#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1j5h n ALA 2 N 0.00 0.00 -2.32 0.00 0.00 -1.26 -5.06 120.51 111.88 1j5h n ALA 2 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 53.09 1j5h n ALA 2 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.42 1j5h n ALA 2 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1j5h s PRO 3 N 0.00 3.19 -0.28 0.00 0.04 -1.24 -4.28 135.00 132.42 1j5h s PRO 3 Ca 0.00 -1.30 -0.23 0.00 0.04 0.00 0.00 61.00 59.51 1j5h s PRO 3 Cb 0.00 -5.33 0.12 0.00 0.04 0.00 0.00 34.50 29.32 1j5h s PRO 3 CO 0.00 -3.01 0.96 0.95 0.04 0.00 0.00 177.00 175.94 1j5h s THR 4 N 7.59 0.00 0.38 1.26 -4.23 0.18 -4.74 115.64 116.08 1j5h s THR 4 Ca 0.60 0.00 0.07 0.00 -1.18 0.00 0.00 61.69 61.18 1j5h s THR 4 Cb 0.00 -1.00 0.00 0.00 1.34 0.00 0.00 72.50 72.84 1j5h s THR 4 CO 0.05 0.00 0.53 0.00 -0.54 0.00 0.00 174.62 174.66 1j5h s ALA 5 N 0.45 4.38 0.08 3.99 0.00 -1.26 0.27 121.76 129.67 1j5h s ALA 5 Ca 0.01 -1.56 -0.18 0.00 0.00 0.00 0.00 51.96 50.22 1j5h s ALA 5 Cb -0.05 -1.66 0.04 0.00 0.00 0.00 0.00 23.12 21.45 1j5h s ALA 5 CO -0.07 -0.17 0.43 0.95 0.00 0.00 0.00 175.76 176.90 1j5h s THR 6 N -2.28 0.05 -0.07 0.00 -4.23 0.14 -4.05 115.64 105.21 1j5h s THR 6 Ca 0.50 -0.44 0.05 0.00 -1.18 0.00 0.00 61.69 60.62 1j5h s THR 6 Cb -0.10 -1.04 -0.01 0.00 1.34 0.00 0.00 72.50 72.70 1j5h s THR 6 CO 0.32 -0.24 -0.24 -0.69 -0.54 0.00 0.00 174.62 173.22 1j5h s VAL 7 N -3.00 2.05 0.11 2.29 1.01 -1.26 -1.02 120.40 120.58 1j5h s VAL 7 Ca -0.02 -1.04 -0.21 0.00 0.00 0.00 0.00 61.98 60.71 1j5h s VAL 7 Cb 0.00 -1.75 -0.05 0.00 0.00 0.00 0.00 36.38 34.59 1j5h s VAL 7 CO -0.06 0.56 1.12 0.41 0.00 0.00 0.00 175.10 177.13 1j5h n THR 8 N 3.19 -0.46 -0.23 3.92 -1.04 -0.66 -4.44 114.28 114.57 1j5h n THR 8 Ca -0.18 1.76 0.00 0.00 -2.04 0.00 0.00 64.05 63.58 1j5h n THR 8 Cb 0.52 -2.18 0.00 0.00 -1.82 0.00 0.00 70.33 66.85 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 -4.72 0.54 -0.76 -2.82 -0.04 -1.26 -5.04 135.00 120.90 1j5h n PRO 9 Ca 0.01 0.00 -0.01 0.00 -0.04 0.00 0.00 63.50 63.47 1j5h n PRO 9 Cb 0.18 0.00 -0.01 0.00 -0.04 0.00 0.00 33.50 33.63 1j5h n PRO 9 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1j5h n SER 10 N -0.92 -0.04 -3.23 3.54 2.88 -1.26 -5.04 113.62 109.55 1j5h n SER 10 Ca 0.00 -1.64 -0.02 0.00 -1.33 0.00 0.00 58.87 55.87 1j5h n SER 10 Cb 0.00 -0.04 -0.03 0.00 -0.75 0.00 0.00 64.21 63.39 1j5h n SER 10 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 1j5h s SER 11 N -0.80 -0.63 0.00 -3.46 0.01 -1.26 -1.65 113.70 105.91 1j5h s SER 11 Ca 0.05 -0.02 0.00 0.00 1.31 0.00 0.00 55.95 57.30 1j5h s SER 11 Cb 0.06 1.59 0.00 0.00 0.21 0.00 0.00 66.02 67.88 1j5h s SER 11 CO -0.03 -0.32 0.82 0.61 0.41 0.00 0.00 173.24 174.73 1j5h n GLY 12 N 5.39 -0.20 0.00 3.44 0.00 0.52 -4.63 105.19 109.71 1j5h n GLY 12 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.04 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 -0.34 0.00 -4.62 0.99 4.77 0.30 -3.46 117.00 114.64 1j5h n LEU 13 Ca 0.00 0.00 -0.44 0.00 -0.03 0.00 0.00 56.01 55.54 1j5h n LEU 13 Cb 0.08 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.13 1j5h n LEU 13 CO 0.00 0.00 1.72 -1.20 -1.33 0.00 0.00 177.39 176.58 1j5h n SER 14 N -0.87 3.59 -4.52 -1.43 7.64 -1.26 -4.37 113.62 112.39 1j5h n SER 14 Ca 0.00 0.56 -0.39 0.00 1.01 0.00 0.00 58.87 60.05 1j5h n SER 14 Cb 0.00 -1.51 -0.08 0.00 -1.01 0.00 0.00 64.21 61.61 1j5h n SER 14 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 1j5h n ASP 15 N 9.47 1.61 -0.05 6.43 2.03 -1.22 0.26 116.55 135.08 1j5h n ASP 15 Ca 0.26 -0.17 0.00 0.00 0.52 0.00 0.00 54.79 55.40 1j5h n ASP 15 Cb 0.41 -1.32 0.00 0.00 -0.72 0.00 0.00 41.12 39.48 1j5h n ASP 15 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1j5h n GLY 16 N 6.23 1.24 3.56 0.27 0.00 -1.01 -4.61 105.19 110.88 1j5h n GLY 16 Ca 0.47 -0.11 -0.16 0.00 0.00 0.00 0.00 46.02 46.22 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 -2.10 3.11 -0.66 2.61 2.01 0.14 -4.18 115.64 116.56 1j5h s THR 17 Ca 0.00 -0.11 -0.27 0.00 0.31 0.00 0.00 61.69 61.62 1j5h s THR 17 Cb 0.00 -3.40 0.01 0.00 0.01 0.00 0.00 72.50 69.11 1j5h s THR 17 CO 0.00 -0.22 1.55 -0.69 -0.69 0.00 0.00 174.62 174.57 1j5h s VAL 18 N 14.23 3.57 0.29 3.82 1.01 -1.25 -1.75 120.40 140.33 1j5h s VAL 18 Ca 0.86 0.35 0.02 0.00 0.00 0.00 0.00 61.98 63.22 1j5h s VAL 18 Cb -0.10 -4.43 -0.05 0.00 0.00 0.00 0.00 36.38 31.80 1j5h s VAL 18 CO 0.08 -1.36 0.10 0.68 0.00 0.00 0.00 175.10 174.60 1j5h s VAL 19 N 7.21 0.67 0.35 2.92 -7.23 -0.73 -4.84 120.40 118.75 1j5h s VAL 19 Ca 0.51 -2.00 -0.26 0.00 -1.81 0.00 0.00 61.98 58.42 1j5h s VAL 19 Cb -0.10 -2.64 -0.13 0.00 0.56 0.00 0.00 36.38 34.07 1j5h s VAL 19 CO 0.19 0.00 0.99 0.29 -0.31 0.00 0.00 175.10 176.26 1j5h n LYS 20 N -0.56 1.34 -3.71 4.82 5.02 -1.26 -0.74 118.16 123.07 1j5h n LYS 20 Ca -0.01 0.47 -0.12 0.00 -2.02 0.00 0.00 58.31 56.64 1j5h n LYS 20 Cb 0.66 -1.92 -0.12 0.00 -0.02 0.00 0.00 35.03 33.63 1j5h n LYS 20 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1j5h s VAL 21 N -1.17 -0.11 0.15 -0.18 1.01 0.43 -1.65 120.40 118.88 1j5h s VAL 21 Ca 0.60 0.15 0.05 0.00 0.00 0.00 0.00 61.98 62.79 1j5h s VAL 21 Cb -0.64 -0.45 -0.04 0.00 0.00 0.00 0.00 36.38 35.25 1j5h s VAL 21 CO 0.59 0.06 -0.11 0.00 0.00 0.00 0.00 175.10 175.65 1j5h s ALA 22 N 1.49 1.51 0.00 5.51 0.00 -0.19 0.18 121.76 130.27 1j5h s ALA 22 Ca -0.08 -1.51 0.00 0.00 0.00 0.00 0.00 51.96 50.37 1j5h s ALA 22 Cb -0.10 0.03 0.00 0.00 0.00 0.00 0.00 23.12 23.05 1j5h s ALA 22 CO -0.10 -0.08 0.00 0.41 0.00 0.00 0.00 175.76 175.99 1j5h n GLY 23 N -0.22 0.87 0.00 0.00 0.00 0.16 0.26 105.19 106.27 1j5h n GLY 23 Ca -0.10 -2.06 0.00 0.00 0.00 0.00 0.00 46.02 43.86 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 1.44 0.00 0.27 4.61 0.00 0.14 -1.40 120.51 125.58 1j5h n ALA 24 Ca 0.00 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.46 1j5h n ALA 24 Cb 0.00 0.00 0.13 0.00 0.00 0.00 0.00 19.45 19.58 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 -0.27 3.72 0.00 0.00 -1.26 0.51 105.19 107.89 1j5h n GLY 25 Ca 0.00 -0.03 -0.32 0.00 0.00 0.00 0.00 46.02 45.67 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 -1.11 -2.59 0.00 0.99 7.94 -1.03 -4.40 117.00 116.80 1j5h n LEU 26 Ca 0.03 -1.02 0.00 0.00 -1.11 0.00 0.00 56.01 53.91 1j5h n LEU 26 Cb 0.02 -2.28 0.00 0.00 0.53 0.00 0.00 43.42 41.69 1j5h n LEU 26 CO 0.03 0.46 0.00 1.67 -1.11 0.00 0.00 177.39 178.44 1j5h n GLN 27 N -4.14 0.00 0.00 1.96 7.27 -0.13 -4.53 117.38 117.80 1j5h n GLN 27 Ca -0.10 0.00 0.00 0.00 0.07 0.00 0.00 57.00 56.97 1j5h n GLN 27 Cb 0.59 0.00 0.00 0.00 2.41 0.00 0.00 30.24 33.24 1j5h n GLN 27 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1j5h n ALA 28 N -3.00 0.00 -3.96 1.69 0.00 -1.26 -3.62 120.51 110.36 1j5h n ALA 28 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 53.44 53.12 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 -0.47 3.55 0.00 0.00 -1.18 -4.91 105.19 102.18 1j5h n GLY 29 Ca 0.00 0.14 -0.25 0.00 0.00 0.00 0.00 46.02 45.91 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 -3.21 3.00 0.64 2.61 2.01 -1.26 -4.75 115.64 114.69 1j5h s THR 30 Ca 0.66 -1.92 -0.18 0.00 0.31 0.00 0.00 61.69 60.56 1j5h s THR 30 Cb -0.35 -2.53 -0.01 0.00 0.01 0.00 0.00 72.50 69.62 1j5h s THR 30 CO 0.81 -0.23 1.23 0.00 -0.69 0.00 0.00 174.62 175.74 1j5h s ALA 31 N -2.01 2.39 -0.45 7.40 0.00 -1.26 -0.66 121.76 127.16 1j5h s ALA 31 Ca 0.27 1.04 0.05 0.00 0.00 0.00 0.00 51.96 53.32 1j5h s ALA 31 Cb -0.07 -3.49 0.18 0.00 0.00 0.00 0.00 23.12 19.74 1j5h s ALA 31 CO 0.16 -1.47 0.52 0.66 0.00 0.00 0.00 175.76 175.62 1j5h n TYR 32 N -1.96 -2.14 -1.67 0.00 4.01 0.12 -4.65 117.16 110.87 1j5h n TYR 32 Ca 0.14 -2.50 -0.50 0.00 -0.16 0.00 0.00 57.90 54.88 1j5h n TYR 32 Cb 0.49 0.76 -0.05 0.00 -0.31 0.00 0.00 39.34 40.23 1j5h n TYR 32 CO 0.00 0.00 0.00 -0.25 -0.46 0.00 0.00 176.86 176.15 1j5h n ASP 33 N 2.79 2.77 -4.75 7.72 8.00 0.17 -1.71 116.55 131.55 1j5h n ASP 33 Ca 0.24 1.05 -0.36 0.00 0.71 0.00 0.00 54.79 56.44 1j5h n ASP 33 Cb 0.52 -1.30 0.05 0.00 -0.02 0.00 0.00 41.12 40.36 1j5h n ASP 33 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1j5h s VAL 34 N 2.33 2.52 -0.06 2.53 1.01 0.27 -0.28 120.40 128.72 1j5h s VAL 34 Ca 0.88 0.31 -0.09 0.00 0.00 0.00 0.00 61.98 63.08 1j5h s VAL 34 Cb -0.82 -3.07 0.02 0.00 0.00 0.00 0.00 36.38 32.51 1j5h s VAL 34 CO 0.50 -0.08 0.23 -0.83 0.00 0.00 0.00 175.10 174.91 1j5h s GLY 35 N -1.67 -0.13 -0.14 4.51 0.00 0.78 -4.27 107.32 106.41 1j5h s GLY 35 Ca 0.77 0.46 -0.01 0.00 0.00 0.00 0.00 44.72 45.94 1j5h s GLY 35 CO 0.36 0.34 -0.02 1.20 0.00 0.00 0.00 173.10 174.99 1j5h s GLN 36 N -0.39 0.98 0.38 2.90 -0.21 -1.26 -0.03 119.66 122.03 1j5h s GLN 36 Ca -0.05 -0.27 0.04 0.00 0.02 0.00 0.00 55.36 55.10 1j5h s GLN 36 Cb -0.03 -1.67 -0.05 0.00 1.00 0.00 0.00 33.01 32.25 1j5h s GLN 36 CO 0.01 -0.43 0.06 0.00 -2.12 0.00 0.00 175.29 172.81 1j5h s ALA 38 N -3.14 -0.35 0.10 0.00 0.00 0.15 0.13 121.76 118.65 1j5h s ALA 38 Ca 0.30 -0.58 -0.15 0.00 0.00 0.00 0.00 51.96 51.53 1j5h s ALA 38 Cb 0.07 0.72 -0.07 0.00 0.00 0.00 0.00 23.12 23.84 1j5h s ALA 38 CO 0.14 -0.63 0.52 -1.58 0.00 0.00 0.00 175.76 174.22 1j5h s TRP 39 N -3.90 3.67 0.00 0.00 0.51 -1.18 -0.79 118.94 117.26 1j5h s TRP 39 Ca 0.10 1.08 0.00 0.00 -2.12 0.00 0.00 56.10 55.16 1j5h s TRP 39 Cb 0.03 -2.37 0.00 0.00 -0.81 0.00 0.00 33.47 30.32 1j5h s TRP 39 CO -0.06 0.51 0.00 0.28 -0.51 0.00 0.00 176.95 177.17 1j5h n VAL 40 N 1.18 0.00 -0.19 4.03 0.31 0.18 -4.71 118.33 119.13 1j5h n VAL 40 Ca -0.08 0.00 -0.21 0.00 -0.01 0.00 0.00 64.34 64.04 1j5h n VAL 40 Cb 0.52 0.00 0.21 0.00 -0.91 0.00 0.00 33.84 33.65 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 -3.52 -4.56 4.52 9.92 -1.22 -4.69 116.55 116.99 1j5h n ASP 41 Ca 0.00 -0.62 -0.27 0.00 -0.53 0.00 0.00 54.79 53.37 1j5h n ASP 41 Cb 0.00 -0.72 -0.05 0.00 -0.64 0.00 0.00 41.12 39.71 1j5h n ASP 41 CO 0.00 0.00 0.00 -0.89 0.13 0.00 0.00 177.20 176.44 1j5h s THR 42 N -1.80 3.46 0.00 -3.53 2.01 -1.26 -1.50 115.64 113.02 1j5h s THR 42 Ca 0.47 -0.39 0.00 0.00 0.31 0.00 0.00 61.69 62.08 1j5h s THR 42 Cb -0.08 -4.03 0.00 0.00 0.01 0.00 0.00 72.50 68.39 1j5h s THR 42 CO 0.39 -0.97 0.00 0.61 -0.69 0.00 0.00 174.62 173.97 1j5h n GLY 43 N 6.84 0.66 3.83 4.40 0.00 -1.26 -5.08 105.19 114.57 1j5h n GLY 43 Ca 0.40 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 46.05 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 -2.00 5.22 0.02 1.61 1.01 -0.56 -5.02 120.40 120.69 1j5h s VAL 44 Ca 0.00 0.60 0.03 0.00 0.00 0.00 0.00 61.98 62.61 1j5h s VAL 44 Cb 0.00 -3.61 -0.02 0.00 0.00 0.00 0.00 36.38 32.76 1j5h s VAL 44 CO 0.00 0.55 -0.10 -0.22 0.00 0.00 0.00 175.10 175.33 1j5h s LEU 45 N -0.77 2.13 -0.12 3.92 0.20 -1.26 0.51 118.68 123.29 1j5h s LEU 45 Ca 0.20 -0.36 0.01 0.00 0.69 0.00 0.00 54.13 54.67 1j5h s LEU 45 Cb -0.15 -0.41 0.02 0.00 -0.43 0.00 0.00 46.19 45.22 1j5h s LEU 45 CO 0.09 -0.00 -0.12 0.00 -0.29 0.00 0.00 176.35 176.03 1j5h s ALA 46 N -0.72 1.59 0.32 5.97 0.00 0.03 -4.55 121.76 124.41 1j5h s ALA 46 Ca -0.01 -0.70 0.01 0.00 0.00 0.00 0.00 51.96 51.26 1j5h s ALA 46 Cb -0.06 -0.92 -0.03 0.00 0.00 0.00 0.00 23.12 22.11 1j5h s ALA 46 CO 0.00 -0.29 0.51 0.00 0.00 0.00 0.00 175.76 175.99 1j5h s ASN 48 N -3.95 5.30 0.00 0.00 2.47 0.41 -0.91 114.94 118.27 1j5h s ASN 48 Ca 0.39 -2.60 0.00 0.00 0.42 0.00 0.00 52.86 51.07 1j5h s ASN 48 Cb -0.10 -1.86 0.00 0.00 -1.45 0.00 0.00 41.25 37.84 1j5h s ASN 48 CO 0.34 -0.43 1.46 -0.81 -3.72 0.00 0.00 177.10 173.95 1j5h n PRO 49 N 3.84 0.75 0.00 0.43 -0.04 -1.26 -2.35 135.00 136.37 1j5h n PRO 49 Ca 0.05 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.51 1j5h n PRO 49 Cb 0.39 -1.13 0.00 0.00 -0.04 0.00 0.00 33.50 32.72 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 1.58 1.33 -0.17 0.55 0.00 -1.26 -4.81 120.51 117.74 1j5h n ALA 50 Ca 0.00 -0.25 -0.06 0.00 0.00 0.00 0.00 53.44 53.13 1j5h n ALA 50 Cb 0.37 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.82 1j5h n ALA 50 CO 0.00 0.00 0.00 0.38 0.00 0.00 0.00 177.50 177.88 1j5h h ASP 51 N 0.00 -1.09 0.00 0.00 2.03 -1.75 -3.42 116.42 112.19 1j5h h ASP 51 Ca 0.00 0.21 0.00 0.00 -0.73 0.00 0.00 57.03 56.51 1j5h h ASP 51 Cb 0.22 0.53 0.00 0.00 -0.83 0.00 0.00 39.33 39.25 1j5h h ASP 51 CO 0.00 -0.30 0.00 0.49 -1.03 0.00 0.00 179.24 178.40 1j5h n PHE 52 N -5.42 0.00 -0.80 4.15 3.72 -1.26 -4.86 117.46 112.99 1j5h n PHE 52 Ca 0.03 0.00 -0.25 0.00 -0.05 0.00 0.00 57.45 57.18 1j5h n PHE 52 Cb 0.34 0.00 0.01 0.00 -0.94 0.00 0.00 39.48 38.89 1j5h n PHE 52 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 1j5h n SER 53 N 0.62 -2.36 -3.81 4.37 7.64 -1.26 -4.52 113.62 114.30 1j5h n SER 53 Ca 0.00 0.42 -0.12 0.00 1.01 0.00 0.00 58.87 60.17 1j5h n SER 53 Cb 0.00 -0.54 -0.11 0.00 -1.01 0.00 0.00 64.21 62.54 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 -0.64 -0.18 0.35 6.43 1.04 -1.26 0.93 113.70 120.37 1j5h s SER 54 Ca 0.36 0.32 0.04 0.00 0.48 0.00 0.00 55.95 57.15 1j5h s SER 54 Cb -0.32 0.40 -0.03 0.00 0.10 0.00 0.00 66.02 66.17 1j5h s SER 54 CO 0.42 -0.14 0.14 0.54 0.98 0.00 0.00 173.24 175.19 1j5h s VAL 55 N -0.18 0.51 0.19 5.02 0.11 -0.69 -4.83 120.40 120.54 1j5h s VAL 55 Ca -0.03 -2.00 0.09 0.00 -2.93 0.00 0.00 61.98 57.11 1j5h s VAL 55 Cb -0.03 -2.47 -0.04 0.00 -1.53 0.00 0.00 36.38 32.31 1j5h s VAL 55 CO 0.01 0.00 -0.17 -0.89 -3.33 0.00 0.00 175.10 170.71 1j5h s THR 56 N -3.40 1.89 0.37 5.04 2.01 -1.26 0.11 115.64 120.41 1j5h s THR 56 Ca 0.31 -2.08 -0.08 0.00 0.31 0.00 0.00 61.69 60.15 1j5h s THR 56 Cb 0.04 -1.97 -0.06 0.00 0.01 0.00 0.00 72.50 70.52 1j5h s THR 56 CO 0.17 -0.41 0.70 0.00 -0.69 0.00 0.00 174.62 174.39 1j5h s ALA 57 N -2.39 3.44 -0.18 7.40 0.00 0.16 -3.22 121.76 126.97 1j5h s ALA 57 Ca 0.20 -0.33 0.00 0.00 0.00 0.00 0.00 51.96 51.83 1j5h s ALA 57 Cb -0.04 -2.57 0.01 0.00 0.00 0.00 0.00 23.12 20.52 1j5h s ALA 57 CO 0.08 0.05 -0.16 0.16 0.00 0.00 0.00 175.76 175.88 1j5h s ASP 58 N -3.21 3.43 0.00 0.00 1.47 -0.06 -3.10 116.67 115.21 1j5h s ASP 58 Ca 0.49 -0.57 0.00 0.00 1.18 0.00 0.00 52.55 53.65 1j5h s ASP 58 Cb -0.10 -1.54 0.00 0.00 -0.34 0.00 0.00 42.92 40.94 1j5h s ASP 58 CO 0.32 0.02 0.00 0.00 0.68 0.00 0.00 175.17 176.18 1j5h n ALA 59 N 4.53 0.00 -0.33 2.11 0.00 -1.26 0.18 120.51 125.73 1j5h n ALA 59 Ca -0.20 0.00 0.20 0.00 0.00 0.00 0.00 53.44 53.44 1j5h n ALA 59 Cb 0.51 0.00 0.38 0.00 0.00 0.00 0.00 19.45 20.33 1j5h n ALA 59 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1j5h n ASN 60 N 0.79 0.02 0.00 0.00 4.13 -1.26 -3.96 115.26 114.97 1j5h n ASN 60 Ca 0.00 1.66 0.00 0.00 1.68 0.00 0.00 54.58 57.92 1j5h n ASN 60 Cb 0.00 -0.67 0.00 0.00 -1.54 0.00 0.00 39.78 37.57 1j5h n ASN 60 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1j5h n GLY 61 N -1.43 0.78 3.72 7.41 0.00 0.47 -3.99 105.19 112.15 1j5h n GLY 61 Ca 0.27 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.88 1j5h n GLY 61 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1j5h s SER 62 N -0.83 7.44 0.77 1.61 0.01 -1.20 -0.96 113.70 120.54 1j5h s SER 62 Ca 0.00 1.73 -0.12 0.00 1.31 0.00 0.00 55.95 58.87 1j5h s SER 62 Cb 0.00 -2.58 0.06 0.00 0.21 0.00 0.00 66.02 63.71 1j5h s SER 62 CO 0.00 -0.12 1.12 0.00 0.41 0.00 0.00 173.24 174.65 1j5h s ALA 63 N 0.30 2.13 -0.29 1.44 0.00 -0.49 -0.88 121.76 123.97 1j5h s ALA 63 Ca 0.48 0.47 0.04 0.00 0.00 0.00 0.00 51.96 52.95 1j5h s ALA 63 Cb -0.22 -3.34 0.19 0.00 0.00 0.00 0.00 23.12 19.74 1j5h s ALA 63 CO 0.29 -1.87 0.57 -1.54 0.00 0.00 0.00 175.76 173.20 1j5h s SER 64 N -2.90 -1.35 0.00 0.00 1.04 -1.20 -0.66 113.70 108.63 1j5h s SER 64 Ca 0.65 0.24 0.00 0.00 0.48 0.00 0.00 55.95 57.32 1j5h s SER 64 Cb -0.20 1.95 0.00 0.00 0.10 0.00 0.00 66.02 67.86 1j5h s SER 64 CO 0.52 -0.30 0.00 1.07 0.98 0.00 0.00 173.24 175.51 1j5h n THR 65 N 5.41 0.00 -2.99 2.02 5.66 0.13 -4.76 114.28 119.75 1j5h n THR 65 Ca 0.03 0.00 -0.41 0.00 -3.05 0.00 0.00 64.05 60.62 1j5h n THR 65 Cb 0.53 0.00 -0.05 0.00 -1.55 0.00 0.00 70.33 69.26 1j5h n THR 65 CO 0.00 0.00 0.00 -0.44 -3.05 0.00 0.00 175.07 171.58 1j5h s SER 66 N 0.00 6.79 0.02 1.09 0.01 -1.26 0.16 113.70 120.52 1j5h s SER 66 Ca 0.00 0.97 0.05 0.00 1.31 0.00 0.00 55.95 58.28 1j5h s SER 66 Cb 0.00 -2.40 -0.03 0.00 0.21 0.00 0.00 66.02 63.79 1j5h s SER 66 CO 0.00 -0.39 -0.12 -0.76 0.41 0.00 0.00 173.24 172.38 1j5h s LEU 67 N 2.33 2.93 -0.34 2.44 1.02 0.08 -4.80 118.68 122.35 1j5h s LEU 67 Ca 0.33 -0.27 -0.25 0.00 0.02 0.00 0.00 54.13 53.95 1j5h s LEU 67 Cb -0.16 -1.70 0.01 0.00 0.02 0.00 0.00 46.19 44.36 1j5h s LEU 67 CO 0.10 0.26 0.87 0.28 0.02 0.00 0.00 176.35 177.88 1j5h s THR 68 N -0.98 4.68 -1.47 5.49 -1.32 -1.26 -1.77 115.64 119.01 1j5h s THR 68 Ca 0.16 1.22 -0.09 0.00 -1.21 0.00 0.00 61.69 61.78 1j5h s THR 68 Cb -0.11 -4.25 0.02 0.00 -1.51 0.00 0.00 72.50 66.65 1j5h s THR 68 CO 0.07 -0.40 2.59 0.52 -2.21 0.00 0.00 174.62 175.19 1j5h n VAL 69 N 5.76 4.60 -1.52 5.08 0.31 -0.72 -4.72 118.33 127.12 1j5h n VAL 69 Ca 0.06 -3.43 -0.52 0.00 -0.01 0.00 0.00 64.34 60.43 1j5h n VAL 69 Cb 0.48 -2.39 -0.05 0.00 -0.91 0.00 0.00 33.84 30.97 1j5h n VAL 69 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 1j5h n ARG 70 N 3.12 0.55 0.00 5.55 1.74 -1.26 -2.39 116.66 123.97 1j5h n ARG 70 Ca 0.67 0.20 0.00 0.00 -0.77 0.00 0.00 57.85 57.95 1j5h n ARG 70 Cb 0.26 -1.61 0.00 0.00 -1.02 0.00 0.00 32.46 30.09 1j5h n ARG 70 CO 0.00 0.00 0.00 -2.13 -1.52 0.00 0.00 177.63 173.98 1j5h n ARG 71 N 1.59 0.00 -3.92 5.56 0.63 -1.26 -4.57 116.66 114.68 1j5h n ARG 71 Ca 0.17 0.21 -0.28 0.00 -0.92 0.00 0.00 57.85 57.03 1j5h n ARG 71 Cb 0.19 -0.67 -0.03 0.00 0.45 0.00 0.00 32.46 32.39 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 -3.12 6.35 0.00 6.15 1.04 -1.26 -1.22 113.70 121.64 1j5h s SER 72 Ca 0.00 0.23 0.00 0.00 0.48 0.00 0.00 55.95 56.66 1j5h s SER 72 Cb 0.00 -1.94 0.00 0.00 0.10 0.00 0.00 66.02 64.18 1j5h s SER 72 CO 0.00 0.10 0.00 2.22 0.98 0.00 0.00 173.24 176.54 1j5h n PHE 73 N -0.18 0.00 -3.12 5.02 1.16 -0.55 -4.86 117.46 114.94 1j5h n PHE 73 Ca -0.06 0.00 -0.44 0.00 -1.87 0.00 0.00 57.45 55.08 1j5h n PHE 73 Cb 0.53 0.00 0.00 0.00 -1.61 0.00 0.00 39.48 38.40 1j5h n PHE 73 CO 0.00 0.00 0.00 0.39 -1.87 0.00 0.00 176.76 175.28 1j5h n GLU 74 N 0.00 3.84 -2.11 3.97 1.02 -1.26 0.35 120.64 126.45 1j5h n GLU 74 Ca 0.00 -4.36 -0.40 0.00 -0.02 0.00 0.00 57.16 52.38 1j5h n GLU 74 Cb 0.00 -2.62 -0.02 0.00 -0.02 0.00 0.00 31.44 28.78 1j5h n GLU 74 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 1j5h s GLY 75 N 0.43 2.98 0.14 0.62 0.00 -1.26 -4.63 107.32 105.61 1j5h s GLY 75 Ca 0.33 1.24 0.10 0.00 0.00 0.00 0.00 44.72 46.39 1j5h s GLY 75 CO -0.00 1.88 -0.23 -0.12 0.00 0.00 0.00 173.10 174.62 1j5h s PHE 76 N -1.17 2.10 0.05 1.90 5.36 -0.09 -1.54 117.98 124.59 1j5h s PHE 76 Ca 0.51 -0.40 -0.33 0.00 -0.96 0.00 0.00 56.93 55.74 1j5h s PHE 76 Cb -0.39 -1.10 -0.19 0.00 -0.34 0.00 0.00 43.02 41.00 1j5h s PHE 76 CO 0.52 0.35 1.43 -0.07 -1.46 0.00 0.00 175.22 175.98 1j5h h LEU 77 N 3.66 -0.97 0.00 6.12 -0.00 -0.96 0.73 115.31 123.89 1j5h h LEU 77 Ca -0.47 0.03 0.00 0.00 -0.00 0.00 0.00 57.88 57.43 1j5h h LEU 77 Cb 1.19 0.25 0.00 0.00 -0.00 0.00 0.00 40.66 42.10 1j5h h LEU 77 CO 0.43 -0.64 0.00 0.49 -0.00 0.00 0.00 178.44 178.72 1j5h n PHE 78 N -5.55 0.00 0.00 1.13 3.72 -1.26 -3.70 117.46 111.80 1j5h n PHE 78 Ca -0.15 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.25 1j5h n PHE 78 Cb 0.46 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.00 1j5h n PHE 78 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 176.76 173.24 1j5h n ASP 79 N 0.00 0.00 0.06 4.37 4.64 -1.26 -5.04 116.55 119.31 1j5h n ASP 79 Ca 0.00 0.00 0.00 0.00 -1.38 0.00 0.00 54.79 53.41 1j5h n ASP 79 Cb 0.00 0.00 0.00 0.00 -1.04 0.00 0.00 41.12 40.08 1j5h n ASP 79 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 1j5h n GLY 80 N 0.00 -0.91 3.76 0.27 0.00 -1.26 -5.17 105.19 101.88 1j5h n GLY 80 Ca 0.00 0.14 -0.00 0.00 0.00 0.00 0.00 46.02 46.16 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 -2.00 0.00 0.55 2.61 2.01 -1.26 -5.06 115.64 112.49 1j5h s THR 81 Ca 0.00 -0.37 0.09 0.00 0.31 0.00 0.00 61.69 61.72 1j5h s THR 81 Cb 0.00 -2.32 0.08 0.00 0.01 0.00 0.00 72.50 70.27 1j5h s THR 81 CO 0.00 0.00 0.76 0.00 -0.69 0.00 0.00 174.62 174.69 1j5h s ARG 82 N -2.50 2.37 0.37 4.92 1.70 -1.26 -0.39 118.95 124.17 1j5h s ARG 82 Ca 0.18 -1.56 0.00 0.00 -0.47 0.00 0.00 55.73 53.87 1j5h s ARG 82 Cb 0.01 -2.66 0.00 0.00 -0.57 0.00 0.00 34.95 31.74 1j5h s ARG 82 CO -0.00 -0.79 0.00 -2.67 -1.08 0.00 0.00 175.30 170.76 1j5h n TRP 83 N -2.20 -4.03 0.00 5.89 4.27 -0.59 -4.80 117.44 115.98 1j5h n TRP 83 Ca 0.14 1.21 0.00 0.00 -3.89 0.00 0.00 57.50 54.97 1j5h n TRP 83 Cb 0.61 3.02 0.00 0.00 -1.36 0.00 0.00 31.31 33.58 1j5h n TRP 83 CO 0.00 0.00 0.00 0.41 -2.29 0.00 0.00 177.69 175.81 1j5h n GLY 84 N -1.01 -0.90 2.57 -1.67 0.00 -1.06 -4.57 105.19 98.54 1j5h n GLY 84 Ca 0.00 0.19 -0.08 0.00 0.00 0.00 0.00 46.02 46.13 1j5h n GLY 84 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1j5h n THR 85 N -0.30 0.00 -3.03 2.61 5.66 0.16 -4.59 114.28 114.79 1j5h n THR 85 Ca 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 1j5h n THR 85 Cb 0.00 -0.09 0.00 0.00 -1.55 0.00 0.00 70.33 68.69 1j5h n THR 85 CO 0.00 0.00 0.00 0.55 -3.05 0.00 0.00 175.07 172.57 1j5h n VAL 86 N -2.36 0.00 -1.69 1.08 3.14 0.90 -4.89 118.33 114.51 1j5h n VAL 86 Ca 0.02 0.00 -0.52 0.00 -2.96 0.00 0.00 64.34 60.88 1j5h n VAL 86 Cb 0.40 0.00 -0.06 0.00 -1.06 0.00 0.00 33.84 33.12 1j5h n VAL 86 CO 0.00 0.00 0.00 0.47 -6.46 0.00 0.00 176.83 170.84 1j5h n ASP 87 N 0.05 3.05 0.07 6.55 10.43 -1.26 -1.48 116.55 133.95 1j5h n ASP 87 Ca 0.00 1.01 0.08 0.00 2.57 0.00 0.00 54.79 58.45 1j5h n ASP 87 Cb 0.00 -1.29 -0.05 0.00 1.84 0.00 0.00 41.12 41.63 1j5h n ASP 87 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 1j5h h THR 89 N 0.00 0.42 0.00 0.00 1.03 -1.85 1.27 112.91 113.79 1j5h h THR 89 Ca -0.05 0.00 -0.03 0.00 -0.01 0.00 0.00 66.41 66.32 1j5h h THR 89 Cb 1.18 0.54 -0.00 0.00 -1.07 0.00 0.00 68.15 68.79 1j5h h THR 89 CO 0.01 0.00 -0.12 0.74 -0.01 0.00 0.00 175.52 176.14 1j5h h THR 90 N 0.00 0.45 -0.98 0.00 2.02 -1.92 -2.39 112.91 110.09 1j5h h THR 90 Ca 0.34 -0.62 -0.61 0.00 0.77 0.00 0.00 66.41 66.29 1j5h h THR 90 Cb 1.58 1.43 -0.37 0.00 -1.74 0.00 0.00 68.15 69.05 1j5h h THR 90 CO -0.00 0.12 -0.12 0.00 0.37 0.00 0.00 175.52 175.89 1j5h n ALA 91 N -2.23 5.57 -1.27 6.16 0.00 0.44 -4.97 120.51 124.20 1j5h n ALA 91 Ca -0.01 -3.75 0.00 0.00 0.00 0.00 0.00 53.44 49.68 1j5h n ALA 91 Cb 0.28 -0.94 0.00 0.00 0.00 0.00 0.00 19.45 18.79 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 -0.75 -0.66 -1.09 0.00 0.00 -0.90 -3.11 120.51 114.00 1j5h n ALA 92 Ca 0.51 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.83 1j5h n ALA 92 Cb 0.79 0.00 0.15 0.00 0.00 0.00 0.00 19.45 20.39 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 -4.51 1.15 -0.30 0.00 0.00 0.34 -2.13 119.66 114.20 1j5h s GLN 94 Ca 0.43 -0.96 0.02 0.00 -0.00 0.00 0.00 55.36 54.85 1j5h s GLN 94 Cb -0.04 0.43 0.09 0.00 0.00 0.00 0.00 33.01 33.49 1j5h s GLN 94 CO 0.32 -0.44 0.04 0.54 0.00 0.00 0.00 175.29 175.76 1j5h s VAL 95 N -3.89 1.62 0.32 3.63 0.11 -0.68 -1.25 120.40 120.26 1j5h s VAL 95 Ca 0.10 -1.75 0.09 0.00 -2.93 0.00 0.00 61.98 57.49 1j5h s VAL 95 Cb 0.02 -2.12 -0.05 0.00 -1.53 0.00 0.00 36.38 32.70 1j5h s VAL 95 CO -0.05 -0.51 0.05 -0.83 -3.33 0.00 0.00 175.10 170.44 1j5h s GLY 96 N 1.27 1.89 0.12 6.54 0.00 0.95 -3.28 107.32 114.81 1j5h s GLY 96 Ca 0.07 -1.81 -0.09 0.00 0.00 0.00 0.00 44.72 42.88 1j5h s GLY 96 CO -0.14 -1.79 0.43 1.08 0.00 0.00 0.00 173.10 172.68 1j5h s LEU 97 N -3.75 4.31 -0.02 0.66 2.01 -1.26 -0.16 118.68 120.47 1j5h s LEU 97 Ca 0.35 0.80 0.02 0.00 0.01 0.00 0.00 54.13 55.31 1j5h s LEU 97 Cb -0.03 -3.16 0.00 0.00 0.01 0.00 0.00 46.19 43.02 1j5h s LEU 97 CO 0.21 0.11 -0.08 -0.44 1.01 0.00 0.00 176.35 177.16 1j5h s SER 98 N -1.95 1.04 0.55 2.29 0.01 0.61 -4.61 113.70 111.64 1j5h s SER 98 Ca 0.37 -0.16 0.08 0.00 1.31 0.00 0.00 55.95 57.55 1j5h s SER 98 Cb -0.13 -0.26 0.07 0.00 0.21 0.00 0.00 66.02 65.90 1j5h s SER 98 CO 0.20 0.06 0.75 1.51 0.41 0.00 0.00 173.24 176.16 1j5h s ASP 99 N 0.18 5.20 -0.30 2.44 1.47 -1.26 0.42 116.67 124.81 1j5h s ASP 99 Ca -0.02 -0.70 -0.00 0.00 1.18 0.00 0.00 52.55 53.01 1j5h s ASP 99 Cb -0.07 0.02 0.25 0.00 -0.34 0.00 0.00 42.92 42.77 1j5h s ASP 99 CO 0.00 -1.23 1.88 0.00 0.68 0.00 0.00 175.17 176.50 1j5h n ALA 100 N -2.19 4.87 0.00 2.11 0.00 -1.26 -3.03 120.51 121.01 1j5h n ALA 100 Ca 0.14 -1.65 0.00 0.00 0.00 0.00 0.00 53.44 51.93 1j5h n ALA 100 Cb 0.61 -1.34 0.00 0.00 0.00 0.00 0.00 19.45 18.71 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 0.15 0.00 -0.05 0.00 0.00 -1.26 -5.00 120.51 114.35 1j5h n ALA 101 Ca 0.31 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.73 1j5h n ALA 101 Cb 0.71 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 20.14 1j5h n ALA 101 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1j5h h GLY 102 N 0.00 0.00 0.00 0.00 0.00 -1.96 -3.49 103.07 97.62 1j5h h GLY 102 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1j5h h GLY 102 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 176.54 177.70 1j5h n ASN 103 N -4.75 0.00 0.00 0.19 6.94 -1.17 -4.86 115.26 111.61 1j5h n ASN 103 Ca -0.02 0.00 0.00 0.00 -0.02 0.00 0.00 54.58 54.54 1j5h n ASN 103 Cb 0.07 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.49 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 1.02 3.77 4.83 0.00 -1.26 -4.81 105.19 108.74 1j5h n GLY 104 Ca 0.00 -1.63 -0.39 0.00 0.00 0.00 0.00 46.02 44.00 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 -4.03 4.45 0.00 1.61 0.04 -1.26 -4.85 135.00 130.95 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 -2.92 0.00 0.00 0.04 0.00 0.00 34.50 31.62 1j5h s PRO 105 CO 0.00 0.07 0.00 0.39 0.04 0.00 0.00 177.00 177.50 1j5h n GLU 106 N 0.67 0.00 -0.15 4.56 1.02 -1.26 -5.15 120.64 120.32 1j5h n GLU 106 Ca 0.01 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.15 1j5h n GLU 106 Cb 0.47 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.89 1j5h n GLU 106 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1j5h n GLY 107 N 0.00 -0.48 3.67 0.62 0.00 -1.26 -4.34 105.19 103.40 1j5h n GLY 107 Ca 0.00 -1.75 -0.35 0.00 0.00 0.00 0.00 46.02 43.92 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 -0.41 4.70 -0.21 1.61 0.11 -1.20 -4.76 120.40 120.23 1j5h s VAL 108 Ca 0.00 -0.08 -0.29 0.00 -2.93 0.00 0.00 61.98 58.68 1j5h s VAL 108 Cb 0.00 -3.07 -0.00 0.00 -1.53 0.00 0.00 36.38 31.78 1j5h s VAL 108 CO 0.00 0.53 1.21 0.00 -3.33 0.00 0.00 175.10 173.50 1j5h s ALA 109 N -0.17 3.62 0.07 1.54 0.00 -1.26 -1.68 121.76 123.88 1j5h s ALA 109 Ca 0.07 0.31 0.09 0.00 0.00 0.00 0.00 51.96 52.43 1j5h s ALA 109 Cb -0.12 -3.63 -0.03 0.00 0.00 0.00 0.00 23.12 19.34 1j5h s ALA 109 CO 0.01 -1.25 -0.23 0.42 0.00 0.00 0.00 175.76 174.72 1j5h s ILE 110 N 3.57 1.89 -0.78 0.00 1.01 -0.90 -4.96 121.20 121.03 1j5h s ILE 110 Ca 0.52 -1.42 -0.26 0.00 0.00 0.00 0.00 60.65 59.49 1j5h s ILE 110 Cb -0.19 -1.66 0.04 0.00 0.01 0.00 0.00 42.46 40.66 1j5h s ILE 110 CO 0.14 0.16 1.28 -0.44 0.00 0.00 0.00 174.94 176.08 1j5h s SER 111 N -1.51 6.22 -0.00 3.58 0.01 -0.66 -4.33 113.70 117.00 1j5h s SER 111 Ca 0.09 -0.66 0.02 0.00 1.31 0.00 0.00 55.95 56.72 1j5h s SER 111 Cb -0.10 -2.55 0.06 0.00 0.21 0.00 0.00 66.02 63.65 1j5h s SER 111 CO 0.03 -1.75 1.04 0.49 0.41 0.00 0.00 173.24 173.46 1j5h n PHE 112 N 9.14 0.10 0.00 2.43 3.01 -1.26 0.19 117.46 131.06 1j5h n PHE 112 Ca 0.07 -0.05 0.00 0.00 1.01 0.00 0.00 57.45 58.48 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 0.09 1.01 0.00 0.00 176.76 177.86