#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1j5h h ALA 2 N 0.00 -0.14 0.18 0.00 0.00 -1.92 -3.38 119.26 113.99 1j5h h ALA 2 Ca 0.00 -0.25 -0.01 0.00 0.00 0.00 0.00 54.91 54.65 1j5h h ALA 2 Cb 0.00 0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.85 1j5h h ALA 2 CO 0.00 -0.28 -0.09 -1.00 0.00 0.00 0.00 179.25 177.88 1j5h h PRO 3 N -0.75 -0.23 -2.42 0.00 0.13 -1.94 -3.51 132.00 123.29 1j5h h PRO 3 Ca -0.01 0.02 0.14 0.00 -0.87 0.00 0.00 66.00 65.27 1j5h h PRO 3 Cb 0.55 0.05 -0.08 0.00 0.13 0.00 0.00 31.00 31.66 1j5h h PRO 3 CO 0.02 -0.16 -0.78 0.25 -0.23 0.00 0.00 178.00 177.11 1j5h n THR 4 N -4.12 -1.18 -3.20 1.56 -2.24 0.19 -4.54 114.28 100.75 1j5h n THR 4 Ca -0.03 0.78 -0.39 0.00 -2.27 0.00 0.00 64.05 62.14 1j5h n THR 4 Cb 0.10 -1.24 -0.06 0.00 -2.10 0.00 0.00 70.33 67.02 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 -4.33 3.52 0.10 6.98 0.00 -1.25 0.28 121.76 127.06 1j5h s ALA 5 Ca 0.00 -0.28 0.02 0.00 0.00 0.00 0.00 51.96 51.70 1j5h s ALA 5 Cb 0.00 -2.85 -0.04 0.00 0.00 0.00 0.00 23.12 20.23 1j5h s ALA 5 CO 0.00 -0.38 -0.06 0.95 0.00 0.00 0.00 175.76 176.27 1j5h s THR 6 N 1.48 0.69 -0.19 0.00 -4.23 -0.47 -4.64 115.64 108.28 1j5h s THR 6 Ca 0.27 -1.94 -0.07 0.00 -1.18 0.00 0.00 61.69 58.77 1j5h s THR 6 Cb -0.16 -1.71 -0.04 0.00 1.34 0.00 0.00 72.50 71.94 1j5h s THR 6 CO 0.11 -0.85 0.05 0.54 -0.54 0.00 0.00 174.62 173.93 1j5h s VAL 7 N -3.63 4.56 0.08 2.29 0.11 -1.26 -1.08 120.40 121.47 1j5h s VAL 7 Ca 0.13 -0.11 -0.16 0.00 -2.93 0.00 0.00 61.98 58.91 1j5h s VAL 7 Cb 0.05 -3.06 -0.04 0.00 -1.53 0.00 0.00 36.38 31.81 1j5h s VAL 7 CO -0.04 0.44 0.97 0.41 -3.33 0.00 0.00 175.10 173.55 1j5h n THR 8 N 3.85 -0.34 -1.51 5.04 -1.04 -0.70 -4.43 114.28 115.14 1j5h n THR 8 Ca -0.17 1.52 -0.30 0.00 -2.04 0.00 0.00 64.05 63.06 1j5h n THR 8 Cb 0.52 -1.90 0.22 0.00 -1.82 0.00 0.00 70.33 67.35 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 -4.69 -0.47 0.00 -2.82 0.04 -1.26 -5.01 135.00 120.79 1j5h s PRO 9 Ca -0.06 -0.32 0.00 0.00 0.04 0.00 0.00 61.00 60.66 1j5h s PRO 9 Cb 0.06 -1.71 0.00 0.00 0.04 0.00 0.00 34.50 32.89 1j5h s PRO 9 CO 0.31 -3.17 0.11 0.45 0.04 0.00 0.00 177.00 174.75 1j5h n SER 10 N -4.32 -0.10 0.00 6.66 2.88 -1.26 -4.96 113.62 112.52 1j5h n SER 10 Ca 0.15 -0.23 0.00 0.00 -1.33 0.00 0.00 58.87 57.47 1j5h n SER 10 Cb 0.59 0.03 0.00 0.00 -0.75 0.00 0.00 64.21 64.08 1j5h n SER 10 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 1j5h n SER 11 N 0.00 0.00 -2.27 -3.46 3.41 -1.24 -1.75 113.62 108.31 1j5h n SER 11 Ca -0.03 0.00 -0.18 0.00 -0.26 0.00 0.00 58.87 58.40 1j5h n SER 11 Cb 0.25 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.18 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 -0.39 -0.13 0.00 5.00 0.00 -0.02 -4.80 105.19 104.85 1j5h n GLY 12 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 -2.82 0.00 -3.48 0.99 4.77 -0.79 -4.67 117.00 110.99 1j5h n LEU 13 Ca -0.21 0.00 -0.12 0.00 -0.03 0.00 0.00 56.01 55.65 1j5h n LEU 13 Cb 0.65 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.71 1j5h n LEU 13 CO 0.25 0.00 0.33 -0.55 -1.33 0.00 0.00 177.39 176.10 1j5h s SER 14 N -1.00 -0.48 -0.47 -1.43 0.15 -1.26 -1.16 113.70 108.05 1j5h s SER 14 Ca 0.00 -0.07 -0.28 0.00 0.70 0.00 0.00 55.95 56.31 1j5h s SER 14 Cb 0.00 0.56 -0.08 0.00 -1.71 0.00 0.00 66.02 64.79 1j5h s SER 14 CO 0.00 -0.92 2.39 -0.90 1.20 0.00 0.00 173.24 175.00 1j5h n ASP 15 N -0.29 2.30 -0.07 5.45 5.68 -1.26 -0.23 116.55 128.13 1j5h n ASP 15 Ca -0.17 -0.22 0.00 0.00 -0.50 0.00 0.00 54.79 53.91 1j5h n ASP 15 Cb 0.64 -1.49 0.00 0.00 -1.14 0.00 0.00 41.12 39.14 1j5h n ASP 15 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1j5h n GLY 16 N 6.06 1.28 3.56 6.12 0.00 -0.29 -4.63 105.19 117.30 1j5h n GLY 16 Ca 0.39 -0.23 -0.28 0.00 0.00 0.00 0.00 46.02 45.90 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 -2.13 3.50 -1.13 2.61 2.01 0.68 -4.57 115.64 116.60 1j5h s THR 17 Ca 0.00 -0.50 -0.22 0.00 0.31 0.00 0.00 61.69 61.28 1j5h s THR 17 Cb 0.00 -4.17 -0.02 0.00 0.01 0.00 0.00 72.50 68.32 1j5h s THR 17 CO 0.00 -1.02 1.81 -0.69 -0.69 0.00 0.00 174.62 174.03 1j5h s VAL 18 N 9.89 3.73 0.57 3.82 1.01 -1.24 -1.67 120.40 136.50 1j5h s VAL 18 Ca 0.68 -1.05 0.06 0.00 0.00 0.00 0.00 61.98 61.67 1j5h s VAL 18 Cb -0.05 -4.70 0.10 0.00 0.00 0.00 0.00 36.38 31.73 1j5h s VAL 18 CO 0.01 -1.40 0.78 1.33 0.00 0.00 0.00 175.10 175.82 1j5h n VAL 19 N 7.31 0.00 -3.08 2.92 0.24 -0.41 -4.80 118.33 120.52 1j5h n VAL 19 Ca 0.43 -1.67 -0.39 0.00 -2.04 0.00 0.00 64.34 60.67 1j5h n VAL 19 Cb 0.47 -0.66 -0.05 0.00 -1.47 0.00 0.00 33.84 32.13 1j5h n VAL 19 CO 0.00 0.00 0.00 -0.54 -2.14 0.00 0.00 176.83 174.15 1j5h s LYS 20 N -4.52 4.42 -0.05 7.34 1.02 -1.26 -0.03 119.74 126.66 1j5h s LYS 20 Ca 0.57 0.93 0.04 0.00 0.02 0.00 0.00 55.97 57.54 1j5h s LYS 20 Cb -0.04 -3.34 -0.00 0.00 -0.52 0.00 0.00 37.83 33.92 1j5h s LYS 20 CO 0.37 0.35 -0.18 0.54 -0.92 0.00 0.00 175.35 175.50 1j5h s VAL 21 N -0.22 1.54 0.04 3.17 0.11 0.14 -1.72 120.40 123.46 1j5h s VAL 21 Ca 0.35 -0.77 0.02 0.00 -2.93 0.00 0.00 61.98 58.65 1j5h s VAL 21 Cb -0.20 -1.33 -0.02 0.00 -1.53 0.00 0.00 36.38 33.30 1j5h s VAL 21 CO 0.21 0.44 -0.08 0.00 -3.33 0.00 0.00 175.10 172.34 1j5h s ALA 22 N 0.09 0.57 0.00 1.54 0.00 -0.24 -0.27 121.76 123.45 1j5h s ALA 22 Ca -0.06 -0.76 0.00 0.00 0.00 0.00 0.00 51.96 51.14 1j5h s ALA 22 Cb -0.13 0.04 0.00 0.00 0.00 0.00 0.00 23.12 23.03 1j5h s ALA 22 CO 0.03 -0.02 0.00 0.41 0.00 0.00 0.00 175.76 176.18 1j5h n GLY 23 N 1.49 -2.60 0.00 0.00 0.00 0.11 -1.36 105.19 102.84 1j5h n GLY 23 Ca -0.23 -2.18 0.00 0.00 0.00 0.00 0.00 46.02 43.61 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 0.31 0.00 0.48 4.61 0.00 0.14 -1.32 120.51 124.73 1j5h n ALA 24 Ca 0.00 0.00 0.04 0.00 0.00 0.00 0.00 53.44 53.48 1j5h n ALA 24 Cb 0.00 0.00 0.23 0.00 0.00 0.00 0.00 19.45 19.68 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 -0.37 3.59 0.00 0.00 -1.26 0.54 105.19 107.69 1j5h n GLY 25 Ca 0.00 -0.05 -0.19 0.00 0.00 0.00 0.00 46.02 45.79 1j5h n GLY 25 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1j5h n LEU 26 N -1.11 -3.24 0.00 0.99 7.94 -1.13 -4.45 117.00 116.01 1j5h n LEU 26 Ca 0.05 -0.73 0.00 0.00 -1.11 0.00 0.00 56.01 54.22 1j5h n LEU 26 Cb 0.04 -2.12 0.00 0.00 0.53 0.00 0.00 43.42 41.87 1j5h n LEU 26 CO 0.05 -0.02 0.00 1.67 -1.11 0.00 0.00 177.39 177.99 1j5h n GLN 27 N -2.52 0.00 0.00 1.96 -0.06 -0.37 -4.63 117.38 111.77 1j5h n GLN 27 Ca -0.22 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 54.78 1j5h n GLN 27 Cb 0.63 -0.04 0.00 0.00 -4.06 0.00 0.00 30.24 26.77 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 -1.82 0.00 -1.13 1.69 0.00 -1.26 -3.91 120.51 114.08 1j5h n ALA 28 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.39 1j5h n ALA 28 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.43 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 0.48 3.79 0.00 0.00 -1.24 -4.85 105.19 103.38 1j5h n GLY 29 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 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 -1.42 3.58 0.56 2.61 2.01 -1.26 -4.20 115.64 117.51 1j5h s THR 30 Ca 0.00 0.85 -0.21 0.00 0.31 0.00 0.00 61.69 62.65 1j5h s THR 30 Cb 0.00 -3.34 -0.04 0.00 0.01 0.00 0.00 72.50 69.13 1j5h s THR 30 CO 0.00 -0.34 1.29 0.00 -0.69 0.00 0.00 174.62 174.88 1j5h s ALA 31 N -2.17 2.72 -0.44 7.40 0.00 -1.26 -1.42 121.76 126.59 1j5h s ALA 31 Ca 0.67 1.19 0.05 0.00 0.00 0.00 0.00 51.96 53.87 1j5h s ALA 31 Cb -0.18 -3.51 0.19 0.00 0.00 0.00 0.00 23.12 19.61 1j5h s ALA 31 CO 0.31 -1.25 0.49 0.66 0.00 0.00 0.00 175.76 175.98 1j5h n TYR 32 N -1.19 -1.73 -1.57 0.00 4.01 0.14 -4.47 117.16 112.35 1j5h n TYR 32 Ca 0.11 -2.77 -0.52 0.00 -0.16 0.00 0.00 57.90 54.57 1j5h n TYR 32 Cb 0.47 0.56 -0.05 0.00 -0.31 0.00 0.00 39.34 40.01 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 2.59 1.34 -4.80 7.72 -0.08 0.44 -1.64 116.55 122.12 1j5h n ASP 33 Ca 0.25 1.13 -0.34 0.00 -1.51 0.00 0.00 54.79 54.32 1j5h n ASP 33 Cb 0.52 -1.17 -0.03 0.00 2.34 0.00 0.00 41.12 42.78 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 0.19 3.88 0.00 5.18 1.01 0.48 0.11 120.40 131.24 1j5h s VAL 34 Ca 0.81 1.11 0.00 0.00 0.00 0.00 0.00 61.98 63.90 1j5h s VAL 34 Cb -0.95 -3.46 0.00 0.00 0.00 0.00 0.00 36.38 31.97 1j5h s VAL 34 CO 0.50 -0.31 0.00 0.61 0.00 0.00 0.00 175.10 175.89 1j5h n GLY 35 N -0.47 7.30 0.00 4.51 0.00 0.31 -4.46 105.19 112.38 1j5h n GLY 35 Ca 0.09 -2.05 0.00 0.00 0.00 0.00 0.00 46.02 44.06 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 -3.28 1.61 -0.06 -1.26 -4.36 117.38 110.04 1j5h n GLN 36 Ca 0.00 0.00 -0.15 0.00 -2.00 0.00 0.00 57.00 54.85 1j5h n GLN 36 Cb 0.00 0.00 -0.03 0.00 -4.06 0.00 0.00 30.24 26.15 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 -2.45 1.83 -0.16 0.00 0.00 0.25 0.35 121.76 121.58 1j5h s ALA 38 Ca 0.02 -2.63 -0.29 0.00 0.00 0.00 0.00 51.96 49.07 1j5h s ALA 38 Cb 0.00 -1.73 -0.04 0.00 0.00 0.00 0.00 23.12 21.36 1j5h s ALA 38 CO 0.02 -2.02 1.62 -0.46 0.00 0.00 0.00 175.76 174.92 1j5h s TRP 39 N -0.03 2.08 -0.05 0.00 -0.00 -1.26 -0.06 118.94 119.62 1j5h s TRP 39 Ca 0.28 0.45 0.04 0.00 -0.00 0.00 0.00 56.10 56.86 1j5h s TRP 39 Cb -0.04 -3.93 -0.05 0.00 -0.00 0.00 0.00 33.47 29.44 1j5h s TRP 39 CO -0.14 -3.21 0.01 0.28 -0.00 0.00 0.00 176.95 173.88 1j5h n VAL 40 N 6.06 0.32 -3.87 5.86 0.31 0.96 -4.77 118.33 123.20 1j5h n VAL 40 Ca 0.18 -0.19 0.04 0.00 -0.01 0.00 0.00 64.34 64.36 1j5h n VAL 40 Cb 0.44 -0.85 0.01 0.00 -0.91 0.00 0.00 33.84 32.53 1j5h n VAL 40 CO 0.00 0.00 0.00 -1.81 -1.32 0.00 0.00 176.83 173.70 1j5h s ASP 41 N -3.73 -0.00 -0.79 4.52 1.01 -1.21 -4.92 116.67 111.55 1j5h s ASP 41 Ca -0.03 -0.06 -0.24 0.00 0.71 0.00 0.00 52.55 52.93 1j5h s ASP 41 Cb 0.01 0.05 -0.16 0.00 1.01 0.00 0.00 42.92 43.83 1j5h s ASP 41 CO 0.18 -0.10 2.39 0.41 0.21 0.00 0.00 175.17 178.27 1j5h n THR 42 N -0.81 -0.01 0.00 -1.27 -1.04 -1.26 0.11 114.28 110.01 1j5h n THR 42 Ca 0.01 -0.52 0.00 0.00 -2.04 0.00 0.00 64.05 61.49 1j5h n THR 42 Cb 0.60 -1.78 0.00 0.00 -1.82 0.00 0.00 70.33 67.33 1j5h n THR 42 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1j5h n GLY 43 N 6.55 0.76 2.25 3.41 0.00 -1.26 -4.94 105.19 111.96 1j5h n GLY 43 Ca 0.49 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 46.20 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 -1.40 3.45 -3.33 1.61 0.31 0.31 -4.34 118.33 114.93 1j5h n VAL 44 Ca 0.00 -2.69 -0.46 0.00 -0.01 0.00 0.00 64.34 61.18 1j5h n VAL 44 Cb 0.00 -1.21 -0.04 0.00 -0.91 0.00 0.00 33.84 31.68 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 -3.38 6.34 -0.95 7.52 0.20 -1.12 -0.03 118.68 127.27 1j5h s LEU 45 Ca 0.57 -2.11 -0.24 0.00 0.69 0.00 0.00 54.13 53.05 1j5h s LEU 45 Cb 0.45 -2.20 -0.01 0.00 -0.43 0.00 0.00 46.19 44.00 1j5h s LEU 45 CO -0.02 -0.75 1.75 0.00 -0.29 0.00 0.00 176.35 177.04 1j5h s ALA 46 N 1.10 2.07 0.32 5.97 0.00 0.91 -4.15 121.76 127.98 1j5h s ALA 46 Ca 0.08 -1.81 -0.27 0.00 0.00 0.00 0.00 51.96 49.96 1j5h s ALA 46 Cb -0.23 -4.55 -0.09 0.00 0.00 0.00 0.00 23.12 18.25 1j5h s ALA 46 CO -0.01 -4.35 1.04 0.00 0.00 0.00 0.00 175.76 172.44 1j5h s ASN 48 N -1.25 4.98 0.00 0.00 3.84 -0.40 -0.14 114.94 121.96 1j5h s ASN 48 Ca 0.49 -2.87 0.00 0.00 0.21 0.00 0.00 52.86 50.69 1j5h s ASN 48 Cb -0.26 -1.79 0.00 0.00 -0.55 0.00 0.00 41.25 38.65 1j5h s ASN 48 CO 0.33 -0.33 1.46 -0.81 -2.79 0.00 0.00 177.10 174.95 1j5h n PRO 49 N 3.42 0.75 0.00 0.43 -0.04 -1.26 -2.34 135.00 135.96 1j5h n PRO 49 Ca 0.07 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.53 1j5h n PRO 49 Cb 0.36 -1.12 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 1.56 1.27 -0.30 0.55 0.00 -1.26 -4.81 120.51 117.52 1j5h n ALA 50 Ca 0.00 -0.32 0.02 0.00 0.00 0.00 0.00 53.44 53.13 1j5h n ALA 50 Cb 0.38 0.00 0.08 0.00 0.00 0.00 0.00 19.45 19.91 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 -0.94 0.00 0.00 3.04 -1.77 -3.42 116.42 113.33 1j5h h ASP 51 Ca 0.00 0.26 0.00 0.00 -3.24 0.00 0.00 57.03 54.05 1j5h h ASP 51 Cb 0.33 0.57 0.00 0.00 -1.04 0.00 0.00 39.33 39.19 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 -5.52 0.00 -0.83 4.15 3.72 -1.26 -4.89 117.46 112.83 1j5h n PHE 52 Ca 0.11 0.00 -0.28 0.00 -0.05 0.00 0.00 57.45 57.23 1j5h n PHE 52 Cb 0.42 0.00 0.02 0.00 -0.94 0.00 0.00 39.48 38.98 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 0.94 -3.74 -3.69 4.37 7.64 -1.26 -4.63 113.62 113.26 1j5h n SER 53 Ca 0.00 0.29 -0.14 0.00 1.01 0.00 0.00 58.87 60.03 1j5h n SER 53 Cb 0.00 -0.60 -0.08 0.00 -1.01 0.00 0.00 64.21 62.52 1j5h n SER 53 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1j5h s SER 54 N -0.75 -0.40 0.10 6.43 0.15 -1.26 -0.39 113.70 117.58 1j5h s SER 54 Ca 0.35 0.54 0.02 0.00 0.70 0.00 0.00 55.95 57.56 1j5h s SER 54 Cb -0.24 0.60 -0.04 0.00 -1.71 0.00 0.00 66.02 64.63 1j5h s SER 54 CO 0.56 -0.38 -0.07 0.54 1.20 0.00 0.00 173.24 175.10 1j5h s VAL 55 N -0.72 0.72 0.00 4.45 0.11 -0.65 -4.80 120.40 119.50 1j5h s VAL 55 Ca -0.08 -1.93 0.07 0.00 -2.93 0.00 0.00 61.98 57.11 1j5h s VAL 55 Cb -0.03 -1.68 -0.02 0.00 -1.53 0.00 0.00 36.38 33.12 1j5h s VAL 55 CO 0.04 -0.86 -0.22 -0.89 -3.33 0.00 0.00 175.10 169.84 1j5h s THR 56 N -3.59 1.71 1.27 5.04 2.01 -1.26 0.29 115.64 121.11 1j5h s THR 56 Ca 0.12 -1.02 -0.20 0.00 0.31 0.00 0.00 61.69 60.90 1j5h s THR 56 Cb 0.05 -1.44 0.31 0.00 0.01 0.00 0.00 72.50 71.43 1j5h s THR 56 CO -0.04 0.40 1.04 0.00 -0.69 0.00 0.00 174.62 175.33 1j5h s ALA 57 N -0.60 0.08 -0.06 7.40 0.00 -0.51 -3.19 121.76 124.88 1j5h s ALA 57 Ca 0.08 -0.83 -0.01 0.00 0.00 0.00 0.00 51.96 51.21 1j5h s ALA 57 Cb -0.08 -2.94 0.03 0.00 0.00 0.00 0.00 23.12 20.13 1j5h s ALA 57 CO 0.00 -3.93 -0.00 0.16 0.00 0.00 0.00 175.76 171.99 1j5h s ASP 58 N -3.53 1.30 0.00 0.00 1.47 0.37 -3.67 116.67 112.61 1j5h s ASP 58 Ca 0.70 -0.07 0.00 0.00 1.18 0.00 0.00 52.55 54.36 1j5h s ASP 58 Cb -0.12 -0.39 0.00 0.00 -0.34 0.00 0.00 42.92 42.07 1j5h s ASP 58 CO 0.57 -0.17 0.00 0.00 0.68 0.00 0.00 175.17 176.26 1j5h n ALA 59 N 4.86 0.00 -0.33 2.11 0.00 -1.26 0.20 120.51 126.09 1j5h n ALA 59 Ca -0.12 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.45 1j5h n ALA 59 Cb 0.50 0.00 0.26 0.00 0.00 0.00 0.00 19.45 20.21 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 0.48 -0.15 0.00 0.00 5.15 -1.26 -4.04 115.26 115.43 1j5h n ASN 60 Ca 0.00 1.63 0.00 0.00 -0.60 0.00 0.00 54.58 55.61 1j5h n ASN 60 Cb 0.00 -0.58 0.00 0.00 -0.53 0.00 0.00 39.78 38.67 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 -1.50 0.24 3.76 8.20 0.00 0.53 -4.00 105.19 112.42 1j5h n GLY 61 Ca 0.21 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.83 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 -0.32 7.22 0.56 1.61 0.01 -1.20 -1.24 113.70 120.35 1j5h s SER 62 Ca 0.00 2.30 -0.14 0.00 1.31 0.00 0.00 55.95 59.42 1j5h s SER 62 Cb 0.00 -2.63 -0.06 0.00 0.21 0.00 0.00 66.02 63.54 1j5h s SER 62 CO 0.00 -0.18 1.00 0.00 0.41 0.00 0.00 173.24 174.47 1j5h s ALA 63 N -1.12 3.09 -0.30 1.44 0.00 -0.43 0.14 121.76 124.58 1j5h s ALA 63 Ca 0.45 0.05 -0.07 0.00 0.00 0.00 0.00 51.96 52.38 1j5h s ALA 63 Cb -0.33 -3.09 0.14 0.00 0.00 0.00 0.00 23.12 19.85 1j5h s ALA 63 CO 0.42 -0.44 0.62 -1.12 0.00 0.00 0.00 175.76 175.25 1j5h s SER 64 N -3.58 -1.16 0.00 0.00 0.01 -1.19 0.09 113.70 107.87 1j5h s SER 64 Ca 0.57 1.36 0.00 0.00 1.31 0.00 0.00 55.95 59.19 1j5h s SER 64 Cb -0.10 2.22 0.00 0.00 0.21 0.00 0.00 66.02 68.35 1j5h s SER 64 CO 0.42 -0.23 0.00 1.07 0.41 0.00 0.00 173.24 174.90 1j5h n THR 65 N 5.44 0.00 -3.93 1.44 5.66 0.63 -4.65 114.28 118.87 1j5h n THR 65 Ca -0.09 0.00 -0.20 0.00 -3.05 0.00 0.00 64.05 60.71 1j5h n THR 65 Cb 0.50 0.00 -0.17 0.00 -1.55 0.00 0.00 70.33 69.11 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 2.00 0.97 -0.15 1.09 0.01 -1.26 0.24 113.70 116.60 1j5h s SER 66 Ca 0.00 -0.07 -0.07 0.00 1.31 0.00 0.00 55.95 57.12 1j5h s SER 66 Cb 0.00 -0.35 -0.04 0.00 0.21 0.00 0.00 66.02 65.84 1j5h s SER 66 CO 0.00 -0.12 0.11 -0.22 0.41 0.00 0.00 173.24 173.41 1j5h s LEU 67 N 1.34 4.14 -1.20 2.44 1.98 0.96 -4.86 118.68 123.49 1j5h s LEU 67 Ca -0.05 0.29 -0.15 0.00 -2.89 0.00 0.00 54.13 51.33 1j5h s LEU 67 Cb -0.13 -2.03 0.14 0.00 0.66 0.00 0.00 46.19 44.83 1j5h s LEU 67 CO -0.02 0.29 1.48 0.28 -1.89 0.00 0.00 176.35 176.49 1j5h s THR 68 N -0.33 4.77 -0.06 3.68 -1.32 -1.26 -1.29 115.64 119.83 1j5h s THR 68 Ca 0.10 -2.33 -0.29 0.00 -1.21 0.00 0.00 61.69 57.96 1j5h s THR 68 Cb -0.12 -4.97 -0.35 0.00 -1.51 0.00 0.00 72.50 65.56 1j5h s THR 68 CO 0.01 -1.72 1.54 0.52 -2.21 0.00 0.00 174.62 172.77 1j5h n VAL 69 N 5.16 0.00 -2.11 5.08 0.31 -0.67 -4.66 118.33 121.44 1j5h n VAL 69 Ca 0.38 -0.03 -0.42 0.00 -0.01 0.00 0.00 64.34 64.26 1j5h n VAL 69 Cb 0.44 -1.86 -0.03 0.00 -0.91 0.00 0.00 33.84 31.48 1j5h n VAL 69 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1j5h s ARG 70 N 6.82 4.26 0.00 5.55 3.03 -1.26 -1.14 118.95 136.20 1j5h s ARG 70 Ca 0.65 2.12 0.00 0.00 2.03 0.00 0.00 55.73 60.52 1j5h s ARG 70 Cb 0.13 -3.50 0.00 0.00 -1.03 0.00 0.00 34.95 30.55 1j5h s ARG 70 CO 0.32 -0.60 0.00 -2.13 -1.13 0.00 0.00 175.30 171.76 1j5h n ARG 71 N 5.09 0.00 -1.55 3.89 0.63 -1.26 -4.66 116.66 118.80 1j5h n ARG 71 Ca 0.14 0.28 -0.26 0.00 -0.92 0.00 0.00 57.85 57.08 1j5h n ARG 71 Cb 0.42 -0.75 -0.05 0.00 0.45 0.00 0.00 32.46 32.53 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 -1.81 2.10 -4.29 6.15 3.41 -1.25 -1.52 113.62 116.40 1j5h n SER 72 Ca 0.00 -0.93 -0.15 0.00 -0.26 0.00 0.00 58.87 57.53 1j5h n SER 72 Cb 0.00 -1.62 -0.10 0.00 -0.26 0.00 0.00 64.21 62.23 1j5h n SER 72 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 1j5h s PHE 73 N 13.37 1.43 -0.55 7.33 0.40 -0.53 -4.81 117.98 134.62 1j5h s PHE 73 Ca 0.96 -1.21 0.06 0.00 -0.60 0.00 0.00 56.93 56.15 1j5h s PHE 73 Cb -0.16 -0.81 0.23 0.00 0.51 0.00 0.00 43.02 42.79 1j5h s PHE 73 CO 0.19 -0.39 0.60 -0.85 0.70 0.00 0.00 175.22 175.47 1j5h n GLU 74 N -0.40 1.63 -2.14 0.44 -0.00 -1.22 -0.75 120.64 118.20 1j5h n GLU 74 Ca -0.00 -4.04 -0.32 0.00 -0.00 0.00 0.00 57.16 52.80 1j5h n GLU 74 Cb 0.66 -1.87 -0.01 0.00 -0.00 0.00 0.00 31.44 30.22 1j5h n GLU 74 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.13 177.33 1j5h s GLY 75 N -1.68 2.00 -0.11 -1.84 0.00 -1.26 -4.57 107.32 99.86 1j5h s GLY 75 Ca 0.36 0.21 -0.11 0.00 0.00 0.00 0.00 44.72 45.18 1j5h s GLY 75 CO -0.08 0.51 0.24 -0.11 0.00 0.00 0.00 173.10 173.66 1j5h s PHE 76 N -2.67 3.57 0.09 1.90 -0.71 0.80 -1.14 117.98 119.81 1j5h s PHE 76 Ca 0.60 0.63 -0.17 0.00 -1.04 0.00 0.00 56.93 56.95 1j5h s PHE 76 Cb -0.13 -2.16 -0.04 0.00 -1.21 0.00 0.00 43.02 39.49 1j5h s PHE 76 CO 0.38 0.53 1.04 1.28 -1.34 0.00 0.00 175.22 177.11 1j5h n LEU 77 N 2.56 -0.59 0.00 -1.99 7.99 0.74 -1.37 117.00 124.35 1j5h n LEU 77 Ca -0.16 1.17 0.00 0.00 -0.01 0.00 0.00 56.01 57.01 1j5h n LEU 77 Cb 0.53 -0.22 0.00 0.00 -0.11 0.00 0.00 43.42 43.62 1j5h n LEU 77 CO 0.36 -0.90 0.00 0.33 -1.51 0.00 0.00 177.39 175.67 1j5h n PHE 78 N -4.37 0.00 0.00 -1.77 -0.00 -1.26 -2.79 117.46 107.27 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 0.14 0.00 0.00 0.00 -0.00 0.00 0.00 39.48 39.62 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 0.13 -2.13 2.03 -1.26 -5.05 116.55 110.28 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 -1.38 3.66 0.27 0.00 -1.26 -5.17 105.19 101.32 1j5h n GLY 80 Ca 0.00 0.30 -0.09 0.00 0.00 0.00 0.00 46.02 46.24 1j5h n GLY 80 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1j5h s THR 81 N -2.00 0.00 -0.07 2.61 2.01 -1.26 -5.06 115.64 111.87 1j5h s THR 81 Ca 0.00 -1.30 0.02 0.00 0.31 0.00 0.00 61.69 60.72 1j5h s THR 81 Cb 0.00 -2.22 -0.03 0.00 0.01 0.00 0.00 72.50 70.26 1j5h s THR 81 CO 0.00 0.00 -0.11 -0.60 -0.69 0.00 0.00 174.62 173.22 1j5h s ARG 82 N -3.83 2.75 0.00 4.92 3.52 -1.26 -0.18 118.95 124.87 1j5h s ARG 82 Ca 0.20 -0.63 0.00 0.00 -0.13 0.00 0.00 55.73 55.16 1j5h s ARG 82 Cb -0.02 -2.51 0.00 0.00 -1.56 0.00 0.00 34.95 30.86 1j5h s ARG 82 CO 0.09 0.57 0.00 0.91 -0.81 0.00 0.00 175.30 176.06 1j5h n TRP 83 N 2.49 0.00 0.00 5.12 7.02 -0.29 -4.88 117.44 126.89 1j5h n TRP 83 Ca -0.18 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.30 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 0.96 2.92 3.31 6.99 0.00 -1.26 -4.99 105.19 113.13 1j5h n GLY 84 Ca 0.00 -1.24 -0.44 0.00 0.00 0.00 0.00 46.02 44.34 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 -1.36 0.84 -3.96 2.61 -1.04 -1.18 -3.39 114.28 106.79 1j5h n THR 85 Ca 0.00 -0.73 -0.23 0.00 -2.04 0.00 0.00 64.05 61.05 1j5h n THR 85 Cb 0.00 -2.15 -0.05 0.00 -1.82 0.00 0.00 70.33 66.31 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 6.10 3.00 -0.57 12.58 0.11 0.07 -4.68 120.40 137.01 1j5h s VAL 86 Ca 0.64 -1.57 -0.26 0.00 -2.93 0.00 0.00 61.98 57.85 1j5h s VAL 86 Cb 0.15 -3.03 -0.03 0.00 -1.53 0.00 0.00 36.38 31.94 1j5h s VAL 86 CO 0.24 -0.13 1.96 -1.81 -3.33 0.00 0.00 175.10 172.03 1j5h s ASP 87 N -3.93 5.14 0.53 3.54 1.11 -1.26 -1.46 116.67 120.35 1j5h s ASP 87 Ca 0.40 0.53 0.42 0.00 0.18 0.00 0.00 52.55 54.08 1j5h s ASP 87 Cb -0.03 -2.52 1.62 0.00 1.07 0.00 0.00 42.92 43.06 1j5h s ASP 87 CO 0.24 -2.44 1.67 0.00 1.18 0.00 0.00 175.17 175.82 1j5h h THR 89 N 0.02 0.13 0.00 0.00 1.03 -1.84 2.52 112.91 114.77 1j5h h THR 89 Ca 0.78 0.00 -0.10 0.00 -0.01 0.00 0.00 66.41 67.09 1j5h h THR 89 Cb 3.02 0.44 -0.01 0.00 -1.07 0.00 0.00 68.15 70.53 1j5h h THR 89 CO -0.07 0.00 -0.46 0.74 -0.01 0.00 0.00 175.52 175.72 1j5h h THR 90 N 0.00 0.93 0.00 0.00 2.02 0.20 -3.21 112.91 112.85 1j5h h THR 90 Ca 0.15 -1.87 0.00 0.00 0.77 0.00 0.00 66.41 65.47 1j5h h THR 90 Cb 1.42 2.15 0.00 0.00 -1.74 0.00 0.00 68.15 69.98 1j5h h THR 90 CO -0.00 0.45 -0.11 0.00 0.37 0.00 0.00 175.52 176.22 1j5h n ALA 91 N -2.28 1.99 -3.34 6.16 0.00 0.69 -5.03 120.51 118.70 1j5h n ALA 91 Ca 0.00 -1.64 -0.28 0.00 0.00 0.00 0.00 53.44 51.52 1j5h n ALA 91 Cb 0.61 -0.28 0.02 0.00 0.00 0.00 0.00 19.45 19.80 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 -0.73 -2.28 -0.47 0.00 0.00 0.67 -4.39 120.51 113.30 1j5h n ALA 92 Ca 0.07 0.05 -0.10 0.00 0.00 0.00 0.00 53.44 53.47 1j5h n ALA 92 Cb 0.55 -1.32 0.16 0.00 0.00 0.00 0.00 19.45 18.84 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 -3.65 0.66 -0.30 0.00 -2.07 0.15 -1.65 119.66 112.80 1j5h s GLN 94 Ca 0.36 -0.22 -0.05 0.00 -1.82 0.00 0.00 55.36 53.63 1j5h s GLN 94 Cb -0.06 0.29 0.02 0.00 -1.09 0.00 0.00 33.01 32.17 1j5h s GLN 94 CO 0.30 -0.18 0.06 0.08 -1.32 0.00 0.00 175.29 174.23 1j5h s VAL 95 N -1.36 3.66 0.48 3.63 1.01 -0.62 -0.69 120.40 126.51 1j5h s VAL 95 Ca -0.14 -0.91 0.07 0.00 0.00 0.00 0.00 61.98 61.00 1j5h s VAL 95 Cb -0.05 -2.94 0.00 0.00 0.00 0.00 0.00 36.38 33.39 1j5h s VAL 95 CO 0.04 0.02 0.36 -0.83 0.00 0.00 0.00 175.10 174.69 1j5h s GLY 96 N 1.43 2.28 0.18 4.51 0.00 -1.26 -4.14 107.32 110.32 1j5h s GLY 96 Ca 0.00 -1.64 0.08 0.00 0.00 0.00 0.00 44.72 43.16 1j5h s GLY 96 CO 0.01 -1.85 -0.04 -2.27 0.00 0.00 0.00 173.10 168.95 1j5h s LEU 97 N -4.17 3.18 -0.01 0.66 1.98 -1.26 -0.53 118.68 118.53 1j5h s LEU 97 Ca 0.40 -0.48 0.01 0.00 -2.89 0.00 0.00 54.13 51.18 1j5h s LEU 97 Cb -0.01 -1.84 0.01 0.00 0.66 0.00 0.00 46.19 45.01 1j5h s LEU 97 CO 0.24 0.09 -0.03 -0.55 -1.89 0.00 0.00 176.35 174.21 1j5h s SER 98 N -2.93 0.52 0.43 3.68 0.15 0.29 -4.60 113.70 111.24 1j5h s SER 98 Ca 0.27 -0.07 0.03 0.00 0.70 0.00 0.00 55.95 56.87 1j5h s SER 98 Cb -0.09 -0.14 0.03 0.00 -1.71 0.00 0.00 66.02 64.10 1j5h s SER 98 CO 0.17 -0.00 0.22 -0.90 1.20 0.00 0.00 173.24 173.93 1j5h n ASP 99 N 3.40 2.66 0.00 5.45 5.68 -1.26 0.17 116.55 132.65 1j5h n ASP 99 Ca -0.18 -2.62 0.10 0.00 -0.50 0.00 0.00 54.79 51.59 1j5h n ASP 99 Cb 0.55 0.07 0.60 0.00 -1.14 0.00 0.00 41.12 41.21 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 -1.95 2.33 0.91 2.12 0.00 -1.26 -1.51 120.51 121.15 1j5h n ALA 100 Ca -0.15 -0.13 0.09 0.00 0.00 0.00 0.00 53.44 53.26 1j5h n ALA 100 Cb 0.51 -1.33 -0.08 0.00 0.00 0.00 0.00 19.45 18.56 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 -0.94 4.20 -2.68 0.00 0.00 -1.26 -4.97 120.51 114.86 1j5h n ALA 101 Ca 0.15 -0.56 -0.12 0.00 0.00 0.00 0.00 53.44 52.91 1j5h n ALA 101 Cb 0.07 -0.70 0.02 0.00 0.00 0.00 0.00 19.45 18.83 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 1.42 0.06 2.98 0.00 0.00 -0.57 -4.99 105.19 104.08 1j5h n GLY 102 Ca 0.05 -0.30 -0.15 0.00 0.00 0.00 0.00 46.02 45.62 1j5h n GLY 102 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1j5h n ASN 103 N -0.51 -3.04 -2.15 1.61 6.94 -1.26 -4.93 115.26 111.93 1j5h n ASN 103 Ca -0.06 -0.41 -0.02 0.00 -0.02 0.00 0.00 54.58 54.08 1j5h n ASN 103 Cb 0.56 -0.74 0.01 0.00 -2.36 0.00 0.00 39.78 37.25 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 2.48 -0.03 0.00 4.83 0.00 -1.26 -4.82 105.19 106.39 1j5h n GLY 104 Ca 0.06 -1.84 0.00 0.00 0.00 0.00 0.00 46.02 44.24 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 -1.15 0.32 0.00 1.61 -0.04 -1.26 -4.57 135.00 129.91 1j5h n PRO 105 Ca 0.01 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.47 1j5h n PRO 105 Cb 0.04 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.50 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 -0.57 0.00 -0.37 0.54 4.07 -1.26 -4.73 120.64 118.32 1j5h n GLU 106 Ca 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.10 1j5h n GLU 106 Cb 0.00 -0.93 0.00 0.00 -0.06 0.00 0.00 31.44 30.45 1j5h n GLU 106 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1j5h n GLY 107 N 3.30 1.15 3.58 8.31 0.00 -1.26 -5.00 105.19 115.27 1j5h n GLY 107 Ca 0.00 -0.26 -0.41 0.00 0.00 0.00 0.00 46.02 45.34 1j5h n GLY 107 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1j5h s VAL 108 N -2.00 4.04 -0.39 1.61 1.01 -1.26 -4.93 120.40 118.48 1j5h s VAL 108 Ca 0.00 -1.66 -0.29 0.00 0.00 0.00 0.00 61.98 60.04 1j5h s VAL 108 Cb 0.00 -5.11 0.00 0.00 0.00 0.00 0.00 36.38 31.27 1j5h s VAL 108 CO 0.00 -1.92 1.50 0.00 0.00 0.00 0.00 175.10 174.68 1j5h s ALA 109 N 4.98 3.01 -0.18 5.51 0.00 -1.26 -1.59 121.76 132.23 1j5h s ALA 109 Ca 0.54 -0.05 -0.08 0.00 0.00 0.00 0.00 51.96 52.37 1j5h s ALA 109 Cb 0.03 -3.95 -0.04 0.00 0.00 0.00 0.00 23.12 19.15 1j5h s ALA 109 CO 0.06 -2.43 0.08 0.42 0.00 0.00 0.00 175.76 173.88 1j5h s ILE 110 N 5.73 4.94 -0.53 0.00 1.01 -0.66 -4.78 121.20 126.91 1j5h s ILE 110 Ca 0.65 0.02 -0.25 0.00 0.00 0.00 0.00 60.65 61.08 1j5h s ILE 110 Cb -0.16 -3.22 0.04 0.00 0.01 0.00 0.00 42.46 39.13 1j5h s ILE 110 CO 0.33 0.47 0.95 -0.55 0.00 0.00 0.00 174.94 176.14 1j5h s SER 111 N 0.22 6.38 -0.12 3.58 0.15 -0.72 -4.09 113.70 119.11 1j5h s SER 111 Ca 0.05 -0.22 -0.28 0.00 0.70 0.00 0.00 55.95 56.20 1j5h s SER 111 Cb -0.12 -2.45 -0.01 0.00 -1.71 0.00 0.00 66.02 61.73 1j5h s SER 111 CO -0.00 -1.21 0.95 -0.36 1.20 0.00 0.00 173.24 173.83 1j5h s PHE 112 N 3.97 3.50 0.00 3.44 0.40 -1.26 -0.84 117.98 127.18 1j5h s PHE 112 Ca 0.33 1.50 0.00 0.00 -0.60 0.00 0.00 56.93 58.16 1j5h s PHE 112 Cb -0.12 -3.13 0.00 0.00 0.51 0.00 0.00 43.02 40.28 1j5h s PHE 112 CO 0.21 -0.21 0.00 -1.71 0.70 0.00 0.00 175.22 174.21