#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1jaz s PRO 2 N 0.00 3.92 -0.25 3.23 0.02 -1.26 -4.62 135.00 136.05 1jaz s PRO 2 Ca 0.00 2.28 -0.22 0.00 0.02 0.00 0.00 61.00 63.08 1jaz s PRO 2 Cb 0.00 -2.77 -0.01 0.00 0.02 0.00 0.00 34.50 31.74 1jaz s PRO 2 CO 0.00 -0.58 0.73 -0.80 -0.33 0.00 0.00 177.00 176.02 1jaz s ASN 3 N -0.59 6.70 -0.05 2.53 -0.87 -1.26 -0.40 114.94 121.01 1jaz s ASN 3 Ca 0.57 0.86 0.04 0.00 -1.57 0.00 0.00 52.86 52.77 1jaz s ASN 3 Cb -0.41 -2.38 -0.00 0.00 -0.02 0.00 0.00 41.25 38.43 1jaz s ASN 3 CO 0.53 -0.44 -0.18 -0.63 -2.57 0.00 0.00 177.10 173.81 1jaz s ILE 4 N 2.67 1.50 -0.19 0.60 -1.09 -0.45 0.27 121.20 124.51 1jaz s ILE 4 Ca 0.30 -0.75 -0.06 0.00 -2.23 0.00 0.00 60.65 57.91 1jaz s ILE 4 Cb -0.15 -1.29 -0.03 0.00 -1.58 0.00 0.00 42.46 39.41 1jaz s ILE 4 CO 0.08 0.43 0.02 -0.89 -1.23 0.00 0.00 174.94 173.35 1jaz s THR 5 N 0.04 4.26 -0.30 2.92 2.01 -0.31 -2.29 115.64 121.98 1jaz s THR 5 Ca -0.04 -0.21 -0.13 0.00 0.31 0.00 0.00 61.69 61.61 1jaz s THR 5 Cb -0.12 -2.92 -0.03 0.00 0.01 0.00 0.00 72.50 69.43 1jaz s THR 5 CO 0.03 0.44 0.29 -0.63 -0.69 0.00 0.00 174.62 174.05 1jaz s ILE 6 N 0.75 5.24 -0.34 1.82 1.01 0.50 -0.63 121.20 129.54 1jaz s ILE 6 Ca 0.01 0.18 -0.11 0.00 0.00 0.00 0.00 60.65 60.74 1jaz s ILE 6 Cb -0.14 -3.67 0.01 0.00 0.01 0.00 0.00 42.46 38.66 1jaz s ILE 6 CO 0.02 0.10 0.19 -0.76 0.00 0.00 0.00 174.94 174.49 1jaz s LEU 7 N 1.90 4.44 -0.07 2.97 1.43 0.18 -1.56 118.68 127.97 1jaz s LEU 7 Ca 0.10 -0.70 -0.13 0.00 -1.03 0.00 0.00 54.13 52.38 1jaz s LEU 7 Cb -0.16 -2.04 -0.05 0.00 0.03 0.00 0.00 46.19 43.97 1jaz s LEU 7 CO 0.11 -0.28 0.32 0.00 0.23 0.00 0.00 176.35 176.73 1jaz s ALA 8 N 1.61 3.71 -1.04 4.21 0.00 -0.50 -1.94 121.76 127.81 1jaz s ALA 8 Ca 0.04 -0.37 0.09 0.00 0.00 0.00 0.00 51.96 51.71 1jaz s ALA 8 Cb -0.18 -2.30 0.09 0.00 0.00 0.00 0.00 23.12 20.73 1jaz s ALA 8 CO 0.07 0.40 0.81 0.25 0.00 0.00 0.00 175.76 177.30 1jaz n THR 9 N 2.35 0.10 -0.34 0.00 -2.24 -0.77 -0.62 114.28 112.76 1jaz n THR 9 Ca -0.15 -0.55 0.00 0.00 -2.27 0.00 0.00 64.05 61.08 1jaz n THR 9 Cb 0.53 1.11 0.00 0.00 -2.10 0.00 0.00 70.33 69.87 1jaz n THR 9 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1jaz n GLY 10 N 0.46 4.10 3.88 3.38 0.00 -1.23 -0.97 105.19 114.81 1jaz n GLY 10 Ca 0.05 -0.41 -0.29 0.00 0.00 0.00 0.00 46.02 45.37 1jaz n GLY 10 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1jaz s GLY 11 N 0.00 1.60 0.71 -0.02 0.00 -1.26 -4.83 107.32 103.53 1jaz s GLY 11 Ca 0.00 -0.54 -0.11 0.00 0.00 0.00 0.00 44.72 44.07 1jaz s GLY 11 CO 0.00 -0.07 1.07 -1.08 0.00 0.00 0.00 173.10 173.02 1jaz s THR 12 N -3.47 3.76 -1.05 0.90 -1.32 -1.26 -4.91 115.64 108.30 1jaz s THR 12 Ca 0.61 0.57 0.09 0.00 -1.21 0.00 0.00 61.69 61.75 1jaz s THR 12 Cb -0.12 -3.41 0.11 0.00 -1.51 0.00 0.00 72.50 67.57 1jaz s THR 12 CO 0.50 -0.75 0.87 2.30 -2.21 0.00 0.00 174.62 175.34 1jaz n ILE 13 N -3.13 0.21 -3.71 5.08 -5.35 -1.26 -4.78 119.36 106.42 1jaz n ILE 13 Ca 0.07 -0.60 -0.14 0.00 -0.27 0.00 0.00 62.75 61.81 1jaz n ILE 13 Cb 0.55 1.04 -0.14 0.00 -1.74 0.00 0.00 39.64 39.36 1jaz n ILE 13 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1jaz s ALA 14 N -0.80 -0.41 0.00 -1.28 0.00 -1.26 -3.64 121.76 114.36 1jaz s ALA 14 Ca 0.12 0.83 0.00 0.00 0.00 0.00 0.00 51.96 52.91 1jaz s ALA 14 Cb 0.08 -0.68 0.00 0.00 0.00 0.00 0.00 23.12 22.52 1jaz s ALA 14 CO 0.12 -0.32 0.00 0.41 0.00 0.00 0.00 175.76 175.96 1jaz n GLY 15 N 4.59 -0.58 3.75 0.00 0.00 -1.26 -4.83 105.19 106.87 1jaz n GLY 15 Ca -0.19 -2.22 -0.41 0.00 0.00 0.00 0.00 46.02 43.20 1jaz n GLY 15 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1jaz s ASN 37 N -3.54 6.34 0.05 1.61 0.01 -1.26 -4.22 114.94 113.93 1jaz s ASN 37 Ca 0.00 2.98 0.26 0.00 -0.71 0.00 0.00 52.86 55.39 1jaz s ASN 37 Cb 0.00 -2.64 0.77 0.00 0.41 0.00 0.00 41.25 39.79 1jaz s ASN 37 CO 0.00 -0.94 1.62 0.00 -1.51 0.00 0.00 177.10 176.28 1jaz n ALA 38 N 2.19 2.86 -3.19 0.60 0.00 -1.26 -4.02 120.51 117.69 1jaz n ALA 38 Ca 0.08 -0.21 -0.22 0.00 0.00 0.00 0.00 53.44 53.10 1jaz n ALA 38 Cb 0.37 -1.29 -0.05 0.00 0.00 0.00 0.00 19.45 18.47 1jaz n ALA 38 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 177.50 179.05 1jaz n VAL 39 N -1.70 -0.21 -0.24 0.00 3.14 -1.26 -4.94 118.33 113.13 1jaz n VAL 39 Ca 0.06 -4.35 0.24 0.00 -2.96 0.00 0.00 64.34 57.33 1jaz n VAL 39 Cb 0.37 -1.28 0.60 0.00 -1.06 0.00 0.00 33.84 32.47 1jaz n VAL 39 CO 0.00 0.00 0.00 -0.65 -6.46 0.00 0.00 176.83 169.72 1jaz h PRO 40 N 3.58 0.22 0.00 1.45 0.11 -2.02 -0.18 132.00 135.17 1jaz h PRO 40 Ca 0.09 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.19 1jaz h PRO 40 Cb 0.89 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 31.95 1jaz h PRO 40 CO 0.51 0.15 0.18 1.04 -0.21 0.00 0.00 178.00 179.67 1jaz n GLN 41 N -4.42 0.01 0.12 1.05 6.02 -1.26 -0.88 117.38 118.02 1jaz n GLN 41 Ca 0.20 0.35 0.00 0.00 -0.01 0.00 0.00 57.00 57.55 1jaz n GLN 41 Cb 0.86 -1.71 0.30 0.00 1.02 0.00 0.00 30.24 30.70 1jaz n GLN 41 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 177.06 175.98 1jaz h LEU 42 N 0.00 0.18 -2.26 1.08 3.38 -1.41 -2.91 115.31 113.37 1jaz h LEU 42 Ca 0.00 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.91 1jaz h LEU 42 Cb 0.36 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 41.06 1jaz h LEU 42 CO 0.00 0.50 0.01 0.11 0.09 0.00 0.00 178.44 179.15 1jaz h LYS 43 N 0.16 0.00 0.00 1.13 1.57 -1.21 -1.17 116.57 117.05 1jaz h LYS 43 Ca 0.02 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.80 1jaz h LYS 43 Cb 0.66 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.97 1jaz h LYS 43 CO 0.05 0.00 0.00 -0.44 -0.57 0.00 0.00 179.45 178.49 1jaz h ASP 44 N 0.00 0.00 0.00 0.86 3.32 -1.70 -3.35 116.42 115.55 1jaz h ASP 44 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1jaz h ASP 44 Cb 0.02 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.57 1jaz h ASP 44 CO -0.00 0.00 -0.85 2.30 -1.72 0.00 0.00 179.24 178.97 1jaz n ILE 45 N -2.53 0.00 -3.47 0.35 -5.35 -0.51 -5.10 119.36 102.74 1jaz n ILE 45 Ca 0.02 0.00 -0.13 0.00 -0.27 0.00 0.00 62.75 62.37 1jaz n ILE 45 Cb 0.28 0.33 -0.03 0.00 -1.74 0.00 0.00 39.64 38.48 1jaz n ILE 45 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1jaz s ALA 46 N -1.71 -1.71 -0.39 -1.28 0.00 -0.81 -4.43 121.76 111.42 1jaz s ALA 46 Ca 0.00 0.89 -0.24 0.00 0.00 0.00 0.00 51.96 52.61 1jaz s ALA 46 Cb 0.00 0.45 0.02 0.00 0.00 0.00 0.00 23.12 23.58 1jaz s ALA 46 CO 0.00 -0.62 0.84 -0.80 0.00 0.00 0.00 175.76 175.19 1jaz s ASN 47 N -2.18 6.55 -0.12 0.00 0.01 0.47 -4.36 114.94 115.31 1jaz s ASN 47 Ca -0.01 0.30 -0.02 0.00 -0.71 0.00 0.00 52.86 52.42 1jaz s ASN 47 Cb -0.01 -2.42 -0.03 0.00 0.41 0.00 0.00 41.25 39.20 1jaz s ASN 47 CO -0.05 -0.85 -0.05 -0.69 -1.51 0.00 0.00 177.10 173.95 1jaz s VAL 48 N 3.34 3.78 0.10 1.60 1.01 -1.26 -1.34 120.40 127.63 1jaz s VAL 48 Ca 0.34 -0.42 0.04 0.00 0.00 0.00 0.00 61.98 61.94 1jaz s VAL 48 Cb -0.12 -2.61 -0.04 0.00 0.00 0.00 0.00 36.38 33.61 1jaz s VAL 48 CO 0.20 0.54 -0.10 -1.59 0.00 0.00 0.00 175.10 174.15 1jaz s LYS 49 N -0.11 0.88 0.04 2.72 -2.85 -0.97 -5.01 119.74 114.44 1jaz s LYS 49 Ca 0.02 -1.21 0.00 0.00 -1.00 0.00 0.00 55.97 53.78 1jaz s LYS 49 Cb -0.13 -0.52 -0.03 0.00 -2.06 0.00 0.00 37.83 35.09 1jaz s LYS 49 CO 0.03 0.07 -0.04 0.20 0.10 0.00 0.00 175.35 175.70 1jaz s GLY 50 N -2.59 0.43 -0.05 0.59 0.00 -1.26 -0.37 107.32 104.07 1jaz s GLY 50 Ca 0.08 -0.90 -0.03 0.00 0.00 0.00 0.00 44.72 43.87 1jaz s GLY 50 CO -0.00 -0.98 0.11 -0.54 0.00 0.00 0.00 173.10 171.69 1jaz s GLU 51 N -2.47 0.08 -0.43 2.90 2.02 -0.60 -4.94 118.70 115.26 1jaz s GLU 51 Ca -0.05 0.25 -0.25 0.00 0.02 0.00 0.00 54.97 54.94 1jaz s GLU 51 Cb -0.03 -0.10 0.02 0.00 0.10 0.00 0.00 34.13 34.12 1jaz s GLU 51 CO -0.04 -0.11 0.91 -1.14 0.02 0.00 0.00 175.26 174.91 1jaz s GLN 52 N 0.73 3.64 -0.06 1.61 2.00 -1.26 -1.41 119.66 124.92 1jaz s GLN 52 Ca -0.06 0.29 -0.04 0.00 -2.00 0.00 0.00 55.36 53.55 1jaz s GLN 52 Cb -0.08 -3.88 -0.27 0.00 0.80 0.00 0.00 33.01 29.58 1jaz s GLN 52 CO -0.03 -1.11 0.62 0.28 -0.50 0.00 0.00 175.29 174.55 1jaz h VAL 53 N 5.98 0.88 -3.32 1.34 2.07 -1.22 -3.47 116.25 118.51 1jaz h VAL 53 Ca -0.24 -2.56 -0.08 0.00 0.82 0.00 0.00 66.70 64.64 1jaz h VAL 53 Cb 1.08 2.63 -0.03 0.00 -1.52 0.00 0.00 31.29 33.45 1jaz h VAL 53 CO 1.00 0.81 0.13 0.68 0.02 0.00 0.00 177.57 180.22 1jaz s VAL 54 N -2.59 0.00 -0.25 2.57 -7.23 -1.19 -5.04 120.40 106.67 1jaz s VAL 54 Ca -0.15 -1.18 -0.02 0.00 -1.81 0.00 0.00 61.98 58.83 1jaz s VAL 54 Cb 0.07 -2.71 0.11 0.00 0.56 0.00 0.00 36.38 34.41 1jaz s VAL 54 CO 0.82 0.00 0.25 0.21 -0.31 0.00 0.00 175.10 176.07 1jaz s ASN 55 N -3.10 1.66 0.17 4.85 3.84 -1.24 -3.58 114.94 117.55 1jaz s ASN 55 Ca 0.19 -0.53 -0.16 0.00 0.21 0.00 0.00 52.86 52.57 1jaz s ASN 55 Cb -0.04 0.40 0.03 0.00 -0.55 0.00 0.00 41.25 41.09 1jaz s ASN 55 CO 0.13 -0.36 0.46 0.27 -2.79 0.00 0.00 177.10 174.80 1jaz s ILE 56 N 2.33 0.04 0.18 -5.21 -4.36 -0.14 -4.93 121.20 109.12 1jaz s ILE 56 Ca 0.08 -0.79 -0.30 0.00 -0.26 0.00 0.00 60.65 59.39 1jaz s ILE 56 Cb -0.15 -1.48 -0.08 0.00 1.25 0.00 0.00 42.46 42.00 1jaz s ILE 56 CO -0.24 -0.20 0.98 -0.83 0.24 0.00 0.00 174.94 174.90 1jaz s GLY 57 N -2.86 3.03 0.67 6.27 0.00 -1.26 -4.28 107.32 108.88 1jaz s GLY 57 Ca 0.08 0.65 0.45 0.00 0.00 0.00 0.00 44.72 45.90 1jaz s GLY 57 CO -0.05 1.39 2.38 1.48 0.00 0.00 0.00 173.10 178.29 1jaz h SER 58 N 4.86 0.00 0.90 1.64 4.64 -1.91 -0.32 113.55 123.36 1jaz h SER 58 Ca -0.44 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.88 1jaz h SER 58 Cb 1.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 1jaz h SER 58 CO 0.70 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 176.66 1jaz n GLN 59 N -3.09 0.19 -0.45 4.77 0.00 -1.26 -1.62 117.38 115.91 1jaz n GLN 59 Ca -0.03 0.34 0.08 0.00 0.00 0.00 0.00 57.00 57.40 1jaz n GLN 59 Cb 0.07 -1.81 0.28 0.00 0.00 0.00 0.00 30.24 28.79 1jaz n GLN 59 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.06 176.81 1jaz n ASP 60 N -2.15 4.07 -4.54 2.61 8.00 -0.13 -5.02 116.55 119.40 1jaz n ASP 60 Ca 0.03 -2.41 -0.39 0.00 0.71 0.00 0.00 54.79 52.74 1jaz n ASP 60 Cb 0.28 -0.48 0.04 0.00 -0.02 0.00 0.00 41.12 40.94 1jaz n ASP 60 CO 0.00 0.00 0.00 0.80 -0.39 0.00 0.00 177.20 177.61 1jaz n MET 61 N 0.69 0.77 -3.97 -1.24 0.00 -0.64 -4.97 117.12 107.76 1jaz n MET 61 Ca 0.21 0.29 -0.11 0.00 -0.00 0.00 0.00 57.70 58.10 1jaz n MET 61 Cb 0.75 -1.89 -0.03 0.00 0.00 0.00 0.00 33.22 32.05 1jaz n MET 61 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 175.97 176.51 1jaz s ASN 62 N -1.11 0.28 0.25 6.12 2.20 -1.26 -5.05 114.94 116.36 1jaz s ASN 62 Ca 0.70 -1.16 -0.06 0.00 -0.94 0.00 0.00 52.86 51.40 1jaz s ASN 62 Cb -0.47 0.69 0.28 0.00 -2.00 0.00 0.00 41.25 39.75 1jaz s ASN 62 CO 0.53 -1.35 1.91 0.44 -2.94 0.00 0.00 177.10 175.68 1jaz h ASP 63 N 2.12 1.07 -0.05 3.54 3.32 -2.00 -2.64 116.42 121.78 1jaz h ASP 63 Ca -0.28 -0.02 0.00 0.00 0.02 0.00 0.00 57.03 56.76 1jaz h ASP 63 Cb 1.25 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 40.54 1jaz h ASP 63 CO 0.37 0.75 0.02 0.78 -1.72 0.00 0.00 179.24 179.44 1jaz h ASN 64 N 1.25 0.02 -0.89 6.45 -0.26 -1.97 -0.34 115.58 119.84 1jaz h ASN 64 Ca 0.37 0.00 0.08 0.00 -0.56 0.00 0.00 56.30 56.19 1jaz h ASN 64 Cb -0.06 0.00 -0.07 0.00 -1.06 0.00 0.00 38.32 37.13 1jaz h ASN 64 CO -0.10 0.02 0.55 0.58 -1.06 0.00 0.00 177.43 177.42 1jaz h VAL 65 N 0.05 1.00 -0.12 2.81 2.07 -1.93 -0.48 116.25 119.65 1jaz h VAL 65 Ca 0.02 -0.33 -0.01 0.00 0.82 0.00 0.00 66.70 67.20 1jaz h VAL 65 Cb 0.01 -0.05 -0.01 0.00 -1.52 0.00 0.00 31.29 29.72 1jaz h VAL 65 CO -0.02 0.18 0.04 -0.50 0.02 0.00 0.00 177.57 177.28 1jaz h TRP 66 N 0.96 0.20 -0.40 1.57 6.55 -1.05 -0.43 115.95 123.35 1jaz h TRP 66 Ca 0.41 -0.02 0.03 0.00 0.95 0.00 0.00 58.89 60.26 1jaz h TRP 66 Cb 0.26 -0.06 -0.03 0.00 -0.86 0.00 0.00 29.16 28.47 1jaz h TRP 66 CO -0.03 0.33 0.21 -0.07 -1.05 0.00 0.00 178.44 177.82 1jaz h LEU 67 N 0.01 0.30 -0.75 -4.49 3.38 -0.68 -1.17 115.31 111.91 1jaz h LEU 67 Ca 0.04 0.02 -0.12 0.00 0.09 0.00 0.00 57.88 57.90 1jaz h LEU 67 Cb 0.22 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 40.92 1jaz h LEU 67 CO -0.00 0.22 -0.37 0.71 0.09 0.00 0.00 178.44 179.09 1jaz h THR 68 N 0.42 1.29 0.02 0.22 1.35 -0.79 -0.29 112.91 115.13 1jaz h THR 68 Ca 0.17 -1.50 -0.00 0.00 -0.55 0.00 0.00 66.41 64.53 1jaz h THR 68 Cb 0.07 1.52 0.00 0.00 -1.73 0.00 0.00 68.15 68.01 1jaz h THR 68 CO -0.11 0.47 -0.01 -0.07 -0.25 0.00 0.00 175.52 175.55 1jaz h LEU 69 N 0.43 -0.03 -0.30 3.87 3.38 -0.81 -0.99 115.31 120.87 1jaz h LEU 69 Ca 0.04 -0.28 0.02 0.00 0.09 0.00 0.00 57.88 57.75 1jaz h LEU 69 Cb 0.85 0.01 -0.03 0.00 0.09 0.00 0.00 40.66 41.58 1jaz h LEU 69 CO 0.07 0.27 0.14 0.00 0.09 0.00 0.00 178.44 179.01 1jaz h ALA 70 N 0.64 0.36 -0.71 1.53 0.00 -1.00 -1.80 119.26 118.29 1jaz h ALA 70 Ca -0.00 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 1jaz h ALA 70 Cb 0.31 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.03 1jaz h ALA 70 CO 0.01 -0.25 0.41 0.87 0.00 0.00 0.00 179.25 180.29 1jaz h LYS 71 N 0.30 0.96 -0.03 0.00 1.57 -0.89 -1.40 116.57 117.09 1jaz h LYS 71 Ca 0.13 -0.09 -0.00 0.00 -1.87 0.00 0.00 60.65 58.81 1jaz h LYS 71 Cb 0.06 -0.20 -0.00 0.00 0.08 0.00 0.00 32.23 32.16 1jaz h LYS 71 CO -0.10 0.69 0.01 -0.22 -0.57 0.00 0.00 179.45 179.26 1jaz h LYS 72 N 0.98 0.04 -0.33 3.15 1.63 -0.70 0.54 116.57 121.88 1jaz h LYS 72 Ca 0.25 -0.01 0.02 0.00 -0.85 0.00 0.00 60.65 60.06 1jaz h LYS 72 Cb -0.01 -0.01 -0.03 0.00 -0.60 0.00 0.00 32.23 31.58 1jaz h LYS 72 CO -0.05 0.26 0.17 0.82 -3.45 0.00 0.00 179.45 177.21 1jaz h ILE 73 N -0.18 1.00 -0.53 2.00 2.04 -1.14 0.22 117.51 120.92 1jaz h ILE 73 Ca 0.01 -0.12 -0.09 0.00 1.00 0.00 0.00 64.86 65.66 1jaz h ILE 73 Cb 0.24 0.61 -0.02 0.00 -0.74 0.00 0.00 36.82 36.91 1jaz h ILE 73 CO 0.00 0.07 -0.01 0.78 0.00 0.00 0.00 178.15 178.98 1jaz h ASN 74 N 0.36 0.88 -0.49 1.72 2.35 -1.10 -0.23 115.58 119.06 1jaz h ASN 74 Ca 0.14 -0.24 -0.12 0.00 -0.55 0.00 0.00 56.30 55.53 1jaz h ASN 74 Cb 0.04 -0.24 -0.02 0.00 0.05 0.00 0.00 38.32 38.16 1jaz h ASN 74 CO -0.09 0.95 -0.17 0.74 -1.65 0.00 0.00 177.43 177.21 1jaz h THR 75 N 0.84 1.27 -0.04 2.81 2.02 -0.68 -3.26 112.91 115.86 1jaz h THR 75 Ca 0.15 -1.33 0.00 0.00 0.77 0.00 0.00 66.41 66.00 1jaz h THR 75 Cb 0.52 1.06 0.00 0.00 -1.74 0.00 0.00 68.15 67.99 1jaz h THR 75 CO 0.03 0.46 0.00 0.47 0.37 0.00 0.00 175.52 176.85 1jaz n ASP 76 N -4.12 2.16 -0.35 4.18 9.92 0.74 -4.54 116.55 124.55 1jaz n ASP 76 Ca 0.01 -1.72 0.22 0.00 -0.53 0.00 0.00 54.79 52.77 1jaz n ASP 76 Cb 0.43 -0.02 0.47 0.00 -0.64 0.00 0.00 41.12 41.37 1jaz n ASP 76 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1jaz n ASP 78 N -4.82 2.78 -0.01 0.00 8.00 -1.26 -3.80 116.55 117.44 1jaz n ASP 78 Ca 0.29 -2.14 0.10 0.00 0.71 0.00 0.00 54.79 53.75 1jaz n ASP 78 Cb 0.91 -0.38 -0.14 0.00 -0.02 0.00 0.00 41.12 41.49 1jaz n ASP 78 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1jaz n LYS 79 N 0.72 0.58 -4.28 -1.24 5.02 -0.26 -5.03 118.16 113.67 1jaz n LYS 79 Ca 0.16 -0.10 -0.17 0.00 -2.02 0.00 0.00 58.31 56.17 1jaz n LYS 79 Cb 0.49 -1.45 -0.09 0.00 -0.02 0.00 0.00 35.03 33.96 1jaz n LYS 79 CO 0.00 0.00 0.00 -0.08 -0.52 0.00 0.00 177.40 176.80 1jaz s THR 80 N -3.15 0.08 -0.13 -0.18 -1.32 -1.25 -5.06 115.64 104.63 1jaz s THR 80 Ca -0.01 -2.00 0.22 0.00 -1.21 0.00 0.00 61.69 58.69 1jaz s THR 80 Cb 0.14 -2.50 -0.18 0.00 -1.51 0.00 0.00 72.50 68.45 1jaz s THR 80 CO 0.82 0.00 0.73 0.47 -2.21 0.00 0.00 174.62 174.43 1jaz n ASP 81 N -1.06 0.43 -3.61 8.08 8.00 0.14 -4.98 116.55 123.55 1jaz n ASP 81 Ca 0.04 0.17 -0.02 0.00 0.71 0.00 0.00 54.79 55.69 1jaz n ASP 81 Cb 0.64 1.14 -0.01 0.00 -0.02 0.00 0.00 41.12 42.87 1jaz n ASP 81 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 1jaz s GLY 82 N -4.52 -0.34 0.03 0.44 0.00 -1.03 -4.42 107.32 97.48 1jaz s GLY 82 Ca -0.05 1.24 0.09 0.00 0.00 0.00 0.00 44.72 46.00 1jaz s GLY 82 CO 0.85 0.36 -0.26 -1.36 0.00 0.00 0.00 173.10 172.69 1jaz s PHE 83 N -2.40 2.32 -0.08 1.90 0.40 -0.24 -1.16 117.98 118.71 1jaz s PHE 83 Ca 0.11 -0.42 0.05 0.00 -0.60 0.00 0.00 56.93 56.07 1jaz s PHE 83 Cb 0.01 -1.42 -0.01 0.00 0.51 0.00 0.00 43.02 42.12 1jaz s PHE 83 CO -0.04 0.08 -0.24 0.08 0.70 0.00 0.00 175.22 175.79 1jaz s VAL 84 N -0.75 2.11 -0.22 -0.44 1.01 0.20 -1.44 120.40 120.87 1jaz s VAL 84 Ca 0.11 -1.03 0.02 0.00 0.00 0.00 0.00 61.98 61.08 1jaz s VAL 84 Cb -0.10 -1.78 0.04 0.00 0.00 0.00 0.00 36.38 34.53 1jaz s VAL 84 CO 0.01 0.56 -0.16 -0.63 0.00 0.00 0.00 175.10 174.89 1jaz s ILE 85 N 0.07 2.12 -0.03 2.22 1.01 0.27 0.52 121.20 127.39 1jaz s ILE 85 Ca -0.11 -1.24 -0.25 0.00 0.00 0.00 0.00 60.65 59.06 1jaz s ILE 85 Cb -0.16 -2.05 -0.04 0.00 0.01 0.00 0.00 42.46 40.22 1jaz s ILE 85 CO 0.06 0.29 0.76 0.42 0.00 0.00 0.00 174.94 176.47 1jaz s THR 86 N 1.21 4.94 -0.09 2.92 -4.23 -0.82 -0.78 115.64 118.79 1jaz s THR 86 Ca -0.01 1.58 -0.21 0.00 -1.18 0.00 0.00 61.69 61.86 1jaz s THR 86 Cb -0.16 -4.10 0.05 0.00 1.34 0.00 0.00 72.50 69.63 1jaz s THR 86 CO -0.09 0.27 0.51 -2.28 -0.54 0.00 0.00 174.62 172.48 1jaz s HIS 87 N 0.60 -0.48 0.90 3.99 5.04 -0.58 -1.84 115.29 122.92 1jaz s HIS 87 Ca 0.40 0.96 -0.11 0.00 -1.54 0.00 0.00 55.06 54.77 1jaz s HIS 87 Cb -0.19 0.24 0.13 0.00 0.04 0.00 0.00 32.58 32.80 1jaz s HIS 87 CO 0.21 -0.42 1.11 0.20 -2.34 0.00 0.00 174.74 173.49 1jaz s GLY 88 N -0.72 1.66 0.23 1.59 0.00 -1.26 -4.07 107.32 104.74 1jaz s GLY 88 Ca -0.08 0.31 0.12 0.00 0.00 0.00 0.00 44.72 45.08 1jaz s GLY 88 CO 0.05 0.75 1.39 -0.91 0.00 0.00 0.00 173.10 174.38 1jaz h THR 89 N -1.69 1.14 -0.63 0.90 1.35 -1.95 -3.26 112.91 108.76 1jaz h THR 89 Ca -0.46 -2.60 0.13 0.00 -0.55 0.00 0.00 66.41 62.92 1jaz h THR 89 Cb 1.27 2.56 -0.10 0.00 -1.73 0.00 0.00 68.15 70.15 1jaz h THR 89 CO 0.47 0.65 0.08 -0.33 -0.25 0.00 0.00 175.52 176.14 1jaz h GLU 90 N 0.00 0.18 0.00 4.72 3.07 -1.92 -2.90 114.58 117.73 1jaz h GLU 90 Ca -0.01 -0.01 -0.05 0.00 -0.50 0.00 0.00 59.36 58.79 1jaz h GLU 90 Cb 1.51 -0.04 -0.10 0.00 -0.84 0.00 0.00 28.75 29.28 1jaz h GLU 90 CO 0.09 0.12 -0.56 0.25 -1.40 0.00 0.00 179.01 177.51 1jaz n THR 91 N -5.21 1.39 -0.22 1.13 -2.24 -1.26 -4.77 114.28 103.09 1jaz n THR 91 Ca 0.10 -2.22 0.09 0.00 -2.27 0.00 0.00 64.05 59.75 1jaz n THR 91 Cb 0.36 0.15 0.36 0.00 -2.10 0.00 0.00 70.33 69.10 1jaz n THR 91 CO 0.00 0.00 0.00 -0.03 -0.57 0.00 0.00 175.07 174.47 1jaz h MET 92 N 0.75 0.72 0.00 -0.78 4.05 -1.55 -0.99 114.93 117.14 1jaz h MET 92 Ca -0.06 -0.04 0.00 0.00 -0.28 0.00 0.00 59.70 59.32 1jaz h MET 92 Cb 1.27 -0.16 0.00 0.00 -0.80 0.00 0.00 31.60 31.91 1jaz h MET 92 CO 0.03 0.47 0.00 1.05 0.23 0.00 0.00 176.91 178.69 1jaz h GLU 93 N 0.74 0.00 0.00 0.39 4.11 -1.86 -1.66 114.58 116.30 1jaz h GLU 93 Ca 0.37 0.00 -0.08 0.00 0.07 0.00 0.00 59.36 59.72 1jaz h GLU 93 Cb 0.46 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.69 1jaz h GLU 93 CO -0.14 0.00 -0.47 0.93 0.07 0.00 0.00 179.01 179.40 1jaz h GLU 94 N 0.00 0.00 -0.82 1.06 5.08 -1.54 -3.25 114.58 115.11 1jaz h GLU 94 Ca 0.00 0.00 0.02 0.00 -1.00 0.00 0.00 59.36 58.38 1jaz h GLU 94 Cb 0.53 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.74 1jaz h GLU 94 CO 0.00 0.92 0.54 1.15 -1.00 0.00 0.00 179.01 180.62 1jaz h THR 95 N -1.00 1.17 -0.69 1.13 2.02 -1.48 -0.27 112.91 113.80 1jaz h THR 95 Ca -0.13 -0.37 -0.01 0.00 0.77 0.00 0.00 66.41 66.67 1jaz h THR 95 Cb 1.05 0.01 -0.03 0.00 -1.74 0.00 0.00 68.15 67.43 1jaz h THR 95 CO -0.08 0.20 0.37 0.00 0.37 0.00 0.00 175.52 176.38 1jaz h ALA 96 N 1.32 1.36 0.06 6.16 0.00 -1.45 0.18 119.26 126.89 1jaz h ALA 96 Ca 0.31 -0.11 -0.24 0.00 0.00 0.00 0.00 54.91 54.88 1jaz h ALA 96 Cb -0.06 -0.28 0.02 0.00 0.00 0.00 0.00 17.79 17.47 1jaz h ALA 96 CO -0.09 0.52 -0.96 -0.92 0.00 0.00 0.00 179.25 177.80 1jaz h TYR 97 N 0.95 0.85 -0.29 0.00 3.20 -1.42 -0.24 116.97 120.02 1jaz h TYR 97 Ca 0.24 -0.51 0.03 0.00 3.14 0.00 0.00 58.73 61.63 1jaz h TYR 97 Cb 0.03 -0.08 -0.03 0.00 1.54 0.00 0.00 36.73 38.20 1jaz h TYR 97 CO 0.01 1.35 0.12 0.35 -1.64 0.00 0.00 178.16 178.35 1jaz h PHE 98 N 0.11 0.23 -0.78 -3.82 3.57 -0.70 0.88 116.94 116.42 1jaz h PHE 98 Ca -0.14 0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.34 1jaz h PHE 98 Cb 1.66 -0.06 -0.04 0.00 2.79 0.00 0.00 35.95 40.30 1jaz h PHE 98 CO 0.13 0.12 0.36 -0.07 -2.23 0.00 0.00 178.31 176.62 1jaz h LEU 99 N 0.27 1.03 -1.14 0.59 3.38 -0.67 -1.49 115.31 117.28 1jaz h LEU 99 Ca 0.12 -0.13 0.12 0.00 0.09 0.00 0.00 57.88 58.08 1jaz h LEU 99 Cb 0.07 -0.27 -0.07 0.00 0.09 0.00 0.00 40.66 40.48 1jaz h LEU 99 CO -0.11 0.88 0.60 -0.78 0.09 0.00 0.00 178.44 179.13 1jaz h ASP 100 N 1.12 0.82 1.31 -0.43 3.58 0.24 0.12 116.42 123.19 1jaz h ASP 100 Ca 0.27 0.04 0.00 0.00 0.42 0.00 0.00 57.03 57.75 1jaz h ASP 100 Cb 0.14 -0.13 0.00 0.00 1.72 0.00 0.00 39.33 41.06 1jaz h ASP 100 CO -0.03 0.45 -0.24 -0.07 -2.88 0.00 0.00 179.24 176.48 1jaz h LEU 101 N 0.89 0.00 0.00 2.28 3.38 -0.07 0.62 115.31 122.41 1jaz h LEU 101 Ca 0.46 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.36 1jaz h LEU 101 Cb 0.51 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.26 1jaz h LEU 101 CO -0.22 0.03 -0.66 0.35 0.09 0.00 0.00 178.44 178.03 1jaz n THR 102 N -2.31 0.00 -2.05 0.22 -2.24 -0.64 -4.55 114.28 102.71 1jaz n THR 102 Ca 0.04 -0.08 -0.42 0.00 -2.27 0.00 0.00 64.05 61.33 1jaz n THR 102 Cb 0.45 0.53 -0.03 0.00 -2.10 0.00 0.00 70.33 69.17 1jaz n THR 102 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1jaz s VAL 103 N -1.49 2.94 -0.77 2.28 1.01 0.33 -4.79 120.40 119.91 1jaz s VAL 103 Ca 0.00 0.68 0.11 0.00 0.00 0.00 0.00 61.98 62.78 1jaz s VAL 103 Cb 0.00 -3.44 0.33 0.00 0.00 0.00 0.00 36.38 33.27 1jaz s VAL 103 CO 0.00 0.06 1.27 0.29 0.00 0.00 0.00 175.10 176.72 1jaz n LYS 104 N 3.75 2.89 -3.58 2.72 4.76 -1.26 -3.33 118.16 124.11 1jaz n LYS 104 Ca 0.12 -2.17 -0.37 0.00 -2.87 0.00 0.00 58.31 53.03 1jaz n LYS 104 Cb 0.40 -1.36 -0.08 0.00 -1.84 0.00 0.00 35.03 32.16 1jaz n LYS 104 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1jaz n ASP 106 N 3.97 0.90 -4.78 0.00 10.43 -1.26 -4.87 116.55 120.95 1jaz n ASP 106 Ca -0.13 -1.05 -0.33 0.00 2.57 0.00 0.00 54.79 55.85 1jaz n ASP 106 Cb 0.52 0.01 0.04 0.00 1.84 0.00 0.00 41.12 43.52 1jaz n ASP 106 CO 0.00 0.00 0.00 -0.54 -1.07 0.00 0.00 177.20 175.59 1jaz s LYS 107 N -2.23 2.96 0.20 -1.24 1.02 -1.26 -3.03 119.74 116.17 1jaz s LYS 107 Ca 0.34 1.34 -0.32 0.00 0.02 0.00 0.00 55.97 57.35 1jaz s LYS 107 Cb 0.21 -1.98 -0.12 0.00 -0.52 0.00 0.00 37.83 35.42 1jaz s LYS 107 CO 0.41 -1.11 1.71 -2.14 -0.92 0.00 0.00 175.35 173.30 1jaz s PRO 108 N -4.08 4.13 -0.17 -1.68 0.02 -1.26 -4.87 135.00 127.09 1jaz s PRO 108 Ca 0.66 2.58 0.01 0.00 0.02 0.00 0.00 61.00 64.27 1jaz s PRO 108 Cb -0.19 -3.08 0.01 0.00 0.02 0.00 0.00 34.50 31.26 1jaz s PRO 108 CO 0.40 -0.74 -0.18 0.08 -0.33 0.00 0.00 177.00 176.23 1jaz s VAL 109 N 1.18 2.25 -0.12 3.83 1.01 -1.26 -1.08 120.40 126.20 1jaz s VAL 109 Ca 0.74 -0.89 0.00 0.00 0.00 0.00 0.00 61.98 61.84 1jaz s VAL 109 Cb -0.49 -1.94 0.02 0.00 0.00 0.00 0.00 36.38 33.97 1jaz s VAL 109 CO 0.32 0.53 -0.12 -0.69 0.00 0.00 0.00 175.10 175.14 1jaz s VAL 110 N 1.18 1.35 0.21 2.92 1.01 -0.52 -0.52 120.40 126.03 1jaz s VAL 110 Ca 0.02 -0.51 -0.05 0.00 0.00 0.00 0.00 61.98 61.44 1jaz s VAL 110 Cb -0.14 -1.28 -0.06 0.00 0.00 0.00 0.00 36.38 34.90 1jaz s VAL 110 CO -0.09 0.42 0.46 -0.04 0.00 0.00 0.00 175.10 175.85 1jaz s MET 111 N 1.40 3.64 -0.11 2.72 -1.94 0.14 -0.56 119.30 124.59 1jaz s MET 111 Ca 0.01 -0.04 -0.23 0.00 -1.71 0.00 0.00 55.69 53.73 1jaz s MET 111 Cb -0.13 -2.75 0.05 0.00 2.01 0.00 0.00 34.83 34.01 1jaz s MET 111 CO -0.07 0.35 0.56 0.54 -0.01 0.00 0.00 175.02 176.39 1jaz s VAL 112 N -1.85 0.01 0.02 -6.03 0.11 0.04 -1.08 120.40 111.63 1jaz s VAL 112 Ca 0.43 -0.10 0.00 0.00 -2.93 0.00 0.00 61.98 59.38 1jaz s VAL 112 Cb -0.11 -0.83 -0.00 0.00 -1.53 0.00 0.00 36.38 33.90 1jaz s VAL 112 CO 0.26 -0.06 0.02 0.61 -3.33 0.00 0.00 175.10 172.61 1jaz n GLY 113 N 1.79 3.66 3.12 6.54 0.00 -1.26 -1.52 105.19 117.52 1jaz n GLY 113 Ca -0.17 -1.58 -0.13 0.00 0.00 0.00 0.00 46.02 44.14 1jaz n GLY 113 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1jaz s ALA 114 N -1.94 -0.57 -0.71 4.61 0.00 -1.26 -4.64 121.76 117.25 1jaz s ALA 114 Ca 0.02 0.65 0.23 0.00 0.00 0.00 0.00 51.96 52.87 1jaz s ALA 114 Cb 0.00 -0.38 0.15 0.00 0.00 0.00 0.00 23.12 22.90 1jaz s ALA 114 CO 0.02 -0.11 1.13 -1.33 0.00 0.00 0.00 175.76 175.46 1jaz n MET 115 N 2.94 0.22 -4.83 0.00 2.81 -1.26 -4.68 117.12 112.32 1jaz n MET 115 Ca -0.13 0.01 -0.31 0.00 -1.81 0.00 0.00 57.70 55.47 1jaz n MET 115 Cb 0.58 -1.59 -0.14 0.00 -0.71 0.00 0.00 33.22 31.37 1jaz n MET 115 CO 0.00 0.00 0.00 1.03 1.51 0.00 0.00 175.97 178.51 1jaz s ARG 116 N -3.15 1.94 0.24 0.03 0.52 -1.26 -4.97 118.95 112.30 1jaz s ARG 116 Ca 0.06 -1.04 -0.31 0.00 -0.52 0.00 0.00 55.73 53.92 1jaz s ARG 116 Cb 0.15 -2.08 -0.14 0.00 0.52 0.00 0.00 34.95 33.40 1jaz s ARG 116 CO 0.78 0.53 1.23 -2.30 0.02 0.00 0.00 175.30 175.56 1jaz n PRO 117 N 1.74 1.60 0.15 3.54 -0.02 -1.26 -4.60 135.00 136.15 1jaz n PRO 117 Ca -0.17 0.57 0.19 0.00 -2.02 0.00 0.00 63.50 62.07 1jaz n PRO 117 Cb 0.52 -2.10 0.72 0.00 -0.02 0.00 0.00 33.50 32.61 1jaz n PRO 117 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1jaz h SER 118 N 3.32 0.00 -0.02 2.55 4.64 -1.86 0.19 113.55 122.38 1jaz h SER 118 Ca -0.43 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.89 1jaz h SER 118 Cb 1.31 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.40 1jaz h SER 118 CO 0.69 0.00 -0.27 0.35 -0.87 0.00 0.00 176.83 176.73 1jaz n THR 119 N -3.38 0.00 -1.52 2.95 -2.24 -1.26 -4.49 114.28 104.34 1jaz n THR 119 Ca 0.05 -0.36 -0.31 0.00 -2.27 0.00 0.00 64.05 61.17 1jaz n THR 119 Cb 0.63 1.33 0.07 0.00 -2.10 0.00 0.00 70.33 70.26 1jaz n THR 119 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1jaz s SER 120 N -2.28 4.99 0.41 3.42 1.04 0.68 -4.98 113.70 116.97 1jaz s SER 120 Ca 0.23 1.55 -0.25 0.00 0.48 0.00 0.00 55.95 57.96 1jaz s SER 120 Cb 0.19 -2.37 -0.08 0.00 0.10 0.00 0.00 66.02 63.86 1jaz s SER 120 CO 0.46 -1.69 1.16 0.00 0.98 0.00 0.00 173.24 174.15 1jaz s MET 121 N -5.06 4.02 -1.47 4.02 0.23 -1.26 -2.68 119.30 117.10 1jaz s MET 121 Ca 0.59 1.82 -0.11 0.00 -1.03 0.00 0.00 55.69 56.96 1jaz s MET 121 Cb -0.15 -2.63 0.06 0.00 -1.53 0.00 0.00 34.83 30.58 1jaz s MET 121 CO 0.55 -0.34 0.95 0.43 -2.03 0.00 0.00 175.02 174.58 1jaz n SER 122 N -0.01 -4.27 -4.71 -1.18 7.64 -1.26 -4.91 113.62 104.92 1jaz n SER 122 Ca 0.05 -0.76 -0.42 0.00 1.01 0.00 0.00 58.87 58.75 1jaz n SER 122 Cb 0.47 -4.05 0.00 0.00 -1.01 0.00 0.00 64.21 59.62 1jaz n SER 122 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1jaz n ALA 123 N -4.64 1.51 0.29 -0.43 0.00 -1.09 -4.91 120.51 111.23 1jaz n ALA 123 Ca -0.03 0.32 0.11 0.00 0.00 0.00 0.00 53.44 53.84 1jaz n ALA 123 Cb 0.56 -2.29 -0.01 0.00 0.00 0.00 0.00 19.45 17.71 1jaz n ALA 123 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1jaz n ASP 124 N 0.46 0.60 -0.07 0.00 5.75 -1.26 -4.47 116.55 117.56 1jaz n ASP 124 Ca 0.05 0.06 -0.08 0.00 -0.01 0.00 0.00 54.79 54.81 1jaz n ASP 124 Cb 0.38 0.83 -0.01 0.00 -1.03 0.00 0.00 41.12 41.29 1jaz n ASP 124 CO 0.00 0.00 0.00 1.23 -0.11 0.00 0.00 177.20 178.32 1jaz h GLY 125 N 4.24 -0.13 0.13 6.12 0.00 -1.82 -1.28 103.07 110.33 1jaz h GLY 125 Ca 0.00 0.31 0.05 0.00 0.00 0.00 0.00 47.33 47.69 1jaz h GLY 125 CO 0.00 -0.20 -0.32 -2.55 0.00 0.00 0.00 176.54 173.47 1jaz h PRO 126 N -0.23 -0.37 -0.11 4.80 0.11 -1.78 0.84 132.00 135.27 1jaz h PRO 126 Ca 0.15 0.02 -0.10 0.00 0.11 0.00 0.00 66.00 66.19 1jaz h PRO 126 Cb 0.47 0.08 -0.01 0.00 0.11 0.00 0.00 31.00 31.65 1jaz h PRO 126 CO -0.43 -0.24 -0.37 0.35 -0.21 0.00 0.00 178.00 177.10 1jaz h PHE 127 N -0.38 0.25 -0.43 0.65 3.57 -1.83 -1.92 116.94 116.85 1jaz h PHE 127 Ca 0.10 -0.06 -0.02 0.00 3.53 0.00 0.00 57.97 61.52 1jaz h PHE 127 Cb 0.54 -0.06 -0.02 0.00 2.79 0.00 0.00 35.95 39.20 1jaz h PHE 127 CO -0.42 0.56 0.18 -0.91 -2.23 0.00 0.00 178.31 175.50 1jaz h ASN 128 N 0.19 0.58 -0.44 0.41 2.35 -0.57 -1.34 115.58 116.76 1jaz h ASN 128 Ca 0.02 -0.16 -0.02 0.00 -0.55 0.00 0.00 56.30 55.60 1jaz h ASN 128 Cb 0.74 -0.15 -0.02 0.00 0.05 0.00 0.00 38.32 38.95 1jaz h ASN 128 CO 0.06 0.58 0.20 0.25 -1.65 0.00 0.00 177.43 176.87 1jaz h LEU 129 N 0.54 0.58 -0.64 1.61 7.12 -0.68 -0.62 115.31 123.22 1jaz h LEU 129 Ca 0.14 -0.14 0.03 0.00 0.13 0.00 0.00 57.88 58.05 1jaz h LEU 129 Cb 0.17 -0.15 -0.04 0.00 -0.53 0.00 0.00 40.66 40.11 1jaz h LEU 129 CO -0.01 0.55 0.39 0.22 -0.13 0.00 0.00 178.44 179.46 1jaz h TYR 130 N 0.56 0.74 0.00 1.25 3.20 -1.22 -1.10 116.97 120.40 1jaz h TYR 130 Ca 0.15 0.02 -0.07 0.00 3.14 0.00 0.00 58.73 61.97 1jaz h TYR 130 Cb 0.13 -0.24 -0.01 0.00 1.54 0.00 0.00 36.73 38.16 1jaz h TYR 130 CO -0.01 0.42 -0.32 -0.91 -1.64 0.00 0.00 178.16 175.70 1jaz h ASN 131 N 0.77 0.00 0.12 -2.11 2.35 -0.79 -2.07 115.58 113.85 1jaz h ASN 131 Ca 0.26 0.00 -0.24 0.00 -0.55 0.00 0.00 56.30 55.77 1jaz h ASN 131 Cb 0.03 0.00 0.01 0.00 0.05 0.00 0.00 38.32 38.41 1jaz h ASN 131 CO -0.11 0.32 -0.96 0.00 -1.65 0.00 0.00 177.43 175.03 1jaz h ALA 132 N 1.68 0.27 -0.41 -0.83 0.00 0.06 -1.51 119.26 118.52 1jaz h ALA 132 Ca -0.00 -0.68 -0.09 0.00 0.00 0.00 0.00 54.91 54.14 1jaz h ALA 132 Cb 0.66 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.45 1jaz h ALA 132 CO 0.04 0.74 -0.08 0.28 0.00 0.00 0.00 179.25 180.23 1jaz h VAL 133 N 0.35 1.27 -0.15 0.00 2.07 -1.06 0.37 116.25 119.10 1jaz h VAL 133 Ca -0.10 -1.17 0.03 0.00 0.82 0.00 0.00 66.70 66.29 1jaz h VAL 133 Cb 1.60 1.20 -0.03 0.00 -1.52 0.00 0.00 31.29 32.53 1jaz h VAL 133 CO 0.18 0.39 -0.06 0.58 0.02 0.00 0.00 177.57 178.68 1jaz h VAL 134 N 0.59 0.78 0.23 2.57 2.07 -1.36 0.42 116.25 121.56 1jaz h VAL 134 Ca 0.10 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.62 1jaz h VAL 134 Cb 0.60 0.78 -0.01 0.00 -1.52 0.00 0.00 31.29 31.15 1jaz h VAL 134 CO 0.04 0.00 -0.16 0.74 0.02 0.00 0.00 177.57 178.20 1jaz h THR 135 N -0.05 0.65 -0.40 2.57 2.02 -1.04 0.61 112.91 117.27 1jaz h THR 135 Ca 0.08 0.00 0.09 0.00 0.77 0.00 0.00 66.41 67.35 1jaz h THR 135 Cb 0.17 0.65 -0.02 0.00 -1.74 0.00 0.00 68.15 67.20 1jaz h THR 135 CO -0.18 0.00 0.28 0.00 0.37 0.00 0.00 175.52 175.99 1jaz h ALA 136 N 0.35 2.19 0.00 6.16 0.00 0.25 -2.25 119.26 125.96 1jaz h ALA 136 Ca -0.02 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1jaz h ALA 136 Cb 0.34 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.12 1jaz h ALA 136 CO 0.00 -0.29 -0.88 0.00 0.00 0.00 0.00 179.25 178.08 1jaz h ALA 137 N 1.80 0.55 -2.38 0.00 0.00 0.51 -3.43 119.26 116.30 1jaz h ALA 137 Ca 0.19 0.00 -0.54 0.00 0.00 0.00 0.00 54.91 54.56 1jaz h ALA 137 Cb 0.56 0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.36 1jaz h ALA 137 CO -0.02 0.00 1.00 0.34 0.00 0.00 0.00 179.25 180.57 1jaz s ASP 138 N -5.34 6.66 0.51 0.00 -1.08 0.14 -4.89 116.67 112.67 1jaz s ASP 138 Ca 0.01 2.36 0.17 0.00 -0.52 0.00 0.00 52.55 54.57 1jaz s ASP 138 Cb 0.09 -2.55 1.24 0.00 -1.46 0.00 0.00 42.92 40.24 1jaz s ASP 138 CO 0.77 -0.87 2.11 0.11 0.52 0.00 0.00 175.17 177.82 1jaz h LYS 139 N 8.62 0.00 0.00 4.34 1.79 -1.88 -1.20 116.57 128.23 1jaz h LYS 139 Ca -0.41 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.06 1jaz h LYS 139 Cb 1.19 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.84 1jaz h LYS 139 CO 0.93 0.05 0.00 0.00 -1.08 0.00 0.00 179.45 179.35 1jaz n ALA 140 N -2.51 1.80 0.31 3.86 0.00 -1.26 -2.66 120.51 120.04 1jaz n ALA 140 Ca -0.03 -0.07 0.12 0.00 0.00 0.00 0.00 53.44 53.47 1jaz n ALA 140 Cb 0.13 -1.24 0.17 0.00 0.00 0.00 0.00 19.45 18.52 1jaz n ALA 140 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 1jaz h SER 141 N 0.00 0.00 -4.22 0.00 0.02 -1.48 -3.47 113.55 104.40 1jaz h SER 141 Ca 0.00 -0.03 -0.53 0.00 -0.84 0.00 0.00 61.79 60.40 1jaz h SER 141 Cb 0.17 0.00 0.16 0.00 0.14 0.00 0.00 62.40 62.87 1jaz h SER 141 CO 0.00 0.01 0.34 0.00 -1.14 0.00 0.00 176.83 176.04 1jaz s ALA 142 N -3.22 1.98 -1.54 3.77 0.00 -1.09 -3.63 121.76 118.03 1jaz s ALA 142 Ca 0.06 0.73 -0.02 0.00 0.00 0.00 0.00 51.96 52.73 1jaz s ALA 142 Cb 0.08 -3.44 0.00 0.00 0.00 0.00 0.00 23.12 19.77 1jaz s ALA 142 CO 0.69 -2.07 0.29 0.09 0.00 0.00 0.00 175.76 174.75 1jaz n ASN 143 N -3.18 -5.66 0.00 0.00 3.02 -1.17 -4.83 115.26 103.44 1jaz n ASN 143 Ca 0.12 -0.14 0.00 0.00 -0.03 0.00 0.00 54.58 54.53 1jaz n ASN 143 Cb 0.51 -4.59 0.00 0.00 -0.61 0.00 0.00 39.78 35.09 1jaz n ASN 143 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1jaz n ARG 144 N -3.31 1.91 0.00 3.52 1.74 -1.24 -5.01 116.66 114.27 1jaz n ARG 144 Ca -0.17 -1.17 0.00 0.00 -0.77 0.00 0.00 57.85 55.74 1jaz n ARG 144 Cb 0.64 -0.92 0.00 0.00 -1.02 0.00 0.00 32.46 31.16 1jaz n ARG 144 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1jaz n GLY 145 N -0.34 -2.38 3.73 -0.13 0.00 -1.26 -4.70 105.19 100.11 1jaz n GLY 145 Ca 0.00 -1.58 -0.41 0.00 0.00 0.00 0.00 46.02 44.03 1jaz n GLY 145 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1jaz s VAL 146 N -0.68 3.75 0.18 1.61 1.01 -1.26 -4.58 120.40 120.43 1jaz s VAL 146 Ca 0.00 1.38 0.09 0.00 0.00 0.00 0.00 61.98 63.45 1jaz s VAL 146 Cb 0.00 -3.88 -0.04 0.00 0.00 0.00 0.00 36.38 32.45 1jaz s VAL 146 CO 0.00 0.18 -0.12 -0.76 0.00 0.00 0.00 175.10 174.40 1jaz s LEU 147 N 0.27 2.89 -0.15 3.92 1.43 0.33 -1.97 118.68 125.39 1jaz s LEU 147 Ca 0.55 -0.62 0.02 0.00 -1.03 0.00 0.00 54.13 53.05 1jaz s LEU 147 Cb -0.31 -1.59 0.01 0.00 0.03 0.00 0.00 46.19 44.33 1jaz s LEU 147 CO 0.33 0.11 -0.21 -0.69 0.23 0.00 0.00 176.35 176.12 1jaz s VAL 148 N -1.71 2.01 -0.18 -1.59 1.01 0.88 0.29 120.40 121.10 1jaz s VAL 148 Ca 0.24 -0.93 -0.03 0.00 0.00 0.00 0.00 61.98 61.26 1jaz s VAL 148 Cb -0.09 -1.79 -0.01 0.00 0.00 0.00 0.00 36.38 34.49 1jaz s VAL 148 CO 0.14 0.54 -0.06 -0.69 0.00 0.00 0.00 175.10 175.03 1jaz s VAL 149 N 1.00 3.39 -0.12 2.92 1.01 -0.24 -0.89 120.40 127.47 1jaz s VAL 149 Ca -0.03 -0.51 -0.29 0.00 0.00 0.00 0.00 61.98 61.16 1jaz s VAL 149 Cb -0.15 -2.50 0.07 0.00 0.00 0.00 0.00 36.38 33.80 1jaz s VAL 149 CO -0.06 0.46 0.68 -0.04 0.00 0.00 0.00 175.10 176.15 1jaz s MET 150 N 0.98 0.97 -1.52 2.72 -1.94 -1.04 -4.46 119.30 115.02 1jaz s MET 150 Ca -0.00 0.50 -0.01 0.00 -1.71 0.00 0.00 55.69 54.47 1jaz s MET 150 Cb -0.15 0.46 0.00 0.00 2.01 0.00 0.00 34.83 37.16 1jaz s MET 150 CO 0.00 -0.25 0.08 -1.71 -0.01 0.00 0.00 175.02 173.13 1jaz n ASN 151 N 1.52 0.64 -0.83 3.03 5.15 -1.26 -2.11 115.26 121.40 1jaz n ASN 151 Ca -0.17 -1.24 -0.11 0.00 -0.60 0.00 0.00 54.58 52.46 1jaz n ASN 151 Cb 0.56 -1.81 -0.05 0.00 -0.53 0.00 0.00 39.78 37.96 1jaz n ASN 151 CO 0.00 0.00 0.00 0.47 1.40 0.00 0.00 177.26 179.13 1jaz n ASP 152 N -2.89 -4.54 -4.15 1.20 8.00 -1.26 -4.97 116.55 107.95 1jaz n ASP 152 Ca -0.32 0.27 -0.22 0.00 0.71 0.00 0.00 54.79 55.23 1jaz n ASP 152 Cb 0.69 -2.99 -0.14 0.00 -0.02 0.00 0.00 41.12 38.66 1jaz n ASP 152 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1jaz s THR 153 N -2.33 1.23 -0.24 -3.53 2.01 -0.90 -0.35 115.64 111.54 1jaz s THR 153 Ca 0.00 -0.89 -0.08 0.00 0.31 0.00 0.00 61.69 61.03 1jaz s THR 153 Cb 0.00 -1.07 -0.04 0.00 0.01 0.00 0.00 72.50 71.40 1jaz s THR 153 CO 0.00 0.17 0.10 -0.69 -0.69 0.00 0.00 174.62 173.51 1jaz s VAL 154 N -0.64 4.64 -0.03 3.82 1.01 0.12 -2.49 120.40 126.82 1jaz s VAL 154 Ca 0.04 -0.07 0.05 0.00 0.00 0.00 0.00 61.98 62.00 1jaz s VAL 154 Cb -0.07 -3.16 -0.01 0.00 0.00 0.00 0.00 36.38 33.14 1jaz s VAL 154 CO 0.01 0.34 -0.17 -0.76 0.00 0.00 0.00 175.10 174.52 1jaz s LEU 155 N 1.40 1.95 0.32 3.92 1.43 -0.06 -1.40 118.68 126.24 1jaz s LEU 155 Ca 0.06 -0.34 -0.27 0.00 -1.03 0.00 0.00 54.13 52.54 1jaz s LEU 155 Cb -0.15 -0.95 -0.09 0.00 0.03 0.00 0.00 46.19 45.03 1jaz s LEU 155 CO 0.05 0.17 1.06 1.51 0.23 0.00 0.00 176.35 179.37 1jaz s ASP 156 N -0.10 7.13 0.55 2.29 1.47 -1.26 -0.08 116.67 126.67 1jaz s ASP 156 Ca -0.01 2.13 0.31 0.00 1.18 0.00 0.00 52.55 56.17 1jaz s ASP 156 Cb -0.10 -2.61 1.61 0.00 -0.34 0.00 0.00 42.92 41.48 1jaz s ASP 156 CO 0.01 -0.23 2.12 1.23 0.68 0.00 0.00 175.17 178.98 1jaz h GLY 157 N 3.34 0.00 0.24 2.12 0.00 -1.68 -1.14 103.07 105.95 1jaz h GLY 157 Ca -0.47 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 46.85 1jaz h GLY 157 CO 0.65 0.00 -0.12 -0.09 0.00 0.00 0.00 176.54 176.99 1jaz h ARG 158 N 0.00 -0.31 0.00 4.80 2.43 -1.86 -3.28 114.38 116.16 1jaz h ARG 158 Ca -0.00 0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.19 1jaz h ARG 158 Cb 0.29 0.07 0.00 0.00 -0.42 0.00 0.00 29.97 29.91 1jaz h ARG 158 CO 0.01 -0.21 0.00 -3.47 -1.51 0.00 0.00 179.97 174.79 1jaz n ASP 159 N -4.16 0.24 -4.71 -3.80 2.03 -1.16 -4.87 116.55 100.12 1jaz n ASP 159 Ca -0.04 0.52 -0.42 0.00 0.52 0.00 0.00 54.79 55.37 1jaz n ASP 159 Cb 0.13 -0.59 -0.03 0.00 -0.72 0.00 0.00 41.12 39.91 1jaz n ASP 159 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 1jaz s VAL 160 N -3.03 3.55 0.16 5.18 0.11 -0.44 -3.81 120.40 122.12 1jaz s VAL 160 Ca 0.13 1.10 -0.00 0.00 -2.93 0.00 0.00 61.98 60.27 1jaz s VAL 160 Cb 0.16 -3.70 -0.04 0.00 -1.53 0.00 0.00 36.38 31.27 1jaz s VAL 160 CO 0.53 0.08 0.06 0.28 -3.33 0.00 0.00 175.10 172.72 1jaz s THR 161 N 1.21 0.23 -0.23 5.04 -1.32 -0.09 -4.77 115.64 115.71 1jaz s THR 161 Ca 0.63 -1.95 -0.22 0.00 -1.21 0.00 0.00 61.69 58.94 1jaz s THR 161 Cb -0.34 -2.20 -0.02 0.00 -1.51 0.00 0.00 72.50 68.43 1jaz s THR 161 CO 0.30 -0.33 0.70 -0.75 -2.21 0.00 0.00 174.62 172.32 1jaz s LYS 162 N -4.05 4.17 -0.13 7.08 2.20 -1.26 -1.98 119.74 125.78 1jaz s LYS 162 Ca 0.28 0.71 0.17 0.00 -0.36 0.00 0.00 55.97 56.78 1jaz s LYS 162 Cb 0.07 -3.62 -0.25 0.00 -1.51 0.00 0.00 37.83 32.52 1jaz s LYS 162 CO 0.05 -0.39 0.19 -2.37 -0.36 0.00 0.00 175.35 172.47 1jaz n THR 163 N 5.05 0.82 -4.02 3.43 5.66 -0.72 -4.97 114.28 119.53 1jaz n THR 163 Ca 0.01 -0.66 -0.12 0.00 -3.05 0.00 0.00 64.05 60.23 1jaz n THR 163 Cb 0.49 -0.32 -0.13 0.00 -1.55 0.00 0.00 70.33 68.82 1jaz n THR 163 CO 0.00 0.00 0.00 0.21 -3.05 0.00 0.00 175.07 172.23 1jaz s ASN 164 N -4.89 0.46 0.44 1.09 2.47 -1.26 -5.07 114.94 108.18 1jaz s ASN 164 Ca -0.08 -0.31 0.22 0.00 0.42 0.00 0.00 52.86 53.10 1jaz s ASN 164 Cb 0.08 0.02 1.03 0.00 -1.45 0.00 0.00 41.25 40.92 1jaz s ASN 164 CO 0.77 -0.12 1.90 0.71 -3.72 0.00 0.00 177.10 176.64 1jaz h THR 165 N 4.80 0.79 0.00 -5.21 1.35 -1.98 -3.38 112.91 109.28 1jaz h THR 165 Ca -0.30 -1.01 0.00 0.00 -0.55 0.00 0.00 66.41 64.54 1jaz h THR 165 Cb 1.20 1.62 0.00 0.00 -1.73 0.00 0.00 68.15 69.24 1jaz h THR 165 CO 0.45 0.24 -0.22 0.35 -0.25 0.00 0.00 175.52 176.10 1jaz n THR 166 N -3.68 0.00 -2.45 6.82 -2.24 -1.26 -5.10 114.28 106.37 1jaz n THR 166 Ca -0.01 -0.05 -0.41 0.00 -2.27 0.00 0.00 64.05 61.31 1jaz n THR 166 Cb 0.37 0.44 -0.04 0.00 -2.10 0.00 0.00 70.33 68.99 1jaz n THR 166 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1jaz s ASP 167 N -0.54 7.20 0.54 3.42 -1.08 -1.26 -4.92 116.67 120.04 1jaz s ASP 167 Ca 0.00 2.21 0.23 0.00 -0.52 0.00 0.00 52.55 54.47 1jaz s ASP 167 Cb 0.00 -2.61 1.41 0.00 -1.46 0.00 0.00 42.92 40.26 1jaz s ASP 167 CO 0.00 -0.25 2.08 -0.37 0.52 0.00 0.00 175.17 177.15 1jaz h VAL 168 N 3.52 0.77 -0.28 1.11 -1.51 -1.95 -1.65 116.25 116.26 1jaz h VAL 168 Ca -0.45 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.02 1jaz h VAL 168 Cb 1.21 0.86 0.00 0.00 -2.13 0.00 0.00 31.29 31.23 1jaz h VAL 168 CO 0.71 0.00 0.00 0.00 -1.23 0.00 0.00 177.57 177.05 1jaz n ALA 169 N -2.54 2.78 0.05 5.19 0.00 -1.26 -4.56 120.51 120.16 1jaz n ALA 169 Ca 0.03 -0.68 0.03 0.00 0.00 0.00 0.00 53.44 52.82 1jaz n ALA 169 Cb 0.36 -1.02 0.41 0.00 0.00 0.00 0.00 19.45 19.20 1jaz n ALA 169 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1jaz h THR 170 N 1.76 1.13 -3.13 0.00 1.03 -1.61 -3.42 112.91 108.68 1jaz h THR 170 Ca 0.00 -0.42 -0.57 0.00 -0.01 0.00 0.00 66.41 65.42 1jaz h THR 170 Cb 0.78 0.79 -0.05 0.00 -1.07 0.00 0.00 68.15 68.60 1jaz h THR 170 CO 0.11 0.16 1.03 -0.36 -0.01 0.00 0.00 175.52 176.44 1jaz s PHE 171 N -5.19 2.49 0.04 0.00 0.40 -1.26 -1.75 117.98 112.71 1jaz s PHE 171 Ca -0.07 0.75 0.01 0.00 -0.60 0.00 0.00 56.93 57.02 1jaz s PHE 171 Cb 0.17 -4.06 -0.03 0.00 0.51 0.00 0.00 43.02 39.61 1jaz s PHE 171 CO 0.73 -2.00 -0.05 0.15 0.70 0.00 0.00 175.22 174.75 1jaz s LYS 172 N 4.53 0.50 -0.84 0.44 1.02 -0.84 -4.95 119.74 119.60 1jaz s LYS 172 Ca 0.61 -0.87 -0.18 0.00 0.02 0.00 0.00 55.97 55.55 1jaz s LYS 172 Cb -0.17 -0.04 0.15 0.00 -0.52 0.00 0.00 37.83 37.26 1jaz s LYS 172 CO 0.27 -0.03 0.96 -1.12 -0.92 0.00 0.00 175.35 174.52 1jaz s SER 173 N -1.99 6.59 0.19 2.83 0.01 -1.26 -0.91 113.70 119.15 1jaz s SER 173 Ca -0.06 -2.10 0.22 0.00 1.31 0.00 0.00 55.95 55.32 1jaz s SER 173 Cb -0.05 -2.33 0.90 0.00 0.21 0.00 0.00 66.02 64.75 1jaz s SER 173 CO -0.03 -0.95 1.68 1.33 0.41 0.00 0.00 173.24 175.69 1jaz n VAL 174 N 5.08 0.80 -0.10 3.43 0.24 -1.25 -1.48 118.33 125.05 1jaz n VAL 174 Ca 0.15 0.16 -0.19 0.00 -2.04 0.00 0.00 64.34 62.42 1jaz n VAL 174 Cb 0.47 -1.03 -0.08 0.00 -1.47 0.00 0.00 33.84 31.73 1jaz n VAL 174 CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 1jaz n ASN 175 N -2.07 1.79 -0.09 -1.34 3.02 -1.26 -4.81 115.26 110.50 1jaz n ASN 175 Ca 0.03 0.14 0.02 0.00 -0.03 0.00 0.00 54.58 54.73 1jaz n ASN 175 Cb 0.25 -0.51 0.00 0.00 -0.61 0.00 0.00 39.78 38.92 1jaz n ASN 175 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 1jaz n TYR 176 N -3.64 0.00 0.00 3.10 4.01 -1.23 -5.06 117.16 114.33 1jaz n TYR 176 Ca -0.38 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.36 1jaz n TYR 176 Cb 0.81 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.84 1jaz n TYR 176 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1jaz n GLY 177 N 0.46 -0.78 3.93 2.72 0.00 -0.55 -4.99 105.19 105.97 1jaz n GLY 177 Ca 0.01 -1.71 -0.26 0.00 0.00 0.00 0.00 46.02 44.07 1jaz n GLY 177 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1jaz s PRO 178 N -1.23 2.99 0.04 1.61 0.04 -1.26 -4.67 135.00 132.53 1jaz s PRO 178 Ca 0.00 -0.12 0.07 0.00 0.04 0.00 0.00 61.00 60.99 1jaz s PRO 178 Cb 0.00 -2.35 -0.23 0.00 0.04 0.00 0.00 34.50 31.96 1jaz s PRO 178 CO 0.00 -0.56 0.99 -0.07 0.04 0.00 0.00 177.00 177.40 1jaz h LEU 179 N -0.01 0.07 -7.00 -3.56 4.07 -1.51 -3.44 115.31 103.94 1jaz h LEU 179 Ca -0.46 -0.10 0.20 0.00 0.08 0.00 0.00 57.88 57.61 1jaz h LEU 179 Cb 1.25 -0.02 -0.18 0.00 1.08 0.00 0.00 40.66 42.79 1jaz h LEU 179 CO 0.60 1.08 0.70 -0.83 -1.08 0.00 0.00 178.44 178.91 1jaz s GLY 180 N -4.89 -0.34 0.10 0.83 0.00 -1.14 -1.43 107.32 100.45 1jaz s GLY 180 Ca -0.03 1.45 0.07 0.00 0.00 0.00 0.00 44.72 46.22 1jaz s GLY 180 CO 0.83 0.50 -0.11 -0.19 0.00 0.00 0.00 173.10 174.13 1jaz s TYR 181 N -2.57 2.71 -0.18 1.90 2.02 -1.23 0.14 117.35 120.14 1jaz s TYR 181 Ca 0.08 -0.17 -0.04 0.00 -0.37 0.00 0.00 57.07 56.57 1jaz s TYR 181 Cb -0.01 -1.43 -0.02 0.00 -0.40 0.00 0.00 41.96 40.10 1jaz s TYR 181 CO -0.06 0.41 -0.04 0.42 -1.57 0.00 0.00 175.55 174.72 1jaz s ILE 182 N -1.19 3.65 -0.02 2.71 1.01 0.53 -2.35 121.20 125.54 1jaz s ILE 182 Ca 0.21 -0.42 0.00 0.00 0.00 0.00 0.00 60.65 60.44 1jaz s ILE 182 Cb -0.11 -2.63 0.02 0.00 0.01 0.00 0.00 42.46 39.76 1jaz s ILE 182 CO 0.13 0.46 0.01 -1.00 0.00 0.00 0.00 174.94 174.53 1jaz s HIS 183 N 0.88 0.18 -1.48 3.97 0.09 -0.51 -4.86 115.29 113.55 1jaz s HIS 183 Ca -0.01 0.04 -0.09 0.00 -0.00 0.00 0.00 55.06 55.01 1jaz s HIS 183 Cb -0.15 -0.30 0.06 0.00 -0.00 0.00 0.00 32.58 32.20 1jaz s HIS 183 CO 0.01 -0.10 0.78 0.09 -0.00 0.00 0.00 174.74 175.53 1jaz n ASN 184 N 3.99 -2.89 -0.74 1.40 4.13 -1.26 -1.35 115.26 118.53 1jaz n ASN 184 Ca -0.25 -0.87 -0.10 0.00 1.68 0.00 0.00 54.58 55.04 1jaz n ASN 184 Cb 0.52 -3.60 -0.04 0.00 -1.54 0.00 0.00 39.78 35.11 1jaz n ASN 184 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1jaz n GLY 185 N -1.67 1.07 3.25 7.41 0.00 -1.26 -5.01 105.19 108.98 1jaz n GLY 185 Ca -0.10 -0.26 -0.26 0.00 0.00 0.00 0.00 46.02 45.40 1jaz n GLY 185 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1jaz s LYS 186 N -2.62 1.47 -0.15 1.61 1.02 -0.46 -5.00 119.74 115.60 1jaz s LYS 186 Ca 0.00 -0.92 -0.02 0.00 0.02 0.00 0.00 55.97 55.04 1jaz s LYS 186 Cb 0.00 -1.56 -0.02 0.00 -0.52 0.00 0.00 37.83 35.73 1jaz s LYS 186 CO 0.00 0.40 -0.07 0.42 -0.92 0.00 0.00 175.35 175.18 1jaz s ILE 187 N -0.75 3.52 -0.72 2.17 1.01 -1.26 -1.43 121.20 123.73 1jaz s ILE 187 Ca 0.08 -0.49 -0.12 0.00 0.00 0.00 0.00 60.65 60.12 1jaz s ILE 187 Cb -0.09 -2.53 0.19 0.00 0.01 0.00 0.00 42.46 40.04 1jaz s ILE 187 CO 0.01 0.49 0.65 -0.62 0.00 0.00 0.00 174.94 175.47 1jaz s ASP 188 N 0.50 6.38 0.01 3.58 2.15 -0.99 -4.99 116.67 123.31 1jaz s ASP 188 Ca -0.05 -2.50 -0.30 0.00 0.43 0.00 0.00 52.55 50.12 1jaz s ASP 188 Cb -0.15 -2.15 -0.04 0.00 -0.30 0.00 0.00 42.92 40.28 1jaz s ASP 188 CO 0.03 -0.60 1.11 -0.31 -0.17 0.00 0.00 175.17 175.23 1jaz s TYR 189 N 0.47 3.49 0.00 -5.34 2.02 -1.26 -3.53 117.35 113.19 1jaz s TYR 189 Ca 0.14 1.45 0.00 0.00 -0.37 0.00 0.00 57.07 58.29 1jaz s TYR 189 Cb -0.16 -3.30 0.00 0.00 -0.40 0.00 0.00 41.96 38.10 1jaz s TYR 189 CO -0.05 -0.75 0.62 1.04 -1.57 0.00 0.00 175.55 174.83 1jaz n GLN 190 N 4.19 0.95 -3.62 -0.62 6.02 -0.51 -5.01 117.38 118.77 1jaz n GLN 190 Ca 0.08 -0.81 -0.15 0.00 -0.01 0.00 0.00 57.00 56.12 1jaz n GLN 190 Cb 0.48 -0.78 -0.06 0.00 1.02 0.00 0.00 30.24 30.90 1jaz n GLN 190 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 1jaz s ARG 191 N -0.38 0.94 -0.02 -1.09 1.81 -1.13 -5.07 118.95 114.00 1jaz s ARG 191 Ca 0.00 -0.12 -0.09 0.00 -1.72 0.00 0.00 55.73 53.80 1jaz s ARG 191 Cb 0.00 0.43 0.01 0.00 -0.45 0.00 0.00 34.95 34.94 1jaz s ARG 191 CO 0.00 -0.31 0.20 -0.08 -0.68 0.00 0.00 175.30 174.43 1jaz s THR 192 N -1.87 0.05 0.51 0.02 -1.32 -1.26 -4.69 115.64 107.08 1jaz s THR 192 Ca -0.09 -0.45 -0.20 0.00 -1.21 0.00 0.00 61.69 59.74 1jaz s THR 192 Cb -0.02 -0.44 -0.07 0.00 -1.51 0.00 0.00 72.50 70.46 1jaz s THR 192 CO 0.03 -0.25 1.11 -2.84 -2.21 0.00 0.00 174.62 170.46 1jaz s PRO 193 N -0.96 3.55 -0.04 7.08 0.02 -1.26 -4.97 135.00 138.41 1jaz s PRO 193 Ca -0.10 1.58 0.09 0.00 0.02 0.00 0.00 61.00 62.59 1jaz s PRO 193 Cb -0.05 -2.11 -0.24 0.00 0.02 0.00 0.00 34.50 32.12 1jaz s PRO 193 CO 0.02 -0.68 0.66 0.00 -0.33 0.00 0.00 177.00 176.67 1jaz h ALA 194 N 1.47 0.69 -2.53 -1.55 0.00 -2.01 -3.46 119.26 111.87 1jaz h ALA 194 Ca -0.50 -1.42 -0.53 0.00 0.00 0.00 0.00 54.91 52.47 1jaz h ALA 194 Cb 1.25 0.48 0.02 0.00 0.00 0.00 0.00 17.79 19.54 1jaz h ALA 194 CO 0.58 1.52 0.77 1.03 0.00 0.00 0.00 179.25 183.15 1jaz s ARG 195 N -2.60 4.30 0.41 0.00 1.81 -1.26 -4.91 118.95 116.69 1jaz s ARG 195 Ca -0.07 2.12 -0.26 0.00 -1.72 0.00 0.00 55.73 55.80 1jaz s ARG 195 Cb 0.08 -3.28 -0.10 0.00 -0.45 0.00 0.00 34.95 31.19 1jaz s ARG 195 CO 0.82 -0.49 1.34 1.63 -0.68 0.00 0.00 175.30 177.91 1jaz n LYS 196 N 4.17 2.13 -1.30 3.54 5.02 -1.19 -4.98 118.16 125.55 1jaz n LYS 196 Ca 0.12 0.76 0.00 0.00 -2.02 0.00 0.00 58.31 57.17 1jaz n LYS 196 Cb 0.42 -2.46 0.00 0.00 -0.02 0.00 0.00 35.03 32.97 1jaz n LYS 196 CO 0.00 0.00 0.00 -2.39 -0.52 0.00 0.00 177.40 174.49 1jaz n HIS 197 N -0.02 -0.43 0.00 2.13 1.44 -1.26 -4.61 115.22 112.47 1jaz n HIS 197 Ca 0.05 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.76 1jaz n HIS 197 Cb 0.39 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.50 1jaz n HIS 197 CO 0.00 0.00 0.00 0.25 -2.81 0.00 0.00 176.34 173.78 1jaz n THR 198 N 0.00 0.00 0.48 0.61 -2.24 0.22 -1.50 114.28 111.85 1jaz n THR 198 Ca 0.00 0.00 0.06 0.00 -2.27 0.00 0.00 64.05 61.84 1jaz n THR 198 Cb 0.00 0.00 0.28 0.00 -2.10 0.00 0.00 70.33 68.51 1jaz n THR 198 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1jaz n SER 199 N 1.31 0.00 0.14 3.42 3.41 -1.21 -2.14 113.62 118.55 1jaz n SER 199 Ca 0.00 0.35 0.13 0.00 -0.26 0.00 0.00 58.87 59.09 1jaz n SER 199 Cb 0.00 -0.42 0.35 0.00 -0.26 0.00 0.00 64.21 63.88 1jaz n SER 199 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 1jaz h ASP 200 N 0.00 0.00 -4.24 4.04 3.32 -1.62 -3.45 116.42 114.47 1jaz h ASP 200 Ca 0.00 0.00 -0.50 0.00 0.02 0.00 0.00 57.03 56.55 1jaz h ASP 200 Cb 0.17 0.00 0.06 0.00 0.22 0.00 0.00 39.33 39.78 1jaz h ASP 200 CO 0.00 0.00 0.37 0.42 -1.72 0.00 0.00 179.24 178.31 1jaz s THR 201 N -3.14 4.52 -2.21 0.35 -4.23 -0.91 -4.86 115.64 105.17 1jaz s THR 201 Ca 0.10 0.69 0.18 0.00 -1.18 0.00 0.00 61.69 61.48 1jaz s THR 201 Cb 0.10 -3.80 0.42 0.00 1.34 0.00 0.00 72.50 70.57 1jaz s THR 201 CO 0.61 -1.01 1.45 -0.81 -0.54 0.00 0.00 174.62 174.33 1jaz n PRO 202 N -2.71 1.86 -2.86 3.99 -0.04 -1.26 -4.94 135.00 129.04 1jaz n PRO 202 Ca 0.05 -1.30 -0.33 0.00 -0.04 0.00 0.00 63.50 61.88 1jaz n PRO 202 Cb 0.55 -1.38 -0.07 0.00 -0.04 0.00 0.00 33.50 32.56 1jaz n PRO 202 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 1jaz s PHE 203 N -1.66 3.33 -0.26 0.54 0.08 -1.26 -5.04 117.98 113.70 1jaz s PHE 203 Ca 0.31 1.52 -0.02 0.00 0.12 0.00 0.00 56.93 58.86 1jaz s PHE 203 Cb 0.17 -2.78 0.12 0.00 -0.57 0.00 0.00 43.02 39.95 1jaz s PHE 203 CO 0.24 -0.08 0.24 0.34 -0.10 0.00 0.00 175.22 175.86 1jaz s ASP 204 N -2.25 1.94 0.22 1.36 2.15 -1.26 -4.93 116.67 113.91 1jaz s ASP 204 Ca 0.60 -0.69 0.25 0.00 0.43 0.00 0.00 52.55 53.15 1jaz s ASP 204 Cb -0.09 0.30 0.60 0.00 -0.30 0.00 0.00 42.92 43.43 1jaz s ASP 204 CO 0.15 -0.38 1.62 -0.37 -0.17 0.00 0.00 175.17 176.02 1jaz h VAL 205 N 6.31 0.00 -0.01 1.11 -1.51 -1.95 -3.29 116.25 116.90 1jaz h VAL 205 Ca -0.16 -0.58 0.00 0.00 -1.23 0.00 0.00 66.70 64.74 1jaz h VAL 205 Cb 1.09 1.46 -0.00 0.00 -2.13 0.00 0.00 31.29 31.71 1jaz h VAL 205 CO 0.34 0.00 0.11 0.77 -1.23 0.00 0.00 177.57 177.56 1jaz h SER 206 N 0.00 0.00 -0.14 4.19 4.64 -1.95 0.67 113.55 120.95 1jaz h SER 206 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1jaz h SER 206 Cb 0.79 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.88 1jaz h SER 206 CO 0.00 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 176.25 1jaz n LYS 207 N -3.11 2.33 -4.45 4.77 5.02 -1.24 -4.95 118.16 116.53 1jaz n LYS 207 Ca -0.02 -2.02 -0.34 0.00 -2.02 0.00 0.00 58.31 53.91 1jaz n LYS 207 Cb 0.18 -1.47 -0.12 0.00 -0.02 0.00 0.00 35.03 33.60 1jaz n LYS 207 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1jaz s LEU 208 N -1.80 3.23 -0.00 -0.35 1.43 0.23 -4.94 118.68 116.47 1jaz s LEU 208 Ca 0.31 -0.11 0.16 0.00 -1.03 0.00 0.00 54.13 53.46 1jaz s LEU 208 Cb 0.21 -1.76 -0.19 0.00 0.03 0.00 0.00 46.19 44.47 1jaz s LEU 208 CO 0.30 0.20 0.63 0.59 0.23 0.00 0.00 176.35 178.30 1jaz n ASN 209 N 3.30 0.84 -3.97 2.29 3.02 -1.26 -5.01 115.26 114.47 1jaz n ASN 209 Ca -0.18 -0.73 -0.09 0.00 -0.03 0.00 0.00 54.58 53.55 1jaz n ASN 209 Cb 0.53 1.13 -0.06 0.00 -0.61 0.00 0.00 39.78 40.77 1jaz n ASN 209 CO 0.00 0.00 0.00 -1.83 -2.62 0.00 0.00 177.26 172.81 1jaz s GLU 210 N -2.63 1.39 0.09 3.52 -1.05 -1.26 -4.95 118.70 113.80 1jaz s GLU 210 Ca 0.04 -1.20 0.09 0.00 -0.15 0.00 0.00 54.97 53.75 1jaz s GLU 210 Cb 0.12 0.44 -0.03 0.00 -0.44 0.00 0.00 34.13 34.21 1jaz s GLU 210 CO 0.67 -0.55 -0.24 -0.51 0.95 0.00 0.00 175.26 175.57 1jaz s LEU 211 N -2.99 2.25 0.45 1.83 1.43 -1.26 -5.11 118.68 115.28 1jaz s LEU 211 Ca 0.20 -0.66 -0.23 0.00 -1.03 0.00 0.00 54.13 52.41 1jaz s LEU 211 Cb 0.01 -1.12 -0.10 0.00 0.03 0.00 0.00 46.19 45.01 1jaz s LEU 211 CO 0.05 0.17 0.97 -2.65 0.23 0.00 0.00 176.35 175.12 1jaz n PRO 212 N 1.31 1.24 -2.43 1.29 -0.02 -1.26 -4.88 135.00 130.25 1jaz n PRO 212 Ca -0.18 0.45 -0.43 0.00 -2.02 0.00 0.00 63.50 61.32 1jaz n PRO 212 Cb 0.53 -2.04 -0.02 0.00 -0.02 0.00 0.00 33.50 31.95 1jaz n PRO 212 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 1jaz s LYS 213 N -2.11 3.89 -0.08 -0.52 1.02 -1.26 -4.86 119.74 115.82 1jaz s LYS 213 Ca 0.65 1.21 0.01 0.00 0.02 0.00 0.00 55.97 57.86 1jaz s LYS 213 Cb -0.53 -3.89 0.02 0.00 -0.52 0.00 0.00 37.83 32.91 1jaz s LYS 213 CO 0.55 -1.15 -0.11 0.08 -0.92 0.00 0.00 175.35 173.80 1jaz s VAL 214 N 4.43 1.12 0.36 3.17 1.01 -1.26 -1.22 120.40 128.01 1jaz s VAL 214 Ca 0.56 -0.43 0.08 0.00 0.00 0.00 0.00 61.98 62.19 1jaz s VAL 214 Cb -0.16 -1.06 -0.05 0.00 0.00 0.00 0.00 36.38 35.11 1jaz s VAL 214 CO 0.24 0.36 0.12 -0.83 0.00 0.00 0.00 175.10 174.99 1jaz s GLY 215 N 1.01 2.08 -0.10 4.51 0.00 -0.88 -4.99 107.32 108.95 1jaz s GLY 215 Ca -0.08 -1.94 0.03 0.00 0.00 0.00 0.00 44.72 42.73 1jaz s GLY 215 CO -0.00 -1.84 -0.19 -0.42 0.00 0.00 0.00 173.10 170.64 1jaz s ILE 216 N -2.50 1.74 0.15 0.90 1.01 -1.26 -0.44 121.20 120.80 1jaz s ILE 216 Ca 0.38 -0.82 0.10 0.00 0.00 0.00 0.00 60.65 60.31 1jaz s ILE 216 Cb -0.00 -1.53 -0.04 0.00 0.01 0.00 0.00 42.46 40.89 1jaz s ILE 216 CO 0.22 0.49 -0.21 0.68 0.00 0.00 0.00 174.94 176.11 1jaz s VAL 217 N 0.60 2.59 0.11 2.92 -7.23 -0.58 -4.96 120.40 113.85 1jaz s VAL 217 Ca -0.14 -1.73 0.03 0.00 -1.81 0.00 0.00 61.98 58.33 1jaz s VAL 217 Cb -0.17 -2.20 -0.04 0.00 0.56 0.00 0.00 36.38 34.53 1jaz s VAL 217 CO 0.04 0.01 0.14 -0.47 -0.31 0.00 0.00 175.10 174.52 1jaz s TYR 218 N -1.33 3.26 0.02 2.82 5.04 -1.26 -0.10 117.35 125.81 1jaz s TYR 218 Ca 0.18 0.08 0.08 0.00 -2.44 0.00 0.00 57.07 54.98 1jaz s TYR 218 Cb -0.09 -1.62 -0.02 0.00 0.35 0.00 0.00 41.96 40.57 1jaz s TYR 218 CO 0.09 0.53 -0.24 -0.80 -1.34 0.00 0.00 175.55 173.79 1jaz s ASN 219 N -2.71 2.86 0.06 4.32 0.01 -0.54 -4.90 114.94 114.05 1jaz s ASN 219 Ca 0.31 -0.52 -0.26 0.00 -0.71 0.00 0.00 52.86 51.68 1jaz s ASN 219 Cb -0.12 -0.27 0.09 0.00 0.41 0.00 0.00 41.25 41.36 1jaz s ASN 219 CO 0.24 0.25 1.19 -0.72 -1.51 0.00 0.00 177.10 176.54 1jaz s TYR 220 N -0.72 0.03 0.29 2.20 1.13 -1.26 -4.65 117.35 114.37 1jaz s TYR 220 Ca 0.10 -0.26 -0.30 0.00 -1.41 0.00 0.00 57.07 55.20 1jaz s TYR 220 Cb -0.09 0.61 -0.11 0.00 -1.10 0.00 0.00 41.96 41.27 1jaz s TYR 220 CO 0.01 -0.53 1.52 0.00 -2.51 0.00 0.00 175.55 174.04 1jaz s ALA 221 N -2.15 3.68 -1.75 9.51 0.00 -1.26 -2.20 121.76 127.59 1jaz s ALA 221 Ca 0.25 1.48 0.00 0.00 0.00 0.00 0.00 51.96 53.68 1jaz s ALA 221 Cb -0.01 -3.61 0.00 0.00 0.00 0.00 0.00 23.12 19.51 1jaz s ALA 221 CO 0.01 -0.90 0.00 -1.71 0.00 0.00 0.00 175.76 173.17 1jaz n ASN 222 N 2.01 -5.50 -4.72 0.00 5.15 -1.26 -4.90 115.26 106.03 1jaz n ASN 222 Ca 0.07 0.10 -0.42 0.00 -0.60 0.00 0.00 54.58 53.72 1jaz n ASN 222 Cb 0.39 -4.58 -0.03 0.00 -0.53 0.00 0.00 39.78 35.02 1jaz n ASN 222 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1jaz s ALA 223 N -2.91 3.91 0.39 5.20 0.00 -0.93 -4.95 121.76 122.47 1jaz s ALA 223 Ca 0.00 1.56 -0.26 0.00 0.00 0.00 0.00 51.96 53.26 1jaz s ALA 223 Cb 0.00 -3.70 -0.09 0.00 0.00 0.00 0.00 23.12 19.33 1jaz s ALA 223 CO 0.00 -0.96 1.26 0.45 0.00 0.00 0.00 175.76 176.52 1jaz s SER 224 N 1.38 6.45 0.00 0.00 0.15 -1.26 -4.61 113.70 115.81 1jaz s SER 224 Ca 0.75 2.57 0.24 0.00 0.70 0.00 0.00 55.95 60.22 1jaz s SER 224 Cb -0.49 -2.63 1.37 0.00 -1.71 0.00 0.00 66.02 62.55 1jaz s SER 224 CO 0.32 -0.74 1.89 -0.90 1.20 0.00 0.00 173.24 175.01 1jaz n ASP 225 N 0.24 0.25 -0.26 5.45 5.68 -1.26 -4.42 116.55 122.23 1jaz n ASP 225 Ca 0.03 -1.30 -0.07 0.00 -0.50 0.00 0.00 54.79 52.96 1jaz n ASP 225 Cb 0.44 -0.01 0.05 0.00 -1.14 0.00 0.00 41.12 40.46 1jaz n ASP 225 CO 0.00 0.00 0.00 -0.07 -1.33 0.00 0.00 177.20 175.80 1jaz h LEU 226 N 0.36 1.05 -0.07 -2.12 3.38 -1.96 -0.99 115.31 114.96 1jaz h LEU 226 Ca 0.00 -0.21 -0.00 0.00 0.09 0.00 0.00 57.88 57.76 1jaz h LEU 226 Cb 0.08 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 40.55 1jaz h LEU 226 CO 0.00 0.98 0.04 -0.65 0.09 0.00 0.00 178.44 178.91 1jaz h PRO 227 N 1.06 0.10 -0.41 1.13 0.11 -2.00 -0.56 132.00 131.43 1jaz h PRO 227 Ca 0.23 -0.01 0.05 0.00 0.11 0.00 0.00 66.00 66.38 1jaz h PRO 227 Cb 0.31 -0.02 -0.05 0.00 0.11 0.00 0.00 31.00 31.35 1jaz h PRO 227 CO -0.01 0.11 0.15 0.00 -0.21 0.00 0.00 178.00 178.04 1jaz h ALA 228 N 0.98 0.49 -0.71 -0.75 0.00 -1.83 -2.04 119.26 115.41 1jaz h ALA 228 Ca 0.03 0.05 0.01 0.00 0.00 0.00 0.00 54.91 54.99 1jaz h ALA 228 Cb 0.04 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 1jaz h ALA 228 CO -0.00 -0.24 0.47 0.87 0.00 0.00 0.00 179.25 180.34 1jaz h LYS 229 N 0.31 0.93 -0.23 0.00 1.57 -0.91 -1.40 116.57 116.84 1jaz h LYS 229 Ca 0.19 -0.06 -0.06 0.00 -1.87 0.00 0.00 60.65 58.85 1jaz h LYS 229 Cb 0.18 -0.21 -0.01 0.00 0.08 0.00 0.00 32.23 32.26 1jaz h LYS 229 CO -0.19 0.62 -0.13 0.00 -0.57 0.00 0.00 179.45 179.18 1jaz h ALA 230 N 1.26 1.36 -0.16 3.86 0.00 -0.74 0.52 119.26 125.35 1jaz h ALA 230 Ca 0.26 -0.24 -0.04 0.00 0.00 0.00 0.00 54.91 54.89 1jaz h ALA 230 Cb -0.11 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 17.56 1jaz h ALA 230 CO -0.06 0.44 -0.05 -0.07 0.00 0.00 0.00 179.25 179.51 1jaz h LEU 231 N 0.36 0.33 -0.56 0.00 3.38 -0.60 -1.48 115.31 116.74 1jaz h LEU 231 Ca 0.07 -0.38 0.01 0.00 0.09 0.00 0.00 57.88 57.67 1jaz h LEU 231 Cb 0.44 -0.09 -0.03 0.00 0.09 0.00 0.00 40.66 41.07 1jaz h LEU 231 CO 0.03 0.64 0.36 0.58 0.09 0.00 0.00 178.44 180.13 1jaz h VAL 232 N 0.02 1.11 0.00 1.22 2.07 -1.06 -1.98 116.25 117.63 1jaz h VAL 232 Ca 0.04 -0.25 -0.04 0.00 0.82 0.00 0.00 66.70 67.28 1jaz h VAL 232 Cb 0.50 0.33 -0.01 0.00 -1.52 0.00 0.00 31.29 30.59 1jaz h VAL 232 CO 0.02 0.13 -0.17 0.44 0.02 0.00 0.00 177.57 178.01 1jaz h ASP 233 N 0.72 0.00 -0.22 0.57 3.32 -0.61 0.17 116.42 120.37 1jaz h ASP 233 Ca 0.21 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.26 1jaz h ASP 233 Cb -0.04 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.51 1jaz h ASP 233 CO -0.07 0.17 0.00 0.00 -1.72 0.00 0.00 179.24 177.62 1jaz n ALA 234 N -2.38 2.53 -3.21 3.45 0.00 -0.58 -4.88 120.51 115.44 1jaz n ALA 234 Ca -0.02 -0.42 -0.20 0.00 0.00 0.00 0.00 53.44 52.80 1jaz n ALA 234 Cb 0.26 -0.99 0.05 0.00 0.00 0.00 0.00 19.45 18.77 1jaz n ALA 234 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1jaz n GLY 235 N 0.76 -0.35 3.78 0.00 0.00 0.61 -4.96 105.19 105.04 1jaz n GLY 235 Ca 0.08 0.07 -0.41 0.00 0.00 0.00 0.00 46.02 45.76 1jaz n GLY 235 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1jaz s TYR 236 N -3.19 2.59 0.21 1.61 1.51 -0.79 -4.92 117.35 114.37 1jaz s TYR 236 Ca 0.40 1.17 0.04 0.00 -1.01 0.00 0.00 57.07 57.67 1jaz s TYR 236 Cb -0.18 -4.02 0.17 0.00 -0.11 0.00 0.00 41.96 37.82 1jaz s TYR 236 CO 0.49 -2.99 1.50 -0.44 -1.11 0.00 0.00 175.55 173.01 1jaz h ASP 237 N 3.00 0.25 -5.04 2.29 3.32 -1.61 -3.46 116.42 115.18 1jaz h ASP 237 Ca -0.51 -0.16 -0.05 0.00 0.02 0.00 0.00 57.03 56.32 1jaz h ASP 237 Cb 1.24 -0.07 -0.15 0.00 0.22 0.00 0.00 39.33 40.57 1jaz h ASP 237 CO 0.64 0.87 0.00 -0.83 -1.72 0.00 0.00 179.24 178.20 1jaz s GLY 238 N -4.39 -0.38 -0.02 2.75 0.00 -0.36 -1.97 107.32 102.94 1jaz s GLY 238 Ca -0.03 0.32 0.01 0.00 0.00 0.00 0.00 44.72 45.01 1jaz s GLY 238 CO 0.81 0.03 -0.04 -0.42 0.00 0.00 0.00 173.10 173.48 1jaz s ILE 239 N -3.09 0.39 -0.18 0.90 1.01 -0.11 -2.08 121.20 118.05 1jaz s ILE 239 Ca -0.02 -0.10 -0.06 0.00 0.00 0.00 0.00 60.65 60.47 1jaz s ILE 239 Cb 0.00 -0.40 -0.04 0.00 0.01 0.00 0.00 42.46 42.03 1jaz s ILE 239 CO -0.07 0.16 0.03 -0.69 0.00 0.00 0.00 174.94 174.38 1jaz s VAL 240 N 0.55 4.53 -0.28 2.92 1.01 0.42 -1.57 120.40 127.98 1jaz s VAL 240 Ca -0.06 -0.13 -0.14 0.00 0.00 0.00 0.00 61.98 61.65 1jaz s VAL 240 Cb -0.10 -3.03 -0.04 0.00 0.00 0.00 0.00 36.38 33.22 1jaz s VAL 240 CO -0.00 0.47 0.34 -0.55 0.00 0.00 0.00 175.10 175.36 1jaz s SER 241 N 0.40 6.21 -0.98 3.32 0.15 0.23 -1.53 113.70 121.49 1jaz s SER 241 Ca 0.01 0.20 -0.21 0.00 0.70 0.00 0.00 55.95 56.65 1jaz s SER 241 Cb -0.13 -2.20 0.08 0.00 -1.71 0.00 0.00 66.02 62.07 1jaz s SER 241 CO 0.01 -0.18 1.32 0.00 1.20 0.00 0.00 173.24 175.59 1jaz s ALA 242 N 2.02 2.97 0.92 5.45 0.00 0.86 -0.90 121.76 133.07 1jaz s ALA 242 Ca 0.13 -2.44 -0.11 0.00 0.00 0.00 0.00 51.96 49.54 1jaz s ALA 242 Cb -0.16 -4.34 0.20 0.00 0.00 0.00 0.00 23.12 18.82 1jaz s ALA 242 CO 0.10 -3.37 1.23 0.41 0.00 0.00 0.00 175.76 174.14 1jaz n GLY 243 N 6.33 -0.82 3.87 0.00 0.00 -0.92 -1.46 105.19 112.19 1jaz n GLY 243 Ca 0.29 -1.81 -0.33 0.00 0.00 0.00 0.00 46.02 44.17 1jaz n GLY 243 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1jaz s VAL 244 N -3.66 5.24 0.00 1.61 -7.23 -0.53 0.33 120.40 116.16 1jaz s VAL 244 Ca 0.73 -0.24 0.00 0.00 -1.81 0.00 0.00 61.98 60.65 1jaz s VAL 244 Cb -0.03 -3.44 0.00 0.00 0.56 0.00 0.00 36.38 33.47 1jaz s VAL 244 CO 0.50 0.32 0.00 0.61 -0.31 0.00 0.00 175.10 176.22 1jaz n GLY 245 N 0.97 2.69 2.76 2.32 0.00 -1.26 -0.71 105.19 111.96 1jaz n GLY 245 Ca -0.11 -0.29 -0.40 0.00 0.00 0.00 0.00 46.02 45.22 1jaz n GLY 245 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1jaz n ASN 246 N 0.88 4.34 -1.05 1.61 2.85 -1.26 -4.50 115.26 118.14 1jaz n ASN 246 Ca 0.00 -2.70 -0.14 0.00 -0.11 0.00 0.00 54.58 51.64 1jaz n ASN 246 Cb 0.00 -1.43 -0.06 0.00 1.24 0.00 0.00 39.78 39.53 1jaz n ASN 246 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1jaz n GLY 247 N 4.11 1.37 3.72 8.20 0.00 -1.19 -4.67 105.19 116.73 1jaz n GLY 247 Ca 0.55 -0.13 -0.29 0.00 0.00 0.00 0.00 46.02 46.14 1jaz n GLY 247 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1jaz s ASN 248 N -2.63 3.39 0.01 1.61 -0.87 0.11 -4.72 114.94 111.85 1jaz s ASN 248 Ca 0.00 1.37 0.05 0.00 -1.57 0.00 0.00 52.86 52.72 1jaz s ASN 248 Cb 0.00 -2.05 -0.02 0.00 -0.02 0.00 0.00 41.25 39.16 1jaz s ASN 248 CO 0.00 -2.67 -0.16 -0.76 -2.57 0.00 0.00 177.10 170.93 1jaz s LEU 249 N -6.22 2.08 0.54 0.60 1.43 -1.26 -1.46 118.68 114.39 1jaz s LEU 249 Ca 0.64 -0.36 -0.21 0.00 -1.03 0.00 0.00 54.13 53.17 1jaz s LEU 249 Cb -0.18 -0.80 -0.05 0.00 0.03 0.00 0.00 46.19 45.19 1jaz s LEU 249 CO 0.57 0.16 1.27 -0.47 0.23 0.00 0.00 176.35 178.11 1jaz s TYR 250 N -0.53 2.45 0.18 0.29 5.04 -1.26 -4.71 117.35 118.82 1jaz s TYR 250 Ca 0.05 1.45 -0.21 0.00 -2.44 0.00 0.00 57.07 55.92 1jaz s TYR 250 Cb -0.07 -3.62 0.11 0.00 0.35 0.00 0.00 41.96 38.73 1jaz s TYR 250 CO 0.00 -2.39 1.58 1.57 -1.34 0.00 0.00 175.55 174.97 1jaz h LYS 251 N 1.46 -0.17 -0.50 4.97 2.10 -1.96 -0.51 116.57 121.96 1jaz h LYS 251 Ca -0.50 0.01 -0.04 0.00 -2.00 0.00 0.00 60.65 58.12 1jaz h LYS 251 Cb 1.29 0.04 -0.02 0.00 -0.90 0.00 0.00 32.23 32.63 1jaz h LYS 251 CO 0.57 -0.11 0.15 0.77 -2.00 0.00 0.00 179.45 178.83 1jaz h SER 252 N -0.17 0.67 -0.28 7.07 0.02 -1.90 0.30 113.55 119.25 1jaz h SER 252 Ca 0.22 -0.10 -0.18 0.00 -0.84 0.00 0.00 61.79 60.89 1jaz h SER 252 Cb 0.55 -0.17 0.00 0.00 0.14 0.00 0.00 62.40 62.92 1jaz h SER 252 CO -0.68 0.65 -0.53 0.58 -1.14 0.00 0.00 176.83 175.71 1jaz h VAL 253 N 0.72 1.28 0.20 2.27 2.07 -1.45 -2.38 116.25 118.95 1jaz h VAL 253 Ca 0.17 -1.71 0.01 0.00 0.82 0.00 0.00 66.70 65.99 1jaz h VAL 253 Cb 0.22 1.65 -0.03 0.00 -1.52 0.00 0.00 31.29 31.60 1jaz h VAL 253 CO -0.01 0.56 -0.35 0.15 0.02 0.00 0.00 177.57 177.94 1jaz h PHE 254 N 0.64 -0.94 -0.58 1.57 3.04 -0.55 -0.44 116.94 119.67 1jaz h PHE 254 Ca 0.01 0.02 0.11 0.00 3.98 0.00 0.00 57.97 62.09 1jaz h PHE 254 Cb 1.14 0.39 -0.08 0.00 2.56 0.00 0.00 35.95 39.95 1jaz h PHE 254 CO 0.08 -0.46 0.13 -0.44 -2.02 0.00 0.00 178.31 175.59 1jaz h ASP 255 N -0.62 0.01 -0.34 0.41 3.32 -0.92 0.24 116.42 118.52 1jaz h ASP 255 Ca 0.01 0.11 -0.07 0.00 0.02 0.00 0.00 57.03 57.10 1jaz h ASP 255 Cb 0.62 0.14 -0.01 0.00 0.22 0.00 0.00 39.33 40.30 1jaz h ASP 255 CO -0.16 0.02 -0.07 0.74 -1.72 0.00 0.00 179.24 178.06 1jaz h THR 256 N 0.26 1.28 -0.05 0.35 2.02 -1.15 -2.83 112.91 112.79 1jaz h THR 256 Ca 0.30 -1.11 -0.15 0.00 0.77 0.00 0.00 66.41 66.23 1jaz h THR 256 Cb 0.44 1.31 -0.01 0.00 -1.74 0.00 0.00 68.15 68.15 1jaz h THR 256 CO -0.38 0.36 -0.63 -0.07 0.37 0.00 0.00 175.52 175.17 1jaz h LEU 257 N 0.42 0.23 -0.23 2.58 3.38 -0.42 -1.89 115.31 119.39 1jaz h LEU 257 Ca 0.09 -0.14 0.02 0.00 0.09 0.00 0.00 57.88 57.94 1jaz h LEU 257 Cb 0.56 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 41.22 1jaz h LEU 257 CO 0.03 0.80 0.08 0.00 0.09 0.00 0.00 178.44 179.45 1jaz h ALA 258 N 1.20 0.26 -0.52 1.53 0.00 -0.51 0.23 119.26 121.45 1jaz h ALA 258 Ca -0.01 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 1jaz h ALA 258 Cb 1.14 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.91 1jaz h ALA 258 CO 0.10 -0.33 0.27 1.15 0.00 0.00 0.00 179.25 180.43 1jaz h THR 259 N 0.20 1.19 -0.54 0.00 2.02 -1.35 -1.64 112.91 112.78 1jaz h THR 259 Ca 0.10 -0.50 0.04 0.00 0.77 0.00 0.00 66.41 66.83 1jaz h THR 259 Cb 0.06 0.57 -0.04 0.00 -1.74 0.00 0.00 68.15 66.99 1jaz h THR 259 CO -0.09 0.20 0.29 0.00 0.37 0.00 0.00 175.52 176.29 1jaz h ALA 260 N 1.11 0.70 -0.10 6.16 0.00 -0.87 -1.50 119.26 124.76 1jaz h ALA 260 Ca 0.18 0.01 -0.11 0.00 0.00 0.00 0.00 54.91 54.99 1jaz h ALA 260 Cb 0.08 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 1jaz h ALA 260 CO -0.03 -0.04 -0.44 0.00 0.00 0.00 0.00 179.25 178.74 1jaz h ALA 261 N 1.28 1.07 0.00 0.00 0.00 -0.21 -0.80 119.26 120.60 1jaz h ALA 261 Ca 0.24 -0.43 -0.02 0.00 0.00 0.00 0.00 54.91 54.69 1jaz h ALA 261 Cb 0.12 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.82 1jaz h ALA 261 CO -0.15 0.61 -0.10 0.87 0.00 0.00 0.00 179.25 180.48 1jaz h LYS 262 N 0.20 0.00 -0.54 0.00 1.57 -0.92 -3.16 116.57 113.71 1jaz h LYS 262 Ca 0.01 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 1jaz h LYS 262 Cb 0.86 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.17 1jaz h LYS 262 CO 0.07 0.10 0.00 0.25 -0.57 0.00 0.00 179.45 179.30 1jaz n THR 263 N -3.17 0.78 0.00 -0.16 -2.24 -0.56 -4.96 114.28 103.97 1jaz n THR 263 Ca 0.02 -0.89 0.00 0.00 -2.27 0.00 0.00 64.05 60.91 1jaz n THR 263 Cb 0.46 0.71 0.00 0.00 -2.10 0.00 0.00 70.33 69.40 1jaz n THR 263 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1jaz n GLY 264 N 1.43 1.28 3.70 3.38 0.00 -0.91 -5.05 105.19 109.03 1jaz n GLY 264 Ca 0.21 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.81 1jaz n GLY 264 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1jaz s THR 265 N -2.00 4.93 0.11 2.61 2.01 -0.41 -4.98 115.64 117.90 1jaz s THR 265 Ca 0.00 1.77 -0.31 0.00 0.31 0.00 0.00 61.69 63.46 1jaz s THR 265 Cb 0.00 -4.19 -0.07 0.00 0.01 0.00 0.00 72.50 68.25 1jaz s THR 265 CO 0.00 0.16 1.29 0.00 -0.69 0.00 0.00 174.62 175.38 1jaz s ALA 266 N 1.21 3.49 -0.12 7.40 0.00 -0.83 -3.90 121.76 129.00 1jaz s ALA 266 Ca 0.44 1.00 -0.00 0.00 0.00 0.00 0.00 51.96 53.40 1jaz s ALA 266 Cb -0.19 -3.48 0.02 0.00 0.00 0.00 0.00 23.12 19.47 1jaz s ALA 266 CO 0.21 -0.51 -0.10 0.08 0.00 0.00 0.00 175.76 175.44 1jaz s VAL 267 N 0.84 1.20 -0.18 0.00 1.01 -1.26 -0.93 120.40 121.08 1jaz s VAL 267 Ca 0.60 -0.40 -0.04 0.00 0.00 0.00 0.00 61.98 62.15 1jaz s VAL 267 Cb -0.34 -1.18 -0.02 0.00 0.00 0.00 0.00 36.38 34.84 1jaz s VAL 267 CO 0.31 0.40 -0.04 -0.69 0.00 0.00 0.00 175.10 175.08 1jaz s VAL 268 N 1.62 3.61 -0.35 2.92 1.01 -0.61 -0.65 120.40 127.95 1jaz s VAL 268 Ca 0.05 -0.44 -0.23 0.00 0.00 0.00 0.00 61.98 61.36 1jaz s VAL 268 Cb -0.13 -2.61 0.01 0.00 0.00 0.00 0.00 36.38 33.65 1jaz s VAL 268 CO -0.09 0.46 0.75 -0.13 0.00 0.00 0.00 175.10 176.09 1jaz s ARG 269 N 0.90 3.77 0.00 2.72 0.52 0.15 -0.60 118.95 126.42 1jaz s ARG 269 Ca -0.00 0.31 0.00 0.00 -0.52 0.00 0.00 55.73 55.51 1jaz s ARG 269 Cb -0.15 -3.79 0.00 0.00 0.52 0.00 0.00 34.95 31.53 1jaz s ARG 269 CO 0.01 -0.80 0.00 0.45 0.02 0.00 0.00 175.30 174.98 1jaz n SER 270 N 6.31 1.63 -3.75 0.23 2.88 -0.08 -0.60 113.62 120.24 1jaz n SER 270 Ca 0.02 0.00 -0.13 0.00 -1.33 0.00 0.00 58.87 57.43 1jaz n SER 270 Cb 0.48 0.00 -0.10 0.00 -0.75 0.00 0.00 64.21 63.85 1jaz n SER 270 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1jaz s SER 271 N 0.71 -0.31 0.54 -3.46 0.15 -1.25 -2.17 113.70 107.91 1jaz s SER 271 Ca 0.00 0.47 0.35 0.00 0.70 0.00 0.00 55.95 57.47 1jaz s SER 271 Cb 0.00 0.56 1.57 0.00 -1.71 0.00 0.00 66.02 66.44 1jaz s SER 271 CO 0.00 -0.27 2.04 0.08 1.20 0.00 0.00 173.24 176.29 1jaz h ARG 272 N 4.81 0.00 -6.44 5.44 0.11 -0.30 -3.39 114.38 114.61 1jaz h ARG 272 Ca -0.28 0.00 -0.54 0.00 0.10 0.00 0.00 59.98 59.27 1jaz h ARG 272 Cb 1.18 0.00 0.01 0.00 1.11 0.00 0.00 29.97 32.27 1jaz h ARG 272 CO 0.33 0.00 0.84 0.08 0.10 0.00 0.00 179.97 181.32 1jaz s VAL 273 N -3.74 3.44 0.50 0.08 1.01 -1.26 -4.90 120.40 115.53 1jaz s VAL 273 Ca -0.00 0.91 0.30 0.00 0.00 0.00 0.00 61.98 63.20 1jaz s VAL 273 Cb 0.10 -3.59 0.33 0.00 0.00 0.00 0.00 36.38 33.22 1jaz s VAL 273 CO 0.49 0.02 2.17 1.55 0.00 0.00 0.00 175.10 179.33 1jaz h PRO 274 N 7.62 0.00 -4.85 2.72 0.13 -2.00 -3.44 132.00 132.18 1jaz h PRO 274 Ca -0.40 0.00 -0.29 0.00 -0.87 0.00 0.00 66.00 64.44 1jaz h PRO 274 Cb 1.19 0.00 -0.15 0.00 0.13 0.00 0.00 31.00 32.18 1jaz h PRO 274 CO 0.90 0.06 -0.68 0.95 -0.23 0.00 0.00 178.00 179.00 1jaz s THR 275 N -4.34 0.80 0.00 1.56 -4.23 -1.26 -5.00 115.64 103.18 1jaz s THR 275 Ca -0.04 -1.99 0.00 0.00 -1.18 0.00 0.00 61.69 58.48 1jaz s THR 275 Cb 0.14 -2.01 0.00 0.00 1.34 0.00 0.00 72.50 71.97 1jaz s THR 275 CO 0.55 -0.59 0.00 0.61 -0.54 0.00 0.00 174.62 174.66 1jaz n GLY 276 N -0.21 -0.75 3.87 3.99 0.00 -1.26 -5.01 105.19 105.82 1jaz n GLY 276 Ca -0.08 -1.62 -0.32 0.00 0.00 0.00 0.00 46.02 44.00 1jaz n GLY 276 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1jaz s ALA 277 N -3.00 3.51 -0.47 4.61 0.00 -1.26 -4.57 121.76 120.58 1jaz s ALA 277 Ca 0.00 -0.20 -0.22 0.00 0.00 0.00 0.00 51.96 51.54 1jaz s ALA 277 Cb 0.00 -2.51 0.03 0.00 0.00 0.00 0.00 23.12 20.64 1jaz s ALA 277 CO 0.00 0.47 0.72 0.99 0.00 0.00 0.00 175.76 177.94 1jaz s THR 278 N -1.85 4.72 0.40 0.00 2.01 -0.28 -4.87 115.64 115.77 1jaz s THR 278 Ca 0.49 0.13 -0.06 0.00 0.31 0.00 0.00 61.69 62.56 1jaz s THR 278 Cb -0.11 -4.30 -0.05 0.00 0.01 0.00 0.00 72.50 68.05 1jaz s THR 278 CO 0.20 -0.74 0.69 0.42 -0.69 0.00 0.00 174.62 174.51 1jaz s THR 279 N 3.08 4.94 0.51 -0.82 -4.23 -1.26 -2.38 115.64 115.47 1jaz s THR 279 Ca 0.25 0.17 -0.18 0.00 -1.18 0.00 0.00 61.69 60.75 1jaz s THR 279 Cb -0.14 -3.80 -0.08 0.00 1.34 0.00 0.00 72.50 69.82 1jaz s THR 279 CO 0.19 -0.60 0.99 -1.10 -0.54 0.00 0.00 174.62 173.56 1jaz s GLN 280 N -4.18 3.89 -1.02 3.99 -0.21 -1.26 -4.07 119.66 116.80 1jaz s GLN 280 Ca 0.46 1.06 0.00 0.00 0.02 0.00 0.00 55.36 56.90 1jaz s GLN 280 Cb -0.10 -2.12 0.00 0.00 1.00 0.00 0.00 33.01 31.78 1jaz s GLN 280 CO 0.37 -0.32 0.00 -0.40 -2.12 0.00 0.00 175.29 172.82 1jaz n ASP 281 N -1.42 -3.69 0.00 5.90 5.75 -1.26 -4.83 116.55 117.00 1jaz n ASP 281 Ca 0.07 0.22 0.00 0.00 -0.01 0.00 0.00 54.79 55.07 1jaz n ASP 281 Cb 0.54 -3.18 0.00 0.00 -1.03 0.00 0.00 41.12 37.45 1jaz n ASP 281 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1jaz n ALA 282 N -1.99 0.51 -0.07 2.12 0.00 -1.26 -4.89 120.51 114.93 1jaz n ALA 282 Ca -0.14 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.16 1jaz n ALA 282 Cb 0.58 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.98 1jaz n ALA 282 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1jaz h GLU 283 N 0.00 0.65 -6.72 0.00 4.39 -1.83 -3.45 114.58 107.61 1jaz h GLU 283 Ca 0.00 -0.40 -0.67 0.00 0.34 0.00 0.00 59.36 58.64 1jaz h GLU 283 Cb 0.00 0.04 -0.23 0.00 -0.10 0.00 0.00 28.75 28.46 1jaz h GLU 283 CO 0.00 1.01 -0.86 0.08 -1.16 0.00 0.00 179.01 178.08 1jaz s VAL 284 N -4.14 2.12 -1.09 3.13 1.01 -1.26 -5.06 120.40 115.11 1jaz s VAL 284 Ca -0.12 -1.62 -0.19 0.00 0.00 0.00 0.00 61.98 60.05 1jaz s VAL 284 Cb 0.08 -1.87 0.10 0.00 0.00 0.00 0.00 36.38 34.69 1jaz s VAL 284 CO 0.83 0.13 1.43 -0.62 0.00 0.00 0.00 175.10 176.87 1jaz s ASP 285 N -1.82 6.72 0.19 3.32 2.15 -1.26 -4.05 116.67 121.92 1jaz s ASP 285 Ca 0.12 -2.12 -0.13 0.00 0.43 0.00 0.00 52.55 50.86 1jaz s ASP 285 Cb -0.10 -2.50 0.10 0.00 -0.30 0.00 0.00 42.92 40.13 1jaz s ASP 285 CO 0.05 -1.17 1.86 0.44 -0.17 0.00 0.00 175.17 176.17 1jaz h ASP 286 N 8.55 0.72 -0.69 -0.34 3.32 -1.97 -2.88 116.42 123.13 1jaz h ASP 286 Ca 0.27 -0.02 -0.03 0.00 0.02 0.00 0.00 57.03 57.27 1jaz h ASP 286 Cb 0.96 -0.18 -0.03 0.00 0.22 0.00 0.00 39.33 40.30 1jaz h ASP 286 CO 1.32 0.52 0.32 0.00 -1.72 0.00 0.00 179.24 179.68 1jaz h ALA 287 N 1.23 0.89 -0.85 3.45 0.00 -1.89 0.40 119.26 122.49 1jaz h ALA 287 Ca 0.23 -0.15 0.21 0.00 0.00 0.00 0.00 54.91 55.19 1jaz h ALA 287 Cb -0.10 -0.27 -0.12 0.00 0.00 0.00 0.00 17.79 17.30 1jaz h ALA 287 CO -0.05 0.47 0.29 -0.22 0.00 0.00 0.00 179.25 179.74 1jaz h LYS 288 N 0.97 0.31 0.00 0.00 3.64 -1.91 -3.09 116.57 116.48 1jaz h LYS 288 Ca 0.24 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.60 1jaz h LYS 288 Cb 0.14 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 31.89 1jaz h LYS 288 CO -0.03 0.21 -1.42 0.66 -2.27 0.00 0.00 179.45 176.60 1jaz n TYR 289 N -5.12 0.00 -0.75 1.91 4.02 -0.68 -4.99 117.16 111.55 1jaz n TYR 289 Ca 0.20 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 58.09 1jaz n TYR 289 Cb 0.60 -0.24 0.00 0.00 -0.02 0.00 0.00 39.34 39.68 1jaz n TYR 289 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1jaz n GLY 290 N 1.43 0.77 3.88 2.72 0.00 0.13 -3.93 105.19 110.19 1jaz n GLY 290 Ca -0.00 -0.59 -0.30 0.00 0.00 0.00 0.00 46.02 45.12 1jaz n GLY 290 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1jaz s PHE 291 N -2.00 3.54 -0.09 1.61 0.08 -0.69 -4.46 117.98 115.98 1jaz s PHE 291 Ca 0.00 1.12 0.04 0.00 0.12 0.00 0.00 56.93 58.21 1jaz s PHE 291 Cb 0.00 -2.54 -0.01 0.00 -0.57 0.00 0.00 43.02 39.91 1jaz s PHE 291 CO 0.00 -0.36 -0.23 0.08 -0.10 0.00 0.00 175.22 174.62 1jaz s VAL 292 N -2.74 2.22 -0.00 -0.44 1.01 0.18 -4.57 120.40 116.05 1jaz s VAL 292 Ca 0.52 -0.98 -0.22 0.00 0.00 0.00 0.00 61.98 61.30 1jaz s VAL 292 Cb -0.10 -1.84 -0.05 0.00 0.00 0.00 0.00 36.38 34.38 1jaz s VAL 292 CO 0.41 0.56 0.64 0.00 0.00 0.00 0.00 175.10 176.71 1jaz s ALA 293 N 0.11 3.45 -1.60 5.51 0.00 -1.26 0.35 121.76 128.31 1jaz s ALA 293 Ca -0.11 0.09 0.30 0.00 0.00 0.00 0.00 51.96 52.24 1jaz s ALA 293 Cb -0.16 -2.82 1.39 0.00 0.00 0.00 0.00 23.12 21.54 1jaz s ALA 293 CO 0.06 0.12 1.96 -1.13 0.00 0.00 0.00 175.76 176.77 1jaz n SER 294 N 2.86 0.26 0.00 0.00 3.41 0.23 -4.90 113.62 115.49 1jaz n SER 294 Ca -0.05 -0.46 0.00 0.00 -0.26 0.00 0.00 58.87 58.10 1jaz n SER 294 Cb 0.51 -0.14 0.00 0.00 -0.26 0.00 0.00 64.21 64.31 1jaz n SER 294 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1jaz n GLY 295 N 1.26 1.69 0.00 5.00 0.00 -1.00 -2.27 105.19 109.87 1jaz n GLY 295 Ca 0.15 -0.56 0.08 0.00 0.00 0.00 0.00 46.02 45.69 1jaz n GLY 295 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1jaz n THR 296 N 0.00 0.33 -2.25 2.61 -2.24 -1.26 -1.12 114.28 110.34 1jaz n THR 296 Ca 0.00 0.08 -0.43 0.00 -2.27 0.00 0.00 64.05 61.43 1jaz n THR 296 Cb 0.00 -0.83 -0.02 0.00 -2.10 0.00 0.00 70.33 67.38 1jaz n THR 296 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1jaz s LEU 297 N -2.33 4.05 0.98 3.22 1.43 -0.96 -4.86 118.68 120.21 1jaz s LEU 297 Ca 0.19 1.66 -0.12 0.00 -1.03 0.00 0.00 54.13 54.82 1jaz s LEU 297 Cb 0.11 -3.54 0.18 0.00 0.03 0.00 0.00 46.19 42.97 1jaz s LEU 297 CO 0.21 -1.02 1.10 0.54 0.23 0.00 0.00 176.35 177.42 1jaz s ASN 298 N 3.12 2.77 0.15 2.29 2.20 -1.26 -4.49 114.94 119.72 1jaz s ASN 298 Ca 0.64 1.15 -0.17 0.00 -0.94 0.00 0.00 52.86 53.54 1jaz s ASN 298 Cb -0.24 -1.80 0.04 0.00 -2.00 0.00 0.00 41.25 37.25 1jaz s ASN 298 CO 0.24 -3.04 1.75 -0.65 -2.94 0.00 0.00 177.10 172.46 1jaz h PRO 299 N -1.83 0.25 -0.34 3.55 0.11 -1.93 0.42 132.00 132.23 1jaz h PRO 299 Ca -0.54 -0.02 -0.06 0.00 0.11 0.00 0.00 66.00 65.50 1jaz h PRO 299 Cb 1.33 -0.06 -0.02 0.00 0.11 0.00 0.00 31.00 32.36 1jaz h PRO 299 CO 0.58 0.17 -0.03 -0.56 -0.21 0.00 0.00 178.00 177.95 1jaz h GLN 300 N 0.26 0.55 -0.20 1.05 -0.00 -1.96 -0.99 115.11 113.81 1jaz h GLN 300 Ca 0.15 -0.13 -0.12 0.00 -0.00 0.00 0.00 58.65 58.56 1jaz h GLN 300 Cb 0.12 -0.07 -0.00 0.00 -0.00 0.00 0.00 27.48 27.53 1jaz h GLN 300 CO -0.15 0.60 -0.33 0.87 -0.00 0.00 0.00 178.83 179.82 1jaz h LYS 301 N 0.52 0.57 -0.89 0.06 1.57 -1.50 -2.96 116.57 113.95 1jaz h LYS 301 Ca 0.11 -0.35 0.13 0.00 -1.87 0.00 0.00 60.65 58.67 1jaz h LYS 301 Cb 0.38 0.04 -0.09 0.00 0.08 0.00 0.00 32.23 32.64 1jaz h LYS 301 CO 0.02 0.96 0.51 0.00 -0.57 0.00 0.00 179.45 180.36 1jaz h ALA 302 N 0.61 1.35 -0.81 3.86 0.00 -0.01 -0.27 119.26 124.00 1jaz h ALA 302 Ca 0.02 0.06 0.03 0.00 0.00 0.00 0.00 54.91 55.02 1jaz h ALA 302 Cb 0.91 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 18.56 1jaz h ALA 302 CO 0.07 0.02 0.52 -0.09 0.00 0.00 0.00 179.25 179.77 1jaz h ARG 303 N 0.76 0.97 -0.47 0.00 2.43 -1.04 0.10 114.38 117.13 1jaz h ARG 303 Ca 0.47 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.58 1jaz h ARG 303 Cb 0.58 -0.22 -0.02 0.00 -0.42 0.00 0.00 29.97 29.89 1jaz h ARG 303 CO -0.32 0.64 0.30 0.28 -1.51 0.00 0.00 179.97 179.37 1jaz h VAL 304 N 1.00 1.13 -0.04 0.20 2.07 -0.91 -1.14 116.25 118.56 1jaz h VAL 304 Ca 0.32 -0.25 -0.21 0.00 0.82 0.00 0.00 66.70 67.39 1jaz h VAL 304 Cb 0.01 0.46 -0.00 0.00 -1.52 0.00 0.00 31.29 30.23 1jaz h VAL 304 CO -0.11 0.12 -0.84 0.25 0.02 0.00 0.00 177.57 177.01 1jaz h LEU 305 N 0.63 0.52 -0.75 2.57 5.85 -0.76 -2.81 115.31 120.55 1jaz h LEU 305 Ca 0.17 -0.38 -0.11 0.00 0.84 0.00 0.00 57.88 58.40 1jaz h LEU 305 Cb -0.06 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 40.81 1jaz h LEU 305 CO -0.04 1.15 -0.26 0.25 -0.34 0.00 0.00 178.44 179.20 1jaz h LEU 306 N 0.26 0.68 -0.56 2.25 5.85 -0.66 0.16 115.31 123.30 1jaz h LEU 306 Ca -0.05 -0.25 0.00 0.00 0.84 0.00 0.00 57.88 58.42 1jaz h LEU 306 Cb 1.45 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 42.26 1jaz h LEU 306 CO 0.14 0.92 0.36 1.56 -0.34 0.00 0.00 178.44 181.08 1jaz h GLN 307 N 0.58 0.74 -0.30 1.25 4.20 -1.16 -0.68 115.11 119.74 1jaz h GLN 307 Ca 0.08 -0.05 -0.10 0.00 0.06 0.00 0.00 58.65 58.63 1jaz h GLN 307 Cb 0.75 -0.16 -0.01 0.00 0.30 0.00 0.00 27.48 28.36 1jaz h GLN 307 CO 0.06 0.51 -0.20 -0.07 -0.67 0.00 0.00 178.83 178.46 1jaz h LEU 308 N 0.75 0.70 -1.01 1.46 4.07 -1.20 -2.87 115.31 117.22 1jaz h LEU 308 Ca 0.20 -0.43 0.03 0.00 0.08 0.00 0.00 57.88 57.76 1jaz h LEU 308 Cb -0.06 -0.19 -0.06 0.00 1.08 0.00 0.00 40.66 41.43 1jaz h LEU 308 CO -0.04 0.98 0.66 0.00 -1.08 0.00 0.00 178.44 178.96 1jaz h ALA 309 N 0.74 1.32 0.00 1.53 0.00 -0.47 -0.05 119.26 122.33 1jaz h ALA 309 Ca 0.06 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1jaz h ALA 309 Cb 0.74 -0.38 0.00 0.00 0.00 0.00 0.00 17.79 18.16 1jaz h ALA 309 CO 0.05 0.60 0.00 1.28 0.00 0.00 0.00 179.25 181.18 1jaz n LEU 310 N -4.42 0.00 -0.05 0.00 4.77 -0.28 -0.29 117.00 116.73 1jaz n LEU 310 Ca 0.13 0.49 0.13 0.00 -0.03 0.00 0.00 56.01 56.73 1jaz n LEU 310 Cb 0.07 -0.49 0.49 0.00 -2.33 0.00 0.00 43.42 41.16 1jaz n LEU 310 CO 0.35 -0.29 0.75 0.35 -1.33 0.00 0.00 177.39 177.23 1jaz n THR 311 N -1.49 0.00 -0.02 -5.08 -2.24 -0.03 -4.12 114.28 101.30 1jaz n THR 311 Ca 0.03 -0.02 -0.02 0.00 -2.27 0.00 0.00 64.05 61.77 1jaz n THR 311 Cb 0.14 -0.09 -0.04 0.00 -2.10 0.00 0.00 70.33 68.24 1jaz n THR 311 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1jaz n GLN 312 N -1.29 2.98 -3.52 -0.78 1.13 0.60 -5.09 117.38 111.40 1jaz n GLN 312 Ca 0.09 -0.01 -0.08 0.00 -1.94 0.00 0.00 57.00 55.07 1jaz n GLN 312 Cb 0.32 -1.12 -0.02 0.00 0.11 0.00 0.00 30.24 29.52 1jaz n GLN 312 CO 0.00 0.00 0.00 -0.08 -1.44 0.00 0.00 177.06 175.54 1jaz s THR 313 N -2.14 0.00 -0.75 5.09 -1.32 0.43 -5.02 115.64 111.95 1jaz s THR 313 Ca -0.02 -0.05 0.06 0.00 -1.21 0.00 0.00 61.69 60.47 1jaz s THR 313 Cb 0.02 -1.07 0.04 0.00 -1.51 0.00 0.00 72.50 69.97 1jaz s THR 313 CO 0.20 0.00 0.66 0.29 -2.21 0.00 0.00 174.62 173.56 1jaz n LYS 314 N -0.25 0.35 -2.72 7.08 4.76 -1.26 -3.81 118.16 122.30 1jaz n LYS 314 Ca -0.08 -0.80 -0.43 0.00 -2.87 0.00 0.00 58.31 54.13 1jaz n LYS 314 Cb 0.62 -1.09 -0.03 0.00 -1.84 0.00 0.00 35.03 32.69 1jaz n LYS 314 CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 1jaz s ASP 315 N -0.62 6.91 0.24 4.39 2.15 -1.26 -4.87 116.67 123.61 1jaz s ASP 315 Ca 0.07 1.04 -0.05 0.00 0.43 0.00 0.00 52.55 54.05 1jaz s ASP 315 Cb 0.05 -2.51 0.44 0.00 -0.30 0.00 0.00 42.92 40.60 1jaz s ASP 315 CO 0.09 -0.76 1.73 -0.65 -0.17 0.00 0.00 175.17 175.41 1jaz h PRO 316 N 7.93 0.42 -0.41 4.34 0.11 -1.95 0.35 132.00 142.78 1jaz h PRO 316 Ca -0.21 -0.03 -0.11 0.00 0.11 0.00 0.00 66.00 65.76 1jaz h PRO 316 Cb 1.07 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 32.07 1jaz h PRO 316 CO 0.98 0.28 -0.20 1.96 -0.21 0.00 0.00 178.00 180.81 1jaz h GLN 317 N 0.44 0.81 -0.17 1.05 4.20 -1.92 0.19 115.11 119.70 1jaz h GLN 317 Ca 0.40 -0.32 -0.10 0.00 0.06 0.00 0.00 58.65 58.70 1jaz h GLN 317 Cb 0.60 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 28.33 1jaz h GLN 317 CO -0.40 0.94 -0.32 1.96 -0.67 0.00 0.00 178.83 180.34 1jaz h GLN 318 N 0.71 0.34 -0.41 1.46 4.20 -1.14 -1.64 115.11 118.63 1jaz h GLN 318 Ca 0.10 -0.14 -0.15 0.00 0.06 0.00 0.00 58.65 58.51 1jaz h GLN 318 Cb 0.71 -0.01 -0.01 0.00 0.30 0.00 0.00 27.48 28.47 1jaz h GLN 318 CO 0.05 0.63 -0.35 0.82 -0.67 0.00 0.00 178.83 179.32 1jaz h ILE 319 N 0.30 1.27 -0.45 2.54 2.04 0.39 -1.93 117.51 121.67 1jaz h ILE 319 Ca 0.04 -1.52 0.00 0.00 1.00 0.00 0.00 64.86 64.38 1jaz h ILE 319 Cb 0.72 1.32 -0.02 0.00 -0.74 0.00 0.00 36.82 38.10 1jaz h ILE 319 CO 0.05 0.51 0.29 -0.61 0.00 0.00 0.00 178.15 178.40 1jaz h GLN 320 N 0.79 0.59 -0.64 2.37 5.75 -0.44 -0.67 115.11 122.86 1jaz h GLN 320 Ca 0.07 -0.04 0.10 0.00 -0.15 0.00 0.00 58.65 58.63 1jaz h GLN 320 Cb 0.94 -0.13 -0.07 0.00 1.07 0.00 0.00 27.48 29.29 1jaz h GLN 320 CO 0.09 0.40 0.25 1.96 -2.65 0.00 0.00 178.83 178.88 1jaz h GLN 321 N 0.60 0.43 -0.85 1.69 4.20 -1.11 0.85 115.11 120.92 1jaz h GLN 321 Ca 0.16 -0.03 0.02 0.00 0.06 0.00 0.00 58.65 58.86 1jaz h GLN 321 Cb -0.06 -0.10 -0.05 0.00 0.30 0.00 0.00 27.48 27.58 1jaz h GLN 321 CO -0.03 0.28 0.56 0.82 -0.67 0.00 0.00 178.83 179.79 1jaz h ILE 322 N 0.44 1.19 0.00 2.54 2.04 -0.53 -0.23 117.51 122.96 1jaz h ILE 322 Ca 0.33 -0.38 0.00 0.00 1.00 0.00 0.00 64.86 65.80 1jaz h ILE 322 Cb 0.41 -0.03 0.00 0.00 -0.74 0.00 0.00 36.82 36.46 1jaz h ILE 322 CO -0.31 0.20 0.00 -0.26 0.00 0.00 0.00 178.15 177.78 1jaz h PHE 323 N 1.12 0.00 -0.00 1.37 -1.00 0.40 -0.25 116.94 118.57 1jaz h PHE 323 Ca 0.32 0.00 0.00 0.00 2.81 0.00 0.00 57.97 61.10 1jaz h PHE 323 Cb -0.08 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.48 1jaz h PHE 323 CO -0.02 0.00 -0.29 0.09 -1.61 0.00 0.00 178.31 176.48 1jaz n ASN 324 N -2.81 0.69 -0.00 2.17 3.02 0.12 -4.45 115.26 114.01 1jaz n ASN 324 Ca 0.01 -0.54 0.00 0.00 -0.03 0.00 0.00 54.58 54.03 1jaz n ASN 324 Cb 0.29 0.09 -0.00 0.00 -0.61 0.00 0.00 39.78 39.55 1jaz n ASN 324 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1jaz n GLN 325 N -1.03 1.18 0.00 3.52 6.02 -0.27 -5.08 117.38 121.72 1jaz n GLN 325 Ca 0.10 -0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.09 1jaz n GLN 325 Cb 0.33 -1.00 0.00 0.00 1.02 0.00 0.00 30.24 30.59 1jaz n GLN 325 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71