#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 -3.24 -1.54 0.00 0.00 -1.26 -4.83 120.51 109.64 1j5h n ALA 2 Ca 0.00 0.44 -0.29 0.00 0.00 0.00 0.00 53.44 53.59 1j5h n ALA 2 Cb 0.00 -1.13 0.13 0.00 0.00 0.00 0.00 19.45 18.45 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 -2.82 1.27 0.00 0.00 0.04 -1.26 -5.07 135.00 127.15 1j5h s PRO 3 Ca 0.00 0.34 0.00 0.00 0.04 0.00 0.00 61.00 61.38 1j5h s PRO 3 Cb 0.00 -1.85 0.00 0.00 0.04 0.00 0.00 34.50 32.69 1j5h s PRO 3 CO 0.00 -2.12 0.00 -2.37 0.04 0.00 0.00 177.00 172.55 1j5h n THR 4 N -3.72 0.00 -4.28 1.26 5.66 0.20 -4.66 114.28 108.74 1j5h n THR 4 Ca 0.07 0.00 -0.23 0.00 -3.05 0.00 0.00 64.05 60.84 1j5h n THR 4 Cb 0.59 0.00 -0.07 0.00 -1.55 0.00 0.00 70.33 69.30 1j5h n THR 4 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1j5h s ALA 5 N -2.00 3.20 0.19 1.79 0.00 -1.26 0.95 121.76 124.63 1j5h s ALA 5 Ca 0.00 -1.65 -0.15 0.00 0.00 0.00 0.00 51.96 50.16 1j5h s ALA 5 Cb 0.00 -0.80 0.02 0.00 0.00 0.00 0.00 23.12 22.34 1j5h s ALA 5 CO 0.00 0.25 0.46 0.95 0.00 0.00 0.00 175.76 177.42 1j5h s THR 6 N -2.32 0.04 -0.10 0.00 -4.23 -0.21 -4.35 115.64 104.46 1j5h s THR 6 Ca 0.32 -0.98 -0.13 0.00 -1.18 0.00 0.00 61.69 59.72 1j5h s THR 6 Cb -0.06 -1.68 -0.05 0.00 1.34 0.00 0.00 72.50 72.05 1j5h s THR 6 CO 0.20 -0.16 0.29 -0.69 -0.54 0.00 0.00 174.62 173.72 1j5h s VAL 7 N -3.91 5.27 0.16 2.29 1.01 -1.26 -1.75 120.40 122.21 1j5h s VAL 7 Ca 0.12 0.56 -0.25 0.00 0.00 0.00 0.00 61.98 62.41 1j5h s VAL 7 Cb 0.00 -3.61 0.02 0.00 0.00 0.00 0.00 36.38 32.79 1j5h s VAL 7 CO -0.01 0.50 1.41 0.41 0.00 0.00 0.00 175.10 177.40 1j5h n THR 8 N 2.71 -0.58 -1.51 3.92 -1.04 -0.63 -4.47 114.28 112.68 1j5h n THR 8 Ca -0.14 2.19 -0.30 0.00 -2.04 0.00 0.00 64.05 63.76 1j5h n THR 8 Cb 0.53 -2.76 0.19 0.00 -1.82 0.00 0.00 70.33 66.47 1j5h n THR 8 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 1j5h s PRO 9 N -5.57 0.09 0.00 -2.82 0.04 -1.26 -5.01 135.00 120.47 1j5h s PRO 9 Ca -0.11 -0.09 0.00 0.00 0.04 0.00 0.00 61.00 60.83 1j5h s PRO 9 Cb 0.12 -1.75 0.00 0.00 0.04 0.00 0.00 34.50 32.91 1j5h s PRO 9 CO 0.59 -2.83 0.50 -1.13 0.04 0.00 0.00 177.00 174.17 1j5h n SER 10 N -4.13 0.00 0.00 6.66 3.41 -1.26 -5.00 113.62 113.30 1j5h n SER 10 Ca 0.12 -1.23 0.00 0.00 -0.26 0.00 0.00 58.87 57.51 1j5h n SER 10 Cb 0.59 -0.05 0.00 0.00 -0.26 0.00 0.00 64.21 64.50 1j5h n SER 10 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1j5h n SER 11 N 0.00 0.00 -2.19 4.04 3.41 -1.24 -1.80 113.62 115.83 1j5h n SER 11 Ca 0.00 0.00 -0.16 0.00 -0.26 0.00 0.00 58.87 58.45 1j5h n SER 11 Cb 0.55 0.00 0.03 0.00 -0.26 0.00 0.00 64.21 64.52 1j5h n SER 11 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1j5h n GLY 12 N -0.18 -0.14 0.00 5.00 0.00 -0.58 -4.85 105.19 104.44 1j5h n GLY 12 Ca 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 46.02 45.88 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 -2.93 0.00 -3.53 0.99 4.77 -0.89 -4.69 117.00 110.73 1j5h n LEU 13 Ca -0.07 0.00 -0.08 0.00 -0.03 0.00 0.00 56.01 55.83 1j5h n LEU 13 Cb 0.58 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.65 1j5h n LEU 13 CO 0.34 0.00 0.66 -0.55 -1.33 0.00 0.00 177.39 176.51 1j5h s SER 14 N -1.00 -0.36 -0.71 -1.43 0.15 -1.26 -1.96 113.70 107.13 1j5h s SER 14 Ca 0.00 -0.05 -0.26 0.00 0.70 0.00 0.00 55.95 56.34 1j5h s SER 14 Cb 0.00 0.42 -0.07 0.00 -1.71 0.00 0.00 66.02 64.66 1j5h s SER 14 CO 0.00 -0.69 2.17 -0.62 1.20 0.00 0.00 173.24 175.30 1j5h s ASP 15 N -2.56 4.64 0.00 5.45 2.15 -1.26 -1.13 116.67 123.95 1j5h s ASP 15 Ca 0.05 0.18 0.00 0.00 0.43 0.00 0.00 52.55 53.21 1j5h s ASP 15 Cb -0.01 -2.54 0.00 0.00 -0.30 0.00 0.00 42.92 40.07 1j5h s ASP 15 CO -0.08 -3.02 0.00 0.61 -0.17 0.00 0.00 175.17 172.50 1j5h n GLY 16 N 6.38 1.25 3.52 2.66 0.00 -1.03 -4.63 105.19 113.35 1j5h n GLY 16 Ca 0.37 -0.26 -0.42 0.00 0.00 0.00 0.00 46.02 45.71 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 -2.15 3.97 -0.64 2.61 2.01 -0.29 -4.54 115.64 116.61 1j5h s THR 17 Ca 0.00 -0.18 -0.27 0.00 0.31 0.00 0.00 61.69 61.55 1j5h s THR 17 Cb 0.00 -4.89 0.01 0.00 0.01 0.00 0.00 72.50 67.62 1j5h s THR 17 CO 0.00 -1.77 1.53 -0.69 -0.69 0.00 0.00 174.62 173.00 1j5h s VAL 18 N 4.98 3.61 0.40 3.82 1.01 -1.25 -1.62 120.40 131.34 1j5h s VAL 18 Ca 0.35 0.41 0.08 0.00 0.00 0.00 0.00 61.98 62.81 1j5h s VAL 18 Cb -0.08 -4.43 -0.05 0.00 0.00 0.00 0.00 36.38 31.82 1j5h s VAL 18 CO 0.06 -1.32 0.15 0.68 0.00 0.00 0.00 175.10 174.68 1j5h s VAL 19 N 7.00 2.39 0.12 2.92 -7.23 -0.72 -4.79 120.40 120.08 1j5h s VAL 19 Ca 0.52 -1.74 -0.31 0.00 -1.81 0.00 0.00 61.98 58.64 1j5h s VAL 19 Cb -0.11 -2.98 -0.09 0.00 0.56 0.00 0.00 36.38 33.77 1j5h s VAL 19 CO 0.20 -0.04 1.59 -0.75 -0.31 0.00 0.00 175.10 175.79 1j5h s LYS 20 N -3.87 4.22 -0.02 4.82 2.20 -1.26 -0.96 119.74 124.86 1j5h s LYS 20 Ca 0.40 2.32 0.05 0.00 -0.36 0.00 0.00 55.97 58.37 1j5h s LYS 20 Cb 0.03 -3.35 -0.01 0.00 -1.51 0.00 0.00 37.83 32.99 1j5h s LYS 20 CO 0.22 -0.64 -0.15 0.08 -0.36 0.00 0.00 175.35 174.49 1j5h s VAL 21 N 1.77 1.22 0.05 4.02 1.01 0.25 -1.60 120.40 127.12 1j5h s VAL 21 Ca 0.71 -0.65 -0.01 0.00 0.00 0.00 0.00 61.98 62.03 1j5h s VAL 21 Cb -0.41 -1.02 -0.04 0.00 0.00 0.00 0.00 36.38 34.90 1j5h s VAL 21 CO 0.31 0.35 -0.03 0.00 0.00 0.00 0.00 175.10 175.73 1j5h s ALA 22 N -0.28 0.50 0.00 5.51 0.00 -0.72 -0.11 121.76 126.67 1j5h s ALA 22 Ca 0.04 -1.20 0.00 0.00 0.00 0.00 0.00 51.96 50.81 1j5h s ALA 22 Cb -0.07 0.27 0.00 0.00 0.00 0.00 0.00 23.12 23.32 1j5h s ALA 22 CO -0.00 -0.37 0.00 0.41 0.00 0.00 0.00 175.76 175.80 1j5h n GLY 23 N 0.13 1.01 0.00 0.00 0.00 0.81 -1.04 105.19 106.09 1j5h n GLY 23 Ca -0.14 -2.06 0.00 0.00 0.00 0.00 0.00 46.02 43.82 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 0.37 4.61 0.00 0.27 -1.52 120.51 125.68 1j5h n ALA 24 Ca 0.00 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.47 1j5h n ALA 24 Cb 0.00 0.00 0.17 0.00 0.00 0.00 0.00 19.45 19.62 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 -0.19 3.64 0.00 0.00 -1.26 0.60 105.19 107.98 1j5h n GLY 25 Ca 0.00 -0.04 -0.27 0.00 0.00 0.00 0.00 46.02 45.72 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 -0.99 -3.07 0.00 0.99 7.94 -1.03 -4.81 117.00 116.03 1j5h n LEU 26 Ca 0.04 -0.89 0.00 0.00 -1.11 0.00 0.00 56.01 54.06 1j5h n LEU 26 Cb 0.02 -2.33 0.00 0.00 0.53 0.00 0.00 43.42 41.64 1j5h n LEU 26 CO 0.03 0.24 0.00 0.00 -1.11 0.00 0.00 177.39 176.55 1j5h n GLN 27 N -3.58 0.00 -2.67 1.96 1.13 0.86 -4.58 117.38 110.49 1j5h n GLN 27 Ca -0.12 0.00 -0.01 0.00 -1.94 0.00 0.00 57.00 54.93 1j5h n GLN 27 Cb 0.59 0.00 0.02 0.00 0.11 0.00 0.00 30.24 30.97 1j5h n GLN 27 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1j5h s ALA 28 N -4.00 -4.83 -0.72 -1.58 0.00 -1.26 -3.22 121.76 106.15 1j5h s ALA 28 Ca 0.00 1.07 0.00 0.00 0.00 0.00 0.00 51.96 53.03 1j5h s ALA 28 Cb 0.00 -3.04 0.00 0.00 0.00 0.00 0.00 23.12 20.08 1j5h s ALA 28 CO 0.00 -2.56 0.00 0.41 0.00 0.00 0.00 175.76 173.61 1j5h n GLY 29 N 3.00 0.68 3.81 0.00 0.00 -1.24 -4.86 105.19 106.58 1j5h n GLY 29 Ca 0.08 -0.03 -0.31 0.00 0.00 0.00 0.00 46.02 45.76 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 -1.65 3.84 0.53 2.61 -1.32 -1.26 -4.25 115.64 114.13 1j5h s THR 30 Ca 0.00 0.64 -0.20 0.00 -1.21 0.00 0.00 61.69 60.92 1j5h s THR 30 Cb 0.00 -3.29 -0.06 0.00 -1.51 0.00 0.00 72.50 67.64 1j5h s THR 30 CO 0.00 -0.73 1.15 0.00 -2.21 0.00 0.00 174.62 172.83 1j5h s ALA 31 N -2.91 2.75 -0.45 11.08 0.00 -1.26 -1.07 121.76 129.90 1j5h s ALA 31 Ca 0.60 0.88 0.05 0.00 0.00 0.00 0.00 51.96 53.49 1j5h s ALA 31 Cb -0.15 -3.38 0.18 0.00 0.00 0.00 0.00 23.12 19.77 1j5h s ALA 31 CO 0.52 -0.80 0.50 0.71 0.00 0.00 0.00 175.76 176.70 1j5h s TYR 32 N -1.69 -0.22 0.10 0.00 2.02 0.13 -4.62 117.35 113.07 1j5h s TYR 32 Ca 0.71 -1.38 -0.35 0.00 -0.37 0.00 0.00 57.07 55.68 1j5h s TYR 32 Cb -0.26 -0.34 -0.14 0.00 -0.40 0.00 0.00 41.96 40.82 1j5h s TYR 32 CO 0.30 -1.03 1.58 -3.47 -1.57 0.00 0.00 175.55 171.35 1j5h n ASP 33 N 3.10 2.85 -4.77 2.29 2.03 0.24 -1.35 116.55 120.96 1j5h n ASP 33 Ca 0.22 1.08 -0.38 0.00 0.52 0.00 0.00 54.79 56.23 1j5h n ASP 33 Cb 0.51 -1.37 0.00 0.00 -0.72 0.00 0.00 41.12 39.54 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 1.31 2.82 0.17 5.18 1.01 0.20 0.19 120.40 131.28 1j5h s VAL 34 Ca 0.82 0.62 0.00 0.00 0.00 0.00 0.00 61.98 63.43 1j5h s VAL 34 Cb -0.74 -3.32 -0.00 0.00 0.00 0.00 0.00 36.38 32.32 1j5h s VAL 34 CO 0.42 0.00 0.02 0.61 0.00 0.00 0.00 175.10 176.15 1j5h n GLY 35 N 0.54 3.92 0.00 4.51 0.00 -0.63 -4.35 105.19 109.19 1j5h n GLY 35 Ca 0.08 -2.18 0.00 0.00 0.00 0.00 0.00 46.02 43.92 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 -0.41 0.00 -4.53 1.61 6.02 -1.26 -4.03 117.38 114.78 1j5h n GLN 36 Ca -0.06 0.00 -0.25 0.00 -0.01 0.00 0.00 57.00 56.68 1j5h n GLN 36 Cb 0.22 0.00 -0.09 0.00 1.02 0.00 0.00 30.24 31.39 1j5h n GLN 36 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1j5h s ALA 38 N -3.19 -1.09 0.49 0.00 0.00 0.15 -0.01 121.76 118.11 1j5h s ALA 38 Ca 0.26 1.52 -0.20 0.00 0.00 0.00 0.00 51.96 53.54 1j5h s ALA 38 Cb 0.04 -1.09 -0.08 0.00 0.00 0.00 0.00 23.12 21.99 1j5h s ALA 38 CO 0.13 -0.46 1.03 -0.46 0.00 0.00 0.00 175.76 176.00 1j5h s TRP 39 N 1.89 3.03 0.00 0.00 -0.00 -1.26 -0.11 118.94 122.50 1j5h s TRP 39 Ca -0.06 1.57 0.00 0.00 -0.00 0.00 0.00 56.10 57.61 1j5h s TRP 39 Cb -0.10 -3.03 0.00 0.00 -0.00 0.00 0.00 33.47 30.34 1j5h s TRP 39 CO -0.13 -0.78 0.00 0.28 -0.00 0.00 0.00 176.95 176.32 1j5h n VAL 40 N -1.06 0.00 -0.61 5.86 0.31 0.10 -4.65 118.33 118.28 1j5h n VAL 40 Ca 0.09 0.00 -0.30 0.00 -0.01 0.00 0.00 64.34 64.12 1j5h n VAL 40 Cb 0.53 0.00 0.20 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 -0.83 -4.56 4.52 10.43 -1.21 -4.74 116.55 120.15 1j5h n ASP 41 Ca 0.00 0.16 -0.16 0.00 2.57 0.00 0.00 54.79 57.36 1j5h n ASP 41 Cb 0.00 -1.34 -0.07 0.00 1.84 0.00 0.00 41.12 41.55 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 -2.50 3.11 0.00 -3.53 2.01 -1.26 -0.27 115.64 113.20 1j5h s THR 42 Ca 0.66 -0.10 0.00 0.00 0.31 0.00 0.00 61.69 62.56 1j5h s THR 42 Cb -0.23 -3.31 0.00 0.00 0.01 0.00 0.00 72.50 68.97 1j5h s THR 42 CO 0.62 -0.24 0.00 0.61 -0.69 0.00 0.00 174.62 174.92 1j5h n GLY 43 N 6.78 1.96 3.68 4.40 0.00 -1.26 -5.07 105.19 115.67 1j5h n GLY 43 Ca 0.45 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 46.07 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 5.03 -0.17 1.61 1.01 0.63 -5.02 120.40 121.27 1j5h s VAL 44 Ca 0.00 1.27 -0.01 0.00 0.00 0.00 0.00 61.98 63.24 1j5h s VAL 44 Cb 0.00 -3.97 0.04 0.00 0.00 0.00 0.00 36.38 32.45 1j5h s VAL 44 CO 0.00 0.16 -0.05 -0.22 0.00 0.00 0.00 175.10 174.99 1j5h s LEU 45 N 1.53 1.60 -0.37 3.92 0.20 -1.26 0.01 118.68 124.31 1j5h s LEU 45 Ca 0.31 -0.68 -0.18 0.00 0.69 0.00 0.00 54.13 54.28 1j5h s LEU 45 Cb -0.16 -0.89 0.00 0.00 -0.43 0.00 0.00 46.19 44.71 1j5h s LEU 45 CO 0.12 -0.19 0.50 0.00 -0.29 0.00 0.00 176.35 176.49 1j5h s ALA 46 N 1.65 3.45 0.74 5.97 0.00 0.84 -4.49 121.76 129.91 1j5h s ALA 46 Ca 0.00 -1.16 -0.10 0.00 0.00 0.00 0.00 51.96 50.71 1j5h s ALA 46 Cb -0.15 -3.04 0.05 0.00 0.00 0.00 0.00 23.12 19.97 1j5h s ALA 46 CO -0.08 -1.35 1.09 0.00 0.00 0.00 0.00 175.76 175.42 1j5h s ASN 48 N -4.48 5.20 0.00 0.00 2.47 0.31 0.01 114.94 118.44 1j5h s ASN 48 Ca 0.60 -3.12 -0.00 0.00 0.42 0.00 0.00 52.86 50.76 1j5h s ASN 48 Cb -0.11 -1.82 -0.02 0.00 -1.45 0.00 0.00 41.25 37.86 1j5h s ASN 48 CO 0.48 -0.29 1.63 -0.81 -3.72 0.00 0.00 177.10 174.39 1j5h n PRO 49 N 3.10 0.82 0.00 0.43 -0.04 -1.26 -2.17 135.00 135.87 1j5h n PRO 49 Ca 0.11 -0.07 0.00 0.00 -0.04 0.00 0.00 63.50 63.50 1j5h n PRO 49 Cb 0.37 -1.19 0.00 0.00 -0.04 0.00 0.00 33.50 32.63 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 1.72 0.63 -0.32 0.55 0.00 -1.26 -4.88 120.51 116.94 1j5h n ALA 50 Ca 0.03 -0.28 -0.08 0.00 0.00 0.00 0.00 53.44 53.11 1j5h n ALA 50 Cb 0.40 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.81 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 -1.73 0.00 0.00 -0.00 -1.71 -3.42 116.42 109.56 1j5h h ASP 51 Ca 0.00 0.29 0.00 0.00 -0.00 0.00 0.00 57.03 57.32 1j5h h ASP 51 Cb 0.70 0.80 0.00 0.00 -0.00 0.00 0.00 39.33 40.83 1j5h h ASP 51 CO 0.00 -0.29 0.00 0.33 -0.00 0.00 0.00 179.24 179.28 1j5h n PHE 52 N -5.37 0.00 -1.15 4.15 7.35 -1.26 -4.88 117.46 116.30 1j5h n PHE 52 Ca 0.04 0.00 -0.36 0.00 -0.76 0.00 0.00 57.45 56.37 1j5h n PHE 52 Cb 0.33 0.00 0.01 0.00 0.35 0.00 0.00 39.48 40.17 1j5h n PHE 52 CO 0.00 0.00 0.00 0.43 -0.76 0.00 0.00 176.76 176.43 1j5h n SER 53 N 1.18 -3.35 -3.80 -2.13 7.64 -1.26 -4.65 113.62 107.25 1j5h n SER 53 Ca 0.00 0.61 -0.12 0.00 1.01 0.00 0.00 58.87 60.37 1j5h n SER 53 Cb 0.00 -0.78 -0.11 0.00 -1.01 0.00 0.00 64.21 62.31 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 -0.92 -0.20 0.22 6.43 1.04 -1.26 0.61 113.70 119.62 1j5h s SER 54 Ca 0.53 0.34 0.03 0.00 0.48 0.00 0.00 55.95 57.32 1j5h s SER 54 Cb -0.46 0.42 -0.05 0.00 0.10 0.00 0.00 66.02 66.03 1j5h s SER 54 CO 0.61 -0.16 0.02 0.54 0.98 0.00 0.00 173.24 175.22 1j5h s VAL 55 N -0.24 0.87 0.08 5.02 0.11 -0.45 -4.82 120.40 120.97 1j5h s VAL 55 Ca -0.04 -2.01 0.08 0.00 -2.93 0.00 0.00 61.98 57.08 1j5h s VAL 55 Cb -0.03 -2.35 -0.03 0.00 -1.53 0.00 0.00 36.38 32.44 1j5h s VAL 55 CO 0.01 -0.30 -0.22 -0.89 -3.33 0.00 0.00 175.10 170.37 1j5h s THR 56 N -3.53 1.78 1.09 5.04 2.01 -1.26 0.19 115.64 120.95 1j5h s THR 56 Ca 0.29 -1.42 -0.16 0.00 0.31 0.00 0.00 61.69 60.71 1j5h s THR 56 Cb 0.06 -1.58 0.23 0.00 0.01 0.00 0.00 72.50 71.23 1j5h s THR 56 CO 0.08 0.09 1.14 0.00 -0.69 0.00 0.00 174.62 175.24 1j5h s ALA 57 N -0.99 1.07 -0.09 7.40 0.00 -0.23 -3.08 121.76 125.84 1j5h s ALA 57 Ca 0.08 -0.80 -0.01 0.00 0.00 0.00 0.00 51.96 51.22 1j5h s ALA 57 Cb -0.10 -2.94 0.03 0.00 0.00 0.00 0.00 23.12 20.11 1j5h s ALA 57 CO 0.03 -3.09 -0.03 0.16 0.00 0.00 0.00 175.76 172.84 1j5h s ASP 58 N -3.96 1.81 0.00 0.00 1.47 0.33 -3.68 116.67 112.63 1j5h s ASP 58 Ca 0.69 -0.17 0.00 0.00 1.18 0.00 0.00 52.55 54.25 1j5h s ASP 58 Cb -0.11 -0.58 0.00 0.00 -0.34 0.00 0.00 42.92 41.88 1j5h s ASP 58 CO 0.55 -0.17 0.00 0.00 0.68 0.00 0.00 175.17 176.24 1j5h n ALA 59 N 5.07 0.00 -0.28 2.11 0.00 -1.26 0.16 120.51 126.31 1j5h n ALA 59 Ca -0.09 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.47 1j5h n ALA 59 Cb 0.50 0.00 0.24 0.00 0.00 0.00 0.00 19.45 20.19 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 0.42 -0.10 0.00 0.00 4.13 -1.26 -4.07 115.26 114.38 1j5h n ASN 60 Ca 0.00 1.38 0.00 0.00 1.68 0.00 0.00 54.58 57.64 1j5h n ASN 60 Cb 0.00 -0.50 0.00 0.00 -1.54 0.00 0.00 39.78 37.74 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 -1.41 0.26 3.76 7.41 0.00 0.41 -4.22 105.19 111.41 1j5h n GLY 61 Ca 0.19 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.82 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 -0.13 7.50 0.56 1.61 0.01 -1.21 -0.10 113.70 121.94 1j5h s SER 62 Ca 0.00 1.93 -0.15 0.00 1.31 0.00 0.00 55.95 59.04 1j5h s SER 62 Cb 0.00 -2.60 -0.06 0.00 0.21 0.00 0.00 66.02 63.57 1j5h s SER 62 CO 0.00 0.05 1.01 0.00 0.41 0.00 0.00 173.24 174.71 1j5h s ALA 63 N -1.34 2.99 -0.29 1.44 0.00 -0.58 0.12 121.76 124.10 1j5h s ALA 63 Ca 0.45 0.16 0.01 0.00 0.00 0.00 0.00 51.96 52.57 1j5h s ALA 63 Cb -0.24 -3.14 0.18 0.00 0.00 0.00 0.00 23.12 19.93 1j5h s ALA 63 CO 0.30 -0.51 0.53 -1.54 0.00 0.00 0.00 175.76 174.54 1j5h s SER 64 N -3.31 -0.94 -0.10 0.00 1.04 -1.18 -0.14 113.70 109.08 1j5h s SER 64 Ca 0.59 0.42 -0.33 0.00 0.48 0.00 0.00 55.95 57.11 1j5h s SER 64 Cb -0.12 1.81 0.15 0.00 0.10 0.00 0.00 66.02 67.97 1j5h s SER 64 CO 0.39 -0.29 1.45 0.28 0.98 0.00 0.00 173.24 176.04 1j5h s THR 65 N 2.76 0.00 -0.14 2.02 -1.32 0.85 -4.73 115.64 115.07 1j5h s THR 65 Ca 0.15 -0.00 -0.24 0.00 -1.21 0.00 0.00 61.69 60.40 1j5h s THR 65 Cb -0.13 -2.05 -0.02 0.00 -1.51 0.00 0.00 72.50 68.78 1j5h s THR 65 CO -0.23 0.00 0.74 -0.44 -2.21 0.00 0.00 174.62 172.48 1j5h s SER 66 N -3.05 6.90 -0.04 8.08 0.01 -1.26 0.84 113.70 125.18 1j5h s SER 66 Ca 0.16 1.09 0.04 0.00 1.31 0.00 0.00 55.95 58.55 1j5h s SER 66 Cb 0.08 -2.41 -0.03 0.00 0.21 0.00 0.00 66.02 63.87 1j5h s SER 66 CO -0.07 -0.28 -0.16 -0.76 0.41 0.00 0.00 173.24 172.38 1j5h s LEU 67 N 1.67 2.65 -0.25 2.44 1.02 -0.14 -4.85 118.68 121.22 1j5h s LEU 67 Ca 0.36 -0.23 -0.29 0.00 0.02 0.00 0.00 54.13 53.98 1j5h s LEU 67 Cb -0.17 -1.53 0.01 0.00 0.02 0.00 0.00 46.19 44.52 1j5h s LEU 67 CO 0.14 0.34 1.14 0.28 0.02 0.00 0.00 176.35 178.27 1j5h s THR 68 N -0.72 4.46 -1.35 5.49 -1.32 -1.26 -1.76 115.64 119.17 1j5h s THR 68 Ca 0.11 1.73 -0.06 0.00 -1.21 0.00 0.00 61.69 62.26 1j5h s THR 68 Cb -0.11 -4.25 0.10 0.00 -1.51 0.00 0.00 72.50 66.74 1j5h s THR 68 CO 0.00 -0.30 2.41 0.52 -2.21 0.00 0.00 174.62 175.04 1j5h n VAL 69 N 5.62 5.07 -1.57 5.08 0.31 -0.64 -4.80 118.33 127.40 1j5h n VAL 69 Ca 0.13 -4.14 -0.48 0.00 -0.01 0.00 0.00 64.34 59.84 1j5h n VAL 69 Cb 0.46 -2.16 -0.03 0.00 -0.91 0.00 0.00 33.84 31.20 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 2.11 1.11 0.00 5.55 1.74 -1.26 -2.47 116.66 123.44 1j5h n ARG 70 Ca 0.63 0.39 0.00 0.00 -0.77 0.00 0.00 57.85 58.10 1j5h n ARG 70 Cb 0.25 -1.82 0.00 0.00 -1.02 0.00 0.00 32.46 29.88 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 1.40 0.00 -2.44 5.56 0.63 -1.26 -4.62 116.66 115.93 1j5h n ARG 71 Ca 0.14 0.00 -0.38 0.00 -0.92 0.00 0.00 57.85 56.69 1j5h n ARG 71 Cb 0.26 -0.06 -0.03 0.00 0.45 0.00 0.00 32.46 33.08 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 -1.06 6.16 0.15 6.15 0.15 -1.26 -1.08 113.70 122.91 1j5h s SER 72 Ca 0.00 -1.14 -0.00 0.00 0.70 0.00 0.00 55.95 55.51 1j5h s SER 72 Cb 0.00 -2.57 -0.04 0.00 -1.71 0.00 0.00 66.02 61.70 1j5h s SER 72 CO 0.00 -1.81 0.05 0.72 1.20 0.00 0.00 173.24 173.40 1j5h s PHE 73 N 6.19 0.98 -0.27 3.44 -0.12 0.00 -4.81 117.98 123.39 1j5h s PHE 73 Ca 0.50 -1.19 -0.28 0.00 -0.05 0.00 0.00 56.93 55.91 1j5h s PHE 73 Cb -0.03 -0.55 0.01 0.00 -0.63 0.00 0.00 43.02 41.82 1j5h s PHE 73 CO -0.05 -0.45 0.99 -1.83 -0.05 0.00 0.00 175.22 173.83 1j5h s GLU 74 N -4.02 4.14 -0.01 1.99 1.03 -1.26 -0.79 118.70 119.76 1j5h s GLU 74 Ca 0.25 1.09 -0.08 0.00 0.03 0.00 0.00 54.97 56.27 1j5h s GLU 74 Cb 0.07 -3.69 -0.05 0.00 -0.80 0.00 0.00 34.13 29.67 1j5h s GLU 74 CO 0.03 -0.72 0.27 0.20 -1.33 0.00 0.00 175.26 173.71 1j5h s GLY 75 N 1.44 2.26 -0.16 -3.83 0.00 -1.26 -4.71 107.32 101.06 1j5h s GLY 75 Ca 0.42 -0.54 0.00 0.00 0.00 0.00 0.00 44.72 44.60 1j5h s GLY 75 CO 0.10 -0.31 -0.16 -1.36 0.00 0.00 0.00 173.10 171.37 1j5h s PHE 76 N -1.22 2.78 0.00 1.90 0.40 0.10 0.03 117.98 121.97 1j5h s PHE 76 Ca 0.25 -1.12 0.00 0.00 -0.60 0.00 0.00 56.93 55.46 1j5h s PHE 76 Cb -0.13 -1.90 0.00 0.00 0.51 0.00 0.00 43.02 41.50 1j5h s PHE 76 CO 0.14 -0.52 0.87 1.28 0.70 0.00 0.00 175.22 177.68 1j5h n LEU 77 N 4.16 0.00 0.00 -0.37 4.77 0.15 0.04 117.00 125.75 1j5h n LEU 77 Ca -0.19 0.87 0.00 0.00 -0.03 0.00 0.00 56.01 56.66 1j5h n LEU 77 Cb 0.51 -0.37 0.00 0.00 -2.33 0.00 0.00 43.42 41.23 1j5h n LEU 77 CO 0.28 -0.37 0.00 0.33 -1.33 0.00 0.00 177.39 176.30 1j5h n PHE 78 N -2.50 0.00 0.00 -1.77 -0.00 -1.26 -4.10 117.46 107.83 1j5h n PHE 78 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.45 1j5h n PHE 78 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 39.48 39.48 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 -0.73 -2.13 2.03 -1.26 -4.95 116.55 109.51 1j5h n ASP 79 Ca 0.00 0.14 -0.03 0.00 0.52 0.00 0.00 54.79 55.42 1j5h n ASP 79 Cb 0.00 -0.36 -0.03 0.00 -0.72 0.00 0.00 41.12 40.01 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 1.91 0.77 3.38 0.27 0.00 -1.26 -5.13 105.19 105.12 1j5h n GLY 80 Ca 0.00 -0.01 -0.19 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 0.00 1.38 -0.24 2.61 2.01 -1.26 -5.05 115.64 115.09 1j5h s THR 81 Ca 0.00 -2.09 -0.26 0.00 0.31 0.00 0.00 61.69 59.66 1j5h s THR 81 Cb 0.00 -2.36 0.08 0.00 0.01 0.00 0.00 72.50 70.24 1j5h s THR 81 CO -0.00 -0.35 0.79 0.00 -0.69 0.00 0.00 174.62 174.38 1j5h s ARG 82 N -3.78 0.78 -0.04 4.92 1.04 -1.26 0.35 118.95 120.96 1j5h s ARG 82 Ca 0.28 0.78 -0.24 0.00 -1.04 0.00 0.00 55.73 55.51 1j5h s ARG 82 Cb 0.04 0.38 -0.22 0.00 -2.04 0.00 0.00 34.95 33.12 1j5h s ARG 82 CO 0.10 -0.12 1.11 -1.49 -0.04 0.00 0.00 175.30 174.85 1j5h h TRP 83 N 4.47 0.21 -0.14 5.89 4.06 -0.78 -3.47 115.95 126.19 1j5h h TRP 83 Ca -0.28 -0.09 0.01 0.00 2.06 0.00 0.00 58.89 60.59 1j5h h TRP 83 Cb 1.16 -0.03 -0.01 0.00 -1.00 0.00 0.00 29.16 29.28 1j5h h TRP 83 CO 0.37 0.82 -0.05 0.41 -3.56 0.00 0.00 178.44 176.43 1j5h n GLY 84 N 0.79 -2.68 1.67 1.49 0.00 -1.13 -4.83 105.19 100.49 1j5h n GLY 84 Ca -0.09 -1.41 0.00 0.00 0.00 0.00 0.00 46.02 44.52 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 -2.00 0.00 -4.96 2.61 -1.04 -1.25 -4.57 114.28 103.07 1j5h n THR 85 Ca -0.00 0.00 -0.30 0.00 -2.04 0.00 0.00 64.05 61.71 1j5h n THR 85 Cb 0.03 0.00 -0.15 0.00 -1.82 0.00 0.00 70.33 68.39 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 -1.19 2.08 -0.32 12.58 0.11 0.03 -4.91 120.40 128.77 1j5h s VAL 86 Ca 0.00 -1.32 -0.26 0.00 -2.93 0.00 0.00 61.98 57.46 1j5h s VAL 86 Cb 0.00 -1.77 0.01 0.00 -1.53 0.00 0.00 36.38 33.09 1j5h s VAL 86 CO 0.00 0.39 0.94 -1.81 -3.33 0.00 0.00 175.10 171.29 1j5h s ASP 87 N -1.12 6.78 0.21 3.54 1.11 -1.26 -0.82 116.67 125.12 1j5h s ASP 87 Ca 0.11 0.81 -0.07 0.00 0.18 0.00 0.00 52.55 53.59 1j5h s ASP 87 Cb -0.10 -2.48 0.16 0.00 1.07 0.00 0.00 42.92 41.57 1j5h s ASP 87 CO 0.01 -0.78 1.70 0.00 1.18 0.00 0.00 175.17 177.28 1j5h h THR 89 N 0.95 0.21 0.00 0.00 1.03 -1.80 2.11 112.91 115.41 1j5h h THR 89 Ca 0.18 0.00 -0.06 0.00 -0.01 0.00 0.00 66.41 66.53 1j5h h THR 89 Cb 0.47 0.93 -0.01 0.00 -1.07 0.00 0.00 68.15 68.47 1j5h h THR 89 CO 0.02 0.00 -0.53 0.74 -0.01 0.00 0.00 175.52 175.74 1j5h h THR 90 N 0.00 0.35 0.00 0.00 2.02 -1.59 -3.29 112.91 110.40 1j5h h THR 90 Ca 0.02 -1.53 -0.02 0.00 0.77 0.00 0.00 66.41 65.64 1j5h h THR 90 Cb 0.17 2.06 -0.05 0.00 -1.74 0.00 0.00 68.15 68.59 1j5h h THR 90 CO -0.00 0.20 -0.37 0.00 0.37 0.00 0.00 175.52 175.72 1j5h n ALA 91 N -2.19 2.63 -3.89 6.16 0.00 0.12 -5.00 120.51 118.34 1j5h n ALA 91 Ca 0.01 -2.49 -0.25 0.00 0.00 0.00 0.00 53.44 50.70 1j5h n ALA 91 Cb 0.64 -0.44 0.01 0.00 0.00 0.00 0.00 19.45 19.66 1j5h n ALA 91 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1j5h n ALA 92 N -0.83 -1.88 -0.59 0.00 0.00 0.67 -4.01 120.51 113.86 1j5h n ALA 92 Ca 0.13 -0.32 -0.08 0.00 0.00 0.00 0.00 53.44 53.17 1j5h n ALA 92 Cb 0.73 -1.33 0.13 0.00 0.00 0.00 0.00 19.45 18.97 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 -3.25 0.59 -0.11 0.00 0.00 0.98 -2.17 119.66 115.71 1j5h s GLN 94 Ca 0.29 -0.99 -0.02 0.00 -0.00 0.00 0.00 55.36 54.64 1j5h s GLN 94 Cb -0.05 -0.10 0.04 0.00 0.00 0.00 0.00 33.01 32.90 1j5h s GLN 94 CO 0.24 -0.02 0.03 0.54 0.00 0.00 0.00 175.29 176.09 1j5h s VAL 95 N -2.52 0.24 0.00 3.63 0.11 -0.81 -1.13 120.40 119.93 1j5h s VAL 95 Ca -0.02 -0.00 0.00 0.00 -2.93 0.00 0.00 61.98 59.03 1j5h s VAL 95 Cb -0.02 -0.57 0.00 0.00 -1.53 0.00 0.00 36.38 34.26 1j5h s VAL 95 CO -0.03 0.07 0.00 0.61 -3.33 0.00 0.00 175.10 172.41 1j5h n GLY 96 N 5.18 5.71 3.96 6.54 0.00 -1.26 -2.56 105.19 122.76 1j5h n GLY 96 Ca -0.07 -1.52 -0.22 0.00 0.00 0.00 0.00 46.02 44.21 1j5h n GLY 96 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1j5h s LEU 97 N 0.00 3.63 -0.24 0.99 2.96 -1.26 -1.60 118.68 123.16 1j5h s LEU 97 Ca 0.00 0.21 -0.06 0.00 -0.22 0.00 0.00 54.13 54.06 1j5h s LEU 97 Cb 0.00 -3.09 0.12 0.00 0.50 0.00 0.00 46.19 43.72 1j5h s LEU 97 CO 0.00 -0.73 0.46 -0.55 -1.32 0.00 0.00 176.35 174.21 1j5h s SER 98 N -4.24 -0.40 1.02 3.68 0.15 0.52 -4.45 113.70 109.98 1j5h s SER 98 Ca 0.49 0.88 -0.23 0.00 0.70 0.00 0.00 55.95 57.78 1j5h s SER 98 Cb -0.10 1.53 -0.08 0.00 -1.71 0.00 0.00 66.02 65.66 1j5h s SER 98 CO 0.37 -0.25 -0.94 0.47 1.20 0.00 0.00 173.24 174.09 1j5h n ASP 99 N 5.40 -2.76 0.04 5.45 9.92 -1.26 0.81 116.55 134.14 1j5h n ASP 99 Ca -0.07 -0.06 0.03 0.00 -0.53 0.00 0.00 54.79 54.17 1j5h n ASP 99 Cb 0.50 -0.65 0.17 0.00 -0.64 0.00 0.00 41.12 40.50 1j5h n ASP 99 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1j5h n ALA 100 N -3.82 1.12 0.30 2.24 0.00 -1.26 0.11 120.51 119.19 1j5h n ALA 100 Ca -0.01 0.04 0.04 0.00 0.00 0.00 0.00 53.44 53.50 1j5h n ALA 100 Cb 0.67 -1.10 -0.05 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 -1.56 2.89 -2.77 0.00 0.00 -1.26 -4.98 120.51 112.83 1j5h n ALA 101 Ca 0.00 -0.22 -0.09 0.00 0.00 0.00 0.00 53.44 53.13 1j5h n ALA 101 Cb 0.04 -0.29 0.04 0.00 0.00 0.00 0.00 19.45 19.25 1j5h n ALA 101 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1j5h n GLY 102 N 1.36 0.06 0.00 0.00 0.00 0.12 -5.02 105.19 101.70 1j5h n GLY 102 Ca 0.01 -0.19 0.00 0.00 0.00 0.00 0.00 46.02 45.84 1j5h n GLY 102 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1j5h n ASN 103 N -1.90 -1.23 -3.17 1.61 5.15 -1.26 -4.76 115.26 109.68 1j5h n ASN 103 Ca -0.13 0.00 -0.32 0.00 -0.60 0.00 0.00 54.58 53.53 1j5h n ASN 103 Cb 0.58 0.00 -0.01 0.00 -0.53 0.00 0.00 39.78 39.82 1j5h n ASN 103 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1j5h n GLY 104 N 0.00 -1.79 3.15 8.20 0.00 -1.26 -4.83 105.19 108.67 1j5h n GLY 104 Ca 0.00 0.07 -0.25 0.00 0.00 0.00 0.00 46.02 45.84 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 0.91 -1.96 0.00 1.61 -0.04 -1.26 -4.93 135.00 129.33 1j5h n PRO 105 Ca 0.10 -1.63 0.00 0.00 -0.04 0.00 0.00 63.50 61.93 1j5h n PRO 105 Cb 0.26 -1.28 0.00 0.00 -0.04 0.00 0.00 33.50 32.44 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 -3.88 0.00 -1.62 0.54 -0.58 -1.26 -5.12 120.64 108.72 1j5h n GLU 106 Ca 0.14 0.00 -0.29 0.00 -0.42 0.00 0.00 57.16 56.58 1j5h n GLU 106 Cb 0.50 0.00 0.10 0.00 -0.57 0.00 0.00 31.44 31.47 1j5h n GLU 106 CO 0.00 0.00 0.00 0.20 -0.48 0.00 0.00 177.13 176.85 1j5h s GLY 107 N 0.00 1.60 -0.27 0.62 0.00 -1.26 -4.60 107.32 103.41 1j5h s GLY 107 Ca 0.00 -0.39 -0.10 0.00 0.00 0.00 0.00 44.72 44.23 1j5h s GLY 107 CO 0.00 0.09 0.16 0.54 0.00 0.00 0.00 173.10 173.88 1j5h s VAL 108 N -3.27 5.02 -0.33 1.40 0.11 -1.06 -4.64 120.40 117.63 1j5h s VAL 108 Ca 0.62 0.07 -0.28 0.00 -2.93 0.00 0.00 61.98 59.46 1j5h s VAL 108 Cb -0.14 -3.38 -0.04 0.00 -1.53 0.00 0.00 36.38 31.29 1j5h s VAL 108 CO 0.53 0.27 2.13 0.00 -3.33 0.00 0.00 175.10 174.70 1j5h s ALA 109 N 1.72 2.50 0.13 1.54 0.00 -1.26 -1.92 121.76 124.47 1j5h s ALA 109 Ca 0.07 0.40 0.10 0.00 0.00 0.00 0.00 51.96 52.53 1j5h s ALA 109 Cb -0.16 -4.13 -0.04 0.00 0.00 0.00 0.00 23.12 18.79 1j5h s ALA 109 CO 0.09 -3.17 -0.25 0.42 0.00 0.00 0.00 175.76 172.85 1j5h s ILE 110 N 8.82 2.12 -0.32 0.00 1.01 -0.92 -4.96 121.20 126.95 1j5h s ILE 110 Ca 0.93 -1.75 -0.23 0.00 0.00 0.00 0.00 60.65 59.60 1j5h s ILE 110 Cb -0.26 -1.90 0.00 0.00 0.01 0.00 0.00 42.46 40.32 1j5h s ILE 110 CO 0.32 0.01 0.77 -0.44 0.00 0.00 0.00 174.94 175.60 1j5h s SER 111 N -2.13 6.63 -0.20 3.58 0.01 -0.75 -4.25 113.70 116.58 1j5h s SER 111 Ca 0.13 0.58 -0.14 0.00 1.31 0.00 0.00 55.95 57.84 1j5h s SER 111 Cb -0.10 -2.40 -0.04 0.00 0.21 0.00 0.00 66.02 63.69 1j5h s SER 111 CO 0.06 -0.62 0.30 -0.36 0.41 0.00 0.00 173.24 173.02 1j5h s PHE 112 N 2.95 3.37 0.00 2.43 0.40 -1.26 -1.53 117.98 124.34 1j5h s PHE 112 Ca 0.31 0.48 0.00 0.00 -0.60 0.00 0.00 56.93 57.13 1j5h s PHE 112 Cb -0.14 -2.40 0.00 0.00 0.51 0.00 0.00 43.02 40.99 1j5h s PHE 112 CO 0.13 0.07 0.00 -1.71 0.70 0.00 0.00 175.22 174.41