#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 -2.97 -1.05 0.00 0.00 -1.24 -4.67 120.51 110.57 1j5h n ALA 2 Ca 0.00 0.46 -0.31 0.00 0.00 0.00 0.00 53.44 53.58 1j5h n ALA 2 Cb 0.00 -1.48 -0.02 0.00 0.00 0.00 0.00 19.45 17.94 1j5h n ALA 2 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1j5h n PRO 3 N 1.10 2.66 0.00 0.00 -0.04 -1.26 -3.39 135.00 134.07 1j5h n PRO 3 Ca 0.17 -1.84 0.06 0.00 -0.04 0.00 0.00 63.50 61.85 1j5h n PRO 3 Cb 0.14 -2.68 -0.03 0.00 -0.04 0.00 0.00 33.50 30.89 1j5h n PRO 3 CO 0.00 0.00 0.00 2.41 -0.04 0.00 0.00 175.50 177.87 1j5h n THR 4 N 4.22 0.00 -2.37 0.52 -1.04 0.01 -4.95 114.28 110.68 1j5h n THR 4 Ca 0.58 -0.31 -0.42 0.00 -2.04 0.00 0.00 64.05 61.86 1j5h n THR 4 Cb 0.21 1.09 -0.03 0.00 -1.82 0.00 0.00 70.33 69.78 1j5h n THR 4 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1j5h s ALA 5 N -1.82 3.44 0.01 2.41 0.00 -1.05 -1.87 121.76 122.88 1j5h s ALA 5 Ca 0.08 0.93 -0.23 0.00 0.00 0.00 0.00 51.96 52.74 1j5h s ALA 5 Cb 0.10 -3.44 0.05 0.00 0.00 0.00 0.00 23.12 19.83 1j5h s ALA 5 CO 0.39 -0.42 0.52 0.95 0.00 0.00 0.00 175.76 177.21 1j5h s THR 6 N 0.47 0.03 -0.26 0.00 -4.23 -0.50 -4.74 115.64 106.41 1j5h s THR 6 Ca 0.56 -0.23 -0.07 0.00 -1.18 0.00 0.00 61.69 60.77 1j5h s THR 6 Cb -0.32 -0.92 -0.02 0.00 1.34 0.00 0.00 72.50 72.59 1j5h s THR 6 CO 0.33 -0.13 0.07 -0.69 -0.54 0.00 0.00 174.62 173.67 1j5h s VAL 7 N -1.90 4.19 0.00 2.29 1.01 -1.26 -1.97 120.40 122.76 1j5h s VAL 7 Ca -0.08 -0.34 0.00 0.00 0.00 0.00 0.00 61.98 61.56 1j5h s VAL 7 Cb -0.01 -3.02 0.00 0.00 0.00 0.00 0.00 36.38 33.35 1j5h s VAL 7 CO 0.03 0.26 0.07 0.41 0.00 0.00 0.00 175.10 175.86 1j5h n THR 8 N 4.91 0.00 0.00 3.92 -1.04 -0.32 -3.31 114.28 118.45 1j5h n THR 8 Ca -0.16 0.10 0.00 0.00 -2.04 0.00 0.00 64.05 61.95 1j5h n THR 8 Cb 0.50 -0.14 0.00 0.00 -1.82 0.00 0.00 70.33 68.88 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 -1.81 0.00 -1.27 -2.82 -0.04 -1.26 -5.00 135.00 122.80 1j5h n PRO 9 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 1j5h n PRO 9 Cb 0.00 -0.11 0.00 0.00 -0.04 0.00 0.00 33.50 33.35 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 0.00 -0.75 -3.59 3.54 3.41 -1.21 -5.02 113.62 110.01 1j5h n SER 10 Ca 0.00 0.00 -0.11 0.00 -0.26 0.00 0.00 58.87 58.50 1j5h n SER 10 Cb 0.00 -0.30 -0.06 0.00 -0.26 0.00 0.00 64.21 63.59 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 -2.60 -0.42 -1.55 4.04 1.04 -1.25 -1.71 113.70 111.25 1j5h s SER 11 Ca 0.00 0.57 -0.14 0.00 0.48 0.00 0.00 55.95 56.86 1j5h s SER 11 Cb 0.00 0.50 0.09 0.00 0.10 0.00 0.00 66.02 66.71 1j5h s SER 11 CO 0.00 -0.30 0.92 0.61 0.98 0.00 0.00 173.24 175.44 1j5h n GLY 12 N 1.19 -0.47 0.00 7.32 0.00 -0.90 -4.89 105.19 107.44 1j5h n GLY 12 Ca -0.12 0.18 0.00 0.00 0.00 0.00 0.00 46.02 46.08 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 -4.60 0.00 -3.62 0.99 4.77 -0.75 -4.83 117.00 108.97 1j5h n LEU 13 Ca 0.02 0.00 -0.07 0.00 -0.03 0.00 0.00 56.01 55.93 1j5h n LEU 13 Cb 0.53 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.60 1j5h n LEU 13 CO 0.77 0.00 0.63 -0.55 -1.33 0.00 0.00 177.39 176.91 1j5h s SER 14 N -1.00 -0.32 -0.50 -1.43 0.15 -1.26 -2.70 113.70 106.63 1j5h s SER 14 Ca 0.00 -0.21 -0.27 0.00 0.70 0.00 0.00 55.95 56.18 1j5h s SER 14 Cb 0.00 0.49 -0.08 0.00 -1.71 0.00 0.00 66.02 64.72 1j5h s SER 14 CO 0.00 -0.85 2.42 -0.90 1.20 0.00 0.00 173.24 175.11 1j5h n ASP 15 N -0.37 2.23 -0.10 5.45 5.75 -1.26 -0.31 116.55 127.95 1j5h n ASP 15 Ca -0.09 -0.38 0.00 0.00 -0.01 0.00 0.00 54.79 54.31 1j5h n ASP 15 Cb 0.62 -1.53 0.00 0.00 -1.03 0.00 0.00 41.12 39.18 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 6.04 1.18 3.57 6.12 0.00 -1.19 -4.73 105.19 116.18 1j5h n GLY 16 Ca 0.39 -0.28 -0.41 0.00 0.00 0.00 0.00 46.02 45.72 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 -2.19 3.99 -0.63 2.61 2.01 0.58 -4.63 115.64 117.37 1j5h s THR 17 Ca 0.00 -1.22 -0.27 0.00 0.31 0.00 0.00 61.69 60.51 1j5h s THR 17 Cb 0.00 -5.09 -0.00 0.00 0.01 0.00 0.00 72.50 67.41 1j5h s THR 17 CO 0.00 -1.95 1.65 -0.69 -0.69 0.00 0.00 174.62 172.94 1j5h s VAL 18 N 4.83 3.50 0.42 3.82 1.01 -1.25 -1.63 120.40 131.10 1j5h s VAL 18 Ca 0.50 0.31 0.07 0.00 0.00 0.00 0.00 61.98 62.86 1j5h s VAL 18 Cb 0.02 -4.25 -0.07 0.00 0.00 0.00 0.00 36.38 32.07 1j5h s VAL 18 CO -0.02 -1.19 0.06 0.68 0.00 0.00 0.00 175.10 174.63 1j5h s VAL 19 N 7.79 2.03 0.05 2.92 -7.23 -0.75 -4.82 120.40 120.39 1j5h s VAL 19 Ca 0.57 -1.91 -0.30 0.00 -1.81 0.00 0.00 61.98 58.53 1j5h s VAL 19 Cb -0.11 -2.95 -0.07 0.00 0.56 0.00 0.00 36.38 33.81 1j5h s VAL 19 CO 0.20 0.00 1.59 -0.54 -0.31 0.00 0.00 175.10 176.04 1j5h s LYS 20 N -3.78 4.22 0.02 4.82 1.02 -1.26 -1.06 119.74 123.72 1j5h s LYS 20 Ca 0.35 2.24 0.08 0.00 0.02 0.00 0.00 55.97 58.65 1j5h s LYS 20 Cb 0.08 -3.61 -0.02 0.00 -0.52 0.00 0.00 37.83 33.75 1j5h s LYS 20 CO 0.18 -0.70 -0.23 0.08 -0.92 0.00 0.00 175.35 173.76 1j5h s VAL 21 N 2.65 1.87 0.09 3.17 1.01 0.30 -1.17 120.40 128.32 1j5h s VAL 21 Ca 0.71 -1.19 -0.01 0.00 0.00 0.00 0.00 61.98 61.50 1j5h s VAL 21 Cb -0.37 -1.59 -0.04 0.00 0.00 0.00 0.00 36.38 34.38 1j5h s VAL 21 CO 0.31 0.36 0.02 0.00 0.00 0.00 0.00 175.10 175.78 1j5h s ALA 22 N -0.71 0.67 0.00 5.51 0.00 -0.83 -0.03 121.76 126.37 1j5h s ALA 22 Ca 0.09 -1.33 0.00 0.00 0.00 0.00 0.00 51.96 50.72 1j5h s ALA 22 Cb -0.09 0.58 0.00 0.00 0.00 0.00 0.00 23.12 23.60 1j5h s ALA 22 CO 0.01 -0.43 0.00 0.41 0.00 0.00 0.00 175.76 175.75 1j5h n GLY 23 N 0.00 -1.76 0.00 0.00 0.00 0.18 -1.42 105.19 102.20 1j5h n GLY 23 Ca -0.10 -1.48 0.00 0.00 0.00 0.00 0.00 46.02 44.44 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 0.98 0.00 1.61 4.61 0.00 -0.78 -0.43 120.51 126.51 1j5h n ALA 24 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.56 1j5h n ALA 24 Cb 0.00 0.00 0.73 0.00 0.00 0.00 0.00 19.45 20.18 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 -0.81 4.02 0.00 0.00 -1.22 -0.81 105.19 106.38 1j5h n GLY 25 Ca 0.00 -0.15 -0.44 0.00 0.00 0.00 0.00 46.02 45.43 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 -0.98 -0.57 0.00 0.99 7.94 -0.99 -3.72 117.00 119.68 1j5h n LEU 26 Ca 0.18 -1.25 0.00 0.00 -1.11 0.00 0.00 56.01 53.84 1j5h n LEU 26 Cb 0.08 -1.66 0.00 0.00 0.53 0.00 0.00 43.42 42.37 1j5h n LEU 26 CO 0.14 0.75 0.00 1.67 -1.11 0.00 0.00 177.39 178.84 1j5h n GLN 27 N -4.73 0.00 0.00 1.96 -0.06 0.59 -4.62 117.38 110.53 1j5h n GLN 27 Ca -0.13 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 54.87 1j5h n GLN 27 Cb 0.58 0.00 0.00 0.00 -4.06 0.00 0.00 30.24 26.76 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 -4.06 1.69 0.00 -1.25 -3.73 120.51 110.15 1j5h n ALA 28 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 53.44 53.03 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 -0.68 3.07 0.00 0.00 -1.20 -4.88 105.19 101.51 1j5h n GLY 29 Ca 0.00 0.31 -0.12 0.00 0.00 0.00 0.00 46.02 46.21 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 -3.71 0.49 0.52 2.61 -1.32 -1.26 -4.79 115.64 108.18 1j5h s THR 30 Ca 0.37 -1.28 -0.21 0.00 -1.21 0.00 0.00 61.69 59.36 1j5h s THR 30 Cb -0.19 -0.84 -0.08 0.00 -1.51 0.00 0.00 72.50 69.89 1j5h s THR 30 CO 0.96 -0.54 1.00 0.00 -2.21 0.00 0.00 174.62 173.83 1j5h n ALA 31 N 1.09 0.26 -3.18 11.08 0.00 -1.26 -0.27 120.51 128.24 1j5h n ALA 31 Ca -0.20 0.11 -0.19 0.00 0.00 0.00 0.00 53.44 53.16 1j5h n ALA 31 Cb 0.56 -2.11 -0.06 0.00 0.00 0.00 0.00 19.45 17.84 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 -1.40 0.15 0.04 0.00 2.02 0.18 -4.03 117.35 114.31 1j5h s TYR 32 Ca 0.69 -1.72 -0.32 0.00 -0.37 0.00 0.00 57.07 55.35 1j5h s TYR 32 Cb -0.48 -0.49 -0.11 0.00 -0.40 0.00 0.00 41.96 40.48 1j5h s TYR 32 CO 0.52 -0.98 1.83 -0.25 -1.57 0.00 0.00 175.55 175.10 1j5h n ASP 33 N 2.89 3.71 -4.74 2.29 8.00 0.51 -1.78 116.55 127.43 1j5h n ASP 33 Ca 0.26 0.98 -0.33 0.00 0.71 0.00 0.00 54.79 56.41 1j5h n ASP 33 Cb 0.51 -1.46 0.09 0.00 -0.02 0.00 0.00 41.12 40.23 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 3.16 2.67 0.00 2.53 1.01 0.14 -0.14 120.40 129.77 1j5h s VAL 34 Ca 0.86 0.30 0.00 0.00 0.00 0.00 0.00 61.98 63.14 1j5h s VAL 34 Cb -0.58 -2.79 0.00 0.00 0.00 0.00 0.00 36.38 33.01 1j5h s VAL 34 CO 0.43 -0.20 0.00 0.61 0.00 0.00 0.00 175.10 175.94 1j5h n GLY 35 N -0.05 6.23 0.00 4.51 0.00 0.50 -4.43 105.19 111.95 1j5h n GLY 35 Ca 0.12 -1.66 0.00 0.00 0.00 0.00 0.00 46.02 44.48 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 0.00 0.00 -4.52 1.61 -0.06 -1.26 -4.30 117.38 108.85 1j5h n GLN 36 Ca 0.00 0.00 -0.25 0.00 -2.00 0.00 0.00 57.00 54.75 1j5h n GLN 36 Cb 0.00 0.00 -0.09 0.00 -4.06 0.00 0.00 30.24 26.09 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 -3.21 0.99 -0.38 0.00 0.00 0.21 -0.03 121.76 119.33 1j5h s ALA 38 Ca 0.26 -0.47 -0.11 0.00 0.00 0.00 0.00 51.96 51.64 1j5h s ALA 38 Cb 0.04 -0.28 0.03 0.00 0.00 0.00 0.00 23.12 22.91 1j5h s ALA 38 CO 0.14 0.22 0.21 -0.46 0.00 0.00 0.00 175.76 175.86 1j5h s TRP 39 N -0.13 3.25 0.00 0.00 -0.11 -1.26 0.35 118.94 121.04 1j5h s TRP 39 Ca 0.02 -1.04 0.00 0.00 1.22 0.00 0.00 56.10 56.30 1j5h s TRP 39 Cb -0.06 -2.47 0.00 0.00 -1.50 0.00 0.00 33.47 29.44 1j5h s TRP 39 CO -0.00 -0.67 0.00 0.28 -4.62 0.00 0.00 176.95 171.94 1j5h n VAL 40 N 4.98 0.00 -0.74 5.86 0.31 0.11 -4.51 118.33 124.34 1j5h n VAL 40 Ca -0.12 0.00 -0.19 0.00 -0.01 0.00 0.00 64.34 64.03 1j5h n VAL 40 Cb 0.46 0.00 0.08 0.00 -0.91 0.00 0.00 33.84 33.47 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 5.29 0.00 4.52 4.64 -1.24 -4.89 116.55 124.87 1j5h n ASP 41 Ca 0.00 -3.16 0.00 0.00 -1.38 0.00 0.00 54.79 50.25 1j5h n ASP 41 Cb 0.00 -0.89 0.00 0.00 -1.04 0.00 0.00 41.12 39.19 1j5h n ASP 41 CO 0.00 0.00 0.00 0.41 -0.82 0.00 0.00 177.20 176.79 1j5h n THR 42 N -0.26 0.00 0.29 5.18 -1.04 -1.26 -4.12 114.28 113.07 1j5h n THR 42 Ca 0.39 0.00 0.15 0.00 -2.04 0.00 0.00 64.05 62.54 1j5h n THR 42 Cb 0.90 0.00 0.69 0.00 -1.82 0.00 0.00 70.33 70.09 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 -5.91 3.41 0.00 -1.99 -3.39 103.07 95.18 1j5h h GLY 43 Ca 0.00 0.00 -0.66 0.00 0.00 0.00 0.00 47.33 46.67 1j5h h GLY 43 CO 0.00 0.00 -0.86 0.14 0.00 0.00 0.00 176.54 175.82 1j5h s VAL 44 N -3.60 1.98 -0.13 4.60 1.01 -1.26 -5.08 120.40 117.92 1j5h s VAL 44 Ca 0.00 -0.91 0.00 0.00 0.00 0.00 0.00 61.98 61.08 1j5h s VAL 44 Cb 0.09 -1.77 0.02 0.00 0.00 0.00 0.00 36.38 34.72 1j5h s VAL 44 CO 0.37 0.53 -0.13 -0.22 0.00 0.00 0.00 175.10 175.65 1j5h s LEU 45 N 1.07 1.56 -0.67 3.92 0.20 -1.26 -0.72 118.68 122.78 1j5h s LEU 45 Ca -0.01 -0.42 -0.16 0.00 0.69 0.00 0.00 54.13 54.23 1j5h s LEU 45 Cb -0.14 -1.06 0.16 0.00 -0.43 0.00 0.00 46.19 44.72 1j5h s LEU 45 CO -0.07 -0.05 0.65 0.00 -0.29 0.00 0.00 176.35 176.59 1j5h s ALA 46 N 1.41 3.77 0.63 5.97 0.00 0.16 -3.48 121.76 130.22 1j5h s ALA 46 Ca 0.02 -2.81 -0.14 0.00 0.00 0.00 0.00 51.96 49.03 1j5h s ALA 46 Cb -0.13 -3.43 -0.02 0.00 0.00 0.00 0.00 23.12 19.54 1j5h s ALA 46 CO -0.08 -2.20 1.07 0.00 0.00 0.00 0.00 175.76 174.55 1j5h s ASN 48 N -2.98 5.10 0.00 0.00 3.84 0.35 -0.84 114.94 120.41 1j5h s ASN 48 Ca 0.63 -3.00 0.00 0.00 0.21 0.00 0.00 52.86 50.70 1j5h s ASN 48 Cb -0.16 -1.81 0.00 0.00 -0.55 0.00 0.00 41.25 38.72 1j5h s ASN 48 CO 0.42 -0.32 1.11 -0.81 -2.79 0.00 0.00 177.10 174.71 1j5h n PRO 49 N 3.26 0.75 0.00 0.43 -0.04 -1.26 -2.02 135.00 136.11 1j5h n PRO 49 Ca 0.09 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.55 1j5h n PRO 49 Cb 0.37 -1.13 0.00 0.00 -0.04 0.00 0.00 33.50 32.70 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 1.11 1.05 -0.34 0.55 0.00 -1.26 -4.84 120.51 116.78 1j5h n ALA 50 Ca 0.00 -0.47 0.16 0.00 0.00 0.00 0.00 53.44 53.13 1j5h n ALA 50 Cb 0.37 0.00 0.31 0.00 0.00 0.00 0.00 19.45 20.13 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 -0.08 -0.09 0.00 0.00 5.68 -0.86 -4.65 116.55 116.55 1j5h n ASP 51 Ca 0.00 1.67 0.00 0.00 -0.50 0.00 0.00 54.79 55.96 1j5h n ASP 51 Cb 0.36 -0.62 0.00 0.00 -1.14 0.00 0.00 41.12 39.72 1j5h n ASP 51 CO 0.00 0.00 0.00 0.49 -1.33 0.00 0.00 177.20 176.36 1j5h n PHE 52 N -5.46 0.00 -0.78 2.11 3.01 -1.26 -4.88 117.46 110.20 1j5h n PHE 52 Ca 0.24 0.00 -0.26 0.00 1.01 0.00 0.00 57.45 58.44 1j5h n PHE 52 Cb 0.79 0.00 -0.01 0.00 -0.01 0.00 0.00 39.48 40.25 1j5h n PHE 52 CO 0.00 0.00 0.00 0.43 1.01 0.00 0.00 176.76 178.20 1j5h n SER 53 N 1.43 -1.50 -3.68 4.37 7.64 -1.26 -4.62 113.62 115.99 1j5h n SER 53 Ca 0.00 0.52 -0.14 0.00 1.01 0.00 0.00 58.87 60.26 1j5h n SER 53 Cb 0.00 -0.53 -0.08 0.00 -1.01 0.00 0.00 64.21 62.58 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 -0.59 -0.56 0.00 6.43 1.04 -1.26 0.29 113.70 119.04 1j5h s SER 54 Ca 0.36 1.05 0.00 0.00 0.48 0.00 0.00 55.95 57.84 1j5h s SER 54 Cb -0.42 1.06 0.00 0.00 0.10 0.00 0.00 66.02 66.77 1j5h s SER 54 CO 0.36 -0.23 0.00 0.55 0.98 0.00 0.00 173.24 174.91 1j5h n VAL 55 N 2.61 0.00 -4.22 5.02 3.14 -0.74 -4.84 118.33 119.30 1j5h n VAL 55 Ca -0.14 0.00 -0.13 0.00 -2.96 0.00 0.00 64.34 61.11 1j5h n VAL 55 Cb 0.56 0.00 -0.10 0.00 -1.06 0.00 0.00 33.84 33.24 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 -1.65 0.08 0.38 1.55 2.01 -1.26 0.51 115.64 117.25 1j5h s THR 56 Ca 0.00 -2.00 -0.01 0.00 0.31 0.00 0.00 61.69 59.99 1j5h s THR 56 Cb 0.00 -2.52 -0.03 0.00 0.01 0.00 0.00 72.50 69.96 1j5h s THR 56 CO 0.00 0.00 0.60 0.00 -0.69 0.00 0.00 174.62 174.53 1j5h s ALA 57 N -4.09 3.65 -0.20 7.40 0.00 0.63 -4.03 121.76 125.13 1j5h s ALA 57 Ca 0.39 -0.85 0.01 0.00 0.00 0.00 0.00 51.96 51.51 1j5h s ALA 57 Cb 0.07 -2.20 0.03 0.00 0.00 0.00 0.00 23.12 21.02 1j5h s ALA 57 CO 0.13 -0.12 -0.17 0.16 0.00 0.00 0.00 175.76 175.75 1j5h s ASP 58 N -4.07 3.42 0.00 0.00 1.47 0.14 -3.24 116.67 114.40 1j5h s ASP 58 Ca 0.42 -0.76 0.00 0.00 1.18 0.00 0.00 52.55 53.39 1j5h s ASP 58 Cb -0.10 -1.51 0.00 0.00 -0.34 0.00 0.00 42.92 40.97 1j5h s ASP 58 CO 0.38 -0.03 0.00 0.00 0.68 0.00 0.00 175.17 176.19 1j5h n ALA 59 N 4.60 0.00 -0.34 2.11 0.00 -1.26 0.14 120.51 125.76 1j5h n ALA 59 Ca -0.20 0.00 0.17 0.00 0.00 0.00 0.00 53.44 53.41 1j5h n ALA 59 Cb 0.49 0.00 0.33 0.00 0.00 0.00 0.00 19.45 20.27 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 -0.34 0.00 0.00 4.21 -1.94 -3.32 115.58 114.19 1j5h h ASN 60 Ca 0.00 0.27 0.00 0.00 1.21 0.00 0.00 56.30 57.78 1j5h h ASN 60 Cb 0.00 0.44 0.00 0.00 -1.12 0.00 0.00 38.32 37.64 1j5h h ASN 60 CO 0.00 -0.35 0.00 0.61 -1.29 0.00 0.00 177.43 176.40 1j5h n GLY 61 N -1.46 0.75 3.76 2.83 0.00 0.37 -3.97 105.19 107.48 1j5h n GLY 61 Ca 0.25 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.88 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 -0.74 7.53 0.60 1.61 0.15 -1.22 -0.30 113.70 121.33 1j5h s SER 62 Ca 0.00 1.83 -0.09 0.00 0.70 0.00 0.00 55.95 58.39 1j5h s SER 62 Cb 0.00 -2.57 -0.03 0.00 -1.71 0.00 0.00 66.02 61.72 1j5h s SER 62 CO 0.00 0.16 0.97 0.00 1.20 0.00 0.00 173.24 175.57 1j5h s ALA 63 N -1.21 3.16 -0.29 5.45 0.00 0.43 -0.68 121.76 128.62 1j5h s ALA 63 Ca 0.40 -0.29 0.01 0.00 0.00 0.00 0.00 51.96 52.09 1j5h s ALA 63 Cb -0.24 -2.91 0.19 0.00 0.00 0.00 0.00 23.12 20.16 1j5h s ALA 63 CO 0.29 -0.68 0.57 -1.54 0.00 0.00 0.00 175.76 174.39 1j5h s SER 64 N -4.20 -1.23 0.00 0.00 1.04 -1.26 0.49 113.70 108.55 1j5h s SER 64 Ca 0.53 0.50 0.00 0.00 0.48 0.00 0.00 55.95 57.47 1j5h s SER 64 Cb -0.11 1.97 0.00 0.00 0.10 0.00 0.00 66.02 67.98 1j5h s SER 64 CO 0.51 -0.28 0.00 1.07 0.98 0.00 0.00 173.24 175.51 1j5h n THR 65 N 5.42 0.00 -2.97 2.02 5.66 0.96 -4.90 114.28 120.48 1j5h n THR 65 Ca 0.01 0.00 -0.41 0.00 -3.05 0.00 0.00 64.05 60.60 1j5h n THR 65 Cb 0.52 0.00 -0.05 0.00 -1.55 0.00 0.00 70.33 69.25 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 6.91 -0.02 1.09 0.01 -1.26 0.11 113.70 120.54 1j5h s SER 66 Ca 0.00 1.12 0.05 0.00 1.31 0.00 0.00 55.95 58.43 1j5h s SER 66 Cb 0.00 -2.42 -0.03 0.00 0.21 0.00 0.00 66.02 63.78 1j5h s SER 66 CO 0.00 -0.31 -0.17 -0.76 0.41 0.00 0.00 173.24 172.41 1j5h s LEU 67 N 1.77 2.60 -0.56 2.44 1.02 -0.23 -4.86 118.68 120.87 1j5h s LEU 67 Ca 0.36 -0.29 -0.28 0.00 0.02 0.00 0.00 54.13 53.94 1j5h s LEU 67 Cb -0.17 -1.52 0.03 0.00 0.02 0.00 0.00 46.19 44.56 1j5h s LEU 67 CO 0.14 0.32 1.16 0.28 0.02 0.00 0.00 176.35 178.27 1j5h s THR 68 N -0.76 4.08 -1.23 5.49 -1.32 -1.26 -1.81 115.64 118.82 1j5h s THR 68 Ca 0.12 0.92 -0.13 0.00 -1.21 0.00 0.00 61.69 61.39 1j5h s THR 68 Cb -0.10 -4.69 -0.06 0.00 -1.51 0.00 0.00 72.50 66.14 1j5h s THR 68 CO 0.01 -1.26 2.34 0.52 -2.21 0.00 0.00 174.62 174.02 1j5h n VAL 69 N 6.67 3.11 -1.54 5.08 0.31 -0.65 -4.75 118.33 126.56 1j5h n VAL 69 Ca 0.09 -2.24 -0.46 0.00 -0.01 0.00 0.00 64.34 61.72 1j5h n VAL 69 Cb 0.49 -2.44 -0.02 0.00 -0.91 0.00 0.00 33.84 30.95 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 5.18 1.00 0.00 5.55 1.74 -1.26 -3.16 116.66 125.71 1j5h n ARG 70 Ca 0.57 0.35 0.00 0.00 -0.77 0.00 0.00 57.85 58.00 1j5h n ARG 70 Cb 0.29 -1.66 0.00 0.00 -1.02 0.00 0.00 32.46 30.07 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 0.95 0.00 -3.01 5.56 0.63 -1.26 -4.70 116.66 114.83 1j5h n ARG 71 Ca 0.12 0.00 -0.42 0.00 -0.92 0.00 0.00 57.85 56.64 1j5h n ARG 71 Cb 0.29 -0.14 -0.06 0.00 0.45 0.00 0.00 32.46 33.00 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 -2.38 6.57 0.15 6.15 1.04 -1.26 -1.31 113.70 122.65 1j5h s SER 72 Ca 0.00 0.49 -0.04 0.00 0.48 0.00 0.00 55.95 56.88 1j5h s SER 72 Cb 0.00 -2.38 0.02 0.00 0.10 0.00 0.00 66.02 63.76 1j5h s SER 72 CO 0.00 -0.60 0.27 2.22 0.98 0.00 0.00 173.24 176.11 1j5h n PHE 73 N 6.14 -1.31 -3.76 5.02 -1.74 -0.05 -4.85 117.46 116.91 1j5h n PHE 73 Ca 0.02 -0.78 -0.36 0.00 -0.56 0.00 0.00 57.45 55.77 1j5h n PHE 73 Cb 0.48 0.31 -0.11 0.00 1.52 0.00 0.00 39.48 41.69 1j5h n PHE 73 CO 0.00 0.00 0.00 -2.00 -0.56 0.00 0.00 176.76 174.20 1j5h s GLU 74 N -2.12 2.31 0.13 3.97 -6.30 -1.23 -0.62 118.70 114.84 1j5h s GLU 74 Ca 0.08 -2.29 -0.06 0.00 -2.50 0.00 0.00 54.97 50.19 1j5h s GLU 74 Cb -0.01 -3.64 -0.06 0.00 0.00 0.00 0.00 34.13 30.42 1j5h s GLU 74 CO 0.06 -1.13 0.39 0.20 0.02 0.00 0.00 175.26 174.80 1j5h s GLY 75 N 0.98 2.26 -0.08 -1.50 0.00 -1.26 -4.79 107.32 102.93 1j5h s GLY 75 Ca 0.14 -0.50 0.00 0.00 0.00 0.00 0.00 44.72 44.36 1j5h s GLY 75 CO -0.03 -0.38 -0.07 -0.11 0.00 0.00 0.00 173.10 172.51 1j5h s PHE 76 N -1.60 2.95 0.08 1.90 -0.71 -0.02 -0.56 117.98 120.02 1j5h s PHE 76 Ca 0.39 -0.03 -0.16 0.00 -1.04 0.00 0.00 56.93 56.09 1j5h s PHE 76 Cb -0.12 -1.75 -0.04 0.00 -1.21 0.00 0.00 43.02 39.90 1j5h s PHE 76 CO 0.23 0.27 1.16 1.28 -1.34 0.00 0.00 175.22 176.82 1j5h n LEU 77 N 2.42 -0.54 0.00 -1.99 4.32 0.28 -0.63 117.00 120.85 1j5h n LEU 77 Ca -0.18 1.28 0.00 0.00 -0.02 0.00 0.00 56.01 57.09 1j5h n LEU 77 Cb 0.53 -0.30 0.00 0.00 -1.62 0.00 0.00 43.42 42.03 1j5h n LEU 77 CO 0.28 -0.92 0.00 0.33 -1.22 0.00 0.00 177.39 175.85 1j5h n PHE 78 N -4.16 0.00 0.00 -1.77 -0.00 -1.26 -4.24 117.46 106.03 1j5h n PHE 78 Ca 0.01 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.46 1j5h n PHE 78 Cb 0.13 0.00 0.00 0.00 -0.00 0.00 0.00 39.48 39.61 1j5h n PHE 78 CO 0.00 0.00 0.00 -3.47 -0.00 0.00 0.00 176.76 173.29 1j5h n ASP 79 N 0.00 0.00 0.03 -2.13 2.03 -1.26 -5.04 116.55 110.18 1j5h n ASP 79 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 1j5h n ASP 79 Cb 0.00 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.40 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 -0.84 3.54 0.27 0.00 -1.26 -5.16 105.19 101.74 1j5h n GLY 80 Ca 0.00 0.28 -0.09 0.00 0.00 0.00 0.00 46.02 46.21 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 0.02 0.03 2.61 2.01 -1.26 -5.07 115.64 111.97 1j5h s THR 81 Ca 0.00 -1.05 0.08 0.00 0.31 0.00 0.00 61.69 61.02 1j5h s THR 81 Cb 0.00 -1.82 -0.02 0.00 0.01 0.00 0.00 72.50 70.67 1j5h s THR 81 CO 0.00 -0.10 -0.23 0.00 -0.69 0.00 0.00 174.62 173.60 1j5h s ARG 82 N -3.93 1.65 0.00 4.92 1.70 -1.26 -0.56 118.95 121.47 1j5h s ARG 82 Ca 0.14 -0.95 0.00 0.00 -0.47 0.00 0.00 55.73 54.45 1j5h s ARG 82 Cb -0.01 -1.73 0.00 0.00 -0.57 0.00 0.00 34.95 32.64 1j5h s ARG 82 CO 0.02 0.45 0.00 0.91 -1.08 0.00 0.00 175.30 175.60 1j5h n TRP 83 N 2.04 0.00 0.00 5.89 7.02 0.28 -4.92 117.44 127.75 1j5h n TRP 83 Ca -0.17 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.31 1j5h n TRP 83 Cb 0.53 0.00 0.00 0.00 -2.42 0.00 0.00 31.31 29.42 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 2.92 0.37 3.30 6.99 0.00 -1.25 -4.94 105.19 112.57 1j5h n GLY 84 Ca 0.00 -1.15 -0.41 0.00 0.00 0.00 0.00 46.02 44.47 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 -0.77 0.70 -4.01 2.61 -1.04 -1.19 -3.53 114.28 107.05 1j5h n THR 85 Ca 0.00 -0.59 -0.22 0.00 -2.04 0.00 0.00 64.05 61.20 1j5h n THR 85 Cb 0.00 -2.08 -0.05 0.00 -1.82 0.00 0.00 70.33 66.38 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 6.07 3.21 -0.42 12.58 0.11 0.21 -4.70 120.40 137.46 1j5h s VAL 86 Ca 0.60 -1.59 -0.29 0.00 -2.93 0.00 0.00 61.98 57.77 1j5h s VAL 86 Cb 0.14 -3.05 0.02 0.00 -1.53 0.00 0.00 36.38 31.96 1j5h s VAL 86 CO 0.24 -0.18 1.16 -1.81 -3.33 0.00 0.00 175.10 171.17 1j5h s ASP 87 N -3.89 6.69 0.39 3.54 -0.00 -1.26 -0.87 116.67 121.27 1j5h s ASP 87 Ca 0.39 0.72 0.15 0.00 -0.00 0.00 0.00 52.55 53.80 1j5h s ASP 87 Cb -0.04 -2.55 0.82 0.00 -0.00 0.00 0.00 42.92 41.16 1j5h s ASP 87 CO 0.24 -1.16 1.86 0.00 -0.00 0.00 0.00 175.17 176.11 1j5h h THR 89 N 0.00 0.12 0.00 0.00 1.03 -1.79 3.10 112.91 115.38 1j5h h THR 89 Ca -0.00 0.00 -0.07 0.00 -0.01 0.00 0.00 66.41 66.32 1j5h h THR 89 Cb 0.62 0.35 -0.01 0.00 -1.07 0.00 0.00 68.15 68.04 1j5h h THR 89 CO 0.04 0.00 -0.36 0.74 -0.01 0.00 0.00 175.52 175.94 1j5h h THR 90 N 0.00 0.73 0.00 0.00 2.02 -1.73 -3.16 112.91 110.76 1j5h h THR 90 Ca 0.21 -1.62 0.00 0.00 0.77 0.00 0.00 66.41 65.77 1j5h h THR 90 Cb 1.71 2.06 0.00 0.00 -1.74 0.00 0.00 68.15 70.18 1j5h h THR 90 CO -0.00 0.35 -0.01 0.00 0.37 0.00 0.00 175.52 176.23 1j5h n ALA 91 N -2.24 1.87 -3.09 6.16 0.00 0.91 -5.06 120.51 119.05 1j5h n ALA 91 Ca 0.01 -1.05 -0.00 0.00 0.00 0.00 0.00 53.44 52.40 1j5h n ALA 91 Cb 0.57 -0.04 -0.00 0.00 0.00 0.00 0.00 19.45 19.98 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 -0.49 -2.12 -1.01 0.00 0.00 0.54 -4.08 120.51 113.36 1j5h n ALA 92 Ca 0.01 0.14 -0.02 0.00 0.00 0.00 0.00 53.44 53.58 1j5h n ALA 92 Cb 0.33 -0.69 0.02 0.00 0.00 0.00 0.00 19.45 19.10 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 -3.19 0.48 -0.19 0.00 0.00 0.95 -1.67 119.66 116.03 1j5h s GLN 94 Ca 0.05 -0.34 0.00 0.00 -0.00 0.00 0.00 55.36 55.08 1j5h s GLN 94 Cb -0.00 0.20 0.04 0.00 0.00 0.00 0.00 33.01 33.25 1j5h s GLN 94 CO 0.04 -0.11 -0.07 0.08 0.00 0.00 0.00 175.29 175.22 1j5h s VAL 95 N -1.27 1.39 0.12 3.63 1.01 -0.48 -1.01 120.40 123.78 1j5h s VAL 95 Ca -0.14 -0.86 0.04 0.00 0.00 0.00 0.00 61.98 61.03 1j5h s VAL 95 Cb -0.07 -1.53 -0.04 0.00 0.00 0.00 0.00 36.38 34.74 1j5h s VAL 95 CO 0.02 0.12 -0.10 -0.83 0.00 0.00 0.00 175.10 174.30 1j5h s GLY 96 N 1.50 0.96 0.24 4.51 0.00 -1.26 -4.49 107.32 108.78 1j5h s GLY 96 Ca -0.01 -1.35 -0.07 0.00 0.00 0.00 0.00 44.72 43.30 1j5h s GLY 96 CO -0.08 -1.43 0.53 1.08 0.00 0.00 0.00 173.10 173.20 1j5h s LEU 97 N -2.82 4.13 0.03 0.66 1.02 -1.26 -0.37 118.68 120.07 1j5h s LEU 97 Ca 0.11 0.79 0.03 0.00 0.02 0.00 0.00 54.13 55.08 1j5h s LEU 97 Cb 0.00 -3.57 -0.02 0.00 0.02 0.00 0.00 46.19 42.63 1j5h s LEU 97 CO 0.00 -0.11 -0.08 -0.94 0.02 0.00 0.00 176.35 175.24 1j5h s SER 98 N -2.71 0.93 0.49 2.29 1.04 0.81 -4.53 113.70 112.03 1j5h s SER 98 Ca 0.45 -0.39 0.09 0.00 0.48 0.00 0.00 55.95 56.58 1j5h s SER 98 Cb -0.11 -0.02 0.05 0.00 0.10 0.00 0.00 66.02 66.03 1j5h s SER 98 CO 0.25 -0.07 0.68 1.51 0.98 0.00 0.00 173.24 176.59 1j5h s ASP 99 N -1.03 5.39 -0.25 7.02 1.47 -1.26 0.19 116.67 128.19 1j5h s ASP 99 Ca -0.04 -0.63 0.00 0.00 1.18 0.00 0.00 52.55 53.06 1j5h s ASP 99 Cb -0.07 -0.20 0.23 0.00 -0.34 0.00 0.00 42.92 42.55 1j5h s ASP 99 CO 0.00 -1.04 1.78 0.00 0.68 0.00 0.00 175.17 176.59 1j5h n ALA 100 N -2.04 4.56 0.00 2.11 0.00 -1.26 -2.80 120.51 121.09 1j5h n ALA 100 Ca 0.12 -1.41 0.00 0.00 0.00 0.00 0.00 53.44 52.15 1j5h n ALA 100 Cb 0.60 -1.28 0.00 0.00 0.00 0.00 0.00 19.45 18.77 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 0.19 0.00 -0.06 0.00 0.00 -1.26 -4.99 120.51 114.39 1j5h n ALA 101 Ca 0.27 0.00 -0.07 0.00 0.00 0.00 0.00 53.44 53.64 1j5h n ALA 101 Cb 0.74 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 20.13 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 -4.68 0.00 0.00 0.19 6.94 -1.12 -3.99 115.26 112.61 1j5h n ASN 103 Ca -0.07 0.00 0.00 0.00 -0.02 0.00 0.00 54.58 54.49 1j5h n ASN 103 Cb 0.25 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.67 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 0.19 3.81 4.83 0.00 -1.26 -1.19 105.19 111.57 1j5h n GLY 104 Ca 0.00 -1.93 -0.32 0.00 0.00 0.00 0.00 46.02 43.77 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 -1.39 3.15 -0.01 1.61 0.04 -1.26 -4.73 135.00 132.41 1j5h s PRO 105 Ca 0.00 1.05 -0.03 0.00 0.04 0.00 0.00 61.00 62.07 1j5h s PRO 105 Cb 0.00 -2.02 -0.01 0.00 0.04 0.00 0.00 34.50 32.52 1j5h s PRO 105 CO 0.00 -0.93 -0.05 0.39 0.04 0.00 0.00 177.00 176.45 1j5h n GLU 106 N -2.60 0.08 0.00 4.56 4.71 -1.26 -4.54 120.64 121.59 1j5h n GLU 106 Ca 0.08 0.03 0.00 0.00 -0.01 0.00 0.00 57.16 57.26 1j5h n GLU 106 Cb 0.53 -0.46 0.00 0.00 -1.01 0.00 0.00 31.44 30.50 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 2.46 1.78 3.23 0.62 0.00 -1.26 -4.90 105.19 107.12 1j5h n GLY 107 Ca -0.02 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.60 1j5h n GLY 107 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1j5h n VAL 108 N -0.30 3.01 -2.02 1.61 0.31 -1.26 -4.91 118.33 114.76 1j5h n VAL 108 Ca 0.00 -2.89 -0.43 0.00 -0.01 0.00 0.00 64.34 61.01 1j5h n VAL 108 Cb 0.00 -2.39 -0.03 0.00 -0.91 0.00 0.00 33.84 30.51 1j5h n VAL 108 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1j5h s ALA 109 N 5.33 3.10 0.04 3.52 0.00 -1.26 -1.38 121.76 131.10 1j5h s ALA 109 Ca 0.55 0.45 0.04 0.00 0.00 0.00 0.00 51.96 53.00 1j5h s ALA 109 Cb 0.08 -3.93 -0.04 0.00 0.00 0.00 0.00 23.12 19.24 1j5h s ALA 109 CO 0.05 -2.25 -0.06 0.42 0.00 0.00 0.00 175.76 173.91 1j5h s ILE 110 N 6.01 3.64 -0.55 0.00 1.01 -0.67 -4.97 121.20 125.66 1j5h s ILE 110 Ca 0.77 -0.93 -0.23 0.00 0.00 0.00 0.00 60.65 60.26 1j5h s ILE 110 Cb -0.25 -2.64 0.05 0.00 0.01 0.00 0.00 42.46 39.63 1j5h s ILE 110 CO 0.32 0.28 0.89 -0.55 0.00 0.00 0.00 174.94 175.88 1j5h s SER 111 N -1.76 6.31 -0.14 3.58 0.15 -0.69 -4.07 113.70 117.09 1j5h s SER 111 Ca 0.20 -0.47 -0.13 0.00 0.70 0.00 0.00 55.95 56.25 1j5h s SER 111 Cb -0.11 -2.41 -0.05 0.00 -1.71 0.00 0.00 66.02 61.74 1j5h s SER 111 CO 0.11 -1.18 0.27 -0.36 1.20 0.00 0.00 173.24 173.28 1j5h s PHE 112 N 3.73 3.51 0.00 3.44 0.40 -1.26 -1.81 117.98 125.99 1j5h s PHE 112 Ca 0.28 0.61 0.00 0.00 -0.60 0.00 0.00 56.93 57.22 1j5h s PHE 112 Cb -0.14 -2.27 0.00 0.00 0.51 0.00 0.00 43.02 41.12 1j5h s PHE 112 CO 0.18 0.36 0.00 -1.71 0.70 0.00 0.00 175.22 174.74