#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 -0.04 -1.55 0.00 0.00 -1.26 -4.95 120.51 112.71 1j5h n ALA 2 Ca 0.00 0.01 -0.30 0.00 0.00 0.00 0.00 53.44 53.15 1j5h n ALA 2 Cb 0.00 -0.01 0.10 0.00 0.00 0.00 0.00 19.45 19.53 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 -1.80 1.90 0.00 0.00 0.04 -1.26 -5.08 135.00 128.80 1j5h s PRO 3 Ca 0.00 0.57 0.00 0.00 0.04 0.00 0.00 61.00 61.61 1j5h s PRO 3 Cb 0.00 -1.90 0.00 0.00 0.04 0.00 0.00 34.50 32.64 1j5h s PRO 3 CO 0.00 -1.73 0.00 0.25 0.04 0.00 0.00 177.00 175.56 1j5h n THR 4 N -3.49 0.00 -3.05 1.26 -2.24 0.29 -4.67 114.28 102.37 1j5h n THR 4 Ca 0.07 0.00 -0.18 0.00 -2.27 0.00 0.00 64.05 61.67 1j5h n THR 4 Cb 0.57 0.00 0.01 0.00 -2.10 0.00 0.00 70.33 68.81 1j5h n THR 4 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1j5h s ALA 5 N -2.00 4.34 0.08 6.98 0.00 -1.26 0.07 121.76 129.98 1j5h s ALA 5 Ca 0.00 -1.55 -0.15 0.00 0.00 0.00 0.00 51.96 50.26 1j5h s ALA 5 Cb 0.00 -1.73 0.03 0.00 0.00 0.00 0.00 23.12 21.42 1j5h s ALA 5 CO 0.00 -0.30 0.35 0.95 0.00 0.00 0.00 175.76 176.76 1j5h s THR 6 N -2.38 0.08 -0.26 0.00 -4.23 -0.11 -4.67 115.64 104.07 1j5h s THR 6 Ca 0.53 -0.66 -0.08 0.00 -1.18 0.00 0.00 61.69 60.30 1j5h s THR 6 Cb -0.10 -1.09 -0.03 0.00 1.34 0.00 0.00 72.50 72.63 1j5h s THR 6 CO 0.34 -0.37 0.09 -0.69 -0.54 0.00 0.00 174.62 173.45 1j5h s VAL 7 N -3.19 4.38 0.04 2.29 1.01 -1.26 -1.67 120.40 121.99 1j5h s VAL 7 Ca -0.01 -0.21 -0.07 0.00 0.00 0.00 0.00 61.98 61.70 1j5h s VAL 7 Cb 0.01 -3.08 -0.02 0.00 0.00 0.00 0.00 36.38 33.29 1j5h s VAL 7 CO -0.07 0.29 0.80 0.41 0.00 0.00 0.00 175.10 176.52 1j5h n THR 8 N 4.94 -0.16 -0.29 3.92 -1.04 -0.35 -4.46 114.28 116.84 1j5h n THR 8 Ca -0.16 1.22 0.00 0.00 -2.04 0.00 0.00 64.05 63.07 1j5h n THR 8 Cb 0.51 -1.57 0.00 0.00 -1.82 0.00 0.00 70.33 67.45 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 -3.42 0.42 -1.96 -2.82 -0.04 -1.26 -5.05 135.00 120.87 1j5h n PRO 9 Ca 0.00 0.00 -0.04 0.00 -0.04 0.00 0.00 63.50 63.43 1j5h n PRO 9 Cb 0.06 0.00 0.05 0.00 -0.04 0.00 0.00 33.50 33.57 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 -1.16 -1.18 -3.48 3.54 2.88 -1.26 -5.04 113.62 107.92 1j5h n SER 10 Ca 0.00 -2.00 -0.28 0.00 -1.33 0.00 0.00 58.87 55.26 1j5h n SER 10 Cb 0.00 0.50 -0.13 0.00 -0.75 0.00 0.00 64.21 63.83 1j5h n SER 10 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1j5h s SER 11 N -0.98 3.03 0.00 -3.46 0.15 -1.26 -1.66 113.70 109.52 1j5h s SER 11 Ca 0.05 -1.75 0.18 0.00 0.70 0.00 0.00 55.95 55.14 1j5h s SER 11 Cb 0.26 -0.28 1.09 0.00 -1.71 0.00 0.00 66.02 65.37 1j5h s SER 11 CO -0.07 -0.36 1.49 0.61 1.20 0.00 0.00 173.24 176.11 1j5h n GLY 12 N 4.57 -0.58 0.00 9.45 0.00 0.77 -4.35 105.19 115.05 1j5h n GLY 12 Ca 0.04 -0.11 0.00 0.00 0.00 0.00 0.00 46.02 45.95 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 -1.00 0.00 -4.55 0.99 4.77 -0.57 -2.17 117.00 114.46 1j5h n LEU 13 Ca 0.14 0.00 -0.38 0.00 -0.03 0.00 0.00 56.01 55.74 1j5h n LEU 13 Cb 0.06 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.12 1j5h n LEU 13 CO 0.10 0.00 1.38 -0.55 -1.33 0.00 0.00 177.39 176.99 1j5h s SER 14 N -2.98 5.85 -0.51 -1.43 0.15 -1.26 -2.59 113.70 110.93 1j5h s SER 14 Ca 0.00 -0.51 -0.38 0.00 0.70 0.00 0.00 55.95 55.76 1j5h s SER 14 Cb 0.00 -2.55 -0.16 0.00 -1.71 0.00 0.00 66.02 61.60 1j5h s SER 14 CO 0.00 -2.04 2.25 -0.90 1.20 0.00 0.00 173.24 173.75 1j5h n ASP 15 N 10.84 1.27 -0.05 5.45 5.75 -0.92 0.10 116.55 138.99 1j5h n ASP 15 Ca 0.20 0.46 0.00 0.00 -0.01 0.00 0.00 54.79 55.43 1j5h n ASP 15 Cb 0.50 -1.07 0.00 0.00 -1.03 0.00 0.00 41.12 39.52 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 6.94 1.26 3.55 6.12 0.00 -0.76 -4.54 105.19 117.77 1j5h n GLY 16 Ca 0.51 -0.32 -0.37 0.00 0.00 0.00 0.00 46.02 45.83 1j5h n GLY 16 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1j5h s THR 17 N -2.11 3.60 -0.93 2.61 -1.32 0.28 -4.38 115.64 113.41 1j5h s THR 17 Ca 0.00 -0.12 -0.24 0.00 -1.21 0.00 0.00 61.69 60.13 1j5h s THR 17 Cb 0.00 -4.47 -0.15 0.00 -1.51 0.00 0.00 72.50 66.36 1j5h s THR 17 CO 0.00 -1.41 1.92 0.52 -2.21 0.00 0.00 174.62 173.44 1j5h n VAL 18 N 7.09 1.52 -2.05 5.08 0.31 -1.23 -2.15 118.33 126.89 1j5h n VAL 18 Ca 0.24 -1.48 -0.29 0.00 -0.01 0.00 0.00 64.34 62.80 1j5h n VAL 18 Cb 0.50 -2.19 0.05 0.00 -0.91 0.00 0.00 33.84 31.29 1j5h n VAL 18 CO 0.00 0.00 0.00 0.68 -1.32 0.00 0.00 176.83 176.19 1j5h s VAL 19 N 9.26 3.34 0.28 2.52 -7.23 -0.55 -4.53 120.40 123.49 1j5h s VAL 19 Ca 0.66 0.26 -0.30 0.00 -1.81 0.00 0.00 61.98 60.79 1j5h s VAL 19 Cb 0.06 -3.40 -0.11 0.00 0.56 0.00 0.00 36.38 33.49 1j5h s VAL 19 CO 0.16 -0.49 1.50 -0.75 -0.31 0.00 0.00 175.10 175.21 1j5h s LYS 20 N -5.27 4.20 0.01 4.82 2.20 -1.26 -0.31 119.74 124.13 1j5h s LYS 20 Ca 0.57 2.44 0.05 0.00 -0.36 0.00 0.00 55.97 58.68 1j5h s LYS 20 Cb -0.11 -3.06 -0.02 0.00 -1.51 0.00 0.00 37.83 33.14 1j5h s LYS 20 CO 0.49 -0.51 -0.16 0.08 -0.36 0.00 0.00 175.35 174.89 1j5h s VAL 21 N -0.17 1.29 -0.01 4.02 1.01 0.15 -1.21 120.40 125.47 1j5h s VAL 21 Ca 0.60 -0.84 -0.09 0.00 0.00 0.00 0.00 61.98 61.65 1j5h s VAL 21 Cb -0.45 -1.10 0.01 0.00 0.00 0.00 0.00 36.38 34.84 1j5h s VAL 21 CO 0.48 0.25 0.18 0.00 0.00 0.00 0.00 175.10 176.00 1j5h s ALA 22 N -0.55 -0.44 0.00 5.51 0.00 -0.67 -0.03 121.76 125.58 1j5h s ALA 22 Ca 0.05 0.05 0.00 0.00 0.00 0.00 0.00 51.96 52.06 1j5h s ALA 22 Cb -0.07 0.04 0.00 0.00 0.00 0.00 0.00 23.12 23.09 1j5h s ALA 22 CO 0.00 -0.20 0.00 0.41 0.00 0.00 0.00 175.76 175.97 1j5h n GLY 23 N 1.62 -2.15 0.00 0.00 0.00 0.29 -0.93 105.19 104.02 1j5h n GLY 23 Ca -0.21 -2.00 0.00 0.00 0.00 0.00 0.00 46.02 43.81 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 0.13 0.00 0.11 4.61 0.00 0.11 -1.52 120.51 123.95 1j5h n ALA 24 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.45 1j5h n ALA 24 Cb 0.00 0.00 0.05 0.00 0.00 0.00 0.00 19.45 19.50 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 -0.24 3.64 0.00 0.00 -1.26 0.10 105.19 107.43 1j5h n GLY 25 Ca 0.00 -0.01 -0.23 0.00 0.00 0.00 0.00 46.02 45.78 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 -1.17 -3.02 0.00 0.99 7.94 -1.09 -4.70 117.00 115.94 1j5h n LEU 26 Ca 0.01 -0.82 0.00 0.00 -1.11 0.00 0.00 56.01 54.09 1j5h n LEU 26 Cb 0.01 -2.18 0.00 0.00 0.53 0.00 0.00 43.42 41.78 1j5h n LEU 26 CO 0.01 0.12 0.00 1.67 -1.11 0.00 0.00 177.39 178.08 1j5h n GLN 27 N -3.07 0.00 0.00 1.96 -0.06 -0.24 -4.63 117.38 111.34 1j5h n GLN 27 Ca -0.17 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 54.83 1j5h n GLN 27 Cb 0.61 -0.00 0.00 0.00 -4.06 0.00 0.00 30.24 26.79 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 -0.07 1.69 0.00 -1.23 -3.87 120.51 114.03 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 0.75 3.38 0.00 0.00 -1.26 -4.71 105.19 103.34 1j5h n GLY 29 Ca 0.00 -0.70 -0.12 0.00 0.00 0.00 0.00 46.02 45.20 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 -1.74 0.03 0.67 2.61 -1.32 -1.26 -4.94 115.64 109.69 1j5h s THR 30 Ca 0.00 -0.27 -0.17 0.00 -1.21 0.00 0.00 61.69 60.04 1j5h s THR 30 Cb 0.00 -1.05 -0.00 0.00 -1.51 0.00 0.00 72.50 69.93 1j5h s THR 30 CO 0.00 -0.15 1.18 0.00 -2.21 0.00 0.00 174.62 173.44 1j5h n ALA 31 N -0.09 0.64 -3.11 11.08 0.00 -1.26 -1.32 120.51 126.46 1j5h n ALA 31 Ca -0.17 -0.06 -0.17 0.00 0.00 0.00 0.00 53.44 53.04 1j5h n ALA 31 Cb 0.63 -2.25 -0.05 0.00 0.00 0.00 0.00 19.45 17.78 1j5h n ALA 31 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1j5h n TYR 32 N -2.13 -2.17 -1.69 0.00 4.01 0.19 -4.28 117.16 111.09 1j5h n TYR 32 Ca 0.15 -2.48 -0.45 0.00 -0.16 0.00 0.00 57.90 54.96 1j5h n TYR 32 Cb 0.48 0.77 -0.03 0.00 -0.31 0.00 0.00 39.34 40.25 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 2.77 3.29 -4.71 7.72 -0.08 0.20 -1.62 116.55 124.12 1j5h n ASP 33 Ca 0.24 1.10 -0.31 0.00 -1.51 0.00 0.00 54.79 54.31 1j5h n ASP 33 Cb 0.52 -1.47 0.13 0.00 2.34 0.00 0.00 41.12 42.64 1j5h n ASP 33 CO 0.00 0.00 0.00 -0.69 0.12 0.00 0.00 177.20 176.63 1j5h s VAL 34 N 0.69 2.73 0.07 5.18 1.01 0.42 0.88 120.40 131.38 1j5h s VAL 34 Ca 0.75 0.24 0.01 0.00 0.00 0.00 0.00 61.98 62.98 1j5h s VAL 34 Cb -0.62 -2.55 -0.01 0.00 0.00 0.00 0.00 36.38 33.20 1j5h s VAL 34 CO 0.40 -0.31 0.05 0.61 0.00 0.00 0.00 175.10 175.85 1j5h n GLY 35 N -0.63 3.83 0.00 4.51 0.00 0.03 -4.55 105.19 108.37 1j5h n GLY 35 Ca 0.09 -1.76 0.00 0.00 0.00 0.00 0.00 46.02 44.35 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 -0.14 0.00 -4.59 1.61 6.02 -1.26 -3.79 117.38 115.23 1j5h n GLN 36 Ca 0.01 0.00 -0.27 0.00 -0.01 0.00 0.00 57.00 56.73 1j5h n GLN 36 Cb 0.12 0.00 -0.10 0.00 1.02 0.00 0.00 30.24 31.28 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 -2.92 0.71 -0.18 0.00 0.00 0.20 0.54 121.76 120.11 1j5h s ALA 38 Ca 0.31 -1.37 0.01 0.00 0.00 0.00 0.00 51.96 50.91 1j5h s ALA 38 Cb 0.08 0.90 0.01 0.00 0.00 0.00 0.00 23.12 24.11 1j5h s ALA 38 CO 0.15 -0.53 -0.18 -1.58 0.00 0.00 0.00 175.76 173.63 1j5h s TRP 39 N -4.04 2.79 0.00 0.00 0.52 -1.26 -0.37 118.94 116.58 1j5h s TRP 39 Ca 0.24 -1.45 0.00 0.00 0.02 0.00 0.00 56.10 54.91 1j5h s TRP 39 Cb 0.07 -1.92 0.00 0.00 -1.15 0.00 0.00 33.47 30.46 1j5h s TRP 39 CO 0.02 -0.71 0.00 0.28 0.02 0.00 0.00 176.95 176.56 1j5h n VAL 40 N 4.50 0.00 -4.54 4.03 0.31 0.30 -4.79 118.33 118.13 1j5h n VAL 40 Ca -0.20 0.00 -0.31 0.00 -0.01 0.00 0.00 64.34 63.82 1j5h n VAL 40 Cb 0.51 0.00 -0.12 0.00 -0.91 0.00 0.00 33.84 33.32 1j5h n VAL 40 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1j5h s ASP 41 N -1.00 4.13 0.00 4.52 3.68 -1.26 -4.53 116.67 122.21 1j5h s ASP 41 Ca 0.00 -0.33 0.00 0.00 2.13 0.00 0.00 52.55 54.35 1j5h s ASP 41 Cb 0.00 -0.79 0.00 0.00 -1.45 0.00 0.00 42.92 40.68 1j5h s ASP 41 CO 0.00 0.25 0.00 1.07 0.13 0.00 0.00 175.17 176.62 1j5h n THR 42 N 1.44 0.00 -0.90 1.71 5.66 -1.26 -3.02 114.28 117.92 1j5h n THR 42 Ca -0.16 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.84 1j5h n THR 42 Cb 0.52 -0.46 0.00 0.00 -1.55 0.00 0.00 70.33 68.84 1j5h n THR 42 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1j5h n GLY 43 N -2.94 0.92 3.55 1.09 0.00 -1.26 -4.99 105.19 101.56 1j5h n GLY 43 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 1j5h n GLY 43 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1j5h n VAL 44 N -2.06 2.07 -3.71 1.61 0.31 -1.17 -4.78 118.33 110.61 1j5h n VAL 44 Ca 0.00 -0.50 -0.28 0.00 -0.01 0.00 0.00 64.34 63.55 1j5h n VAL 44 Cb 0.00 -0.86 -0.16 0.00 -0.91 0.00 0.00 33.84 31.92 1j5h n VAL 44 CO 0.00 0.00 0.00 -0.22 -1.32 0.00 0.00 176.83 175.29 1j5h s LEU 45 N 0.67 1.36 -0.22 7.52 0.20 -1.26 -0.54 118.68 126.42 1j5h s LEU 45 Ca 0.61 -1.09 -0.09 0.00 0.69 0.00 0.00 54.13 54.26 1j5h s LEU 45 Cb -0.65 -0.63 -0.04 0.00 -0.43 0.00 0.00 46.19 44.44 1j5h s LEU 45 CO 0.58 -0.35 0.10 0.00 -0.29 0.00 0.00 176.35 176.39 1j5h s ALA 46 N 1.83 3.43 0.33 5.97 0.00 0.50 -4.47 121.76 129.35 1j5h s ALA 46 Ca 0.03 -0.87 -0.04 0.00 0.00 0.00 0.00 51.96 51.07 1j5h s ALA 46 Cb -0.17 -2.10 -0.05 0.00 0.00 0.00 0.00 23.12 20.80 1j5h s ALA 46 CO -0.16 -0.09 0.60 0.00 0.00 0.00 0.00 175.76 176.11 1j5h s ASN 48 N -3.44 5.69 0.00 0.00 3.84 0.19 -1.55 114.94 119.67 1j5h s ASN 48 Ca 0.44 -2.14 0.00 0.00 0.21 0.00 0.00 52.86 51.37 1j5h s ASN 48 Cb -0.10 -1.99 0.00 0.00 -0.55 0.00 0.00 41.25 38.61 1j5h s ASN 48 CO 0.33 -0.62 1.21 -0.81 -2.79 0.00 0.00 177.10 174.42 1j5h n PRO 49 N 4.58 0.75 0.00 0.43 -0.04 -1.26 -2.08 135.00 137.38 1j5h n PRO 49 Ca -0.03 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.43 1j5h n PRO 49 Cb 0.41 -1.13 0.00 0.00 -0.04 0.00 0.00 33.50 32.74 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 1.25 1.03 -0.27 0.55 0.00 -1.26 -4.85 120.51 116.96 1j5h n ALA 50 Ca 0.00 -0.49 0.23 0.00 0.00 0.00 0.00 53.44 53.18 1j5h n ALA 50 Cb 0.37 0.00 0.44 0.00 0.00 0.00 0.00 19.45 20.26 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 -0.07 0.21 0.00 0.00 5.75 -0.88 -4.63 116.55 116.93 1j5h n ASP 51 Ca 0.00 1.38 0.00 0.00 -0.01 0.00 0.00 54.79 56.16 1j5h n ASP 51 Cb 0.42 -0.64 0.00 0.00 -1.03 0.00 0.00 41.12 39.87 1j5h n ASP 51 CO 0.00 0.00 0.00 0.33 -0.11 0.00 0.00 177.20 177.42 1j5h n PHE 52 N -4.94 0.00 -0.94 2.11 -0.00 -1.26 -4.87 117.46 107.55 1j5h n PHE 52 Ca 0.29 0.00 -0.30 0.00 -0.00 0.00 0.00 57.45 57.44 1j5h n PHE 52 Cb 0.98 0.00 0.01 0.00 -0.00 0.00 0.00 39.48 40.47 1j5h n PHE 52 CO 0.00 0.00 0.00 0.43 -0.00 0.00 0.00 176.76 177.19 1j5h n SER 53 N 1.48 -3.09 -3.61 -2.13 7.64 -1.26 -4.68 113.62 107.96 1j5h n SER 53 Ca 0.00 0.46 -0.15 0.00 1.01 0.00 0.00 58.87 60.19 1j5h n SER 53 Cb 0.00 -0.65 -0.07 0.00 -1.01 0.00 0.00 64.21 62.48 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 -0.77 -0.65 0.00 6.43 1.04 -1.26 -0.44 113.70 118.05 1j5h s SER 54 Ca 0.42 1.05 0.00 0.00 0.48 0.00 0.00 55.95 57.90 1j5h s SER 54 Cb -0.35 1.01 0.00 0.00 0.10 0.00 0.00 66.02 66.78 1j5h s SER 54 CO 0.53 -0.37 0.00 0.55 0.98 0.00 0.00 173.24 174.93 1j5h n VAL 55 N 2.02 0.00 -3.96 5.02 3.14 -0.64 -4.81 118.33 119.10 1j5h n VAL 55 Ca -0.16 0.00 -0.09 0.00 -2.96 0.00 0.00 64.34 61.13 1j5h n VAL 55 Cb 0.56 0.00 -0.07 0.00 -1.06 0.00 0.00 33.84 33.27 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 -1.79 0.09 1.13 1.55 2.01 -1.26 0.55 115.64 117.93 1j5h s THR 56 Ca 0.00 -1.42 -0.19 0.00 0.31 0.00 0.00 61.69 60.39 1j5h s THR 56 Cb 0.00 -1.75 0.27 0.00 0.01 0.00 0.00 72.50 71.04 1j5h s THR 56 CO 0.00 -0.41 1.19 0.00 -0.69 0.00 0.00 174.62 174.71 1j5h n ALA 57 N -0.16 -2.69 -3.30 7.40 0.00 -0.43 -3.70 120.51 117.64 1j5h n ALA 57 Ca -0.09 -1.68 -0.16 0.00 0.00 0.00 0.00 53.44 51.51 1j5h n ALA 57 Cb 0.63 -0.10 -0.15 0.00 0.00 0.00 0.00 19.45 19.82 1j5h n ALA 57 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.50 177.66 1j5h s ASP 58 N -5.03 0.49 0.00 0.00 1.47 0.48 -4.70 116.67 109.37 1j5h s ASP 58 Ca 0.73 -0.06 0.00 0.00 1.18 0.00 0.00 52.55 54.40 1j5h s ASP 58 Cb -0.05 -0.17 0.00 0.00 -0.34 0.00 0.00 42.92 42.36 1j5h s ASP 58 CO 0.54 -0.03 0.00 0.00 0.68 0.00 0.00 175.17 176.36 1j5h n ALA 59 N 3.61 0.00 0.00 2.11 0.00 -1.26 0.18 120.51 125.15 1j5h n ALA 59 Ca -0.21 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.23 1j5h n ALA 59 Cb 0.54 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.99 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 -4.85 115.26 114.30 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 1.34 3.73 8.20 0.00 0.13 -3.53 105.19 115.06 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 -0.56 0.00 0.00 0.00 173.32 172.76 1j5h s SER 62 N -1.53 7.27 0.62 1.61 0.01 -1.20 -1.08 113.70 119.41 1j5h s SER 62 Ca 0.00 2.04 -0.10 0.00 1.31 0.00 0.00 55.95 59.20 1j5h s SER 62 Cb 0.00 -2.60 -0.02 0.00 0.21 0.00 0.00 66.02 63.61 1j5h s SER 62 CO 0.00 -0.24 1.00 0.00 0.41 0.00 0.00 173.24 174.41 1j5h s ALA 63 N -0.02 3.10 -0.30 1.44 0.00 -0.58 0.18 121.76 125.59 1j5h s ALA 63 Ca 0.50 -0.28 -0.10 0.00 0.00 0.00 0.00 51.96 52.09 1j5h s ALA 63 Cb -0.29 -2.95 0.15 0.00 0.00 0.00 0.00 23.12 20.04 1j5h s ALA 63 CO 0.34 -0.78 0.75 -1.54 0.00 0.00 0.00 175.76 174.52 1j5h s SER 64 N -4.23 -1.02 0.00 0.00 1.04 -1.24 -0.54 113.70 107.70 1j5h s SER 64 Ca 0.55 1.17 0.00 0.00 0.48 0.00 0.00 55.95 58.15 1j5h s SER 64 Cb -0.11 2.07 0.00 0.00 0.10 0.00 0.00 66.02 68.08 1j5h s SER 64 CO 0.51 -0.19 0.00 1.07 0.98 0.00 0.00 173.24 175.61 1j5h n THR 65 N 5.33 0.00 -3.71 2.02 5.66 0.96 -4.80 114.28 119.75 1j5h n THR 65 Ca -0.09 0.00 -0.12 0.00 -3.05 0.00 0.00 64.05 60.79 1j5h n THR 65 Cb 0.51 0.00 -0.10 0.00 -1.55 0.00 0.00 70.33 69.18 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 -4.00 -0.48 -0.06 1.09 0.01 -1.26 0.29 113.70 109.30 1j5h s SER 66 Ca 0.00 0.88 0.05 0.00 1.31 0.00 0.00 55.95 58.19 1j5h s SER 66 Cb 0.00 0.83 -0.02 0.00 0.21 0.00 0.00 66.02 67.05 1j5h s SER 66 CO 0.00 -0.17 -0.22 -0.76 0.41 0.00 0.00 173.24 172.51 1j5h s LEU 67 N 0.74 2.28 -0.60 2.44 1.02 0.57 -4.84 118.68 120.29 1j5h s LEU 67 Ca -0.04 -0.42 -0.28 0.00 0.02 0.00 0.00 54.13 53.41 1j5h s LEU 67 Cb -0.05 -1.43 0.03 0.00 0.02 0.00 0.00 46.19 44.75 1j5h s LEU 67 CO -0.05 0.26 1.18 0.28 0.02 0.00 0.00 176.35 178.04 1j5h s THR 68 N -0.26 4.02 -1.34 5.49 -1.32 -1.26 -1.48 115.64 119.48 1j5h s THR 68 Ca -0.00 0.78 -0.11 0.00 -1.21 0.00 0.00 61.69 61.15 1j5h s THR 68 Cb -0.13 -4.73 -0.06 0.00 -1.51 0.00 0.00 72.50 66.07 1j5h s THR 68 CO 0.03 -1.38 2.50 0.52 -2.21 0.00 0.00 174.62 174.07 1j5h n VAL 69 N 6.59 3.44 -1.64 5.08 0.31 -0.92 -4.67 118.33 126.53 1j5h n VAL 69 Ca 0.07 -2.32 -0.52 0.00 -0.01 0.00 0.00 64.34 61.56 1j5h n VAL 69 Cb 0.49 -2.48 -0.06 0.00 -0.91 0.00 0.00 33.84 30.88 1j5h n VAL 69 CO 0.00 0.00 0.00 -2.11 -1.32 0.00 0.00 176.83 173.40 1j5h n ARG 70 N 4.64 1.35 0.00 5.55 1.85 -1.26 -1.82 116.66 126.97 1j5h n ARG 70 Ca 0.62 0.49 0.00 0.00 -1.00 0.00 0.00 57.85 57.96 1j5h n ARG 70 Cb 0.26 -2.18 0.00 0.00 -1.05 0.00 0.00 32.46 29.49 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 3.74 0.00 -1.65 2.89 0.63 -1.26 -4.58 116.66 116.42 1j5h n ARG 71 Ca 0.21 0.19 -0.45 0.00 -0.92 0.00 0.00 57.85 56.87 1j5h n ARG 71 Cb 0.19 -1.01 -0.04 0.00 0.45 0.00 0.00 32.46 32.05 1j5h n ARG 71 CO 0.00 0.00 0.00 -1.13 -2.51 0.00 0.00 177.63 173.99 1j5h n SER 72 N -1.06 3.64 -4.33 6.15 3.41 -1.26 0.35 113.62 120.52 1j5h n SER 72 Ca 0.00 0.82 -0.31 0.00 -0.26 0.00 0.00 58.87 59.12 1j5h n SER 72 Cb 0.00 -1.45 -0.16 0.00 -0.26 0.00 0.00 64.21 62.35 1j5h n SER 72 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 175.04 175.00 1j5h s PHE 73 N 4.92 2.41 -0.43 7.33 2.19 -0.75 -4.76 117.98 128.90 1j5h s PHE 73 Ca 0.93 -0.46 0.08 0.00 0.33 0.00 0.00 56.93 57.80 1j5h s PHE 73 Cb -0.56 -1.55 0.26 0.00 -1.31 0.00 0.00 43.02 39.87 1j5h s PHE 73 CO 0.46 -0.05 0.71 -0.85 1.83 0.00 0.00 175.22 177.33 1j5h n GLU 74 N 2.55 0.79 -0.12 10.12 0.28 -1.26 0.71 120.64 133.71 1j5h n GLU 74 Ca -0.17 -2.64 0.00 0.00 -0.16 0.00 0.00 57.16 54.20 1j5h n GLU 74 Cb 0.51 -1.34 0.00 0.00 1.43 0.00 0.00 31.44 32.05 1j5h n GLU 74 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1j5h n GLY 75 N 1.28 1.92 3.21 -1.84 0.00 -1.26 -4.79 105.19 103.71 1j5h n GLY 75 Ca 0.16 -2.05 -0.19 0.00 0.00 0.00 0.00 46.02 43.94 1j5h n GLY 75 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1j5h s PHE 76 N 1.88 1.36 0.07 1.61 5.36 -0.60 -1.65 117.98 126.02 1j5h s PHE 76 Ca 0.00 -0.50 -0.28 0.00 -0.96 0.00 0.00 56.93 55.19 1j5h s PHE 76 Cb 0.00 -0.74 -0.17 0.00 -0.34 0.00 0.00 43.02 41.77 1j5h s PHE 76 CO 0.00 0.11 1.65 -0.07 -1.46 0.00 0.00 175.22 175.45 1j5h h LEU 77 N 3.93 -0.40 0.00 6.12 3.38 -1.54 0.22 115.31 127.02 1j5h h LEU 77 Ca -0.41 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.56 1j5h h LEU 77 Cb 1.19 0.10 0.00 0.00 0.09 0.00 0.00 40.66 42.05 1j5h h LEU 77 CO 0.45 -0.26 0.00 0.49 0.09 0.00 0.00 178.44 179.20 1j5h n PHE 78 N -5.28 0.00 0.00 1.13 3.72 -1.26 -4.47 117.46 111.29 1j5h n PHE 78 Ca -0.10 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.30 1j5h n PHE 78 Cb 0.21 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.75 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 0.04 4.37 2.03 -1.26 -5.04 116.55 116.69 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 -0.08 0.00 0.27 0.00 -1.26 -5.17 105.19 98.95 1j5h n GLY 80 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1j5h n GLY 80 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1j5h n THR 81 N -2.91 0.00 -2.84 2.61 -1.04 -1.26 -5.04 114.28 103.81 1j5h n THR 81 Ca 0.00 0.00 -0.20 0.00 -2.04 0.00 0.00 64.05 61.81 1j5h n THR 81 Cb 0.09 0.00 0.02 0.00 -1.82 0.00 0.00 70.33 68.62 1j5h n THR 81 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1j5h s ARG 82 N -2.00 2.72 0.00 -2.82 1.70 -1.26 -1.67 118.95 115.63 1j5h s ARG 82 Ca 0.00 -0.89 0.00 0.00 -0.47 0.00 0.00 55.73 54.37 1j5h s ARG 82 Cb 0.00 -2.59 0.00 0.00 -0.57 0.00 0.00 34.95 31.79 1j5h s ARG 82 CO 0.00 -0.48 0.00 0.91 -1.08 0.00 0.00 175.30 174.65 1j5h n TRP 83 N -2.13 0.00 -0.77 5.89 7.02 -0.66 -4.94 117.44 121.85 1j5h n TRP 83 Ca 0.07 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.55 1j5h n TRP 83 Cb 0.59 0.00 0.00 0.00 -2.42 0.00 0.00 31.31 29.48 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 -0.52 0.48 2.17 6.99 0.00 -1.25 -3.71 105.19 109.35 1j5h n GLY 84 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 -2.04 0.00 0.00 2.61 5.66 -1.20 -3.56 114.28 115.75 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 0.02 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 68.80 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 -2.11 0.00 -0.21 1.08 3.14 0.22 -4.14 118.33 116.31 1j5h n VAL 86 Ca 0.00 0.00 -0.04 0.00 -2.96 0.00 0.00 64.34 61.34 1j5h n VAL 86 Cb 0.41 0.00 -0.03 0.00 -1.06 0.00 0.00 33.84 33.16 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 -1.07 -0.10 -0.33 6.55 8.00 -1.26 -1.80 116.55 126.54 1j5h n ASP 87 Ca 0.00 -0.03 0.17 0.00 0.71 0.00 0.00 54.79 55.64 1j5h n ASP 87 Cb 0.00 -0.10 0.34 0.00 -0.02 0.00 0.00 41.12 41.34 1j5h n ASP 87 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1j5h n THR 89 N -5.39 0.00 0.20 0.00 5.66 -1.26 0.55 114.28 114.04 1j5h n THR 89 Ca 0.25 1.30 0.05 0.00 -3.05 0.00 0.00 64.05 62.59 1j5h n THR 89 Cb 0.83 -2.26 0.42 0.00 -1.55 0.00 0.00 70.33 67.77 1j5h n THR 89 CO 0.00 0.00 0.00 0.74 -3.05 0.00 0.00 175.07 172.76 1j5h h THR 90 N 0.00 1.10 0.00 1.09 2.02 0.23 -3.38 112.91 113.96 1j5h h THR 90 Ca 0.64 -1.18 0.00 0.00 0.77 0.00 0.00 66.41 66.64 1j5h h THR 90 Cb 3.15 1.66 0.00 0.00 -1.74 0.00 0.00 68.15 71.22 1j5h h THR 90 CO -0.01 0.32 -0.21 0.00 0.37 0.00 0.00 175.52 176.00 1j5h n ALA 91 N -2.41 2.01 -0.44 6.16 0.00 1.58 -5.09 120.51 122.32 1j5h n ALA 91 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.42 1j5h n ALA 91 Cb 0.39 0.10 0.00 0.00 0.00 0.00 0.00 19.45 19.95 1j5h n ALA 91 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1j5h n ALA 92 N -1.72 -0.37 -0.61 0.00 0.00 2.20 -4.97 120.51 115.04 1j5h n ALA 92 Ca 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 53.44 53.37 1j5h n ALA 92 Cb 0.10 -0.04 0.12 0.00 0.00 0.00 0.00 19.45 19.64 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 -3.24 0.96 -0.06 0.00 0.00 0.19 -2.14 119.66 115.36 1j5h s GLN 94 Ca 0.28 -1.25 0.01 0.00 -0.00 0.00 0.00 55.36 54.40 1j5h s GLN 94 Cb -0.05 -0.70 0.02 0.00 0.00 0.00 0.00 33.01 32.28 1j5h s GLN 94 CO 0.24 0.12 -0.07 0.54 0.00 0.00 0.00 175.29 176.11 1j5h s VAL 95 N -2.51 0.76 0.03 3.63 0.11 -0.60 -0.94 120.40 120.87 1j5h s VAL 95 Ca 0.09 -0.23 0.01 0.00 -2.93 0.00 0.00 61.98 58.91 1j5h s VAL 95 Cb -0.03 -0.76 -0.00 0.00 -1.53 0.00 0.00 36.38 34.06 1j5h s VAL 95 CO 0.01 0.28 0.03 0.61 -3.33 0.00 0.00 175.10 172.70 1j5h n GLY 96 N 4.15 3.84 3.71 6.54 0.00 -1.25 -2.00 105.19 120.18 1j5h n GLY 96 Ca -0.22 -1.65 -0.25 0.00 0.00 0.00 0.00 46.02 43.90 1j5h n GLY 96 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1j5h s LEU 97 N 0.00 3.46 0.07 0.99 1.43 -1.26 -0.79 118.68 122.58 1j5h s LEU 97 Ca 0.03 -0.36 0.01 0.00 -1.03 0.00 0.00 54.13 52.79 1j5h s LEU 97 Cb 0.00 -2.07 -0.04 0.00 0.03 0.00 0.00 46.19 44.12 1j5h s LEU 97 CO 0.02 0.06 -0.06 -0.55 0.23 0.00 0.00 176.35 176.05 1j5h s SER 98 N -3.17 0.89 0.26 2.29 0.15 0.25 -4.76 113.70 109.62 1j5h s SER 98 Ca 0.29 -0.89 0.04 0.00 0.70 0.00 0.00 55.95 56.10 1j5h s SER 98 Cb -0.09 0.11 0.04 0.00 -1.71 0.00 0.00 66.02 64.37 1j5h s SER 98 CO 0.20 -0.44 0.36 -0.90 1.20 0.00 0.00 173.24 173.67 1j5h n ASP 99 N 0.37 0.96 0.00 5.45 5.68 -1.26 0.58 116.55 128.33 1j5h n ASP 99 Ca -0.15 -1.70 0.10 0.00 -0.50 0.00 0.00 54.79 52.54 1j5h n ASP 99 Cb 0.59 -0.19 0.57 0.00 -1.14 0.00 0.00 41.12 40.95 1j5h n ASP 99 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1j5h n ALA 100 N -2.70 2.52 0.44 2.12 0.00 -1.26 -2.12 120.51 119.52 1j5h n ALA 100 Ca -0.06 -0.12 0.07 0.00 0.00 0.00 0.00 53.44 53.33 1j5h n ALA 100 Cb 0.27 -1.31 -0.10 0.00 0.00 0.00 0.00 19.45 18.31 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 -0.83 3.44 -2.57 0.00 0.00 -1.26 -4.99 120.51 114.30 1j5h n ALA 101 Ca 0.14 -0.40 -0.12 0.00 0.00 0.00 0.00 53.44 53.07 1j5h n ALA 101 Cb 0.07 -0.53 0.01 0.00 0.00 0.00 0.00 19.45 19.00 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 1.45 0.00 0.95 0.00 0.00 -0.90 -5.00 105.19 101.69 1j5h n GLY 102 Ca 0.01 -0.32 -0.06 0.00 0.00 0.00 0.00 46.02 45.66 1j5h n GLY 102 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1j5h n ASN 103 N -0.47 -1.85 -4.77 1.61 3.02 -1.26 -4.84 115.26 106.68 1j5h n ASN 103 Ca -0.08 -0.16 -0.40 0.00 -0.03 0.00 0.00 54.58 53.90 1j5h n ASN 103 Cb 0.57 -0.25 -0.01 0.00 -0.61 0.00 0.00 39.78 39.48 1j5h n ASN 103 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 1j5h s GLY 104 N -1.51 2.96 0.00 7.41 0.00 -1.26 -4.86 107.32 110.05 1j5h s GLY 104 Ca 0.13 1.37 0.00 0.00 0.00 0.00 0.00 44.72 46.22 1j5h s GLY 104 CO 0.11 2.02 0.00 -1.55 0.00 0.00 0.00 173.10 173.67 1j5h n PRO 105 N 0.47 0.00 -3.37 2.90 -0.04 -1.26 -4.93 135.00 128.77 1j5h n PRO 105 Ca 0.01 0.00 -0.16 0.00 -0.04 0.00 0.00 63.50 63.31 1j5h n PRO 105 Cb 0.41 -0.12 0.08 0.00 -0.04 0.00 0.00 33.50 33.84 1j5h n PRO 105 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 1j5h n GLU 106 N 0.00 -5.77 0.00 0.54 2.13 -1.26 -4.74 120.64 111.54 1j5h n GLU 106 Ca 0.00 0.84 0.00 0.00 0.66 0.00 0.00 57.16 58.66 1j5h n GLU 106 Cb 0.00 -5.79 0.00 0.00 0.27 0.00 0.00 31.44 25.92 1j5h n GLU 106 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1j5h n GLY 107 N -1.15 -0.86 3.64 8.31 0.00 -1.26 -4.64 105.19 109.24 1j5h n GLY 107 Ca -0.25 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.72 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 0.00 0.00 -0.29 1.61 0.11 -0.85 -4.74 120.40 116.25 1j5h s VAL 108 Ca 0.00 0.00 -0.29 0.00 -2.93 0.00 0.00 61.98 58.76 1j5h s VAL 108 Cb 0.00 -1.00 -0.01 0.00 -1.53 0.00 0.00 36.38 33.84 1j5h s VAL 108 CO 0.00 0.00 1.49 0.00 -3.33 0.00 0.00 175.10 173.26 1j5h s ALA 109 N 0.85 3.22 0.15 1.54 0.00 -1.26 -1.56 121.76 124.70 1j5h s ALA 109 Ca -0.04 0.22 0.04 0.00 0.00 0.00 0.00 51.96 52.18 1j5h s ALA 109 Cb -0.04 -3.86 -0.04 0.00 0.00 0.00 0.00 23.12 19.18 1j5h s ALA 109 CO -0.12 -2.03 0.18 0.42 0.00 0.00 0.00 175.76 174.22 1j5h s ILE 110 N 5.12 4.81 -0.60 0.00 1.01 -0.91 -4.98 121.20 125.66 1j5h s ILE 110 Ca 0.65 -0.89 -0.19 0.00 0.00 0.00 0.00 60.65 60.22 1j5h s ILE 110 Cb -0.20 -3.45 0.10 0.00 0.01 0.00 0.00 42.46 38.92 1j5h s ILE 110 CO 0.28 -0.07 0.73 -0.44 0.00 0.00 0.00 174.94 175.44 1j5h s SER 111 N -3.06 6.18 0.71 3.58 0.01 -0.66 -4.39 113.70 116.07 1j5h s SER 111 Ca 0.32 -1.38 -0.06 0.00 1.31 0.00 0.00 55.95 56.14 1j5h s SER 111 Cb -0.11 -2.31 0.08 0.00 0.21 0.00 0.00 66.02 63.89 1j5h s SER 111 CO 0.25 -1.14 1.02 -0.36 0.41 0.00 0.00 173.24 173.42 1j5h s PHE 112 N 2.82 2.66 -2.00 2.43 0.40 -1.26 0.27 117.98 123.29 1j5h s PHE 112 Ca 0.13 0.31 0.32 0.00 -0.60 0.00 0.00 56.93 57.08 1j5h s PHE 112 Cb -0.23 -3.21 1.90 0.00 0.51 0.00 0.00 43.02 41.98 1j5h s PHE 112 CO 0.07 -1.50 2.22 -1.71 0.70 0.00 0.00 175.22 175.00