#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1j7h s MET 2 N 0.00 2.70 0.35 2.12 -2.45 -1.26 -4.99 119.30 115.76 1j7h s MET 2 Ca 0.00 -1.25 0.00 0.00 -1.25 0.00 0.00 55.69 53.19 1j7h s MET 2 Cb 0.00 -2.43 0.00 0.00 1.25 0.00 0.00 34.83 33.65 1j7h s MET 2 CO 0.00 0.26 0.00 2.41 1.05 0.00 0.00 175.02 178.74 1j7h n THR 3 N -1.19 -5.07 -3.39 10.11 -1.04 -0.83 -5.00 114.28 107.87 1j7h n THR 3 Ca -0.05 2.27 0.02 0.00 -2.04 0.00 0.00 64.05 64.24 1j7h n THR 3 Cb 0.59 -3.10 -0.05 0.00 -1.82 0.00 0.00 70.33 65.95 1j7h n THR 3 CO 0.00 0.00 0.00 -1.58 -0.64 0.00 0.00 175.07 172.85 1j7h s GLN 4 N -2.57 0.20 0.72 -2.82 2.00 0.63 -4.95 119.66 112.88 1j7h s GLN 4 Ca 0.00 0.45 -0.16 0.00 -2.00 0.00 0.00 55.36 53.65 1j7h s GLN 4 Cb 0.00 0.23 0.01 0.00 0.80 0.00 0.00 33.01 34.05 1j7h s GLN 4 CO 0.00 -0.06 1.04 -0.89 -0.50 0.00 0.00 175.29 174.88 1j7h n ILE 5 N 4.48 2.96 -4.29 -2.34 -0.00 -1.26 -0.91 119.36 118.00 1j7h n ILE 5 Ca -0.10 -0.36 -0.27 0.00 -0.00 0.00 0.00 62.75 62.02 1j7h n ILE 5 Cb 0.55 -1.16 -0.09 0.00 -0.00 0.00 0.00 39.64 38.94 1j7h n ILE 5 CO 0.00 0.00 0.00 -0.63 -0.00 0.00 0.00 176.55 175.92 1j7h s ILE 6 N -1.81 3.23 -0.21 1.39 1.01 0.76 -4.74 121.20 120.84 1j7h s ILE 6 Ca 0.74 -1.66 -0.10 0.00 0.00 0.00 0.00 60.65 59.64 1j7h s ILE 6 Cb -0.34 -2.61 0.08 0.00 0.01 0.00 0.00 42.46 39.60 1j7h s ILE 6 CO 0.49 -0.13 0.47 -2.28 0.00 0.00 0.00 174.94 173.50 1j7h s HIS 7 N -1.74 -0.79 0.09 3.97 2.46 -1.26 -2.75 115.29 115.25 1j7h s HIS 7 Ca 0.25 1.57 0.05 0.00 0.47 0.00 0.00 55.06 57.41 1j7h s HIS 7 Cb -0.09 0.38 -0.03 0.00 -0.13 0.00 0.00 32.58 32.71 1j7h s HIS 7 CO 0.16 -0.44 -0.14 -0.08 -2.47 0.00 0.00 174.74 171.77 1j7h s THR 8 N 1.93 1.16 -0.41 0.89 -1.32 -1.26 -5.01 115.64 111.62 1j7h s THR 8 Ca -0.07 -1.45 0.04 0.00 -1.21 0.00 0.00 61.69 59.00 1j7h s THR 8 Cb -0.09 -1.23 0.61 0.00 -1.51 0.00 0.00 72.50 70.28 1j7h s THR 8 CO -0.14 -0.30 1.84 -0.62 -2.21 0.00 0.00 174.62 173.18 1j7h n GLU 9 N 1.01 2.14 -0.07 7.08 1.02 -1.26 -4.20 120.64 126.36 1j7h n GLU 9 Ca -0.19 -2.74 -0.09 0.00 -0.02 0.00 0.00 57.16 54.11 1j7h n GLU 9 Cb 0.55 -2.08 -0.06 0.00 -0.02 0.00 0.00 31.44 29.83 1j7h n GLU 9 CO 0.00 0.00 0.00 1.17 1.18 0.00 0.00 177.13 179.48 1j7h n LYS 10 N -1.00 0.47 -3.26 3.49 0.00 -1.26 -4.96 118.16 111.64 1j7h n LYS 10 Ca 0.55 0.07 -0.40 0.00 0.00 0.00 0.00 58.31 58.53 1j7h n LYS 10 Cb 1.56 -1.27 -0.08 0.00 0.00 0.00 0.00 35.03 35.25 1j7h n LYS 10 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1j7h s ALA 11 N -2.27 3.58 -0.75 3.14 0.00 -1.26 -4.92 121.76 119.28 1j7h s ALA 11 Ca -0.17 -0.60 0.10 0.00 0.00 0.00 0.00 51.96 51.29 1j7h s ALA 11 Cb 0.05 -2.86 0.47 0.00 0.00 0.00 0.00 23.12 20.78 1j7h s ALA 11 CO 0.32 -0.68 1.29 -2.30 0.00 0.00 0.00 175.76 174.39 1j7h n PRO 12 N 5.40 0.05 0.00 0.00 -0.02 -1.26 -4.73 135.00 134.44 1j7h n PRO 12 Ca -0.05 0.49 0.00 0.00 -2.02 0.00 0.00 63.50 61.93 1j7h n PRO 12 Cb 0.50 -1.65 0.00 0.00 -0.02 0.00 0.00 33.50 32.33 1j7h n PRO 12 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1j7h n ALA 13 N -1.59 0.00 -0.92 3.55 0.00 -1.26 -4.82 120.51 115.47 1j7h n ALA 13 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1j7h n ALA 13 Cb 0.05 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.50 1j7h n ALA 13 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1j7h n ALA 14 N -2.35 0.00 -0.98 0.00 0.00 -1.26 -4.91 120.51 111.00 1j7h n ALA 14 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1j7h n ALA 14 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1j7h n ALA 14 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 1j7h n ILE 15 N -0.87 0.00 0.00 0.00 2.08 -1.26 -4.99 119.36 114.31 1j7h n ILE 15 Ca 0.00 0.00 0.00 0.00 0.56 0.00 0.00 62.75 63.31 1j7h n ILE 15 Cb 0.00 -0.32 0.00 0.00 -0.75 0.00 0.00 39.64 38.57 1j7h n ILE 15 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1j7h n GLY 16 N -2.98 5.23 1.99 7.39 0.00 -1.26 -5.00 105.19 110.55 1j7h n GLY 16 Ca 0.00 -1.11 -0.14 0.00 0.00 0.00 0.00 46.02 44.78 1j7h n GLY 16 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1j7h n PRO 17 N 0.00 1.84 -1.64 1.61 -0.04 -1.26 -4.84 135.00 130.67 1j7h n PRO 17 Ca 0.00 -1.18 0.00 0.00 -0.04 0.00 0.00 63.50 62.28 1j7h n PRO 17 Cb 0.00 -1.75 0.00 0.00 -0.04 0.00 0.00 33.50 31.71 1j7h n PRO 17 CO 0.00 0.00 0.00 2.48 -0.04 0.00 0.00 175.50 177.94 1j7h n TYR 18 N 1.55 -0.18 -4.75 0.54 4.11 -1.26 -5.19 117.16 111.99 1j7h n TYR 18 Ca 0.33 0.00 -0.32 0.00 -0.00 0.00 0.00 57.90 57.90 1j7h n TYR 18 Cb 0.68 0.00 -0.07 0.00 -0.00 0.00 0.00 39.34 39.96 1j7h n TYR 18 CO 0.00 0.00 0.00 1.33 -0.00 0.00 0.00 176.86 178.19 1j7h n VAL 19 N 0.00 0.00 0.04 -3.48 0.24 -1.26 -4.45 118.33 109.42 1j7h n VAL 19 Ca 0.00 -2.41 -0.12 0.00 -2.04 0.00 0.00 64.34 59.77 1j7h n VAL 19 Cb 0.00 0.51 -0.09 0.00 -1.47 0.00 0.00 33.84 32.79 1j7h n VAL 19 CO 0.00 0.00 0.00 1.56 -2.14 0.00 0.00 176.83 176.25 1j7h h GLN 20 N 0.00 -0.15 0.00 7.34 1.08 -1.94 -3.43 115.11 118.01 1j7h h GLN 20 Ca -0.42 0.01 -0.04 0.00 -1.45 0.00 0.00 58.65 56.76 1j7h h GLN 20 Cb 1.28 0.03 0.01 0.00 -0.05 0.00 0.00 27.48 28.75 1j7h h GLN 20 CO 0.69 0.32 0.22 0.00 -0.95 0.00 0.00 178.83 179.11 1j7h n ALA 21 N -2.47 -1.48 -3.33 3.87 0.00 -1.11 -3.32 120.51 112.68 1j7h n ALA 21 Ca -0.08 -1.11 -0.16 0.00 0.00 0.00 0.00 53.44 52.09 1j7h n ALA 21 Cb 0.27 0.88 -0.15 0.00 0.00 0.00 0.00 19.45 20.45 1j7h n ALA 21 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 1j7h s VAL 22 N -2.25 0.22 -0.54 0.00 -7.23 -1.08 -0.17 120.40 109.35 1j7h s VAL 22 Ca 0.14 -0.02 -0.02 0.00 -1.81 0.00 0.00 61.98 60.28 1j7h s VAL 22 Cb -0.04 -0.26 0.14 0.00 0.56 0.00 0.00 36.38 36.78 1j7h s VAL 22 CO 0.11 0.12 0.34 -0.62 -0.31 0.00 0.00 175.10 174.73 1j7h s ASP 23 N 0.54 5.11 0.63 4.85 -1.08 -0.08 -2.60 116.67 124.04 1j7h s ASP 23 Ca -0.05 -2.63 0.41 0.00 -0.52 0.00 0.00 52.55 49.75 1j7h s ASP 23 Cb -0.08 -1.81 2.13 0.00 -1.46 0.00 0.00 42.92 41.69 1j7h s ASP 23 CO -0.01 -0.40 2.27 -0.07 0.52 0.00 0.00 175.17 177.48 1j7h h LEU 24 N 7.25 0.00 0.00 -1.34 3.38 -1.78 0.18 115.31 123.00 1j7h h LEU 24 Ca -0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.92 1j7h h LEU 24 Cb 0.97 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.72 1j7h h LEU 24 CO 0.70 0.01 0.00 0.61 0.09 0.00 0.00 178.44 179.84 1j7h n GLY 25 N -0.81 0.96 0.32 0.83 0.00 -1.26 -1.96 105.19 103.27 1j7h n GLY 25 Ca -0.02 -0.64 0.14 0.00 0.00 0.00 0.00 46.02 45.49 1j7h n GLY 25 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1j7h h ASN 26 N 0.00 0.04 -3.29 1.61 4.21 -1.92 -3.39 115.58 112.84 1j7h h ASN 26 Ca 0.00 0.00 -0.68 0.00 1.21 0.00 0.00 56.30 56.83 1j7h h ASN 26 Cb 0.00 -0.01 -0.33 0.00 -1.12 0.00 0.00 38.32 36.86 1j7h h ASN 26 CO 0.00 0.02 -0.87 -0.76 -1.29 0.00 0.00 177.43 174.54 1j7h s LEU 27 N -8.95 2.14 0.50 1.61 1.02 -1.26 -0.06 118.68 113.67 1j7h s LEU 27 Ca -0.05 -0.56 0.07 0.00 0.02 0.00 0.00 54.13 53.61 1j7h s LEU 27 Cb 0.18 -1.44 0.02 0.00 0.02 0.00 0.00 46.19 44.98 1j7h s LEU 27 CO 0.71 0.13 0.47 0.68 0.02 0.00 0.00 176.35 178.36 1j7h s VAL 28 N 0.53 2.16 -0.19 -1.59 -7.23 0.35 -2.80 120.40 111.62 1j7h s VAL 28 Ca -0.14 -1.33 -0.28 0.00 -1.81 0.00 0.00 61.98 58.42 1j7h s VAL 28 Cb -0.17 -2.49 0.11 0.00 0.56 0.00 0.00 36.38 34.40 1j7h s VAL 28 CO 0.05 0.00 0.95 -1.48 -0.31 0.00 0.00 175.10 174.31 1j7h s LEU 29 N -4.30 -0.46 0.05 1.32 2.34 -1.07 -1.50 118.68 115.07 1j7h s LEU 29 Ca 0.45 0.66 0.04 0.00 0.06 0.00 0.00 54.13 55.34 1j7h s LEU 29 Cb -0.03 2.00 -0.04 0.00 -0.56 0.00 0.00 46.19 47.55 1j7h s LEU 29 CO 0.27 -0.31 -0.02 0.42 -1.06 0.00 0.00 176.35 175.65 1j7h s THR 30 N -0.59 3.90 0.63 5.48 -4.23 -0.39 -2.62 115.64 117.82 1j7h s THR 30 Ca -0.01 -0.88 -0.10 0.00 -1.18 0.00 0.00 61.69 59.52 1j7h s THR 30 Cb -0.02 -2.80 -0.01 0.00 1.34 0.00 0.00 72.50 71.01 1j7h s THR 30 CO 0.00 0.24 1.00 -0.55 -0.54 0.00 0.00 174.62 174.77 1j7h s SER 31 N -1.93 5.86 -0.81 3.99 0.15 -1.21 -4.11 113.70 115.64 1j7h s SER 31 Ca 0.22 1.15 -0.22 0.00 0.70 0.00 0.00 55.95 57.80 1j7h s SER 31 Cb -0.11 -2.13 -0.19 0.00 -1.71 0.00 0.00 66.02 61.88 1j7h s SER 31 CO 0.14 -1.03 2.38 0.61 1.20 0.00 0.00 173.24 176.54 1j7h n GLY 32 N -2.76 -0.21 3.75 9.45 0.00 -1.24 -4.50 105.19 109.68 1j7h n GLY 32 Ca 0.05 0.39 -0.35 0.00 0.00 0.00 0.00 46.02 46.11 1j7h n GLY 32 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1j7h s GLN 33 N 8.33 2.77 -0.05 1.61 -1.52 0.32 -4.80 119.66 126.32 1j7h s GLN 33 Ca 1.09 1.72 0.04 0.00 -1.95 0.00 0.00 55.36 56.26 1j7h s GLN 33 Cb -0.44 -1.92 0.00 0.00 -0.22 0.00 0.00 33.01 30.43 1j7h s GLN 33 CO 0.28 -1.34 -0.16 0.42 -0.25 0.00 0.00 175.29 174.25 1j7h s ILE 34 N -1.82 1.37 -1.07 1.08 1.09 -1.26 -2.73 121.20 117.85 1j7h s ILE 34 Ca 0.75 -0.67 -0.20 0.00 -1.10 0.00 0.00 60.65 59.43 1j7h s ILE 34 Cb -0.28 -1.19 -0.07 0.00 -1.06 0.00 0.00 42.46 39.86 1j7h s ILE 34 CO 0.37 0.40 1.99 -0.81 -0.10 0.00 0.00 174.94 176.79 1j7h n PRO 35 N 3.30 2.05 -2.85 2.79 -0.04 -1.26 -4.66 135.00 134.34 1j7h n PRO 35 Ca -0.19 -2.29 -0.43 0.00 -0.04 0.00 0.00 63.50 60.54 1j7h n PRO 35 Cb 0.53 -3.20 -0.02 0.00 -0.04 0.00 0.00 33.50 30.76 1j7h n PRO 35 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1j7h s VAL 36 N 5.39 4.60 -0.12 0.52 1.01 -1.25 -2.35 120.40 128.20 1j7h s VAL 36 Ca 0.56 -1.62 -0.28 0.00 0.00 0.00 0.00 61.98 60.64 1j7h s VAL 36 Cb 0.11 -4.87 -0.13 0.00 0.00 0.00 0.00 36.38 31.49 1j7h s VAL 36 CO 0.06 -1.63 0.82 -3.20 0.00 0.00 0.00 175.10 171.16 1j7h n ASN 37 N 6.92 0.28 0.00 3.32 2.85 -1.26 -4.52 115.26 122.85 1j7h n ASN 37 Ca 0.29 0.77 0.09 0.00 -0.11 0.00 0.00 54.58 55.62 1j7h n ASN 37 Cb 0.48 -0.59 0.49 0.00 1.24 0.00 0.00 39.78 41.40 1j7h n ASN 37 CO 0.00 0.00 0.00 -0.81 -2.11 0.00 0.00 177.26 174.34 1j7h n PRO 38 N 1.57 0.28 -0.02 1.20 -0.04 -1.26 0.21 135.00 136.92 1j7h n PRO 38 Ca 0.16 0.10 0.02 0.00 -0.04 0.00 0.00 63.50 63.74 1j7h n PRO 38 Cb 0.02 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 31.88 1j7h n PRO 38 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1j7h n ALA 39 N -1.28 2.19 0.00 0.55 0.00 -1.26 -4.78 120.51 115.93 1j7h n ALA 39 Ca 0.09 -0.47 0.00 0.00 0.00 0.00 0.00 53.44 53.06 1j7h n ALA 39 Cb 0.15 -0.27 0.00 0.00 0.00 0.00 0.00 19.45 19.33 1j7h n ALA 39 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 1j7h n THR 40 N -2.12 0.00 -2.07 0.00 5.66 -1.13 -5.07 114.28 109.55 1j7h n THR 40 Ca -0.08 0.00 -0.02 0.00 -3.05 0.00 0.00 64.05 60.89 1j7h n THR 40 Cb 0.53 -0.45 0.01 0.00 -1.55 0.00 0.00 70.33 68.87 1j7h n THR 40 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1j7h n GLY 41 N 1.79 0.41 1.13 1.09 0.00 0.55 -4.93 105.19 105.23 1j7h n GLY 41 Ca 0.00 -0.35 0.00 0.00 0.00 0.00 0.00 46.02 45.67 1j7h n GLY 41 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1j7h n GLU 42 N -1.47 0.00 0.00 1.61 -0.58 -1.26 -4.71 120.64 114.23 1j7h n GLU 42 Ca -0.03 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.71 1j7h n GLU 42 Cb 0.52 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.39 1j7h n GLU 42 CO 0.00 0.00 0.00 1.55 -0.48 0.00 0.00 177.13 178.20 1j7h n VAL 43 N -1.85 0.00 -1.65 2.62 3.14 -0.99 -3.94 118.33 115.66 1j7h n VAL 43 Ca 0.00 0.00 -0.43 0.00 -2.96 0.00 0.00 64.34 60.95 1j7h n VAL 43 Cb 0.00 0.00 -0.01 0.00 -1.06 0.00 0.00 33.84 32.77 1j7h n VAL 43 CO 0.00 0.00 0.00 -2.65 -6.46 0.00 0.00 176.83 167.72 1j7h n PRO 44 N 0.00 1.74 0.13 1.45 -0.02 -1.26 -4.89 135.00 132.14 1j7h n PRO 44 Ca 0.00 0.61 -0.01 0.00 -2.02 0.00 0.00 63.50 62.08 1j7h n PRO 44 Cb 0.00 -2.10 0.25 0.00 -0.02 0.00 0.00 33.50 31.63 1j7h n PRO 44 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1j7h h ALA 45 N 2.22 1.17 -1.20 3.55 0.00 -1.99 -3.40 119.26 119.60 1j7h h ALA 45 Ca -0.43 -0.41 -0.46 0.00 0.00 0.00 0.00 54.91 53.61 1j7h h ALA 45 Cb 1.31 -0.08 -0.05 0.00 0.00 0.00 0.00 17.79 18.96 1j7h h ALA 45 CO 0.61 0.58 1.14 0.34 0.00 0.00 0.00 179.25 181.92 1j7h s ASP 46 N -6.89 5.54 0.53 0.00 2.15 -1.26 -4.82 116.67 111.92 1j7h s ASP 46 Ca -0.04 -0.32 0.41 0.00 0.43 0.00 0.00 52.55 53.03 1j7h s ASP 46 Cb 0.14 -2.55 1.59 0.00 -0.30 0.00 0.00 42.92 41.80 1j7h s ASP 46 CO 0.76 -2.28 1.67 -0.29 -0.17 0.00 0.00 175.17 174.86 1j7h h ILE 47 N 6.83 0.19 0.03 4.11 6.09 -1.97 0.97 117.51 133.77 1j7h h ILE 47 Ca -0.10 -0.01 -0.00 0.00 -1.37 0.00 0.00 64.86 63.37 1j7h h ILE 47 Cb 1.08 0.16 0.00 0.00 0.47 0.00 0.00 36.82 38.53 1j7h h ILE 47 CO 1.25 0.01 -0.01 0.58 -3.07 0.00 0.00 178.15 176.91 1j7h h VAL 48 N 0.03 1.40 -0.64 2.19 2.07 -1.93 -1.79 116.25 117.59 1j7h h VAL 48 Ca 0.77 -1.72 -0.04 0.00 0.82 0.00 0.00 66.70 66.54 1j7h h VAL 48 Cb 2.94 2.49 -0.03 0.00 -1.52 0.00 0.00 31.29 35.17 1j7h h VAL 48 CO -0.09 0.42 0.26 0.00 0.02 0.00 0.00 177.57 178.17 1j7h h ALA 49 N 0.02 1.25 0.00 1.67 0.00 -0.74 0.62 119.26 122.07 1j7h h ALA 49 Ca -0.00 -0.16 -0.08 0.00 0.00 0.00 0.00 54.91 54.66 1j7h h ALA 49 Cb 0.71 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 1j7h h ALA 49 CO 0.01 0.55 -0.37 0.37 0.00 0.00 0.00 179.25 179.81 1j7h h GLN 50 N 0.92 0.00 0.13 0.00 -0.00 0.67 -1.96 115.11 114.87 1j7h h GLN 50 Ca 0.22 0.00 -0.28 0.00 -0.00 0.00 0.00 58.65 58.59 1j7h h GLN 50 Cb 0.18 0.00 0.00 0.00 0.00 0.00 0.00 27.48 27.66 1j7h h GLN 50 CO -0.02 0.37 -1.26 0.00 0.00 0.00 0.00 178.83 177.92 1j7h h ALA 51 N 1.63 0.10 -0.34 3.38 0.00 -0.34 -2.69 119.26 121.00 1j7h h ALA 51 Ca -0.00 -0.90 -0.11 0.00 0.00 0.00 0.00 54.91 53.89 1j7h h ALA 51 Cb 0.74 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.55 1j7h h ALA 51 CO 0.05 0.98 -0.24 -0.09 0.00 0.00 0.00 179.25 179.96 1j7h h ARG 52 N 0.07 0.75 -0.47 0.00 2.43 -0.71 0.69 114.38 117.14 1j7h h ARG 52 Ca -0.14 -0.36 -0.13 0.00 -0.81 0.00 0.00 59.98 58.54 1j7h h ARG 52 Cb 1.97 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 31.51 1j7h h ARG 52 CO 0.20 0.98 -0.22 1.96 -1.51 0.00 0.00 179.97 181.39 1j7h h GLN 53 N 0.53 0.97 -0.21 0.20 1.08 -1.46 -1.16 115.11 115.06 1j7h h GLN 53 Ca 0.07 -0.41 -0.16 0.00 -1.45 0.00 0.00 58.65 56.70 1j7h h GLN 53 Cb 0.79 -0.03 -0.01 0.00 -0.05 0.00 0.00 27.48 28.18 1j7h h GLN 53 CO 0.06 1.08 -0.53 0.77 -0.95 0.00 0.00 178.83 179.26 1j7h h SER 54 N 0.83 0.68 -0.48 1.46 0.02 -1.43 -2.17 113.55 112.48 1j7h h SER 54 Ca 0.11 -0.36 -0.12 0.00 -0.84 0.00 0.00 61.79 60.57 1j7h h SER 54 Cb 0.79 -0.20 -0.01 0.00 0.14 0.00 0.00 62.40 63.12 1j7h h SER 54 CO 0.07 1.09 -0.19 -0.07 -1.14 0.00 0.00 176.83 176.58 1j7h h LEU 55 N 0.48 0.99 -0.69 5.07 3.38 -0.74 -2.31 115.31 121.50 1j7h h LEU 55 Ca 0.01 -0.39 -0.10 0.00 0.09 0.00 0.00 57.88 57.49 1j7h h LEU 55 Cb 1.09 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 41.55 1j7h h LEU 55 CO 0.10 1.16 -0.10 -0.33 0.09 0.00 0.00 178.44 179.37 1j7h h GLU 56 N 0.82 0.92 -0.51 1.13 5.08 -1.17 -2.56 114.58 118.28 1j7h h GLU 56 Ca 0.11 -0.32 -0.03 0.00 -1.00 0.00 0.00 59.36 58.13 1j7h h GLU 56 Cb 0.76 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.92 1j7h h GLU 56 CO 0.06 0.97 0.21 -0.91 -1.00 0.00 0.00 179.01 178.34 1j7h h ASN 57 N 0.82 0.70 -0.54 1.42 2.35 -1.27 0.34 115.58 119.41 1j7h h ASN 57 Ca 0.14 -0.17 -0.01 0.00 -0.55 0.00 0.00 56.30 55.71 1j7h h ASN 57 Cb 0.62 -0.18 -0.03 0.00 0.05 0.00 0.00 38.32 38.78 1j7h h ASN 57 CO 0.04 0.68 0.30 0.58 -1.65 0.00 0.00 177.43 177.38 1j7h h VAL 58 N 0.68 1.17 0.07 2.81 2.07 -1.27 -2.11 116.25 119.67 1j7h h VAL 58 Ca 0.17 -0.44 -0.24 0.00 0.82 0.00 0.00 66.70 67.01 1j7h h VAL 58 Cb 0.19 0.42 -0.01 0.00 -1.52 0.00 0.00 31.29 30.37 1j7h h VAL 58 CO -0.01 0.19 -1.11 0.50 0.02 0.00 0.00 177.57 177.15 1j7h h LYS 59 N 0.78 0.16 -0.96 1.57 3.64 -1.04 -3.08 116.57 117.63 1j7h h LYS 59 Ca 0.20 -0.26 -0.00 0.00 -1.27 0.00 0.00 60.65 59.32 1j7h h LYS 59 Cb 0.03 0.09 -0.05 0.00 -0.41 0.00 0.00 32.23 31.89 1j7h h LYS 59 CO -0.03 1.11 0.60 0.00 -2.27 0.00 0.00 179.45 178.85 1j7h h ALA 60 N 0.78 1.24 -0.15 5.00 0.00 0.28 0.70 119.26 127.12 1j7h h ALA 60 Ca -0.08 -0.09 -0.05 0.00 0.00 0.00 0.00 54.91 54.69 1j7h h ALA 60 Cb 1.85 -0.39 -0.00 0.00 0.00 0.00 0.00 17.79 19.25 1j7h h ALA 60 CO 0.17 0.66 -0.11 0.82 0.00 0.00 0.00 179.25 180.79 1j7h h ILE 61 N 1.32 1.33 -0.14 0.00 2.04 -1.46 0.57 117.51 121.17 1j7h h ILE 61 Ca 0.35 -1.23 -0.09 0.00 1.00 0.00 0.00 64.86 64.89 1j7h h ILE 61 Cb -0.08 1.82 -0.01 0.00 -0.74 0.00 0.00 36.82 37.81 1j7h h ILE 61 CO -0.07 0.36 -0.31 0.40 0.00 0.00 0.00 178.15 178.53 1j7h h ILE 62 N -0.03 1.27 -0.19 -0.67 2.04 -1.39 -2.68 117.51 115.86 1j7h h ILE 62 Ca 0.03 -1.28 -0.19 0.00 1.00 0.00 0.00 64.86 64.42 1j7h h ILE 62 Cb 0.62 1.50 0.01 0.00 -0.74 0.00 0.00 36.82 38.21 1j7h h ILE 62 CO 0.03 0.39 -0.62 -0.08 0.00 0.00 0.00 178.15 177.87 1j7h h GLU 63 N 0.24 0.75 0.00 2.37 4.57 0.61 -1.24 114.58 121.88 1j7h h GLU 63 Ca 0.03 -0.55 -0.00 0.00 -1.18 0.00 0.00 59.36 57.66 1j7h h GLU 63 Cb 0.67 0.10 -0.00 0.00 -0.16 0.00 0.00 28.75 29.36 1j7h h GLU 63 CO 0.05 1.17 -0.01 -0.22 -1.18 0.00 0.00 179.01 178.82 1j7h h LYS 64 N 0.47 0.00 0.00 1.92 1.63 -0.66 -0.69 116.57 119.23 1j7h h LYS 64 Ca -0.02 0.00 -0.23 0.00 -0.85 0.00 0.00 60.65 59.55 1j7h h LYS 64 Cb 1.24 0.00 -0.04 0.00 -0.60 0.00 0.00 32.23 32.83 1j7h h LYS 64 CO 0.13 0.01 -1.40 0.00 -3.45 0.00 0.00 179.45 174.74 1j7h h ALA 65 N 1.99 0.66 0.00 5.00 0.00 -1.25 -3.49 119.26 122.17 1j7h h ALA 65 Ca -0.00 -1.12 0.00 0.00 0.00 0.00 0.00 54.91 53.79 1j7h h ALA 65 Cb 0.07 0.27 0.00 0.00 0.00 0.00 0.00 17.79 18.14 1j7h h ALA 65 CO 0.00 1.27 0.00 0.41 0.00 0.00 0.00 179.25 180.93 1j7h n GLY 66 N 1.45 0.92 3.50 0.00 0.00 -0.27 -5.11 105.19 105.67 1j7h n GLY 66 Ca -0.10 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.79 1j7h n GLY 66 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1j7h s LEU 67 N 0.00 -0.34 0.36 0.99 1.43 -0.52 -5.00 118.68 115.60 1j7h s LEU 67 Ca 0.00 1.21 -0.01 0.00 -1.03 0.00 0.00 54.13 54.31 1j7h s LEU 67 Cb 0.00 2.03 -0.04 0.00 0.03 0.00 0.00 46.19 48.21 1j7h s LEU 67 CO 0.00 -0.21 0.58 -0.89 0.23 0.00 0.00 176.35 176.06 1j7h s THR 68 N 0.56 5.07 0.42 5.49 2.01 -1.26 -2.73 115.64 125.20 1j7h s THR 68 Ca -0.02 -0.32 0.11 0.00 0.31 0.00 0.00 61.69 61.77 1j7h s THR 68 Cb -0.05 -3.85 0.31 0.00 0.01 0.00 0.00 72.50 68.92 1j7h s THR 68 CO -0.03 -0.57 1.99 0.00 -0.69 0.00 0.00 174.62 175.33 1j7h h ALA 69 N 0.79 1.90 -0.67 7.40 0.00 -1.94 -0.16 119.26 126.58 1j7h h ALA 69 Ca -0.49 -0.02 0.19 0.00 0.00 0.00 0.00 54.91 54.60 1j7h h ALA 69 Cb 1.21 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.86 1j7h h ALA 69 CO 0.62 -0.01 0.55 0.00 0.00 0.00 0.00 179.25 180.41 1j7h h ALA 70 N 1.70 2.53 0.00 0.00 0.00 -1.89 0.90 119.26 122.51 1j7h h ALA 70 Ca 0.25 -0.02 -0.10 0.00 0.00 0.00 0.00 54.91 55.04 1j7h h ALA 70 Cb 0.37 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 1j7h h ALA 70 CO -0.07 -0.89 -0.46 -0.44 0.00 0.00 0.00 179.25 177.39 1j7h h ASP 71 N 0.00 0.00 -1.42 0.00 5.19 -1.36 -3.45 116.42 115.37 1j7h h ASP 71 Ca 0.32 0.00 -0.74 0.00 -0.62 0.00 0.00 57.03 55.99 1j7h h ASP 71 Cb 1.42 0.00 0.01 0.00 0.18 0.00 0.00 39.33 40.93 1j7h h ASP 71 CO -0.00 0.46 0.96 -0.38 -3.12 0.00 0.00 179.24 177.15 1j7h n ILE 72 N -3.52 0.28 -0.04 0.35 5.41 0.31 -3.00 119.36 119.16 1j7h n ILE 72 Ca -0.00 -0.07 -0.10 0.00 1.00 0.00 0.00 62.75 63.58 1j7h n ILE 72 Cb 0.58 -1.21 -0.14 0.00 -0.71 0.00 0.00 39.64 38.16 1j7h n ILE 72 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 176.55 177.88 1j7h n VAL 73 N 4.88 1.58 -4.12 1.39 0.24 -0.77 -4.25 118.33 117.28 1j7h n VAL 73 Ca 0.29 -0.80 -0.08 0.00 -2.04 0.00 0.00 64.34 61.71 1j7h n VAL 73 Cb 0.12 -0.98 -0.10 0.00 -1.47 0.00 0.00 33.84 31.41 1j7h n VAL 73 CO 0.00 0.00 0.00 -0.75 -2.14 0.00 0.00 176.83 173.94 1j7h s LYS 74 N -2.57 0.71 -0.18 7.34 2.20 -1.18 0.37 119.74 126.41 1j7h s LYS 74 Ca -0.07 -1.27 -0.15 0.00 -0.36 0.00 0.00 55.97 54.11 1j7h s LYS 74 Cb 0.08 0.04 0.05 0.00 -1.51 0.00 0.00 37.83 36.49 1j7h s LYS 74 CO 0.82 -0.08 0.48 0.99 -0.36 0.00 0.00 175.35 177.20 1j7h s THR 75 N -3.80 -0.00 -0.01 3.43 2.01 0.20 -1.25 115.64 116.22 1j7h s THR 75 Ca 0.09 0.01 0.05 0.00 0.31 0.00 0.00 61.69 62.16 1j7h s THR 75 Cb 0.07 -0.67 -0.01 0.00 0.01 0.00 0.00 72.50 71.89 1j7h s THR 75 CO -0.08 0.01 -0.17 -0.89 -0.69 0.00 0.00 174.62 172.80 1j7h s THR 76 N 0.50 1.35 -0.16 -0.82 2.01 -0.26 -1.30 115.64 116.95 1j7h s THR 76 Ca -0.02 -0.77 -0.04 0.00 0.31 0.00 0.00 61.69 61.17 1j7h s THR 76 Cb -0.04 -1.13 0.08 0.00 0.01 0.00 0.00 72.50 71.42 1j7h s THR 76 CO -0.02 0.35 0.25 -0.69 -0.69 0.00 0.00 174.62 173.81 1j7h s VAL 77 N -0.45 -0.38 -0.41 3.82 1.01 -1.19 -1.69 120.40 121.11 1j7h s VAL 77 Ca 0.06 0.12 -0.22 0.00 0.00 0.00 0.00 61.98 61.94 1j7h s VAL 77 Cb -0.07 -0.54 0.02 0.00 0.00 0.00 0.00 36.38 35.79 1j7h s VAL 77 CO -0.00 -0.02 0.73 -0.36 0.00 0.00 0.00 175.10 175.45 1j7h s PHE 78 N 2.38 3.07 0.08 5.22 0.08 -0.97 -2.50 117.98 125.34 1j7h s PHE 78 Ca 0.04 0.26 -0.04 0.00 0.12 0.00 0.00 56.93 57.31 1j7h s PHE 78 Cb -0.14 -3.43 -0.05 0.00 -0.57 0.00 0.00 43.02 38.84 1j7h s PHE 78 CO -0.10 -0.83 0.29 0.14 -0.10 0.00 0.00 175.22 174.63 1j7h s VAL 79 N 3.03 5.27 -1.86 -0.44 -7.23 -0.06 -1.80 120.40 117.32 1j7h s VAL 79 Ca 0.28 -0.05 0.23 0.00 -1.81 0.00 0.00 61.98 60.62 1j7h s VAL 79 Cb -0.13 -3.61 -0.02 0.00 0.56 0.00 0.00 36.38 33.18 1j7h s VAL 79 CO 0.19 0.17 1.10 1.17 -0.31 0.00 0.00 175.10 177.42 1j7h n LYS 80 N 0.46 0.99 -3.28 4.82 0.00 -1.11 0.10 118.16 120.15 1j7h n LYS 80 Ca -0.06 -0.81 -0.07 0.00 0.00 0.00 0.00 58.31 57.37 1j7h n LYS 80 Cb 0.52 -1.48 -0.05 0.00 0.00 0.00 0.00 35.03 34.02 1j7h n LYS 80 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.40 176.89 1j7h s ASP 81 N -2.56 -0.03 0.54 3.14 1.11 -1.26 -4.87 116.67 112.74 1j7h s ASP 81 Ca 0.17 -0.52 0.32 0.00 0.18 0.00 0.00 52.55 52.70 1j7h s ASP 81 Cb 0.18 1.27 1.75 0.00 1.07 0.00 0.00 42.92 47.19 1j7h s ASP 81 CO 0.61 -0.31 1.97 -0.07 1.18 0.00 0.00 175.17 178.56 1j7h h LEU 82 N 7.84 0.00 -0.44 1.23 3.38 -1.96 0.21 115.31 125.57 1j7h h LEU 82 Ca -0.04 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.84 1j7h h LEU 82 Cb 1.13 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.86 1j7h h LEU 82 CO 0.22 0.00 -0.44 0.78 0.09 0.00 0.00 178.44 179.09 1j7h h ASN 83 N 0.00 0.00 1.26 -0.43 2.35 -2.01 -3.08 115.58 113.67 1j7h h ASN 83 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1j7h h ASN 83 Cb 0.22 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.59 1j7h h ASN 83 CO 0.00 0.44 -0.70 0.44 -1.65 0.00 0.00 177.43 175.96 1j7h h ASP 84 N 0.00 0.00 -0.08 5.81 3.32 -1.01 -3.32 116.42 121.15 1j7h h ASP 84 Ca -0.00 -0.02 0.02 0.00 0.02 0.00 0.00 57.03 57.05 1j7h h ASP 84 Cb 1.16 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.71 1j7h h ASP 84 CO 0.06 0.01 0.18 0.15 -1.72 0.00 0.00 179.24 177.91 1j7h h PHE 85 N 0.00 0.00 -0.77 4.55 3.57 -1.41 -1.41 116.94 121.48 1j7h h PHE 85 Ca 0.00 0.00 0.10 0.00 3.53 0.00 0.00 57.97 61.60 1j7h h PHE 85 Cb 0.98 0.00 -0.05 0.00 2.79 0.00 0.00 35.95 39.66 1j7h h PHE 85 CO 0.00 0.00 0.50 0.00 -2.23 0.00 0.00 178.31 176.58 1j7h h ALA 86 N 1.72 1.81 0.11 2.41 0.00 -1.73 0.92 119.26 124.50 1j7h h ALA 86 Ca 0.04 -0.01 -0.22 0.00 0.00 0.00 0.00 54.91 54.72 1j7h h ALA 86 Cb 0.39 -0.15 0.01 0.00 0.00 0.00 0.00 17.79 18.04 1j7h h ALA 86 CO -0.00 0.03 -1.09 0.00 0.00 0.00 0.00 179.25 178.19 1j7h h ALA 87 N 1.61 0.06 -0.59 0.00 0.00 -1.54 -3.03 119.26 115.77 1j7h h ALA 87 Ca 0.36 -0.90 -0.07 0.00 0.00 0.00 0.00 54.91 54.30 1j7h h ALA 87 Cb 0.48 0.31 -0.03 0.00 0.00 0.00 0.00 17.79 18.56 1j7h h ALA 87 CO -0.13 0.60 0.10 0.28 0.00 0.00 0.00 179.25 180.10 1j7h h VAL 88 N -0.40 1.25 -0.49 0.00 2.07 -1.42 -1.64 116.25 115.62 1j7h h VAL 88 Ca -0.23 -0.94 -0.08 0.00 0.82 0.00 0.00 66.70 66.27 1j7h h VAL 88 Cb 1.65 0.68 -0.02 0.00 -1.52 0.00 0.00 31.29 32.09 1j7h h VAL 88 CO 0.08 0.35 -0.01 -1.13 0.02 0.00 0.00 177.57 176.88 1j7h h ASN 89 N 0.89 0.86 -0.34 0.57 -1.24 0.73 0.86 115.58 117.91 1j7h h ASN 89 Ca 0.18 -0.31 -0.08 0.00 0.71 0.00 0.00 56.30 56.80 1j7h h ASN 89 Cb 0.38 -0.23 -0.02 0.00 0.73 0.00 0.00 38.32 39.18 1j7h h ASN 89 CO 0.01 0.96 -0.06 0.00 -1.29 0.00 0.00 177.43 177.05 1j7h h ALA 90 N 0.93 1.07 0.02 1.57 0.00 -1.37 -2.97 119.26 118.51 1j7h h ALA 90 Ca 0.14 -0.29 -0.25 0.00 0.00 0.00 0.00 54.91 54.51 1j7h h ALA 90 Cb 0.52 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.10 1j7h h ALA 90 CO 0.03 0.58 -1.33 0.93 0.00 0.00 0.00 179.25 179.45 1j7h h GLU 91 N 0.69 0.04 -0.71 0.00 4.39 -1.13 -2.97 114.58 114.89 1j7h h GLU 91 Ca 0.13 -0.06 0.11 0.00 0.34 0.00 0.00 59.36 59.87 1j7h h GLU 91 Cb 0.52 0.02 -0.08 0.00 -0.10 0.00 0.00 28.75 29.11 1j7h h GLU 91 CO 0.03 0.83 0.32 -0.92 -1.16 0.00 0.00 179.01 178.11 1j7h h TYR 92 N 0.01 0.57 0.00 4.33 3.20 0.90 -0.36 116.97 125.62 1j7h h TYR 92 Ca -0.14 0.03 -0.05 0.00 3.14 0.00 0.00 58.73 61.71 1j7h h TYR 92 Cb 1.89 -0.15 -0.01 0.00 1.54 0.00 0.00 36.73 40.01 1j7h h TYR 92 CO 0.01 0.17 -0.75 1.49 -1.64 0.00 0.00 178.16 177.44 1j7h h GLU 93 N 0.53 0.00 0.00 1.82 4.81 -1.65 -3.20 114.58 116.88 1j7h h GLU 93 Ca 0.36 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.57 1j7h h GLU 93 Cb 0.44 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.81 1j7h h GLU 93 CO -0.31 0.14 -0.09 -0.09 -0.73 0.00 0.00 179.01 177.93 1j7h h ARG 94 N 0.00 0.00 0.05 1.92 2.43 -1.07 -3.12 114.38 114.60 1j7h h ARG 94 Ca -0.03 0.00 -0.34 0.00 -0.81 0.00 0.00 59.98 58.80 1j7h h ARG 94 Cb 1.18 0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 30.69 1j7h h ARG 94 CO 0.02 0.09 -1.95 1.97 -1.51 0.00 0.00 179.97 178.59 1j7h n PHE 95 N -3.17 0.96 0.35 2.20 1.16 -0.26 -3.14 117.46 115.55 1j7h n PHE 95 Ca 0.02 0.26 -0.19 0.00 -1.87 0.00 0.00 57.45 55.67 1j7h n PHE 95 Cb 0.43 -1.15 -0.10 0.00 -1.61 0.00 0.00 39.48 37.06 1j7h n PHE 95 CO 0.00 0.00 0.00 0.74 -1.87 0.00 0.00 176.76 175.63 1j7h h PHE 96 N 0.03 -1.36 0.00 2.97 0.04 -1.55 0.33 116.94 117.40 1j7h h PHE 96 Ca -0.39 0.00 -0.04 0.00 2.80 0.00 0.00 57.97 60.35 1j7h h PHE 96 Cb 2.03 0.51 -0.01 0.00 2.20 0.00 0.00 35.95 40.69 1j7h h PHE 96 CO 0.04 -0.69 -0.17 -0.22 -0.60 0.00 0.00 178.31 176.66 1j7h h LYS 97 N -1.08 0.00 0.00 1.51 3.11 -1.71 1.27 116.57 119.66 1j7h h LYS 97 Ca -0.08 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.76 1j7h h LYS 97 Cb 0.91 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 32.14 1j7h h LYS 97 CO 0.00 0.17 0.00 0.39 -2.81 0.00 0.00 179.45 177.21 1j7h n GLU 98 N -4.17 0.00 0.00 1.90 1.02 -0.81 -2.76 120.64 115.83 1j7h n GLU 98 Ca -0.02 0.07 0.04 0.00 -0.02 0.00 0.00 57.16 57.22 1j7h n GLU 98 Cb 0.24 -1.50 -0.01 0.00 -0.02 0.00 0.00 31.44 30.15 1j7h n GLU 98 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1j7h n ASN 99 N -1.50 0.86 -0.14 1.62 3.02 0.11 -4.99 115.26 114.24 1j7h n ASN 99 Ca 0.06 -0.93 0.00 0.00 -0.03 0.00 0.00 54.58 53.68 1j7h n ASN 99 Cb 0.29 0.60 0.00 0.00 -0.61 0.00 0.00 39.78 40.07 1j7h n ASN 99 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1j7h n ASN 100 N -0.52 -0.87 -2.72 6.41 4.13 0.32 -4.85 115.26 117.14 1j7h n ASN 100 Ca 0.03 0.00 -0.29 0.00 1.68 0.00 0.00 54.58 55.99 1j7h n ASN 100 Cb 0.14 -0.30 -0.01 0.00 -1.54 0.00 0.00 39.78 38.08 1j7h n ASN 100 CO 0.00 0.00 0.00 1.41 0.28 0.00 0.00 177.26 178.95 1j7h n HIS 101 N -2.19 3.51 0.29 3.10 8.25 0.41 -4.67 115.22 123.92 1j7h n HIS 101 Ca 0.00 -3.24 0.15 0.00 -0.26 0.00 0.00 57.72 54.37 1j7h n HIS 101 Cb 0.30 -0.38 0.50 0.00 1.12 0.00 0.00 29.99 31.53 1j7h n HIS 101 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 1j7h h PRO 102 N 2.83 0.00 -1.17 -0.41 0.13 -1.90 -3.27 132.00 128.21 1j7h h PRO 102 Ca 0.30 0.00 0.34 0.00 -0.87 0.00 0.00 66.00 65.77 1j7h h PRO 102 Cb 0.67 0.00 -0.10 0.00 0.13 0.00 0.00 31.00 31.69 1j7h h PRO 102 CO 0.93 0.00 0.76 -0.97 -0.23 0.00 0.00 178.00 178.49 1j7h h ASN 103 N 0.00 0.33 -4.09 1.44 -0.00 -1.88 -3.47 115.58 107.91 1j7h h ASN 103 Ca 0.00 0.10 0.00 0.00 -0.00 0.00 0.00 56.30 56.40 1j7h h ASN 103 Cb 0.66 0.06 -0.03 0.00 -0.00 0.00 0.00 38.32 39.00 1j7h h ASN 103 CO 0.00 -0.03 -0.73 0.49 -0.00 0.00 0.00 177.43 177.17 1j7h n PHE 104 N -4.61 -2.83 -2.39 0.67 3.72 -1.23 -5.03 117.46 105.76 1j7h n PHE 104 Ca 0.30 1.67 -0.28 0.00 -0.05 0.00 0.00 57.45 59.09 1j7h n PHE 104 Cb 1.13 -3.06 0.01 0.00 -0.94 0.00 0.00 39.48 36.62 1j7h n PHE 104 CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 176.76 175.46 1j7h s PRO 105 N -1.04 3.50 0.76 -1.08 0.04 -1.26 -4.97 135.00 130.94 1j7h s PRO 105 Ca -0.06 0.34 -0.15 0.00 0.04 0.00 0.00 61.00 61.16 1j7h s PRO 105 Cb 0.00 -2.28 0.01 0.00 0.04 0.00 0.00 34.50 32.27 1j7h s PRO 105 CO 0.17 -0.36 0.82 0.00 0.04 0.00 0.00 177.00 177.67 1j7h n ALA 106 N -2.43 -0.83 -2.56 8.56 0.00 0.16 -4.61 120.51 118.79 1j7h n ALA 106 Ca 0.02 -0.27 -0.29 0.00 0.00 0.00 0.00 53.44 52.90 1j7h n ALA 106 Cb 0.55 -2.03 -0.10 0.00 0.00 0.00 0.00 19.45 17.87 1j7h n ALA 106 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1j7h s ARG 107 N -3.31 2.05 -0.42 0.00 1.81 -1.25 0.62 118.95 118.44 1j7h s ARG 107 Ca 0.69 -1.08 0.08 0.00 -1.72 0.00 0.00 55.73 53.70 1j7h s ARG 107 Cb -0.32 -2.25 0.36 0.00 -0.45 0.00 0.00 34.95 32.28 1j7h s ARG 107 CO 0.54 0.49 1.26 0.43 -0.68 0.00 0.00 175.30 177.35 1j7h n SER 108 N 0.65 -2.08 -4.83 0.23 7.64 -0.42 -4.90 113.62 109.92 1j7h n SER 108 Ca -0.14 -2.95 -0.32 0.00 1.01 0.00 0.00 58.87 56.47 1j7h n SER 108 Cb 0.53 1.38 -0.06 0.00 -1.01 0.00 0.00 64.21 65.05 1j7h n SER 108 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1j7h s VAL 110 N -1.29 0.06 -0.85 0.00 -7.23 -1.04 -4.93 120.40 105.12 1j7h s VAL 110 Ca 0.26 -0.50 -0.25 0.00 -1.81 0.00 0.00 61.98 59.68 1j7h s VAL 110 Cb -0.12 -1.02 0.03 0.00 0.56 0.00 0.00 36.38 35.83 1j7h s VAL 110 CO 0.18 -0.27 1.47 -0.70 -0.31 0.00 0.00 175.10 175.46 1j7h s GLU 111 N -2.85 3.22 0.34 4.82 2.12 -1.26 -0.88 118.70 124.22 1j7h s GLU 111 Ca -0.03 -0.48 -0.19 0.00 0.36 0.00 0.00 54.97 54.63 1j7h s GLU 111 Cb -0.00 -4.72 -0.10 0.00 0.26 0.00 0.00 34.13 29.57 1j7h s GLU 111 CO -0.05 -2.35 0.83 0.14 -0.54 0.00 0.00 175.26 173.29 1j7h s VAL 112 N 6.21 4.51 0.14 3.70 -7.23 0.28 -4.95 120.40 123.07 1j7h s VAL 112 Ca 0.46 1.28 -0.17 0.00 -1.81 0.00 0.00 61.98 61.74 1j7h s VAL 112 Cb -0.05 -3.69 -0.01 0.00 0.56 0.00 0.00 36.38 33.18 1j7h s VAL 112 CO 0.05 -0.13 1.78 0.00 -0.31 0.00 0.00 175.10 176.49 1j7h h ALA 113 N 2.44 0.45 -2.91 1.32 0.00 -1.93 -3.38 119.26 115.24 1j7h h ALA 113 Ca -0.48 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.36 1j7h h ALA 113 Cb 1.18 -0.14 -0.07 0.00 0.00 0.00 0.00 17.79 18.76 1j7h h ALA 113 CO 0.64 -0.06 0.03 1.03 0.00 0.00 0.00 179.25 180.89 1j7h s ARG 114 N -6.04 1.72 0.07 0.00 0.52 -1.26 -4.98 118.95 108.98 1j7h s ARG 114 Ca -0.13 -1.21 -0.05 0.00 -0.52 0.00 0.00 55.73 53.82 1j7h s ARG 114 Cb 0.10 0.53 -0.02 0.00 0.52 0.00 0.00 34.95 36.08 1j7h s ARG 114 CO 0.72 -0.75 0.08 -0.51 0.02 0.00 0.00 175.30 174.86 1j7h s LEU 115 N -3.00 1.97 0.20 2.53 1.43 -1.24 -5.05 118.68 115.52 1j7h s LEU 115 Ca 0.18 -0.84 -0.31 0.00 -1.03 0.00 0.00 54.13 52.13 1j7h s LEU 115 Cb -0.03 0.60 -0.16 0.00 0.03 0.00 0.00 46.19 46.63 1j7h s LEU 115 CO 0.09 -0.66 0.99 -2.65 0.23 0.00 0.00 176.35 174.35 1j7h n PRO 116 N 0.02 0.92 -1.24 1.29 -0.02 -1.26 -0.55 135.00 134.16 1j7h n PRO 116 Ca -0.14 0.33 -0.08 0.00 -2.02 0.00 0.00 63.50 61.58 1j7h n PRO 116 Cb 0.62 -1.69 -0.04 0.00 -0.02 0.00 0.00 33.50 32.37 1j7h n PRO 116 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 1j7h n LYS 117 N 1.31 -0.80 -1.40 -0.52 4.01 -1.26 -2.51 118.16 116.99 1j7h n LYS 117 Ca 0.14 0.74 -0.14 0.00 -0.51 0.00 0.00 58.31 58.55 1j7h n LYS 117 Cb 0.26 -4.65 -0.06 0.00 -0.51 0.00 0.00 35.03 30.06 1j7h n LYS 117 CO 0.00 0.00 0.00 -0.25 -1.11 0.00 0.00 177.40 176.04 1j7h n ASP 118 N 0.11 -5.44 -4.72 4.39 8.00 0.29 -4.89 116.55 114.29 1j7h n ASP 118 Ca -0.08 0.34 -0.34 0.00 0.71 0.00 0.00 54.79 55.42 1j7h n ASP 118 Cb 0.33 -4.15 0.09 0.00 -0.02 0.00 0.00 41.12 37.37 1j7h n ASP 118 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 1j7h s VAL 119 N -2.25 2.40 -0.38 2.53 -7.23 -1.04 -4.80 120.40 109.64 1j7h s VAL 119 Ca 0.00 0.19 0.07 0.00 -1.81 0.00 0.00 61.98 60.44 1j7h s VAL 119 Cb 0.00 -2.73 0.72 0.00 0.56 0.00 0.00 36.38 34.93 1j7h s VAL 119 CO 0.00 -0.11 1.85 0.61 -0.31 0.00 0.00 175.10 177.14 1j7h n GLY 120 N 0.27 3.95 3.64 2.32 0.00 -1.26 -3.67 105.19 110.44 1j7h n GLY 120 Ca 0.13 -1.02 -0.02 0.00 0.00 0.00 0.00 46.02 45.10 1j7h n GLY 120 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1j7h s LEU 121 N -3.09 -0.03 -0.05 0.99 1.43 -1.26 -2.77 118.68 113.91 1j7h s LEU 121 Ca 0.56 0.01 -0.19 0.00 -1.03 0.00 0.00 54.13 53.48 1j7h s LEU 121 Cb 0.45 1.09 0.04 0.00 0.03 0.00 0.00 46.19 47.80 1j7h s LEU 121 CO 0.13 -0.05 0.42 -0.70 0.23 0.00 0.00 176.35 176.38 1j7h s GLU 122 N -1.88 0.74 0.06 1.70 2.12 -0.75 -4.47 118.70 116.22 1j7h s GLU 122 Ca 0.11 0.05 0.08 0.00 0.36 0.00 0.00 54.97 55.57 1j7h s GLU 122 Cb -0.01 0.34 -0.03 0.00 0.26 0.00 0.00 34.13 34.69 1j7h s GLU 122 CO -0.04 -0.20 -0.23 0.42 -0.54 0.00 0.00 175.26 174.68 1j7h s ILE 123 N -1.03 1.87 -0.30 -3.70 -1.09 -1.10 -2.30 121.20 113.54 1j7h s ILE 123 Ca -0.11 -1.37 -0.06 0.00 -2.23 0.00 0.00 60.65 56.88 1j7h s ILE 123 Cb -0.04 -1.63 0.19 0.00 -1.58 0.00 0.00 42.46 39.40 1j7h s ILE 123 CO 0.05 0.19 0.92 -1.83 -1.23 0.00 0.00 174.94 173.05 1j7h s GLU 124 N -1.41 0.26 0.32 2.79 -1.05 -0.68 0.12 118.70 119.05 1j7h s GLU 124 Ca 0.09 0.24 0.07 0.00 -0.15 0.00 0.00 54.97 55.22 1j7h s GLU 124 Cb -0.09 0.11 -0.06 0.00 -0.44 0.00 0.00 34.13 33.64 1j7h s GLU 124 CO 0.03 -0.48 -0.03 0.00 0.95 0.00 0.00 175.26 175.73 1j7h s ALA 125 N 2.89 2.62 0.17 -0.84 0.00 -1.26 -1.10 121.76 124.24 1j7h s ALA 125 Ca 0.23 -2.05 0.09 0.00 0.00 0.00 0.00 51.96 50.23 1j7h s ALA 125 Cb -0.04 0.23 -0.04 0.00 0.00 0.00 0.00 23.12 23.27 1j7h s ALA 125 CO -0.23 -0.10 -0.10 0.42 0.00 0.00 0.00 175.76 175.75 1j7h s ILE 126 N -2.94 3.17 0.02 0.00 -1.09 -0.38 -1.27 121.20 118.71 1j7h s ILE 126 Ca 0.32 -1.64 -0.02 0.00 -2.23 0.00 0.00 60.65 57.09 1j7h s ILE 126 Cb 0.06 -2.56 -0.02 0.00 -1.58 0.00 0.00 42.46 38.36 1j7h s ILE 126 CO 0.15 -0.09 0.01 0.00 -1.23 0.00 0.00 174.94 173.77 1j7h s ALA 127 N -1.66 0.07 0.55 9.38 0.00 -0.56 -1.84 121.76 127.70 1j7h s ALA 127 Ca 0.24 -0.58 0.07 0.00 0.00 0.00 0.00 51.96 51.69 1j7h s ALA 127 Cb -0.09 0.17 0.07 0.00 0.00 0.00 0.00 23.12 23.26 1j7h s ALA 127 CO 0.15 -0.20 0.55 1.33 0.00 0.00 0.00 175.76 177.59 1j7h n VAL 128 N 1.34 0.00 -2.68 0.00 0.24 -1.16 0.13 118.33 116.20 1j7h n VAL 128 Ca -0.22 -2.02 -0.05 0.00 -2.04 0.00 0.00 64.34 60.00 1j7h n VAL 128 Cb 0.56 -0.24 0.09 0.00 -1.47 0.00 0.00 33.84 32.79 1j7h n VAL 128 CO 0.00 0.00 0.00 -1.14 -2.14 0.00 0.00 176.83 173.55 1j7h n ARG 129 N -1.94 1.00 0.00 7.34 0.00 0.91 -4.74 116.66 119.23 1j7h n ARG 129 Ca 0.05 -1.46 0.00 0.00 -0.00 0.00 0.00 57.85 56.44 1j7h n ARG 129 Cb 0.60 0.04 0.00 0.00 0.00 0.00 0.00 32.46 33.10 1j7h n ARG 129 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.63 178.80