 0.00 0.00 -1.04 -5.00 121.76 111.80 1jx1 s ALA 176 Ca -0.18 0.60 0.03 0.00 0.00 0.00 0.00 51.96 52.41 1jx1 s ALA 176 Cb 0.06 0.03 0.09 0.00 0.00 0.00 0.00 23.12 23.30 1jx1 s ALA 176 CO 0.83 -0.29 0.01 -0.51 0.00 0.00 0.00 175.76 175.80 1jx1 s LEU 177 N -1.24 4.09 -0.33 0.00 1.43 -1.26 0.19 118.68 121.56 1jx1 s LEU 177 Ca -0.13 -1.86 -0.28 0.00 -1.03 0.00 0.00 54.13 50.83 1jx1 s LEU 177 Cb -0.04 -1.52 0.02 0.00 0.03 0.00 0.00 46.19 44.68 1jx1 s LEU 177 CO 0.06 -0.32 1.04 -0.63 0.23 0.00 0.00 176.35 176.72 1jx1 s ILE 178 N 1.04 4.52 -1.03 -0.59 -1.09 0.10 -4.89 121.20 119.27 1jx1 s ILE 178 Ca 0.05 1.62 -0.12 0.00 -2.23 0.00 0.00 60.65 59.96 1jx1 s ILE 178 Cb -0.19 -4.40 0.23 0.00 -1.58 0.00 0.00 42.46 36.52 1jx1 s ILE 178 CO -0.08 -0.50 1.07 -1.61 -1.23 0.00 0.00 174.94 172.59 1jx1 s GLU 179 N 3.63 3.94 -0.18 2.79 2.02 -1.26 -1.05 118.70 128.59 1jx1 s GLU 179 Ca 0.44 -2.73 -0.09 0.00 0.02 0.00 0.00 54.97 52.61 1jx1 s GLU 179 Cb -0.12 -4.65 0.06 0.00 0.10 0.00 0.00 34.13 29.52 1jx1 s GLU 179 CO 0.16 -1.41 0.43 1.21 0.02 0.00 0.00 175.26 175.67 1jx1 s ASN 180 N 2.09 -0.50 -0.01 -0.19 3.84 -1.19 -5.03 114.94 113.96 1jx1 s ASN 180 Ca 0.29 0.94 -0.25 0.00 0.21 0.00 0.00 52.86 54.05 1jx1 s ASN 180 Cb -0.08 0.88 -0.19 0.00 -0.55 0.00 0.00 41.25 41.31 1jx1 s ASN 180 CO -0.07 -0.20 1.31 0.50 -2.79 0.00 0.00 177.10 175.85 1jx1 h LYS 181 N 7.27 -0.02 -0.78 0.43 1.63 -1.91 -2.03 116.57 121.14 1jx1 h LYS 181 Ca -0.33 0.00 -0.04 0.00 -0.85 0.00 0.00 60.65 59.43 1jx1 h LYS 181 Cb 1.18 0.01 -0.04 0.00 -0.60 0.00 0.00 32.23 32.78 1jx1 h LYS 181 CO 0.26 0.40 0.33 0.00 -3.45 0.00 0.00 179.45 177.00 1jx1 h ALA 182 N 0.51 1.11 -0.00 5.00 0.00 -1.93 -2.92 119.26 121.03 1jx1 h ALA 182 Ca -0.00 -0.18 -0.19 0.00 0.00 0.00 0.00 54.91 54.53 1jx1 h ALA 182 Cb 0.44 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 1jx1 h ALA 182 CO 0.00 0.65 -0.86 0.28 0.00 0.00 0.00 179.25 179.32 1jx1 h VAL 183 N 1.13 1.49 -0.35 0.00 2.07 -1.92 -2.86 116.25 115.82 1jx1 h VAL 183 Ca 0.26 -2.59 0.10 0.00 0.82 0.00 0.00 66.70 65.29 1jx1 h VAL 183 Cb 0.18 2.44 -0.01 0.00 -1.52 0.00 0.00 31.29 32.38 1jx1 h VAL 183 CO -0.03 0.75 0.28 0.77 0.02 0.00 0.00 177.57 179.37 1jx1 h SER 184 N 0.11 0.00 -0.00 0.57 4.64 -1.16 -1.15 113.55 116.55 1jx1 h SER 184 Ca -0.04 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.28 1jx1 h SER 184 Cb 1.48 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.57 1jx1 h SER 184 CO 0.13 0.00 -0.58 -1.54 -0.87 0.00 0.00 176.83 173.97 1jx1 n SER 185 N -4.20 1.05 -0.33 4.97 3.41 -1.22 -4.61 113.62 112.68 1jx1 n SER 185 Ca 0.05 -1.02 0.01 0.00 -0.26 0.00 0.00 58.87 57.65 1jx1 n SER 185 Cb 0.45 0.81 0.18 0.00 -0.26 0.00 0.00 64.21 65.39 1jx1 n SER 185 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1jx1 h ALA 186 N 2.40 1.40 0.78 7.33 0.00 -0.96 -1.39 119.26 128.82 1jx1 h ALA 186 Ca 0.00 -0.05 -0.04 0.00 0.00 0.00 0.00 54.91 54.83 1jx1 h ALA 186 Cb 0.43 -0.33 0.01 0.00 0.00 0.00 0.00 17.79 17.89 1jx1 h ALA 186 CO 0.00 0.51 -0.38 0.28 0.00 0.00 0.00 179.25 179.66 1jx1 h VAL 187 N 1.18 0.22 0.00 0.00 2.07 -1.82 -1.56 116.25 116.35 1jx1 h VAL 187 Ca 0.37 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.88 1jx1 h VAL 187 Cb 0.01 0.22 -0.00 0.00 -1.52 0.00 0.00 31.29 30.00 1jx1 h VAL 187 CO -0.11 0.00 -0.05 0.25 0.02 0.00 0.00 177.57 177.67 1jx1 h LEU 188 N -1.06 0.00 -0.31 2.57 5.85 -1.85 -2.54 115.31 117.96 1jx1 h LEU 188 Ca -0.11 0.00 -0.10 0.00 0.84 0.00 0.00 57.88 58.52 1jx1 h LEU 188 Cb 0.82 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.84 1jx1 h LEU 188 CO 0.17 0.05 -0.18 -0.08 -0.34 0.00 0.00 178.44 178.06 1jx1 h GLU 189 N 0.00 0.68 0.00 1.25 4.57 -0.84 -0.96 114.58 119.28 1jx1 h GLU 189 Ca -0.00 -0.31 0.00 0.00 -1.18 0.00 0.00 59.36 57.87 1jx1 h GLU 189 Cb 0.12 -0.01 0.00 0.00 -0.16 0.00 0.00 28.75 28.70 1jx1 h GLU 189 CO 0.01 0.91 0.00 0.25 -1.18 0.00 0.00 179.01 178.99 1jx1 n THR 190 N -4.35 0.36 -0.08 0.32 -2.24 -0.62 -0.80 114.28 106.86 1jx1 n THR 190 Ca -0.03 0.09 -0.09 0.00 -2.27 0.00 0.00 64.05 61.75 1jx1 n THR 190 Cb 0.40 -0.70 -0.03 0.00 -2.10 0.00 0.00 70.33 67.90 1jx1 n THR 190 CO 0.00 0.00 0.00 0.23 -0.57 0.00 0.00 175.07 174.73 1jx1 n MET 191 N -1.40 0.50 -0.19 -0.78 2.81 -1.01 -4.56 117.12 112.49 1jx1 n MET 191 Ca 0.08 0.38 0.09 0.00 -1.81 0.00 0.00 57.70 56.44 1jx1 n MET 191 Cb 0.23 -1.58 0.17 0.00 -0.71 0.00 0.00 33.22 31.33 1jx1 n MET 191 CO 0.00 0.00 0.00 0.44 1.51 0.00 0.00 175.97 177.92 1jx1 n ILE 192 N -4.52 1.93 -2.03 2.02 -5.35 -0.40 -4.78 119.36 106.23 1jx1 n ILE 192 Ca -0.14 -2.01 -0.29 0.00 -0.27 0.00 0.00 62.75 60.05 1jx1 n ILE 192 Cb 0.42 -0.17 0.16 0.00 -1.74 0.00 0.00 39.64 38.31 1jx1 n ILE 192 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 1jx1 s GLY 193 N -2.37 1.75 0.44 3.28 0.00 0.02 -4.92 107.32 105.51 1jx1 s GLY 193 Ca 0.33 -1.19 0.15 0.00 0.00 0.00 0.00 44.72 44.01 1jx1 s GLY 193 CO 0.05 -0.50 1.95 -2.09 0.00 0.00 0.00 173.10 172.52 1jx1 h GLU 194 N -1.38 0.38 -1.63 2.90 4.81 -1.95 -2.81 114.58 114.90 1jx1 h GLU 194 Ca -0.44 -0.02 -0.67 0.00 -0.13 0.00 0.00 59.36 58.10 1jx1 h GLU 194 Cb 1.25 -0.09 -0.34 0.00 0.63 0.00 0.00 28.75 30.21 1jx1 h GLU 194 CO 0.43 0.25 0.20 0.72 -0.73 0.00 0.00 179.01 179.88 1jx1 n HIS 195 N -4.47 3.16 -4.10 0.92 8.25 -1.26 -5.00 115.22 112.71 1jx1 n HIS 195 Ca 0.12 -2.69 -0.34 0.00 -0.26 0.00 0.00 57.72 54.55 1jx1 n HIS 195 Cb 0.46 -0.71 -0.07 0.00 1.12 0.00 0.00 29.99 30.78 1jx1 n HIS 195 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1jx1 s ALA 196 N -3.81 3.60 0.00 -1.41 0.00 -1.06 -4.93 121.76 114.14 1jx1 s ALA 196 Ca 0.51 -0.82 0.00 0.00 0.00 0.00 0.00 51.96 51.66 1jx1 s ALA 196 Cb 0.43 -1.64 0.00 0.00 0.00 0.00 0.00 23.12 21.91 1jx1 s ALA 196 CO -0.26 0.67 0.76 0.28 0.00 0.00 0.00 175.76 177.21 1jx1 n VAL 197 N 1.45 0.00 -3.60 0.00 0.31 -1.26 -4.67 118.33 110.56 1jx1 n VAL 197 Ca -0.15 1.26 -0.41 0.00 -0.01 0.00 0.00 64.34 65.04 1jx1 n VAL 197 Cb 0.53 -2.25 -0.11 0.00 -0.91 0.00 0.00 33.84 31.10 1jx1 n VAL 197 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 1jx1 s SER 198 N -2.03 5.72 -1.21 4.52 1.04 -1.26 -5.01 113.70 115.48 1jx1 s SER 198 Ca 0.00 -1.08 -0.13 0.00 0.48 0.00 0.00 55.95 55.22 1jx1 s SER 198 Cb 0.00 -2.02 -0.06 0.00 0.10 0.00 0.00 66.02 64.04 1jx1 s SER 198 CO 0.00 -0.41 2.32 -2.65 0.98 0.00 0.00 173.24 173.48 1jx1 n PRO 199 N 4.99 2.58 0.00 4.02 -0.02 -1.26 -4.24 135.00 141.07 1jx1 n PRO 199 Ca -0.12 -2.04 -0.13 0.00 -2.02 0.00 0.00 63.50 59.20 1jx1 n PRO 199 Cb 0.45 -2.87 -0.14 0.00 -0.02 0.00 0.00 33.50 30.93 1jx1 n PRO 199 CO 0.00 0.00 0.00 0.38 1.98 0.00 0.00 175.50 177.86 1jx1 h ASP 200 N 6.24 0.17 1.13 2.55 2.03 -1.95 -2.67 116.42 123.94 1jx1 h ASP 200 Ca 0.60 -0.34 -0.14 0.00 -0.73 0.00 0.00 57.03 56.41 1jx1 h ASP 200 Cb 0.43 -0.06 -0.02 0.00 -0.83 0.00 0.00 39.33 38.85 1jx1 h ASP 200 CO 1.77 1.30 -0.69 -0.07 -1.03 0.00 0.00 179.24 180.52 1jx1 h LEU 201 N 0.03 0.00 -0.11 0.15 3.38 -1.92 -2.31 115.31 114.53 1jx1 h LEU 201 Ca -0.30 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.52 1jx1 h LEU 201 Cb 2.01 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.74 1jx1 h LEU 201 CO 0.10 0.69 -0.71 0.11 0.09 0.00 0.00 178.44 178.71 1jx1 h LYS 202 N 0.00 0.00 0.02 1.13 1.57 -1.86 -2.26 116.57 115.18 1jx1 h LYS 202 Ca -0.01 0.00 -0.22 0.00 -1.87 0.00 0.00 60.65 58.56 1jx1 h LYS 202 Cb 1.44 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.73 1jx1 h LYS 202 CO 0.09 0.71 -1.01 0.00 -0.57 0.00 0.00 179.45 178.67 1jx1 h ARG 203 N 0.00 0.07 -0.15 3.15 3.08 -1.43 -2.16 114.38 116.93 1jx1 h ARG 203 Ca -0.01 -0.10 -0.06 0.00 0.07 0.00 0.00 59.98 59.88 1jx1 h ARG 203 Cb 1.50 0.04 -0.00 0.00 0.08 0.00 0.00 29.97 31.58 1jx1 h ARG 203 CO 0.09 1.01 -0.16 0.00 -1.07 0.00 0.00 179.97 179.85 1jx1 h LEU 205 N -0.00 0.08 -2.18 0.00 3.38 -1.13 0.58 115.31 116.04 1jx1 h LEU 205 Ca 0.02 -0.06 -0.01 0.00 0.09 0.00 0.00 57.88 57.92 1jx1 h LEU 205 Cb 0.70 -0.02 -0.00 0.00 0.09 0.00 0.00 40.66 41.43 1jx1 h LEU 205 CO 0.04 0.12 -0.06 0.00 0.09 0.00 0.00 178.44 178.62 1jx1 h ALA 206 N 0.97 1.32 0.10 1.53 0.00 -1.40 -0.35 119.26 121.44 1jx1 h ALA 206 Ca 0.02 -0.06 -0.36 0.00 0.00 0.00 0.00 54.91 54.51 1jx1 h ALA 206 Cb 0.05 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 1jx1 h ALA 206 CO -0.00 0.08 -2.01 0.00 0.00 0.00 0.00 179.25 177.31 1jx1 n ALA 207 N -2.27 0.94 0.09 0.00 0.00 -0.36 -4.21 120.51 114.69 1jx1 n ALA 207 Ca -0.02 -0.64 -0.11 0.00 0.00 0.00 0.00 53.44 52.66 1jx1 n ALA 207 Cb 0.17 -0.61 -0.10 0.00 0.00 0.00 0.00 19.45 18.91 1jx1 n ALA 207 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1jx1 h ARG 208 N -0.01 0.17 -0.19 0.00 3.08 0.35 -3.39 114.38 114.39 1jx1 h ARG 208 Ca -0.44 -0.26 -0.16 0.00 0.07 0.00 0.00 59.98 59.19 1jx1 h ARG 208 Cb 1.97 0.09 -0.01 0.00 0.08 0.00 0.00 29.97 32.11 1jx1 h ARG 208 CO 0.05 1.09 -0.55 -0.07 -1.07 0.00 0.00 179.97 179.42 1jx1 h LEU 209 N 0.06 0.62 -0.75 3.04 -0.00 -1.27 -3.33 115.31 113.69 1jx1 h LEU 209 Ca -0.07 -0.33 0.13 0.00 -0.00 0.00 0.00 57.88 57.61 1jx1 h LEU 209 Cb 1.80 -0.18 -0.09 0.00 -0.00 0.00 0.00 40.66 42.19 1jx1 h LEU 209 CO 0.16 1.04 0.32 -0.65 -0.00 0.00 0.00 178.44 179.32 1jx1 h PRO 210 N 0.43 0.48 -0.56 1.13 0.11 -1.79 -0.10 132.00 131.70 1jx1 h PRO 210 Ca 0.01 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.09 1jx1 h PRO 210 Cb 1.09 -0.11 -0.03 0.00 0.11 0.00 0.00 31.00 32.06 1jx1 h PRO 210 CO 0.10 0.32 0.35 0.00 -0.21 0.00 0.00 178.00 178.57 1jx1 h ALA 211 N 1.52 1.57 0.15 -0.75 0.00 -1.83 -2.28 119.26 117.64 1jx1 h ALA 211 Ca 0.40 -0.05 -0.30 0.00 0.00 0.00 0.00 54.91 54.96 1jx1 h ALA 211 Cb 0.56 -0.23 0.02 0.00 0.00 0.00 0.00 17.79 18.15 1jx1 h ALA 211 CO -0.36 0.39 -1.28 -0.07 0.00 0.00 0.00 179.25 177.92 1jx1 h LEU 212 N 0.76 0.75 -0.60 0.00 3.38 -1.46 -3.08 115.31 115.06 1jx1 h LEU 212 Ca 0.20 -0.73 0.00 0.00 0.09 0.00 0.00 57.88 57.44 1jx1 h LEU 212 Cb -0.06 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 40.45 1jx1 h LEU 212 CO -0.04 1.55 0.00 0.18 0.09 0.00 0.00 178.44 180.22 1jx1 n LEU 213 N -3.72 0.33 0.07 1.67 4.77 -0.14 -2.18 117.00 117.81 1jx1 n LEU 213 Ca -0.13 0.62 -0.16 0.00 -0.03 0.00 0.00 56.01 56.31 1jx1 n LEU 213 Cb 1.01 -0.62 -0.07 0.00 -2.33 0.00 0.00 43.42 41.41 1jx1 n LEU 213 CO 0.57 -0.60 0.12 0.78 -1.33 0.00 0.00 177.39 176.94 1jx1 h ASN 214 N 0.00 0.63 -0.01 -1.43 2.35 -1.32 -3.44 115.58 112.36 1jx1 h ASN 214 Ca 0.00 -0.52 0.00 0.00 -0.55 0.00 0.00 56.30 55.23 1jx1 h ASN 214 Cb 0.14 -0.19 0.00 0.00 0.05 0.00 0.00 38.32 38.32 1jx1 h ASN 214 CO 0.00 1.33 0.00 -1.84 -1.65 0.00 0.00 177.43 175.27