#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1j5h h ALA 2 N 0.00 -1.24 -3.00 0.00 0.00 -1.84 -3.40 119.26 109.78 1j5h h ALA 2 Ca 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.64 1j5h h ALA 2 Cb 0.00 0.49 0.00 0.00 0.00 0.00 0.00 17.79 18.28 1j5h h ALA 2 CO 0.00 -1.20 0.00 -0.35 0.00 0.00 0.00 179.25 177.70 1j5h n PRO 3 N -5.62 0.00 0.00 0.00 -0.04 -1.26 -5.07 135.00 123.01 1j5h n PRO 3 Ca -0.16 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.30 1j5h n PRO 3 Cb 0.49 -0.10 0.00 0.00 -0.04 0.00 0.00 33.50 33.85 1j5h n PRO 3 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1j5h n THR 4 N 0.00 0.00 -3.65 0.52 -2.24 -0.35 -5.00 114.28 103.56 1j5h n THR 4 Ca 0.00 0.00 -0.21 0.00 -2.27 0.00 0.00 64.05 61.57 1j5h n THR 4 Cb 0.00 0.00 -0.03 0.00 -2.10 0.00 0.00 70.33 68.20 1j5h n THR 4 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1j5h s ALA 5 N -2.00 3.98 0.02 6.98 0.00 -0.13 -0.45 121.76 130.16 1j5h s ALA 5 Ca 0.00 -1.75 -0.18 0.00 0.00 0.00 0.00 51.96 50.02 1j5h s ALA 5 Cb 0.00 -1.14 0.03 0.00 0.00 0.00 0.00 23.12 22.02 1j5h s ALA 5 CO 0.00 -0.11 0.40 0.95 0.00 0.00 0.00 175.76 177.00 1j5h s THR 6 N -2.38 0.05 0.11 0.00 -4.23 -0.43 -4.33 115.64 104.43 1j5h s THR 6 Ca 0.45 -0.43 0.08 0.00 -1.18 0.00 0.00 61.69 60.61 1j5h s THR 6 Cb -0.05 -0.86 -0.04 0.00 1.34 0.00 0.00 72.50 72.90 1j5h s THR 6 CO 0.28 -0.24 -0.21 0.54 -0.54 0.00 0.00 174.62 174.45 1j5h s VAL 7 N -2.01 1.72 0.15 2.29 0.11 -1.26 -0.59 120.40 120.81 1j5h s VAL 7 Ca -0.08 -1.58 -0.16 0.00 -2.93 0.00 0.00 61.98 57.23 1j5h s VAL 7 Cb -0.02 -1.58 0.10 0.00 -1.53 0.00 0.00 36.38 33.35 1j5h s VAL 7 CO 0.01 -0.08 1.14 0.41 -3.33 0.00 0.00 175.10 173.25 1j5h n THR 8 N 1.01 -0.43 -0.10 5.04 -1.04 0.12 -4.38 114.28 114.49 1j5h n THR 8 Ca -0.19 1.75 0.00 0.00 -2.04 0.00 0.00 64.05 63.57 1j5h n THR 8 Cb 0.54 -2.26 0.00 0.00 -1.82 0.00 0.00 70.33 66.79 1j5h n THR 8 CO 0.00 0.00 0.00 -0.81 -0.64 0.00 0.00 175.07 173.62 1j5h n PRO 9 N -5.03 0.79 0.00 -2.82 -0.04 -1.26 -5.04 135.00 121.60 1j5h n PRO 9 Ca 0.06 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.52 1j5h n PRO 9 Cb 0.26 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.72 1j5h n PRO 9 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1j5h n SER 10 N -0.42 0.00 -3.55 3.54 3.41 -1.26 -5.10 113.62 110.23 1j5h n SER 10 Ca 0.00 0.00 -0.09 0.00 -0.26 0.00 0.00 58.87 58.52 1j5h n SER 10 Cb 0.00 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 63.91 1j5h n SER 10 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1j5h s SER 11 N -0.94 -0.32 -0.10 4.04 1.04 -1.25 -1.87 113.70 114.30 1j5h s SER 11 Ca 0.00 0.19 0.00 0.00 0.48 0.00 0.00 55.95 56.62 1j5h s SER 11 Cb 0.00 0.30 0.00 0.00 0.10 0.00 0.00 66.02 66.42 1j5h s SER 11 CO 0.00 -0.42 0.00 0.61 0.98 0.00 0.00 173.24 174.41 1j5h n GLY 12 N 0.25 0.35 0.00 7.32 0.00 0.48 -4.89 105.19 108.70 1j5h n GLY 12 Ca -0.08 -0.87 0.00 0.00 0.00 0.00 0.00 46.02 45.07 1j5h n GLY 12 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1j5h n LEU 13 N -0.16 0.00 -3.86 0.99 4.77 -0.70 -4.78 117.00 113.26 1j5h n LEU 13 Ca -0.01 0.00 -0.09 0.00 -0.03 0.00 0.00 56.01 55.87 1j5h n LEU 13 Cb 0.44 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.48 1j5h n LEU 13 CO 0.02 0.00 0.19 -0.55 -1.33 0.00 0.00 177.39 175.71 1j5h s SER 14 N -1.28 -0.15 -0.53 -1.43 0.15 -1.07 -4.33 113.70 105.06 1j5h s SER 14 Ca 0.00 -0.69 -0.26 0.00 0.70 0.00 0.00 55.95 55.70 1j5h s SER 14 Cb 0.00 0.55 -0.06 0.00 -1.71 0.00 0.00 66.02 64.81 1j5h s SER 14 CO 0.00 -1.05 2.27 1.51 1.20 0.00 0.00 173.24 177.16 1j5h s ASP 15 N -2.93 4.64 0.00 5.45 1.47 -1.26 -0.89 116.67 123.15 1j5h s ASP 15 Ca 0.14 0.86 0.00 0.00 1.18 0.00 0.00 52.55 54.73 1j5h s ASP 15 Cb -0.00 -2.51 0.00 0.00 -0.34 0.00 0.00 42.92 40.07 1j5h s ASP 15 CO 0.01 -2.77 0.00 0.61 0.68 0.00 0.00 175.17 173.70 1j5h n GLY 16 N 5.94 0.96 3.58 2.12 0.00 0.13 -4.67 105.19 113.24 1j5h n GLY 16 Ca 0.33 -0.52 -0.23 0.00 0.00 0.00 0.00 46.02 45.60 1j5h n GLY 16 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1j5h s THR 17 N -2.31 3.34 -0.53 2.61 2.01 0.18 -4.23 115.64 116.72 1j5h s THR 17 Ca 0.00 -0.53 -0.27 0.00 0.31 0.00 0.00 61.69 61.20 1j5h s THR 17 Cb 0.00 -4.22 -0.03 0.00 0.01 0.00 0.00 72.50 68.26 1j5h s THR 17 CO 0.00 -0.64 1.99 -0.69 -0.69 0.00 0.00 174.62 174.58 1j5h s VAL 18 N 12.95 3.28 0.39 3.82 1.01 -1.25 -1.69 120.40 138.91 1j5h s VAL 18 Ca 0.74 0.19 0.04 0.00 0.00 0.00 0.00 61.98 62.95 1j5h s VAL 18 Cb -0.04 -3.66 -0.05 0.00 0.00 0.00 0.00 36.38 32.63 1j5h s VAL 18 CO 0.12 -0.61 0.06 0.68 0.00 0.00 0.00 175.10 175.35 1j5h s VAL 19 N 9.49 1.16 -0.04 2.92 -7.23 -0.72 -4.90 120.40 121.08 1j5h s VAL 19 Ca 0.77 -2.00 -0.30 0.00 -1.81 0.00 0.00 61.98 58.64 1j5h s VAL 19 Cb -0.15 -2.60 -0.04 0.00 0.56 0.00 0.00 36.38 34.15 1j5h s VAL 19 CO 0.24 0.00 1.27 -0.75 -0.31 0.00 0.00 175.10 175.55 1j5h s LYS 20 N -3.81 4.33 -0.02 4.82 2.20 -1.26 -0.68 119.74 125.32 1j5h s LYS 20 Ca 0.28 1.77 0.03 0.00 -0.36 0.00 0.00 55.97 57.68 1j5h s LYS 20 Cb 0.06 -3.57 -0.03 0.00 -1.51 0.00 0.00 37.83 32.78 1j5h s LYS 20 CO 0.13 -0.49 -0.08 0.54 -0.36 0.00 0.00 175.35 175.09 1j5h s VAL 21 N 2.30 3.55 0.06 4.02 0.11 0.28 0.12 120.40 130.85 1j5h s VAL 21 Ca 0.58 -0.72 -0.03 0.00 -2.93 0.00 0.00 61.98 58.88 1j5h s VAL 21 Cb -0.27 -2.50 -0.03 0.00 -1.53 0.00 0.00 36.38 32.05 1j5h s VAL 21 CO 0.23 0.46 0.02 0.00 -3.33 0.00 0.00 175.10 172.48 1j5h s ALA 22 N -0.92 0.38 0.00 1.54 0.00 0.24 -0.20 121.76 122.80 1j5h s ALA 22 Ca 0.15 -1.11 0.00 0.00 0.00 0.00 0.00 51.96 51.00 1j5h s ALA 22 Cb -0.11 0.36 0.00 0.00 0.00 0.00 0.00 23.12 23.37 1j5h s ALA 22 CO 0.05 -0.41 0.00 0.41 0.00 0.00 0.00 175.76 175.81 1j5h n GLY 23 N 0.06 -1.36 0.00 0.00 0.00 0.67 -1.31 105.19 103.25 1j5h n GLY 23 Ca -0.14 -1.25 0.00 0.00 0.00 0.00 0.00 46.02 44.63 1j5h n GLY 23 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1j5h n ALA 24 N 0.94 0.00 1.45 4.61 0.00 0.40 -1.28 120.51 126.62 1j5h n ALA 24 Ca 0.00 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.57 1j5h n ALA 24 Cb 0.00 0.00 0.72 0.00 0.00 0.00 0.00 19.45 20.17 1j5h n ALA 24 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1j5h n GLY 25 N 0.00 -0.99 3.88 0.00 0.00 -1.26 -1.21 105.19 105.60 1j5h n GLY 25 Ca 0.00 -0.14 -0.34 0.00 0.00 0.00 0.00 46.02 45.53 1j5h n GLY 25 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1j5h n LEU 26 N -1.15 -1.94 0.00 0.99 7.94 -1.00 -3.98 117.00 117.85 1j5h n LEU 26 Ca 0.16 -1.10 0.00 0.00 -1.11 0.00 0.00 56.01 53.96 1j5h n LEU 26 Cb 0.15 -2.12 0.00 0.00 0.53 0.00 0.00 43.42 41.98 1j5h n LEU 26 CO 0.17 0.55 0.00 0.00 -1.11 0.00 0.00 177.39 177.01 1j5h n GLN 27 N -4.48 0.00 0.00 1.96 3.00 0.19 -4.49 117.38 113.56 1j5h n GLN 27 Ca -0.16 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.83 1j5h n GLN 27 Cb 0.61 -0.16 0.00 0.00 0.00 0.00 0.00 30.24 30.69 1j5h n GLN 27 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1j5h n ALA 28 N -3.00 0.00 -4.01 -1.58 0.00 -1.25 -4.12 120.51 106.54 1j5h n ALA 28 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 53.09 1j5h n ALA 28 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.43 1j5h n ALA 28 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1j5h n GLY 29 N 0.00 -0.49 3.11 0.00 0.00 -1.23 -4.86 105.19 101.72 1j5h n GLY 29 Ca 0.00 0.23 -0.15 0.00 0.00 0.00 0.00 46.02 46.10 1j5h n GLY 29 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1j5h s THR 30 N -3.91 0.77 0.44 2.61 -1.32 -1.26 -4.76 115.64 108.21 1j5h s THR 30 Ca 0.28 -1.22 -0.21 0.00 -1.21 0.00 0.00 61.69 59.32 1j5h s THR 30 Cb -0.15 -0.85 -0.13 0.00 -1.51 0.00 0.00 72.50 69.86 1j5h s THR 30 CO 0.80 -0.35 0.41 0.00 -2.21 0.00 0.00 174.62 173.27 1j5h n ALA 31 N 1.29 -1.85 -3.13 11.08 0.00 -1.26 -1.26 120.51 125.38 1j5h n ALA 31 Ca -0.21 0.11 -0.16 0.00 0.00 0.00 0.00 53.44 53.18 1j5h n ALA 31 Cb 0.55 -1.70 -0.05 0.00 0.00 0.00 0.00 19.45 18.25 1j5h n ALA 31 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 1j5h s TYR 32 N -1.58 -0.21 0.02 0.00 2.02 0.97 -4.76 117.35 113.81 1j5h s TYR 32 Ca 0.63 -1.40 -0.31 0.00 -0.37 0.00 0.00 57.07 55.62 1j5h s TYR 32 Cb -0.58 -0.34 -0.10 0.00 -0.40 0.00 0.00 41.96 40.55 1j5h s TYR 32 CO 0.59 -1.03 1.96 -3.47 -1.57 0.00 0.00 175.55 172.03 1j5h n ASP 33 N 3.08 4.06 -4.60 2.29 2.03 0.39 -1.51 116.55 122.28 1j5h n ASP 33 Ca 0.23 0.91 -0.36 0.00 0.52 0.00 0.00 54.79 56.09 1j5h n ASP 33 Cb 0.51 -1.50 0.08 0.00 -0.72 0.00 0.00 41.12 39.49 1j5h n ASP 33 CO 0.00 0.00 0.00 0.52 -1.92 0.00 0.00 177.20 175.80 1j5h n VAL 34 N 5.47 2.75 -2.60 5.18 0.31 0.11 0.90 118.33 130.45 1j5h n VAL 34 Ca 0.20 -0.38 0.00 0.00 -0.01 0.00 0.00 64.34 64.16 1j5h n VAL 34 Cb 0.39 -1.07 0.00 0.00 -0.91 0.00 0.00 33.84 32.25 1j5h n VAL 34 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1j5h n GLY 35 N 1.14 5.98 0.00 2.92 0.00 -0.30 -4.32 105.19 110.60 1j5h n GLY 35 Ca 0.13 -1.61 0.00 0.00 0.00 0.00 0.00 46.02 44.54 1j5h n GLY 35 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1j5h n GLN 36 N 0.00 0.00 -4.46 1.61 1.13 -1.26 -4.43 117.38 109.97 1j5h n GLN 36 Ca 0.00 0.00 -0.23 0.00 -1.94 0.00 0.00 57.00 54.83 1j5h n GLN 36 Cb 0.00 0.00 -0.09 0.00 0.11 0.00 0.00 30.24 30.26 1j5h n GLN 36 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1j5h s ALA 38 N -3.33 0.28 -0.32 0.00 0.00 0.18 0.07 121.76 118.64 1j5h s ALA 38 Ca 0.31 0.06 -0.11 0.00 0.00 0.00 0.00 51.96 52.22 1j5h s ALA 38 Cb 0.06 -0.22 -0.02 0.00 0.00 0.00 0.00 23.12 22.94 1j5h s ALA 38 CO 0.15 -0.02 0.20 1.67 0.00 0.00 0.00 175.76 177.76 1j5h s TRP 39 N 0.61 3.21 0.00 0.00 1.48 -1.25 -0.52 118.94 122.46 1j5h s TRP 39 Ca -0.06 -0.29 0.00 0.00 -1.06 0.00 0.00 56.10 54.69 1j5h s TRP 39 Cb -0.09 -2.42 0.00 0.00 -1.16 0.00 0.00 33.47 29.80 1j5h s TRP 39 CO -0.01 -0.36 0.00 0.28 -4.06 0.00 0.00 176.95 172.79 1j5h n VAL 40 N 5.06 0.00 -0.75 -0.66 0.31 0.45 -4.64 118.33 118.09 1j5h n VAL 40 Ca -0.13 0.00 -0.18 0.00 -0.01 0.00 0.00 64.34 64.02 1j5h n VAL 40 Cb 0.50 0.00 0.06 0.00 -0.91 0.00 0.00 33.84 33.49 1j5h n VAL 40 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 1j5h n ASP 41 N 0.00 5.63 0.00 4.52 8.00 -1.24 -4.88 116.55 128.58 1j5h n ASP 41 Ca 0.00 -3.11 0.00 0.00 0.71 0.00 0.00 54.79 52.39 1j5h n ASP 41 Cb 0.00 -0.93 0.00 0.00 -0.02 0.00 0.00 41.12 40.17 1j5h n ASP 41 CO 0.00 0.00 0.00 0.41 -0.39 0.00 0.00 177.20 177.22 1j5h n THR 42 N -0.07 0.00 0.25 -3.53 -1.04 -1.26 -4.18 114.28 104.45 1j5h n THR 42 Ca 0.36 0.00 0.15 0.00 -2.04 0.00 0.00 64.05 62.51 1j5h n THR 42 Cb 0.78 0.00 0.75 0.00 -1.82 0.00 0.00 70.33 70.05 1j5h n THR 42 CO 0.00 0.00 0.00 1.23 -0.64 0.00 0.00 175.07 175.66 1j5h h GLY 43 N 0.00 0.00 -6.16 3.41 0.00 -2.00 -3.38 103.07 94.95 1j5h h GLY 43 Ca 0.00 0.00 -0.59 0.00 0.00 0.00 0.00 47.33 46.74 1j5h h GLY 43 CO 0.00 0.00 -0.83 0.14 0.00 0.00 0.00 176.54 175.85 1j5h s VAL 44 N -3.69 1.51 -0.11 4.60 1.01 -1.26 -5.09 120.40 117.38 1j5h s VAL 44 Ca -0.02 -0.63 -0.01 0.00 0.00 0.00 0.00 61.98 61.33 1j5h s VAL 44 Cb 0.09 -1.40 0.03 0.00 0.00 0.00 0.00 36.38 35.10 1j5h s VAL 44 CO 0.31 0.45 -0.02 -0.22 0.00 0.00 0.00 175.10 175.61 1j5h s LEU 45 N 1.22 0.99 -0.34 3.92 0.20 -1.26 -0.42 118.68 122.99 1j5h s LEU 45 Ca -0.01 -0.33 -0.11 0.00 0.69 0.00 0.00 54.13 54.37 1j5h s LEU 45 Cb -0.14 -0.65 0.01 0.00 -0.43 0.00 0.00 46.19 44.98 1j5h s LEU 45 CO -0.05 -0.19 0.18 0.00 -0.29 0.00 0.00 176.35 176.00 1j5h s ALA 46 N 1.83 3.30 0.51 5.97 0.00 0.32 -4.26 121.76 129.42 1j5h s ALA 46 Ca 0.04 -1.52 -0.05 0.00 0.00 0.00 0.00 51.96 50.42 1j5h s ALA 46 Cb -0.13 -2.50 -0.02 0.00 0.00 0.00 0.00 23.12 20.46 1j5h s ALA 46 CO -0.07 -1.11 0.81 0.00 0.00 0.00 0.00 175.76 175.39 1j5h s ASN 48 N -4.16 5.02 0.00 0.00 3.84 0.37 -1.38 114.94 118.63 1j5h s ASN 48 Ca 0.49 -2.97 -0.01 0.00 0.21 0.00 0.00 52.86 50.58 1j5h s ASN 48 Cb -0.10 -1.80 -0.04 0.00 -0.55 0.00 0.00 41.25 38.76 1j5h s ASN 48 CO 0.45 -0.32 1.76 -0.81 -2.79 0.00 0.00 177.10 175.39 1j5h n PRO 49 N 3.28 0.89 0.00 0.43 -0.04 -1.26 -2.31 135.00 135.99 1j5h n PRO 49 Ca 0.08 -0.14 0.00 0.00 -0.04 0.00 0.00 63.50 63.40 1j5h n PRO 49 Cb 0.36 -1.26 0.00 0.00 -0.04 0.00 0.00 33.50 32.56 1j5h n PRO 49 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1j5h n ALA 50 N 1.81 0.81 -0.31 0.55 0.00 -1.26 -4.86 120.51 117.24 1j5h n ALA 50 Ca 0.06 -0.33 0.06 0.00 0.00 0.00 0.00 53.44 53.23 1j5h n ALA 50 Cb 0.44 0.00 0.14 0.00 0.00 0.00 0.00 19.45 20.02 1j5h n ALA 50 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1j5h n ASP 51 N -0.04 -0.29 0.00 0.00 5.68 -0.98 -4.63 116.55 116.29 1j5h n ASP 51 Ca 0.00 1.50 0.00 0.00 -0.50 0.00 0.00 54.79 55.79 1j5h n ASP 51 Cb 0.33 -0.46 0.00 0.00 -1.14 0.00 0.00 41.12 39.84 1j5h n ASP 51 CO 0.00 0.00 0.00 0.33 -1.33 0.00 0.00 177.20 176.20 1j5h n PHE 52 N -5.41 0.00 -0.92 2.11 7.35 -1.26 -4.87 117.46 114.46 1j5h n PHE 52 Ca 0.15 0.00 -0.30 0.00 -0.76 0.00 0.00 57.45 56.54 1j5h n PHE 52 Cb 0.46 0.00 0.02 0.00 0.35 0.00 0.00 39.48 40.31 1j5h n PHE 52 CO 0.00 0.00 0.00 0.43 -0.76 0.00 0.00 176.76 176.43 1j5h n SER 53 N 1.40 -3.57 -3.64 -2.13 7.64 -1.26 -4.63 113.62 107.43 1j5h n SER 53 Ca 0.00 0.39 -0.14 0.00 1.01 0.00 0.00 58.87 60.12 1j5h n SER 53 Cb 0.00 -0.65 -0.08 0.00 -1.01 0.00 0.00 64.21 62.48 1j5h n SER 53 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1j5h s SER 54 N -0.79 -0.63 0.00 6.43 1.04 -1.26 0.08 113.70 118.56 1j5h s SER 54 Ca 0.40 1.12 0.00 0.00 0.48 0.00 0.00 55.95 57.96 1j5h s SER 54 Cb -0.31 1.12 0.00 0.00 0.10 0.00 0.00 66.02 66.93 1j5h s SER 54 CO 0.57 -0.29 0.00 0.55 0.98 0.00 0.00 173.24 175.05 1j5h n VAL 55 N 2.37 0.00 -3.98 5.02 3.14 -0.57 -4.82 118.33 119.49 1j5h n VAL 55 Ca -0.15 0.00 -0.09 0.00 -2.96 0.00 0.00 64.34 61.14 1j5h n VAL 55 Cb 0.56 0.00 -0.08 0.00 -1.06 0.00 0.00 33.84 33.26 1j5h n VAL 55 CO 0.00 0.00 0.00 -0.89 -6.46 0.00 0.00 176.83 169.48 1j5h s THR 56 N -1.08 0.11 0.69 1.55 2.01 -1.26 -0.02 115.64 117.64 1j5h s THR 56 Ca 0.00 -1.48 -0.05 0.00 0.31 0.00 0.00 61.69 60.47 1j5h s THR 56 Cb 0.00 -1.69 0.06 0.00 0.01 0.00 0.00 72.50 70.88 1j5h s THR 56 CO 0.00 -0.52 0.98 0.00 -0.69 0.00 0.00 174.62 174.39 1j5h s ALA 57 N -3.95 3.28 -0.16 7.40 0.00 -0.39 -3.51 121.76 124.44 1j5h s ALA 57 Ca 0.14 -1.02 0.00 0.00 0.00 0.00 0.00 51.96 51.08 1j5h s ALA 57 Cb 0.05 -2.50 0.03 0.00 0.00 0.00 0.00 23.12 20.70 1j5h s ALA 57 CO -0.04 -1.24 -0.13 0.16 0.00 0.00 0.00 175.76 174.51 1j5h s ASP 58 N -4.52 2.82 0.00 0.00 1.47 0.31 -3.61 116.67 113.13 1j5h s ASP 58 Ca 0.60 -0.57 0.00 0.00 1.18 0.00 0.00 52.55 53.77 1j5h s ASP 58 Cb -0.10 -1.18 0.00 0.00 -0.34 0.00 0.00 42.92 41.30 1j5h s ASP 58 CO 0.44 -0.08 0.00 0.00 0.68 0.00 0.00 175.17 176.21 1j5h n ALA 59 N 4.76 0.00 -0.29 2.11 0.00 -1.26 0.14 120.51 125.97 1j5h n ALA 59 Ca -0.16 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.40 1j5h n ALA 59 Cb 0.49 0.00 0.25 0.00 0.00 0.00 0.00 19.45 20.19 1j5h n ALA 59 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1j5h n ASN 60 N 0.49 -0.09 0.00 0.00 2.85 -1.26 -3.54 115.26 113.71 1j5h n ASN 60 Ca 0.00 1.42 0.00 0.00 -0.11 0.00 0.00 54.58 55.89 1j5h n ASN 60 Cb 0.00 -0.52 0.00 0.00 1.24 0.00 0.00 39.78 40.50 1j5h n ASN 60 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1j5h n GLY 61 N -1.42 0.73 3.74 8.20 0.00 0.36 -4.02 105.19 112.78 1j5h n GLY 61 Ca 0.20 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.82 1j5h n GLY 61 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1j5h s SER 62 N -0.88 7.14 0.89 1.61 0.15 -1.21 0.53 113.70 121.93 1j5h s SER 62 Ca 0.00 1.37 -0.11 0.00 0.70 0.00 0.00 55.95 57.91 1j5h s SER 62 Cb 0.00 -2.44 0.13 0.00 -1.71 0.00 0.00 66.02 61.99 1j5h s SER 62 CO 0.00 0.01 1.10 0.00 1.20 0.00 0.00 173.24 175.55 1j5h s ALA 63 N 0.03 1.54 -0.30 5.45 0.00 -0.40 -0.53 121.76 127.55 1j5h s ALA 63 Ca 0.37 0.18 -0.00 0.00 0.00 0.00 0.00 51.96 52.51 1j5h s ALA 63 Cb -0.20 -3.28 0.19 0.00 0.00 0.00 0.00 23.12 19.83 1j5h s ALA 63 CO 0.21 -2.42 0.67 -1.54 0.00 0.00 0.00 175.76 172.69 1j5h s SER 64 N -3.15 -1.32 0.00 0.00 1.04 -1.23 -0.24 113.70 108.80 1j5h s SER 64 Ca 0.64 0.49 0.00 0.00 0.48 0.00 0.00 55.95 57.55 1j5h s SER 64 Cb -0.19 1.97 0.00 0.00 0.10 0.00 0.00 66.02 67.90 1j5h s SER 64 CO 0.58 -0.24 0.00 1.07 0.98 0.00 0.00 173.24 175.62 1j5h n THR 65 N 5.41 0.00 -3.84 2.02 5.66 0.72 -4.82 114.28 119.42 1j5h n THR 65 Ca 0.02 0.00 -0.17 0.00 -3.05 0.00 0.00 64.05 60.85 1j5h n THR 65 Cb 0.53 0.00 -0.16 0.00 -1.55 0.00 0.00 70.33 69.15 1j5h n THR 65 CO 0.00 0.00 0.00 -0.94 -3.05 0.00 0.00 175.07 171.08 1j5h s SER 66 N 2.00 0.36 0.07 1.09 1.04 -1.26 0.10 113.70 117.10 1j5h s SER 66 Ca 0.00 0.01 0.09 0.00 0.48 0.00 0.00 55.95 56.53 1j5h s SER 66 Cb 0.00 -0.16 -0.03 0.00 0.10 0.00 0.00 66.02 65.93 1j5h s SER 66 CO 0.00 -0.12 -0.24 -0.76 0.98 0.00 0.00 173.24 173.09 1j5h s LEU 67 N 1.14 2.34 -0.71 2.42 1.02 0.15 -4.85 118.68 120.19 1j5h s LEU 67 Ca -0.08 -0.60 -0.26 0.00 0.02 0.00 0.00 54.13 53.20 1j5h s LEU 67 Cb -0.13 -1.33 0.04 0.00 0.02 0.00 0.00 46.19 44.78 1j5h s LEU 67 CO -0.02 0.23 1.22 0.28 0.02 0.00 0.00 176.35 178.08 1j5h s THR 68 N -0.92 3.85 -0.57 5.49 -1.32 -1.26 -1.75 115.64 119.15 1j5h s THR 68 Ca 0.13 0.36 -0.20 0.00 -1.21 0.00 0.00 61.69 60.77 1j5h s THR 68 Cb -0.10 -4.86 -0.18 0.00 -1.51 0.00 0.00 72.50 65.85 1j5h s THR 68 CO 0.04 -1.74 1.81 0.52 -2.21 0.00 0.00 174.62 173.05 1j5h n VAL 69 N 6.34 1.38 -1.89 5.08 0.31 -0.68 -4.70 118.33 124.17 1j5h n VAL 69 Ca 0.03 -1.10 -0.42 0.00 -0.01 0.00 0.00 64.34 62.83 1j5h n VAL 69 Cb 0.48 -2.16 -0.03 0.00 -0.91 0.00 0.00 33.84 31.22 1j5h n VAL 69 CO 0.00 0.00 0.00 -0.13 -1.32 0.00 0.00 176.83 175.38 1j5h s ARG 70 N 5.19 4.20 0.00 5.55 0.52 -1.26 0.19 118.95 133.34 1j5h s ARG 70 Ca 0.53 2.41 0.00 0.00 -0.52 0.00 0.00 55.73 58.15 1j5h s ARG 70 Cb 0.13 -3.14 0.00 0.00 0.52 0.00 0.00 34.95 32.46 1j5h s ARG 70 CO 0.14 -0.63 0.00 -2.13 0.02 0.00 0.00 175.30 172.70 1j5h n ARG 71 N 3.92 0.00 -2.36 3.54 0.63 -1.26 -4.60 116.66 116.53 1j5h n ARG 71 Ca 0.14 0.00 -0.35 0.00 -0.92 0.00 0.00 57.85 56.72 1j5h n ARG 71 Cb 0.38 -0.23 -0.04 0.00 0.45 0.00 0.00 32.46 33.02 1j5h n ARG 71 CO 0.00 0.00 0.00 -1.54 -2.51 0.00 0.00 177.63 173.58 1j5h s SER 72 N -2.47 5.96 0.09 6.15 1.04 -1.26 -0.91 113.70 122.29 1j5h s SER 72 Ca 0.00 -1.13 0.02 0.00 0.48 0.00 0.00 55.95 55.32 1j5h s SER 72 Cb 0.00 -2.57 -0.04 0.00 0.10 0.00 0.00 66.02 63.52 1j5h s SER 72 CO 0.00 -2.00 -0.07 0.72 0.98 0.00 0.00 173.24 172.87 1j5h s PHE 73 N 7.01 0.86 -0.57 5.02 -0.12 -0.32 -4.83 117.98 125.03 1j5h s PHE 73 Ca 0.56 -0.83 -0.27 0.00 -0.05 0.00 0.00 56.93 56.34 1j5h s PHE 73 Cb -0.03 -0.50 0.03 0.00 -0.63 0.00 0.00 43.02 41.90 1j5h s PHE 73 CO -0.06 -0.13 1.12 -1.83 -0.05 0.00 0.00 175.22 174.27 1j5h s GLU 74 N -3.37 3.46 0.30 1.99 -1.05 -1.26 -1.53 118.70 117.24 1j5h s GLU 74 Ca 0.08 0.09 -0.13 0.00 -0.15 0.00 0.00 54.97 54.86 1j5h s GLU 74 Cb 0.02 -4.03 -0.08 0.00 -0.44 0.00 0.00 34.13 29.60 1j5h s GLU 74 CO -0.04 -1.63 0.69 0.20 0.95 0.00 0.00 175.26 175.43 1j5h s GLY 75 N 2.93 2.31 -0.02 -3.83 0.00 -1.26 -4.73 107.32 102.72 1j5h s GLY 75 Ca 0.39 -0.05 0.02 0.00 0.00 0.00 0.00 44.72 45.09 1j5h s GLY 75 CO 0.23 0.14 -0.08 -1.36 0.00 0.00 0.00 173.10 172.04 1j5h s PHE 76 N -1.95 0.79 0.16 1.90 0.40 -0.48 -0.67 117.98 118.13 1j5h s PHE 76 Ca 0.52 -0.18 -0.15 0.00 -0.60 0.00 0.00 56.93 56.52 1j5h s PHE 76 Cb -0.10 -0.55 0.07 0.00 0.51 0.00 0.00 43.02 42.94 1j5h s PHE 76 CO 0.19 -0.06 1.78 -0.07 0.70 0.00 0.00 175.22 177.75 1j5h h LEU 77 N 6.25 0.28 0.00 -0.37 -0.00 -1.18 0.81 115.31 121.10 1j5h h LEU 77 Ca -0.32 0.02 0.00 0.00 -0.00 0.00 0.00 57.88 57.58 1j5h h LEU 77 Cb 1.17 -0.03 0.00 0.00 -0.00 0.00 0.00 40.66 41.81 1j5h h LEU 77 CO 0.49 0.20 0.00 0.33 -0.00 0.00 0.00 178.44 179.47 1j5h n PHE 78 N -4.93 0.00 0.00 1.13 7.35 -1.23 -4.49 117.46 115.29 1j5h n PHE 78 Ca 0.02 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.71 1j5h n PHE 78 Cb 0.10 0.00 0.00 0.00 0.35 0.00 0.00 39.48 39.93 1j5h n PHE 78 CO 0.00 0.00 0.00 -0.25 -0.76 0.00 0.00 176.76 175.75 1j5h n ASP 79 N 0.00 3.44 0.00 -2.13 8.00 -1.26 -4.98 116.55 119.61 1j5h n ASP 79 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.50 1j5h n ASP 79 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.10 1j5h n ASP 79 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1j5h n GLY 80 N 3.31 0.00 3.63 0.44 0.00 -1.26 -5.17 105.19 106.14 1j5h n GLY 80 Ca 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.96 1j5h n GLY 80 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1j5h s THR 81 N 0.00 0.00 -0.23 2.61 2.01 -1.26 -5.05 115.64 113.72 1j5h s THR 81 Ca 0.00 -0.33 -0.15 0.00 0.31 0.00 0.00 61.69 61.52 1j5h s THR 81 Cb 0.00 -1.49 0.07 0.00 0.01 0.00 0.00 72.50 71.08 1j5h s THR 81 CO 0.00 0.00 0.57 0.00 -0.69 0.00 0.00 174.62 174.50 1j5h s ARG 82 N -3.24 0.60 0.00 4.92 3.03 -1.26 -0.87 118.95 122.13 1j5h s ARG 82 Ca 0.08 0.97 0.00 0.00 2.03 0.00 0.00 55.73 58.81 1j5h s ARG 82 Cb -0.01 0.15 0.00 0.00 -1.03 0.00 0.00 34.95 34.05 1j5h s ARG 82 CO -0.04 -0.13 0.00 0.91 -1.13 0.00 0.00 175.30 174.91 1j5h n TRP 83 N 3.84 0.00 0.00 5.89 5.03 0.15 -4.93 117.44 127.42 1j5h n TRP 83 Ca -0.19 0.00 0.00 0.00 3.03 0.00 0.00 57.50 60.34 1j5h n TRP 83 Cb 0.57 -0.04 0.00 0.00 -1.03 0.00 0.00 31.31 30.81 1j5h n TRP 83 CO 0.00 0.00 0.00 0.41 -0.03 0.00 0.00 177.69 178.07 1j5h n GLY 84 N 2.46 2.34 1.29 6.99 0.00 -1.01 -4.91 105.19 112.36 1j5h n GLY 84 Ca 0.00 -1.76 0.00 0.00 0.00 0.00 0.00 46.02 44.26 1j5h n GLY 84 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1j5h n THR 85 N 1.62 0.00 -4.44 2.61 -1.04 -1.26 -4.62 114.28 107.15 1j5h n THR 85 Ca 0.00 0.00 -0.24 0.00 -2.04 0.00 0.00 64.05 61.77 1j5h n THR 85 Cb 0.00 0.00 -0.13 0.00 -1.82 0.00 0.00 70.33 68.38 1j5h n THR 85 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 1j5h s VAL 86 N -0.66 1.66 -0.25 12.58 0.11 -0.58 -4.93 120.40 128.33 1j5h s VAL 86 Ca 0.00 -1.37 -0.25 0.00 -2.93 0.00 0.00 61.98 57.43 1j5h s VAL 86 Cb 0.00 -1.48 -0.00 0.00 -1.53 0.00 0.00 36.38 33.36 1j5h s VAL 86 CO 0.00 0.05 0.86 -1.81 -3.33 0.00 0.00 175.10 170.87 1j5h s ASP 87 N -1.56 6.85 0.23 3.54 1.01 -1.26 -1.17 116.67 124.31 1j5h s ASP 87 Ca 0.07 1.04 -0.03 0.00 0.71 0.00 0.00 52.55 54.34 1j5h s ASP 87 Cb -0.09 -2.45 0.24 0.00 1.01 0.00 0.00 42.92 41.63 1j5h s ASP 87 CO 0.03 -0.56 1.65 0.00 0.21 0.00 0.00 175.17 176.51 1j5h h THR 89 N 0.61 0.44 0.00 0.00 1.03 -1.86 1.67 112.91 114.81 1j5h h THR 89 Ca 0.09 -0.02 -0.08 0.00 -0.01 0.00 0.00 66.41 66.38 1j5h h THR 89 Cb 0.71 1.01 -0.01 0.00 -1.07 0.00 0.00 68.15 68.80 1j5h h THR 89 CO 0.05 0.00 -0.39 0.74 -0.01 0.00 0.00 175.52 175.92 1j5h h THR 90 N 0.00 0.72 0.00 0.00 2.02 -1.73 -3.23 112.91 110.69 1j5h h THR 90 Ca -0.00 -1.83 -0.03 0.00 0.77 0.00 0.00 66.41 65.32 1j5h h THR 90 Cb 0.01 2.22 -0.06 0.00 -1.74 0.00 0.00 68.15 68.58 1j5h h THR 90 CO 0.00 0.38 -0.41 0.00 0.37 0.00 0.00 175.52 175.86 1j5h n ALA 91 N -2.22 2.75 -3.84 6.16 0.00 0.50 -5.00 120.51 118.86 1j5h n ALA 91 Ca 0.02 -2.60 -0.25 0.00 0.00 0.00 0.00 53.44 50.60 1j5h n ALA 91 Cb 0.64 -0.44 0.01 0.00 0.00 0.00 0.00 19.45 19.66 1j5h n ALA 91 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1j5h n ALA 92 N -0.82 -1.93 -0.75 0.00 0.00 0.54 -3.82 120.51 113.72 1j5h n ALA 92 Ca 0.13 -0.32 -0.05 0.00 0.00 0.00 0.00 53.44 53.21 1j5h n ALA 92 Cb 0.74 -1.30 0.08 0.00 0.00 0.00 0.00 19.45 18.98 1j5h n ALA 92 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1j5h s GLN 94 N -2.88 0.43 -0.24 0.00 -2.07 0.11 -1.62 119.66 113.39 1j5h s GLN 94 Ca 0.19 -0.58 -0.04 0.00 -1.82 0.00 0.00 55.36 53.11 1j5h s GLN 94 Cb -0.03 -0.22 0.08 0.00 -1.09 0.00 0.00 33.01 31.75 1j5h s GLN 94 CO 0.16 0.04 0.09 0.54 -1.32 0.00 0.00 175.29 174.80 1j5h s VAL 95 N -1.08 0.18 0.00 3.63 0.11 -0.61 -1.39 120.40 121.24 1j5h s VAL 95 Ca -0.08 -0.64 0.00 0.00 -2.93 0.00 0.00 61.98 58.33 1j5h s VAL 95 Cb -0.08 -0.97 0.00 0.00 -1.53 0.00 0.00 36.38 33.80 1j5h s VAL 95 CO 0.00 -0.49 0.00 0.61 -3.33 0.00 0.00 175.10 171.89 1j5h n GLY 96 N 5.16 5.43 3.93 6.54 0.00 -1.26 -3.80 105.19 121.19 1j5h n GLY 96 Ca -0.06 -1.56 -0.26 0.00 0.00 0.00 0.00 46.02 44.14 1j5h n GLY 96 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1j5h s LEU 97 N 0.00 4.02 -0.06 0.99 2.01 -1.26 -1.15 118.68 123.23 1j5h s LEU 97 Ca 0.00 0.54 -0.13 0.00 0.01 0.00 0.00 54.13 54.56 1j5h s LEU 97 Cb 0.00 -3.39 0.03 0.00 0.01 0.00 0.00 46.19 42.84 1j5h s LEU 97 CO 0.00 -0.26 0.30 -0.44 1.01 0.00 0.00 176.35 176.96 1j5h s SER 98 N -3.74 -0.24 1.07 2.29 0.01 0.26 -4.67 113.70 108.67 1j5h s SER 98 Ca 0.41 0.33 -0.15 0.00 1.31 0.00 0.00 55.95 57.85 1j5h s SER 98 Cb -0.10 0.47 0.22 0.00 0.21 0.00 0.00 66.02 66.82 1j5h s SER 98 CO 0.34 -0.29 1.11 -1.81 0.41 0.00 0.00 173.24 173.01 1j5h s ASP 99 N -0.63 2.04 0.00 2.44 1.11 -1.26 0.15 116.67 120.52 1j5h s ASP 99 Ca -0.07 0.90 0.09 0.00 0.18 0.00 0.00 52.55 53.65 1j5h s ASP 99 Cb -0.04 -1.37 0.42 0.00 1.07 0.00 0.00 42.92 43.00 1j5h s ASP 99 CO 0.02 -3.46 1.23 0.00 1.18 0.00 0.00 175.17 174.14 1j5h n ALA 100 N -4.35 1.50 0.11 5.23 0.00 -1.26 -0.88 120.51 120.85 1j5h n ALA 100 Ca 0.09 -0.04 0.01 0.00 0.00 0.00 0.00 53.44 53.50 1j5h n ALA 100 Cb 0.58 -1.15 -0.02 0.00 0.00 0.00 0.00 19.45 18.87 1j5h n ALA 100 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1j5h n ALA 101 N -1.40 2.34 -2.63 0.00 0.00 -1.26 -5.02 120.51 112.53 1j5h n ALA 101 Ca 0.03 -0.08 -0.07 0.00 0.00 0.00 0.00 53.44 53.32 1j5h n ALA 101 Cb 0.09 -0.11 0.03 0.00 0.00 0.00 0.00 19.45 19.46 1j5h n ALA 101 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1j5h n GLY 102 N 1.33 0.28 0.00 0.00 0.00 -0.06 -5.03 105.19 101.70 1j5h n GLY 102 Ca 0.00 -0.31 0.00 0.00 0.00 0.00 0.00 46.02 45.71 1j5h n GLY 102 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1j5h n ASN 103 N -1.07 -0.55 -2.36 1.61 6.94 -1.26 -4.44 115.26 114.12 1j5h n ASN 103 Ca -0.06 0.00 -0.27 0.00 -0.02 0.00 0.00 54.58 54.23 1j5h n ASN 103 Cb 0.54 0.00 -0.07 0.00 -2.36 0.00 0.00 39.78 37.89 1j5h n ASN 103 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1j5h n GLY 104 N 0.00 -0.17 0.00 4.83 0.00 -1.26 -4.61 105.19 103.97 1j5h n GLY 104 Ca 0.00 0.62 0.00 0.00 0.00 0.00 0.00 46.02 46.64 1j5h n GLY 104 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1j5h n PRO 105 N 4.32 1.78 -0.54 1.61 -0.04 -1.26 0.18 135.00 141.04 1j5h n PRO 105 Ca 0.33 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.79 1j5h n PRO 105 Cb -0.00 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.46 1j5h n PRO 105 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 1j5h n GLU 106 N 0.00 0.00 0.00 0.54 2.13 -1.26 -4.42 120.64 117.63 1j5h n GLU 106 Ca 0.00 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.82 1j5h n GLU 106 Cb 0.00 -0.63 0.00 0.00 0.27 0.00 0.00 31.44 31.08 1j5h n GLU 106 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1j5h n GLY 107 N -0.38 -1.27 3.15 8.31 0.00 -1.26 -4.21 105.19 109.53 1j5h n GLY 107 Ca 0.00 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.06 1j5h n GLY 107 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1j5h s VAL 108 N 0.00 -0.96 -0.45 1.61 0.11 -1.25 -0.95 120.40 118.51 1j5h s VAL 108 Ca 0.00 0.00 -0.28 0.00 -2.93 0.00 0.00 61.98 58.77 1j5h s VAL 108 Cb 0.00 -0.98 -0.01 0.00 -1.53 0.00 0.00 36.38 33.86 1j5h s VAL 108 CO 0.00 0.00 1.67 0.00 -3.33 0.00 0.00 175.10 173.44 1j5h s ALA 109 N 2.85 2.73 0.09 1.54 0.00 -1.26 -1.58 121.76 126.14 1j5h s ALA 109 Ca 0.16 -0.19 0.06 0.00 0.00 0.00 0.00 51.96 51.99 1j5h s ALA 109 Cb -0.13 -4.08 -0.03 0.00 0.00 0.00 0.00 23.12 18.88 1j5h s ALA 109 CO -0.23 -2.93 -0.16 0.42 0.00 0.00 0.00 175.76 172.86 1j5h s ILE 110 N 6.99 1.35 -0.63 0.00 1.01 -0.64 -4.95 121.20 124.33 1j5h s ILE 110 Ca 0.69 -1.49 -0.27 0.00 0.00 0.00 0.00 60.65 59.57 1j5h s ILE 110 Cb -0.16 -1.34 0.02 0.00 0.01 0.00 0.00 42.46 40.99 1j5h s ILE 110 CO 0.29 -0.23 1.39 -0.55 0.00 0.00 0.00 174.94 175.84 1j5h s SER 111 N -1.98 6.09 0.00 3.58 0.15 -0.78 -4.08 113.70 116.67 1j5h s SER 111 Ca 0.03 0.03 0.13 0.00 0.70 0.00 0.00 55.95 56.85 1j5h s SER 111 Cb -0.09 -2.55 0.79 0.00 -1.71 0.00 0.00 66.02 62.47 1j5h s SER 111 CO 0.03 -1.79 1.51 0.49 1.20 0.00 0.00 173.24 174.68 1j5h n PHE 112 N 9.71 0.01 -0.18 3.44 3.01 -1.26 0.18 117.46 132.36 1j5h n PHE 112 Ca 0.10 -0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.55 1j5h n PHE 112 Cb 0.49 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.96 1j5h n PHE 112 CO 0.00 0.00 0.00 -1.71 1.01 0.00 0.00 176.76 176.06