#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 0.00 -2.41 0.00 0.00 -1.99 -3.47 119.26 111.40 1j5h h ALA 2 Ca 0.00 -0.25 -0.49 0.00 0.00 0.00 0.00 54.91 54.17 1j5h h ALA 2 Cb 0.00 0.24 0.11 0.00 0.00 0.00 0.00 17.79 18.15 1j5h h ALA 2 CO 0.00 0.24 0.34 -1.25 0.00 0.00 0.00 179.25 178.58 1j5h s PRO 3 N -1.85 2.11 0.00 0.00 0.04 -1.26 -5.07 135.00 128.97 1j5h s PRO 3 Ca -0.07 0.66 0.00 0.00 0.04 0.00 0.00 61.00 61.62 1j5h s PRO 3 Cb 0.01 -1.92 0.00 0.00 0.04 0.00 0.00 34.50 32.63 1j5h s PRO 3 CO 0.11 -1.61 0.00 0.25 0.04 0.00 0.00 177.00 175.79 1j5h n THR 4 N -3.43 0.00 -3.57 1.26 -2.24 0.20 -4.78 114.28 101.72 1j5h n THR 4 Ca 0.07 0.00 -0.20 0.00 -2.27 0.00 0.00 64.05 61.65 1j5h n THR 4 Cb 0.56 0.00 -0.02 0.00 -2.10 0.00 0.00 70.33 68.77 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 4.08 0.12 6.98 0.00 -1.26 -0.73 121.76 128.95 1j5h s ALA 5 Ca 0.00 -1.64 -0.16 0.00 0.00 0.00 0.00 51.96 50.16 1j5h s ALA 5 Cb 0.00 -1.35 0.03 0.00 0.00 0.00 0.00 23.12 21.81 1j5h s ALA 5 CO 0.00 -0.08 0.39 0.95 0.00 0.00 0.00 175.76 177.02 1j5h s THR 6 N -2.30 0.07 -0.16 0.00 -4.23 -0.16 -4.32 115.64 104.55 1j5h s THR 6 Ca 0.45 -0.61 -0.07 0.00 -1.18 0.00 0.00 61.69 60.28 1j5h s THR 6 Cb -0.07 -1.17 -0.04 0.00 1.34 0.00 0.00 72.50 72.56 1j5h s THR 6 CO 0.29 -0.34 0.07 0.54 -0.54 0.00 0.00 174.62 174.64 1j5h s VAL 7 N -3.74 4.88 0.10 2.29 0.11 -1.26 -1.66 120.40 121.11 1j5h s VAL 7 Ca 0.03 -0.01 -0.20 0.00 -2.93 0.00 0.00 61.98 58.87 1j5h s VAL 7 Cb 0.02 -3.17 -0.04 0.00 -1.53 0.00 0.00 36.38 31.66 1j5h s VAL 7 CO -0.11 0.51 1.10 0.41 -3.33 0.00 0.00 175.10 173.67 1j5h n THR 8 N 3.04 -0.43 0.00 5.04 -1.04 -0.67 -3.57 114.28 116.65 1j5h n THR 8 Ca -0.17 1.72 0.00 0.00 -2.04 0.00 0.00 64.05 63.55 1j5h n THR 8 Cb 0.53 -2.14 0.00 0.00 -1.82 0.00 0.00 70.33 66.90 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 -4.60 0.00 -0.78 -2.82 -0.04 -1.26 -4.98 135.00 120.52 1j5h n PRO 9 Ca 0.01 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.47 1j5h n PRO 9 Cb 0.17 -0.28 0.00 0.00 -0.04 0.00 0.00 33.50 33.34 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 -0.16 -1.56 -3.64 3.54 3.41 -1.23 -5.02 113.62 108.95 1j5h n SER 10 Ca 0.00 0.00 -0.04 0.00 -0.26 0.00 0.00 58.87 58.57 1j5h n SER 10 Cb 0.00 -0.31 -0.07 0.00 -0.26 0.00 0.00 64.21 63.57 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 -2.62 -0.37 -0.83 4.04 1.04 -1.25 -1.79 113.70 111.92 1j5h s SER 11 Ca 0.00 0.65 -0.04 0.00 0.48 0.00 0.00 55.95 57.04 1j5h s SER 11 Cb 0.00 0.91 0.00 0.00 0.10 0.00 0.00 66.02 67.03 1j5h s SER 11 CO 0.00 -0.11 0.48 0.61 0.98 0.00 0.00 173.24 175.21 1j5h n GLY 12 N 2.81 0.05 0.00 7.32 0.00 -0.83 -4.93 105.19 109.62 1j5h n GLY 12 Ca -0.15 -0.22 0.00 0.00 0.00 0.00 0.00 46.02 45.65 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 -2.66 0.00 -3.55 0.99 4.77 -0.75 -4.67 117.00 111.13 1j5h n LEU 13 Ca -0.03 0.00 -0.08 0.00 -0.03 0.00 0.00 56.01 55.87 1j5h n LEU 13 Cb 0.55 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.62 1j5h n LEU 13 CO 0.31 0.00 0.64 -0.55 -1.33 0.00 0.00 177.39 176.46 1j5h s SER 14 N -1.14 -0.36 -0.84 -1.43 0.15 -1.26 -2.61 113.70 106.22 1j5h s SER 14 Ca 0.00 -0.10 -0.22 0.00 0.70 0.00 0.00 55.95 56.34 1j5h s SER 14 Cb 0.00 0.45 -0.19 0.00 -1.71 0.00 0.00 66.02 64.57 1j5h s SER 14 CO 0.00 -0.75 2.25 -0.90 1.20 0.00 0.00 173.24 175.05 1j5h n ASP 15 N -0.31 0.96 -0.10 5.45 5.75 -1.26 0.02 116.55 127.06 1j5h n ASP 15 Ca -0.09 -1.48 0.00 0.00 -0.01 0.00 0.00 54.79 53.20 1j5h n ASP 15 Cb 0.62 -1.42 0.00 0.00 -1.03 0.00 0.00 41.12 39.29 1j5h n ASP 15 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1j5h n GLY 16 N 6.36 0.88 3.56 6.12 0.00 -1.21 -4.68 105.19 116.23 1j5h n GLY 16 Ca 0.48 -0.10 -0.32 0.00 0.00 0.00 0.00 46.02 46.07 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 -1.97 3.63 -1.11 2.61 2.01 0.10 -4.64 115.64 116.27 1j5h s THR 17 Ca 0.00 -0.59 -0.22 0.00 0.31 0.00 0.00 61.69 61.20 1j5h s THR 17 Cb 0.00 -4.43 0.02 0.00 0.01 0.00 0.00 72.50 68.10 1j5h s THR 17 CO 0.00 -1.31 1.70 -0.69 -0.69 0.00 0.00 174.62 173.63 1j5h s VAL 18 N 8.29 3.84 0.45 3.82 1.01 -1.25 -1.84 120.40 134.72 1j5h s VAL 18 Ca 0.62 -1.07 0.07 0.00 0.00 0.00 0.00 61.98 61.59 1j5h s VAL 18 Cb -0.04 -4.84 -0.01 0.00 0.00 0.00 0.00 36.38 31.49 1j5h s VAL 18 CO -0.03 -1.64 0.36 0.68 0.00 0.00 0.00 175.10 174.47 1j5h s VAL 19 N 6.61 2.35 0.46 2.92 -7.23 -0.68 -4.80 120.40 120.02 1j5h s VAL 19 Ca 0.56 -1.43 -0.23 0.00 -1.81 0.00 0.00 61.98 59.07 1j5h s VAL 19 Cb -0.00 -2.78 -0.07 0.00 0.56 0.00 0.00 36.38 34.08 1j5h s VAL 19 CO 0.01 0.00 1.16 -0.75 -0.31 0.00 0.00 175.10 175.21 1j5h s LYS 20 N -4.14 3.77 0.02 4.82 2.20 -1.26 -0.06 119.74 125.09 1j5h s LYS 20 Ca 0.44 1.76 0.00 0.00 -0.36 0.00 0.00 55.97 57.81 1j5h s LYS 20 Cb -0.02 -2.40 -0.02 0.00 -1.51 0.00 0.00 37.83 33.89 1j5h s LYS 20 CO 0.26 -0.54 -0.02 0.08 -0.36 0.00 0.00 175.35 174.76 1j5h s VAL 21 N -1.56 0.09 0.01 4.02 1.01 0.47 -1.66 120.40 122.79 1j5h s VAL 21 Ca 0.63 -0.75 -0.06 0.00 0.00 0.00 0.00 61.98 61.81 1j5h s VAL 21 Cb -0.28 -0.22 -0.01 0.00 0.00 0.00 0.00 36.38 35.88 1j5h s VAL 21 CO 0.34 -0.41 0.10 0.00 0.00 0.00 0.00 175.10 175.13 1j5h s ALA 22 N -1.20 -0.19 0.00 5.51 0.00 -0.67 -0.38 121.76 124.84 1j5h s ALA 22 Ca -0.13 -0.31 0.00 0.00 0.00 0.00 0.00 51.96 51.52 1j5h s ALA 22 Cb -0.08 0.15 0.00 0.00 0.00 0.00 0.00 23.12 23.19 1j5h s ALA 22 CO -0.01 -0.22 0.00 0.41 0.00 0.00 0.00 175.76 175.94 1j5h n GLY 23 N 1.32 -1.89 0.00 0.00 0.00 0.17 -0.98 105.19 103.81 1j5h n GLY 23 Ca -0.22 -2.12 0.00 0.00 0.00 0.00 0.00 46.02 43.68 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 0.04 0.00 0.40 4.61 0.00 0.09 -1.39 120.51 124.26 1j5h n ALA 24 Ca 0.00 0.00 0.04 0.00 0.00 0.00 0.00 53.44 53.48 1j5h n ALA 24 Cb 0.00 0.00 0.20 0.00 0.00 0.00 0.00 19.45 19.65 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 -0.39 3.82 0.00 0.00 -1.26 0.60 105.19 107.96 1j5h n GLY 25 Ca 0.00 -0.04 -0.37 0.00 0.00 0.00 0.00 46.02 45.61 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 -1.95 0.00 0.99 7.94 -1.14 -4.75 117.00 116.94 1j5h n LEU 26 Ca 0.04 -1.11 0.00 0.00 -1.11 0.00 0.00 56.01 53.83 1j5h n LEU 26 Cb 0.04 -2.13 0.00 0.00 0.53 0.00 0.00 43.42 41.87 1j5h n LEU 26 CO 0.05 0.59 0.00 0.00 -1.11 0.00 0.00 177.39 176.92 1j5h n GLN 27 N -4.49 0.00 0.00 1.96 1.13 -0.66 -4.42 117.38 110.90 1j5h n GLN 27 Ca -0.10 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 54.96 1j5h n GLN 27 Cb 0.58 0.00 0.00 0.00 0.11 0.00 0.00 30.24 30.93 1j5h n GLN 27 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1j5h n ALA 28 N -3.00 0.00 -1.92 -1.58 0.00 -1.25 -3.59 120.51 109.16 1j5h n ALA 28 Ca 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 53.44 53.37 1j5h n ALA 28 Cb 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.44 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 -0.01 3.98 0.00 0.00 -1.17 -4.89 105.19 103.11 1j5h n GLY 29 Ca 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.82 1j5h n GLY 29 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1j5h s THR 30 N -2.02 3.63 0.39 2.61 2.01 -1.26 -4.65 115.64 116.35 1j5h s THR 30 Ca 0.00 -0.83 -0.23 0.00 0.31 0.00 0.00 61.69 60.93 1j5h s THR 30 Cb 0.00 -3.28 -0.10 0.00 0.01 0.00 0.00 72.50 69.13 1j5h s THR 30 CO 0.00 -0.14 0.97 0.00 -0.69 0.00 0.00 174.62 174.76 1j5h s ALA 31 N -2.38 3.09 -0.44 7.40 0.00 -1.26 -0.84 121.76 127.33 1j5h s ALA 31 Ca 0.50 0.52 0.05 0.00 0.00 0.00 0.00 51.96 53.03 1j5h s ALA 31 Cb -0.10 -3.19 0.19 0.00 0.00 0.00 0.00 23.12 20.02 1j5h s ALA 31 CO 0.34 0.04 0.49 0.66 0.00 0.00 0.00 175.76 177.29 1j5h n TYR 32 N -0.14 -1.75 -1.69 0.00 4.01 0.43 -4.56 117.16 113.45 1j5h n TYR 32 Ca 0.05 -2.75 -0.43 0.00 -0.16 0.00 0.00 57.90 54.61 1j5h n TYR 32 Cb 0.52 0.58 -0.01 0.00 -0.31 0.00 0.00 39.34 40.12 1j5h n TYR 32 CO 0.00 0.00 0.00 -3.47 -0.46 0.00 0.00 176.86 172.93 1j5h n ASP 33 N 2.66 2.77 -4.59 7.72 -0.08 -0.96 -1.60 116.55 122.46 1j5h n ASP 33 Ca 0.25 1.19 -0.32 0.00 -1.51 0.00 0.00 54.79 54.40 1j5h n ASP 33 Cb 0.51 -1.47 0.15 0.00 2.34 0.00 0.00 41.12 42.65 1j5h n ASP 33 CO 0.00 0.00 0.00 0.52 0.12 0.00 0.00 177.20 177.84 1j5h n VAL 34 N 0.81 0.27 0.00 5.18 0.31 0.20 0.25 118.33 125.34 1j5h n VAL 34 Ca 0.07 -0.09 0.00 0.00 -0.01 0.00 0.00 64.34 64.31 1j5h n VAL 34 Cb 0.35 -0.90 0.00 0.00 -0.91 0.00 0.00 33.84 32.38 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 0.70 0.57 1.64 2.92 0.00 0.42 -4.52 105.19 106.92 1j5h n GLY 35 Ca 0.11 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.12 1j5h n GLY 35 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1j5h n GLN 36 N -0.12 -1.59 -4.55 1.61 -0.06 -1.23 -4.14 117.38 107.30 1j5h n GLN 36 Ca 0.00 1.51 -0.30 0.00 -2.00 0.00 0.00 57.00 56.21 1j5h n GLN 36 Cb 0.00 -2.09 -0.07 0.00 -4.06 0.00 0.00 30.24 24.03 1j5h n GLN 36 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 1j5h s ALA 38 N -2.91 -0.16 0.58 0.00 0.00 0.35 -1.24 121.76 118.38 1j5h s ALA 38 Ca 0.05 -0.57 -0.20 0.00 0.00 0.00 0.00 51.96 51.24 1j5h s ALA 38 Cb 0.00 -1.70 -0.04 0.00 0.00 0.00 0.00 23.12 21.38 1j5h s ALA 38 CO 0.03 -1.72 1.28 -1.58 0.00 0.00 0.00 175.76 173.77 1j5h s TRP 39 N 2.24 2.32 0.00 0.00 0.51 -1.23 -1.07 118.94 121.70 1j5h s TRP 39 Ca 0.10 1.46 0.00 0.00 -2.12 0.00 0.00 56.10 55.54 1j5h s TRP 39 Cb -0.15 -3.64 0.00 0.00 -0.81 0.00 0.00 33.47 28.87 1j5h s TRP 39 CO -0.32 -2.57 0.00 0.28 -0.51 0.00 0.00 176.95 173.83 1j5h n VAL 40 N -1.36 0.00 -0.35 4.03 0.31 0.14 -4.41 118.33 116.69 1j5h n VAL 40 Ca 0.12 0.00 -0.28 0.00 -0.01 0.00 0.00 64.34 64.18 1j5h n VAL 40 Cb 0.47 0.00 0.26 0.00 -0.91 0.00 0.00 33.84 33.66 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 -3.46 -4.56 4.52 10.43 -1.25 -4.70 116.55 117.53 1j5h n ASP 41 Ca 0.00 -0.62 -0.24 0.00 2.57 0.00 0.00 54.79 56.49 1j5h n ASP 41 Cb 0.00 -1.01 -0.05 0.00 1.84 0.00 0.00 41.12 41.90 1j5h n ASP 41 CO 0.00 0.00 0.00 -0.89 -1.07 0.00 0.00 177.20 175.24 1j5h s THR 42 N -2.16 3.32 0.00 -3.53 2.01 -1.26 -1.23 115.64 112.79 1j5h s THR 42 Ca 0.61 -0.23 0.00 0.00 0.31 0.00 0.00 61.69 62.38 1j5h s THR 42 Cb -0.14 -3.73 0.00 0.00 0.01 0.00 0.00 72.50 68.64 1j5h s THR 42 CO 0.55 -0.69 0.00 0.61 -0.69 0.00 0.00 174.62 174.39 1j5h n GLY 43 N 6.75 2.44 3.68 4.40 0.00 -1.26 -5.07 105.19 116.12 1j5h n GLY 43 Ca 0.40 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 46.00 1j5h n GLY 43 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1j5h s VAL 44 N -2.23 4.58 -0.06 1.61 1.01 -0.36 -4.99 120.40 119.96 1j5h s VAL 44 Ca 0.00 1.88 -0.00 0.00 0.00 0.00 0.00 61.98 63.86 1j5h s VAL 44 Cb 0.00 -4.21 0.02 0.00 0.00 0.00 0.00 36.38 32.19 1j5h s VAL 44 CO 0.00 -0.04 -0.02 -0.22 0.00 0.00 0.00 175.10 174.81 1j5h s LEU 45 N 2.40 1.02 -0.58 3.92 0.20 -1.26 0.24 118.68 124.62 1j5h s LEU 45 Ca 0.50 -0.11 -0.05 0.00 0.69 0.00 0.00 54.13 55.16 1j5h s LEU 45 Cb -0.20 -0.45 0.15 0.00 -0.43 0.00 0.00 46.19 45.26 1j5h s LEU 45 CO 0.17 -0.12 0.41 0.00 -0.29 0.00 0.00 176.35 176.52 1j5h s ALA 46 N 1.38 3.52 0.61 5.97 0.00 -0.24 -3.41 121.76 129.60 1j5h s ALA 46 Ca -0.04 -3.00 -0.14 0.00 0.00 0.00 0.00 51.96 48.78 1j5h s ALA 46 Cb -0.13 -2.73 -0.03 0.00 0.00 0.00 0.00 23.12 20.22 1j5h s ALA 46 CO -0.03 -2.03 1.05 0.00 0.00 0.00 0.00 175.76 174.75 1j5h s ASN 48 N -3.16 5.33 0.00 0.00 3.84 0.28 0.87 114.94 122.10 1j5h s ASN 48 Ca 0.61 -3.82 0.00 0.00 0.21 0.00 0.00 52.86 49.86 1j5h s ASN 48 Cb -0.14 -1.75 0.00 0.00 -0.55 0.00 0.00 41.25 38.80 1j5h s ASN 48 CO 0.42 -0.12 0.83 -0.81 -2.79 0.00 0.00 177.10 174.62 1j5h n PRO 49 N 2.10 0.75 0.00 0.43 -0.04 -1.26 -2.12 135.00 134.86 1j5h n PRO 49 Ca 0.21 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.67 1j5h n PRO 49 Cb 0.36 -1.13 0.00 0.00 -0.04 0.00 0.00 33.50 32.69 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 0.73 2.09 -0.30 0.55 0.00 -1.26 -4.74 120.51 117.58 1j5h n ALA 50 Ca 0.00 -0.43 0.30 0.00 0.00 0.00 0.00 53.44 53.31 1j5h n ALA 50 Cb 0.37 0.00 0.55 0.00 0.00 0.00 0.00 19.45 20.37 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 -0.01 0.32 0.00 0.00 5.75 -0.90 -4.64 116.55 117.08 1j5h n ASP 51 Ca 0.00 1.54 0.00 0.00 -0.01 0.00 0.00 54.79 56.32 1j5h n ASP 51 Cb 0.04 -0.75 0.00 0.00 -1.03 0.00 0.00 41.12 39.38 1j5h n ASP 51 CO 0.00 0.00 0.00 0.49 -0.11 0.00 0.00 177.20 177.58 1j5h n PHE 52 N -5.09 0.00 -1.85 2.11 3.72 -1.26 -4.91 117.46 110.18 1j5h n PHE 52 Ca 0.35 0.00 -0.31 0.00 -0.05 0.00 0.00 57.45 57.45 1j5h n PHE 52 Cb 1.21 -0.54 0.03 0.00 -0.94 0.00 0.00 39.48 39.23 1j5h n PHE 52 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 176.76 175.59 1j5h s SER 53 N -1.72 5.81 -0.07 4.37 0.01 -1.26 -4.92 113.70 115.92 1j5h s SER 53 Ca 0.00 1.30 -0.26 0.00 1.31 0.00 0.00 55.95 58.30 1j5h s SER 53 Cb 0.00 -2.23 0.06 0.00 0.21 0.00 0.00 66.02 64.06 1j5h s SER 53 CO 0.00 -1.13 0.60 -0.94 0.41 0.00 0.00 173.24 172.18 1j5h s SER 54 N -4.23 -0.57 0.18 2.44 1.04 -1.26 0.59 113.70 111.88 1j5h s SER 54 Ca 0.57 0.69 0.02 0.00 0.48 0.00 0.00 55.95 57.70 1j5h s SER 54 Cb -0.11 0.62 -0.05 0.00 0.10 0.00 0.00 66.02 66.58 1j5h s SER 54 CO 0.53 -0.51 0.01 0.54 0.98 0.00 0.00 173.24 174.79 1j5h s VAL 55 N -0.96 0.65 0.13 5.02 0.11 -0.63 -4.83 120.40 119.89 1j5h s VAL 55 Ca -0.10 -1.98 0.07 0.00 -2.93 0.00 0.00 61.98 57.05 1j5h s VAL 55 Cb -0.02 -2.15 -0.04 0.00 -1.53 0.00 0.00 36.38 32.65 1j5h s VAL 55 CO 0.07 -0.45 -0.08 -0.89 -3.33 0.00 0.00 175.10 170.43 1j5h s THR 56 N -3.67 3.42 0.41 5.04 2.01 -1.26 -0.43 115.64 121.16 1j5h s THR 56 Ca 0.25 -1.34 -0.13 0.00 0.31 0.00 0.00 61.69 60.78 1j5h s THR 56 Cb 0.06 -2.64 -0.07 0.00 0.01 0.00 0.00 72.50 69.86 1j5h s THR 56 CO 0.04 0.04 0.81 0.00 -0.69 0.00 0.00 174.62 174.83 1j5h s ALA 57 N -1.37 3.27 -0.20 7.40 0.00 -0.02 -2.83 121.76 128.01 1j5h s ALA 57 Ca 0.23 -0.06 -0.01 0.00 0.00 0.00 0.00 51.96 52.13 1j5h s ALA 57 Cb -0.10 -2.82 0.02 0.00 0.00 0.00 0.00 23.12 20.21 1j5h s ALA 57 CO 0.15 0.01 -0.13 0.16 0.00 0.00 0.00 175.76 175.94 1j5h s ASP 58 N -2.95 3.68 0.00 0.00 1.47 0.22 -3.03 116.67 116.05 1j5h s ASP 58 Ca 0.54 -0.65 0.00 0.00 1.18 0.00 0.00 52.55 53.61 1j5h s ASP 58 Cb -0.10 -1.58 0.00 0.00 -0.34 0.00 0.00 42.92 40.90 1j5h s ASP 58 CO 0.28 -0.03 0.00 0.00 0.68 0.00 0.00 175.17 176.10 1j5h n ALA 59 N 4.66 0.00 -0.33 2.11 0.00 -1.26 0.12 120.51 125.81 1j5h n ALA 59 Ca -0.19 0.00 0.21 0.00 0.00 0.00 0.00 53.44 53.46 1j5h n ALA 59 Cb 0.49 0.00 0.41 0.00 0.00 0.00 0.00 19.45 20.35 1j5h n ALA 59 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 1j5h h ASN 60 N 0.00 -0.13 0.00 0.00 2.35 -1.94 -3.35 115.58 112.50 1j5h h ASN 60 Ca 0.00 0.27 0.00 0.00 -0.55 0.00 0.00 56.30 56.02 1j5h h ASN 60 Cb 0.00 0.39 0.00 0.00 0.05 0.00 0.00 38.32 38.76 1j5h h ASN 60 CO 0.00 -0.37 0.00 0.61 -1.65 0.00 0.00 177.43 176.02 1j5h n GLY 61 N -1.40 0.61 3.70 2.83 0.00 0.33 -3.91 105.19 107.36 1j5h n GLY 61 Ca 0.29 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.89 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 -0.77 6.96 0.46 1.61 0.15 -1.19 -1.65 113.70 119.27 1j5h s SER 62 Ca 0.00 2.07 -0.21 0.00 0.70 0.00 0.00 55.95 58.51 1j5h s SER 62 Cb 0.00 -2.57 -0.10 0.00 -1.71 0.00 0.00 66.02 61.64 1j5h s SER 62 CO 0.00 -0.60 1.00 0.00 1.20 0.00 0.00 173.24 174.84 1j5h s ALA 63 N 1.67 2.94 -0.20 5.45 0.00 -0.48 -0.61 121.76 130.53 1j5h s ALA 63 Ca 0.61 0.53 -0.04 0.00 0.00 0.00 0.00 51.96 53.06 1j5h s ALA 63 Cb -0.31 -3.21 0.09 0.00 0.00 0.00 0.00 23.12 19.69 1j5h s ALA 63 CO 0.27 -0.13 0.20 -1.54 0.00 0.00 0.00 175.76 174.56 1j5h s SER 64 N -2.05 1.67 -0.15 0.00 1.04 -1.13 0.45 113.70 113.53 1j5h s SER 64 Ca 0.65 -0.37 -0.34 0.00 0.48 0.00 0.00 55.95 56.37 1j5h s SER 64 Cb -0.14 0.24 0.15 0.00 0.10 0.00 0.00 66.02 66.37 1j5h s SER 64 CO 0.17 -0.34 1.42 0.28 0.98 0.00 0.00 173.24 175.75 1j5h s THR 65 N 2.28 0.00 -0.09 2.02 -1.32 0.49 -4.55 115.64 114.48 1j5h s THR 65 Ca 0.06 -0.02 -0.20 0.00 -1.21 0.00 0.00 61.69 60.32 1j5h s THR 65 Cb -0.16 -1.71 -0.04 0.00 -1.51 0.00 0.00 72.50 69.08 1j5h s THR 65 CO -0.14 0.00 0.57 -0.94 -2.21 0.00 0.00 174.62 171.90 1j5h s SER 66 N -2.72 6.82 0.12 8.08 1.04 -1.26 0.18 113.70 125.96 1j5h s SER 66 Ca 0.14 0.98 0.08 0.00 0.48 0.00 0.00 55.95 57.63 1j5h s SER 66 Cb 0.05 -2.34 -0.04 0.00 0.10 0.00 0.00 66.02 63.79 1j5h s SER 66 CO -0.05 -0.03 -0.13 -0.76 0.98 0.00 0.00 173.24 173.25 1j5h s LEU 67 N 0.62 2.91 -0.70 2.42 1.02 0.91 -4.86 118.68 121.01 1j5h s LEU 67 Ca 0.31 -0.48 -0.20 0.00 0.02 0.00 0.00 54.13 53.77 1j5h s LEU 67 Cb -0.16 -1.70 0.10 0.00 0.02 0.00 0.00 46.19 44.44 1j5h s LEU 67 CO 0.14 0.17 0.91 0.28 0.02 0.00 0.00 176.35 177.86 1j5h s THR 68 N -1.27 4.61 -1.24 5.49 -1.32 -1.26 -1.68 115.64 118.97 1j5h s THR 68 Ca 0.21 -0.89 -0.11 0.00 -1.21 0.00 0.00 61.69 59.69 1j5h s THR 68 Cb -0.11 -4.63 -0.06 0.00 -1.51 0.00 0.00 72.50 66.19 1j5h s THR 68 CO 0.13 -1.35 2.39 0.52 -2.21 0.00 0.00 174.62 174.10 1j5h n VAL 69 N 5.65 3.16 -1.58 5.08 0.31 -0.76 -4.75 118.33 125.44 1j5h n VAL 69 Ca 0.01 -2.15 -0.41 0.00 -0.01 0.00 0.00 64.34 61.77 1j5h n VAL 69 Cb 0.45 -2.42 0.01 0.00 -0.91 0.00 0.00 33.84 30.98 1j5h n VAL 69 CO 0.00 0.00 0.00 -2.11 -1.32 0.00 0.00 176.83 173.40 1j5h n ARG 70 N 4.83 1.16 -0.00 5.55 1.85 -1.26 -3.26 116.66 125.52 1j5h n ARG 70 Ca 0.58 0.42 -0.03 0.00 -1.00 0.00 0.00 57.85 57.82 1j5h n ARG 70 Cb 0.26 -1.94 -0.01 0.00 -1.05 0.00 0.00 32.46 29.72 1j5h n ARG 70 CO 0.00 0.00 0.00 -2.13 -0.01 0.00 0.00 177.63 175.49 1j5h n ARG 71 N 0.16 0.19 -2.31 2.89 0.00 -1.26 -4.63 116.66 111.71 1j5h n ARG 71 Ca 0.10 0.08 -0.34 0.00 -0.00 0.00 0.00 57.85 57.69 1j5h n ARG 71 Cb 0.40 -0.81 -0.04 0.00 0.00 0.00 0.00 32.46 32.01 1j5h n ARG 71 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.63 176.09 1j5h s SER 72 N -5.84 5.84 0.00 6.15 1.04 -1.26 -1.79 113.70 117.83 1j5h s SER 72 Ca -0.10 -1.18 0.00 0.00 0.48 0.00 0.00 55.95 55.14 1j5h s SER 72 Cb 0.01 -2.57 0.00 0.00 0.10 0.00 0.00 66.02 63.57 1j5h s SER 72 CO 0.16 -2.13 0.00 2.22 0.98 0.00 0.00 173.24 174.47 1j5h n PHE 73 N 11.43 -0.05 -3.48 5.02 -1.74 0.35 -4.78 117.46 124.20 1j5h n PHE 73 Ca 0.38 0.00 -0.12 0.00 -0.56 0.00 0.00 57.45 57.15 1j5h n PHE 73 Cb 0.49 0.00 -0.03 0.00 1.52 0.00 0.00 39.48 41.46 1j5h n PHE 73 CO 0.00 0.00 0.00 -1.21 -0.56 0.00 0.00 176.76 174.99 1j5h s GLU 74 N -1.90 1.25 0.00 3.97 0.41 -0.62 -1.29 118.70 120.53 1j5h s GLU 74 Ca 0.00 -0.54 0.00 0.00 -0.41 0.00 0.00 54.97 54.02 1j5h s GLU 74 Cb 0.00 0.57 0.00 0.00 -1.78 0.00 0.00 34.13 32.92 1j5h s GLU 74 CO 0.00 -0.54 0.00 0.41 -0.49 0.00 0.00 175.26 174.64 1j5h n GLY 75 N -0.35 5.58 3.51 -1.39 0.00 -1.22 -4.34 105.19 106.98 1j5h n GLY 75 Ca -0.16 -2.07 -0.33 0.00 0.00 0.00 0.00 46.02 43.45 1j5h n GLY 75 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1j5h s PHE 76 N 0.81 2.81 0.20 1.61 0.40 0.25 -0.32 117.98 123.74 1j5h s PHE 76 Ca 0.00 -0.12 -0.11 0.00 -0.60 0.00 0.00 56.93 56.10 1j5h s PHE 76 Cb 0.00 -1.68 0.26 0.00 0.51 0.00 0.00 43.02 42.11 1j5h s PHE 76 CO 0.00 0.22 1.69 -0.07 0.70 0.00 0.00 175.22 177.75 1j5h h LEU 77 N 5.42 -0.13 0.14 -0.37 -0.00 -0.83 -1.14 115.31 118.38 1j5h h LEU 77 Ca -0.46 0.12 -0.06 0.00 -0.00 0.00 0.00 57.88 57.49 1j5h h LEU 77 Cb 1.16 0.20 -0.02 0.00 -0.00 0.00 0.00 40.66 42.00 1j5h h LEU 77 CO 0.52 -0.05 -0.05 0.33 -0.00 0.00 0.00 178.44 179.18 1j5h n PHE 78 N -5.20 0.00 -1.86 1.13 7.35 -1.17 -4.48 117.46 113.23 1j5h n PHE 78 Ca 0.08 0.00 -0.05 0.00 -0.76 0.00 0.00 57.45 56.72 1j5h n PHE 78 Cb 0.31 -0.89 -0.05 0.00 0.35 0.00 0.00 39.48 39.20 1j5h n PHE 78 CO 0.00 0.00 0.00 -3.47 -0.76 0.00 0.00 176.76 172.53 1j5h n ASP 79 N 0.72 -0.64 0.00 -2.13 2.03 -1.26 -5.01 116.55 110.26 1j5h n ASP 79 Ca -0.03 -1.40 0.00 0.00 0.52 0.00 0.00 54.79 53.88 1j5h n ASP 79 Cb 0.14 0.19 0.00 0.00 -0.72 0.00 0.00 41.12 40.73 1j5h n ASP 79 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1j5h n GLY 80 N 0.00 -1.94 0.00 0.27 0.00 -1.26 -5.16 105.19 97.11 1j5h n GLY 80 Ca -0.18 0.64 0.00 0.00 0.00 0.00 0.00 46.02 46.48 1j5h n GLY 80 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1j5h n THR 81 N 0.00 0.00 -3.92 2.61 -1.04 -1.26 -5.05 114.28 105.62 1j5h n THR 81 Ca 0.00 0.00 -0.10 0.00 -2.04 0.00 0.00 64.05 61.91 1j5h n THR 81 Cb 0.00 0.00 -0.10 0.00 -1.82 0.00 0.00 70.33 68.41 1j5h n THR 81 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1j5h s ARG 82 N 3.46 0.43 0.00 -2.82 1.70 -1.26 -0.54 118.95 119.92 1j5h s ARG 82 Ca 0.00 -0.52 0.00 0.00 -0.47 0.00 0.00 55.73 54.74 1j5h s ARG 82 Cb 0.00 0.17 0.00 0.00 -0.57 0.00 0.00 34.95 34.55 1j5h s ARG 82 CO 0.00 -0.10 0.00 0.91 -1.08 0.00 0.00 175.30 175.03 1j5h n TRP 83 N 1.41 0.00 0.00 5.89 7.02 0.56 -4.83 117.44 127.49 1j5h n TRP 83 Ca -0.23 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.25 1j5h n TRP 83 Cb 0.56 -0.42 0.00 0.00 -2.42 0.00 0.00 31.31 29.03 1j5h n TRP 83 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1j5h n GLY 84 N 2.03 1.19 2.79 6.99 0.00 -1.15 -4.96 105.19 112.08 1j5h n GLY 84 Ca 0.00 -0.66 -0.16 0.00 0.00 0.00 0.00 46.02 45.20 1j5h n GLY 84 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1j5h s THR 85 N 0.00 -0.44 0.42 2.61 2.01 -1.26 -1.58 115.64 117.39 1j5h s THR 85 Ca 0.00 -0.47 0.04 0.00 0.31 0.00 0.00 61.69 61.56 1j5h s THR 85 Cb 0.00 -0.98 -0.04 0.00 0.01 0.00 0.00 72.50 71.49 1j5h s THR 85 CO 0.00 -0.44 0.06 0.54 -0.69 0.00 0.00 174.62 174.08 1j5h s VAL 86 N 2.36 1.15 -0.65 3.82 0.11 -0.41 -4.73 120.40 122.05 1j5h s VAL 86 Ca 0.10 -2.00 -0.27 0.00 -2.93 0.00 0.00 61.98 56.87 1j5h s VAL 86 Cb -0.14 -2.52 0.02 0.00 -1.53 0.00 0.00 36.38 32.21 1j5h s VAL 86 CO -0.32 0.00 1.39 -1.81 -3.33 0.00 0.00 175.10 171.03 1j5h s ASP 87 N -3.67 6.07 0.00 3.54 -0.00 -1.26 0.13 116.67 121.48 1j5h s ASP 87 Ca 0.24 -0.05 0.00 0.00 -0.00 0.00 0.00 52.55 52.74 1j5h s ASP 87 Cb 0.05 -2.55 0.00 0.00 -0.00 0.00 0.00 42.92 40.42 1j5h s ASP 87 CO 0.12 -1.83 0.00 0.00 -0.00 0.00 0.00 175.17 173.46 1j5h n THR 89 N 0.00 0.00 -0.10 0.00 5.66 -1.26 -4.43 114.28 114.15 1j5h n THR 89 Ca 0.00 0.00 -0.12 0.00 -3.05 0.00 0.00 64.05 60.88 1j5h n THR 89 Cb 0.00 -0.17 -0.12 0.00 -1.55 0.00 0.00 70.33 68.49 1j5h n THR 89 CO 0.00 0.00 0.00 0.41 -3.05 0.00 0.00 175.07 172.43 1j5h n THR 90 N -1.54 1.21 1.01 1.09 -1.04 -1.26 -4.41 114.28 109.35 1j5h n THR 90 Ca 0.00 -0.60 0.11 0.00 -2.04 0.00 0.00 64.05 61.51 1j5h n THR 90 Cb 0.00 -0.91 -0.03 0.00 -1.82 0.00 0.00 70.33 67.58 1j5h n THR 90 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1j5h n ALA 91 N -2.89 4.20 -1.98 2.41 0.00 -1.26 -5.03 120.51 115.97 1j5h n ALA 91 Ca -0.33 -0.58 -0.00 0.00 0.00 0.00 0.00 53.44 52.52 1j5h n ALA 91 Cb 0.98 -0.83 -0.00 0.00 0.00 0.00 0.00 19.45 19.60 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 -1.00 -3.21 -1.94 0.00 0.00 -1.26 -4.48 120.51 108.61 1j5h n ALA 92 Ca 0.06 0.32 -0.28 0.00 0.00 0.00 0.00 53.44 53.54 1j5h n ALA 92 Cb 0.37 -0.63 0.15 0.00 0.00 0.00 0.00 19.45 19.34 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 -5.66 0.60 -0.19 0.00 0.00 -0.37 -1.82 119.66 112.21 1j5h s GLN 94 Ca 0.70 -0.85 -0.01 0.00 -0.00 0.00 0.00 55.36 55.20 1j5h s GLN 94 Cb -0.06 0.23 0.05 0.00 0.00 0.00 0.00 33.01 33.24 1j5h s GLN 94 CO 0.50 -0.15 -0.03 0.08 0.00 0.00 0.00 175.29 175.69 1j5h s VAL 95 N -2.92 1.10 0.31 3.63 1.01 -0.72 -0.84 120.40 121.96 1j5h s VAL 95 Ca -0.02 -0.80 0.06 0.00 0.00 0.00 0.00 61.98 61.21 1j5h s VAL 95 Cb 0.01 -1.38 -0.03 0.00 0.00 0.00 0.00 36.38 34.97 1j5h s VAL 95 CO -0.06 -0.03 0.24 -0.83 0.00 0.00 0.00 175.10 174.42 1j5h s GLY 96 N 1.61 2.18 0.16 4.51 0.00 -1.26 -2.79 107.32 111.73 1j5h s GLY 96 Ca -0.02 -1.96 0.04 0.00 0.00 0.00 0.00 44.72 42.79 1j5h s GLY 96 CO -0.07 -1.48 0.19 1.08 0.00 0.00 0.00 173.10 172.82 1j5h s LEU 97 N -3.35 4.01 -0.28 0.66 2.01 -1.26 -0.44 118.68 120.04 1j5h s LEU 97 Ca 0.39 -0.01 -0.10 0.00 0.01 0.00 0.00 54.13 54.42 1j5h s LEU 97 Cb 0.03 -2.61 0.11 0.00 0.01 0.00 0.00 46.19 43.74 1j5h s LEU 97 CO 0.24 0.06 0.61 -0.55 1.01 0.00 0.00 176.35 177.72 1j5h s SER 98 N -3.16 -0.95 0.74 2.29 0.15 0.14 -4.45 113.70 108.47 1j5h s SER 98 Ca 0.32 1.45 -0.06 0.00 0.70 0.00 0.00 55.95 58.37 1j5h s SER 98 Cb -0.10 1.95 0.11 0.00 -1.71 0.00 0.00 66.02 66.26 1j5h s SER 98 CO 0.25 -0.22 1.04 -1.81 1.20 0.00 0.00 173.24 173.70 1j5h s ASP 99 N 2.60 4.40 -0.10 5.45 1.11 -1.26 -2.26 116.67 126.60 1j5h s ASP 99 Ca -0.06 0.11 0.03 0.00 0.18 0.00 0.00 52.55 52.81 1j5h s ASP 99 Cb -0.11 -0.59 0.22 0.00 1.07 0.00 0.00 42.92 43.52 1j5h s ASP 99 CO -0.18 -1.85 1.07 0.00 1.18 0.00 0.00 175.17 175.39 1j5h n ALA 100 N -2.99 3.16 0.00 5.23 0.00 -1.26 -3.95 120.51 120.71 1j5h n ALA 100 Ca 0.12 -0.71 0.00 0.00 0.00 0.00 0.00 53.44 52.84 1j5h n ALA 100 Cb 0.60 -1.09 0.00 0.00 0.00 0.00 0.00 19.45 18.97 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 0.10 0.00 0.04 0.00 0.00 -1.26 -5.05 120.51 114.34 1j5h n ALA 101 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.57 1j5h n ALA 101 Cb 0.69 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.14 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 0.00 -0.16 0.00 0.00 0.00 -1.25 -5.15 105.19 98.63 1j5h n GLY 102 Ca 0.00 0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.03 1j5h n GLY 102 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1j5h n ASN 103 N -2.77 0.49 0.00 1.61 5.03 -1.26 -4.89 115.26 113.47 1j5h n ASN 103 Ca 0.00 -0.63 0.00 0.00 0.87 0.00 0.00 54.58 54.82 1j5h n ASN 103 Cb 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 39.78 38.76 1j5h n ASN 103 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1j5h n GLY 104 N 1.21 1.75 3.66 7.41 0.00 -1.26 -4.16 105.19 113.80 1j5h n GLY 104 Ca 0.00 0.23 -0.43 0.00 0.00 0.00 0.00 46.02 45.83 1j5h n GLY 104 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1j5h s PRO 105 N 3.68 4.23 0.00 1.61 0.04 -1.26 -4.65 135.00 138.65 1j5h s PRO 105 Ca 0.00 1.67 0.00 0.00 0.04 0.00 0.00 61.00 62.71 1j5h s PRO 105 Cb 0.00 -3.77 0.00 0.00 0.04 0.00 0.00 34.50 30.77 1j5h s PRO 105 CO 0.00 -0.71 0.00 0.39 0.04 0.00 0.00 177.00 176.72 1j5h n GLU 106 N 6.60 0.00 -0.94 4.56 4.71 -1.26 -5.17 120.64 129.15 1j5h n GLU 106 Ca 0.14 0.00 -0.30 0.00 -0.01 0.00 0.00 57.16 56.99 1j5h n GLU 106 Cb 0.45 0.00 0.24 0.00 -1.01 0.00 0.00 31.44 31.11 1j5h n GLU 106 CO 0.00 0.00 0.00 0.20 0.09 0.00 0.00 177.13 177.42 1j5h s GLY 107 N 0.00 1.55 -0.24 0.62 0.00 -1.26 -4.70 107.32 103.29 1j5h s GLY 107 Ca 0.00 -0.74 -0.09 0.00 0.00 0.00 0.00 44.72 43.88 1j5h s GLY 107 CO 0.00 0.10 0.13 0.54 0.00 0.00 0.00 173.10 173.86 1j5h s VAL 108 N -2.83 5.02 -0.30 1.40 0.11 -1.12 -4.72 120.40 117.96 1j5h s VAL 108 Ca 0.69 0.06 -0.29 0.00 -2.93 0.00 0.00 61.98 59.52 1j5h s VAL 108 Cb -0.13 -3.34 -0.07 0.00 -1.53 0.00 0.00 36.38 31.31 1j5h s VAL 108 CO 0.57 0.35 2.26 0.00 -3.33 0.00 0.00 175.10 174.96 1j5h n ALA 109 N 4.42 1.49 -2.56 1.54 0.00 -1.26 -1.75 120.51 122.39 1j5h n ALA 109 Ca -0.15 -0.35 -0.30 0.00 0.00 0.00 0.00 53.44 52.64 1j5h n ALA 109 Cb 0.52 -2.91 -0.10 0.00 0.00 0.00 0.00 19.45 16.96 1j5h n ALA 109 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1j5h s ILE 110 N 8.90 3.29 -0.50 0.00 1.01 -0.76 -4.98 121.20 128.17 1j5h s ILE 110 Ca 1.02 -1.24 -0.21 0.00 0.00 0.00 0.00 60.65 60.22 1j5h s ILE 110 Cb -0.40 -2.51 0.04 0.00 0.01 0.00 0.00 42.46 39.60 1j5h s ILE 110 CO 0.36 0.16 0.73 -0.55 0.00 0.00 0.00 174.94 175.63 1j5h s SER 111 N -2.06 6.29 -0.02 3.58 0.15 -0.74 -4.25 113.70 116.65 1j5h s SER 111 Ca 0.20 -0.55 -0.25 0.00 0.70 0.00 0.00 55.95 56.05 1j5h s SER 111 Cb -0.11 -2.34 -0.04 0.00 -1.71 0.00 0.00 66.02 61.81 1j5h s SER 111 CO 0.12 -0.96 0.75 -0.36 1.20 0.00 0.00 173.24 173.99 1j5h s PHE 112 N 3.09 3.64 0.00 3.44 0.40 -1.26 -1.81 117.98 125.48 1j5h s PHE 112 Ca 0.22 1.37 0.00 0.00 -0.60 0.00 0.00 56.93 57.92 1j5h s PHE 112 Cb -0.16 -2.84 0.00 0.00 0.51 0.00 0.00 43.02 40.53 1j5h s PHE 112 CO 0.17 0.14 0.00 -1.71 0.70 0.00 0.00 175.22 174.52