#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h3g s LYS -343N 0.00 1.97 0.27 0.00 2.20 -1.26 -4.98 119.74 117.95 3h3g s LYS -343Ca 0.00 -1.46 -0.30 0.00 -0.36 0.00 0.00 55.97 53.85 3h3g s LYS -343Cb 0.00 -2.03 -0.11 0.00 -1.51 0.00 0.00 37.83 34.18 3h3g s LYS -343CO 0.00 0.39 1.56 0.42 -0.36 0.00 0.00 175.35 177.35 3h3g s ILE -342N -2.06 2.25 -0.06 5.43 1.01 -1.26 -4.98 121.20 121.52 3h3g s ILE -342Ca 0.27 0.20 -0.07 0.00 0.00 0.00 0.00 60.65 61.06 3h3g s ILE -342Cb -0.07 -3.13 0.02 0.00 0.01 0.00 0.00 42.46 39.29 3h3g s ILE -342CO 0.16 0.03 0.19 -0.70 0.00 0.00 0.00 174.94 174.61 3h3g s GLU -341N -0.32 0.24 0.16 2.79 2.12 -1.26 -5.11 118.70 117.32 3h3g s GLU -341Ca 0.63 0.21 -0.33 0.00 0.36 0.00 0.00 54.97 55.84 3h3g s GLU -341Cb -0.46 0.12 -0.13 0.00 0.26 0.00 0.00 34.13 33.91 3h3g s GLU -341CO 0.45 -0.03 1.66 -1.91 -0.54 0.00 0.00 175.26 174.88 3h3g n GLU -340N 2.85 2.37 -0.25 4.30 2.13 -1.26 -3.01 120.64 127.78 3h3g n GLU -340Ca -0.13 0.86 0.00 0.00 0.66 0.00 0.00 57.16 58.54 3h3g n GLU -340Cb 0.58 -2.66 0.00 0.00 0.27 0.00 0.00 31.44 29.63 3h3g n GLU -340CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3h3g n GLY -339N 3.69 0.84 3.11 8.31 0.00 -1.26 -5.05 105.19 114.83 3h3g n GLY -339Ca 0.17 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.12 3h3g n GLY -339CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3h3g s LYS -338N -0.75 0.68 -0.02 1.61 1.02 -1.16 -4.29 119.74 116.81 3h3g s LYS -338Ca 0.00 -1.21 0.08 0.00 0.02 0.00 0.00 55.97 54.86 3h3g s LYS -338Cb 0.00 0.23 -0.02 0.00 -0.52 0.00 0.00 37.83 37.52 3h3g s LYS -338CO 0.00 -0.15 -0.26 -0.51 -0.92 0.00 0.00 175.35 173.52 3h3g s LEU -337N -2.93 2.06 -0.10 3.17 1.43 0.34 -4.69 118.68 117.95 3h3g s LEU -337Ca 0.09 -0.47 0.04 0.00 -1.03 0.00 0.00 54.13 52.75 3h3g s LEU -337Cb 0.08 -1.35 -0.00 0.00 0.03 0.00 0.00 46.19 44.95 3h3g s LEU -337CO -0.09 0.31 -0.23 -0.69 0.23 0.00 0.00 176.35 175.89 3h3g s VAL -336N -0.57 2.18 -0.05 -1.59 1.01 -1.26 -0.52 120.40 119.61 3h3g s VAL -336Ca 0.09 -0.98 0.05 0.00 0.00 0.00 0.00 61.98 61.14 3h3g s VAL -336Cb -0.10 -1.84 -0.01 0.00 0.00 0.00 0.00 36.38 34.43 3h3g s VAL -336CO -0.01 0.56 -0.22 -0.63 0.00 0.00 0.00 175.10 174.80 3h3g s ILE -335N 0.33 1.78 -0.12 2.22 1.01 0.81 -0.76 121.20 126.46 3h3g s ILE -335Ca -0.18 -0.91 -0.01 0.00 0.00 0.00 0.00 60.65 59.55 3h3g s ILE -335Cb -0.18 -1.51 -0.02 0.00 0.01 0.00 0.00 42.46 40.76 3h3g s ILE -335CO 0.08 0.50 -0.08 0.26 0.00 0.00 0.00 174.94 175.70 3h3g s TRP -334N -0.09 2.92 0.03 3.97 0.52 -0.26 -0.36 118.94 125.67 3h3g s TRP -334Ca -0.03 -0.33 -0.05 0.00 0.02 0.00 0.00 56.10 55.71 3h3g s TRP -334Cb -0.13 -1.85 -0.01 0.00 -1.15 0.00 0.00 33.47 30.34 3h3g s TRP -334CO 0.03 0.01 0.08 -1.50 0.02 0.00 0.00 176.95 175.58 3h3g s ILE -333N 0.03 0.13 0.37 2.03 2.07 -0.70 -0.79 121.20 124.34 3h3g s ILE -333Ca -0.02 -1.08 -0.28 0.00 -1.41 0.00 0.00 60.65 57.86 3h3g s ILE -333Cb -0.14 -0.82 -0.10 0.00 0.13 0.00 0.00 42.46 41.53 3h3g s ILE -333CO 0.03 -0.60 1.38 0.21 -1.91 0.00 0.00 174.94 174.05 3h3g s ASN -332N -2.03 6.48 0.42 4.50 2.47 -1.26 -4.03 114.94 121.48 3h3g s ASN -332Ca -0.06 2.83 0.29 0.00 0.42 0.00 0.00 52.86 56.34 3h3g s ASN -332Cb -0.02 -2.65 1.50 0.00 -1.45 0.00 0.00 41.25 38.63 3h3g s ASN -332CO -0.04 -0.75 1.88 1.23 -3.72 0.00 0.00 177.10 175.70 3h3g h GLY -331N 3.05 0.00 2.00 1.21 0.00 -1.87 -0.57 103.07 106.89 3h3g h GLY -331Ca -0.50 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.83 3h3g h GLY -331CO 0.64 0.00 0.00 2.09 0.00 0.00 0.00 176.54 179.27 3h3g n ASP -330N -2.54 0.41 -4.85 0.19 5.75 -1.26 -4.93 116.55 109.31 3h3g n ASP -330Ca -0.01 0.54 -0.21 0.00 -0.01 0.00 0.00 54.79 55.10 3h3g n ASP -330Cb 0.09 -0.65 0.08 0.00 -1.03 0.00 0.00 41.12 39.61 3h3g n ASP -330CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 3h3g s LYS -329N -3.06 2.05 -1.57 0.11 -0.14 -0.22 -4.78 119.74 112.13 3h3g s LYS -329Ca 0.12 -1.30 -0.11 0.00 -1.36 0.00 0.00 55.97 53.32 3h3g s LYS -329Cb 0.15 -2.49 -0.06 0.00 -1.68 0.00 0.00 37.83 33.75 3h3g s LYS -329CO 0.54 -1.10 2.77 0.41 -0.76 0.00 0.00 175.35 177.22 3h3g n GLY -328N -2.51 4.25 0.24 -3.33 0.00 -1.26 -4.69 105.19 97.88 3h3g n GLY -328Ca 0.14 -1.51 0.02 0.00 0.00 0.00 0.00 46.02 44.68 3h3g n GLY -328CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 173.32 173.42 3h3g h TYR -327N 5.28 0.24 -0.39 1.61 -0.00 -1.92 -0.53 116.97 121.26 3h3g h TYR -327Ca 0.80 -0.03 -0.04 0.00 0.00 0.00 0.00 58.73 59.46 3h3g h TYR -327Cb 0.36 -0.07 -0.02 0.00 0.00 0.00 0.00 36.73 37.01 3h3g h TYR -327CO 1.79 0.38 0.08 -0.97 -0.00 0.00 0.00 178.16 179.44 3h3g h ASN -326N 0.21 0.60 -0.57 0.10 -0.00 -1.97 0.12 115.58 114.07 3h3g h ASN -326Ca 0.04 -0.25 -0.02 0.00 -0.00 0.00 0.00 56.30 56.07 3h3g h ASN -326Cb 0.41 -0.16 -0.03 0.00 -0.00 0.00 0.00 38.32 38.55 3h3g h ASN -326CO 0.03 0.69 0.27 1.23 -0.00 0.00 0.00 177.43 179.64 3h3g h GLY -325N 0.48 0.89 1.02 1.57 0.00 -1.63 -0.64 103.07 104.76 3h3g h GLY -325Ca 0.12 -0.45 -0.02 0.00 0.00 0.00 0.00 47.33 46.98 3h3g h GLY -325CO 0.00 0.42 0.45 -2.00 0.00 0.00 0.00 176.54 175.42 3h3g h LEU -324N 0.78 1.04 -0.90 3.11 5.85 -1.02 -1.85 115.31 122.31 3h3g h LEU -324Ca 0.20 -0.10 0.10 0.00 0.84 0.00 0.00 57.88 58.92 3h3g h LEU -324Cb 0.13 -0.26 -0.08 0.00 0.37 0.00 0.00 40.66 40.82 3h3g h LEU -324CO -0.02 0.84 0.54 0.00 -0.34 0.00 0.00 178.44 179.46 3h3g h ALA -323N 1.24 1.31 -0.71 1.25 0.00 -0.15 -0.93 119.26 121.27 3h3g h ALA -323Ca 0.29 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.20 3h3g h ALA -323Cb 0.03 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.62 3h3g h ALA -323CO -0.05 0.17 0.36 0.93 0.00 0.00 0.00 179.25 180.66 3h3g h GLU -322N 0.89 1.01 -0.86 0.00 5.08 -0.33 -0.43 114.58 119.95 3h3g h GLU -322Ca 0.44 -0.14 0.00 0.00 -1.00 0.00 0.00 59.36 58.66 3h3g h GLU -322Cb 0.40 -0.19 -0.04 0.00 0.50 0.00 0.00 28.75 29.42 3h3g h GLU -322CO -0.25 0.78 0.55 0.28 -1.00 0.00 0.00 179.01 179.38 3h3g h VAL -321N 0.99 1.23 -0.43 3.13 2.07 -0.92 -1.76 116.25 120.55 3h3g h VAL -321Ca 0.25 -0.44 0.00 0.00 0.82 0.00 0.00 66.70 67.33 3h3g h VAL -321Cb 0.09 -0.02 -0.02 0.00 -1.52 0.00 0.00 31.29 29.82 3h3g h VAL -321CO -0.03 0.23 0.27 1.23 0.02 0.00 0.00 177.57 179.29 3h3g h GLY -320N 1.17 0.60 1.61 2.17 0.00 -0.39 -1.39 103.07 106.85 3h3g h GLY -320Ca 0.31 -0.23 -0.24 0.00 0.00 0.00 0.00 47.33 47.17 3h3g h GLY -320CO -0.06 0.22 -1.06 0.50 0.00 0.00 0.00 176.54 176.14 3h3g h LYS -319N 0.58 0.33 -0.50 4.80 1.79 -0.70 -2.14 116.57 120.72 3h3g h LYS -319Ca 0.16 -0.43 0.00 0.00 -2.18 0.00 0.00 60.65 58.20 3h3g h LYS -319Cb -0.05 0.14 -0.02 0.00 -1.58 0.00 0.00 32.23 30.71 3h3g h LYS -319CO -0.03 1.14 0.33 -0.22 -1.08 0.00 0.00 179.45 179.58 3h3g h LYS -318N 0.15 0.67 -0.36 3.15 1.63 -1.04 -0.15 116.57 120.62 3h3g h LYS -318Ca -0.10 -0.05 0.04 0.00 -0.85 0.00 0.00 60.65 59.70 3h3g h LYS -318Cb 1.74 -0.15 -0.04 0.00 -0.60 0.00 0.00 32.23 33.18 3h3g h LYS -318CO 0.18 0.45 0.12 0.35 -3.45 0.00 0.00 179.45 177.10 3h3g h PHE -317N 0.68 0.21 -0.80 1.91 3.57 -1.21 -1.81 116.94 119.50 3h3g h PHE -317Ca 0.18 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.68 3h3g h PHE -317Cb -0.06 -0.04 -0.04 0.00 2.79 0.00 0.00 35.95 38.60 3h3g h PHE -317CO -0.04 0.08 0.43 1.49 -2.23 0.00 0.00 178.31 178.05 3h3g h GLU -316N 0.27 1.11 -0.22 1.11 4.81 -1.12 -0.68 114.58 119.85 3h3g h GLU -316Ca 0.16 -0.13 -0.06 0.00 -0.13 0.00 0.00 59.36 59.20 3h3g h GLU -316Cb 0.14 -0.22 -0.01 0.00 0.63 0.00 0.00 28.75 29.29 3h3g h GLU -316CO -0.17 0.82 -0.15 -0.22 -0.73 0.00 0.00 179.01 178.56 3h3g h LYS -315N 1.12 0.37 0.00 1.92 3.64 -0.66 0.52 116.57 123.46 3h3g h LYS -315Ca 0.28 -0.10 -0.10 0.00 -1.27 0.00 0.00 60.65 59.46 3h3g h LYS -315Cb 0.04 -0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 31.80 3h3g h LYS -315CO -0.04 0.51 -0.96 -0.44 -2.27 0.00 0.00 179.45 176.25 3h3g h ASP -314N 0.34 0.00 0.00 4.20 3.32 -0.86 -3.41 116.42 120.01 3h3g h ASP -314Ca 0.06 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.11 3h3g h ASP -314Cb 0.46 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.01 3h3g h ASP -314CO 0.03 0.38 -0.01 0.35 -1.72 0.00 0.00 179.24 178.27 3h3g n THR -313N -2.95 0.00 -0.86 0.35 -2.24 -0.31 -5.02 114.28 103.26 3h3g n THR -313Ca -0.03 -0.20 0.00 0.00 -2.27 0.00 0.00 64.05 61.54 3h3g n THR -313Cb 0.72 0.98 0.00 0.00 -2.10 0.00 0.00 70.33 69.93 3h3g n THR -313CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3h3g n GLY -312N 0.43 0.52 3.57 3.38 0.00 0.17 -5.00 105.19 108.26 3h3g n GLY -312Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 3h3g n GLY -312CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3h3g s ILE -311N -2.48 4.82 0.28 -0.61 -1.09 -1.26 -4.98 121.20 115.88 3h3g s ILE -311Ca 0.00 0.67 -0.29 0.00 -2.23 0.00 0.00 60.65 58.80 3h3g s ILE -311Cb 0.00 -4.14 -0.10 0.00 -1.58 0.00 0.00 42.46 36.65 3h3g s ILE -311CO 0.00 -0.38 1.26 -0.75 -1.23 0.00 0.00 174.94 173.84 3h3g s LYS -310N 2.87 4.44 -0.13 2.79 2.20 -1.26 -3.30 119.74 127.34 3h3g s LYS -310Ca 0.27 2.07 -0.00 0.00 -0.36 0.00 0.00 55.97 57.95 3h3g s LYS -310Cb -0.14 -3.14 0.03 0.00 -1.51 0.00 0.00 37.83 33.07 3h3g s LYS -310CO 0.16 -0.11 -0.10 0.08 -0.36 0.00 0.00 175.35 175.02 3h3g s VAL -309N -0.78 1.25 -0.14 4.02 1.01 -1.26 -0.51 120.40 124.00 3h3g s VAL -309Ca 0.50 -0.47 -0.03 0.00 0.00 0.00 0.00 61.98 61.98 3h3g s VAL -309Cb -0.37 -1.25 -0.03 0.00 0.00 0.00 0.00 36.38 34.74 3h3g s VAL -309CO 0.46 0.37 -0.05 -0.89 0.00 0.00 0.00 175.10 174.99 3h3g s THR -308N 1.61 3.83 -0.20 3.92 2.01 0.32 -4.72 115.64 122.42 3h3g s THR -308Ca 0.04 -0.39 -0.03 0.00 0.31 0.00 0.00 61.69 61.62 3h3g s THR -308Cb -0.13 -2.66 -0.01 0.00 0.01 0.00 0.00 72.50 69.71 3h3g s THR -308CO -0.09 0.51 -0.06 -0.69 -0.69 0.00 0.00 174.62 173.61 3h3g s VAL -307N 0.16 3.40 0.22 3.82 1.01 -1.26 -0.13 120.40 127.62 3h3g s VAL -307Ca -0.02 -0.50 0.12 0.00 0.00 0.00 0.00 61.98 61.58 3h3g s VAL -307Cb -0.14 -2.52 -0.05 0.00 0.00 0.00 0.00 36.38 33.68 3h3g s VAL -307CO 0.03 0.45 -0.22 -1.61 0.00 0.00 0.00 175.10 173.74 3h3g s GLU -306N 1.12 1.57 -0.53 2.72 2.02 0.51 -4.97 118.70 121.15 3h3g s GLU -306Ca 0.01 -1.61 0.07 0.00 0.02 0.00 0.00 54.97 53.46 3h3g s GLU -306Cb -0.15 -1.81 0.24 0.00 0.10 0.00 0.00 34.13 32.52 3h3g s GLU -306CO -0.01 0.37 0.63 -2.39 0.02 0.00 0.00 175.26 173.88 3h3g n HIS -305N -0.05 1.84 -2.02 1.61 1.44 -1.26 -1.72 115.22 115.06 3h3g n HIS -305Ca -0.10 -3.89 -0.37 0.00 -2.01 0.00 0.00 57.72 51.35 3h3g n HIS -305Cb 0.57 -0.45 0.02 0.00 0.12 0.00 0.00 29.99 30.26 3h3g n HIS -305CO 0.00 0.00 0.00 -2.14 -2.81 0.00 0.00 176.34 171.39 3h3g s PRO -304N -1.81 3.33 0.43 -1.40 0.02 -1.26 -4.55 135.00 129.76 3h3g s PRO -304Ca 0.37 1.96 -0.25 0.00 0.02 0.00 0.00 61.00 63.10 3h3g s PRO -304Cb 0.14 -2.23 -0.08 0.00 0.02 0.00 0.00 34.50 32.36 3h3g s PRO -304CO -0.07 -0.95 1.26 0.34 -0.33 0.00 0.00 177.00 177.25 3h3g s ASP -303N -1.27 6.21 -1.44 2.53 2.15 -1.26 -3.30 116.67 120.28 3h3g s ASP -303Ca 0.70 2.54 -0.09 0.00 0.43 0.00 0.00 52.55 56.13 3h3g s ASP -303Cb -0.33 -2.63 0.05 0.00 -0.30 0.00 0.00 42.92 39.71 3h3g s ASP -303CO 0.39 -0.91 0.90 0.29 -0.17 0.00 0.00 175.17 175.67 3h3g n LYS -302N -0.13 -5.50 0.15 4.34 5.02 -1.26 -4.83 118.16 115.95 3h3g n LYS -302Ca 0.05 0.62 0.03 0.00 -2.02 0.00 0.00 58.31 56.99 3h3g n LYS -302Cb 0.45 -5.41 0.39 0.00 -0.02 0.00 0.00 35.03 30.44 3h3g n LYS -302CO 0.00 0.00 0.00 1.37 -0.52 0.00 0.00 177.40 178.25 3h3g h LEU -301N -2.06 0.14 -1.46 -0.35 8.10 -1.95 -0.40 115.31 117.33 3h3g h LEU -301Ca -0.59 -0.03 -0.03 0.00 0.11 0.00 0.00 57.88 57.34 3h3g h LEU -301Cb 1.37 -0.04 -0.00 0.00 -0.44 0.00 0.00 40.66 41.55 3h3g h LEU -301CO 0.63 0.36 -0.15 1.05 -4.11 0.00 0.00 178.44 176.23 3h3g h GLU -300N 0.14 0.00 0.01 0.17 9.09 -1.90 -0.84 114.58 121.25 3h3g h GLU -300Ca 0.02 0.00 -0.33 0.00 0.05 0.00 0.00 59.36 59.10 3h3g h GLU -300Cb 0.46 0.00 -0.05 0.00 -1.65 0.00 0.00 28.75 27.50 3h3g h GLU -300CO 0.03 0.15 -2.00 0.39 0.05 0.00 0.00 179.01 177.63 3h3g n GLU -299N -3.38 0.67 -0.11 1.06 1.02 -0.82 -4.34 120.64 114.74 3h3g n GLU -299Ca -0.00 0.19 -0.13 0.00 -0.02 0.00 0.00 57.16 57.20 3h3g n GLU -299Cb 0.34 -1.69 -0.02 0.00 -0.02 0.00 0.00 31.44 30.06 3h3g n GLU -299CO 0.00 0.00 0.00 -0.22 1.18 0.00 0.00 177.13 178.09 3h3g h LYS -298N 0.01 0.93 -0.03 3.49 3.64 -0.84 -3.33 116.57 120.44 3h3g h LYS -298Ca -0.40 -0.50 0.03 0.00 -1.27 0.00 0.00 60.65 58.51 3h3g h LYS -298Cb 2.08 0.02 -0.06 0.00 -0.41 0.00 0.00 32.23 33.87 3h3g h LYS -298CO 0.05 1.16 -0.40 0.35 -2.27 0.00 0.00 179.45 178.34 3h3g h PHE -297N 0.76 -1.14 0.00 1.91 3.57 -1.35 -1.07 116.94 119.61 3h3g h PHE -297Ca 0.06 0.04 -0.04 0.00 3.53 0.00 0.00 57.97 61.55 3h3g h PHE -297Cb 1.00 0.50 -0.01 0.00 2.79 0.00 0.00 35.95 40.24 3h3g h PHE -297CO 0.06 -0.48 -0.21 -1.00 -2.23 0.00 0.00 178.31 174.46 3h3g h PRO -296N -0.54 0.00 -0.04 6.41 0.13 -1.81 -0.75 132.00 135.39 3h3g h PRO -296Ca 0.06 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 65.09 3h3g h PRO -296Cb 0.63 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.75 3h3g h PRO -296CO -0.32 0.21 -0.42 1.96 -0.23 0.00 0.00 178.00 179.19 3h3g h GLN -295N 0.00 0.09 0.00 0.86 4.20 -1.34 -3.37 115.11 115.55 3h3g h GLN -295Ca -0.00 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.67 3h3g h GLN -295Cb 0.37 -0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.15 3h3g h GLN -295CO 0.03 0.50 -0.21 1.33 -0.67 0.00 0.00 178.83 179.81 3h3g n VAL -294N -4.03 0.00 -0.16 -0.54 0.24 -0.62 -4.69 118.33 108.54 3h3g n VAL -294Ca -0.02 -0.40 -0.04 0.00 -2.04 0.00 0.00 64.34 61.84 3h3g n VAL -294Cb 0.46 0.91 0.05 0.00 -1.47 0.00 0.00 33.84 33.80 3h3g n VAL -294CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3h3g h ALA -293N 0.10 0.60 0.00 2.33 0.00 -1.31 -1.81 119.26 119.18 3h3g h ALA -293Ca 0.00 0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 3h3g h ALA -293Cb 0.02 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 3h3g h ALA -293CO 0.00 -0.18 -0.08 0.00 0.00 0.00 0.00 179.25 178.99 3h3g h ALA -292N 1.30 1.80 0.00 0.00 0.00 -1.84 -2.49 119.26 118.03 3h3g h ALA -292Ca 0.22 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.06 3h3g h ALA -292Cb 0.20 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.97 3h3g h ALA -292CO -0.20 0.11 -0.41 0.25 0.00 0.00 0.00 179.25 179.00 3h3g n THR -291N -4.35 0.01 0.00 0.00 -2.24 -0.95 -4.93 114.28 101.83 3h3g n THR -291Ca -0.03 -0.01 0.00 0.00 -2.27 0.00 0.00 64.05 61.74 3h3g n THR -291Cb 0.16 0.09 0.00 0.00 -2.10 0.00 0.00 70.33 68.49 3h3g n THR -291CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3h3g n GLY -290N 1.49 1.03 0.81 3.38 0.00 -0.94 -4.99 105.19 105.98 3h3g n GLY -290Ca 0.06 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.15 3h3g n GLY -290CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3h3g n ASP -289N 0.00 3.21 -4.14 1.61 8.00 -0.72 -4.37 116.55 120.14 3h3g n ASP -289Ca 0.00 -2.05 -0.29 0.00 0.71 0.00 0.00 54.79 53.16 3h3g n ASP -289Cb 0.00 -0.30 0.18 0.00 -0.02 0.00 0.00 41.12 40.98 3h3g n ASP -289CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 3h3g s GLY -288N -1.03 1.80 0.57 0.44 0.00 -1.21 -4.84 107.32 103.04 3h3g s GLY -288Ca 0.30 -1.35 0.00 0.00 0.00 0.00 0.00 44.72 43.67 3h3g s GLY -288CO 0.19 -0.58 0.80 2.56 0.00 0.00 0.00 173.10 176.07 3h3g s PRO -287N -5.81 2.51 0.21 2.90 0.04 -1.26 -4.32 135.00 129.26 3h3g s PRO -287Ca 0.74 -0.73 -0.02 0.00 0.04 0.00 0.00 61.00 61.04 3h3g s PRO -287Cb -0.03 -2.45 0.17 0.00 0.04 0.00 0.00 34.50 32.22 3h3g s PRO -287CO 0.52 -0.77 1.55 -0.44 0.04 0.00 0.00 177.00 177.90 3h3g h ASP -286N 0.00 0.59 -3.54 6.66 5.19 -1.34 -3.41 116.42 120.58 3h3g h ASP -286Ca -0.42 -0.29 -0.43 0.00 -0.62 0.00 0.00 57.03 55.27 3h3g h ASP -286Cb 1.30 -0.17 -0.33 0.00 0.18 0.00 0.00 39.33 40.31 3h3g h ASP -286CO 0.53 0.98 -0.78 -0.63 -3.12 0.00 0.00 179.24 176.22 3h3g s ILE -285N -4.09 0.70 -0.09 0.35 1.01 -0.89 -1.49 121.20 116.70 3h3g s ILE -285Ca -0.07 -0.24 0.04 0.00 0.00 0.00 0.00 60.65 60.37 3h3g s ILE -285Cb 0.12 -0.67 -0.01 0.00 0.01 0.00 0.00 42.46 41.90 3h3g s ILE -285CO 0.83 0.25 -0.21 -0.51 0.00 0.00 0.00 174.94 175.31 3h3g s ILE -284N 0.68 2.42 -0.21 2.92 2.07 -0.49 -1.10 121.20 127.49 3h3g s ILE -284Ca -0.10 -0.91 -0.06 0.00 -1.41 0.00 0.00 60.65 58.16 3h3g s ILE -284Cb -0.13 -1.94 -0.03 0.00 0.13 0.00 0.00 42.46 40.49 3h3g s ILE -284CO 0.01 0.56 0.04 -0.36 -1.91 0.00 0.00 174.94 173.27 3h3g s PHE -283N 0.08 3.11 0.19 3.50 0.40 0.03 -1.30 117.98 123.99 3h3g s PHE -283Ca -0.09 -0.28 -0.21 0.00 -0.60 0.00 0.00 56.93 55.75 3h3g s PHE -283Cb -0.15 -2.12 0.05 0.00 0.51 0.00 0.00 43.02 41.30 3h3g s PHE -283CO 0.06 -0.15 0.59 -0.46 0.70 0.00 0.00 175.22 175.95 3h3g s TRP -282N 0.97 -0.34 0.58 0.36 -0.11 -0.77 -4.32 118.94 115.32 3h3g s TRP -282Ca 0.03 0.04 -0.19 0.00 1.22 0.00 0.00 56.10 57.20 3h3g s TRP -282Cb -0.14 0.52 -0.06 0.00 -1.50 0.00 0.00 33.47 32.29 3h3g s TRP -282CO 0.02 -0.93 0.93 0.00 -4.62 0.00 0.00 176.95 172.36 3h3g n ALA -281N -0.37 0.08 0.29 5.86 0.00 -1.26 -0.41 120.51 124.69 3h3g n ALA -281Ca -0.13 0.02 0.19 0.00 0.00 0.00 0.00 53.44 53.53 3h3g n ALA -281Cb 0.63 -2.08 1.03 0.00 0.00 0.00 0.00 19.45 19.02 3h3g n ALA -281CO 0.00 0.00 0.00 1.12 0.00 0.00 0.00 177.50 178.62 3h3g h HIS -280N 0.55 0.00 0.00 0.00 2.07 -1.35 -3.11 115.15 113.31 3h3g h HIS -280Ca -0.48 0.00 -0.06 0.00 -2.85 0.00 0.00 60.37 56.98 3h3g h HIS -280Cb 1.36 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 31.34 3h3g h HIS -280CO 0.37 0.00 -0.31 0.38 -3.07 0.00 0.00 177.93 175.30 3h3g h ASP -279N 0.00 0.00 1.35 3.10 2.03 -1.87 -2.12 116.42 118.90 3h3g h ASP -279Ca 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 3h3g h ASP -279Cb 0.06 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.56 3h3g h ASP -279CO 0.00 0.31 0.00 0.54 -1.03 0.00 0.00 179.24 179.06 3h3g n ARG -278N -4.07 0.24 0.09 4.15 5.12 -1.18 -4.27 116.66 116.74 3h3g n ARG -278Ca -0.02 0.24 -0.05 0.00 -1.93 0.00 0.00 57.85 56.09 3h3g n ARG -278Cb 0.36 -1.81 -0.01 0.00 -1.16 0.00 0.00 32.46 29.84 3h3g n ARG -278CO 0.00 0.00 0.00 0.74 -1.93 0.00 0.00 177.63 176.44 3h3g h PHE -277N 0.00 0.00 -0.88 -1.55 -1.00 -1.59 -3.09 116.94 108.83 3h3g h PHE -277Ca 0.00 0.00 -0.01 0.00 2.81 0.00 0.00 57.97 60.77 3h3g h PHE -277Cb 0.67 0.00 -0.04 0.00 3.61 0.00 0.00 35.95 40.19 3h3g h PHE -277CO 0.00 0.85 0.51 0.78 -1.61 0.00 0.00 178.31 178.85 3h3g h GLY -276N 2.64 1.29 0.96 -1.45 0.00 -1.54 -0.63 103.07 104.33 3h3g h GLY -276Ca -0.01 -0.55 0.01 0.00 0.00 0.00 0.00 47.33 46.78 3h3g h GLY -276CO 0.11 0.53 0.35 -1.33 0.00 0.00 0.00 176.54 176.21 3h3g h GLY -275N 1.22 0.77 0.92 4.60 0.00 -1.67 -0.16 103.07 108.76 3h3g h GLY -275Ca 0.31 -0.27 -0.06 0.00 0.00 0.00 0.00 47.33 47.31 3h3g h GLY -275CO -0.06 0.25 0.00 -0.97 0.00 0.00 0.00 176.54 175.77 3h3g h TYR -274N 0.71 0.70 -0.54 5.60 0.05 -1.43 -2.28 116.97 119.78 3h3g h TYR -274Ca 0.21 -0.12 0.01 0.00 0.05 0.00 0.00 58.73 58.88 3h3g h TYR -274Cb -0.05 -0.18 -0.03 0.00 1.01 0.00 0.00 36.73 37.48 3h3g h TYR -274CO -0.05 0.74 0.35 0.00 -1.05 0.00 0.00 178.16 178.15 3h3g h ALA -273N 0.87 0.69 -0.83 3.88 0.00 -1.01 -0.67 119.26 122.20 3h3g h ALA -273Ca 0.10 -0.03 0.10 0.00 0.00 0.00 0.00 54.91 55.09 3h3g h ALA -273Cb 0.46 -0.20 -0.06 0.00 0.00 0.00 0.00 17.79 17.99 3h3g h ALA -273CO 0.02 0.09 0.54 0.37 0.00 0.00 0.00 179.25 180.27 3h3g h GLN -272N 0.70 0.74 -0.01 0.00 4.15 -0.82 -0.29 115.11 119.58 3h3g h GLN -272Ca 0.21 -0.04 0.00 0.00 0.77 0.00 0.00 58.65 59.58 3h3g h GLN -272Cb -0.04 -0.17 0.00 0.00 0.21 0.00 0.00 27.48 27.48 3h3g h GLN -272CO -0.06 0.49 0.00 0.43 -1.93 0.00 0.00 178.83 177.76 3h3g n SER -271N -4.51 0.68 -2.06 -0.69 7.64 -0.87 -4.91 113.62 108.89 3h3g n SER -271Ca 0.14 -1.25 -0.13 0.00 1.01 0.00 0.00 58.87 58.65 3h3g n SER -271Cb 0.33 -0.00 0.04 0.00 -1.01 0.00 0.00 64.21 63.57 3h3g n SER -271CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3h3g n GLY -270N 1.07 0.13 0.12 0.23 0.00 -0.12 -4.96 105.19 101.66 3h3g n GLY -270Ca 0.21 -0.20 0.07 0.00 0.00 0.00 0.00 46.02 46.10 3h3g n GLY -270CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3h3g n LEU -269N -2.77 0.99 -4.34 0.99 4.77 -0.29 -4.80 117.00 111.55 3h3g n LEU -269Ca -0.01 -0.59 -0.32 0.00 -0.03 0.00 0.00 56.01 55.06 3h3g n LEU -269Cb 0.54 0.00 -0.15 0.00 -2.33 0.00 0.00 43.42 41.47 3h3g n LEU -269CO 0.33 0.22 -0.54 -0.76 -1.33 0.00 0.00 177.39 175.30 3h3g s LEU -268N -2.44 2.21 0.34 2.23 1.43 -1.26 -0.86 118.68 120.34 3h3g s LEU -268Ca 0.08 -0.42 -0.26 0.00 -1.03 0.00 0.00 54.13 52.50 3h3g s LEU -268Cb 0.11 -1.40 -0.09 0.00 0.03 0.00 0.00 46.19 44.84 3h3g s LEU -268CO 0.52 0.31 1.04 0.00 0.23 0.00 0.00 176.35 178.45 3h3g s ALA -267N -0.52 3.22 0.29 4.21 0.00 -0.20 -4.65 121.76 124.11 3h3g s ALA -267Ca 0.07 0.72 -0.29 0.00 0.00 0.00 0.00 51.96 52.46 3h3g s ALA -267Cb -0.11 -3.27 -0.10 0.00 0.00 0.00 0.00 23.12 19.64 3h3g s ALA -267CO 0.00 -0.10 1.23 -2.00 0.00 0.00 0.00 175.76 174.90 3h3g s GLU -266N -2.01 4.46 -0.07 0.00 2.12 -1.26 -4.66 118.70 117.29 3h3g s GLU -266Ca 0.51 2.04 -0.08 0.00 0.36 0.00 0.00 54.97 57.80 3h3g s GLU -266Cb -0.25 -3.14 -0.04 0.00 0.26 0.00 0.00 34.13 30.96 3h3g s GLU -266CO 0.31 -0.06 0.22 0.96 -0.54 0.00 0.00 175.26 176.15 3h3g s ILE -265N -0.89 5.37 -0.55 -3.70 -4.36 -0.72 -5.03 121.20 111.33 3h3g s ILE -265Ca 0.49 0.30 0.04 0.00 -0.26 0.00 0.00 60.65 61.23 3h3g s ILE -265Cb -0.36 -3.50 0.38 0.00 1.25 0.00 0.00 42.46 40.22 3h3g s ILE -265CO 0.46 0.55 1.13 0.35 0.24 0.00 0.00 174.94 177.67 3h3g n THR -264N 1.72 2.92 -2.52 8.37 -2.24 -1.26 -4.72 114.28 116.56 3h3g n THR -264Ca -0.17 -5.22 -0.41 0.00 -2.27 0.00 0.00 64.05 55.99 3h3g n THR -264Cb 0.54 -1.33 -0.04 0.00 -2.10 0.00 0.00 70.33 67.39 3h3g n THR -264CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 3h3g s PRO -263N -3.59 4.64 0.96 -0.78 0.04 -1.26 -5.03 135.00 129.99 3h3g s PRO -263Ca 0.48 1.74 -0.13 0.00 0.04 0.00 0.00 61.00 63.13 3h3g s PRO -263Cb 0.34 -3.23 0.17 0.00 0.04 0.00 0.00 34.50 31.82 3h3g s PRO -263CO -0.18 0.19 1.13 0.16 0.04 0.00 0.00 177.00 178.34 3h3g s ASP -262N -0.60 3.00 0.29 6.66 1.47 -1.26 -4.77 116.67 121.45 3h3g s ASP -262Ca 0.46 0.99 -0.02 0.00 1.18 0.00 0.00 52.55 55.16 3h3g s ASP -262Cb -0.30 -1.56 0.42 0.00 -0.34 0.00 0.00 42.92 41.14 3h3g s ASP -262CO 0.38 -2.87 1.95 0.50 0.68 0.00 0.00 175.17 175.81 3h3g h LYS -261N -1.72 1.09 -0.81 2.11 3.64 -1.98 -0.61 116.57 118.29 3h3g h LYS -261Ca -0.52 -0.08 0.02 0.00 -1.27 0.00 0.00 60.65 58.81 3h3g h LYS -261Cb 1.33 -0.24 -0.04 0.00 -0.41 0.00 0.00 32.23 32.86 3h3g h LYS -261CO 0.58 0.74 0.53 0.00 -2.27 0.00 0.00 179.45 179.03 3h3g h ALA -260N 1.46 1.04 -0.39 5.00 0.00 -1.99 0.12 119.26 124.50 3h3g h ALA -260Ca 0.30 -0.05 -0.16 0.00 0.00 0.00 0.00 54.91 55.01 3h3g h ALA -260Cb -0.10 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.38 3h3g h ALA -260CO -0.06 0.40 -0.37 0.35 0.00 0.00 0.00 179.25 179.56 3h3g h PHE -259N 1.06 1.10 -0.81 0.00 3.04 -1.63 -3.20 116.94 116.51 3h3g h PHE -259Ca 0.31 -0.32 -0.01 0.00 3.98 0.00 0.00 57.97 61.93 3h3g h PHE -259Cb -0.07 -0.23 -0.04 0.00 2.56 0.00 0.00 35.95 38.17 3h3g h PHE -259CO -0.02 1.15 0.48 1.96 -2.02 0.00 0.00 178.31 179.85 3h3g h GLN -258N 0.76 1.10 0.00 1.11 4.20 -0.66 -2.08 115.11 119.53 3h3g h GLN -258Ca 0.07 -0.10 0.00 0.00 0.06 0.00 0.00 58.65 58.67 3h3g h GLN -258Cb 0.96 -0.23 0.00 0.00 0.30 0.00 0.00 27.48 28.51 3h3g h GLN -258CO 0.09 0.78 0.09 -0.44 -0.67 0.00 0.00 178.83 178.68 3h3g h ASP -257N 1.12 0.00 1.72 1.46 3.32 -0.97 -2.12 116.42 120.94 3h3g h ASP -257Ca 0.29 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.34 3h3g h ASP -257Cb -0.03 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.52 3h3g h ASP -257CO -0.05 0.00 -0.21 0.11 -1.72 0.00 0.00 179.24 177.37 3h3g h LYS -256N 0.00 0.00 -6.31 3.56 1.57 -1.46 -3.46 116.57 110.47 3h3g h LYS -256Ca 0.00 0.00 -0.59 0.00 -1.87 0.00 0.00 60.65 58.19 3h3g h LYS -256Cb 0.18 0.00 -0.11 0.00 0.08 0.00 0.00 32.23 32.38 3h3g h LYS -256CO 0.00 0.00 -0.65 -0.51 -0.57 0.00 0.00 179.45 177.72 3h3g s LEU -255N -5.81 3.34 0.24 2.94 1.43 -0.80 -1.85 118.68 118.17 3h3g s LEU -255Ca 0.06 -0.41 -0.30 0.00 -1.03 0.00 0.00 54.13 52.45 3h3g s LEU -255Cb 0.07 -1.97 -0.11 0.00 0.03 0.00 0.00 46.19 44.21 3h3g s LEU -255CO 0.69 0.07 1.55 -0.31 0.23 0.00 0.00 176.35 178.58 3h3g s TYR -254N -1.81 2.92 0.26 0.29 2.02 -0.85 -4.92 117.35 115.26 3h3g s TYR -254Ca 0.28 0.79 -0.05 0.00 -0.37 0.00 0.00 57.07 57.73 3h3g s TYR -254Cb -0.09 -3.96 0.51 0.00 -0.40 0.00 0.00 41.96 38.02 3h3g s TYR -254CO 0.19 -3.31 1.63 -1.35 -1.57 0.00 0.00 175.55 171.14 3h3g h PRO -253N 5.49 0.12 0.00 -1.71 0.11 -1.94 -0.35 132.00 133.71 3h3g h PRO -253Ca -0.45 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.64 3h3g h PRO -253Cb 1.21 -0.03 -0.00 0.00 0.11 0.00 0.00 31.00 32.30 3h3g h PRO -253CO 0.83 0.08 -0.04 0.27 -0.21 0.00 0.00 178.00 178.93 3h3g h PHE -252N 0.12 0.00 0.05 0.65 -0.00 -2.00 -1.66 116.94 114.10 3h3g h PHE -252Ca 0.45 0.00 -0.27 0.00 -0.00 0.00 0.00 57.97 58.15 3h3g h PHE -252Cb 0.83 0.00 0.02 0.00 -0.00 0.00 0.00 35.95 36.80 3h3g h PHE -252CO -0.40 0.04 -1.11 1.79 -0.00 0.00 0.00 178.31 178.63 3h3g h THR -251N 0.00 1.31 -0.79 0.88 1.35 -1.43 -2.96 112.91 111.27 3h3g h THR -251Ca -0.00 -2.40 0.03 0.00 -0.55 0.00 0.00 66.41 63.48 3h3g h THR -251Cb 0.27 2.53 -0.05 0.00 -1.73 0.00 0.00 68.15 69.17 3h3g h THR -251CO 0.01 0.73 0.51 -0.50 -0.25 0.00 0.00 175.52 176.01 3h3g h TRP -250N 0.31 0.95 -0.95 4.73 4.06 -1.21 -2.62 115.95 121.22 3h3g h TRP -250Ca -0.14 0.02 0.10 0.00 2.06 0.00 0.00 58.89 60.93 3h3g h TRP -250Cb 1.77 -0.32 -0.07 0.00 -1.00 0.00 0.00 29.16 29.54 3h3g h TRP -250CO 0.10 0.56 0.61 -0.44 -3.56 0.00 0.00 178.44 175.71 3h3g h ASP -249N 1.00 0.88 0.32 -3.49 3.32 -1.38 -1.16 116.42 115.90 3h3g h ASP -249Ca 0.31 0.03 -0.02 0.00 0.02 0.00 0.00 57.03 57.37 3h3g h ASP -249Cb -0.02 -0.15 -0.00 0.00 0.22 0.00 0.00 39.33 39.37 3h3g h ASP -249CO -0.10 0.51 -0.09 0.00 -1.72 0.00 0.00 179.24 177.83 3h3g h ALA -248N 1.53 1.30 -0.21 3.45 0.00 -1.29 -2.82 119.26 121.22 3h3g h ALA -248Ca 0.45 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.27 3h3g h ALA -248Cb 0.41 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.19 3h3g h ALA -248CO -0.21 0.12 0.00 1.33 0.00 0.00 0.00 179.25 180.49 3h3g n VAL -247N -3.63 2.08 -3.46 0.00 0.24 -0.47 -4.81 118.33 108.28 3h3g n VAL -247Ca -0.02 -1.87 -0.37 0.00 -2.04 0.00 0.00 64.34 60.03 3h3g n VAL -247Cb 0.21 -0.18 -0.07 0.00 -1.47 0.00 0.00 33.84 32.33 3h3g n VAL -247CO 0.00 0.00 0.00 -0.60 -2.14 0.00 0.00 176.83 174.09 3h3g s ARG -246N -2.66 4.22 -0.07 7.34 3.52 -1.00 -1.30 118.95 129.01 3h3g s ARG -246Ca 0.38 0.16 -0.01 0.00 -0.13 0.00 0.00 55.73 56.13 3h3g s ARG -246Cb 0.30 -3.48 0.03 0.00 -1.56 0.00 0.00 34.95 30.24 3h3g s ARG -246CO 0.08 0.10 -0.01 -0.47 -0.81 0.00 0.00 175.30 174.19 3h3g s TYR -245N 0.87 0.72 -1.55 5.12 5.04 0.11 -4.80 117.35 122.86 3h3g s TYR -245Ca 0.18 -0.20 -0.06 0.00 -2.44 0.00 0.00 57.07 54.55 3h3g s TYR -245Cb -0.14 -0.79 0.05 0.00 0.35 0.00 0.00 41.96 41.43 3h3g s TYR -245CO 0.06 -0.31 0.40 0.09 -1.34 0.00 0.00 175.55 174.45 3h3g n ASN -244N 4.94 -0.74 0.00 4.32 5.03 -1.26 -1.93 115.26 125.62 3h3g n ASN -244Ca -0.11 -1.10 0.00 0.00 0.87 0.00 0.00 54.58 54.24 3h3g n ASN -244Cb 0.50 -2.48 0.00 0.00 -1.02 0.00 0.00 39.78 36.78 3h3g n ASN -244CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 3h3g n GLY -243N -1.95 0.55 3.33 7.41 0.00 -1.26 -5.00 105.19 108.27 3h3g n GLY -243Ca -0.20 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.51 3h3g n GLY -243CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3h3g s LYS -242N -0.35 2.21 -0.08 1.61 1.02 -0.81 -5.11 119.74 118.23 3h3g s LYS -242Ca 0.00 -0.90 -0.30 0.00 0.02 0.00 0.00 55.97 54.80 3h3g s LYS -242Cb 0.00 -2.10 -0.02 0.00 -0.52 0.00 0.00 37.83 35.19 3h3g s LYS -242CO 0.00 0.55 1.13 -0.51 -0.92 0.00 0.00 175.35 175.60 3h3g s LEU -241N -0.58 4.26 0.00 3.17 1.43 -1.26 0.06 118.68 125.75 3h3g s LEU -241Ca 0.09 1.69 0.00 0.00 -1.03 0.00 0.00 54.13 54.88 3h3g s LEU -241Cb -0.10 -3.56 0.00 0.00 0.03 0.00 0.00 46.19 42.56 3h3g s LEU -241CO -0.00 -0.54 0.90 2.30 0.23 0.00 0.00 176.35 179.23 3h3g n ILE -240N 4.64 0.81 -3.52 -0.59 -5.35 -0.42 -1.75 119.36 113.19 3h3g n ILE -240Ca 0.10 -0.89 -0.10 0.00 -0.27 0.00 0.00 62.75 61.60 3h3g n ILE -240Cb 0.47 0.60 -0.03 0.00 -1.74 0.00 0.00 39.64 38.94 3h3g n ILE -240CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3h3g s ALA -239N -0.81 -1.84 -0.14 -1.28 0.00 -1.26 -4.56 121.76 111.88 3h3g s ALA -239Ca 0.00 1.15 -0.23 0.00 0.00 0.00 0.00 51.96 52.89 3h3g s ALA -239Cb 0.00 0.14 -0.03 0.00 0.00 0.00 0.00 23.12 23.23 3h3g s ALA -239CO 0.00 -0.58 0.69 0.71 0.00 0.00 0.00 175.76 176.58 3h3g s TYR -238N -2.53 3.46 0.30 0.00 1.51 0.06 -4.87 117.35 115.28 3h3g s TYR -238Ca 0.02 1.11 -0.28 0.00 -1.01 0.00 0.00 57.07 56.91 3h3g s TYR -238Cb -0.01 -2.83 -0.09 0.00 -0.11 0.00 0.00 41.96 38.91 3h3g s TYR -238CO -0.05 -0.08 1.02 -1.25 -1.11 0.00 0.00 175.55 174.08 3h3g s PRO -237N 1.51 4.59 -0.06 -1.71 0.05 -1.26 -0.38 135.00 137.74 3h3g s PRO -237Ca 0.34 1.59 -0.06 0.00 0.05 0.00 0.00 61.00 62.92 3h3g s PRO -237Cb -0.17 -3.02 -0.03 0.00 0.05 0.00 0.00 34.50 31.33 3h3g s PRO -237CO 0.13 0.23 -0.13 -0.89 0.05 0.00 0.00 177.00 176.40 3h3g n ILE -236N 0.92 0.89 -3.69 0.56 2.08 0.17 -4.74 119.36 115.55 3h3g n ILE -236Ca 0.00 0.05 -0.14 0.00 0.56 0.00 0.00 62.75 63.23 3h3g n ILE -236Cb 0.47 -1.74 -0.07 0.00 -0.75 0.00 0.00 39.64 37.55 3h3g n ILE -236CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 3h3g s ALA -235N -2.25 -1.00 -0.24 -1.39 0.00 -1.12 -0.59 121.76 115.18 3h3g s ALA -235Ca -0.13 0.42 -0.07 0.00 0.00 0.00 0.00 51.96 52.18 3h3g s ALA -235Cb 0.04 0.20 -0.03 0.00 0.00 0.00 0.00 23.12 23.33 3h3g s ALA -235CO 0.17 -0.37 0.07 0.08 0.00 0.00 0.00 175.76 175.71 3h3g s VAL -234N -1.90 4.43 -0.07 0.00 1.01 0.23 0.13 120.40 124.23 3h3g s VAL -234Ca -0.09 -0.14 0.03 0.00 0.00 0.00 0.00 61.98 61.78 3h3g s VAL -234Cb -0.02 -3.06 -0.02 0.00 0.00 0.00 0.00 36.38 33.28 3h3g s VAL -234CO 0.02 0.36 -0.15 -1.61 0.00 0.00 0.00 175.10 173.71 3h3g s GLU -233N 1.35 2.69 -0.04 2.72 2.02 0.89 -2.40 118.70 125.93 3h3g s GLU -233Ca 0.05 -0.72 -0.11 0.00 0.02 0.00 0.00 54.97 54.21 3h3g s GLU -233Cb -0.15 -2.40 0.02 0.00 0.10 0.00 0.00 34.13 31.70 3h3g s GLU -233CO 0.04 0.51 0.25 0.00 0.02 0.00 0.00 175.26 176.07 3h3g s ALA -232N -0.43 -0.62 0.48 5.21 0.00 -1.26 -1.64 121.76 123.50 3h3g s ALA -232Ca 0.05 0.36 -0.23 0.00 0.00 0.00 0.00 51.96 52.15 3h3g s ALA -232Cb -0.12 -0.11 -0.07 0.00 0.00 0.00 0.00 23.12 22.83 3h3g s ALA -232CO 0.02 -0.20 1.24 -0.51 0.00 0.00 0.00 175.76 176.31 3h3g s LEU -231N -0.80 3.97 0.25 0.00 1.43 -1.26 -4.52 118.68 117.75 3h3g s LEU -231Ca -0.09 2.48 0.03 0.00 -1.03 0.00 0.00 54.13 55.52 3h3g s LEU -231Cb -0.05 -4.23 -0.05 0.00 0.03 0.00 0.00 46.19 41.89 3h3g s LEU -231CO 0.02 -1.13 0.04 -0.44 0.23 0.00 0.00 176.35 175.07 3h3g s SER -230N -1.19 1.69 -0.24 2.29 0.01 -0.69 -4.80 113.70 110.78 3h3g s SER -230Ca 0.66 -1.30 -0.26 0.00 1.31 0.00 0.00 55.95 56.36 3h3g s SER -230Cb -0.33 0.05 -0.00 0.00 0.21 0.00 0.00 66.02 65.95 3h3g s SER -230CO 0.40 -0.60 0.88 -0.22 0.41 0.00 0.00 173.24 174.11 3h3g s LEU -229N -3.33 4.09 -0.17 2.44 2.96 -0.80 -2.69 118.68 121.17 3h3g s LEU -229Ca 0.33 1.13 -0.05 0.00 -0.22 0.00 0.00 54.13 55.31 3h3g s LEU -229Cb 0.07 -3.28 -0.03 0.00 0.50 0.00 0.00 46.19 43.45 3h3g s LEU -229CO 0.11 -0.55 0.00 -0.63 -1.32 0.00 0.00 176.35 173.96 3h3g s ILE -228N 2.92 4.24 0.11 6.68 1.01 -0.28 -0.25 121.20 135.63 3h3g s ILE -228Ca 0.37 -0.23 0.03 0.00 0.00 0.00 0.00 60.65 60.83 3h3g s ILE -228Cb -0.15 -2.89 -0.04 0.00 0.01 0.00 0.00 42.46 39.39 3h3g s ILE -228CO 0.07 0.47 -0.09 -0.72 0.00 0.00 0.00 174.94 174.68 3h3g s TYR -227N 0.42 1.04 -0.43 3.97 1.13 -0.63 -0.49 117.35 122.37 3h3g s TYR -227Ca -0.01 -0.75 -0.21 0.00 -1.41 0.00 0.00 57.07 54.69 3h3g s TYR -227Cb -0.14 -0.57 0.02 0.00 -1.10 0.00 0.00 41.96 40.18 3h3g s TYR -227CO 0.02 -0.03 0.66 1.21 -2.51 0.00 0.00 175.55 174.90 3h3g s ASN -226N -2.75 6.35 0.36 -0.18 3.84 0.12 -1.35 114.94 121.32 3h3g s ASN -226Ca 0.09 -0.23 0.03 0.00 0.21 0.00 0.00 52.86 52.96 3h3g s ASN -226Cb 0.00 -2.33 0.66 0.00 -0.55 0.00 0.00 41.25 39.03 3h3g s ASN -226CO -0.01 -0.77 2.01 0.11 -2.79 0.00 0.00 177.10 175.66 3h3g h LYS -225N 8.82 0.81 -0.24 0.43 1.57 0.10 0.18 116.57 128.25 3h3g h LYS -225Ca -0.25 -0.05 -0.12 0.00 -1.87 0.00 0.00 60.65 58.36 3h3g h LYS -225Cb 1.10 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 33.21 3h3g h LYS -225CO 0.89 0.54 -0.36 -0.44 -0.57 0.00 0.00 179.45 179.51 3h3g h ASP -224N 0.83 0.55 0.46 0.86 3.32 -1.93 -2.98 116.42 117.53 3h3g h ASP -224Ca 0.23 -0.23 -0.30 0.00 0.02 0.00 0.00 57.03 56.75 3h3g h ASP -224Cb -0.09 -0.15 -0.02 0.00 0.22 0.00 0.00 39.33 39.30 3h3g h ASP -224CO -0.05 0.86 -1.57 -0.07 -1.72 0.00 0.00 179.24 176.69 3h3g h LEU -223N 0.44 0.31 -6.71 1.55 3.38 -1.86 -3.43 115.31 108.99 3h3g h LEU -223Ca 0.05 -0.46 -0.60 0.00 0.09 0.00 0.00 57.88 56.95 3h3g h LEU -223Cb 0.84 -0.10 -0.40 0.00 0.09 0.00 0.00 40.66 41.09 3h3g h LEU -223CO 0.07 1.39 -0.81 -0.22 0.09 0.00 0.00 178.44 178.96 3h3g s LEU -222N -6.83 2.47 0.20 1.67 2.96 0.62 -4.97 118.68 114.80 3h3g s LEU -222Ca -0.09 -3.05 -0.10 0.00 -0.22 0.00 0.00 54.13 50.67 3h3g s LEU -222Cb 0.07 -0.86 0.13 0.00 0.50 0.00 0.00 46.19 46.03 3h3g s LEU -222CO 0.84 -0.19 1.80 1.55 -1.32 0.00 0.00 176.35 179.03 3h3g h PRO -221N 6.00 1.02 -4.11 0.98 0.13 -1.75 -3.36 132.00 130.91 3h3g h PRO -221Ca 0.15 -0.14 -0.68 0.00 -0.87 0.00 0.00 66.00 64.47 3h3g h PRO -221Cb 0.88 -0.19 -0.37 0.00 0.13 0.00 0.00 31.00 31.45 3h3g h PRO -221CO 0.47 0.78 -0.56 -0.80 -0.23 0.00 0.00 178.00 177.66 3h3g s ASN -220N -6.09 4.94 0.75 1.44 0.01 -1.26 -4.99 114.94 109.73 3h3g s ASN -220Ca -0.13 -2.45 -0.15 0.00 -0.71 0.00 0.00 52.86 49.42 3h3g s ASN -220Cb 0.14 -1.75 0.05 0.00 0.41 0.00 0.00 41.25 40.10 3h3g s ASN -220CO 0.80 -0.40 1.23 -2.16 -1.51 0.00 0.00 177.10 175.06 3h3g s PRO -219N 0.51 2.00 0.38 -0.60 0.04 -1.26 -4.94 135.00 131.12 3h3g s PRO -219Ca 0.13 1.83 -0.27 0.00 0.04 0.00 0.00 61.00 62.73 3h3g s PRO -219Cb -0.22 -1.81 -0.09 0.00 0.04 0.00 0.00 34.50 32.42 3h3g s PRO -219CO -0.04 -1.96 1.24 -1.25 0.04 0.00 0.00 177.00 175.03 3h3g s PRO -218N -3.90 4.15 0.06 0.56 0.04 -1.26 -4.92 135.00 129.73 3h3g s PRO -218Ca 0.76 2.02 0.25 0.00 0.04 0.00 0.00 61.00 64.06 3h3g s PRO -218Cb -0.31 -2.84 0.41 0.00 0.04 0.00 0.00 34.50 31.80 3h3g s PRO -218CO 0.46 -0.30 1.35 1.63 0.04 0.00 0.00 177.00 180.18 3h3g n LYS -217N 0.35 0.17 -4.30 4.56 5.02 -1.26 -4.64 118.16 118.06 3h3g n LYS -217Ca 0.03 0.04 -0.20 0.00 -2.02 0.00 0.00 58.31 56.15 3h3g n LYS -217Cb 0.44 -1.60 -0.13 0.00 -0.02 0.00 0.00 35.03 33.73 3h3g n LYS -217CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 3h3g s THR -216N -3.10 1.25 0.29 -0.18 -4.23 -1.26 -0.94 115.64 107.47 3h3g s THR -216Ca 0.08 -1.21 -0.03 0.00 -1.18 0.00 0.00 61.69 59.36 3h3g s THR -216Cb 0.15 -1.15 0.26 0.00 1.34 0.00 0.00 72.50 73.10 3h3g s THR -216CO 0.71 -0.07 1.96 -0.50 -0.54 0.00 0.00 174.62 176.18 3h3g h TRP -215N 4.56 1.08 0.00 3.99 4.06 -1.04 -3.11 115.95 125.50 3h3g h TRP -215Ca -0.41 0.03 -0.00 0.00 2.06 0.00 0.00 58.89 60.57 3h3g h TRP -215Cb 1.18 -0.37 -0.00 0.00 -1.00 0.00 0.00 29.16 28.98 3h3g h TRP -215CO 0.58 0.67 -0.01 0.93 -3.56 0.00 0.00 178.44 177.05 3h3g h GLU -214N 1.16 0.00 -0.01 0.49 3.07 -1.96 -1.45 114.58 115.87 3h3g h GLU -214Ca 0.32 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.18 3h3g h GLU -214Cb -0.11 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.80 3h3g h GLU -214CO -0.07 0.01 -0.07 -0.85 -1.40 0.00 0.00 179.01 176.63 3h3g n GLU -213N -4.09 1.18 -0.10 2.33 0.28 -1.17 -4.26 120.64 114.81 3h3g n GLU -213Ca -0.03 -0.55 -0.12 0.00 -0.16 0.00 0.00 57.16 56.30 3h3g n GLU -213Cb 0.10 -1.49 -0.04 0.00 1.43 0.00 0.00 31.44 31.44 3h3g n GLU -213CO 0.00 0.00 0.00 0.82 -0.16 0.00 0.00 177.13 177.79 3h3g h ILE -212N 1.35 1.29 -0.68 3.84 2.04 -1.39 -2.66 117.51 121.30 3h3g h ILE -212Ca 0.00 -1.21 0.13 0.00 1.00 0.00 0.00 64.86 64.78 3h3g h ILE -212Cb 0.39 1.45 -0.09 0.00 -0.74 0.00 0.00 36.82 37.82 3h3g h ILE -212CO 0.00 0.39 0.19 -0.65 0.00 0.00 0.00 178.15 178.08 3h3g h PRO -211N 0.37 0.31 -0.08 2.37 0.11 -1.77 0.21 132.00 133.51 3h3g h PRO -211Ca 0.07 -0.02 -0.12 0.00 0.11 0.00 0.00 66.00 66.04 3h3g h PRO -211Cb 0.64 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 31.67 3h3g h PRO -211CO 0.04 0.20 -0.48 0.00 -0.21 0.00 0.00 178.00 177.55 3h3g h ALA -210N 1.53 1.03 -0.46 -0.75 0.00 -1.83 -1.46 119.26 117.33 3h3g h ALA -210Ca 0.37 -0.46 -0.13 0.00 0.00 0.00 0.00 54.91 54.69 3h3g h ALA -210Cb 0.57 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 3h3g h ALA -210CO -0.43 0.64 -0.21 1.25 0.00 0.00 0.00 179.25 180.51 3h3g h LEU -209N 0.17 0.98 -0.37 0.00 5.85 -0.96 -2.61 115.31 118.36 3h3g h LEU -209Ca 0.01 -0.40 -0.06 0.00 0.84 0.00 0.00 57.88 58.27 3h3g h LEU -209Cb 0.92 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 41.67 3h3g h LEU -209CO 0.07 1.16 -0.00 -0.78 -0.34 0.00 0.00 178.44 178.55 3h3g h ASP -208N 0.80 0.64 -0.86 1.25 3.58 -0.42 -0.59 116.42 120.81 3h3g h ASP -208Ca 0.10 -0.31 0.07 0.00 0.42 0.00 0.00 57.03 57.32 3h3g h ASP -208Cb 0.78 -0.17 -0.07 0.00 1.72 0.00 0.00 39.33 41.59 3h3g h ASP -208CO 0.06 0.79 0.53 0.50 -2.88 0.00 0.00 179.24 178.25 3h3g h LYS -207N 0.47 0.90 -0.50 0.28 3.64 -1.27 0.23 116.57 120.32 3h3g h LYS -207Ca 0.11 -0.05 -0.07 0.00 -1.27 0.00 0.00 60.65 59.37 3h3g h LYS -207Cb 0.46 -0.20 -0.02 0.00 -0.41 0.00 0.00 32.23 32.06 3h3g h LYS -207CO 0.02 0.60 0.06 1.49 -2.27 0.00 0.00 179.45 179.35 3h3g h GLU -206N 0.93 0.85 -0.07 1.90 4.81 -1.29 -3.09 114.58 118.62 3h3g h GLU -206Ca 0.39 -0.24 -0.22 0.00 -0.13 0.00 0.00 59.36 59.16 3h3g h GLU -206Cb 0.25 -0.09 0.01 0.00 0.63 0.00 0.00 28.75 29.54 3h3g h GLU -206CO -0.20 0.85 -0.84 -0.07 -0.73 0.00 0.00 179.01 178.02 3h3g h LEU -205N 0.72 0.70 -2.02 1.64 3.38 -0.22 -3.11 115.31 116.40 3h3g h LEU -205Ca 0.15 -0.50 0.06 0.00 0.09 0.00 0.00 57.88 57.69 3h3g h LEU -205Cb 0.43 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.96 3h3g h LEU -205CO 0.01 1.28 0.16 0.11 0.09 0.00 0.00 178.44 180.09 3h3g h LYS -204N 0.37 0.00 0.00 1.13 1.79 0.29 0.12 116.57 120.27 3h3g h LYS -204Ca -0.06 0.00 -0.03 0.00 -2.18 0.00 0.00 60.65 58.37 3h3g h LYS -204Cb 1.46 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 32.11 3h3g h LYS -204CO 0.16 0.00 -0.15 0.00 -1.08 0.00 0.00 179.45 178.38 3h3g h ALA -203N 1.88 1.16 -0.53 3.86 0.00 -1.46 -2.56 119.26 121.61 3h3g h ALA -203Ca 0.10 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.88 3h3g h ALA -203Cb 0.42 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.19 3h3g h ALA -203CO -0.00 0.19 0.00 1.63 0.00 0.00 0.00 179.25 181.07 3h3g n LYS -202N -3.50 4.31 -2.97 0.00 5.02 0.31 -4.94 118.16 116.40 3h3g n LYS -202Ca -0.01 -3.04 -0.14 0.00 -2.02 0.00 0.00 58.31 53.10 3h3g n LYS -202Cb 0.31 -2.11 0.04 0.00 -0.02 0.00 0.00 35.03 33.25 3h3g n LYS -202CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3h3g n GLY -201N 0.53 0.05 3.27 0.72 0.00 -0.96 -5.04 105.19 103.76 3h3g n GLY -201Ca 0.26 -0.18 -0.18 0.00 0.00 0.00 0.00 46.02 45.92 3h3g n GLY -201CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3h3g s LYS -200N -5.55 1.65 0.11 1.61 -0.14 -0.50 -4.98 119.74 111.95 3h3g s LYS -200Ca 0.28 -1.95 0.04 0.00 -1.36 0.00 0.00 55.97 52.98 3h3g s LYS -200Cb -0.12 0.30 -0.04 0.00 -1.68 0.00 0.00 37.83 36.28 3h3g s LYS -200CO 0.34 -0.60 -0.10 -1.54 -0.76 0.00 0.00 175.35 172.70 3h3g s SER -199N -3.34 1.56 -0.01 2.83 1.04 -1.02 -1.73 113.70 113.04 3h3g s SER -199Ca 0.40 -0.89 -0.24 0.00 0.48 0.00 0.00 55.95 55.71 3h3g s SER -199Cb 0.03 0.01 -0.19 0.00 0.10 0.00 0.00 66.02 65.97 3h3g s SER -199CO 0.24 -0.29 1.24 0.00 0.98 0.00 0.00 173.24 175.41 3h3g h ALA -198N 3.27 0.09 -2.71 5.32 0.00 -1.85 -0.79 119.26 122.59 3h3g h ALA -198Ca -0.37 -0.32 -0.13 0.00 0.00 0.00 0.00 54.91 54.09 3h3g h ALA -198Cb 1.19 -0.01 -0.27 0.00 0.00 0.00 0.00 17.79 18.70 3h3g h ALA -198CO 0.57 -0.05 -0.31 -1.17 0.00 0.00 0.00 179.25 178.28 3h3g s LEU -197N -9.02 0.05 -0.03 0.00 2.96 -1.26 -0.56 118.68 110.82 3h3g s LEU -197Ca -0.15 0.84 0.01 0.00 -0.22 0.00 0.00 54.13 54.60 3h3g s LEU -197Cb 0.03 1.28 0.03 0.00 0.50 0.00 0.00 46.19 48.02 3h3g s LEU -197CO 0.72 -0.18 -0.01 -0.04 -1.32 0.00 0.00 176.35 175.51 3h3g s MET -196N 1.20 0.46 0.18 1.98 -1.94 -0.85 -4.84 119.30 115.50 3h3g s MET -196Ca -0.08 0.02 -0.11 0.00 -1.71 0.00 0.00 55.69 53.80 3h3g s MET -196Cb -0.08 -0.58 0.00 0.00 2.01 0.00 0.00 34.83 36.18 3h3g s MET -196CO -0.10 -0.12 0.36 -0.59 -0.01 0.00 0.00 175.02 174.57 3h3g s PHE -195N 0.97 0.28 -0.17 -0.03 -0.71 -1.26 -4.11 117.98 112.95 3h3g s PHE -195Ca -0.10 -0.64 -0.29 0.00 -1.04 0.00 0.00 56.93 54.86 3h3g s PHE -195Cb -0.14 0.08 -0.05 0.00 -1.21 0.00 0.00 43.02 41.70 3h3g s PHE -195CO -0.01 -0.80 1.91 1.21 -1.34 0.00 0.00 175.22 176.18 3h3g s ASN -194N -2.95 6.05 0.00 1.98 2.47 -1.26 -4.62 114.94 116.61 3h3g s ASN -194Ca 0.16 1.91 0.25 0.00 0.42 0.00 0.00 52.86 55.61 3h3g s ASN -194Cb 0.02 -2.52 0.47 0.00 -1.45 0.00 0.00 41.25 37.76 3h3g s ASN -194CO 0.01 -1.48 1.41 0.18 -3.72 0.00 0.00 177.10 173.49 3h3g n LEU -193N 9.46 2.20 0.05 3.21 4.77 0.34 -4.24 117.00 132.79 3h3g n LEU -193Ca 0.23 -0.74 0.12 0.00 -0.03 0.00 0.00 56.01 55.59 3h3g n LEU -193Cb 0.44 -0.01 0.07 0.00 -2.33 0.00 0.00 43.42 41.59 3h3g n LEU -193CO 0.66 0.38 0.11 0.00 -1.33 0.00 0.00 177.39 177.21 3h3g n GLN -192N 0.58 0.34 -4.11 3.23 1.13 -1.25 -4.66 117.38 112.64 3h3g n GLN -192Ca 0.15 0.04 -0.33 0.00 -1.94 0.00 0.00 57.00 54.92 3h3g n GLN -192Cb 0.48 -1.66 -0.16 0.00 0.11 0.00 0.00 30.24 29.01 3h3g n GLN -192CO 0.00 0.00 0.00 -1.21 -1.44 0.00 0.00 177.06 174.41 3h3g s GLU -191N -3.22 2.89 0.64 -1.09 0.41 -1.26 -5.00 118.70 112.07 3h3g s GLU -191Ca 0.04 -0.81 0.42 0.00 -0.41 0.00 0.00 54.97 54.21 3h3g s GLU -191Cb 0.13 -2.52 2.22 0.00 -1.78 0.00 0.00 34.13 32.18 3h3g s GLU -191CO 0.77 -0.22 2.30 -1.00 -0.49 0.00 0.00 175.26 176.62 3h3g h PRO -190N 7.95 0.00 -0.95 0.39 0.13 -1.89 -2.14 132.00 135.50 3h3g h PRO -190Ca -0.44 0.00 0.20 0.00 -0.87 0.00 0.00 66.00 64.89 3h3g h PRO -190Cb 1.14 0.00 -0.08 0.00 0.13 0.00 0.00 31.00 32.19 3h3g h PRO -190CO 0.62 0.00 0.61 -0.92 -0.23 0.00 0.00 178.00 178.08 3h3g h TYR -189N 0.00 0.73 0.00 1.56 3.20 -1.95 0.10 116.97 120.61 3h3g h TYR -189Ca -0.00 0.02 -0.14 0.00 3.14 0.00 0.00 58.73 61.75 3h3g h TYR -189Cb 0.10 -0.22 -0.02 0.00 1.54 0.00 0.00 36.73 38.13 3h3g h TYR -189CO 0.00 0.18 -0.76 0.74 -1.64 0.00 0.00 178.16 176.67 3h3g h PHE -188N 0.53 0.00 0.00 -3.82 0.04 -1.65 -3.31 116.94 108.74 3h3g h PHE -188Ca 0.51 0.00 0.00 0.00 2.80 0.00 0.00 57.97 61.28 3h3g h PHE -188Cb 1.09 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.24 3h3g h PHE -188CO -0.00 0.64 -1.24 0.25 -0.60 0.00 0.00 178.31 177.36 3h3g n THR -187N -3.21 0.16 -0.20 -1.55 -2.24 -0.82 -4.39 114.28 102.03 3h3g n THR -187Ca -0.00 -0.30 0.00 0.00 -2.27 0.00 0.00 64.05 61.47 3h3g n THR -187Cb 0.80 0.20 0.11 0.00 -2.10 0.00 0.00 70.33 69.34 3h3g n THR -187CO 0.00 0.00 0.00 -0.25 -0.57 0.00 0.00 175.07 174.25 3h3g h TRP -186N 0.00 0.33 -0.93 4.78 2.91 -0.90 -2.39 115.95 119.75 3h3g h TRP -186Ca 0.00 0.03 0.19 0.00 1.13 0.00 0.00 58.89 60.24 3h3g h TRP -186Cb 0.79 -0.06 -0.08 0.00 -0.51 0.00 0.00 29.16 29.31 3h3g h TRP -186CO 0.00 0.05 0.60 -1.35 -1.03 0.00 0.00 178.44 176.71 3h3g h PRO -185N 0.35 0.56 -0.03 2.65 0.11 -1.77 0.43 132.00 134.30 3h3g h PRO -185Ca 0.31 -0.03 -0.03 0.00 0.11 0.00 0.00 66.00 66.36 3h3g h PRO -185Cb 0.41 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 31.39 3h3g h PRO -185CO -0.34 0.37 -0.08 1.25 -0.21 0.00 0.00 178.00 178.99 3h3g h LEU -184N 0.58 0.13 -0.97 2.35 5.85 -1.76 -1.03 115.31 120.45 3h3g h LEU -184Ca 0.50 -0.59 0.15 0.00 0.84 0.00 0.00 57.88 58.77 3h3g h LEU -184Cb 0.99 -0.04 -0.09 0.00 0.37 0.00 0.00 40.66 41.89 3h3g h LEU -184CO -0.24 0.70 0.59 0.40 -0.34 0.00 0.00 178.44 179.56 3h3g h ILE -183N -0.43 0.81 0.00 4.05 2.04 -0.92 -2.91 117.51 120.15 3h3g h ILE -183Ca -0.00 -0.29 -0.07 0.00 1.00 0.00 0.00 64.86 65.50 3h3g h ILE -183Cb 0.69 -0.11 -0.01 0.00 -0.74 0.00 0.00 36.82 36.65 3h3g h ILE -183CO 0.02 0.15 -0.55 0.00 0.00 0.00 0.00 178.15 177.78 3h3g h ALA -182N 1.58 0.74 -0.48 1.87 0.00 -0.99 -2.99 119.26 119.00 3h3g h ALA -182Ca 0.52 -0.32 0.10 0.00 0.00 0.00 0.00 54.91 55.20 3h3g h ALA -182Cb 0.67 0.00 -0.10 0.00 0.00 0.00 0.00 17.79 18.36 3h3g h ALA -182CO -0.32 0.41 -0.18 0.00 0.00 0.00 0.00 179.25 179.15 3h3g h ALA -181N 1.69 0.20 -0.50 0.00 0.00 -1.23 -1.70 119.26 117.72 3h3g h ALA -181Ca -0.02 0.17 -0.21 0.00 0.00 0.00 0.00 54.91 54.84 3h3g h ALA -181Cb 1.26 0.48 -0.13 0.00 0.00 0.00 0.00 17.79 19.40 3h3g h ALA -181CO 0.04 -0.52 0.12 -3.47 0.00 0.00 0.00 179.25 175.41 3h3g n ASP -180N -5.39 3.26 0.00 0.00 2.03 -1.26 -4.69 116.55 110.50 3h3g n ASP -180Ca 0.04 -3.54 0.00 0.00 0.52 0.00 0.00 54.79 51.81 3h3g n ASP -180Cb 0.29 -0.67 0.00 0.00 -0.72 0.00 0.00 41.12 40.02 3h3g n ASP -180CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3h3g n GLY -179N -0.90 0.69 3.75 0.27 0.00 -0.64 -4.08 105.19 104.28 3h3g n GLY -179Ca 0.37 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.99 3h3g n GLY -179CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3h3g n GLY -178N 0.00 0.91 3.28 -0.02 0.00 -1.13 -4.72 105.19 103.51 3h3g n GLY -178Ca 0.00 0.13 -0.10 0.00 0.00 0.00 0.00 46.02 46.06 3h3g n GLY -178CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3h3g s TYR -177N -1.22 0.02 0.00 1.61 -0.85 -0.75 -4.37 117.35 111.79 3h3g s TYR -177Ca 0.65 -0.40 0.00 0.00 -0.52 0.00 0.00 57.07 56.80 3h3g s TYR -177Cb -0.44 0.09 0.00 0.00 0.38 0.00 0.00 41.96 41.99 3h3g s TYR -177CO 0.55 -0.64 0.00 0.00 -1.52 0.00 0.00 175.55 173.94 3h3g n ALA -176N -0.15 0.00 -2.68 9.51 0.00 -1.26 -1.59 120.51 124.33 3h3g n ALA -176Ca -0.14 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 52.97 3h3g n ALA -176Cb 0.63 0.00 -0.14 0.00 0.00 0.00 0.00 19.45 19.94 3h3g n ALA -176CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 3h3g s PHE -175N 0.00 2.68 0.15 0.00 0.08 -1.26 -2.37 117.98 117.26 3h3g s PHE -175Ca 0.00 -0.39 -0.31 0.00 0.12 0.00 0.00 56.93 56.34 3h3g s PHE -175Cb 0.00 -1.68 -0.10 0.00 -0.57 0.00 0.00 43.02 40.67 3h3g s PHE -175CO 0.00 0.00 1.59 0.21 -0.10 0.00 0.00 175.22 176.93 3h3g s LYS -174N -0.33 4.21 -0.46 0.44 2.47 -0.68 -4.83 119.74 120.57 3h3g s LYS -174Ca 0.03 2.36 -0.19 0.00 -1.56 0.00 0.00 55.97 56.61 3h3g s LYS -174Cb -0.13 -3.24 0.04 0.00 -1.46 0.00 0.00 37.83 33.04 3h3g s LYS -174CO 0.02 -0.64 0.58 -0.47 0.16 0.00 0.00 175.35 175.01 3h3g s TYR -173N 1.44 3.08 -0.34 4.03 5.04 -1.26 -0.97 117.35 128.38 3h3g s TYR -173Ca 0.71 -0.31 -0.07 0.00 -2.44 0.00 0.00 57.07 54.96 3h3g s TYR -173Cb -0.43 -3.30 0.04 0.00 0.35 0.00 0.00 41.96 38.62 3h3g s TYR -173CO 0.31 -0.89 0.11 -2.00 -1.34 0.00 0.00 175.55 171.74 3h3g s GLU -172N 2.58 2.66 -0.29 4.97 2.56 0.10 -4.92 118.70 126.35 3h3g s GLU -172Ca 0.17 -1.16 -0.26 0.00 0.00 0.00 0.00 54.97 53.72 3h3g s GLU -172Cb -0.17 -3.47 -0.11 0.00 2.00 0.00 0.00 34.13 32.38 3h3g s GLU -172CO 0.15 -0.65 1.14 0.09 -0.56 0.00 0.00 175.26 175.43 3h3g n ASN -171N 4.82 0.54 0.00 -1.70 4.13 -1.26 -1.26 115.26 120.53 3h3g n ASN -171Ca -0.13 0.51 0.00 0.00 1.68 0.00 0.00 54.58 56.64 3h3g n ASN -171Cb 0.45 -0.52 0.00 0.00 -1.54 0.00 0.00 39.78 38.16 3h3g n ASN -171CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3h3g n GLY -170N 3.64 3.14 3.61 7.41 0.00 -1.26 -5.08 105.19 116.65 3h3g n GLY -170Ca 0.27 -0.90 -0.09 0.00 0.00 0.00 0.00 46.02 45.31 3h3g n GLY -170CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3h3g s LYS -169N 0.00 1.53 0.06 1.61 -2.85 -0.39 -5.16 119.74 114.54 3h3g s LYS -169Ca 0.00 -1.07 -0.22 0.00 -1.00 0.00 0.00 55.97 53.68 3h3g s LYS -169Cb 0.00 0.51 -0.06 0.00 -2.06 0.00 0.00 37.83 36.22 3h3g s LYS -169CO 0.00 -0.65 0.65 0.71 0.10 0.00 0.00 175.35 176.16 3h3g s TYR -168N -3.95 3.77 -0.47 1.78 2.02 -1.26 0.01 117.35 119.25 3h3g s TYR -168Ca 0.16 1.34 -0.17 0.00 -0.37 0.00 0.00 57.07 58.03 3h3g s TYR -168Cb -0.02 -2.64 0.06 0.00 -0.40 0.00 0.00 41.96 38.97 3h3g s TYR -168CO 0.04 0.44 0.45 0.34 -1.57 0.00 0.00 175.55 175.25 3h3g s ASP -167N -0.60 6.17 0.21 2.29 -1.08 -0.15 -4.94 116.67 118.57 3h3g s ASP -167Ca 0.32 -1.15 0.22 0.00 -0.52 0.00 0.00 52.55 51.42 3h3g s ASP -167Cb -0.20 -2.21 0.91 0.00 -1.46 0.00 0.00 42.92 39.96 3h3g s ASP -167CO 0.20 -0.69 1.67 2.30 0.52 0.00 0.00 175.17 179.17 3h3g n ILE -166N 5.32 0.84 0.95 4.11 -5.35 -1.26 -1.57 119.36 122.41 3h3g n ILE -166Ca -0.10 0.21 0.13 0.00 -0.27 0.00 0.00 62.75 62.72 3h3g n ILE -166Cb 0.45 -1.11 0.40 0.00 -1.74 0.00 0.00 39.64 37.64 3h3g n ILE -166CO 0.00 0.00 0.00 0.29 -1.76 0.00 0.00 176.55 175.08 3h3g n LYS -165N -2.11 0.03 -3.83 6.28 5.02 -1.26 -4.62 118.16 117.68 3h3g n LYS -165Ca 0.02 0.02 -0.34 0.00 -2.02 0.00 0.00 58.31 55.99 3h3g n LYS -165Cb 0.23 -1.53 -0.12 0.00 -0.02 0.00 0.00 35.03 33.59 3h3g n LYS -165CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 3h3g s ASP -164N -3.15 4.91 -0.07 4.39 -1.08 -0.61 -5.07 116.67 115.99 3h3g s ASP -164Ca 0.12 -2.71 -0.01 0.00 -0.52 0.00 0.00 52.55 49.42 3h3g s ASP -164Cb 0.18 -1.76 -0.03 0.00 -1.46 0.00 0.00 42.92 39.84 3h3g s ASP -164CO 0.63 -0.35 0.00 -0.69 0.52 0.00 0.00 175.17 175.28 3h3g s VAL -163N 0.14 4.29 -0.32 1.11 1.01 -1.26 -1.69 120.40 123.68 3h3g s VAL -163Ca 0.15 -0.32 0.07 0.00 0.00 0.00 0.00 61.98 61.88 3h3g s VAL -163Cb -0.22 -2.83 0.47 0.00 0.00 0.00 0.00 36.38 33.80 3h3g s VAL -163CO -0.03 0.56 1.39 0.61 0.00 0.00 0.00 175.10 177.63 3h3g n GLY -162N 1.98 5.63 0.14 4.51 0.00 -0.62 -4.69 105.19 112.14 3h3g n GLY -162Ca -0.18 -1.91 0.09 0.00 0.00 0.00 0.00 46.02 44.02 3h3g n GLY -162CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3h3g h VAL -161N 1.44 0.17 -0.10 1.61 2.07 -1.82 -1.99 116.25 117.62 3h3g h VAL -161Ca 0.29 -1.28 -0.12 0.00 0.82 0.00 0.00 66.70 66.41 3h3g h VAL -161Cb 1.41 1.81 -0.17 0.00 -1.52 0.00 0.00 31.29 32.82 3h3g h VAL -161CO 0.61 0.10 -0.71 -0.90 0.02 0.00 0.00 177.57 176.68 3h3g n ASP -160N -2.88 1.87 -4.21 0.57 5.75 -1.26 -4.67 116.55 111.71 3h3g n ASP -160Ca -0.00 -3.29 -0.29 0.00 -0.01 0.00 0.00 54.79 51.20 3h3g n ASP -160Cb 0.61 -0.45 0.17 0.00 -1.03 0.00 0.00 41.12 40.43 3h3g n ASP -160CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 3h3g s ASN -159N -2.98 3.31 0.30 -1.12 2.20 -1.26 -4.87 114.94 110.53 3h3g s ASN -159Ca 0.38 0.13 -0.01 0.00 -0.94 0.00 0.00 52.86 52.42 3h3g s ASN -159Cb 0.38 -0.22 0.47 0.00 -2.00 0.00 0.00 41.25 39.88 3h3g s ASN -159CO -0.08 -2.59 1.92 0.00 -2.94 0.00 0.00 177.10 173.40 3h3g h ALA -158N -1.45 1.36 -0.14 3.54 0.00 -1.94 -1.99 119.26 118.64 3h3g h ALA -158Ca -0.43 -0.12 -0.17 0.00 0.00 0.00 0.00 54.91 54.20 3h3g h ALA -158Cb 1.24 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.75 3h3g h ALA -158CO 0.38 0.51 -0.62 0.78 0.00 0.00 0.00 179.25 180.31 3h3g h GLY -157N 0.99 0.53 1.04 0.00 0.00 -1.88 -0.21 103.07 103.54 3h3g h GLY -157Ca 0.23 -0.66 -0.11 0.00 0.00 0.00 0.00 47.33 46.79 3h3g h GLY -157CO -0.03 0.59 -0.14 0.00 0.00 0.00 0.00 176.54 176.96 3h3g h ALA -156N 0.97 0.62 -0.19 3.60 0.00 -1.58 -2.14 119.26 120.54 3h3g h ALA -156Ca -0.01 -0.35 -0.00 0.00 0.00 0.00 0.00 54.91 54.55 3h3g h ALA -156Cb 1.16 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.79 3h3g h ALA -156CO 0.11 0.54 0.10 0.87 0.00 0.00 0.00 179.25 180.87 3h3g h LYS -155N 0.72 0.26 -0.60 0.00 1.57 -1.27 -1.54 116.57 115.71 3h3g h LYS -155Ca 0.11 -0.03 0.08 0.00 -1.87 0.00 0.00 60.65 58.94 3h3g h LYS -155Cb 0.69 -0.05 -0.07 0.00 0.08 0.00 0.00 32.23 32.89 3h3g h LYS -155CO 0.05 0.25 0.26 0.00 -0.57 0.00 0.00 179.45 179.44 3h3g h ALA -154N 1.00 0.78 -0.21 3.86 0.00 -0.98 0.81 119.26 124.52 3h3g h ALA -154Ca 0.07 0.06 -0.05 0.00 0.00 0.00 0.00 54.91 54.99 3h3g h ALA -154Cb 0.06 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 3h3g h ALA -154CO -0.01 -0.14 -0.07 0.78 0.00 0.00 0.00 179.25 179.81 3h3g h GLY -153N 0.46 0.46 1.30 0.00 0.00 -1.23 -1.96 103.07 102.11 3h3g h GLY -153Ca 0.29 -0.39 -0.13 0.00 0.00 0.00 0.00 47.33 47.11 3h3g h GLY -153CO -0.26 0.35 -0.28 -2.00 0.00 0.00 0.00 176.54 174.35 3h3g h LEU -152N 0.14 0.81 -0.77 3.11 5.85 -1.13 -2.66 115.31 120.65 3h3g h LEU -152Ca 0.05 -0.32 0.08 0.00 0.84 0.00 0.00 57.88 58.53 3h3g h LEU -152Cb 0.54 -0.23 -0.07 0.00 0.37 0.00 0.00 40.66 41.27 3h3g h LEU -152CO 0.02 1.04 0.44 0.74 -0.34 0.00 0.00 178.44 180.34 3h3g h THR -151N 0.68 0.93 -0.67 1.05 2.02 -0.76 -0.32 112.91 115.84 3h3g h THR -151Ca 0.08 -0.26 -0.01 0.00 0.77 0.00 0.00 66.41 66.99 3h3g h THR -151Cb 0.81 0.11 -0.03 0.00 -1.74 0.00 0.00 68.15 67.29 3h3g h THR -151CO 0.07 0.14 0.39 0.15 0.37 0.00 0.00 175.52 176.64 3h3g h PHE -150N 0.76 0.89 -0.31 3.16 3.57 -1.12 1.00 116.94 124.89 3h3g h PHE -150Ca 0.36 -0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.85 3h3g h PHE -150Cb 0.29 -0.29 -0.01 0.00 2.79 0.00 0.00 35.95 38.72 3h3g h PHE -150CO -0.07 0.61 0.18 1.25 -2.23 0.00 0.00 178.31 178.05 3h3g h LEU -149N 0.91 0.38 -0.56 0.59 5.85 -1.09 -1.53 115.31 119.86 3h3g h LEU -149Ca 0.24 -0.06 -0.03 0.00 0.84 0.00 0.00 57.88 58.87 3h3g h LEU -149Cb -0.01 -0.09 -0.02 0.00 0.37 0.00 0.00 40.66 40.90 3h3g h LEU -149CO -0.04 0.33 0.23 0.58 -0.34 0.00 0.00 178.44 179.19 3h3g h VAL -148N 0.39 1.22 -0.66 1.05 2.07 -0.77 -2.48 116.25 117.06 3h3g h VAL -148Ca 0.11 -0.67 -0.04 0.00 0.82 0.00 0.00 66.70 66.91 3h3g h VAL -148Cb 0.03 0.62 -0.03 0.00 -1.52 0.00 0.00 31.29 30.39 3h3g h VAL -148CO -0.02 0.26 0.24 0.44 0.02 0.00 0.00 177.57 178.51 3h3g h ASP -147N 0.76 0.92 -0.81 0.57 3.32 -0.63 0.49 116.42 121.04 3h3g h ASP -147Ca 0.19 -0.14 0.08 0.00 0.02 0.00 0.00 57.03 57.17 3h3g h ASP -147Cb 0.19 -0.24 -0.06 0.00 0.22 0.00 0.00 39.33 39.43 3h3g h ASP -147CO -0.02 0.84 0.47 -0.07 -1.72 0.00 0.00 179.24 178.74 3h3g h LEU -146N 0.97 0.71 -0.09 1.55 3.38 -0.96 0.15 115.31 121.02 3h3g h LEU -146Ca 0.22 0.03 -0.02 0.00 0.09 0.00 0.00 57.88 58.20 3h3g h LEU -146Cb 0.23 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 40.86 3h3g h LEU -146CO -0.01 0.43 -0.02 0.40 0.09 0.00 0.00 178.44 179.33 3h3g h ILE -145N 0.84 1.30 -0.96 1.22 2.04 -0.98 0.32 117.51 121.27 3h3g h ILE -145Ca 0.37 -0.96 0.07 0.00 1.00 0.00 0.00 64.86 65.35 3h3g h ILE -145Cb 0.26 1.75 -0.07 0.00 -0.74 0.00 0.00 36.82 38.02 3h3g h ILE -145CO -0.21 0.27 0.61 0.11 0.00 0.00 0.00 178.15 178.94 3h3g h LYS -144N -0.16 1.06 -0.28 2.37 1.57 -0.60 -0.45 116.57 120.08 3h3g h LYS -144Ca 0.02 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.74 3h3g h LYS -144Cb 0.44 -0.24 0.00 0.00 0.08 0.00 0.00 32.23 32.51 3h3g h LYS -144CO 0.01 0.70 0.00 0.09 -0.57 0.00 0.00 179.45 179.68 3h3g n ASN -143N -4.56 1.48 -1.66 0.86 5.03 0.50 -4.91 115.26 112.00 3h3g n ASN -143Ca 0.15 -2.01 -0.16 0.00 0.87 0.00 0.00 54.58 53.44 3h3g n ASN -143Cb 0.21 -0.19 -0.02 0.00 -1.02 0.00 0.00 39.78 38.76 3h3g n ASN -143CO 0.00 0.00 0.00 0.29 -1.83 0.00 0.00 177.26 175.72 3h3g n LYS -142N 0.30 -1.23 0.03 3.52 4.76 -0.18 -4.88 118.16 120.48 3h3g n LYS -142Ca 0.09 0.85 0.12 0.00 -2.87 0.00 0.00 58.31 56.50 3h3g n LYS -142Cb 0.24 -5.18 0.26 0.00 -1.84 0.00 0.00 35.03 28.50 3h3g n LYS -142CO 0.00 0.00 0.00 0.72 -1.37 0.00 0.00 177.40 176.75 3h3g n HIS -141N -3.62 0.30 -3.83 2.13 8.25 0.11 -4.91 115.22 113.64 3h3g n HIS -141Ca -0.18 0.09 -0.10 0.00 -0.26 0.00 0.00 57.72 57.27 3h3g n HIS -141Cb 0.61 -0.50 -0.06 0.00 1.12 0.00 0.00 29.99 31.16 3h3g n HIS -141CO 0.00 0.00 0.00 -1.64 0.64 0.00 0.00 176.34 175.34 3h3g s MET -140N -3.08 1.12 -0.16 -0.41 -1.94 -1.13 -4.71 119.30 108.98 3h3g s MET -140Ca 0.09 -0.98 -0.02 0.00 -1.71 0.00 0.00 55.69 53.08 3h3g s MET -140Cb 0.15 0.42 -0.01 0.00 2.01 0.00 0.00 34.83 37.40 3h3g s MET -140CO 0.69 -0.42 -0.10 -0.80 -0.01 0.00 0.00 175.02 174.38 3h3g s ASN -139N -2.89 4.16 0.57 3.03 0.01 -1.26 -4.25 114.94 114.31 3h3g s ASN -139Ca 0.10 -0.33 0.28 0.00 -0.71 0.00 0.00 52.86 52.20 3h3g s ASN -139Cb 0.02 -1.66 1.50 0.00 0.41 0.00 0.00 41.25 41.52 3h3g s ASN -139CO -0.05 0.11 1.96 0.00 -1.51 0.00 0.00 177.10 177.60 3h3g h ALA -138N 7.15 2.21 -0.01 0.60 0.00 -1.93 -1.48 119.26 125.79 3h3g h ALA -138Ca -0.32 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.58 3h3g h ALA -138Cb 1.19 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.02 3h3g h ALA -138CO 0.58 -0.64 -0.05 -0.40 0.00 0.00 0.00 179.25 178.75 3h3g n ASP -137N -3.90 1.02 -4.69 0.00 5.75 -1.26 -4.83 116.55 108.65 3h3g n ASP -137Ca 0.08 -1.21 -0.43 0.00 -0.01 0.00 0.00 54.79 53.22 3h3g n ASP -137Cb 0.60 0.01 -0.03 0.00 -1.03 0.00 0.00 41.12 40.67 3h3g n ASP -137CO 0.00 0.00 0.00 0.41 -0.11 0.00 0.00 177.20 177.50 3h3g n THR -136N -0.29 0.39 -4.21 2.12 -1.04 -0.56 -4.95 114.28 105.74 3h3g n THR -136Ca 0.19 -0.07 -0.10 0.00 -2.04 0.00 0.00 64.05 62.02 3h3g n THR -136Cb 0.30 -2.09 -0.02 0.00 -1.82 0.00 0.00 70.33 66.69 3h3g n THR -136CO 0.00 0.00 0.00 -0.90 -0.64 0.00 0.00 175.07 173.53 3h3g n ASP -135N 5.74 2.41 0.22 8.00 5.68 -1.26 -0.50 116.55 136.82 3h3g n ASP -135Ca 0.18 -1.70 -0.15 0.00 -0.50 0.00 0.00 54.79 52.62 3h3g n ASP -135Cb 0.37 0.11 -0.07 0.00 -1.14 0.00 0.00 41.12 40.38 3h3g n ASP -135CO 0.00 0.00 0.00 0.22 -1.33 0.00 0.00 177.20 176.09 3h3g h TYR -134N 1.06 -0.65 -0.10 2.11 5.03 -1.92 -1.17 116.97 121.33 3h3g h TYR -134Ca -0.13 -0.00 -0.10 0.00 2.58 0.00 0.00 58.73 61.08 3h3g h TYR -134Cb 0.40 0.24 -0.01 0.00 1.55 0.00 0.00 36.73 38.91 3h3g h TYR -134CO 0.00 -0.38 -0.37 0.66 -1.32 0.00 0.00 178.16 176.75 3h3g h SER -133N -0.59 0.21 -0.06 -2.11 4.64 -1.98 0.52 113.55 114.17 3h3g h SER -133Ca -0.03 -0.08 -0.01 0.00 -0.47 0.00 0.00 61.79 61.20 3h3g h SER -133Cb 0.50 -0.06 -0.00 0.00 -0.31 0.00 0.00 62.40 62.53 3h3g h SER -133CO 0.01 0.57 -0.01 0.40 -0.87 0.00 0.00 176.83 176.93 3h3g h ILE -132N 0.17 1.28 -0.57 0.95 2.04 -1.91 -0.83 117.51 118.64 3h3g h ILE -132Ca 0.02 -0.86 -0.02 0.00 1.00 0.00 0.00 64.86 65.00 3h3g h ILE -132Cb 0.74 1.74 -0.03 0.00 -0.74 0.00 0.00 36.82 38.53 3h3g h ILE -132CO 0.06 0.24 0.29 0.00 0.00 0.00 0.00 178.15 178.73 3h3g h ALA -131N 0.68 0.73 -0.45 1.87 0.00 -0.99 -1.14 119.26 119.97 3h3g h ALA -131Ca 0.02 -0.11 -0.05 0.00 0.00 0.00 0.00 54.91 54.76 3h3g h ALA -131Cb 0.38 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 3h3g h ALA -131CO 0.00 0.27 0.08 1.49 0.00 0.00 0.00 179.25 181.10 3h3g h GLU -130N 0.76 0.73 -0.48 0.00 4.81 -0.88 -1.18 114.58 118.34 3h3g h GLU -130Ca 0.20 -0.19 -0.02 0.00 -0.13 0.00 0.00 59.36 59.21 3h3g h GLU -130Cb 0.08 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 29.35 3h3g h GLU -130CO -0.03 0.75 0.20 0.00 -0.73 0.00 0.00 179.01 179.20 3h3g h ALA -129N 0.95 0.62 -0.62 2.92 0.00 -1.08 -0.48 119.26 121.58 3h3g h ALA -129Ca 0.14 -0.14 0.01 0.00 0.00 0.00 0.00 54.91 54.92 3h3g h ALA -129Cb 0.36 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.93 3h3g h ALA -129CO 0.01 0.22 0.40 0.00 0.00 0.00 0.00 179.25 179.87 3h3g h ALA -128N 1.05 0.79 -0.20 0.00 0.00 -1.02 -1.31 119.26 118.58 3h3g h ALA -128Ca 0.16 -0.03 -0.12 0.00 0.00 0.00 0.00 54.91 54.92 3h3g h ALA -128Cb 0.17 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.73 3h3g h ALA -128CO -0.02 0.18 -0.33 0.35 0.00 0.00 0.00 179.25 179.44 3h3g h PHE -127N 0.81 0.71 0.00 0.00 3.04 -1.13 0.35 116.94 120.71 3h3g h PHE -127Ca 0.23 -0.25 0.00 0.00 3.98 0.00 0.00 57.97 61.94 3h3g h PHE -127Cb -0.06 -0.14 0.00 0.00 2.56 0.00 0.00 35.95 38.32 3h3g h PHE -127CO -0.04 0.98 0.00 0.09 -2.02 0.00 0.00 178.31 177.32 3h3g n ASN -126N -4.31 0.00 -0.79 0.41 5.03 -0.20 -1.78 115.26 113.62 3h3g n ASN -126Ca -0.06 0.10 0.07 0.00 0.87 0.00 0.00 54.58 55.56 3h3g n ASN -126Cb 0.49 -0.35 0.18 0.00 -1.02 0.00 0.00 39.78 39.08 3h3g n ASN -126CO 0.00 0.00 0.00 0.29 -1.83 0.00 0.00 177.26 175.72 3h3g n LYS -125N -1.35 2.56 -1.75 3.52 5.02 -0.52 -4.84 118.16 120.81 3h3g n LYS -125Ca 0.10 -2.08 -0.10 0.00 -2.02 0.00 0.00 58.31 54.20 3h3g n LYS -125Cb 0.21 -1.34 -0.02 0.00 -0.02 0.00 0.00 35.03 33.86 3h3g n LYS -125CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3h3g n GLY -124N 0.81 0.57 0.12 0.72 0.00 -0.73 -4.91 105.19 101.76 3h3g n GLY -124Ca 0.14 -0.50 0.03 0.00 0.00 0.00 0.00 46.02 45.69 3h3g n GLY -124CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3h3g h GLU -123N 0.00 0.00 -4.89 1.61 5.08 -1.14 -3.46 114.58 111.78 3h3g h GLU -123Ca -0.23 0.00 -0.39 0.00 -1.00 0.00 0.00 59.36 57.74 3h3g h GLU -123Cb 0.93 0.00 -0.26 0.00 0.50 0.00 0.00 28.75 29.92 3h3g h GLU -123CO 0.30 0.32 -0.78 -0.08 -1.00 0.00 0.00 179.01 177.78 3h3g s THR -122N -3.01 0.81 -0.01 1.13 -1.32 -1.14 -2.43 115.64 109.67 3h3g s THR -122Ca 0.01 -0.69 0.15 0.00 -1.21 0.00 0.00 61.69 59.95 3h3g s THR -122Cb 0.08 -0.73 0.04 0.00 -1.51 0.00 0.00 72.50 70.38 3h3g s THR -122CO 0.77 0.05 1.50 0.00 -2.21 0.00 0.00 174.62 174.74 3h3g h ALA -121N 5.38 0.72 -2.92 11.08 0.00 -1.05 -3.43 119.26 129.05 3h3g h ALA -121Ca -0.34 -0.50 -0.16 0.00 0.00 0.00 0.00 54.91 53.91 3h3g h ALA -121Cb 1.18 -0.09 -0.21 0.00 0.00 0.00 0.00 17.79 18.68 3h3g h ALA -121CO 0.46 0.68 -0.68 -1.64 0.00 0.00 0.00 179.25 178.08 3h3g s MET -120N -3.11 0.35 0.19 0.00 -1.94 0.28 0.12 119.30 115.17 3h3g s MET -120Ca 0.02 -0.62 -0.01 0.00 -1.71 0.00 0.00 55.69 53.37 3h3g s MET -120Cb 0.09 0.13 -0.04 0.00 2.01 0.00 0.00 34.83 37.01 3h3g s MET -120CO 0.74 -0.06 0.10 -0.08 -0.01 0.00 0.00 175.02 175.71 3h3g s THR -119N -1.59 0.09 -0.16 2.05 -1.32 0.36 -2.01 115.64 113.06 3h3g s THR -119Ca -0.15 -1.98 0.01 0.00 -1.21 0.00 0.00 61.69 58.37 3h3g s THR -119Cb -0.09 -2.38 0.02 0.00 -1.51 0.00 0.00 72.50 68.54 3h3g s THR -119CO -0.01 -0.13 -0.19 -0.63 -2.21 0.00 0.00 174.62 171.45 3h3g s ILE -118N -4.08 1.91 0.23 5.08 1.01 -1.26 -1.13 121.20 122.96 3h3g s ILE -118Ca 0.35 -0.85 -0.22 0.00 0.00 0.00 0.00 60.65 59.92 3h3g s ILE -118Cb 0.07 -1.73 0.05 0.00 0.01 0.00 0.00 42.46 40.86 3h3g s ILE -118CO 0.09 0.52 0.85 0.21 0.00 0.00 0.00 174.94 176.61 3h3g s ASN -117N 1.26 -0.18 0.54 3.58 3.84 -1.10 -4.67 114.94 118.22 3h3g s ASN -117Ca 0.03 -0.58 0.08 0.00 0.21 0.00 0.00 52.86 52.60 3h3g s ASN -117Cb -0.13 0.62 0.06 0.00 -0.55 0.00 0.00 41.25 41.25 3h3g s ASN -117CO -0.10 -1.16 0.74 -0.83 -2.79 0.00 0.00 177.10 172.95 3h3g s GLY -116N -2.98 1.81 0.35 1.21 0.00 -1.26 -1.71 107.32 104.74 3h3g s GLY -116Ca 0.13 -1.90 0.09 0.00 0.00 0.00 0.00 44.72 43.03 3h3g s GLY -116CO 0.05 -1.53 1.85 -2.55 0.00 0.00 0.00 173.10 170.92 3h3g h PRO -115N 0.25 0.68 -0.65 2.90 0.11 -1.84 -1.72 132.00 131.74 3h3g h PRO -115Ca -0.34 -0.04 0.19 0.00 0.11 0.00 0.00 66.00 65.91 3h3g h PRO -115Cb 1.28 -0.15 -0.03 0.00 0.11 0.00 0.00 31.00 32.22 3h3g h PRO -115CO 0.43 0.45 0.54 0.11 -0.21 0.00 0.00 178.00 179.32 3h3g h TRP -114N 0.70 0.00 0.00 0.65 0.09 -1.80 -0.38 115.95 115.21 3h3g h TRP -114Ca 0.48 0.00 0.00 0.00 0.09 0.00 0.00 58.89 59.46 3h3g h TRP -114Cb 0.79 0.00 0.00 0.00 0.08 0.00 0.00 29.16 30.03 3h3g h TRP -114CO -0.00 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.53 3h3g n ALA -113N -2.54 2.00 -0.07 0.11 0.00 -0.65 -4.13 120.51 115.24 3h3g n ALA -113Ca 0.13 0.03 -0.03 0.00 0.00 0.00 0.00 53.44 53.57 3h3g n ALA -113Cb 0.79 -1.43 0.21 0.00 0.00 0.00 0.00 19.45 19.02 3h3g n ALA -113CO 0.00 0.00 0.00 -1.49 0.00 0.00 0.00 177.50 176.01 3h3g h TRP -112N 0.00 0.72 -0.05 0.00 6.55 -1.23 -3.13 115.95 118.81 3h3g h TRP -112Ca 0.00 -0.09 -0.11 0.00 0.95 0.00 0.00 58.89 59.64 3h3g h TRP -112Cb 0.56 -0.20 -0.01 0.00 -0.86 0.00 0.00 29.16 28.65 3h3g h TRP -112CO 0.00 0.68 -0.48 0.66 -1.05 0.00 0.00 178.44 178.25 3h3g h SER -111N 0.64 0.13 -0.22 -3.49 4.64 -1.79 0.43 113.55 113.90 3h3g h SER -111Ca 0.13 -0.06 -0.08 0.00 -0.47 0.00 0.00 61.79 61.31 3h3g h SER -111Cb 0.41 -0.04 -0.02 0.00 -0.31 0.00 0.00 62.40 62.44 3h3g h SER -111CO 0.02 0.60 -0.13 0.78 -0.87 0.00 0.00 176.83 177.22 3h3g h ASN -110N 0.10 0.61 -0.39 4.97 2.35 -1.82 -1.09 115.58 120.31 3h3g h ASN -110Ca 0.00 -0.17 -0.12 0.00 -0.55 0.00 0.00 56.30 55.46 3h3g h ASN -110Cb 0.89 -0.16 -0.02 0.00 0.05 0.00 0.00 38.32 39.09 3h3g h ASN -110CO 0.07 0.76 -0.19 0.40 -1.65 0.00 0.00 177.43 176.83 3h3g h ILE -109N 0.57 1.27 -0.47 2.81 2.04 -1.44 -1.30 117.51 120.99 3h3g h ILE -109Ca 0.10 -1.32 0.05 0.00 1.00 0.00 0.00 64.86 64.70 3h3g h ILE -109Cb 0.55 1.12 -0.05 0.00 -0.74 0.00 0.00 36.82 37.71 3h3g h ILE -109CO 0.03 0.45 0.20 0.44 0.00 0.00 0.00 178.15 179.27 3h3g h ASP -108N 0.77 0.24 -0.77 1.72 3.32 -0.54 -2.13 116.42 119.04 3h3g h ASP -108Ca 0.11 0.04 -0.02 0.00 0.02 0.00 0.00 57.03 57.18 3h3g h ASP -108Cb 0.72 0.01 -0.04 0.00 0.22 0.00 0.00 39.33 40.24 3h3g h ASP -108CO 0.06 0.17 0.39 0.74 -1.72 0.00 0.00 179.24 178.88 3h3g h THR -107N 0.39 1.24 0.00 0.35 2.02 -1.01 -2.22 112.91 113.68 3h3g h THR -107Ca 0.22 -0.65 0.00 0.00 0.77 0.00 0.00 66.41 66.75 3h3g h THR -107Cb 0.19 0.22 0.00 0.00 -1.74 0.00 0.00 68.15 66.82 3h3g h THR -107CO -0.20 0.28 0.00 0.77 0.37 0.00 0.00 175.52 176.75 3h3g h SER -106N 1.10 0.00 -0.35 4.18 4.64 -0.64 -3.47 113.55 119.02 3h3g h SER -106Ca 0.27 0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 61.44 3h3g h SER -106Cb 0.08 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 62.11 3h3g h SER -106CO -0.04 0.00 -0.14 0.29 -0.87 0.00 0.00 176.83 176.08 3h3g n LYS -105N -2.95 -1.31 -2.01 4.77 4.76 -0.84 -4.98 118.16 115.60 3h3g n LYS -105Ca 0.01 0.69 -0.41 0.00 -2.87 0.00 0.00 58.31 55.73 3h3g n LYS -105Cb 0.27 -4.83 -0.01 0.00 -1.84 0.00 0.00 35.03 28.62 3h3g n LYS -105CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 3h3g s VAL -104N -1.88 2.50 -0.85 -0.18 1.01 -1.24 -4.94 120.40 114.83 3h3g s VAL -104Ca 0.00 0.50 -0.24 0.00 0.00 0.00 0.00 61.98 62.25 3h3g s VAL -104Cb 0.00 -3.32 0.06 0.00 0.00 0.00 0.00 36.38 33.12 3h3g s VAL -104CO 0.00 0.12 1.26 0.21 0.00 0.00 0.00 175.10 176.69 3h3g s ASN -103N -0.35 6.34 0.23 3.32 2.47 -1.26 -4.86 114.94 120.83 3h3g s ASN -103Ca 0.50 -1.11 0.10 0.00 0.42 0.00 0.00 52.86 52.77 3h3g s ASN -103Cb -0.42 -2.51 -0.04 0.00 -1.45 0.00 0.00 41.25 36.82 3h3g s ASN -103CO 0.56 -1.54 -0.13 -0.72 -3.72 0.00 0.00 177.10 171.54 3h3g s TYR -102N 4.74 2.49 0.19 0.43 1.13 -1.26 0.72 117.35 125.79 3h3g s TYR -102Ca 0.36 -0.28 0.07 0.00 -1.41 0.00 0.00 57.07 55.81 3h3g s TYR -102Cb -0.06 -1.16 -0.05 0.00 -1.10 0.00 0.00 41.96 39.59 3h3g s TYR -102CO 0.02 0.58 -0.13 0.20 -2.51 0.00 0.00 175.55 173.71 3h3g s GLY -101N -3.14 1.32 -0.14 5.49 0.00 -0.46 -4.85 107.32 105.54 3h3g s GLY -101Ca 0.27 -1.60 0.01 0.00 0.00 0.00 0.00 44.72 43.39 3h3g s GLY -101CO 0.15 -1.70 -0.17 0.14 0.00 0.00 0.00 173.10 171.52 3h3g s VAL -100N -3.01 1.71 0.26 1.40 1.01 -1.26 -1.61 120.40 118.90 3h3g s VAL -100Ca 0.20 -0.74 0.06 0.00 0.00 0.00 0.00 61.98 61.50 3h3g s VAL -100Cb -0.00 -1.57 -0.02 0.00 0.00 0.00 0.00 36.38 34.79 3h3g s VAL -100CO 0.05 0.48 0.21 1.07 0.00 0.00 0.00 175.10 176.91 3h3g n THR -99 N 4.50 0.00 -2.27 3.92 5.66 0.66 -4.74 114.28 122.01 3h3g n THR -99 Ca -0.19 -1.88 -0.39 0.00 -3.05 0.00 0.00 64.05 58.54 3h3g n THR -99 Cb 0.51 0.91 -0.02 0.00 -1.55 0.00 0.00 70.33 70.18 3h3g n THR -99 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 175.07 172.56 3h3g s VAL -98 N -3.02 3.07 0.68 1.08 0.11 -1.26 -1.91 120.40 119.15 3h3g s VAL -98 Ca 0.29 0.96 -0.17 0.00 -2.93 0.00 0.00 61.98 60.13 3h3g s VAL -98 Cb 0.01 -3.57 0.01 0.00 -1.53 0.00 0.00 36.38 31.30 3h3g s VAL -98 CO 0.21 0.14 1.28 -0.76 -3.33 0.00 0.00 175.10 172.63 3h3g s LEU -97 N -2.21 3.49 0.78 2.54 1.43 -1.26 -4.49 118.68 118.95 3h3g s LEU -97 Ca 0.54 2.57 -0.12 0.00 -1.03 0.00 0.00 54.13 56.08 3h3g s LEU -97 Cb -0.33 -4.61 0.07 0.00 0.03 0.00 0.00 46.19 41.34 3h3g s LEU -97 CO 0.42 -2.13 1.14 -2.84 0.23 0.00 0.00 176.35 173.17 3h3g s PRO -96 N -3.53 1.98 0.41 1.29 0.02 -1.26 -4.60 135.00 129.31 3h3g s PRO -96 Ca 0.81 1.48 -0.12 0.00 0.02 0.00 0.00 61.00 63.18 3h3g s PRO -96 Cb -0.36 -1.84 -0.07 0.00 0.02 0.00 0.00 34.50 32.25 3h3g s PRO -96 CO 0.42 -1.90 0.80 0.95 -0.33 0.00 0.00 177.00 176.94 3h3g s THR -95 N -2.47 4.72 -0.11 0.99 -4.23 -0.11 -3.34 115.64 111.08 3h3g s THR -95 Ca 0.67 0.79 0.02 0.00 -1.18 0.00 0.00 61.69 61.99 3h3g s THR -95 Cb -0.23 -3.71 0.02 0.00 1.34 0.00 0.00 72.50 69.92 3h3g s THR -95 CO 0.51 -0.49 -0.14 0.12 -0.54 0.00 0.00 174.62 174.07 3h3g s PHE -94 N -2.35 1.89 -1.50 3.99 5.36 0.58 -0.47 117.98 125.49 3h3g s PHE -94 Ca 0.53 -0.88 -0.13 0.00 -0.96 0.00 0.00 56.93 55.49 3h3g s PHE -94 Cb -0.10 -1.38 0.10 0.00 -0.34 0.00 0.00 43.02 41.30 3h3g s PHE -94 CO 0.29 -0.46 0.77 1.63 -1.46 0.00 0.00 175.22 175.99 3h3g n LYS -93 N 4.22 -4.28 -0.45 10.12 5.02 -1.26 -1.40 118.16 130.13 3h3g n LYS -93 Ca -0.19 0.52 0.00 0.00 -2.02 0.00 0.00 58.31 56.62 3h3g n LYS -93 Cb 0.51 -5.32 0.00 0.00 -0.02 0.00 0.00 35.03 30.20 3h3g n LYS -93 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3h3g n GLY -92 N -1.45 1.82 3.72 0.72 0.00 -1.26 -5.01 105.19 103.72 3h3g n GLY -92 Ca 0.03 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.70 3h3g n GLY -92 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3h3g s GLN -91 N -0.10 3.35 0.48 1.61 -1.52 -0.50 -5.00 119.66 117.99 3h3g s GLN -91 Ca 0.00 -0.32 -0.23 0.00 -1.95 0.00 0.00 55.36 52.86 3h3g s GLN -91 Cb 0.00 -3.00 -0.08 0.00 -0.22 0.00 0.00 33.01 29.70 3h3g s GLN -91 CO 0.00 0.62 1.14 -0.35 -0.25 0.00 0.00 175.29 176.45 3h3g n PRO -90 N 2.44 1.51 -2.01 2.91 -0.04 -1.26 -0.30 135.00 138.25 3h3g n PRO -90 Ca -0.19 0.55 -0.39 0.00 -0.04 0.00 0.00 63.50 63.43 3h3g n PRO -90 Cb 0.54 -2.27 0.00 0.00 -0.04 0.00 0.00 33.50 31.73 3h3g n PRO -90 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 3h3g s SER -89 N -0.79 6.20 -0.64 3.54 0.01 -1.21 -4.46 113.70 116.34 3h3g s SER -89 Ca 0.66 2.68 0.05 0.00 1.31 0.00 0.00 55.95 60.65 3h3g s SER -89 Cb -0.49 -2.64 0.16 0.00 0.21 0.00 0.00 66.02 63.26 3h3g s SER -89 CO 0.54 -0.93 0.44 -0.54 0.41 0.00 0.00 173.24 173.16 3h3g s LYS -88 N -2.32 2.20 0.46 12.44 1.02 -0.44 -4.62 119.74 128.50 3h3g s LYS -88 Ca 0.58 -3.08 -0.24 0.00 0.02 0.00 0.00 55.97 53.26 3h3g s LYS -88 Cb -0.39 -3.18 -0.07 0.00 -0.52 0.00 0.00 37.83 33.68 3h3g s LYS -88 CO 0.49 -1.27 1.25 -1.25 -0.92 0.00 0.00 175.35 173.66 3h3g s PRO -87 N -1.09 3.68 -0.13 -1.68 0.04 -1.26 -3.99 135.00 130.58 3h3g s PRO -87 Ca 0.24 2.00 -0.29 0.00 0.04 0.00 0.00 61.00 62.99 3h3g s PRO -87 Cb -0.07 -2.49 -0.01 0.00 0.04 0.00 0.00 34.50 31.97 3h3g s PRO -87 CO -0.14 -0.68 1.10 -0.06 0.04 0.00 0.00 177.00 177.26 3h3g s PHE -86 N -1.39 3.30 -0.18 0.56 0.08 -1.26 -1.99 117.98 117.10 3h3g s PHE -86 Ca 0.63 1.39 -0.14 0.00 0.12 0.00 0.00 56.93 58.94 3h3g s PHE -86 Cb -0.34 -3.31 -0.05 0.00 -0.57 0.00 0.00 43.02 38.75 3h3g s PHE -86 CO 0.42 -0.76 0.29 0.08 -0.10 0.00 0.00 175.22 175.16 3h3g s VAL -85 N 2.51 5.29 -0.03 -0.44 1.01 0.73 -4.80 120.40 124.67 3h3g s VAL -85 Ca 0.50 0.53 0.02 0.00 0.00 0.00 0.00 61.98 63.02 3h3g s VAL -85 Cb -0.20 -3.63 -0.03 0.00 0.00 0.00 0.00 36.38 32.52 3h3g s VAL -85 CO 0.16 0.35 -0.05 -0.83 0.00 0.00 0.00 175.10 174.74 3h3g s GLY -84 N 0.66 1.76 -0.42 4.51 0.00 -0.65 -1.80 107.32 111.39 3h3g s GLY -84 Ca 0.16 -0.94 -0.11 0.00 0.00 0.00 0.00 44.72 43.83 3h3g s GLY -84 CO 0.04 -0.76 0.28 0.14 0.00 0.00 0.00 173.10 172.81 3h3g s VAL -83 N -0.93 4.53 0.13 1.40 1.01 -1.26 -0.07 120.40 125.20 3h3g s VAL -83 Ca 0.15 -1.22 -0.32 0.00 0.00 0.00 0.00 61.98 60.59 3h3g s VAL -83 Cb -0.11 -3.71 -0.12 0.00 0.00 0.00 0.00 36.38 32.44 3h3g s VAL -83 CO 0.05 -0.48 1.74 -0.11 0.00 0.00 0.00 175.10 176.31 3h3g n LEU -82 N 5.00 3.71 -4.18 3.92 7.94 0.12 -0.88 117.00 132.63 3h3g n LEU -82 Ca -0.11 1.03 -0.11 0.00 -1.11 0.00 0.00 56.01 55.71 3h3g n LEU -82 Cb 0.44 -1.50 -0.10 0.00 0.53 0.00 0.00 43.42 42.79 3h3g n LEU -82 CO 0.41 0.02 -0.39 -0.44 -1.11 0.00 0.00 177.39 175.88 3h3g s SER -81 N 2.00 1.23 -0.18 1.96 0.01 0.45 0.44 113.70 119.61 3h3g s SER -81 Ca 0.81 -1.02 0.01 0.00 1.31 0.00 0.00 55.95 57.06 3h3g s SER -81 Cb -0.56 0.08 0.03 0.00 0.21 0.00 0.00 66.02 65.78 3h3g s SER -81 CO 0.38 -0.45 -0.15 0.00 0.41 0.00 0.00 173.24 173.43 3h3g s ALA -80 N -3.59 2.13 0.17 1.44 0.00 0.49 -1.85 121.76 120.55 3h3g s ALA -80 Ca 0.13 -1.17 0.05 0.00 0.00 0.00 0.00 51.96 50.96 3h3g s ALA -80 Cb 0.05 -1.21 -0.04 0.00 0.00 0.00 0.00 23.12 21.93 3h3g s ALA -80 CO -0.04 -0.56 0.18 0.20 0.00 0.00 0.00 175.76 175.54 3h3g s GLY -79 N 1.36 1.69 -0.21 0.00 0.00 -0.42 -0.76 107.32 108.98 3h3g s GLY -79 Ca 0.02 -1.18 -0.09 0.00 0.00 0.00 0.00 44.72 43.48 3h3g s GLY -79 CO -0.10 -1.19 0.10 -0.42 0.00 0.00 0.00 173.10 171.49 3h3g s ILE -78 N -1.77 4.93 0.09 0.90 1.01 -1.26 -1.39 121.20 123.71 3h3g s ILE -78 Ca 0.32 0.02 -0.32 0.00 0.00 0.00 0.00 60.65 60.67 3h3g s ILE -78 Cb -0.10 -3.26 -0.11 0.00 0.01 0.00 0.00 42.46 38.99 3h3g s ILE -78 CO 0.25 0.40 1.81 -3.20 0.00 0.00 0.00 174.94 174.20 3h3g n ASN -77 N 4.02 3.80 0.30 3.58 2.85 -0.56 -1.03 115.26 128.22 3h3g n ASN -77 Ca -0.16 0.99 0.16 0.00 -0.11 0.00 0.00 54.58 55.46 3h3g n ASN -77 Cb 0.52 -1.50 0.94 0.00 1.24 0.00 0.00 39.78 40.98 3h3g n ASN -77 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 3h3g h ALA -76 N 8.38 1.50 -0.00 5.20 0.00 -1.26 -1.63 119.26 131.45 3h3g h ALA -76 Ca -0.47 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.44 3h3g h ALA -76 Cb 1.24 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.03 3h3g h ALA -76 CO 0.94 -0.01 -0.09 0.00 0.00 0.00 0.00 179.25 180.08 3h3g n ALA -75 N -2.31 2.70 -2.32 0.00 0.00 -1.26 -4.88 120.51 112.44 3h3g n ALA -75 Ca -0.03 -0.23 -0.42 0.00 0.00 0.00 0.00 53.44 52.77 3h3g n ALA -75 Cb 0.09 -1.37 -0.03 0.00 0.00 0.00 0.00 19.45 18.13 3h3g n ALA -75 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3h3g s SER -74 N -2.57 7.07 0.00 0.00 0.15 -0.61 -4.90 113.70 112.83 3h3g s SER -74 Ca 0.27 2.08 0.06 0.00 0.70 0.00 0.00 55.95 59.06 3h3g s SER -74 Cb 0.20 -2.59 0.19 0.00 -1.71 0.00 0.00 66.02 62.11 3h3g s SER -74 CO 0.49 -0.46 1.15 -0.81 1.20 0.00 0.00 173.24 174.81 3h3g n PRO -73 N 3.60 1.39 -1.15 5.44 -0.04 -1.26 -4.18 135.00 138.80 3h3g n PRO -73 Ca 0.08 -0.60 -0.07 0.00 -0.04 0.00 0.00 63.50 62.87 3h3g n PRO -73 Cb 0.46 -1.14 0.14 0.00 -0.04 0.00 0.00 33.50 32.91 3h3g n PRO -73 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 3h3g n ASN -72 N -0.02 3.08 -0.23 3.54 3.02 -1.26 -4.85 115.26 118.54 3h3g n ASN -72 Ca 0.06 -3.84 -0.06 0.00 -0.03 0.00 0.00 54.58 50.72 3h3g n ASN -72 Cb 0.14 -0.48 0.09 0.00 -0.61 0.00 0.00 39.78 38.92 3h3g n ASN -72 CO 0.00 0.00 0.00 0.11 -2.62 0.00 0.00 177.26 174.75 3h3g h LYS -71 N 1.44 1.07 -0.31 3.52 1.57 -1.93 0.11 116.57 122.05 3h3g h LYS -71 Ca 0.17 -0.23 -0.07 0.00 -1.87 0.00 0.00 60.65 58.65 3h3g h LYS -71 Cb 1.26 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 33.41 3h3g h LYS -71 CO 0.35 0.93 -0.09 1.49 -0.57 0.00 0.00 179.45 181.56 3h3g h GLU -70 N 1.02 0.60 -0.95 3.15 4.57 -1.95 -0.94 114.58 120.08 3h3g h GLU -70 Ca 0.22 -0.24 0.01 0.00 -1.18 0.00 0.00 59.36 58.17 3h3g h GLU -70 Cb 0.32 -0.03 -0.05 0.00 -0.16 0.00 0.00 28.75 28.84 3h3g h GLU -70 CO -0.00 0.80 0.62 -0.07 -1.18 0.00 0.00 179.01 179.18 3h3g h LEU -69 N 0.37 1.11 -0.26 1.64 3.38 -1.87 -0.86 115.31 118.82 3h3g h LEU -69 Ca 0.08 -0.04 -0.00 0.00 0.09 0.00 0.00 57.88 58.00 3h3g h LEU -69 Cb 0.59 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.05 3h3g h LEU -69 CO 0.03 0.81 0.14 0.00 0.09 0.00 0.00 178.44 179.52 3h3g h ALA -68 N 1.34 0.33 -0.34 1.53 0.00 -0.55 -0.65 119.26 120.92 3h3g h ALA -68 Ca 0.35 -0.07 0.06 0.00 0.00 0.00 0.00 54.91 55.25 3h3g h ALA -68 Cb -0.13 -0.10 -0.05 0.00 0.00 0.00 0.00 17.79 17.51 3h3g h ALA -68 CO -0.07 -0.14 0.02 -0.22 0.00 0.00 0.00 179.25 178.84 3h3g h LYS -67 N 0.30 0.12 -0.69 0.00 3.64 -0.97 -1.38 116.57 117.58 3h3g h LYS -67 Ca 0.09 -0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.45 3h3g h LYS -67 Cb 0.06 -0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 31.82 3h3g h LYS -67 CO -0.01 0.08 0.38 0.93 -2.27 0.00 0.00 179.45 178.56 3h3g h GLU -66 N 0.12 0.97 -0.36 1.90 5.08 -0.93 0.45 114.58 121.80 3h3g h GLU -66 Ca 0.16 -0.11 -0.02 0.00 -1.00 0.00 0.00 59.36 58.39 3h3g h GLU -66 Cb 0.21 -0.19 -0.02 0.00 0.50 0.00 0.00 28.75 29.25 3h3g h GLU -66 CO -0.25 0.72 0.13 0.35 -1.00 0.00 0.00 179.01 178.96 3h3g h PHE -65 N 0.95 0.56 -0.05 4.33 3.04 -0.87 -1.38 116.94 123.53 3h3g h PHE -65 Ca 0.24 -0.05 -0.01 0.00 3.98 0.00 0.00 57.97 62.13 3h3g h PHE -65 Cb 0.04 -0.17 -0.00 0.00 2.56 0.00 0.00 35.95 38.38 3h3g h PHE -65 CO -0.00 0.53 -0.01 -0.07 -2.02 0.00 0.00 178.31 176.73 3h3g h LEU -64 N 0.44 0.10 -0.29 0.59 3.38 -1.02 -1.00 115.31 117.50 3h3g h LEU -64 Ca 0.12 -0.38 -0.12 0.00 0.09 0.00 0.00 57.88 57.59 3h3g h LEU -64 Cb 0.21 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 40.93 3h3g h LEU -64 CO -0.01 0.46 -0.27 -0.33 0.09 0.00 0.00 178.44 178.38 3h3g h GLU -63 N -0.26 0.70 0.00 1.13 5.08 -0.97 -0.21 114.58 120.05 3h3g h GLU -63 Ca 0.01 -0.36 0.00 0.00 -1.00 0.00 0.00 59.36 58.01 3h3g h GLU -63 Cb 0.42 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.68 3h3g h GLU -63 CO 0.01 0.98 -1.10 0.09 -1.00 0.00 0.00 179.01 177.98 3h3g n ASN -62 N -4.27 0.84 0.00 1.42 3.02 -0.52 -4.32 115.26 111.43 3h3g n ASN -62 Ca -0.04 -0.66 -0.03 0.00 -0.03 0.00 0.00 54.58 53.82 3h3g n ASN -62 Cb 0.46 1.23 -0.01 0.00 -0.61 0.00 0.00 39.78 40.85 3h3g n ASN -62 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 3h3g n TYR -61 N -1.61 0.00 0.19 3.10 4.02 -0.74 -4.85 117.16 117.27 3h3g n TYR -61 Ca 0.01 0.00 -0.10 0.00 -0.01 0.00 0.00 57.90 57.81 3h3g n TYR -61 Cb 0.33 -0.14 -0.05 0.00 -0.02 0.00 0.00 39.34 39.46 3h3g n TYR -61 CO 0.00 0.00 0.00 1.25 -1.01 0.00 0.00 176.86 177.10 3h3g h LEU -60 N -0.19 -0.47 -4.30 7.72 5.85 -1.22 -3.28 115.31 119.43 3h3g h LEU -60 Ca -0.06 -0.05 -0.27 0.00 0.84 0.00 0.00 57.88 58.35 3h3g h LEU -60 Cb 0.59 0.12 -0.04 0.00 0.37 0.00 0.00 40.66 41.70 3h3g h LEU -60 CO -0.04 -0.03 0.52 0.18 -0.34 0.00 0.00 178.44 178.73 3h3g n LEU -59 N -5.15 5.45 -4.48 2.25 4.77 -0.09 -2.31 117.00 117.44 3h3g n LEU -59 Ca -0.08 -3.18 -0.23 0.00 -0.03 0.00 0.00 56.01 52.50 3h3g n LEU -59 Cb 0.25 -1.33 -0.11 0.00 -2.33 0.00 0.00 43.42 39.90 3h3g n LEU -59 CO 0.20 1.56 -0.32 0.42 -1.33 0.00 0.00 177.39 177.92 3h3g s THR -58 N 1.44 1.60 0.16 -5.08 -4.23 -1.25 -4.86 115.64 103.43 3h3g s THR -58 Ca 0.62 -2.06 -0.15 0.00 -1.18 0.00 0.00 61.69 58.91 3h3g s THR -58 Cb 0.26 -2.68 0.05 0.00 1.34 0.00 0.00 72.50 71.47 3h3g s THR -58 CO -0.01 -0.14 1.73 0.44 -0.54 0.00 0.00 174.62 176.10 3h3g h ASP -57 N 2.11 0.05 -0.45 3.99 3.32 -1.91 -1.82 116.42 121.71 3h3g h ASP -57 Ca -0.41 0.06 -0.05 0.00 0.02 0.00 0.00 57.03 56.65 3h3g h ASP -57 Cb 1.24 0.07 -0.02 0.00 0.22 0.00 0.00 39.33 40.84 3h3g h ASP -57 CO 0.71 0.06 0.08 -0.33 -1.72 0.00 0.00 179.24 178.05 3h3g h GLU -56 N 0.23 0.75 0.17 3.56 5.08 -1.90 -1.00 114.58 121.47 3h3g h GLU -56 Ca 0.19 -0.19 -0.01 0.00 -1.00 0.00 0.00 59.36 58.34 3h3g h GLU -56 Cb 0.21 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.37 3h3g h GLU -56 CO -0.23 0.76 -0.08 0.78 -1.00 0.00 0.00 179.01 179.24 3h3g h GLY -55 N 0.61 -0.24 1.29 -3.84 0.00 -1.58 -1.02 103.07 98.29 3h3g h GLY -55 Ca 0.14 0.09 -0.04 0.00 0.00 0.00 0.00 47.33 47.52 3h3g h GLY -55 CO 0.01 -0.09 0.20 1.41 0.00 0.00 0.00 176.54 178.07 3h3g h LEU -54 N -0.43 0.83 -0.54 3.11 3.38 -0.91 -2.51 115.31 118.24 3h3g h LEU -54 Ca -0.02 -0.13 -0.04 0.00 0.09 0.00 0.00 57.88 57.78 3h3g h LEU -54 Cb 0.33 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.84 3h3g h LEU -54 CO 0.04 0.77 0.20 -0.08 0.09 0.00 0.00 178.44 179.46 3h3g h GLU -53 N 0.88 0.83 -0.57 1.13 4.81 -1.07 0.14 114.58 120.72 3h3g h GLU -53 Ca 0.20 -0.16 0.09 0.00 -0.13 0.00 0.00 59.36 59.36 3h3g h GLU -53 Cb 0.23 -0.13 -0.07 0.00 0.63 0.00 0.00 28.75 29.41 3h3g h GLU -53 CO -0.01 0.73 0.17 0.00 -0.73 0.00 0.00 179.01 179.17 3h3g h ALA -52 N 1.05 0.70 -0.02 2.92 0.00 -0.88 0.92 119.26 123.94 3h3g h ALA -52 Ca 0.18 0.10 -0.01 0.00 0.00 0.00 0.00 54.91 55.18 3h3g h ALA -52 Cb 0.23 0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.12 3h3g h ALA -52 CO -0.01 -0.25 -0.01 0.28 0.00 0.00 0.00 179.25 179.26 3h3g h VAL -51 N 0.32 1.33 -0.86 0.00 2.07 -1.24 -3.17 116.25 114.71 3h3g h VAL -51 Ca 0.29 -1.00 0.04 0.00 0.82 0.00 0.00 66.70 66.85 3h3g h VAL -51 Cb 0.38 1.97 -0.05 0.00 -1.52 0.00 0.00 31.29 32.07 3h3g h VAL -51 CO -0.33 0.27 0.56 -1.13 0.02 0.00 0.00 177.57 176.96 3h3g h ASN -50 N -0.36 0.91 -0.36 0.57 -1.24 -0.46 -0.88 115.58 113.75 3h3g h ASN -50 Ca 0.00 -0.01 0.00 0.00 0.71 0.00 0.00 56.30 57.01 3h3g h ASN -50 Cb 0.44 -0.21 -0.02 0.00 0.73 0.00 0.00 38.32 39.26 3h3g h ASN -50 CO 0.00 0.62 0.23 0.11 -1.29 0.00 0.00 177.43 177.10 3h3g h LYS -49 N 1.05 0.48 0.14 6.67 1.57 -0.86 -2.84 116.57 122.79 3h3g h LYS -49 Ca 0.35 -0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 59.09 3h3g h LYS -49 Cb 0.06 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 32.26 3h3g h LYS -49 CO -0.11 0.32 -0.07 0.22 -0.57 0.00 0.00 179.45 179.25 3h3g h ASP -48 N 0.49 -0.16 -3.40 0.86 3.58 -1.16 -3.46 116.42 113.17 3h3g h ASP -48 Ca 0.13 0.01 -0.42 0.00 0.42 0.00 0.00 57.03 57.17 3h3g h ASP -48 Cb -0.04 0.04 -0.35 0.00 1.72 0.00 0.00 39.33 40.70 3h3g h ASP -48 CO -0.03 0.03 -0.77 -0.54 -2.88 0.00 0.00 179.24 175.05 3h3g s LYS -47 N -2.22 0.81 0.20 0.28 -0.14 -0.72 -4.83 119.74 113.12 3h3g s LYS -47 Ca -0.03 -0.06 -0.32 0.00 -1.36 0.00 0.00 55.97 54.19 3h3g s LYS -47 Cb 0.00 -0.91 -0.14 0.00 -1.68 0.00 0.00 37.83 35.10 3h3g s LYS -47 CO 0.08 -0.14 1.37 -2.30 -0.76 0.00 0.00 175.35 173.60 3h3g n PRO -46 N 4.34 1.76 0.19 -1.68 -0.02 -1.07 -4.04 135.00 134.48 3h3g n PRO -46 Ca -0.20 0.63 0.08 0.00 -2.02 0.00 0.00 63.50 61.99 3h3g n PRO -46 Cb 0.51 -2.27 0.15 0.00 -0.02 0.00 0.00 33.50 31.87 3h3g n PRO -46 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 3h3g h LEU -45 N 4.31 0.00 0.00 2.45 3.38 -1.88 -2.66 115.31 120.91 3h3g h LEU -45 Ca -0.45 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.52 3h3g h LEU -45 Cb 1.29 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.04 3h3g h LEU -45 CO 0.77 0.24 0.00 0.61 0.09 0.00 0.00 178.44 180.15 3h3g n GLY -44 N 1.04 0.28 3.59 0.83 0.00 -1.26 -4.49 105.19 105.19 3h3g n GLY -44 Ca 0.03 -1.68 -0.42 0.00 0.00 0.00 0.00 46.02 43.94 3h3g n GLY -44 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h3g s ALA -43 N -1.92 3.39 0.52 4.61 0.00 -1.01 -4.88 121.76 122.47 3h3g s ALA -43 Ca 0.00 -0.59 -0.17 0.00 0.00 0.00 0.00 51.96 51.20 3h3g s ALA -43 Cb 0.00 -3.48 -0.07 0.00 0.00 0.00 0.00 23.12 19.56 3h3g s ALA -43 CO 0.00 -1.63 1.00 0.14 0.00 0.00 0.00 175.76 175.27 3h3g s VAL -42 N 3.36 4.34 0.39 0.00 -7.23 -1.26 0.76 120.40 120.76 3h3g s VAL -42 Ca 0.35 1.17 0.12 0.00 -1.81 0.00 0.00 61.98 61.82 3h3g s VAL -42 Cb -0.12 -3.63 0.12 0.00 0.56 0.00 0.00 36.38 33.31 3h3g s VAL -42 CO 0.19 -0.59 1.87 0.00 -0.31 0.00 0.00 175.10 176.26 3h3g h ALA -41 N 0.96 1.46 -2.04 1.32 0.00 -1.14 -3.43 119.26 116.40 3h3g h ALA -41 Ca -0.47 -0.28 -0.56 0.00 0.00 0.00 0.00 54.91 53.59 3h3g h ALA -41 Cb 1.19 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.89 3h3g h ALA -41 CO 0.61 0.40 1.05 -1.17 0.00 0.00 0.00 179.25 180.13 3h3g s LEU -40 N -8.39 3.96 0.16 0.00 2.96 -1.26 -2.00 118.68 114.12 3h3g s LEU -40 Ca -0.04 1.55 -0.14 0.00 -0.22 0.00 0.00 54.13 55.29 3h3g s LEU -40 Cb 0.15 -3.54 0.05 0.00 0.50 0.00 0.00 46.19 43.35 3h3g s LEU -40 CO 0.72 -1.12 1.77 0.11 -1.32 0.00 0.00 176.35 176.52 3h3g h LYS -39 N 9.89 0.72 -0.71 1.98 1.57 -1.65 -0.87 116.57 127.50 3h3g h LYS -39 Ca -0.31 -0.08 0.06 0.00 -1.87 0.00 0.00 60.65 58.45 3h3g h LYS -39 Cb 1.13 -0.14 -0.06 0.00 0.08 0.00 0.00 32.23 33.24 3h3g h LYS -39 CO 1.00 0.56 0.40 0.66 -0.57 0.00 0.00 179.45 181.51 3h3g h SER -38 N 0.69 0.60 0.56 0.86 4.64 -1.92 -1.39 113.55 117.60 3h3g h SER -38 Ca 0.18 0.03 -0.27 0.00 -0.47 0.00 0.00 61.79 61.26 3h3g h SER -38 Cb 0.05 -0.09 0.01 0.00 -0.31 0.00 0.00 62.40 62.06 3h3g h SER -38 CO -0.03 0.38 -1.20 0.22 -0.87 0.00 0.00 176.83 175.33 3h3g h TYR -37 N 0.73 0.54 -0.08 4.77 3.20 -1.94 -3.30 116.97 120.90 3h3g h TYR -37 Ca 0.32 -0.38 -0.00 0.00 3.14 0.00 0.00 58.73 61.81 3h3g h TYR -37 Cb 0.21 -0.03 -0.00 0.00 1.54 0.00 0.00 36.73 38.45 3h3g h TYR -37 CO -0.07 1.28 0.03 1.49 -1.64 0.00 0.00 178.16 179.25 3h3g h GLU -36 N 0.10 0.11 -0.31 1.82 4.57 -0.84 -1.67 114.58 118.36 3h3g h GLU -36 Ca -0.13 -0.01 -0.02 0.00 -1.18 0.00 0.00 59.36 58.02 3h3g h GLU -36 Cb 1.92 -0.02 -0.02 0.00 -0.16 0.00 0.00 28.75 30.47 3h3g h GLU -36 CO 0.20 0.09 0.11 0.93 -1.18 0.00 0.00 179.01 179.17 3h3g h GLU -35 N 0.11 0.44 0.20 1.92 5.08 -1.33 0.32 114.58 121.31 3h3g h GLU -35 Ca 0.03 -0.05 -0.31 0.00 -1.00 0.00 0.00 59.36 58.02 3h3g h GLU -35 Cb 0.02 -0.09 0.03 0.00 0.50 0.00 0.00 28.75 29.22 3h3g h GLU -35 CO -0.00 0.38 -1.37 0.93 -1.00 0.00 0.00 179.01 177.94 3h3g h GLU -34 N 0.44 0.50 -0.08 2.33 4.39 -1.51 -3.35 114.58 117.30 3h3g h GLU -34 Ca 0.11 -0.80 -0.12 0.00 0.34 0.00 0.00 59.36 58.89 3h3g h GLU -34 Cb 0.11 0.29 -0.01 0.00 -0.10 0.00 0.00 28.75 29.04 3h3g h GLU -34 CO -0.01 1.37 -0.49 -0.07 -1.16 0.00 0.00 179.01 178.65 3h3g h LEU -33 N 0.16 0.23 -2.01 1.33 3.38 -0.92 -3.15 115.31 114.33 3h3g h LEU -33 Ca -0.21 -0.11 0.15 0.00 0.09 0.00 0.00 57.88 57.80 3h3g h LEU -33 Cb 2.06 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 42.73 3h3g h LEU -33 CO 0.25 0.69 0.42 0.00 0.09 0.00 0.00 178.44 179.89 3h3g h ALA -32 N 1.32 2.42 0.00 1.53 0.00 -0.51 -1.06 119.26 122.95 3h3g h ALA -32 Ca 0.01 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 3h3g h ALA -32 Cb 0.94 0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.76 3h3g h ALA -32 CO 0.08 -0.69 -0.03 0.87 0.00 0.00 0.00 179.25 179.47 3h3g h LYS -31 N 0.00 0.00 -6.23 0.00 1.57 -1.73 -3.40 116.57 106.78 3h3g h LYS -31 Ca 0.25 0.00 -0.56 0.00 -1.87 0.00 0.00 60.65 58.47 3h3g h LYS -31 Cb 1.08 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 33.37 3h3g h LYS -31 CO -0.00 0.03 0.87 0.34 -0.57 0.00 0.00 179.45 180.13 3h3g s ASP -30 N -5.66 6.92 0.60 0.86 -1.08 -0.40 -4.91 116.67 112.99 3h3g s ASP -30 Ca -0.01 1.85 0.30 0.00 -0.52 0.00 0.00 52.55 54.16 3h3g s ASP -30 Cb 0.11 -2.54 1.70 0.00 -1.46 0.00 0.00 42.92 40.72 3h3g s ASP -30 CO 0.52 -0.74 2.10 1.55 0.52 0.00 0.00 175.17 179.12 3h3g h PRO -29 N 8.17 0.00 -0.12 4.34 0.13 -1.89 -0.09 132.00 142.53 3h3g h PRO -29 Ca -0.31 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 64.67 3h3g h PRO -29 Cb 1.14 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.26 3h3g h PRO -29 CO 0.94 0.00 -0.55 0.00 -0.23 0.00 0.00 178.00 178.16 3h3g h ARG -28 N 0.00 0.36 -0.03 0.86 3.08 -1.91 -2.02 114.38 114.73 3h3g h ARG -28 Ca 0.08 -0.23 -0.16 0.00 0.07 0.00 0.00 59.98 59.74 3h3g h ARG -28 Cb 0.49 0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.55 3h3g h ARG -28 CO -0.00 0.82 -0.71 0.82 -1.07 0.00 0.00 179.97 179.83 3h3g h ILE -27 N 0.28 1.44 -0.25 2.04 1.08 -1.34 -2.13 117.51 118.63 3h3g h ILE -27 Ca 0.00 -2.25 -0.01 0.00 -0.39 0.00 0.00 64.86 62.21 3h3g h ILE -27 Cb 1.05 2.20 -0.01 0.00 -3.07 0.00 0.00 36.82 36.98 3h3g h ILE -27 CO 0.09 0.66 0.10 0.00 -0.69 0.00 0.00 178.15 178.31 3h3g h ALA -26 N 1.13 0.33 -0.77 1.87 0.00 -1.08 -0.50 119.26 120.24 3h3g h ALA -26 Ca -0.02 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.77 3h3g h ALA -26 Cb 1.26 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 18.91 3h3g h ALA -26 CO 0.11 -0.08 0.45 0.00 0.00 0.00 0.00 179.25 179.73 3h3g h ALA -25 N 0.94 0.98 -0.33 0.00 0.00 -1.35 -0.18 119.26 119.33 3h3g h ALA -25 Ca 0.08 -0.10 0.04 0.00 0.00 0.00 0.00 54.91 54.94 3h3g h ALA -25 Cb 0.18 -0.31 -0.04 0.00 0.00 0.00 0.00 17.79 17.62 3h3g h ALA -25 CO -0.01 0.46 0.09 1.15 0.00 0.00 0.00 179.25 180.94 3h3g h THR -24 N 1.05 0.88 -0.51 0.00 2.02 -1.13 -1.12 112.91 114.11 3h3g h THR -24 Ca 0.27 -0.08 -0.06 0.00 0.77 0.00 0.00 66.41 67.31 3h3g h THR -24 Cb -0.02 0.64 -0.02 0.00 -1.74 0.00 0.00 68.15 67.01 3h3g h THR -24 CO -0.05 0.04 0.05 0.24 0.37 0.00 0.00 175.52 176.18 3h3g h MET -23 N 0.22 0.82 -0.41 6.66 2.86 -0.62 -0.27 114.93 124.19 3h3g h MET -23 Ca 0.15 -0.20 -0.04 0.00 -2.06 0.00 0.00 59.70 57.56 3h3g h MET -23 Cb 0.14 -0.11 -0.02 0.00 0.06 0.00 0.00 31.60 31.68 3h3g h MET -23 CO -0.18 0.79 0.12 1.49 1.06 0.00 0.00 176.91 180.19 3h3g h GLU -22 N 0.77 0.64 -0.61 1.72 4.81 -0.71 0.87 114.58 122.07 3h3g h GLU -22 Ca 0.16 -0.15 -0.06 0.00 -0.13 0.00 0.00 59.36 59.18 3h3g h GLU -22 Cb 0.39 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 29.66 3h3g h GLU -22 CO 0.01 0.65 0.14 -0.91 -0.73 0.00 0.00 179.01 178.17 3h3g h ASN -21 N 0.52 0.94 -0.46 1.04 2.35 -1.02 -2.51 115.58 116.44 3h3g h ASN -21 Ca 0.13 -0.24 0.00 0.00 -0.55 0.00 0.00 56.30 55.65 3h3g h ASN -21 Cb 0.28 -0.25 -0.02 0.00 0.05 0.00 0.00 38.32 38.38 3h3g h ASN -21 CO -0.00 0.93 0.30 0.00 -1.65 0.00 0.00 177.43 177.01 3h3g h ALA -20 N 1.04 0.58 -0.07 -0.83 0.00 -0.78 -2.05 119.26 117.15 3h3g h ALA -20 Ca 0.19 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 3h3g h ALA -20 Cb 0.37 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.97 3h3g h ALA -20 CO 0.00 0.04 0.02 1.96 0.00 0.00 0.00 179.25 181.27 3h3g h GLN -19 N 0.62 0.09 0.00 0.00 4.20 -0.60 -0.17 115.11 119.25 3h3g h GLN -19 Ca 0.17 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.87 3h3g h GLN -19 Cb -0.06 -0.02 0.00 0.00 0.30 0.00 0.00 27.48 27.70 3h3g h GLN -19 CO -0.04 0.09 -0.24 1.63 -0.67 0.00 0.00 178.83 179.61 3h3g n LYS -18 N -4.50 0.16 0.00 1.46 5.02 -0.94 -4.90 118.16 114.47 3h3g n LYS -18 Ca -0.02 0.09 0.00 0.00 -2.02 0.00 0.00 58.31 56.36 3h3g n LYS -18 Cb 0.11 -1.65 0.00 0.00 -0.02 0.00 0.00 35.03 33.47 3h3g n LYS -18 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3h3g n GLY -17 N 1.40 1.89 2.98 0.72 0.00 -0.08 -4.58 105.19 107.52 3h3g n GLY -17 Ca 0.05 -1.92 -0.12 0.00 0.00 0.00 0.00 46.02 44.03 3h3g n GLY -17 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3h3g s GLU -16 N 3.74 0.14 0.24 1.61 2.02 -0.84 -4.93 118.70 120.67 3h3g s GLU -16 Ca 0.00 0.07 -0.30 0.00 0.02 0.00 0.00 54.97 54.77 3h3g s GLU -16 Cb 0.00 0.06 -0.09 0.00 0.10 0.00 0.00 34.13 34.20 3h3g s GLU -16 CO 0.00 -0.02 1.28 0.42 0.02 0.00 0.00 175.26 176.96 3h3g s ILE -15 N -0.09 3.16 0.55 -1.63 1.01 -1.26 -0.19 121.20 122.75 3h3g s ILE -15 Ca -0.01 1.02 -0.20 0.00 0.00 0.00 0.00 60.65 61.45 3h3g s ILE -15 Cb -0.01 -3.65 -0.05 0.00 0.01 0.00 0.00 42.46 38.76 3h3g s ILE -15 CO 0.00 0.18 1.23 -0.04 0.00 0.00 0.00 174.94 176.31 3h3g s MET -14 N -0.63 3.20 0.85 2.79 -1.94 -0.74 -4.79 119.30 118.03 3h3g s MET -14 Ca 0.53 1.90 -0.10 0.00 -1.71 0.00 0.00 55.69 56.31 3h3g s MET -14 Cb -0.36 -2.12 0.10 0.00 2.01 0.00 0.00 34.83 34.46 3h3g s MET -14 CO 0.42 -1.04 1.13 -2.14 -0.01 0.00 0.00 175.02 173.37 3h3g s PRO -13 N -3.08 1.59 0.00 2.03 0.02 -1.26 -4.88 135.00 129.41 3h3g s PRO -13 Ca 0.73 1.40 0.12 0.00 0.02 0.00 0.00 61.00 63.28 3h3g s PRO -13 Cb -0.32 -1.80 0.33 0.00 0.02 0.00 0.00 34.50 32.72 3h3g s PRO -13 CO 0.37 -2.18 1.26 0.27 -0.33 0.00 0.00 177.00 176.38 3h3g n ASN -12 N -3.86 2.98 -4.75 2.53 6.94 -1.26 -4.39 115.26 113.44 3h3g n ASN -12 Ca 0.11 -1.95 -0.36 0.00 -0.02 0.00 0.00 54.58 52.35 3h3g n ASN -12 Cb 0.52 -0.24 0.05 0.00 -2.36 0.00 0.00 39.78 37.75 3h3g n ASN -12 CO 0.00 0.00 0.00 0.27 -1.03 0.00 0.00 177.26 176.50 3h3g s ILE -11 N -1.01 2.40 0.50 1.53 -4.36 -1.26 -1.84 121.20 117.17 3h3g s ILE -11 Ca 0.26 0.25 0.30 0.00 -0.26 0.00 0.00 60.65 61.19 3h3g s ILE -11 Cb 0.14 -3.10 0.48 0.00 1.25 0.00 0.00 42.46 41.22 3h3g s ILE -11 CO 0.18 -0.05 1.84 -0.65 0.24 0.00 0.00 174.94 176.50 3h3g h PRO -10 N 0.78 0.10 0.00 0.37 0.11 -1.90 -1.03 132.00 130.43 3h3g h PRO -10 Ca -0.51 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.60 3h3g h PRO -10 Cb 1.31 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.40 3h3g h PRO -10 CO 0.54 0.07 0.00 1.04 -0.21 0.00 0.00 178.00 179.44 3h3g n GLN -9 N -4.33 0.10 -0.12 1.05 3.00 -1.26 -3.61 117.38 112.21 3h3g n GLN -9 Ca 0.22 0.43 0.02 0.00 -0.01 0.00 0.00 57.00 57.66 3h3g n GLN -9 Cb 1.01 -1.72 0.31 0.00 0.00 0.00 0.00 30.24 29.84 3h3g n GLN -9 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 177.06 177.58 3h3g h MET -8 N 0.00 0.79 -0.31 -1.09 2.86 -1.49 -1.81 114.93 113.86 3h3g h MET -8 Ca 0.00 -0.06 -0.18 0.00 -2.06 0.00 0.00 59.70 57.40 3h3g h MET -8 Cb 0.20 -0.17 -0.00 0.00 0.06 0.00 0.00 31.60 31.68 3h3g h MET -8 CO 0.00 0.54 -0.50 0.66 1.06 0.00 0.00 176.91 178.67 3h3g h SER -7 N 0.80 0.97 -0.82 1.22 4.64 -1.82 -1.10 113.55 117.45 3h3g h SER -7 Ca 0.21 -0.50 0.06 0.00 -0.47 0.00 0.00 61.79 61.10 3h3g h SER -7 Cb -0.05 -0.28 -0.06 0.00 -0.31 0.00 0.00 62.40 61.70 3h3g h SER -7 CO -0.04 1.30 0.50 0.00 -0.87 0.00 0.00 176.83 177.71 3h3g h ALA -6 N 0.73 1.13 -0.21 5.18 0.00 -1.74 -0.57 119.26 123.78 3h3g h ALA -6 Ca 0.03 0.00 0.01 0.00 0.00 0.00 0.00 54.91 54.95 3h3g h ALA -6 Cb 1.10 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.67 3h3g h ALA -6 CO 0.11 0.22 0.11 0.35 0.00 0.00 0.00 179.25 180.03 3h3g h PHE -5 N 0.90 0.20 -0.46 0.00 3.57 -1.06 -2.01 116.94 118.08 3h3g h PHE -5 Ca 0.36 0.01 -0.12 0.00 3.53 0.00 0.00 57.97 61.75 3h3g h PHE -5 Cb 0.19 -0.06 -0.01 0.00 2.79 0.00 0.00 35.95 38.86 3h3g h PHE -5 CO -0.04 0.11 -0.19 -1.49 -2.23 0.00 0.00 178.31 174.47 3h3g h TRP -4 N 0.23 1.08 -0.77 0.41 -0.00 -0.86 -1.12 115.95 114.92 3h3g h TRP -4 Ca 0.09 -0.26 0.01 0.00 -0.00 0.00 0.00 58.89 58.73 3h3g h TRP -4 Cb 0.02 -0.25 -0.04 0.00 -0.00 0.00 0.00 29.16 28.89 3h3g h TRP -4 CO -0.09 1.06 0.50 -0.92 -0.00 0.00 0.00 178.44 178.99 3h3g h TYR -3 N 0.78 0.95 -0.47 0.49 3.20 -1.10 0.16 116.97 120.99 3h3g h TYR -3 Ca 0.11 0.02 -0.06 0.00 3.14 0.00 0.00 58.73 61.94 3h3g h TYR -3 Cb 0.76 -0.32 -0.02 0.00 1.54 0.00 0.00 36.73 38.69 3h3g h TYR -3 CO 0.05 0.59 0.05 0.00 -1.64 0.00 0.00 178.16 177.21 3h3g h ALA -2 N 1.29 0.63 -0.10 1.82 0.00 -1.08 -1.65 119.26 120.17 3h3g h ALA -2 Ca 0.29 -0.25 -0.14 0.00 0.00 0.00 0.00 54.91 54.81 3h3g h ALA -2 Cb -0.09 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.52 3h3g h ALA -2 CO -0.07 0.38 -0.55 0.28 0.00 0.00 0.00 179.25 179.28 3h3g h VAL -1 N 0.66 1.36 0.32 0.00 2.07 -1.02 -1.79 116.25 117.84 3h3g h VAL -1 Ca 0.14 -1.85 -0.02 0.00 0.82 0.00 0.00 66.70 65.79 3h3g h VAL -1 Cb 0.43 1.89 0.00 0.00 -1.52 0.00 0.00 31.29 32.10 3h3g h VAL -1 CO 0.01 0.55 -0.15 -0.09 0.02 0.00 0.00 177.57 177.92 3h3g h ARG 0 N 0.23 -0.41 -0.36 1.57 2.43 -0.50 -2.16 114.38 115.18 3h3g h ARG 0 Ca 0.00 0.03 0.06 0.00 -0.81 0.00 0.00 59.98 59.26 3h3g h ARG 0 Cb 1.04 0.09 -0.05 0.00 -0.42 0.00 0.00 29.97 30.63 3h3g h ARG 0 CO 0.09 -0.25 0.04 1.15 -1.51 0.00 0.00 179.97 179.49 3h3g h THR 1 N -0.46 0.77 -0.37 0.20 2.02 -1.27 -2.03 112.91 111.77 3h3g h THR 1 Ca -0.04 -0.05 0.04 0.00 0.77 0.00 0.00 66.41 67.13 3h3g h THR 1 Cb 0.35 0.61 -0.04 0.00 -1.74 0.00 0.00 68.15 67.33 3h3g h THR 1 CO 0.07 0.03 0.12 0.00 0.37 0.00 0.00 175.52 176.11 3h3g h ALA 2 N 1.30 0.42 -0.14 6.16 0.00 -1.14 0.81 119.26 126.67 3h3g h ALA 2 Ca 0.18 0.05 -0.07 0.00 0.00 0.00 0.00 54.91 55.06 3h3g h ALA 2 Cb 0.23 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.04 3h3g h ALA 2 CO -0.26 -0.27 -0.17 0.28 0.00 0.00 0.00 179.25 178.82 3h3g h VAL 3 N 0.27 1.35 -0.57 0.00 2.07 -1.23 0.16 116.25 118.31 3h3g h VAL 3 Ca 0.17 -1.36 0.05 0.00 0.82 0.00 0.00 66.70 66.37 3h3g h VAL 3 Cb 0.15 1.92 -0.05 0.00 -1.52 0.00 0.00 31.29 31.79 3h3g h VAL 3 CO -0.18 0.40 0.30 0.40 0.02 0.00 0.00 177.57 178.51 3h3g h ILE 4 N -0.01 0.96 -0.33 4.57 2.04 -1.29 0.25 117.51 123.70 3h3g h ILE 4 Ca 0.02 -0.20 -0.08 0.00 1.00 0.00 0.00 64.86 65.61 3h3g h ILE 4 Cb 0.72 0.34 -0.01 0.00 -0.74 0.00 0.00 36.82 37.13 3h3g h ILE 4 CO 0.04 0.10 -0.09 0.78 0.00 0.00 0.00 178.15 178.98 3h3g h ASN 5 N 0.57 0.65 -0.42 1.72 4.21 -0.66 -2.19 115.58 119.46 3h3g h ASN 5 Ca 0.25 -0.37 -0.13 0.00 1.21 0.00 0.00 56.30 57.26 3h3g h ASN 5 Cb 0.15 -0.18 -0.01 0.00 -1.12 0.00 0.00 38.32 37.16 3h3g h ASN 5 CO -0.17 0.87 -0.25 0.00 -1.29 0.00 0.00 177.43 176.59 3h3g h ALA 6 N 0.80 0.60 -0.64 -0.83 0.00 -0.55 0.04 119.26 118.68 3h3g h ALA 6 Ca 0.08 -0.40 -0.04 0.00 0.00 0.00 0.00 54.91 54.55 3h3g h ALA 6 Cb 0.59 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.21 3h3g h ALA 6 CO 0.03 0.60 0.23 0.00 0.00 0.00 0.00 179.25 180.12 3h3g h ALA 7 N 0.81 1.20 -0.02 0.00 0.00 -0.48 -2.59 119.26 118.19 3h3g h ALA 7 Ca 0.09 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.82 3h3g h ALA 7 Cb 0.83 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.36 3h3g h ALA 7 CO 0.07 0.57 0.00 -1.13 0.00 0.00 0.00 179.25 178.77 3h3g n SER 8 N -4.29 1.28 0.00 0.00 3.41 -0.83 -4.73 113.62 108.46 3h3g n SER 8 Ca 0.05 -1.43 0.00 0.00 -0.26 0.00 0.00 58.87 57.23 3h3g n SER 8 Cb 0.19 -0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.14 3h3g n SER 8 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3h3g n GLY 9 N 1.15 0.62 0.37 5.00 0.00 -0.98 -4.90 105.19 106.44 3h3g n GLY 9 Ca 0.20 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.27 3h3g n GLY 9 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 3h3g h ARG 10 N 1.67 0.94 -5.15 1.61 2.43 -1.27 -3.42 114.38 111.19 3h3g h ARG 10 Ca 0.00 -0.06 -0.36 0.00 -0.81 0.00 0.00 59.98 58.75 3h3g h ARG 10 Cb 0.09 -0.21 -0.18 0.00 -0.42 0.00 0.00 29.97 29.25 3h3g h ARG 10 CO 0.00 0.62 -0.74 -0.65 -1.51 0.00 0.00 179.97 177.69 3h3g s GLN 11 N -5.88 0.91 0.81 0.20 -0.21 -0.89 -5.01 119.66 109.59 3h3g s GLN 11 Ca -0.11 -1.17 -0.11 0.00 0.02 0.00 0.00 55.36 53.99 3h3g s GLN 11 Cb 0.21 -0.68 0.08 0.00 1.00 0.00 0.00 33.01 33.61 3h3g s GLN 11 CO 0.80 0.12 1.09 0.95 -2.12 0.00 0.00 175.29 176.13 3h3g s THR 12 N -2.25 3.10 0.25 -0.19 -4.23 -1.26 -4.09 115.64 106.97 3h3g s THR 12 Ca 0.06 0.36 -0.04 0.00 -1.18 0.00 0.00 61.69 60.89 3h3g s THR 12 Cb -0.04 -2.84 0.22 0.00 1.34 0.00 0.00 72.50 71.17 3h3g s THR 12 CO 0.01 -0.47 1.77 0.58 -0.54 0.00 0.00 174.62 175.97 3h3g h VAL 13 N -1.27 0.77 0.34 2.29 2.07 -1.96 0.13 116.25 118.62 3h3g h VAL 13 Ca -0.46 -0.21 -0.02 0.00 0.82 0.00 0.00 66.70 66.84 3h3g h VAL 13 Cb 1.25 0.11 0.00 0.00 -1.52 0.00 0.00 31.29 31.13 3h3g h VAL 13 CO 0.52 0.11 -0.16 0.44 0.02 0.00 0.00 177.57 178.50 3h3g h ASP 14 N 0.61 -0.38 -0.59 0.57 3.32 -1.97 -1.03 116.42 116.95 3h3g h ASP 14 Ca 0.42 -0.04 0.07 0.00 0.02 0.00 0.00 57.03 57.50 3h3g h ASP 14 Cb 0.54 0.10 -0.06 0.00 0.22 0.00 0.00 39.33 40.13 3h3g h ASP 14 CO -0.33 -0.21 0.28 -0.33 -1.72 0.00 0.00 179.24 176.92 3h3g h GLU 15 N -0.53 0.50 -0.49 3.56 5.08 -1.88 -1.95 114.58 118.86 3h3g h GLU 15 Ca -0.05 -0.03 -0.05 0.00 -1.00 0.00 0.00 59.36 58.23 3h3g h GLU 15 Cb 0.40 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.52 3h3g h GLU 15 CO 0.08 0.33 0.10 0.00 -1.00 0.00 0.00 179.01 178.52 3h3g h ALA 16 N 1.35 0.65 0.02 3.43 0.00 -0.57 -2.39 119.26 121.76 3h3g h ALA 16 Ca 0.27 -0.22 -0.21 0.00 0.00 0.00 0.00 54.91 54.76 3h3g h ALA 16 Cb 0.24 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 3h3g h ALA 16 CO -0.22 0.36 -0.95 -0.07 0.00 0.00 0.00 179.25 178.37 3h3g h LEU 17 N 0.68 0.18 -0.13 0.00 3.38 -1.12 -2.39 115.31 115.92 3h3g h LEU 17 Ca 0.15 -0.16 0.02 0.00 0.09 0.00 0.00 57.88 57.97 3h3g h LEU 17 Cb 0.36 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 41.03 3h3g h LEU 17 CO 0.00 1.03 0.03 0.50 0.09 0.00 0.00 178.44 180.09 3h3g h LYS 18 N 0.06 0.08 -0.81 1.13 3.64 -1.34 0.04 116.57 119.37 3h3g h LYS 18 Ca -0.04 -0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 59.30 3h3g h LYS 18 Cb 1.63 -0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 33.39 3h3g h LYS 18 CO 0.14 0.05 0.40 -0.44 -2.27 0.00 0.00 179.45 177.33 3h3g h ASP 19 N 0.08 1.05 -0.48 4.20 5.19 -1.43 -1.97 116.42 123.07 3h3g h ASP 19 Ca 0.06 -0.12 -0.10 0.00 -0.62 0.00 0.00 57.03 56.25 3h3g h ASP 19 Cb 0.05 -0.27 -0.02 0.00 0.18 0.00 0.00 39.33 39.27 3h3g h ASP 19 CO -0.07 0.88 -0.09 0.00 -3.12 0.00 0.00 179.24 176.84 3h3g h ALA 20 N 1.28 0.87 -0.21 3.45 0.00 -1.05 -1.57 119.26 122.03 3h3g h ALA 20 Ca 0.28 -0.33 0.03 0.00 0.00 0.00 0.00 54.91 54.89 3h3g h ALA 20 Cb 0.10 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.67 3h3g h ALA 20 CO -0.04 0.65 0.04 0.37 0.00 0.00 0.00 179.25 180.27 3h3g h GLN 21 N 0.85 0.11 -0.98 0.00 5.75 -0.78 0.20 115.11 120.27 3h3g h GLN 21 Ca 0.14 -0.01 0.07 0.00 -0.15 0.00 0.00 58.65 58.71 3h3g h GLN 21 Cb 0.62 -0.03 -0.07 0.00 1.07 0.00 0.00 27.48 29.08 3h3g h GLN 21 CO 0.04 0.08 0.63 1.15 -2.65 0.00 0.00 178.83 178.08 3h3g h THR 22 N 0.12 1.06 0.16 2.39 2.02 -1.08 -2.73 112.91 114.85 3h3g h THR 22 Ca 0.10 -0.38 -0.33 0.00 0.77 0.00 0.00 66.41 66.57 3h3g h THR 22 Cb 0.10 -0.15 0.01 0.00 -1.74 0.00 0.00 68.15 66.36 3h3g h THR 22 CO -0.13 0.20 -1.63 0.78 0.37 0.00 0.00 175.52 175.11 3h3g h ASN 23 N 1.11 0.55 0.08 4.18 2.35 -0.92 -2.35 115.58 120.58 3h3g h ASN 23 Ca 0.43 -0.91 -0.00 0.00 -0.55 0.00 0.00 56.30 55.26 3h3g h ASN 23 Cb 0.22 -0.18 -0.00 0.00 0.05 0.00 0.00 38.32 38.42 3h3g h ASN 23 CO -0.18 1.73 -0.01 0.00 -1.65 0.00 0.00 177.43 177.32 3h3g h ALA 24 N 0.06 1.24 -0.01 -0.83 0.00 -0.65 -2.60 119.26 116.46 3h3g h ALA 24 Ca -0.33 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.57 3h3g h ALA 24 Cb 1.99 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.77 3h3g h ALA 24 CO 0.14 0.01 -0.46 0.00 0.00 0.00 0.00 179.25 178.94 3h3g n ALA 25 N -2.20 3.50 -2.65 0.00 0.00 -1.03 -4.64 120.51 113.48 3h3g n ALA 25 Ca -0.03 -0.58 -0.37 0.00 0.00 0.00 0.00 53.44 52.47 3h3g n ALA 25 Cb 0.10 -0.67 -0.10 0.00 0.00 0.00 0.00 19.45 18.79 3h3g n ALA 25 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3h3g s ALA 26 N -2.24 3.59 0.00 0.00 0.00 -0.88 -4.93 121.76 117.30 3h3g s ALA 26 Ca 0.14 -0.89 0.00 0.00 0.00 0.00 0.00 51.96 51.21 3h3g s ALA 26 Cb 0.15 -2.38 0.00 0.00 0.00 0.00 0.00 23.12 20.89 3h3g s ALA 26 CO 0.52 -0.27 0.00 1.55 0.00 0.00 0.00 175.76 177.56 3h3g n VAL 31 N 4.43 0.00 -2.00 0.00 3.14 -1.26 -5.08 118.33 117.56 3h3g n VAL 31 Ca -0.14 0.00 -0.42 0.00 -2.96 0.00 0.00 64.34 60.82 3h3g n VAL 31 Cb 0.52 0.00 -0.03 0.00 -1.06 0.00 0.00 33.84 33.27 3h3g n VAL 31 CO 0.00 0.00 0.00 -0.32 -6.46 0.00 0.00 176.83 170.05 3h3g s MET 32 N 0.00 4.22 0.58 1.45 -2.45 -1.26 -5.01 119.30 116.83 3h3g s MET 32 Ca 0.00 2.25 -0.07 0.00 -1.25 0.00 0.00 55.69 56.62 3h3g s MET 32 Cb 0.00 -3.54 -0.00 0.00 1.25 0.00 0.00 34.83 32.54 3h3g s MET 32 CO 0.00 -0.68 0.90 -0.08 1.05 0.00 0.00 175.02 176.21 3h3g s THR 33 N 2.40 3.97 0.20 10.11 -1.32 -1.26 -4.95 115.64 124.79 3h3g s THR 33 Ca 0.71 0.14 -0.11 0.00 -1.21 0.00 0.00 61.69 61.23 3h3g s THR 33 Cb -0.38 -3.57 0.12 0.00 -1.51 0.00 0.00 72.50 67.16 3h3g s THR 33 CO 0.31 -0.61 1.80 0.50 -2.21 0.00 0.00 174.62 174.41 3h3g h LYS 34 N -0.14 0.60 -0.73 7.08 3.64 -1.99 -1.16 116.57 123.87 3h3g h LYS 34 Ca -0.46 -0.04 0.07 0.00 -1.27 0.00 0.00 60.65 58.96 3h3g h LYS 34 Cb 1.24 -0.14 -0.06 0.00 -0.41 0.00 0.00 32.23 32.86 3h3g h LYS 34 CO 0.61 0.40 0.40 0.93 -2.27 0.00 0.00 179.45 179.52 3h3g h GLU 35 N 0.62 0.70 0.30 1.90 3.07 -1.99 0.85 114.58 120.03 3h3g h GLU 35 Ca 0.27 -0.04 -0.00 0.00 -0.50 0.00 0.00 59.36 59.08 3h3g h GLU 35 Cb 0.16 -0.16 -0.01 0.00 -0.84 0.00 0.00 28.75 27.90 3h3g h GLU 35 CO -0.17 0.46 -0.23 1.49 -1.40 0.00 0.00 179.01 179.16 3h3g h GLU 36 N 0.72 -0.51 -0.89 2.33 4.81 -1.91 -2.13 114.58 116.99 3h3g h GLU 36 Ca 0.34 0.04 0.11 0.00 -0.13 0.00 0.00 59.36 59.71 3h3g h GLU 36 Cb 0.26 0.12 -0.07 0.00 0.63 0.00 0.00 28.75 29.69 3h3g h GLU 36 CO -0.21 -0.34 0.57 0.37 -0.73 0.00 0.00 179.01 178.67 3h3g h GLN 37 N -0.53 0.81 -0.36 1.92 5.75 -0.56 -0.54 115.11 121.60 3h3g h GLN 37 Ca -0.02 -0.05 -0.15 0.00 -0.15 0.00 0.00 58.65 58.28 3h3g h GLN 37 Cb 0.47 -0.18 -0.01 0.00 1.07 0.00 0.00 27.48 28.83 3h3g h GLN 37 CO -0.01 0.54 -0.37 0.82 -2.65 0.00 0.00 178.83 177.16 3h3g h ILE 38 N 0.83 1.28 -0.52 2.39 2.04 -0.76 -1.49 117.51 121.28 3h3g h ILE 38 Ca 0.42 -1.54 -0.04 0.00 1.00 0.00 0.00 64.86 64.71 3h3g h ILE 38 Cb 0.49 1.39 -0.02 0.00 -0.74 0.00 0.00 36.82 37.94 3h3g h ILE 38 CO -0.19 0.51 0.18 0.15 0.00 0.00 0.00 178.15 178.80 3h3g h PHE 39 N 0.70 0.83 -0.89 1.37 3.57 -0.61 -1.54 116.94 120.37 3h3g h PHE 39 Ca 0.06 -0.08 -0.01 0.00 3.53 0.00 0.00 57.97 61.47 3h3g h PHE 39 Cb 0.93 -0.24 -0.04 0.00 2.79 0.00 0.00 35.95 39.39 3h3g h PHE 39 CO 0.05 0.70 0.50 -0.07 -2.23 0.00 0.00 178.31 177.26 3h3g h LEU 40 N 0.71 1.10 -0.74 0.59 3.38 -0.87 -0.92 115.31 118.56 3h3g h LEU 40 Ca 0.17 -0.09 -0.06 0.00 0.09 0.00 0.00 57.88 57.99 3h3g h LEU 40 Cb 0.25 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.69 3h3g h LEU 40 CO -0.01 0.87 0.24 -0.07 0.09 0.00 0.00 178.44 179.57 3h3g h LEU 41 N 1.24 1.08 -1.42 1.67 3.38 -1.16 -1.61 115.31 118.49 3h3g h LEU 41 Ca 0.31 -0.21 -0.03 0.00 0.09 0.00 0.00 57.88 58.05 3h3g h LEU 41 Cb 0.01 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.46 3h3g h LEU 41 CO -0.05 0.99 0.08 -0.74 0.09 0.00 0.00 178.44 178.81 3h3g h HIS 42 N 1.10 0.47 -0.06 1.13 2.76 -0.46 0.11 115.15 120.20 3h3g h HIS 42 Ca 0.24 -0.02 -0.02 0.00 -2.20 0.00 0.00 60.37 58.36 3h3g h HIS 42 Cb 0.30 -0.15 -0.00 0.00 1.55 0.00 0.00 27.41 29.11 3h3g h HIS 42 CO 0.02 0.41 -0.05 -0.09 -1.30 0.00 0.00 177.93 176.93 3h3g h ARG 43 N 0.47 0.13 -0.52 5.26 2.43 -0.76 -1.64 114.38 119.75 3h3g h ARG 43 Ca 0.11 -0.07 -0.03 0.00 -0.81 0.00 0.00 59.98 59.18 3h3g h ARG 43 Cb 0.18 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 29.70 3h3g h ARG 43 CO -0.00 0.57 0.20 0.00 -1.51 0.00 0.00 179.97 179.23 3h3g h ALA 44 N 0.56 1.38 -0.18 2.80 0.00 -1.13 -1.47 119.26 121.22 3h3g h ALA 44 Ca 0.01 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 3h3g h ALA 44 Cb 0.55 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 3h3g h ALA 44 CO 0.01 0.47 0.06 0.37 0.00 0.00 0.00 179.25 180.16 3h3g h GLN 45 N 0.74 0.29 -0.61 0.00 4.15 -0.71 -0.02 115.11 118.95 3h3g h GLN 45 Ca 0.18 -0.06 0.00 0.00 0.77 0.00 0.00 58.65 59.54 3h3g h GLN 45 Cb 0.15 -0.04 -0.03 0.00 0.21 0.00 0.00 27.48 27.77 3h3g h GLN 45 CO -0.02 0.40 0.40 0.00 -1.93 0.00 0.00 178.83 177.68 3h3g h ALA 46 N 0.88 0.77 -0.56 3.38 0.00 -1.13 -0.39 119.26 122.22 3h3g h ALA 46 Ca 0.06 -0.05 0.01 0.00 0.00 0.00 0.00 54.91 54.93 3h3g h ALA 46 Cb 0.23 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.74 3h3g h ALA 46 CO -0.00 0.22 0.37 0.37 0.00 0.00 0.00 179.25 180.21 3h3g h GLN 47 N 0.83 0.72 -0.36 0.00 4.15 -1.18 -0.78 115.11 118.49 3h3g h GLN 47 Ca 0.22 -0.04 -0.13 0.00 0.77 0.00 0.00 58.65 59.47 3h3g h GLN 47 Cb -0.08 -0.16 -0.01 0.00 0.21 0.00 0.00 27.48 27.44 3h3g h GLN 47 CO -0.05 0.48 -0.27 0.00 -1.93 0.00 0.00 178.83 177.06 3h3g h GLU 49 N 0.61 1.01 -0.29 0.00 5.08 -0.58 -0.88 114.58 119.52 3h3g h GLU 49 Ca 0.07 -0.36 0.01 0.00 -1.00 0.00 0.00 59.36 58.07 3h3g h GLU 49 Cb 0.84 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 30.01 3h3g h GLU 49 CO 0.07 1.04 0.20 0.87 -1.00 0.00 0.00 179.01 180.19 3h3g h LYS 50 N 0.88 0.38 -0.24 2.33 1.57 -1.22 -1.41 116.57 118.86 3h3g h LYS 50 Ca 0.14 -0.02 -0.12 0.00 -1.87 0.00 0.00 60.65 58.78 3h3g h LYS 50 Cb 0.64 -0.09 -0.00 0.00 0.08 0.00 0.00 32.23 32.86 3h3g h LYS 50 CO 0.04 0.25 -0.33 -0.09 -0.57 0.00 0.00 179.45 178.76 3h3g h ARG 51 N 0.39 0.65 -0.03 3.15 2.43 -1.01 -3.21 114.38 116.76 3h3g h ARG 51 Ca 0.11 -0.37 -0.07 0.00 -0.81 0.00 0.00 59.98 58.83 3h3g h ARG 51 Cb -0.03 0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.54 3h3g h ARG 51 CO -0.02 0.99 -0.33 -0.07 -1.51 0.00 0.00 179.97 179.02 3h3g h LEU 52 N 0.36 0.05 -0.20 3.80 3.38 -0.73 -2.95 115.31 119.02 3h3g h LEU 52 Ca 0.03 -0.01 0.06 0.00 0.09 0.00 0.00 57.88 58.04 3h3g h LEU 52 Cb 0.91 -0.01 -0.07 0.00 0.09 0.00 0.00 40.66 41.57 3h3g h LEU 52 CO 0.08 0.38 -0.31 0.11 0.09 0.00 0.00 178.44 178.79 3h3g h LYS 53 N 0.04 -0.33 -0.00 1.13 1.57 -1.27 -0.17 116.57 117.54 3h3g h LYS 53 Ca 0.00 0.02 -0.23 0.00 -1.87 0.00 0.00 60.65 58.58 3h3g h LYS 53 Cb 0.61 0.07 0.00 0.00 0.08 0.00 0.00 32.23 33.00 3h3g h LYS 53 CO 0.04 -0.22 -0.95 1.05 -0.57 0.00 0.00 179.45 178.80 3h3g h GLU 54 N -0.34 0.44 -0.25 3.15 4.11 -1.64 -3.28 114.58 116.76 3h3g h GLU 54 Ca 0.12 -0.48 -0.09 0.00 0.07 0.00 0.00 59.36 58.98 3h3g h GLU 54 Cb 0.53 0.13 -0.00 0.00 0.50 0.00 0.00 28.75 29.91 3h3g h GLU 54 CO -0.40 1.13 -0.21 0.28 0.07 0.00 0.00 179.01 179.89 3h3g h VAL 55 N 0.25 1.31 -3.32 -1.06 2.07 -1.43 -3.53 116.25 110.55 3h3g h VAL 55 Ca -0.08 -1.36 -0.66 0.00 0.82 0.00 0.00 66.70 65.42 3h3g h VAL 55 Cb 1.59 1.64 -0.29 0.00 -1.52 0.00 0.00 31.29 32.70 3h3g h VAL 55 CO 0.17 0.42 -0.76 -0.76 0.02 0.00 0.00 177.57 176.66 3h3g s LEU 56 N -9.06 2.71 0.00 2.57 1.43 -0.08 -5.10 118.68 111.14 3h3g s LEU 56 Ca -0.13 -0.44 0.00 0.00 -1.03 0.00 0.00 54.13 52.53 3h3g s LEU 56 Cb 0.08 -1.67 0.00 0.00 0.03 0.00 0.00 46.19 44.63 3h3g s LEU 56 CO 0.80 0.00 0.00 -1.14 0.23 0.00 0.00 176.35 176.24 3h3g n ARG 102 N 4.64 0.00 -1.56 1.70 0.63 -1.26 -4.83 116.66 115.99 3h3g n ARG 102 Ca -0.19 0.04 -0.47 0.00 -0.92 0.00 0.00 57.85 56.30 3h3g n ARG 102 Cb 0.51 -0.34 -0.05 0.00 0.45 0.00 0.00 32.46 33.02 3h3g n ARG 102 CO 0.00 0.00 0.00 0.98 -2.51 0.00 0.00 177.63 176.10 3h3g n TYR 103 N -1.96 1.91 -2.98 -0.14 9.36 -1.26 0.30 117.16 122.38 3h3g n TYR 103 Ca 0.00 0.06 -0.18 0.00 3.32 0.00 0.00 57.90 61.10 3h3g n TYR 103 Cb 0.00 -2.64 0.04 0.00 -0.63 0.00 0.00 39.34 36.11 3h3g n TYR 103 CO 0.00 0.00 0.00 0.54 0.22 0.00 0.00 176.86 177.62 3h3g n ARG 104 N 8.05 -4.44 -0.36 2.98 1.74 -1.26 -4.94 116.66 118.42 3h3g n ARG 104 Ca 0.33 0.69 0.08 0.00 -0.77 0.00 0.00 57.85 58.17 3h3g n ARG 104 Cb 0.32 -5.13 0.24 0.00 -1.02 0.00 0.00 32.46 26.88 3h3g n ARG 104 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3h3g n GLY 105 N -1.44 2.98 2.93 -0.13 0.00 0.15 -4.67 105.19 105.01 3h3g n GLY 105 Ca -0.06 -0.67 -0.30 0.00 0.00 0.00 0.00 46.02 44.99 3h3g n GLY 105 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3h3g s ARG 106 N -1.56 1.61 0.68 1.61 3.52 -1.26 -4.95 118.95 118.60 3h3g s ARG 106 Ca 0.37 -0.84 -0.11 0.00 -0.13 0.00 0.00 55.73 55.02 3h3g s ARG 106 Cb 0.23 -2.42 -0.01 0.00 -1.56 0.00 0.00 34.95 31.19 3h3g s ARG 106 CO 0.19 -0.54 1.06 -1.25 -0.81 0.00 0.00 175.30 173.95 3h3g s PRO 107 N 1.47 3.12 0.37 5.12 0.04 -1.26 -3.09 135.00 140.77 3h3g s PRO 107 Ca -0.03 0.77 -0.25 0.00 0.04 0.00 0.00 61.00 61.53 3h3g s PRO 107 Cb -0.18 -2.03 -0.09 0.00 0.04 0.00 0.00 34.50 32.25 3h3g s PRO 107 CO -0.07 -0.92 1.02 0.00 0.04 0.00 0.00 177.00 177.07 3h3g s LEU 109 N -2.40 4.27 0.49 0.00 1.43 -1.26 -1.32 118.68 119.88 3h3g s LEU 109 Ca 0.55 1.42 -0.24 0.00 -1.03 0.00 0.00 54.13 54.82 3h3g s LEU 109 Cb -0.21 -3.75 -0.07 0.00 0.03 0.00 0.00 46.19 42.19 3h3g s LEU 109 CO 0.27 -0.04 1.40 -2.16 0.23 0.00 0.00 176.35 176.05 3h3g s PRO 110 N -2.25 3.47 0.15 1.29 0.04 -1.26 -4.78 135.00 131.66 3h3g s PRO 110 Ca 0.46 2.35 -0.13 0.00 0.04 0.00 0.00 61.00 63.72 3h3g s PRO 110 Cb -0.15 -2.50 0.02 0.00 0.04 0.00 0.00 34.50 31.91 3h3g s PRO 110 CO 0.20 -0.97 0.36 -1.83 0.04 0.00 0.00 177.00 174.81 3h3g s GLU 111 N -2.63 1.13 -0.18 4.56 -1.05 -0.67 -4.95 118.70 114.91 3h3g s GLU 111 Ca 0.65 -0.91 -0.13 0.00 -0.15 0.00 0.00 54.97 54.42 3h3g s GLU 111 Cb -0.42 0.44 -0.05 0.00 -0.44 0.00 0.00 34.13 33.65 3h3g s GLU 111 CO 0.53 -0.43 0.28 -0.46 0.95 0.00 0.00 175.26 176.12 3h3g s TRP 112 N -3.87 3.43 -0.20 4.83 -0.11 -1.26 0.65 118.94 122.41 3h3g s TRP 112 Ca 0.09 0.53 0.17 0.00 1.22 0.00 0.00 56.10 58.11 3h3g s TRP 112 Cb 0.02 -2.34 0.50 0.00 -1.50 0.00 0.00 33.47 30.15 3h3g s TRP 112 CO -0.06 0.19 1.39 -0.40 -4.62 0.00 0.00 176.95 173.45 3h3g n ASP 113 N 3.78 3.72 0.00 5.86 5.75 -0.92 -4.94 116.55 129.80 3h3g n ASP 113 Ca -0.12 -3.00 0.00 0.00 -0.01 0.00 0.00 54.79 51.66 3h3g n ASP 113 Cb 0.52 -0.52 0.00 0.00 -1.03 0.00 0.00 41.12 40.08 3h3g n ASP 113 CO 0.00 0.00 0.00 1.41 -0.11 0.00 0.00 177.20 178.50 3h3g n HIS 114 N -0.57 0.00 0.00 2.11 8.25 -1.26 -4.77 115.22 118.98 3h3g n HIS 114 Ca 0.21 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.67 3h3g n HIS 114 Cb 0.86 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.97 3h3g n HIS 114 CO 0.00 0.00 0.00 -0.89 0.64 0.00 0.00 176.34 176.09 3h3g n ILE 115 N -2.00 0.00 -4.26 1.59 5.41 -1.26 -5.07 119.36 113.77 3h3g n ILE 115 Ca 0.00 0.00 -0.19 0.00 1.00 0.00 0.00 62.75 63.56 3h3g n ILE 115 Cb 0.00 -0.72 -0.13 0.00 -0.71 0.00 0.00 39.64 38.08 3h3g n ILE 115 CO 0.00 0.00 0.00 -0.76 0.00 0.00 0.00 176.55 175.79 3h3g s LEU 116 N -4.96 2.23 -0.32 1.39 1.43 -1.26 -4.99 118.68 112.19 3h3g s LEU 116 Ca 0.00 -0.54 -0.17 0.00 -1.03 0.00 0.00 54.13 52.39 3h3g s LEU 116 Cb 0.00 -0.56 -0.01 0.00 0.03 0.00 0.00 46.19 45.65 3h3g s LEU 116 CO 0.00 -0.02 0.48 0.00 0.23 0.00 0.00 176.35 177.04 3h3g s TRP 118 N 2.30 3.69 0.68 0.00 0.52 0.21 -4.92 118.94 121.42 3h3g s TRP 118 Ca 0.18 1.30 -0.10 0.00 0.02 0.00 0.00 56.10 57.50 3h3g s TRP 118 Cb -0.16 -2.71 0.15 0.00 -1.15 0.00 0.00 33.47 29.61 3h3g s TRP 118 CO 0.12 0.29 0.93 -0.35 0.02 0.00 0.00 176.95 177.96 3h3g n PRO 119 N 2.87 -0.74 -1.63 4.98 -0.04 -1.26 -1.67 135.00 137.51 3h3g n PRO 119 Ca -0.05 -1.62 -0.45 0.00 -0.04 0.00 0.00 63.50 61.34 3h3g n PRO 119 Cb 0.51 -0.90 -0.02 0.00 -0.04 0.00 0.00 33.50 33.04 3h3g n PRO 119 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 3h3g n LEU 120 N 0.00 2.45 -4.47 1.53 4.77 -1.26 -4.06 117.00 115.97 3h3g n LEU 120 Ca 0.12 1.16 -0.33 0.00 -0.03 0.00 0.00 56.01 56.93 3h3g n LEU 120 Cb 0.43 -1.35 -0.13 0.00 -2.33 0.00 0.00 43.42 40.04 3h3g n LEU 120 CO 0.31 -0.91 -0.38 -0.83 -1.33 0.00 0.00 177.39 174.24 3h3g s GLY 121 N -0.07 1.66 0.13 -0.72 0.00 -0.44 -4.94 107.32 102.95 3h3g s GLY 121 Ca 0.65 -0.85 -0.31 0.00 0.00 0.00 0.00 44.72 44.22 3h3g s GLY 121 CO 0.54 -0.16 1.37 0.00 0.00 0.00 0.00 173.10 174.85 3h3g s ALA 122 N 0.24 3.57 0.30 3.20 0.00 -1.26 -0.63 121.76 127.18 3h3g s ALA 122 Ca -0.05 1.11 -0.30 0.00 0.00 0.00 0.00 51.96 52.72 3h3g s ALA 122 Cb -0.14 -3.52 -0.11 0.00 0.00 0.00 0.00 23.12 19.34 3h3g s ALA 122 CO 0.04 -0.59 1.60 -1.25 0.00 0.00 0.00 175.76 175.55 3h3g s PRO 123 N 0.80 4.11 0.00 0.00 0.04 -1.26 -1.84 135.00 136.85 3h3g s PRO 123 Ca 0.62 2.60 0.00 0.00 0.04 0.00 0.00 61.00 64.26 3h3g s PRO 123 Cb -0.37 -3.01 0.00 0.00 0.04 0.00 0.00 34.50 31.16 3h3g s PRO 123 CO 0.32 -0.64 0.00 0.41 0.04 0.00 0.00 177.00 177.13 3h3g n GLY 124 N 2.05 0.82 3.54 0.56 0.00 0.10 -4.76 105.19 107.49 3h3g n GLY 124 Ca 0.08 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.83 3h3g n GLY 124 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3h3g s GLU 125 N -0.34 1.95 0.21 1.61 2.02 -0.77 -4.91 118.70 118.47 3h3g s GLU 125 Ca 0.00 -1.31 -0.30 0.00 0.02 0.00 0.00 54.97 53.38 3h3g s GLU 125 Cb 0.00 -2.10 -0.08 0.00 0.10 0.00 0.00 34.13 32.05 3h3g s GLU 125 CO 0.00 0.43 1.04 0.08 0.02 0.00 0.00 175.26 176.83 3h3g s VAL 126 N -1.67 3.92 -0.18 2.63 1.01 -1.26 -0.75 120.40 124.10 3h3g s VAL 126 Ca 0.24 1.78 -0.03 0.00 0.00 0.00 0.00 61.98 63.97 3h3g s VAL 126 Cb -0.09 -4.14 -0.01 0.00 0.00 0.00 0.00 36.38 32.14 3h3g s VAL 126 CO 0.14 0.36 -0.07 -0.69 0.00 0.00 0.00 175.10 174.84 3h3g s VAL 127 N -0.68 3.33 -0.14 2.92 1.01 -0.02 -4.93 120.40 121.88 3h3g s VAL 127 Ca 0.46 -0.53 -0.03 0.00 0.00 0.00 0.00 61.98 61.87 3h3g s VAL 127 Cb -0.28 -2.47 -0.03 0.00 0.00 0.00 0.00 36.38 33.60 3h3g s VAL 127 CO 0.35 0.47 -0.04 0.00 0.00 0.00 0.00 175.10 175.88 3h3g s ALA 128 N 0.95 3.01 -0.06 5.51 0.00 -1.26 -1.33 121.76 128.58 3h3g s ALA 128 Ca -0.01 -0.82 0.04 0.00 0.00 0.00 0.00 51.96 51.17 3h3g s ALA 128 Cb -0.15 -1.52 0.00 0.00 0.00 0.00 0.00 23.12 21.45 3h3g s ALA 128 CO 0.00 0.27 -0.18 0.08 0.00 0.00 0.00 175.76 175.93 3h3g s VAL 129 N 0.19 1.54 0.30 0.00 1.01 0.04 -4.98 120.40 118.50 3h3g s VAL 129 Ca -0.02 -0.75 -0.29 0.00 0.00 0.00 0.00 61.98 60.92 3h3g s VAL 129 Cb -0.14 -1.33 -0.13 0.00 0.00 0.00 0.00 36.38 34.78 3h3g s VAL 129 CO 0.03 0.44 1.20 -2.65 0.00 0.00 0.00 175.10 174.12 3h3g n PRO 130 N 3.34 1.81 -1.71 2.72 -0.02 -1.26 -0.32 135.00 139.56 3h3g n PRO 130 Ca -0.19 0.64 -0.42 0.00 -2.02 0.00 0.00 63.50 61.50 3h3g n PRO 130 Cb 0.53 -2.15 -0.03 0.00 -0.02 0.00 0.00 33.50 31.83 3h3g n PRO 130 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3h3g n PRO 132 N 7.51 2.70 0.01 0.00 -0.04 -1.26 -4.64 135.00 139.28 3h3g n PRO 132 Ca 0.20 0.96 0.08 0.00 -0.04 0.00 0.00 63.50 64.70 3h3g n PRO 132 Cb 0.41 -2.74 0.50 0.00 -0.04 0.00 0.00 33.50 31.64 3h3g n PRO 132 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 3h3g h ASP 133 N 4.60 0.33 0.37 3.54 3.32 -1.94 -2.82 116.42 123.82 3h3g h ASP 133 Ca -0.47 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.57 3h3g h ASP 133 Cb 1.23 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 40.70 3h3g h ASP 133 CO 0.78 0.22 0.00 0.00 -1.72 0.00 0.00 179.24 178.52 3h3g n TYR 134 N -4.48 0.00 -3.16 4.55 4.11 -1.26 -4.39 117.16 112.53 3h3g n TYR 134 Ca 0.05 0.00 -0.45 0.00 -0.00 0.00 0.00 57.90 57.51 3h3g n TYR 134 Cb 0.21 -0.20 -0.05 0.00 -0.00 0.00 0.00 39.34 39.30 3h3g n TYR 134 CO 0.00 0.00 0.00 0.42 -0.00 0.00 0.00 176.86 177.28 3h3g s ILE 135 N -2.39 4.90 0.23 -3.48 -1.09 -1.06 -4.78 121.20 113.53 3h3g s ILE 135 Ca 0.33 -0.91 -0.06 0.00 -2.23 0.00 0.00 60.65 57.78 3h3g s ILE 135 Cb 0.20 -4.40 0.20 0.00 -1.58 0.00 0.00 42.46 36.87 3h3g s ILE 135 CO 0.41 -0.98 1.73 0.22 -1.23 0.00 0.00 174.94 175.08 3h3g h TYR 136 N 9.08 0.46 0.00 3.97 5.03 -1.87 -2.27 116.97 131.38 3h3g h TYR 136 Ca -0.29 0.04 0.00 0.00 2.58 0.00 0.00 58.73 61.06 3h3g h TYR 136 Cb 1.09 -0.10 0.00 0.00 1.55 0.00 0.00 36.73 39.28 3h3g h TYR 136 CO 0.79 0.06 0.00 -0.25 -1.32 0.00 0.00 178.16 177.44 3h3g n ASP 137 N -5.01 0.00 -4.80 -2.11 10.43 -1.26 -4.89 116.55 108.91 3h3g n ASP 137 Ca 0.13 0.18 -0.33 0.00 2.57 0.00 0.00 54.79 57.34 3h3g n ASP 137 Cb 0.38 -0.39 0.02 0.00 1.84 0.00 0.00 41.12 42.96 3h3g n ASP 137 CO 0.00 0.00 0.00 -0.36 -1.07 0.00 0.00 177.20 175.77 3h3g s PHE 138 N -2.78 2.93 -0.49 1.24 0.08 -0.85 -4.87 117.98 113.24 3h3g s PHE 138 Ca 0.21 1.51 -0.29 0.00 0.12 0.00 0.00 56.93 58.49 3h3g s PHE 138 Cb 0.19 -3.03 0.02 0.00 -0.57 0.00 0.00 43.02 39.63 3h3g s PHE 138 CO 0.48 -1.21 1.25 1.21 -0.10 0.00 0.00 175.22 176.85 3h3g s ASN 139 N -2.78 6.48 0.00 1.36 2.47 0.13 -4.93 114.94 117.67 3h3g s ASN 139 Ca 0.64 0.49 0.30 0.00 0.42 0.00 0.00 52.86 54.70 3h3g s ASN 139 Cb -0.17 -2.55 1.37 0.00 -1.45 0.00 0.00 41.25 38.46 3h3g s ASN 139 CO 0.38 -1.38 1.96 1.41 -3.72 0.00 0.00 177.10 175.75 3h3g n HIS 140 N 8.37 0.00 1.24 0.43 8.25 -1.26 -2.49 115.22 129.75 3h3g n HIS 140 Ca 0.13 0.00 0.13 0.00 -0.26 0.00 0.00 57.72 57.72 3h3g n HIS 140 Cb 0.49 -0.25 0.36 0.00 1.12 0.00 0.00 29.99 31.71 3h3g n HIS 140 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 3h3g n LYS 141 N -1.16 0.88 -2.60 -0.41 5.02 -1.26 -4.59 118.16 114.03 3h3g n LYS 141 Ca 0.14 -0.53 -0.22 0.00 -2.02 0.00 0.00 58.31 55.67 3h3g n LYS 141 Cb 0.26 -1.49 0.07 0.00 -0.02 0.00 0.00 35.03 33.85 3h3g n LYS 141 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 3h3g s GLY 142 N -2.49 1.79 0.10 0.72 0.00 -1.04 -4.94 107.32 101.45 3h3g s GLY 142 Ca 0.24 -1.53 0.07 0.00 0.00 0.00 0.00 44.72 43.51 3h3g s GLY 142 CO 0.52 -1.10 -0.18 0.30 0.00 0.00 0.00 173.10 172.64 3h3g s HIS 143 N -2.96 1.61 0.13 1.90 3.76 -1.26 -0.21 115.29 118.25 3h3g s HIS 143 Ca 0.62 -0.44 0.02 0.00 -0.15 0.00 0.00 55.06 55.11 3h3g s HIS 143 Cb -0.08 -0.88 -0.04 0.00 1.11 0.00 0.00 32.58 32.70 3h3g s HIS 143 CO 0.42 0.17 0.24 0.00 -0.85 0.00 0.00 174.74 174.71 3h3g s ALA 144 N -1.33 3.90 0.02 -1.40 0.00 0.57 -4.34 121.76 119.17 3h3g s ALA 144 Ca 0.05 -1.02 0.04 0.00 0.00 0.00 0.00 51.96 51.03 3h3g s ALA 144 Cb -0.09 -1.71 -0.01 0.00 0.00 0.00 0.00 23.12 21.30 3h3g s ALA 144 CO 0.04 0.61 -0.12 0.71 0.00 0.00 0.00 175.76 177.00 3h3g s TYR 145 N -1.68 1.04 0.33 0.00 1.51 -0.76 -0.78 117.35 117.01 3h3g s TYR 145 Ca 0.34 -0.28 0.07 0.00 -1.01 0.00 0.00 57.07 56.19 3h3g s TYR 145 Cb -0.11 -0.64 -0.07 0.00 -0.11 0.00 0.00 41.96 41.03 3h3g s TYR 145 CO 0.27 -0.00 -0.02 1.03 -1.11 0.00 0.00 175.55 175.72 3h3g s ARG 146 N -0.72 1.71 -0.14 -0.62 0.52 -0.44 -1.17 118.95 118.08 3h3g s ARG 146 Ca 0.02 -1.91 0.02 0.00 -0.52 0.00 0.00 55.73 53.34 3h3g s ARG 146 Cb -0.06 -1.29 0.00 0.00 0.52 0.00 0.00 34.95 34.12 3h3g s ARG 146 CO 0.00 -0.01 -0.20 1.03 0.02 0.00 0.00 175.30 176.14 3h3g s ARG 147 N -3.74 3.09 -0.29 3.54 0.52 -1.26 -0.84 118.95 119.96 3h3g s ARG 147 Ca 0.33 -0.82 -0.14 0.00 -0.52 0.00 0.00 55.73 54.58 3h3g s ARG 147 Cb 0.06 -2.48 -0.03 0.00 0.52 0.00 0.00 34.95 33.01 3h3g s ARG 147 CO 0.15 0.02 0.30 0.00 0.02 0.00 0.00 175.30 175.79 3h3g s ASP 149 N 1.71 2.99 0.65 0.00 1.47 -0.08 0.00 116.67 123.41 3h3g s ASP 149 Ca 0.11 1.17 0.42 0.00 1.18 0.00 0.00 52.55 55.43 3h3g s ASP 149 Cb -0.16 -1.82 2.31 0.00 -0.34 0.00 0.00 42.92 42.91 3h3g s ASP 149 CO 0.11 -2.90 2.34 0.03 0.68 0.00 0.00 175.17 175.43 3h3g h ARG 150 N -1.73 0.00 -0.13 2.11 2.47 -1.86 -1.51 114.38 113.72 3h3g h ARG 150 Ca -0.53 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.19 3h3g h ARG 150 Cb 1.32 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.64 3h3g h ARG 150 CO 0.58 0.00 0.00 0.09 0.56 0.00 0.00 179.97 181.21 3h3g n ASN 151 N -3.19 2.66 -0.00 7.04 5.03 -1.26 -4.21 115.26 121.33 3h3g n ASN 151 Ca -0.03 -1.87 -0.00 0.00 0.87 0.00 0.00 54.58 53.55 3h3g n ASN 151 Cb 0.08 -0.07 -0.00 0.00 -1.02 0.00 0.00 39.78 38.77 3h3g n ASN 151 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 3h3g n GLY 152 N 1.33 0.37 3.55 7.41 0.00 -0.61 -4.84 105.19 112.40 3h3g n GLY 152 Ca 0.17 -0.95 -0.34 0.00 0.00 0.00 0.00 46.02 44.90 3h3g n GLY 152 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3h3g s SER 153 N -3.00 4.48 0.29 1.61 0.01 -1.26 -3.71 113.70 112.12 3h3g s SER 153 Ca 0.00 -0.07 -0.30 0.00 1.31 0.00 0.00 55.95 56.89 3h3g s SER 153 Cb 0.00 -1.08 -0.11 0.00 0.21 0.00 0.00 66.02 65.05 3h3g s SER 153 CO 0.00 0.36 1.49 0.26 0.41 0.00 0.00 173.24 175.76 3h3g s TRP 154 N -0.80 2.86 0.26 2.43 0.52 -1.26 -0.90 118.94 122.05 3h3g s TRP 154 Ca 0.12 0.99 -0.30 0.00 0.02 0.00 0.00 56.10 56.93 3h3g s TRP 154 Cb -0.11 -3.93 -0.10 0.00 -1.15 0.00 0.00 33.47 28.18 3h3g s TRP 154 CO 0.01 -2.98 1.44 -1.21 0.02 0.00 0.00 176.95 174.23 3h3g s GLU 155 N -0.78 4.26 0.10 4.98 2.02 0.27 -4.84 118.70 124.71 3h3g s GLU 155 Ca 0.59 2.31 -0.04 0.00 0.02 0.00 0.00 54.97 57.86 3h3g s GLU 155 Cb -0.44 -3.10 -0.05 0.00 0.10 0.00 0.00 34.13 30.63 3h3g s GLU 155 CO 0.49 -0.42 0.31 -0.51 0.02 0.00 0.00 175.26 175.14 3h3g s LEU 156 N -0.49 4.31 0.17 1.80 1.43 -1.26 -0.28 118.68 124.36 3h3g s LEU 156 Ca 0.59 0.49 -0.32 0.00 -1.03 0.00 0.00 54.13 53.85 3h3g s LEU 156 Cb -0.42 -3.10 -0.12 0.00 0.03 0.00 0.00 46.19 42.58 3h3g s LEU 156 CO 0.44 0.12 1.76 0.52 0.23 0.00 0.00 176.35 179.42 3h3g n VAL 157 N 0.31 0.15 -1.73 -1.59 0.31 -0.35 -4.64 118.33 110.79 3h3g n VAL 157 Ca -0.05 -0.03 -0.42 0.00 -0.01 0.00 0.00 64.34 63.84 3h3g n VAL 157 Cb 0.52 -1.99 -0.02 0.00 -0.91 0.00 0.00 33.84 31.44 3h3g n VAL 157 CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 3h3g n PRO 158 N 4.60 2.67 -0.81 5.55 -0.02 -1.26 -2.47 135.00 143.25 3h3g n PRO 158 Ca 0.17 0.95 0.00 0.00 -2.02 0.00 0.00 63.50 62.60 3h3g n PRO 158 Cb 0.35 -2.74 0.00 0.00 -0.02 0.00 0.00 33.50 31.09 3h3g n PRO 158 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3h3g n GLY 159 N 2.52 0.80 3.23 -1.23 0.00 -1.26 -5.01 105.19 104.23 3h3g n GLY 159 Ca 0.10 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.02 3h3g n GLY 159 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3h3g s HIS 160 N -3.05 0.77 -2.43 1.61 3.76 -1.03 -5.05 115.29 109.87 3h3g s HIS 160 Ca 0.00 -1.11 0.22 0.00 -0.15 0.00 0.00 55.06 54.02 3h3g s HIS 160 Cb 0.00 -0.35 0.63 0.00 1.11 0.00 0.00 32.58 33.96 3h3g s HIS 160 CO 0.00 -0.61 1.49 0.09 -0.85 0.00 0.00 174.74 174.86 3h3g n ASN 161 N -0.17 2.31 -4.85 1.40 5.03 -1.26 -4.51 115.26 113.21 3h3g n ASN 161 Ca -0.05 -1.80 -0.32 0.00 0.87 0.00 0.00 54.58 53.28 3h3g n ASN 161 Cb 0.64 -0.13 -0.05 0.00 -1.02 0.00 0.00 39.78 39.22 3h3g n ASN 161 CO 0.00 0.00 0.00 -0.13 -1.83 0.00 0.00 177.26 175.30 3h3g s ARG 162 N -1.74 3.95 0.15 3.52 0.52 -1.26 -4.93 118.95 119.15 3h3g s ARG 162 Ca 0.34 0.73 -0.30 0.00 -0.52 0.00 0.00 55.73 55.98 3h3g s ARG 162 Cb 0.20 -2.32 -0.07 0.00 0.52 0.00 0.00 34.95 33.28 3h3g s ARG 162 CO 0.29 -0.02 1.09 0.99 0.02 0.00 0.00 175.30 177.66 3h3g s THR 163 N -2.27 4.03 0.08 0.02 2.01 -1.26 -1.21 115.64 117.04 3h3g s THR 163 Ca 0.55 1.68 -0.31 0.00 0.31 0.00 0.00 61.69 63.93 3h3g s THR 163 Cb -0.10 -4.08 -0.09 0.00 0.01 0.00 0.00 72.50 68.24 3h3g s THR 163 CO 0.24 0.26 1.73 0.86 -0.69 0.00 0.00 174.62 177.02 3h3g s TRP 164 N 0.01 2.26 -0.14 4.92 -0.00 0.61 -4.67 118.94 121.93 3h3g s TRP 164 Ca 0.50 0.16 -0.10 0.00 -0.00 0.00 0.00 56.10 56.66 3h3g s TRP 164 Cb -0.28 -4.05 0.04 0.00 -0.00 0.00 0.00 33.47 29.18 3h3g s TRP 164 CO 0.33 -4.29 0.36 0.00 -0.00 0.00 0.00 176.95 173.34 3h3g s ALA 165 N 2.81 -0.89 -0.30 5.86 0.00 -1.26 -4.36 121.76 123.62 3h3g s ALA 165 Ca 0.77 1.17 0.00 0.00 0.00 0.00 0.00 51.96 53.90 3h3g s ALA 165 Cb -0.42 -0.70 0.06 0.00 0.00 0.00 0.00 23.12 22.06 3h3g s ALA 165 CO 0.34 -0.20 -0.02 1.21 0.00 0.00 0.00 175.76 177.09 3h3g s ASN 166 N 0.74 4.76 -0.09 0.00 3.84 -0.32 -4.94 114.94 118.93 3h3g s ASN 166 Ca -0.04 -1.43 0.16 0.00 0.21 0.00 0.00 52.86 51.75 3h3g s ASN 166 Cb -0.06 -1.66 0.55 0.00 -0.55 0.00 0.00 41.25 39.53 3h3g s ASN 166 CO -0.05 -0.27 1.46 -1.22 -2.79 0.00 0.00 177.10 174.24 3h3g n TYR 167 N 4.53 1.02 0.06 0.43 4.02 -1.26 -1.83 117.16 124.13 3h3g n TYR 167 Ca -0.11 -0.63 0.03 0.00 -0.01 0.00 0.00 57.90 57.18 3h3g n TYR 167 Cb 0.43 -0.18 0.42 0.00 -0.02 0.00 0.00 39.34 39.99 3h3g n TYR 167 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 176.86 176.51 3h3g h SER 168 N 2.94 0.37 0.24 7.72 4.64 -1.92 -1.11 113.55 126.44 3h3g h SER 168 Ca 0.00 -0.03 -0.07 0.00 -0.47 0.00 0.00 61.79 61.22 3h3g h SER 168 Cb 1.21 -0.09 -0.01 0.00 -0.31 0.00 0.00 62.40 63.20 3h3g h SER 168 CO 0.15 0.34 -0.29 -0.33 -0.87 0.00 0.00 176.83 175.83 3h3g h GLU 169 N 0.41 0.07 -0.30 4.77 5.08 -1.85 -3.05 114.58 119.73 3h3g h GLU 169 Ca 0.10 -0.02 -0.12 0.00 -1.00 0.00 0.00 59.36 58.32 3h3g h GLU 169 Cb 0.09 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.33 3h3g h GLU 169 CO -0.01 0.36 -0.28 0.00 -1.00 0.00 0.00 179.01 178.08 3h3g n VAL 171 N -4.26 1.78 -0.29 0.00 0.24 -1.10 0.22 118.33 114.92 3h3g n VAL 171 Ca -0.04 -0.91 0.07 0.00 -2.04 0.00 0.00 64.34 61.43 3h3g n VAL 171 Cb 0.47 -0.34 0.22 0.00 -1.47 0.00 0.00 33.84 32.72 3h3g n VAL 171 CO 0.00 0.00 0.00 0.50 -2.14 0.00 0.00 176.83 175.19 3h3g h LYS 172 N 2.61 0.56 -1.00 7.34 3.64 -1.52 -2.23 116.57 125.97 3h3g h LYS 172 Ca 0.00 -0.03 -0.50 0.00 -1.27 0.00 0.00 60.65 58.85 3h3g h LYS 172 Cb 1.45 -0.13 -0.29 0.00 -0.41 0.00 0.00 32.23 32.86 3h3g h LYS 172 CO 0.32 0.37 0.63 1.19 -2.27 0.00 0.00 179.45 179.68 3h3g n PHE 173 N -4.91 2.89 -2.11 1.91 3.01 -1.26 -4.26 117.46 112.73 3h3g n PHE 173 Ca 0.17 -1.83 -0.27 0.00 1.01 0.00 0.00 57.45 56.53 3h3g n PHE 173 Cb 0.45 -0.94 0.02 0.00 -0.01 0.00 0.00 39.48 39.00 3h3g n PHE 173 CO 0.00 0.00 0.00 1.28 1.01 0.00 0.00 176.76 179.05 3h3g n LEU 174 N -1.03 5.20 0.00 4.37 4.77 -0.84 -5.09 117.00 124.39 3h3g n LEU 174 Ca 0.56 -4.87 0.00 0.00 -0.03 0.00 0.00 56.01 51.68 3h3g n LEU 174 Cb 1.54 -0.46 0.00 0.00 -2.33 0.00 0.00 43.42 42.17 3h3g n LEU 174 CO 0.58 2.08 0.00 0.41 -1.33 0.00 0.00 177.39 179.14