#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 0.79 -2.33 0.00 0.00 -1.26 -5.09 120.51 112.62 1j5h n ALA 2 Ca 0.00 -2.55 -0.41 0.00 0.00 0.00 0.00 53.44 50.47 1j5h n ALA 2 Cb 0.00 -1.03 -0.03 0.00 0.00 0.00 0.00 19.45 18.39 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 -0.75 3.24 0.00 0.00 0.04 -1.26 -4.69 135.00 131.59 1j5h s PRO 3 Ca 0.33 0.54 0.00 0.00 0.04 0.00 0.00 61.00 61.91 1j5h s PRO 3 Cb 0.25 -4.16 0.00 0.00 0.04 0.00 0.00 34.50 30.63 1j5h s PRO 3 CO -0.13 -2.01 0.00 0.25 0.04 0.00 0.00 177.00 175.15 1j5h n THR 4 N 6.93 0.00 -2.80 1.26 -2.24 -0.01 -4.78 114.28 112.64 1j5h n THR 4 Ca 0.14 0.00 -0.23 0.00 -2.27 0.00 0.00 64.05 61.69 1j5h n THR 4 Cb 0.49 0.00 0.02 0.00 -2.10 0.00 0.00 70.33 68.74 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 -1.75 3.72 -0.01 6.98 0.00 -1.25 0.19 121.76 129.63 1j5h s ALA 5 Ca 0.00 -1.08 -0.08 0.00 0.00 0.00 0.00 51.96 50.80 1j5h s ALA 5 Cb 0.00 -2.19 0.01 0.00 0.00 0.00 0.00 23.12 20.93 1j5h s ALA 5 CO 0.00 -0.56 0.17 0.95 0.00 0.00 0.00 175.76 176.32 1j5h s THR 6 N -2.68 0.07 -0.23 0.00 -4.23 0.88 -3.48 115.64 105.97 1j5h s THR 6 Ca 0.52 -0.57 -0.01 0.00 -1.18 0.00 0.00 61.69 60.44 1j5h s THR 6 Cb -0.10 -0.44 0.02 0.00 1.34 0.00 0.00 72.50 73.32 1j5h s THR 6 CO 0.39 -0.32 -0.09 -0.69 -0.54 0.00 0.00 174.62 173.37 1j5h s VAL 7 N -1.19 2.72 0.04 2.29 1.01 -1.26 -0.63 120.40 123.38 1j5h s VAL 7 Ca -0.13 -0.97 -0.07 0.00 0.00 0.00 0.00 61.98 60.81 1j5h s VAL 7 Cb -0.06 -2.32 -0.02 0.00 0.00 0.00 0.00 36.38 33.97 1j5h s VAL 7 CO 0.02 0.29 0.71 0.41 0.00 0.00 0.00 175.10 176.53 1j5h n THR 8 N 4.66 -0.16 0.00 3.92 -1.04 -0.78 -3.61 114.28 117.26 1j5h n THR 8 Ca -0.18 1.10 0.00 0.00 -2.04 0.00 0.00 64.05 62.93 1j5h n THR 8 Cb 0.48 -1.41 0.00 0.00 -1.82 0.00 0.00 70.33 67.58 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 -3.47 0.00 -2.95 -2.82 -0.04 -1.26 -4.97 135.00 119.49 1j5h n PRO 9 Ca 0.00 0.00 -0.11 0.00 -0.04 0.00 0.00 63.50 63.35 1j5h n PRO 9 Cb 0.06 -0.19 0.04 0.00 -0.04 0.00 0.00 33.50 33.38 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 -0.06 -3.52 -3.46 3.54 2.88 -1.24 -4.97 113.62 106.80 1j5h n SER 10 Ca 0.00 -0.29 0.01 0.00 -1.33 0.00 0.00 58.87 57.26 1j5h n SER 10 Cb 0.00 -2.84 -0.04 0.00 -0.75 0.00 0.00 64.21 60.58 1j5h n SER 10 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 1j5h s SER 11 N -3.34 -0.69 -1.11 -3.46 1.04 -1.24 -2.08 113.70 102.81 1j5h s SER 11 Ca 0.20 0.95 -0.03 0.00 0.48 0.00 0.00 55.95 57.55 1j5h s SER 11 Cb -0.09 1.76 0.00 0.00 0.10 0.00 0.00 66.02 67.79 1j5h s SER 11 CO 0.37 -0.13 0.95 0.61 0.98 0.00 0.00 173.24 176.02 1j5h n GLY 12 N 4.99 -0.31 0.00 7.32 0.00 -0.53 -4.91 105.19 111.75 1j5h n GLY 12 Ca -0.10 0.08 0.00 0.00 0.00 0.00 0.00 46.02 46.00 1j5h n GLY 12 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 1j5h n LEU 13 N -4.06 0.00 0.00 0.99 -0.00 -0.99 -4.86 117.00 108.08 1j5h n LEU 13 Ca -0.14 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 55.87 1j5h n LEU 13 Cb 0.61 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 44.03 1j5h n LEU 13 CO 0.55 0.00 0.00 -0.24 -0.00 0.00 0.00 177.39 177.70 1j5h n SER 14 N 0.00 0.00 -3.79 1.45 2.88 -1.26 -4.43 113.62 108.47 1j5h n SER 14 Ca 0.00 0.00 -0.23 0.00 -1.33 0.00 0.00 58.87 57.31 1j5h n SER 14 Cb 0.00 0.00 0.01 0.00 -0.75 0.00 0.00 64.21 63.47 1j5h n SER 14 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 1j5h n ASP 15 N -2.34 -0.97 0.00 -3.46 2.03 -0.27 -0.78 116.55 110.76 1j5h n ASP 15 Ca 0.00 -0.88 0.00 0.00 0.52 0.00 0.00 54.79 54.43 1j5h n ASP 15 Cb 0.00 -3.72 0.00 0.00 -0.72 0.00 0.00 41.12 36.68 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 -1.71 0.46 3.57 0.27 0.00 -1.03 -4.66 105.19 102.09 1j5h n GLY 16 Ca -0.29 -0.87 -0.43 0.00 0.00 0.00 0.00 46.02 44.42 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 -2.00 4.58 -0.81 2.61 2.01 0.04 -4.68 115.64 117.39 1j5h s THR 17 Ca 0.00 0.72 -0.23 0.00 0.31 0.00 0.00 61.69 62.49 1j5h s THR 17 Cb 0.00 -4.35 0.07 0.00 0.01 0.00 0.00 72.50 68.23 1j5h s THR 17 CO 0.00 -0.70 1.17 -0.69 -0.69 0.00 0.00 174.62 173.70 1j5h s VAL 18 N 3.48 4.20 0.36 3.82 1.01 -1.25 -2.14 120.40 129.89 1j5h s VAL 18 Ca 0.34 -0.54 0.08 0.00 0.00 0.00 0.00 61.98 61.85 1j5h s VAL 18 Cb -0.11 -4.83 -0.02 0.00 0.00 0.00 0.00 36.38 31.41 1j5h s VAL 18 CO 0.23 -1.65 0.33 0.68 0.00 0.00 0.00 175.10 174.68 1j5h s VAL 19 N 4.31 3.23 0.04 2.92 -7.23 -0.78 -4.66 120.40 118.23 1j5h s VAL 19 Ca 0.32 -1.35 -0.30 0.00 -1.81 0.00 0.00 61.98 58.83 1j5h s VAL 19 Cb -0.09 -3.12 -0.07 0.00 0.56 0.00 0.00 36.38 33.66 1j5h s VAL 19 CO 0.03 -0.11 1.60 -0.54 -0.31 0.00 0.00 175.10 175.77 1j5h s LYS 20 N -4.05 4.21 -0.11 4.82 1.02 -1.26 -0.89 119.74 123.49 1j5h s LYS 20 Ca 0.44 2.24 0.02 0.00 0.02 0.00 0.00 55.97 58.69 1j5h s LYS 20 Cb -0.05 -3.63 0.01 0.00 -0.52 0.00 0.00 37.83 33.64 1j5h s LYS 20 CO 0.27 -0.71 -0.17 0.08 -0.92 0.00 0.00 175.35 173.90 1j5h s VAL 21 N 2.73 1.59 0.14 3.17 1.01 0.35 -1.87 120.40 127.52 1j5h s VAL 21 Ca 0.72 -0.71 0.09 0.00 0.00 0.00 0.00 61.98 62.08 1j5h s VAL 21 Cb -0.37 -1.44 -0.04 0.00 0.00 0.00 0.00 36.38 34.53 1j5h s VAL 21 CO 0.31 0.46 -0.21 0.00 0.00 0.00 0.00 175.10 175.66 1j5h s ALA 22 N 0.86 2.02 0.00 5.51 0.00 0.20 -0.67 121.76 129.68 1j5h s ALA 22 Ca -0.09 -1.41 0.00 0.00 0.00 0.00 0.00 51.96 50.46 1j5h s ALA 22 Cb -0.15 -0.24 0.00 0.00 0.00 0.00 0.00 23.12 22.72 1j5h s ALA 22 CO 0.00 0.33 0.00 0.41 0.00 0.00 0.00 175.76 176.51 1j5h n GLY 23 N 0.66 -1.31 0.00 0.00 0.00 0.27 -0.08 105.19 104.72 1j5h n GLY 23 Ca -0.16 -2.15 0.00 0.00 0.00 0.00 0.00 46.02 43.71 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 -0.22 0.00 0.24 4.61 0.00 0.13 -1.37 120.51 123.90 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 0.12 0.00 0.00 0.00 0.00 19.45 19.57 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 -0.32 3.66 0.00 0.00 -1.26 -0.83 105.19 106.43 1j5h n GLY 25 Ca 0.00 -0.02 -0.23 0.00 0.00 0.00 0.00 46.02 45.77 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 -1.18 -2.85 0.00 0.99 7.94 -1.11 -4.73 117.00 116.07 1j5h n LEU 26 Ca 0.03 -0.83 0.00 0.00 -1.11 0.00 0.00 56.01 54.10 1j5h n LEU 26 Cb 0.03 -2.08 0.00 0.00 0.53 0.00 0.00 43.42 41.90 1j5h n LEU 26 CO 0.03 0.13 0.00 1.67 -1.11 0.00 0.00 177.39 178.11 1j5h n GLN 27 N -2.92 0.00 0.00 1.96 -0.06 -0.38 -4.67 117.38 111.31 1j5h n GLN 27 Ca -0.20 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 54.80 1j5h n GLN 27 Cb 0.63 0.00 0.00 0.00 -4.06 0.00 0.00 30.24 26.81 1j5h n GLN 27 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 1j5h n ALA 28 N -3.00 0.00 -1.23 1.69 0.00 -1.24 -3.51 120.51 113.22 1j5h n ALA 28 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1j5h n ALA 28 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 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 0.20 3.52 0.00 0.00 -1.26 -4.84 105.19 102.81 1j5h n GLY 29 Ca 0.00 -0.32 -0.10 0.00 0.00 0.00 0.00 46.02 45.60 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 -2.82 0.03 0.58 2.61 2.01 -1.26 -4.97 115.64 111.82 1j5h s THR 30 Ca 0.00 -0.82 -0.17 0.00 0.31 0.00 0.00 61.69 61.01 1j5h s THR 30 Cb 0.00 -1.62 -0.04 0.00 0.01 0.00 0.00 72.50 70.85 1j5h s THR 30 CO 0.00 -0.12 1.07 0.00 -0.69 0.00 0.00 174.62 174.88 1j5h s ALA 31 N -3.88 2.71 -0.45 7.40 0.00 -1.26 -1.41 121.76 124.87 1j5h s ALA 31 Ca 0.10 0.50 0.05 0.00 0.00 0.00 0.00 51.96 52.61 1j5h s ALA 31 Cb -0.01 -3.26 0.19 0.00 0.00 0.00 0.00 23.12 20.04 1j5h s ALA 31 CO -0.02 -0.81 0.51 0.66 0.00 0.00 0.00 175.76 176.09 1j5h n TYR 32 N -1.86 -1.91 -1.62 0.00 4.01 0.22 -4.67 117.16 111.32 1j5h n TYR 32 Ca 0.09 -2.65 -0.53 0.00 -0.16 0.00 0.00 57.90 54.65 1j5h n TYR 32 Cb 0.52 0.65 -0.06 0.00 -0.31 0.00 0.00 39.34 40.14 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 1.88 -4.78 7.72 2.03 -0.06 -1.64 116.55 124.35 1j5h n ASP 33 Ca 0.24 1.11 -0.35 0.00 0.52 0.00 0.00 54.79 56.31 1j5h n ASP 33 Cb 0.52 -1.19 -0.00 0.00 -0.72 0.00 0.00 41.12 39.73 1j5h n ASP 33 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 1j5h s VAL 34 N 1.24 3.22 0.12 5.18 1.01 0.18 0.38 120.40 131.73 1j5h s VAL 34 Ca 0.88 0.78 0.01 0.00 0.00 0.00 0.00 61.98 63.65 1j5h s VAL 34 Cb -0.97 -3.33 -0.00 0.00 0.00 0.00 0.00 36.38 32.08 1j5h s VAL 34 CO 0.51 -0.14 0.03 0.61 0.00 0.00 0.00 175.10 176.11 1j5h n GLY 35 N 0.17 3.92 0.00 4.51 0.00 0.15 -4.32 105.19 109.62 1j5h n GLY 35 Ca 0.11 -2.08 0.00 0.00 0.00 0.00 0.00 46.02 44.05 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 -0.29 0.00 -4.69 1.61 1.13 -1.26 -3.88 117.38 110.00 1j5h n GLN 36 Ca -0.03 0.00 -0.30 0.00 -1.94 0.00 0.00 57.00 54.72 1j5h n GLN 36 Cb 0.17 0.00 -0.09 0.00 0.11 0.00 0.00 30.24 30.43 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 -2.82 2.33 -0.57 0.00 0.00 0.40 -0.55 121.76 120.55 1j5h s ALA 38 Ca 0.20 -1.10 -0.20 0.00 0.00 0.00 0.00 51.96 50.86 1j5h s ALA 38 Cb 0.06 -1.09 0.08 0.00 0.00 0.00 0.00 23.12 22.17 1j5h s ALA 38 CO 0.10 -0.08 0.73 -0.46 0.00 0.00 0.00 175.76 176.05 1j5h s TRP 39 N 0.89 2.95 0.00 0.00 -0.11 -1.19 -0.99 118.94 120.49 1j5h s TRP 39 Ca -0.05 -0.74 0.00 0.00 1.22 0.00 0.00 56.10 56.54 1j5h s TRP 39 Cb -0.15 -3.92 0.00 0.00 -1.50 0.00 0.00 33.47 27.90 1j5h s TRP 39 CO -0.03 -1.27 0.00 0.28 -4.62 0.00 0.00 176.95 171.31 1j5h n VAL 40 N 5.65 0.00 -0.60 5.86 0.31 -0.56 -4.52 118.33 124.47 1j5h n VAL 40 Ca -0.07 0.00 -0.17 0.00 -0.01 0.00 0.00 64.34 64.09 1j5h n VAL 40 Cb 0.44 0.00 0.08 0.00 -0.91 0.00 0.00 33.84 33.45 1j5h n VAL 40 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 1j5h n ASP 41 N 0.00 4.76 0.00 4.52 2.03 -1.25 -4.88 116.55 121.73 1j5h n ASP 41 Ca 0.00 -3.08 0.00 0.00 0.52 0.00 0.00 54.79 52.23 1j5h n ASP 41 Cb 0.00 -0.84 0.00 0.00 -0.72 0.00 0.00 41.12 39.56 1j5h n ASP 41 CO 0.00 0.00 0.00 0.41 -1.92 0.00 0.00 177.20 175.69 1j5h n THR 42 N -0.28 0.00 0.26 5.18 -1.04 -1.26 -4.23 114.28 112.90 1j5h n THR 42 Ca 0.37 0.00 0.13 0.00 -2.04 0.00 0.00 64.05 62.51 1j5h n THR 42 Cb 0.97 0.00 0.63 0.00 -1.82 0.00 0.00 70.33 70.11 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 -6.29 3.41 0.00 -2.00 -3.38 103.07 94.80 1j5h h GLY 43 Ca 0.00 0.00 -0.61 0.00 0.00 0.00 0.00 47.33 46.72 1j5h h GLY 43 CO 0.00 0.00 -0.84 0.14 0.00 0.00 0.00 176.54 175.84 1j5h s VAL 44 N -3.55 1.60 -0.25 4.60 1.01 -1.26 -5.09 120.40 117.46 1j5h s VAL 44 Ca -0.00 -0.65 -0.01 0.00 0.00 0.00 0.00 61.98 61.31 1j5h s VAL 44 Cb 0.08 -1.49 0.07 0.00 0.00 0.00 0.00 36.38 35.04 1j5h s VAL 44 CO 0.30 0.46 0.03 -0.22 0.00 0.00 0.00 175.10 175.68 1j5h s LEU 45 N 1.43 2.09 -0.74 3.92 2.96 -1.25 -1.50 118.68 125.58 1j5h s LEU 45 Ca 0.04 -1.25 -0.24 0.00 -0.22 0.00 0.00 54.13 52.46 1j5h s LEU 45 Cb -0.13 -0.90 0.06 0.00 0.50 0.00 0.00 46.19 45.73 1j5h s LEU 45 CO -0.10 -0.32 1.12 0.00 -1.32 0.00 0.00 176.35 175.72 1j5h s ALA 46 N 1.60 3.00 0.53 5.97 0.00 -0.16 -4.15 121.76 128.55 1j5h s ALA 46 Ca 0.02 -1.83 -0.18 0.00 0.00 0.00 0.00 51.96 49.97 1j5h s ALA 46 Cb -0.18 -4.05 -0.07 0.00 0.00 0.00 0.00 23.12 18.82 1j5h s ALA 46 CO -0.13 -3.02 1.03 0.00 0.00 0.00 0.00 175.76 173.63 1j5h s ASN 48 N -2.59 5.11 0.00 0.00 2.47 0.30 -0.64 114.94 119.59 1j5h s ASN 48 Ca 0.63 -2.77 0.00 0.00 0.42 0.00 0.00 52.86 51.14 1j5h s ASN 48 Cb -0.14 -1.82 0.00 0.00 -1.45 0.00 0.00 41.25 37.84 1j5h s ASN 48 CO 0.29 -0.37 1.14 -0.81 -3.72 0.00 0.00 177.10 173.63 1j5h n PRO 49 N 3.57 0.75 0.00 0.43 -0.04 -1.26 -2.04 135.00 136.41 1j5h n PRO 49 Ca 0.06 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.52 1j5h n PRO 49 Cb 0.38 -1.13 0.00 0.00 -0.04 0.00 0.00 33.50 32.71 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 1.15 1.05 -0.32 0.55 0.00 -1.26 -4.83 120.51 116.85 1j5h n ALA 50 Ca 0.00 -0.42 0.15 0.00 0.00 0.00 0.00 53.44 53.16 1j5h n ALA 50 Cb 0.37 0.00 0.30 0.00 0.00 0.00 0.00 19.45 20.12 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 -0.28 0.00 0.00 3.04 -1.68 -3.42 116.42 114.08 1j5h h ASP 51 Ca 0.00 0.25 0.00 0.00 -3.24 0.00 0.00 57.03 54.04 1j5h h ASP 51 Cb 0.62 0.40 0.00 0.00 -1.04 0.00 0.00 39.33 39.31 1j5h h ASP 51 CO 0.00 -0.29 0.00 0.49 -2.04 0.00 0.00 179.24 177.40 1j5h n PHE 52 N -5.39 0.00 -0.80 4.15 3.72 -1.26 -4.86 117.46 113.02 1j5h n PHE 52 Ca 0.23 0.00 -0.25 0.00 -0.05 0.00 0.00 57.45 57.38 1j5h n PHE 52 Cb 0.75 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.29 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 0.75 -2.08 -3.84 4.37 7.64 -1.26 -4.58 113.62 114.62 1j5h n SER 53 Ca 0.00 0.45 -0.12 0.00 1.01 0.00 0.00 58.87 60.21 1j5h n SER 53 Cb 0.00 -0.54 -0.12 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 -0.63 -0.09 0.35 6.43 1.04 -1.26 0.48 113.70 120.02 1j5h s SER 54 Ca 0.36 0.14 0.05 0.00 0.48 0.00 0.00 55.95 56.99 1j5h s SER 54 Cb -0.35 0.27 -0.03 0.00 0.10 0.00 0.00 66.02 66.01 1j5h s SER 54 CO 0.40 -0.14 0.20 0.54 0.98 0.00 0.00 173.24 175.23 1j5h s VAL 55 N -0.36 0.25 0.04 5.02 0.11 -0.65 -4.79 120.40 120.02 1j5h s VAL 55 Ca -0.04 -2.00 0.00 0.00 -2.93 0.00 0.00 61.98 57.01 1j5h s VAL 55 Cb -0.03 -2.44 -0.03 0.00 -1.53 0.00 0.00 36.38 32.35 1j5h s VAL 55 CO 0.01 0.00 -0.04 -0.89 -3.33 0.00 0.00 175.10 170.84 1j5h s THR 56 N -3.40 0.29 1.04 5.04 2.01 -1.26 0.71 115.64 120.07 1j5h s THR 56 Ca 0.34 -1.30 -0.14 0.00 0.31 0.00 0.00 61.69 60.90 1j5h s THR 56 Cb 0.03 -0.83 0.21 0.00 0.01 0.00 0.00 72.50 71.92 1j5h s THR 56 CO 0.21 -0.65 1.10 0.00 -0.69 0.00 0.00 174.62 174.59 1j5h s ALA 57 N -2.35 0.93 -0.05 7.40 0.00 -0.50 -3.63 121.76 123.56 1j5h s ALA 57 Ca -0.06 -0.53 0.02 0.00 0.00 0.00 0.00 51.96 51.39 1j5h s ALA 57 Cb -0.03 -3.05 0.02 0.00 0.00 0.00 0.00 23.12 20.05 1j5h s ALA 57 CO -0.04 -2.98 -0.07 0.16 0.00 0.00 0.00 175.76 172.83 1j5h s ASP 58 N -3.63 1.26 0.00 0.00 1.47 0.28 -4.63 116.67 111.43 1j5h s ASP 58 Ca 0.67 -0.19 0.00 0.00 1.18 0.00 0.00 52.55 54.20 1j5h s ASP 58 Cb -0.16 -0.59 0.00 0.00 -0.34 0.00 0.00 42.92 41.83 1j5h s ASP 58 CO 0.57 -0.02 0.00 0.00 0.68 0.00 0.00 175.17 176.40 1j5h n ALA 59 N 3.95 0.00 0.00 2.11 0.00 -1.26 -0.63 120.51 124.67 1j5h n ALA 59 Ca -0.24 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.20 1j5h n ALA 59 Cb 0.51 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.96 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 0.00 0.00 0.00 0.00 5.15 -1.26 -4.90 115.26 114.25 1j5h n ASN 60 Ca 0.00 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.98 1j5h n ASN 60 Cb 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.25 1j5h n ASN 60 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1j5h n GLY 61 N 0.00 1.31 3.72 8.20 0.00 0.20 -3.69 105.19 114.93 1j5h n GLY 61 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 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 -1.52 7.23 0.69 1.61 0.15 -1.23 -1.24 113.70 119.38 1j5h s SER 62 Ca 0.00 1.98 -0.10 0.00 0.70 0.00 0.00 55.95 58.53 1j5h s SER 62 Cb 0.00 -2.59 0.02 0.00 -1.71 0.00 0.00 66.02 61.74 1j5h s SER 62 CO 0.00 -0.31 1.07 0.00 1.20 0.00 0.00 173.24 175.20 1j5h s ALA 63 N 0.42 2.96 -0.30 5.45 0.00 -0.47 0.10 121.76 129.93 1j5h s ALA 63 Ca 0.53 -0.41 -0.09 0.00 0.00 0.00 0.00 51.96 51.98 1j5h s ALA 63 Cb -0.28 -2.95 0.18 0.00 0.00 0.00 0.00 23.12 20.07 1j5h s ALA 63 CO 0.32 -1.10 0.88 -1.54 0.00 0.00 0.00 175.76 174.32 1j5h s SER 64 N -4.36 -0.81 0.00 0.00 1.04 -1.23 -0.57 113.70 107.78 1j5h s SER 64 Ca 0.58 0.59 0.00 0.00 0.48 0.00 0.00 55.95 57.60 1j5h s SER 64 Cb -0.11 1.72 0.00 0.00 0.10 0.00 0.00 66.02 67.73 1j5h s SER 64 CO 0.50 -0.15 0.00 1.07 0.98 0.00 0.00 173.24 175.64 1j5h n THR 65 N 5.40 0.00 -2.92 2.02 5.66 0.16 -4.81 114.28 119.79 1j5h n THR 65 Ca -0.05 0.00 -0.41 0.00 -3.05 0.00 0.00 64.05 60.53 1j5h n THR 65 Cb 0.52 0.00 -0.04 0.00 -1.55 0.00 0.00 70.33 69.26 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 0.00 6.93 -0.03 1.09 1.04 -1.26 0.13 113.70 121.61 1j5h s SER 66 Ca 0.00 1.14 0.07 0.00 0.48 0.00 0.00 55.95 57.64 1j5h s SER 66 Cb 0.00 -2.44 -0.02 0.00 0.10 0.00 0.00 66.02 63.66 1j5h s SER 66 CO 0.00 -0.37 -0.24 -0.76 0.98 0.00 0.00 173.24 172.85 1j5h s LEU 67 N 2.03 2.17 -0.39 2.42 1.43 -0.07 -4.85 118.68 121.42 1j5h s LEU 67 Ca 0.37 -0.43 -0.25 0.00 -1.03 0.00 0.00 54.13 52.80 1j5h s LEU 67 Cb -0.17 -1.38 0.02 0.00 0.03 0.00 0.00 46.19 44.69 1j5h s LEU 67 CO 0.13 0.32 0.88 0.28 0.23 0.00 0.00 176.35 178.19 1j5h s THR 68 N -0.60 4.60 -1.39 5.49 -1.32 -1.26 -1.87 115.64 119.29 1j5h s THR 68 Ca 0.09 0.98 -0.07 0.00 -1.21 0.00 0.00 61.69 61.48 1j5h s THR 68 Cb -0.10 -4.32 0.08 0.00 -1.51 0.00 0.00 72.50 66.64 1j5h s THR 68 CO -0.00 -0.59 2.44 0.52 -2.21 0.00 0.00 174.62 174.78 1j5h n VAL 69 N 6.04 4.86 -1.63 5.08 0.31 -0.91 -4.86 118.33 127.22 1j5h n VAL 69 Ca 0.06 -3.90 -0.53 0.00 -0.01 0.00 0.00 64.34 59.95 1j5h n VAL 69 Cb 0.48 -2.25 -0.06 0.00 -0.91 0.00 0.00 33.84 31.10 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 2.57 1.19 0.00 5.55 1.85 -1.26 -1.11 116.66 125.45 1j5h n ARG 70 Ca 0.63 0.43 0.00 0.00 -1.00 0.00 0.00 57.85 57.91 1j5h n ARG 70 Cb 0.26 -2.09 0.00 0.00 -1.05 0.00 0.00 32.46 29.58 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 3.42 0.00 -2.29 2.89 0.63 -1.26 -4.69 116.66 115.35 1j5h n ARG 71 Ca 0.21 0.12 -0.42 0.00 -0.92 0.00 0.00 57.85 56.84 1j5h n ARG 71 Cb 0.18 -0.51 -0.03 0.00 0.45 0.00 0.00 32.46 32.55 1j5h n ARG 71 CO 0.00 0.00 0.00 0.45 -2.51 0.00 0.00 177.63 175.57 1j5h s SER 72 N -1.89 6.09 0.00 6.15 0.15 -1.26 -1.64 113.70 121.31 1j5h s SER 72 Ca 0.00 0.62 0.00 0.00 0.70 0.00 0.00 55.95 57.27 1j5h s SER 72 Cb 0.00 -2.54 0.00 0.00 -1.71 0.00 0.00 66.02 61.77 1j5h s SER 72 CO 0.00 -1.67 0.00 2.22 1.20 0.00 0.00 173.24 174.99 1j5h n PHE 73 N 9.69 -0.27 -4.01 3.44 -1.74 -0.51 -4.88 117.46 119.18 1j5h n PHE 73 Ca 0.16 0.00 -0.30 0.00 -0.56 0.00 0.00 57.45 56.75 1j5h n PHE 73 Cb 0.49 0.00 -0.16 0.00 1.52 0.00 0.00 39.48 41.32 1j5h n PHE 73 CO 0.00 0.00 0.00 -1.83 -0.56 0.00 0.00 176.76 174.37 1j5h s GLU 74 N -0.42 2.25 0.10 3.97 1.03 -1.26 0.74 118.70 125.12 1j5h s GLU 74 Ca 0.00 -0.55 0.09 0.00 0.03 0.00 0.00 54.97 54.54 1j5h s GLU 74 Cb 0.00 -2.09 -0.04 0.00 -0.80 0.00 0.00 34.13 31.20 1j5h s GLU 74 CO 0.00 -0.24 -0.23 0.20 -1.33 0.00 0.00 175.26 173.66 1j5h s GLY 75 N 1.50 1.32 -0.18 -3.83 0.00 -1.26 -4.62 107.32 100.24 1j5h s GLY 75 Ca 0.05 -1.29 -0.08 0.00 0.00 0.00 0.00 44.72 43.40 1j5h s GLY 75 CO -0.11 -1.28 0.08 -0.11 0.00 0.00 0.00 173.10 171.69 1j5h s PHE 76 N -1.10 3.31 0.07 1.90 -0.12 0.18 -0.98 117.98 121.24 1j5h s PHE 76 Ca 0.09 0.17 -0.16 0.00 -0.05 0.00 0.00 56.93 56.98 1j5h s PHE 76 Cb -0.10 -2.09 -0.04 0.00 -0.63 0.00 0.00 43.02 40.16 1j5h s PHE 76 CO 0.04 0.23 1.27 -0.07 -0.05 0.00 0.00 175.22 176.65 1j5h h LEU 77 N 6.55 -1.00 0.00 -1.99 4.07 -0.68 -1.01 115.31 121.26 1j5h h LEU 77 Ca -0.39 0.14 0.00 0.00 0.08 0.00 0.00 57.88 57.71 1j5h h LEU 77 Cb 1.17 0.43 0.00 0.00 1.08 0.00 0.00 40.66 43.33 1j5h h LEU 77 CO 0.71 -0.16 0.00 0.33 -1.08 0.00 0.00 178.44 178.24 1j5h n PHE 78 N -4.07 0.00 -0.01 1.13 -0.00 -1.26 -3.97 117.46 109.29 1j5h n PHE 78 Ca -0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 57.45 57.44 1j5h n PHE 78 Cb 0.15 0.00 -0.00 0.00 -0.00 0.00 0.00 39.48 39.63 1j5h n PHE 78 CO 0.00 0.00 0.00 -0.25 -0.00 0.00 0.00 176.76 176.51 1j5h n ASP 79 N 0.00 0.28 -0.92 -2.13 8.00 -1.26 -4.95 116.55 115.57 1j5h n ASP 79 Ca 0.00 0.31 -0.03 0.00 0.71 0.00 0.00 54.79 55.77 1j5h n ASP 79 Cb 0.00 -0.56 -0.03 0.00 -0.02 0.00 0.00 41.12 40.52 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 1.72 0.10 3.35 0.44 0.00 -1.26 -5.15 105.19 104.39 1j5h n GLY 80 Ca -0.01 -0.01 -0.18 0.00 0.00 0.00 0.00 46.02 45.82 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 0.01 0.54 -0.14 2.61 2.01 -1.26 -5.04 115.64 114.37 1j5h s THR 81 Ca 0.01 -2.00 -0.30 0.00 0.31 0.00 0.00 61.69 59.71 1j5h s THR 81 Cb 0.03 -2.59 0.10 0.00 0.01 0.00 0.00 72.50 70.05 1j5h s THR 81 CO -0.01 0.00 0.85 0.00 -0.69 0.00 0.00 174.62 174.77 1j5h s ARG 82 N -3.92 0.79 -0.04 4.92 1.70 -1.26 -0.11 118.95 121.03 1j5h s ARG 82 Ca 0.36 0.30 -0.10 0.00 -0.47 0.00 0.00 55.73 55.82 1j5h s ARG 82 Cb 0.07 0.38 -0.06 0.00 -0.57 0.00 0.00 34.95 34.77 1j5h s ARG 82 CO 0.15 -0.22 0.49 -1.49 -1.08 0.00 0.00 175.30 173.15 1j5h h TRP 83 N 3.08 -0.33 0.00 5.89 4.06 -1.45 -3.47 115.95 123.73 1j5h h TRP 83 Ca -0.24 -0.01 0.00 0.00 2.06 0.00 0.00 58.89 60.71 1j5h h TRP 83 Cb 1.15 0.11 0.00 0.00 -1.00 0.00 0.00 29.16 29.42 1j5h h TRP 83 CO 0.34 -0.21 0.00 0.41 -3.56 0.00 0.00 178.44 175.42 1j5h n GLY 84 N 0.69 -2.45 3.09 1.49 0.00 -1.26 -4.71 105.19 102.04 1j5h n GLY 84 Ca -0.04 -1.20 -0.20 0.00 0.00 0.00 0.00 46.02 44.57 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 -0.63 -0.10 -3.79 2.61 5.66 -0.28 -4.81 114.28 112.94 1j5h n THR 85 Ca 0.00 -0.05 -0.33 0.00 -3.05 0.00 0.00 64.05 60.62 1j5h n THR 85 Cb 0.00 -0.30 -0.05 0.00 -1.55 0.00 0.00 70.33 68.43 1j5h n THR 85 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 175.07 172.56 1j5h s VAL 86 N -2.43 5.31 -0.35 1.08 0.11 0.23 -4.76 120.40 119.58 1j5h s VAL 86 Ca 0.33 0.02 -0.29 0.00 -2.93 0.00 0.00 61.98 59.11 1j5h s VAL 86 Cb -0.19 -3.58 0.02 0.00 -1.53 0.00 0.00 36.38 31.09 1j5h s VAL 86 CO 0.51 0.26 1.13 1.51 -3.33 0.00 0.00 175.10 175.18 1j5h s ASP 87 N -1.99 6.81 0.25 3.54 1.47 -1.26 -1.42 116.67 124.07 1j5h s ASP 87 Ca 0.31 0.94 -0.03 0.00 1.18 0.00 0.00 52.55 54.95 1j5h s ASP 87 Cb -0.13 -2.54 0.31 0.00 -0.34 0.00 0.00 42.92 40.21 1j5h s ASP 87 CO 0.20 -1.01 1.76 0.00 0.68 0.00 0.00 175.17 176.80 1j5h h THR 89 N 0.79 0.26 0.00 0.00 1.03 -1.88 2.98 112.91 116.09 1j5h h THR 89 Ca 0.16 0.00 -0.00 0.00 -0.01 0.00 0.00 66.41 66.56 1j5h h THR 89 Cb 0.43 0.44 -0.00 0.00 -1.07 0.00 0.00 68.15 67.96 1j5h h THR 89 CO 0.02 0.00 -0.01 0.74 -0.01 0.00 0.00 175.52 176.26 1j5h h THR 90 N 0.00 0.01 0.00 0.00 2.02 -1.72 -3.26 112.91 109.96 1j5h h THR 90 Ca 0.30 -0.95 -0.08 0.00 0.77 0.00 0.00 66.41 66.45 1j5h h THR 90 Cb 1.69 1.94 -0.18 0.00 -1.74 0.00 0.00 68.15 69.87 1j5h h THR 90 CO -0.00 0.01 -0.69 0.00 0.37 0.00 0.00 175.52 175.21 1j5h n ALA 91 N -2.10 2.55 -1.79 6.16 0.00 0.83 -5.04 120.51 121.13 1j5h n ALA 91 Ca 0.04 -2.29 -0.07 0.00 0.00 0.00 0.00 53.44 51.12 1j5h n ALA 91 Cb 0.50 -0.56 0.01 0.00 0.00 0.00 0.00 19.45 19.40 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 -0.18 -1.27 -0.39 0.00 0.00 0.72 -3.18 120.51 116.21 1j5h n ALA 92 Ca 0.09 0.03 -0.29 0.00 0.00 0.00 0.00 53.44 53.27 1j5h n ALA 92 Cb 0.89 -0.35 0.26 0.00 0.00 0.00 0.00 19.45 20.25 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 -4.49 0.80 -0.23 0.00 0.00 0.29 -1.67 119.66 114.35 1j5h s GLN 94 Ca 0.65 -1.21 -0.01 0.00 -0.00 0.00 0.00 55.36 54.79 1j5h s GLN 94 Cb -0.18 -0.31 0.07 0.00 0.00 0.00 0.00 33.01 32.58 1j5h s GLN 94 CO 0.61 0.02 0.02 0.54 0.00 0.00 0.00 175.29 176.48 1j5h s VAL 95 N -2.99 0.92 0.33 3.63 0.11 -0.54 -1.28 120.40 120.59 1j5h s VAL 95 Ca 0.07 -0.95 0.08 0.00 -2.93 0.00 0.00 61.98 58.25 1j5h s VAL 95 Cb 0.01 -1.41 -0.06 0.00 -1.53 0.00 0.00 36.38 33.38 1j5h s VAL 95 CO -0.03 -0.27 -0.07 -0.83 -3.33 0.00 0.00 175.10 170.57 1j5h s GLY 96 N 1.66 2.09 0.29 6.54 0.00 -1.25 -3.78 107.32 112.87 1j5h s GLY 96 Ca -0.00 -2.05 -0.11 0.00 0.00 0.00 0.00 44.72 42.56 1j5h s GLY 96 CO -0.11 -1.97 0.65 1.08 0.00 0.00 0.00 173.10 172.75 1j5h s LEU 97 N -3.56 4.07 -0.12 0.66 2.01 -1.26 0.32 118.68 120.80 1j5h s LEU 97 Ca 0.32 1.05 -0.05 0.00 0.01 0.00 0.00 54.13 55.46 1j5h s LEU 97 Cb 0.04 -3.85 0.06 0.00 0.01 0.00 0.00 46.19 42.44 1j5h s LEU 97 CO 0.15 -0.18 0.26 -0.55 1.01 0.00 0.00 176.35 177.04 1j5h s SER 98 N -2.53 0.11 0.48 2.29 0.15 0.16 -4.70 113.70 109.67 1j5h s SER 98 Ca 0.50 0.57 0.08 0.00 0.70 0.00 0.00 55.95 57.80 1j5h s SER 98 Cb -0.11 0.59 0.03 0.00 -1.71 0.00 0.00 66.02 64.82 1j5h s SER 98 CO 0.22 -0.21 0.62 1.51 1.20 0.00 0.00 173.24 176.58 1j5h s ASP 99 N 1.97 5.38 -0.27 5.45 1.47 -1.26 -0.88 116.67 128.52 1j5h s ASP 99 Ca -0.03 -0.62 -0.00 0.00 1.18 0.00 0.00 52.55 53.08 1j5h s ASP 99 Cb -0.11 -0.29 0.24 0.00 -0.34 0.00 0.00 42.92 42.42 1j5h s ASP 99 CO -0.09 -0.96 1.82 0.00 0.68 0.00 0.00 175.17 176.62 1j5h n ALA 100 N -1.95 4.69 0.00 2.11 0.00 -1.26 -2.94 120.51 121.16 1j5h n ALA 100 Ca 0.10 -1.50 0.00 0.00 0.00 0.00 0.00 53.44 52.04 1j5h n ALA 100 Cb 0.60 -1.31 0.00 0.00 0.00 0.00 0.00 19.45 18.75 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 0.18 0.00 -0.05 0.00 0.00 -1.26 -4.99 120.51 114.40 1j5h n ALA 101 Ca 0.28 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.64 1j5h n ALA 101 Cb 0.73 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 20.10 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 -0.03 0.00 0.00 0.00 -1.96 -3.48 103.07 97.60 1j5h h GLY 102 Ca 0.00 0.01 0.00 0.00 0.00 0.00 0.00 47.33 47.34 1j5h h GLY 102 CO 0.00 -0.01 0.00 1.16 0.00 0.00 0.00 176.54 177.69 1j5h n ASN 103 N -4.72 0.00 0.00 0.19 0.23 -1.15 -4.87 115.26 104.94 1j5h n ASN 103 Ca -0.06 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 53.99 1j5h n ASN 103 Cb 0.26 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 37.96 1j5h n ASN 103 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1j5h n GLY 104 N 0.00 0.41 0.00 4.83 0.00 -1.26 -4.80 105.19 104.37 1j5h n GLY 104 Ca 0.00 -1.91 0.00 0.00 0.00 0.00 0.00 46.02 44.11 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 0.00 -0.48 0.00 1.61 -0.04 -1.26 -5.07 135.00 129.76 1j5h n PRO 105 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 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 0.39 -0.04 0.00 0.00 175.50 175.85 1j5h n GLU 106 N -1.23 3.40 0.07 0.54 4.71 -1.26 -4.80 120.64 122.06 1j5h n GLU 106 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.15 1j5h n GLU 106 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 31.44 30.43 1j5h n GLU 106 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1j5h n GLY 107 N 2.78 -0.14 3.58 0.62 0.00 -1.26 -4.43 105.19 106.34 1j5h n GLY 107 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.92 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 -2.00 0.00 -0.31 1.61 0.11 -1.23 -3.86 120.40 114.72 1j5h s VAL 108 Ca 0.00 0.00 -0.21 0.00 -2.93 0.00 0.00 61.98 58.84 1j5h s VAL 108 Cb 0.00 -1.00 -0.00 0.00 -1.53 0.00 0.00 36.38 33.85 1j5h s VAL 108 CO 0.00 0.00 0.69 0.00 -3.33 0.00 0.00 175.10 172.46 1j5h s ALA 109 N -1.10 3.52 -0.06 1.54 0.00 -1.26 -1.46 121.76 122.93 1j5h s ALA 109 Ca -0.01 -0.59 -0.11 0.00 0.00 0.00 0.00 51.96 51.25 1j5h s ALA 109 Cb -0.00 -3.18 -0.05 0.00 0.00 0.00 0.00 23.12 19.89 1j5h s ALA 109 CO 0.01 -1.15 0.27 0.42 0.00 0.00 0.00 175.76 175.30 1j5h s ILE 110 N 2.75 5.28 -0.57 0.00 1.09 -0.67 -4.96 121.20 124.11 1j5h s ILE 110 Ca 0.28 0.51 -0.28 0.00 -1.10 0.00 0.00 60.65 60.05 1j5h s ILE 110 Cb -0.15 -3.55 0.03 0.00 -1.06 0.00 0.00 42.46 37.74 1j5h s ILE 110 CO 0.12 0.60 1.17 -0.55 -0.10 0.00 0.00 174.94 176.18 1j5h s SER 111 N -1.04 6.45 -0.06 3.58 0.15 -0.88 -4.30 113.70 117.60 1j5h s SER 111 Ca 0.19 0.09 0.01 0.00 0.70 0.00 0.00 55.95 56.94 1j5h s SER 111 Cb -0.14 -2.54 0.11 0.00 -1.71 0.00 0.00 66.02 61.74 1j5h s SER 111 CO 0.08 -1.45 0.95 0.49 1.20 0.00 0.00 173.24 174.52 1j5h n PHE 112 N 8.34 0.41 -0.46 3.44 3.01 -1.26 -1.46 117.46 129.48 1j5h n PHE 112 Ca 0.08 -0.46 0.00 0.00 1.01 0.00 0.00 57.45 58.08 1j5h n PHE 112 Cb 0.49 -0.28 0.00 0.00 -0.01 0.00 0.00 39.48 39.68 1j5h n PHE 112 CO 0.00 0.00 0.00 -1.71 1.01 0.00 0.00 176.76 176.06