#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hrr s ILE 1306N 0.00 3.73 0.05 6.31 2.07 -1.26 -4.95 121.20 127.16 3hrr s ILE 1306Ca 0.00 1.17 -0.31 0.00 -1.41 0.00 0.00 60.65 60.10 3hrr s ILE 1306Cb 0.00 -3.75 -0.07 0.00 0.13 0.00 0.00 42.46 38.77 3hrr s ILE 1306CO 0.00 0.03 1.49 -0.54 -1.91 0.00 0.00 174.94 174.01 3hrr s LYS 1307N 1.91 4.26 0.52 3.50 -0.14 -1.26 -5.02 119.74 123.51 3hrr s LYS 1307Ca 0.62 2.13 -0.18 0.00 -1.36 0.00 0.00 55.97 57.19 3hrr s LYS 1307Cb -0.32 -3.50 -0.07 0.00 -1.68 0.00 0.00 37.83 32.27 3hrr s LYS 1307CO 0.27 -0.61 1.02 0.95 -0.76 0.00 0.00 175.35 176.23 3hrr s THR 1308N 2.16 4.05 0.12 2.17 -4.23 -1.26 -4.97 115.64 113.69 3hrr s THR 1308Ca 0.68 1.11 0.01 0.00 -1.18 0.00 0.00 61.69 62.31 3hrr s THR 1308Cb -0.36 -3.51 -0.00 0.00 1.34 0.00 0.00 72.50 69.97 3hrr s THR 1308CO 0.29 -0.44 0.15 0.35 -0.54 0.00 0.00 174.62 174.43 3hrr n THR 1309N -1.39 0.00 -0.06 3.99 -2.24 0.55 -4.97 114.28 110.15 3hrr n THR 1309Ca 0.08 -0.73 0.03 0.00 -2.27 0.00 0.00 64.05 61.15 3hrr n THR 1309Cb 0.53 0.41 0.36 0.00 -2.10 0.00 0.00 70.33 69.54 3hrr n THR 1309CO 0.00 0.00 0.00 0.74 -0.57 0.00 0.00 175.07 175.24 3hrr h THR 1310N 1.37 1.14 -0.18 4.28 2.02 -1.72 -3.11 112.91 116.71 3hrr h THR 1310Ca -0.09 -0.29 0.00 0.00 0.77 0.00 0.00 66.41 66.80 3hrr h THR 1310Cb 0.43 0.41 0.00 0.00 -1.74 0.00 0.00 68.15 67.25 3hrr h THR 1310CO 0.13 0.14 0.00 0.35 0.37 0.00 0.00 175.52 176.51 3hrr n THR 1311N -4.44 0.36 -3.64 3.16 -2.24 -1.26 -4.68 114.28 101.54 3hrr n THR 1311Ca 0.04 -0.68 -0.25 0.00 -2.27 0.00 0.00 64.05 60.90 3hrr n THR 1311Cb 0.07 1.02 -0.17 0.00 -2.10 0.00 0.00 70.33 69.15 3hrr n THR 1311CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 3hrr s LEU 1312N -1.16 0.36 -0.26 3.22 0.20 -1.17 -4.76 118.68 115.10 3hrr s LEU 1312Ca 0.22 -0.45 -0.02 0.00 0.69 0.00 0.00 54.13 54.57 3hrr s LEU 1312Cb 0.14 -0.25 -0.16 0.00 -0.43 0.00 0.00 46.19 45.49 3hrr s LEU 1312CO 0.20 -0.32 -0.26 1.41 -0.29 0.00 0.00 176.35 177.09 3hrr n HIS 1313N 5.27 0.00 -3.70 5.38 8.25 -0.16 -0.33 115.22 129.92 3hrr n HIS 1313Ca -0.06 0.00 -0.10 0.00 -0.26 0.00 0.00 57.72 57.29 3hrr n HIS 1313Cb 0.49 -1.00 -0.06 0.00 1.12 0.00 0.00 29.99 30.55 3hrr n HIS 1313CO 0.00 0.00 0.00 -0.98 0.64 0.00 0.00 176.34 176.00 3hrr s ARG 1314N -2.52 0.98 -0.21 -0.41 1.70 -0.97 -4.86 118.95 112.67 3hrr s ARG 1314Ca -0.36 -0.72 -0.19 0.00 -0.47 0.00 0.00 55.73 53.98 3hrr s ARG 1314Cb 0.10 0.43 -0.03 0.00 -0.57 0.00 0.00 34.95 34.88 3hrr s ARG 1314CO 0.57 -0.36 0.57 0.08 -1.08 0.00 0.00 175.30 175.08 3hrr s VAL 1315N -3.62 5.06 -0.04 4.99 1.01 -1.26 -0.56 120.40 125.98 3hrr s VAL 1315Ca 0.02 1.05 -0.11 0.00 0.00 0.00 0.00 61.98 62.95 3hrr s VAL 1315Cb 0.02 -3.89 -0.31 0.00 0.00 0.00 0.00 36.38 32.21 3hrr s VAL 1315CO -0.10 0.14 0.69 0.58 0.00 0.00 0.00 175.10 176.40 3hrr h VAL 1316N 5.18 0.96 -2.34 2.92 2.07 -0.20 -3.48 116.25 121.36 3hrr h VAL 1316Ca -0.32 -2.53 -0.07 0.00 0.82 0.00 0.00 66.70 64.60 3hrr h VAL 1316Cb 1.15 2.77 -0.23 0.00 -1.52 0.00 0.00 31.29 33.46 3hrr h VAL 1316CO 0.75 0.86 -0.06 -0.70 0.02 0.00 0.00 177.57 178.44 3hrr s GLU 1317N -2.58 0.64 -0.27 1.57 2.12 -0.87 -4.98 118.70 114.34 3hrr s GLU 1317Ca -0.15 0.85 -0.02 0.00 0.36 0.00 0.00 54.97 56.01 3hrr s GLU 1317Cb 0.05 0.26 0.12 0.00 0.26 0.00 0.00 34.13 34.83 3hrr s GLU 1317CO 0.86 -0.10 0.25 -2.00 -0.54 0.00 0.00 175.26 173.73 3hrr s GLU 1318N 0.60 0.27 -0.08 4.30 2.12 -1.26 -0.36 118.70 124.29 3hrr s GLU 1318Ca -0.02 -0.12 0.03 0.00 0.36 0.00 0.00 54.97 55.22 3hrr s GLU 1318Cb -0.05 -0.86 0.01 0.00 0.26 0.00 0.00 34.13 33.49 3hrr s GLU 1318CO -0.03 -0.94 -0.17 0.95 -0.54 0.00 0.00 175.26 174.52 3hrr s THR 1319N 2.31 1.55 -0.04 -1.70 -4.23 -0.55 -5.02 115.64 107.96 3hrr s THR 1319Ca 0.09 -0.72 -0.03 0.00 -1.18 0.00 0.00 61.69 59.85 3hrr s THR 1319Cb -0.15 -1.37 -0.04 0.00 1.34 0.00 0.00 72.50 72.28 3hrr s THR 1319CO -0.29 0.45 0.11 -0.89 -0.54 0.00 0.00 174.62 173.46 3hrr s THR 1320N 0.54 5.02 0.09 3.99 2.01 -1.26 -1.35 115.64 124.68 3hrr s THR 1320Ca -0.16 -0.19 0.01 0.00 0.31 0.00 0.00 61.69 61.66 3hrr s THR 1320Cb -0.17 -3.26 -0.00 0.00 0.01 0.00 0.00 72.50 69.08 3hrr s THR 1320CO 0.06 0.44 0.04 2.29 -0.69 0.00 0.00 174.62 176.75 3hrr n LYS 1321N 1.44 0.80 0.09 4.92 2.85 0.27 -4.99 118.16 123.54 3hrr n LYS 1321Ca -0.15 -0.78 -0.11 0.00 -1.05 0.00 0.00 58.31 56.22 3hrr n LYS 1321Cb 0.53 0.44 -0.07 0.00 -0.65 0.00 0.00 35.03 35.28 3hrr n LYS 1321CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 177.40 176.35 3hrr h PRO 1322N 0.00 0.19 -0.45 -1.58 0.13 -2.00 -3.34 132.00 124.95 3hrr h PRO 1322Ca -0.07 -0.26 0.00 0.00 -0.87 0.00 0.00 66.00 64.80 3hrr h PRO 1322Cb 0.28 0.09 0.00 0.00 0.13 0.00 0.00 31.00 31.49 3hrr h PRO 1322CO 0.11 1.05 0.00 1.28 -0.23 0.00 0.00 178.00 180.22 3hrr n LEU 1323N -3.56 4.54 0.00 1.56 4.77 -1.26 -4.58 117.00 118.47 3hrr n LEU 1323Ca -0.05 -2.76 0.00 0.00 -0.03 0.00 0.00 56.01 53.18 3hrr n LEU 1323Cb 0.90 -0.56 0.00 0.00 -2.33 0.00 0.00 43.42 41.43 3hrr n LEU 1323CO 0.50 0.70 0.00 0.61 -1.33 0.00 0.00 177.39 177.87 3hrr n GLY 1324N 0.31 -1.81 3.31 -0.72 0.00 -1.26 -2.13 105.19 102.90 3hrr n GLY 1324Ca 0.23 -1.20 -0.14 0.00 0.00 0.00 0.00 46.02 44.91 3hrr n GLY 1324CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hrr s ALA 1325N -1.35 -1.04 -0.07 4.61 0.00 -0.21 -0.56 121.76 123.13 3hrr s ALA 1325Ca 0.00 0.56 0.03 0.00 0.00 0.00 0.00 51.96 52.55 3hrr s ALA 1325Cb 0.00 0.08 0.01 0.00 0.00 0.00 0.00 23.12 23.21 3hrr s ALA 1325CO 0.00 -0.31 -0.16 0.99 0.00 0.00 0.00 175.76 176.29 3hrr s THR 1326N -1.41 1.40 -0.13 0.00 2.01 -0.45 -0.37 115.64 116.69 3hrr s THR 1326Ca -0.12 -0.64 -0.00 0.00 0.31 0.00 0.00 61.69 61.24 3hrr s THR 1326Cb -0.03 -1.25 0.02 0.00 0.01 0.00 0.00 72.50 71.25 3hrr s THR 1326CO 0.05 0.41 -0.10 -0.22 -0.69 0.00 0.00 174.62 174.08 3hrr s LEU 1327N 0.54 1.38 -0.19 4.42 2.96 0.68 -1.48 118.68 126.99 3hrr s LEU 1327Ca -0.15 -0.39 -0.01 0.00 -0.22 0.00 0.00 54.13 53.36 3hrr s LEU 1327Cb -0.16 -0.96 -0.00 0.00 0.50 0.00 0.00 46.19 45.57 3hrr s LEU 1327CO 0.05 -0.10 -0.11 -0.69 -1.32 0.00 0.00 176.35 174.18 3hrr s VAL 1328N 1.63 2.88 0.34 1.68 1.01 0.51 -0.26 120.40 128.20 3hrr s VAL 1328Ca 0.05 -0.67 0.09 0.00 0.00 0.00 0.00 61.98 61.45 3hrr s VAL 1328Cb -0.13 -2.26 -0.06 0.00 0.00 0.00 0.00 36.38 33.93 3hrr s VAL 1328CO -0.09 0.48 -0.02 0.68 0.00 0.00 0.00 175.10 176.15 3hrr s VAL 1329N 1.19 2.53 0.00 2.92 -7.23 -0.22 0.56 120.40 120.14 3hrr s VAL 1329Ca 0.02 -2.04 0.01 0.00 -1.81 0.00 0.00 61.98 58.15 3hrr s VAL 1329Cb -0.14 -2.75 -0.01 0.00 0.56 0.00 0.00 36.38 34.05 3hrr s VAL 1329CO -0.04 -0.21 -0.03 -0.70 -0.31 0.00 0.00 175.10 173.81 3hrr s GLU 1330N -3.68 0.28 -0.12 4.82 2.12 0.27 -1.36 118.70 121.03 3hrr s GLU 1330Ca 0.34 -0.22 -0.01 0.00 0.36 0.00 0.00 54.97 55.44 3hrr s GLU 1330Cb 0.00 -0.21 0.04 0.00 0.26 0.00 0.00 34.13 34.22 3hrr s GLU 1330CO 0.18 0.05 -0.01 0.99 -0.54 0.00 0.00 175.26 175.94 3hrr s THR 1331N -0.33 0.60 -0.67 -1.70 2.01 0.31 -0.99 115.64 114.87 3hrr s THR 1331Ca -0.02 -0.21 -0.26 0.00 0.31 0.00 0.00 61.69 61.52 3hrr s THR 1331Cb -0.03 -0.83 0.04 0.00 0.01 0.00 0.00 72.50 71.69 3hrr s THR 1331CO -0.00 0.14 1.15 -0.62 -0.69 0.00 0.00 174.62 174.60 3hrr s ASP 1332N 1.86 6.23 0.00 3.53 -1.08 -1.26 -0.67 116.67 125.28 3hrr s ASP 1332Ca 0.03 -0.48 0.18 0.00 -0.52 0.00 0.00 52.55 51.76 3hrr s ASP 1332Cb -0.14 -2.51 0.84 0.00 -1.46 0.00 0.00 42.92 39.65 3hrr s ASP 1332CO -0.07 -1.61 1.57 2.30 0.52 0.00 0.00 175.17 177.88 3hrr n ILE 1333N 6.29 0.63 0.84 4.11 -5.35 -0.44 -0.90 119.36 124.54 3hrr n ILE 1333Ca 0.02 0.16 0.13 0.00 -0.27 0.00 0.00 62.75 62.79 3hrr n ILE 1333Cb 0.48 -0.85 0.40 0.00 -1.74 0.00 0.00 39.64 37.93 3hrr n ILE 1333CO 0.00 0.00 0.00 -1.20 -1.76 0.00 0.00 176.55 173.59 3hrr n SER 1334N -1.41 0.42 -4.77 7.28 7.64 -1.26 -3.52 113.62 118.00 3hrr n SER 1334Ca 0.06 0.26 -0.41 0.00 1.01 0.00 0.00 58.87 59.79 3hrr n SER 1334Cb 0.18 -0.25 -0.00 0.00 -1.01 0.00 0.00 64.21 63.13 3hrr n SER 1334CO 0.00 0.00 0.00 -1.14 -3.01 0.00 0.00 175.04 170.89 3hrr n ARG 1335N -1.77 2.64 0.26 1.43 0.63 -0.08 -4.67 116.66 115.10 3hrr n ARG 1335Ca 0.06 0.93 0.09 0.00 -0.92 0.00 0.00 57.85 58.00 3hrr n ARG 1335Cb 0.38 -2.65 0.68 0.00 0.45 0.00 0.00 32.46 31.31 3hrr n ARG 1335CO 0.00 0.00 0.00 -0.22 -2.51 0.00 0.00 177.63 174.90 3hrr h LYS 1336N 3.07 0.00 0.00 -0.14 3.64 -1.91 -0.84 116.57 120.40 3hrr h LYS 1336Ca -0.50 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.88 3hrr h LYS 1336Cb 1.24 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.06 3hrr h LYS 1336CO 0.65 0.01 0.00 0.38 -2.27 0.00 0.00 179.45 178.22 3hrr h ASP 1337N 0.00 0.00 0.00 4.20 2.03 -1.96 -3.36 116.42 117.33 3hrr h ASP 1337Ca -0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 3hrr h ASP 1337Cb 0.02 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.52 3hrr h ASP 1337CO 0.00 0.00 -0.81 0.55 -1.03 0.00 0.00 179.24 177.95 3hrr n VAL 1338N -3.02 0.00 -0.19 4.15 3.14 -0.44 -4.76 118.33 117.21 3hrr n VAL 1338Ca 0.02 -0.20 -0.08 0.00 -2.96 0.00 0.00 64.34 61.12 3hrr n VAL 1338Cb 0.40 0.62 0.02 0.00 -1.06 0.00 0.00 33.84 33.82 3hrr n VAL 1338CO 0.00 0.00 0.00 -1.13 -6.46 0.00 0.00 176.83 169.24 3hrr h ASN 1339N 0.00 0.76 -0.40 6.55 -1.24 -1.27 0.12 115.58 120.10 3hrr h ASN 1339Ca 0.00 -0.19 0.07 0.00 0.71 0.00 0.00 56.30 56.89 3hrr h ASN 1339Cb 0.14 -0.20 -0.06 0.00 0.73 0.00 0.00 38.32 38.93 3hrr h ASN 1339CO 0.00 0.74 0.02 1.23 -1.29 0.00 0.00 177.43 178.13 3hrr h GLY 1340N 0.73 0.42 1.70 1.57 0.00 -1.86 -2.53 103.07 103.10 3hrr h GLY 1340Ca 0.18 0.03 -0.11 0.00 0.00 0.00 0.00 47.33 47.42 3hrr h GLY 1340CO -0.01 -0.08 -0.40 -2.00 0.00 0.00 0.00 176.54 174.05 3hrr h LEU 1341N 0.13 0.35 -1.83 3.11 5.85 -1.70 -2.45 115.31 118.77 3hrr h LEU 1341Ca 0.19 -0.15 -0.03 0.00 0.84 0.00 0.00 57.88 58.74 3hrr h LEU 1341Cb 0.26 -0.10 -0.00 0.00 0.37 0.00 0.00 40.66 41.19 3hrr h LEU 1341CO -0.30 0.72 -0.14 0.00 -0.34 0.00 0.00 178.44 178.37 3hrr h ALA 1342N 1.30 1.38 -1.20 1.25 0.00 -0.38 -3.30 119.26 118.30 3hrr h ALA 1342Ca 0.03 -0.13 -0.76 0.00 0.00 0.00 0.00 54.91 54.05 3hrr h ALA 1342Cb 0.82 -0.02 -0.17 0.00 0.00 0.00 0.00 17.79 18.42 3hrr h ALA 1342CO 0.07 0.18 1.74 0.54 0.00 0.00 0.00 179.25 181.78 3hrr n ARG 1343N -3.81 3.62 0.01 0.00 1.74 -0.92 -3.17 116.66 114.13 3hrr n ARG 1343Ca -0.02 -3.70 -0.18 0.00 -0.77 0.00 0.00 57.85 53.18 3hrr n ARG 1343Cb 0.25 -2.91 -0.11 0.00 -1.02 0.00 0.00 32.46 28.66 3hrr n ARG 1343CO 0.00 0.00 0.00 0.78 -1.52 0.00 0.00 177.63 176.89 3hrr h GLY 1344N 8.11 0.45 -2.47 -0.13 0.00 -1.50 -3.39 103.07 104.15 3hrr h GLY 1344Ca 0.36 -0.81 -0.53 0.00 0.00 0.00 0.00 47.33 46.34 3hrr h GLY 1344CO 1.50 0.72 -0.75 0.30 0.00 0.00 0.00 176.54 178.31 3hrr s HIS 1345N -3.14 2.00 -0.07 5.60 3.76 -1.10 -1.36 115.29 120.98 3hrr s HIS 1345Ca -0.13 -0.45 -0.01 0.00 -0.15 0.00 0.00 55.06 54.32 3hrr s HIS 1345Cb 0.03 -0.90 0.03 0.00 1.11 0.00 0.00 32.58 32.85 3hrr s HIS 1345CO 0.82 0.52 0.00 -1.17 -0.85 0.00 0.00 174.74 174.07 3hrr s LEU 1346N -3.34 0.60 -0.16 0.89 2.96 0.76 -1.31 118.68 119.09 3hrr s LEU 1346Ca 0.25 -0.09 0.00 0.00 -0.22 0.00 0.00 54.13 54.08 3hrr s LEU 1346Cb -0.03 -0.45 0.02 0.00 0.50 0.00 0.00 46.19 46.23 3hrr s LEU 1346CO 0.11 -0.19 -0.15 -0.69 -1.32 0.00 0.00 176.35 174.11 3hrr s VAL 1347N 1.96 1.66 -1.46 1.68 1.01 -0.64 -0.72 120.40 123.88 3hrr s VAL 1347Ca 0.05 -0.71 -0.10 0.00 0.00 0.00 0.00 61.98 61.22 3hrr s VAL 1347Cb -0.12 -1.56 0.06 0.00 0.00 0.00 0.00 36.38 34.76 3hrr s VAL 1347CO -0.05 0.45 0.91 0.47 0.00 0.00 0.00 175.10 176.88 3hrr n ASP 1348N 4.74 -3.81 0.00 3.32 8.00 -1.26 -0.98 116.55 126.56 3hrr n ASP 1348Ca -0.17 -0.78 0.00 0.00 0.71 0.00 0.00 54.79 54.54 3hrr n ASP 1348Cb 0.50 -3.98 0.00 0.00 -0.02 0.00 0.00 41.12 37.62 3hrr n ASP 1348CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3hrr n GLY 1349N -1.68 0.22 3.55 0.44 0.00 -1.26 -5.00 105.19 101.47 3hrr n GLY 1349Ca -0.06 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.58 3hrr n GLY 1349CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3hrr s ILE 1350N -1.54 5.12 0.49 -0.61 1.01 -0.15 -5.08 121.20 120.43 3hrr s ILE 1350Ca 0.00 0.04 -0.20 0.00 0.00 0.00 0.00 60.65 60.49 3hrr s ILE 1350Cb 0.00 -3.46 -0.08 0.00 0.01 0.00 0.00 42.46 38.93 3hrr s ILE 1350CO 0.00 0.22 1.05 -2.16 0.00 0.00 0.00 174.94 174.06 3hrr s PRO 1351N 1.73 3.75 -0.02 2.79 0.04 -1.26 -1.61 135.00 140.40 3hrr s PRO 1351Ca 0.07 1.41 0.01 0.00 0.04 0.00 0.00 61.00 62.52 3hrr s PRO 1351Cb -0.16 -2.10 0.02 0.00 0.04 0.00 0.00 34.50 32.30 3hrr s PRO 1351CO 0.10 -0.48 -0.00 -0.51 0.04 0.00 0.00 177.00 176.14 3hrr s LEU 1352N -3.49 1.34 0.19 -3.56 1.43 -0.43 -4.06 118.68 110.11 3hrr s LEU 1352Ca 0.68 -0.03 -0.30 0.00 -1.03 0.00 0.00 54.13 53.45 3hrr s LEU 1352Cb -0.18 -0.20 -0.08 0.00 0.03 0.00 0.00 46.19 45.76 3hrr s LEU 1352CO 0.21 -0.07 1.26 0.00 0.23 0.00 0.00 176.35 177.99 3hrr s THR 1354N 0.03 4.87 0.47 0.00 -4.23 -1.26 -4.64 115.64 110.88 3hrr s THR 1354Ca 0.55 0.44 0.23 0.00 -1.18 0.00 0.00 61.69 61.73 3hrr s THR 1354Cb -0.35 -3.72 0.41 0.00 1.34 0.00 0.00 72.50 70.19 3hrr s THR 1354CO 0.38 -0.40 1.89 -0.65 -0.54 0.00 0.00 174.62 175.30 3hrr h PRO 1355N 1.55 0.22 -0.12 3.99 0.11 -1.97 0.12 132.00 135.90 3hrr h PRO 1355Ca -0.47 -0.01 0.04 0.00 0.11 0.00 0.00 66.00 65.66 3hrr h PRO 1355Cb 1.19 -0.05 -0.00 0.00 0.11 0.00 0.00 31.00 32.24 3hrr h PRO 1355CO 0.65 0.14 0.14 0.66 -0.21 0.00 0.00 178.00 179.38 3hrr h SER 1356N 0.22 0.00 0.08 -2.05 4.64 -1.93 -1.12 113.55 113.39 3hrr h SER 1356Ca 0.42 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.74 3hrr h SER 1356Cb 1.30 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.40 3hrr h SER 1356CO -0.10 0.00 -0.04 0.15 -0.87 0.00 0.00 176.83 175.98 3hrr h PHE 1357N 0.00 -0.09 -0.83 4.77 3.57 -1.24 -1.02 116.94 122.09 3hrr h PHE 1357Ca 0.06 -0.00 0.04 0.00 3.53 0.00 0.00 57.97 61.60 3hrr h PHE 1357Cb 0.34 0.03 -0.05 0.00 2.79 0.00 0.00 35.95 39.06 3hrr h PHE 1357CO 0.00 0.21 0.52 1.88 -2.23 0.00 0.00 178.31 178.69 3hrr h TYR 1358N -0.40 0.98 -0.91 0.41 0.05 -1.54 -2.88 116.97 112.68 3hrr h TYR 1358Ca -0.01 0.03 -0.00 0.00 0.05 0.00 0.00 58.73 58.79 3hrr h TYR 1358Cb 0.34 -0.32 -0.04 0.00 1.01 0.00 0.00 36.73 37.72 3hrr h TYR 1358CO 0.02 0.53 0.56 0.00 -1.05 0.00 0.00 178.16 178.22 3hrr h ALA 1359N 1.37 1.16 -0.13 3.88 0.00 -1.00 0.55 119.26 125.10 3hrr h ALA 1359Ca 0.35 -0.10 0.02 0.00 0.00 0.00 0.00 54.91 55.18 3hrr h ALA 1359Cb 0.08 -0.37 -0.02 0.00 0.00 0.00 0.00 17.79 17.48 3hrr h ALA 1359CO -0.14 0.61 0.01 0.22 0.00 0.00 0.00 179.25 179.96 3hrr h ASP 1360N 1.25 -0.01 -0.66 0.00 3.58 -1.00 -0.85 116.42 118.73 3hrr h ASP 1360Ca 0.33 0.02 -0.07 0.00 0.42 0.00 0.00 57.03 57.73 3hrr h ASP 1360Cb -0.06 0.03 -0.03 0.00 1.72 0.00 0.00 39.33 40.99 3hrr h ASP 1360CO -0.06 0.01 0.15 0.40 -2.88 0.00 0.00 179.24 176.86 3hrr h ILE 1361N 0.06 1.26 -0.38 2.25 2.04 -1.22 -1.82 117.51 119.70 3hrr h ILE 1361Ca 0.06 -0.95 0.01 0.00 1.00 0.00 0.00 64.86 64.97 3hrr h ILE 1361Cb 0.06 0.62 -0.02 0.00 -0.74 0.00 0.00 36.82 36.73 3hrr h ILE 1361CO -0.08 0.36 0.23 0.00 0.00 0.00 0.00 178.15 178.66 3hrr h ALA 1362N 1.06 0.47 -0.79 1.87 0.00 -0.68 0.57 119.26 121.76 3hrr h ALA 1362Ca 0.20 -0.02 0.05 0.00 0.00 0.00 0.00 54.91 55.15 3hrr h ALA 1362Cb 0.37 -0.13 -0.05 0.00 0.00 0.00 0.00 17.79 17.98 3hrr h ALA 1362CO 0.00 -0.10 0.49 0.52 0.00 0.00 0.00 179.25 180.17 3hrr h MET 1363N 0.47 0.90 0.04 0.00 2.86 -0.90 0.25 114.93 118.55 3hrr h MET 1363Ca 0.14 -0.05 -0.00 0.00 -2.06 0.00 0.00 59.70 57.73 3hrr h MET 1363Cb -0.02 -0.20 0.00 0.00 0.06 0.00 0.00 31.60 31.44 3hrr h MET 1363CO -0.05 0.59 -0.02 1.96 1.06 0.00 0.00 176.91 180.45 3hrr h GLN 1364N 0.92 -0.05 -0.07 1.72 4.20 -0.46 0.15 115.11 121.53 3hrr h GLN 1364Ca 0.33 0.00 -0.11 0.00 0.06 0.00 0.00 58.65 58.93 3hrr h GLN 1364Cb 0.09 0.01 -0.01 0.00 0.30 0.00 0.00 27.48 27.87 3hrr h GLN 1364CO -0.14 0.21 -0.48 -0.39 -0.67 0.00 0.00 178.83 177.36 3hrr h VAL 1365N -0.31 1.34 0.08 -0.54 -1.51 -0.85 -2.14 116.25 112.33 3hrr h VAL 1365Ca -0.01 -1.68 -0.00 0.00 -1.23 0.00 0.00 66.70 63.78 3hrr h VAL 1365Cb 0.28 1.82 0.00 0.00 -2.13 0.00 0.00 31.29 31.27 3hrr h VAL 1365CO 0.01 0.49 -0.04 1.23 -1.23 0.00 0.00 177.57 178.03 3hrr h GLY 1366N 1.36 -0.11 0.71 5.19 0.00 -0.94 -1.02 103.07 108.26 3hrr h GLY 1366Ca 0.01 0.04 0.06 0.00 0.00 0.00 0.00 47.33 47.44 3hrr h GLY 1366CO 0.07 -0.04 0.44 1.46 0.00 0.00 0.00 176.54 178.47 3hrr h GLN 1367N -0.40 0.79 0.20 4.80 4.20 -0.95 0.63 115.11 124.38 3hrr h GLN 1367Ca -0.01 -0.05 -0.01 0.00 0.06 0.00 0.00 58.65 58.64 3hrr h GLN 1367Cb 0.34 -0.18 0.00 0.00 0.30 0.00 0.00 27.48 27.94 3hrr h GLN 1367CO 0.02 0.52 -0.10 -0.92 -0.67 0.00 0.00 178.83 177.69 3hrr h TYR 1368N 0.82 -0.25 -0.49 2.96 3.20 -1.41 -1.50 116.97 120.30 3hrr h TYR 1368Ca 0.33 -0.01 0.09 0.00 3.14 0.00 0.00 58.73 62.28 3hrr h TYR 1368Cb 0.17 0.08 -0.07 0.00 1.54 0.00 0.00 36.73 38.45 3hrr h TYR 1368CO -0.06 0.00 0.07 0.77 -1.64 0.00 0.00 178.16 177.31 3hrr h SER 1369N -0.48 -0.06 -0.72 -2.11 0.02 -0.96 0.54 113.55 109.79 3hrr h SER 1369Ca -0.03 0.10 -0.07 0.00 -0.84 0.00 0.00 61.79 60.95 3hrr h SER 1369Cb 0.36 0.14 -0.03 0.00 0.14 0.00 0.00 62.40 63.02 3hrr h SER 1369CO 0.04 -0.00 0.18 -0.03 -1.14 0.00 0.00 176.83 175.88 3hrr h MET 1370N 0.20 1.15 -0.24 3.45 1.85 -0.79 -1.99 114.93 118.56 3hrr h MET 1370Ca 0.24 -0.27 -0.08 0.00 -0.61 0.00 0.00 59.70 58.98 3hrr h MET 1370Cb 0.34 -0.15 -0.00 0.00 0.43 0.00 0.00 31.60 32.21 3hrr h MET 1370CO -0.34 1.01 -0.18 1.96 -0.40 0.00 0.00 176.91 178.96 3hrr h GLN 1371N 1.09 0.54 -0.19 0.39 4.20 -1.03 -3.12 115.11 117.00 3hrr h GLN 1371Ca 0.23 -0.26 0.06 0.00 0.06 0.00 0.00 58.65 58.73 3hrr h GLN 1371Cb 0.37 -0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.14 3hrr h GLN 1371CO 0.00 0.84 0.14 -0.09 -0.67 0.00 0.00 178.83 179.05 3hrr h ARG 1372N 0.25 0.00 0.00 1.46 2.43 -0.73 -2.87 114.38 114.92 3hrr h ARG 1372Ca 0.05 0.00 -0.13 0.00 -0.81 0.00 0.00 59.98 59.08 3hrr h ARG 1372Cb 0.71 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 30.24 3hrr h ARG 1372CO 0.05 0.00 -1.02 -0.07 -1.51 0.00 0.00 179.97 177.41 3hrr h LEU 1373N 0.00 0.00 0.00 3.80 4.07 -1.34 -3.51 115.31 118.32 3hrr h LEU 1373Ca 0.09 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.05 3hrr h LEU 1373Cb 0.38 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.12 3hrr h LEU 1373CO -0.00 0.51 0.00 0.54 -1.08 0.00 0.00 178.44 178.41 3hrr n ARG 1374N -3.01 0.00 0.00 1.13 1.74 -1.09 -4.53 116.66 110.91 3hrr n ARG 1374Ca -0.04 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.04 3hrr n ARG 1374Cb 0.78 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 32.22 3hrr n ARG 1374CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3hrr n GLY 1385N 4.93 4.06 3.78 -0.13 0.00 -1.26 -5.05 105.19 111.51 3hrr n GLY 1385Ca 0.00 -1.13 -0.38 0.00 0.00 0.00 0.00 46.02 44.50 3hrr n GLY 1385CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3hrr s LEU 1386N 0.00 4.42 -0.19 0.99 1.43 -1.26 -4.99 118.68 119.08 3hrr s LEU 1386Ca 0.00 1.04 -0.12 0.00 -1.03 0.00 0.00 54.13 54.02 3hrr s LEU 1386Cb 0.00 -2.77 -0.05 0.00 0.03 0.00 0.00 46.19 43.40 3hrr s LEU 1386CO 0.00 0.17 0.21 -0.69 0.23 0.00 0.00 176.35 176.26 3hrr s VAL 1387N -0.37 5.36 -0.21 -1.59 1.01 -1.26 -1.37 120.40 121.97 3hrr s VAL 1387Ca 0.27 0.36 -0.05 0.00 0.00 0.00 0.00 61.98 62.56 3hrr s VAL 1387Cb -0.17 -3.55 -0.02 0.00 0.00 0.00 0.00 36.38 32.64 3hrr s VAL 1387CO 0.15 0.41 -0.00 -0.62 0.00 0.00 0.00 175.10 175.03 3hrr s ASP 1388N 0.46 4.76 -0.79 3.32 -1.08 0.80 -4.57 116.67 119.57 3hrr s ASP 1388Ca 0.12 -0.23 -0.23 0.00 -0.52 0.00 0.00 52.55 51.68 3hrr s ASP 1388Cb -0.12 -1.82 0.07 0.00 -1.46 0.00 0.00 42.92 39.59 3hrr s ASP 1388CO 0.01 0.04 1.16 -0.69 0.52 0.00 0.00 175.17 176.21 3hrr s VAL 1389N 1.13 4.15 0.35 1.11 1.01 -0.44 -1.02 120.40 126.69 3hrr s VAL 1389Ca 0.03 -0.41 0.08 0.00 0.00 0.00 0.00 61.98 61.68 3hrr s VAL 1389Cb -0.14 -4.83 -0.04 0.00 0.00 0.00 0.00 36.38 31.36 3hrr s VAL 1389CO 0.01 -1.66 0.16 -0.94 0.00 0.00 0.00 175.10 172.68 3hrr s SER 1390N 3.91 4.70 -1.49 3.32 1.04 -0.30 -2.25 113.70 122.63 3hrr s SER 1390Ca 0.31 -0.79 -0.09 0.00 0.48 0.00 0.00 55.95 55.86 3hrr s SER 1390Cb -0.10 -0.70 0.06 0.00 0.10 0.00 0.00 66.02 65.39 3hrr s SER 1390CO 0.05 -0.35 0.80 0.47 0.98 0.00 0.00 173.24 175.20 3hrr n ASP 1391N -1.19 -3.05 -4.69 7.02 8.00 -0.28 -0.58 116.55 121.78 3hrr n ASP 1391Ca -0.02 -0.86 -0.42 0.00 0.71 0.00 0.00 54.79 54.20 3hrr n ASP 1391Cb 0.62 -3.63 -0.03 0.00 -0.02 0.00 0.00 41.12 38.05 3hrr n ASP 1391CO 0.00 0.00 0.00 -0.32 -0.39 0.00 0.00 177.20 176.49 3hrr s MET 1392N -6.51 4.43 -0.13 -1.24 -2.45 -0.28 -4.09 119.30 109.04 3hrr s MET 1392Ca 0.42 1.50 -0.00 0.00 -1.25 0.00 0.00 55.69 56.35 3hrr s MET 1392Cb -0.21 -3.51 0.02 0.00 1.25 0.00 0.00 34.83 32.37 3hrr s MET 1392CO 0.85 -0.29 -0.10 0.08 1.05 0.00 0.00 175.02 176.61 3hrr s VAL 1393N 1.79 1.24 -0.38 10.11 1.01 -0.03 -2.13 120.40 132.01 3hrr s VAL 1393Ca 0.52 -0.42 -0.12 0.00 0.00 0.00 0.00 61.98 61.95 3hrr s VAL 1393Cb -0.21 -1.21 0.02 0.00 0.00 0.00 0.00 36.38 34.97 3hrr s VAL 1393CO 0.22 0.40 0.24 -0.69 0.00 0.00 0.00 175.10 175.27 3hrr s VAL 1394N 1.60 4.89 -0.21 2.92 1.01 -0.58 -1.65 120.40 128.38 3hrr s VAL 1394Ca 0.05 -0.67 -0.07 0.00 0.00 0.00 0.00 61.98 61.29 3hrr s VAL 1394Cb -0.13 -3.68 -0.19 0.00 0.00 0.00 0.00 36.38 32.38 3hrr s VAL 1394CO -0.09 -0.20 -0.01 -0.67 0.00 0.00 0.00 175.10 174.13 3hrr n ASP 1395N 5.06 2.00 -3.92 3.32 2.03 0.91 -4.89 116.55 121.07 3hrr n ASP 1395Ca -0.12 0.14 -0.17 0.00 0.52 0.00 0.00 54.79 55.16 3hrr n ASP 1395Cb 0.47 -0.71 -0.15 0.00 -0.72 0.00 0.00 41.12 40.02 3hrr n ASP 1395CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 3hrr s LYS 1396N -2.51 0.47 0.36 -0.67 1.02 -0.82 -5.06 119.74 112.53 3hrr s LYS 1396Ca -0.31 -0.13 -0.26 0.00 0.02 0.00 0.00 55.97 55.29 3hrr s LYS 1396Cb 0.09 -0.49 -0.12 0.00 -0.52 0.00 0.00 37.83 36.79 3hrr s LYS 1396CO 0.63 0.04 0.94 0.00 -0.92 0.00 0.00 175.35 176.04 3hrr n ALA 1397N 3.33 -0.27 -3.82 5.17 0.00 -1.26 -4.65 120.51 119.00 3hrr n ALA 1397Ca -0.17 0.29 -0.34 0.00 0.00 0.00 0.00 53.44 53.22 3hrr n ALA 1397Cb 0.56 -2.00 -0.15 0.00 0.00 0.00 0.00 19.45 17.85 3hrr n ALA 1397CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 3hrr s LEU 1398N 0.28 2.67 -0.43 0.00 2.96 -1.26 -5.00 118.68 117.89 3hrr s LEU 1398Ca 0.61 -0.63 -0.10 0.00 -0.22 0.00 0.00 54.13 53.79 3hrr s LEU 1398Cb -0.63 -1.61 0.08 0.00 0.50 0.00 0.00 46.19 44.53 3hrr s LEU 1398CO 0.58 -0.04 0.29 -0.69 -1.32 0.00 0.00 176.35 175.17 3hrr s VAL 1399N 1.36 4.42 -0.69 1.68 1.01 -1.26 -0.92 120.40 126.00 3hrr s VAL 1399Ca 0.04 -1.35 -0.27 0.00 0.00 0.00 0.00 61.98 60.40 3hrr s VAL 1399Cb -0.14 -3.70 0.01 0.00 0.00 0.00 0.00 36.38 32.55 3hrr s VAL 1399CO -0.08 -0.53 1.47 -2.84 0.00 0.00 0.00 175.10 173.12 3hrr s PRO 1400N 1.46 3.02 0.30 2.72 0.02 -1.26 -4.85 135.00 136.40 3hrr s PRO 1400Ca 0.03 0.06 0.10 0.00 0.02 0.00 0.00 61.00 61.21 3hrr s PRO 1400Cb -0.23 -4.24 0.45 0.00 0.02 0.00 0.00 34.50 30.49 3hrr s PRO 1400CO 0.03 -2.33 1.67 1.12 -0.33 0.00 0.00 177.00 177.16 3hrr h HIS 1401N 11.64 0.07 -0.22 6.54 2.07 -1.95 -3.47 115.15 129.84 3hrr h HIS 1401Ca -0.27 -0.02 -0.09 0.00 -2.85 0.00 0.00 60.37 57.13 3hrr h HIS 1401Cb 1.09 -0.01 -0.04 0.00 2.57 0.00 0.00 27.41 31.02 3hrr h HIS 1401CO 1.10 0.58 -0.08 0.41 -3.07 0.00 0.00 177.93 176.86 3hrr n GLY 1402N 0.01 0.73 2.95 6.13 0.00 -1.26 -4.98 105.19 108.78 3hrr n GLY 1402Ca -0.02 -0.64 -0.30 0.00 0.00 0.00 0.00 46.02 45.06 3hrr n GLY 1402CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hrr s LYS 1403N -2.09 2.63 0.00 1.61 1.02 -1.26 -5.03 119.74 116.61 3hrr s LYS 1403Ca 0.00 -3.28 0.00 0.00 0.02 0.00 0.00 55.97 52.71 3hrr s LYS 1403Cb 0.00 -3.55 0.00 0.00 -0.52 0.00 0.00 37.83 33.76 3hrr s LYS 1403CO 0.00 -1.27 0.00 0.41 -0.92 0.00 0.00 175.35 173.57 3hrr n GLY 1404N 2.14 -1.08 3.72 -3.33 0.00 -1.26 -4.93 105.19 100.45 3hrr n GLY 1404Ca 0.19 -1.63 -0.40 0.00 0.00 0.00 0.00 46.02 44.17 3hrr n GLY 1404CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3hrr n PRO 1405N -1.28 2.01 -3.64 1.61 -0.02 -1.26 -4.72 135.00 127.71 3hrr n PRO 1405Ca 0.00 0.72 -0.29 0.00 -2.02 0.00 0.00 63.50 61.91 3hrr n PRO 1405Cb 0.00 -2.47 -0.16 0.00 -0.02 0.00 0.00 33.50 30.85 3hrr n PRO 1405CO 0.00 0.00 0.00 -1.14 1.98 0.00 0.00 175.50 176.34 3hrr s GLN 1406N -2.33 0.40 -0.45 -0.52 0.74 -1.26 -4.97 119.66 111.28 3hrr s GLN 1406Ca 0.62 -0.60 -0.18 0.00 0.05 0.00 0.00 55.36 55.25 3hrr s GLN 1406Cb -0.48 -1.66 0.03 0.00 1.10 0.00 0.00 33.01 32.00 3hrr s GLN 1406CO 0.57 -0.89 0.51 -0.51 -0.55 0.00 0.00 175.29 174.42 3hrr s LEU 1407N 1.93 4.87 -0.33 3.68 1.43 -1.03 -1.32 118.68 127.90 3hrr s LEU 1407Ca 0.06 -0.71 -0.24 0.00 -1.03 0.00 0.00 54.13 52.21 3hrr s LEU 1407Cb -0.17 -2.45 0.01 0.00 0.03 0.00 0.00 46.19 43.61 3hrr s LEU 1407CO -0.24 -0.69 0.82 -0.22 0.23 0.00 0.00 176.35 176.25 3hrr s LEU 1408N 2.33 4.08 -0.21 1.79 2.96 0.15 0.13 118.68 129.91 3hrr s LEU 1408Ca 0.14 0.57 -0.10 0.00 -0.22 0.00 0.00 54.13 54.52 3hrr s LEU 1408Cb -0.17 -3.10 -0.05 0.00 0.50 0.00 0.00 46.19 43.36 3hrr s LEU 1408CO 0.14 -0.70 0.14 -0.13 -1.32 0.00 0.00 176.35 174.48 3hrr s ARG 1409N 3.10 4.16 -0.23 1.98 0.52 0.12 -0.53 118.95 128.08 3hrr s ARG 1409Ca 0.33 -0.23 -0.04 0.00 -0.52 0.00 0.00 55.73 55.28 3hrr s ARG 1409Cb -0.13 -3.45 -0.00 0.00 0.52 0.00 0.00 34.95 31.88 3hrr s ARG 1409CO 0.15 0.24 -0.04 0.99 0.02 0.00 0.00 175.30 176.66 3hrr s THR 1410N 0.53 3.31 -0.23 0.02 2.01 -0.46 -1.47 115.64 119.35 3hrr s THR 1410Ca 0.08 -0.57 -0.05 0.00 0.31 0.00 0.00 61.69 61.46 3hrr s THR 1410Cb -0.12 -2.53 -0.02 0.00 0.01 0.00 0.00 72.50 69.85 3hrr s THR 1410CO -0.00 0.39 -0.01 -0.89 -0.69 0.00 0.00 174.62 173.42 3hrr s THR 1411N 1.46 3.71 -0.15 -0.82 2.01 -0.14 -1.06 115.64 120.64 3hrr s THR 1411Ca 0.05 -0.38 -0.03 0.00 0.31 0.00 0.00 61.69 61.64 3hrr s THR 1411Cb -0.15 -2.70 -0.02 0.00 0.01 0.00 0.00 72.50 69.64 3hrr s THR 1411CO -0.03 0.40 -0.05 -0.22 -0.69 0.00 0.00 174.62 174.02 3hrr s LEU 1412N 1.47 3.13 -0.03 4.42 0.20 0.64 -1.14 118.68 127.38 3hrr s LEU 1412Ca 0.06 -0.18 0.05 0.00 0.69 0.00 0.00 54.13 54.75 3hrr s LEU 1412Cb -0.15 -1.75 -0.01 0.00 -0.43 0.00 0.00 46.19 43.85 3hrr s LEU 1412CO -0.01 0.16 -0.20 0.42 -0.29 0.00 0.00 176.35 176.43 3hrr s THR 1413N 0.43 1.58 0.08 3.68 -4.23 0.06 -0.23 115.64 117.00 3hrr s THR 1413Ca -0.05 -0.83 0.06 0.00 -1.18 0.00 0.00 61.69 59.70 3hrr s THR 1413Cb -0.15 -1.33 -0.03 0.00 1.34 0.00 0.00 72.50 72.34 3hrr s THR 1413CO 0.03 0.45 -0.17 -0.04 -0.54 0.00 0.00 174.62 174.35 3hrr s MET 1414N -0.25 0.99 0.05 3.99 -1.94 0.50 -1.81 119.30 120.82 3hrr s MET 1414Ca 0.02 -1.02 0.03 0.00 -1.71 0.00 0.00 55.69 53.02 3hrr s MET 1414Cb -0.10 -1.11 -0.02 0.00 2.01 0.00 0.00 34.83 35.61 3hrr s MET 1414CO 0.01 0.26 -0.10 -1.21 -0.01 0.00 0.00 175.02 173.96 3hrr s GLU 1415N -1.70 0.64 0.19 2.03 2.02 -1.26 -1.05 118.70 119.56 3hrr s GLU 1415Ca 0.02 -0.79 -0.21 0.00 0.02 0.00 0.00 54.97 54.01 3hrr s GLU 1415Cb -0.10 -0.50 0.05 0.00 0.10 0.00 0.00 34.13 33.68 3hrr s GLU 1415CO 0.03 0.11 0.60 1.67 0.02 0.00 0.00 175.26 177.68 3hrr s TRP 1416N -1.25 -0.39 0.67 1.61 -2.14 -0.91 -4.90 118.94 111.63 3hrr s TRP 1416Ca -0.06 0.10 -0.15 0.00 2.66 0.00 0.00 56.10 58.65 3hrr s TRP 1416Cb -0.09 0.54 0.01 0.00 -3.10 0.00 0.00 33.47 30.82 3hrr s TRP 1416CO 0.01 -0.92 1.12 -2.14 -2.66 0.00 0.00 176.95 172.35 3hrr s PRO 1417N -3.80 2.72 -0.15 3.25 0.02 -1.26 -4.59 135.00 131.18 3hrr s PRO 1417Ca 0.04 1.41 -0.23 0.00 0.02 0.00 0.00 61.00 62.24 3hrr s PRO 1417Cb -0.02 -1.94 -0.02 0.00 0.02 0.00 0.00 34.50 32.54 3hrr s PRO 1417CO -0.08 -1.31 0.72 -1.25 -0.33 0.00 0.00 177.00 174.76 3hrr s PRO 1418N -4.11 4.30 -0.62 5.54 0.04 -1.26 -0.83 135.00 138.06 3hrr s PRO 1418Ca 0.67 0.84 0.06 0.00 0.04 0.00 0.00 61.00 62.61 3hrr s PRO 1418Cb -0.21 -3.54 0.24 0.00 0.04 0.00 0.00 34.50 31.03 3hrr s PRO 1418CO 0.42 -0.19 0.70 0.36 0.04 0.00 0.00 177.00 178.33 3hrr n LYS 1419N 4.78 2.28 -1.03 4.56 2.85 -1.26 -5.06 118.16 125.27 3hrr n LYS 1419Ca 0.01 -4.51 -0.17 0.00 -1.05 0.00 0.00 58.31 52.59 3hrr n LYS 1419Cb 0.50 -2.15 0.18 0.00 -0.65 0.00 0.00 35.03 32.91 3hrr n LYS 1419CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 3hrr n ALA 1420N 1.00 5.01 -0.33 0.58 0.00 -0.01 -4.68 120.51 122.08 3hrr n ALA 1420Ca 0.28 -2.41 0.19 0.00 0.00 0.00 0.00 53.44 51.50 3hrr n ALA 1420Cb 0.42 -1.35 0.36 0.00 0.00 0.00 0.00 19.45 18.88 3hrr n ALA 1420CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3hrr h ALA 1421N 1.49 1.44 0.00 0.00 0.00 -1.94 0.63 119.26 120.89 3hrr h ALA 1421Ca 0.48 0.30 0.00 0.00 0.00 0.00 0.00 54.91 55.69 3hrr h ALA 1421Cb 2.52 0.48 0.00 0.00 0.00 0.00 0.00 17.79 20.79 3hrr h ALA 1421CO 0.89 -0.65 0.00 0.00 0.00 0.00 0.00 179.25 179.50 3hrr n ALA 1422N -2.84 1.45 1.59 0.00 0.00 -1.26 -2.11 120.51 117.33 3hrr n ALA 1422Ca 0.27 0.06 0.15 0.00 0.00 0.00 0.00 53.44 53.91 3hrr n ALA 1422Cb 0.88 -1.27 0.65 0.00 0.00 0.00 0.00 19.45 19.71 3hrr n ALA 1422CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3hrr n THR 1423N -1.92 0.00 -2.35 0.00 -2.24 0.22 -4.89 114.28 103.10 3hrr n THR 1423Ca 0.02 -0.12 -0.42 0.00 -2.27 0.00 0.00 64.05 61.26 3hrr n THR 1423Cb 0.14 0.04 -0.03 0.00 -2.10 0.00 0.00 70.33 68.39 3hrr n THR 1423CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 3hrr s THR 1424N -2.18 3.99 -0.72 4.28 2.01 -0.90 -4.92 115.64 117.20 3hrr s THR 1424Ca 0.37 1.34 0.07 0.00 0.31 0.00 0.00 61.69 63.78 3hrr s THR 1424Cb 0.21 -3.86 0.10 0.00 0.01 0.00 0.00 72.50 68.96 3hrr s THR 1424CO 0.40 0.00 0.88 0.54 -0.69 0.00 0.00 174.62 175.76 3hrr n ARG 1425N 5.22 1.10 -3.81 4.92 1.74 -1.26 -4.89 116.66 119.68 3hrr n ARG 1425Ca 0.12 -1.26 -0.10 0.00 -0.77 0.00 0.00 57.85 55.84 3hrr n ARG 1425Cb 0.45 -1.14 -0.05 0.00 -1.02 0.00 0.00 32.46 30.70 3hrr n ARG 1425CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 3hrr s SER 1426N -0.73 -0.12 -0.10 0.55 1.04 -1.26 -0.72 113.70 112.37 3hrr s SER 1426Ca 0.10 -0.61 -0.09 0.00 0.48 0.00 0.00 55.95 55.83 3hrr s SER 1426Cb 0.06 0.49 0.03 0.00 0.10 0.00 0.00 66.02 66.70 3hrr s SER 1426CO 0.09 -0.94 0.27 0.00 0.98 0.00 0.00 173.24 173.64 3hrr s ALA 1427N -3.89 -0.66 0.04 5.32 0.00 0.19 -4.78 121.76 117.98 3hrr s ALA 1427Ca 0.11 0.76 -0.26 0.00 0.00 0.00 0.00 51.96 52.57 3hrr s ALA 1427Cb 0.01 -0.45 -0.05 0.00 0.00 0.00 0.00 23.12 22.64 3hrr s ALA 1427CO -0.04 -0.13 0.79 0.15 0.00 0.00 0.00 175.76 176.53 3hrr s LYS 1428N 0.17 4.51 -0.05 0.00 -0.14 -0.75 -0.58 119.74 122.90 3hrr s LYS 1428Ca -0.00 1.11 0.03 0.00 -1.36 0.00 0.00 55.97 55.75 3hrr s LYS 1428Cb -0.02 -3.38 0.00 0.00 -1.68 0.00 0.00 37.83 32.75 3hrr s LYS 1428CO 0.00 0.23 -0.14 0.08 -0.76 0.00 0.00 175.35 174.77 3hrr s VAL 1429N 0.10 1.21 0.02 3.17 1.01 0.31 -0.76 120.40 125.45 3hrr s VAL 1429Ca 0.40 -0.56 0.06 0.00 0.00 0.00 0.00 61.98 61.87 3hrr s VAL 1429Cb -0.21 -1.07 -0.02 0.00 0.00 0.00 0.00 36.38 35.09 3hrr s VAL 1429CO 0.23 0.36 -0.17 -0.54 0.00 0.00 0.00 175.10 174.99 3hrr s LYS 1430N 0.31 1.22 -0.19 2.72 1.02 -0.29 -1.00 119.74 123.53 3hrr s LYS 1430Ca -0.08 -0.72 0.01 0.00 0.02 0.00 0.00 55.97 55.20 3hrr s LYS 1430Cb -0.13 -1.23 0.03 0.00 -0.52 0.00 0.00 37.83 35.98 3hrr s LYS 1430CO 0.03 0.32 -0.14 -0.06 -0.92 0.00 0.00 175.35 174.58 3hrr s PHE 1431N -0.62 2.57 -0.06 3.18 0.40 -0.12 -0.97 117.98 122.36 3hrr s PHE 1431Ca 0.05 -1.60 -0.06 0.00 -0.60 0.00 0.00 56.93 54.72 3hrr s PHE 1431Cb -0.07 -1.75 0.02 0.00 0.51 0.00 0.00 43.02 41.72 3hrr s PHE 1431CO 0.01 -0.76 0.17 0.00 0.70 0.00 0.00 175.22 175.33 3hrr s ALA 1432N 1.35 -0.40 0.15 5.36 0.00 -0.54 -0.44 121.76 127.23 3hrr s ALA 1432Ca 0.01 0.49 -0.17 0.00 0.00 0.00 0.00 51.96 52.29 3hrr s ALA 1432Cb -0.15 -0.29 -0.07 0.00 0.00 0.00 0.00 23.12 22.61 3hrr s ALA 1432CO -0.10 -0.08 0.60 0.95 0.00 0.00 0.00 175.76 177.12 3hrr s THR 1433N 0.16 4.75 0.11 0.00 -4.23 -0.26 0.16 115.64 116.34 3hrr s THR 1433Ca -0.01 1.04 0.09 0.00 -1.18 0.00 0.00 61.69 61.64 3hrr s THR 1433Cb -0.02 -3.81 -0.04 0.00 1.34 0.00 0.00 72.50 69.98 3hrr s THR 1433CO -0.00 0.32 -0.23 -0.31 -0.54 0.00 0.00 174.62 173.86 3hrr s TYR 1434N -1.38 1.94 0.00 3.99 2.02 0.34 -0.39 117.35 123.86 3hrr s TYR 1434Ca 0.37 -0.41 0.00 0.00 -0.37 0.00 0.00 57.07 56.66 3hrr s TYR 1434Cb -0.17 -1.06 0.00 0.00 -0.40 0.00 0.00 41.96 40.33 3hrr s TYR 1434CO 0.20 0.25 0.28 1.19 -1.57 0.00 0.00 175.55 175.89 3hrr n PHE 1435N 1.02 0.00 0.00 2.71 3.01 -1.26 -2.48 117.46 120.47 3hrr n PHE 1435Ca -0.19 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.27 3hrr n PHE 1435Cb 0.53 -0.45 0.00 0.00 -0.01 0.00 0.00 39.48 39.55 3hrr n PHE 1435CO 0.00 0.00 0.00 1.63 1.01 0.00 0.00 176.76 179.40 3hrr n LYS 1439N -1.86 0.00 -1.67 -1.08 5.02 -1.26 -4.88 118.16 112.42 3hrr n LYS 1439Ca 0.00 0.00 -0.48 0.00 -2.02 0.00 0.00 58.31 55.81 3hrr n LYS 1439Cb 0.00 -0.07 -0.05 0.00 -0.02 0.00 0.00 35.03 34.90 3hrr n LYS 1439CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 3hrr n LEU 1440N -1.26 3.17 -0.01 -0.35 7.94 -1.26 -4.89 117.00 120.34 3hrr n LEU 1440Ca 0.00 1.02 -0.01 0.00 -1.11 0.00 0.00 56.01 55.92 3hrr n LEU 1440Cb 0.00 -1.37 -0.00 0.00 0.53 0.00 0.00 43.42 42.58 3hrr n LEU 1440CO 0.00 -0.21 -0.04 -0.67 -1.11 0.00 0.00 177.39 175.36 3hrr n ASP 1441N 5.27 0.12 -3.85 1.96 -0.08 0.48 -4.94 116.55 115.50 3hrr n ASP 1441Ca 0.21 0.02 -0.12 0.00 -1.51 0.00 0.00 54.79 53.39 3hrr n ASP 1441Cb 0.28 -0.47 -0.11 0.00 2.34 0.00 0.00 41.12 43.15 3hrr n ASP 1441CO 0.00 0.00 0.00 -0.89 0.12 0.00 0.00 177.20 176.43 3hrr s THR 1442N -1.12 0.04 -0.28 5.18 2.01 -1.10 -4.99 115.64 115.38 3hrr s THR 1442Ca -0.02 -0.33 -0.16 0.00 0.31 0.00 0.00 61.69 61.50 3hrr s THR 1442Cb 0.00 -0.31 -0.03 0.00 0.01 0.00 0.00 72.50 72.17 3hrr s THR 1442CO 0.03 -0.18 0.43 -1.61 -0.69 0.00 0.00 174.62 172.59 3hrr s GLU 1443N -0.60 3.96 -0.27 4.92 2.02 -1.26 -1.10 118.70 126.38 3hrr s GLU 1443Ca -0.07 0.07 -0.04 0.00 0.02 0.00 0.00 54.97 54.96 3hrr s GLU 1443Cb -0.04 -3.68 -0.15 0.00 0.10 0.00 0.00 34.13 30.36 3hrr s GLU 1443CO 0.01 -0.35 -0.27 0.72 0.02 0.00 0.00 175.26 175.38 3hrr n HIS 1444N 5.44 0.01 -3.74 1.61 8.25 0.41 -4.36 115.22 122.84 3hrr n HIS 1444Ca -0.07 0.00 -0.09 0.00 -0.26 0.00 0.00 57.72 57.31 3hrr n HIS 1444Cb 0.50 -1.00 -0.02 0.00 1.12 0.00 0.00 29.99 30.59 3hrr n HIS 1444CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3hrr s ALA 1445N -2.52 -1.24 0.09 -1.41 0.00 -1.11 -0.06 121.76 115.51 3hrr s ALA 1445Ca -0.36 -0.12 -0.12 0.00 0.00 0.00 0.00 51.96 51.36 3hrr s ALA 1445Cb 0.11 0.87 0.01 0.00 0.00 0.00 0.00 23.12 24.11 3hrr s ALA 1445CO 0.56 -0.94 0.27 -1.54 0.00 0.00 0.00 175.76 174.11 3hrr s SER 1446N -2.88 -0.02 0.29 0.00 1.04 -0.66 -0.95 113.70 110.52 3hrr s SER 1446Ca 0.09 -0.46 -0.16 0.00 0.48 0.00 0.00 55.95 55.90 3hrr s SER 1446Cb -0.04 0.38 0.01 0.00 0.10 0.00 0.00 66.02 66.47 3hrr s SER 1446CO 0.01 -0.73 0.62 0.00 0.98 0.00 0.00 173.24 174.11 3hrr s THR 1448N -3.68 2.09 0.19 0.00 2.01 0.25 -0.53 115.64 115.97 3hrr s THR 1448Ca 0.17 -1.07 -0.25 0.00 0.31 0.00 0.00 61.69 60.85 3hrr s THR 1448Cb -0.03 -1.95 -0.08 0.00 0.01 0.00 0.00 72.50 70.45 3hrr s THR 1448CO 0.09 0.43 0.80 0.68 -0.69 0.00 0.00 174.62 175.93 3hrr s VAL 1449N 1.25 4.35 -0.04 3.82 -7.23 0.26 -1.15 120.40 121.66 3hrr s VAL 1449Ca 0.02 1.71 0.05 0.00 -1.81 0.00 0.00 61.98 61.95 3hrr s VAL 1449Cb -0.14 -4.12 -0.00 0.00 0.56 0.00 0.00 36.38 32.67 3hrr s VAL 1449CO -0.11 0.47 -0.19 -0.13 -0.31 0.00 0.00 175.10 174.83 3hrr s ARG 1450N -1.29 1.90 -0.64 4.82 0.52 -0.19 -0.64 118.95 123.44 3hrr s ARG 1450Ca 0.38 -0.66 -0.18 0.00 -0.52 0.00 0.00 55.73 54.75 3hrr s ARG 1450Cb -0.22 -1.65 0.13 0.00 0.52 0.00 0.00 34.95 33.72 3hrr s ARG 1450CO 0.26 0.27 0.70 -0.06 0.02 0.00 0.00 175.30 176.49 3hrr s PHE 1451N -0.01 3.17 0.46 -0.53 0.08 0.11 -0.14 117.98 121.11 3hrr s PHE 1451Ca -0.03 -1.22 0.07 0.00 0.12 0.00 0.00 56.93 55.87 3hrr s PHE 1451Cb -0.12 -3.96 0.00 0.00 -0.57 0.00 0.00 43.02 38.38 3hrr s PHE 1451CO 0.02 -1.20 0.44 -0.08 -0.10 0.00 0.00 175.22 174.30 3hrr s THR 1452N 2.07 2.44 0.73 0.64 -1.32 -0.47 -4.85 115.64 114.89 3hrr s THR 1452Ca 0.12 -1.31 -0.07 0.00 -1.21 0.00 0.00 61.69 59.22 3hrr s THR 1452Cb -0.22 -2.75 0.09 0.00 -1.51 0.00 0.00 72.50 68.10 3hrr s THR 1452CO 0.02 0.00 1.05 -0.94 -2.21 0.00 0.00 174.62 172.54 3hrr s SER 1453N -4.23 4.56 -0.02 8.08 1.04 -1.26 -4.13 113.70 117.74 3hrr s SER 1453Ca 0.48 0.32 0.16 0.00 0.48 0.00 0.00 55.95 57.38 3hrr s SER 1453Cb -0.04 -0.87 0.48 0.00 0.10 0.00 0.00 66.02 65.69 3hrr s SER 1453CO 0.28 -1.76 1.39 -0.90 0.98 0.00 0.00 173.24 173.23 3hrr n ASP 1454N -3.00 2.96 -0.13 7.02 5.75 -1.26 -4.47 116.55 123.41 3hrr n ASP 1454Ca 0.10 -2.06 -0.05 0.00 -0.01 0.00 0.00 54.79 52.77 3hrr n ASP 1454Cb 0.60 -0.38 0.04 0.00 -1.03 0.00 0.00 41.12 40.35 3hrr n ASP 1454CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3hrr h ALA 1455N 3.92 0.50 -0.19 2.12 0.00 -1.99 0.71 119.26 124.33 3hrr h ALA 1455Ca 0.00 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 3hrr h ALA 1455Cb 0.78 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.60 3hrr h ALA 1455CO 0.03 -0.25 0.08 0.37 0.00 0.00 0.00 179.25 179.48 3hrr h GLN 1456N 0.30 0.28 -0.60 0.00 4.15 -2.00 -1.48 115.11 115.76 3hrr h GLN 1456Ca 0.20 -0.05 0.12 0.00 0.77 0.00 0.00 58.65 59.69 3hrr h GLN 1456Cb 0.20 -0.05 -0.10 0.00 0.21 0.00 0.00 27.48 27.75 3hrr h GLN 1456CO -0.21 0.35 0.02 1.25 -1.93 0.00 0.00 178.83 178.31 3hrr h LEU 1457N 0.15 -0.22 -0.82 -2.39 5.85 -1.74 0.89 115.31 117.04 3hrr h LEU 1457Ca 0.06 0.14 -0.03 0.00 0.84 0.00 0.00 57.88 58.90 3hrr h LEU 1457Cb 0.17 0.24 -0.04 0.00 0.37 0.00 0.00 40.66 41.41 3hrr h LEU 1457CO -0.01 -0.09 0.41 0.11 -0.34 0.00 0.00 178.44 178.52 3hrr h LYS 1458N 0.14 1.17 -0.35 1.25 1.57 -0.57 -0.71 116.57 119.07 3hrr h LYS 1458Ca 0.32 -0.17 -0.01 0.00 -1.87 0.00 0.00 60.65 58.91 3hrr h LYS 1458Cb 0.50 -0.22 -0.02 0.00 0.08 0.00 0.00 32.23 32.58 3hrr h LYS 1458CO -0.50 0.90 0.16 1.03 -0.57 0.00 0.00 179.45 180.48 3hrr h SER 1459N 1.16 0.47 -0.97 0.86 0.87 -0.47 -2.83 113.55 112.64 3hrr h SER 1459Ca 0.28 -0.14 0.04 0.00 -1.23 0.00 0.00 61.79 60.74 3hrr h SER 1459Cb 0.10 -0.12 -0.06 0.00 -0.44 0.00 0.00 62.40 61.88 3hrr h SER 1459CO -0.04 0.47 0.63 -0.07 -0.53 0.00 0.00 176.83 177.30 3hrr h LEU 1460N 0.43 1.06 -1.51 2.23 3.38 -0.50 -1.87 115.31 118.52 3hrr h LEU 1460Ca 0.12 -0.01 0.04 0.00 0.09 0.00 0.00 57.88 58.12 3hrr h LEU 1460Cb 0.14 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.61 3hrr h LEU 1460CO -0.01 0.72 0.38 0.03 0.09 0.00 0.00 178.44 179.65 3hrr h ARG 1461N 1.23 0.62 0.00 1.13 3.08 -0.95 -1.55 114.38 117.93 3hrr h ARG 1461Ca 0.39 -0.04 -0.05 0.00 0.07 0.00 0.00 59.98 60.35 3hrr h ARG 1461Cb -0.00 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 29.90 3hrr h ARG 1461CO -0.12 0.41 -0.25 0.00 -1.07 0.00 0.00 179.97 178.94 3hrr h ARG 1462N 0.64 0.00 -0.01 0.04 3.08 -1.12 -3.04 114.38 113.97 3hrr h ARG 1462Ca 0.23 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.28 3hrr h ARG 1462Cb 0.13 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.18 3hrr h ARG 1462CO -0.06 0.25 -0.15 0.43 -1.07 0.00 0.00 179.97 179.36 3hrr n SER 1463N -3.24 1.42 -0.14 7.04 7.64 -0.64 -4.53 113.62 121.17 3hrr n SER 1463Ca 0.02 -1.25 -0.05 0.00 1.01 0.00 0.00 58.87 58.60 3hrr n SER 1463Cb 0.55 0.10 0.02 0.00 -1.01 0.00 0.00 64.21 63.86 3hrr n SER 1463CO 0.00 0.00 0.00 0.58 -3.01 0.00 0.00 175.04 172.61 3hrr h VAL 1464N 1.99 0.41 -0.63 0.44 2.07 -1.29 0.37 116.25 119.61 3hrr h VAL 1464Ca 0.00 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.57 3hrr h VAL 1464Cb 0.55 0.41 -0.04 0.00 -1.52 0.00 0.00 31.29 30.70 3hrr h VAL 1464CO 0.00 0.00 0.42 0.77 0.02 0.00 0.00 177.57 178.78 3hrr h SER 1465N -0.09 0.59 -0.35 0.57 4.64 -1.83 0.59 113.55 117.67 3hrr h SER 1465Ca 0.22 -0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 61.45 3hrr h SER 1465Cb 0.43 -0.13 -0.01 0.00 -0.31 0.00 0.00 62.40 62.38 3hrr h SER 1465CO -0.51 0.40 -0.11 -0.08 -0.87 0.00 0.00 176.83 175.65 3hrr h GLU 1466N 0.68 0.69 -0.52 4.77 4.81 -1.27 -1.60 114.58 122.14 3hrr h GLU 1466Ca 0.26 -0.28 0.01 0.00 -0.13 0.00 0.00 59.36 59.23 3hrr h GLU 1466Cb 0.17 -0.03 -0.03 0.00 0.63 0.00 0.00 28.75 29.49 3hrr h GLU 1466CO -0.08 0.87 0.33 1.88 -0.73 0.00 0.00 179.01 181.28 3hrr h TYR 1467N 0.47 0.62 -0.21 0.92 0.05 -0.43 -2.03 116.97 116.36 3hrr h TYR 1467Ca 0.08 0.02 -0.03 0.00 0.05 0.00 0.00 58.73 58.85 3hrr h TYR 1467Cb 0.63 -0.21 -0.01 0.00 1.01 0.00 0.00 36.73 38.15 3hrr h TYR 1467CO 0.05 0.38 0.01 0.87 -1.05 0.00 0.00 178.16 178.42 3hrr h LYS 1468N 0.67 0.31 -0.28 4.88 1.79 -0.81 -1.63 116.57 121.49 3hrr h LYS 1468Ca 0.20 -0.05 -0.12 0.00 -2.18 0.00 0.00 60.65 58.51 3hrr h LYS 1468Cb -0.03 -0.05 -0.00 0.00 -1.58 0.00 0.00 32.23 30.56 3hrr h LYS 1468CO -0.07 0.33 -0.28 1.15 -1.08 0.00 0.00 179.45 179.50 3hrr h THR 1469N 0.30 1.30 -0.61 -0.16 2.02 -0.92 -0.43 112.91 114.41 3hrr h THR 1469Ca 0.07 -1.44 0.02 0.00 0.77 0.00 0.00 66.41 65.83 3hrr h THR 1469Cb 0.19 1.59 -0.04 0.00 -1.74 0.00 0.00 68.15 68.16 3hrr h THR 1469CO 0.00 0.46 0.39 0.45 0.37 0.00 0.00 175.52 177.19 3hrr h HIS 1470N 0.42 0.73 0.06 3.16 3.86 -0.80 -0.11 115.15 122.47 3hrr h HIS 1470Ca 0.05 0.02 -0.00 0.00 -1.16 0.00 0.00 60.37 59.27 3hrr h HIS 1470Cb 0.84 -0.24 0.00 0.00 1.06 0.00 0.00 27.41 29.07 3hrr h HIS 1470CO 0.07 0.43 -0.03 0.82 0.86 0.00 0.00 177.93 180.09 3hrr h ILE 1471N 0.77 0.96 -0.85 2.45 2.04 -1.17 -1.18 117.51 120.53 3hrr h ILE 1471Ca 0.24 -0.08 0.02 0.00 1.00 0.00 0.00 64.86 66.04 3hrr h ILE 1471Cb -0.03 1.02 -0.04 0.00 -0.74 0.00 0.00 36.82 37.03 3hrr h ILE 1471CO -0.08 0.02 0.56 -0.09 0.00 0.00 0.00 178.15 178.56 3hrr h ARG 1472N -0.11 1.09 -0.12 2.37 2.43 -0.84 -1.65 114.38 117.55 3hrr h ARG 1472Ca -0.01 -0.07 -0.09 0.00 -0.81 0.00 0.00 59.98 59.00 3hrr h ARG 1472Cb 0.09 -0.25 -0.01 0.00 -0.42 0.00 0.00 29.97 29.38 3hrr h ARG 1472CO 0.01 0.72 -0.35 1.96 -1.51 0.00 0.00 179.97 180.81 3hrr h GLN 1473N 1.12 0.24 -0.28 0.20 4.20 -0.70 -0.86 115.11 119.03 3hrr h GLN 1473Ca 0.32 -0.10 -0.05 0.00 0.06 0.00 0.00 58.65 58.88 3hrr h GLN 1473Cb -0.09 -0.01 -0.01 0.00 0.30 0.00 0.00 27.48 27.67 3hrr h GLN 1473CO -0.08 0.56 -0.03 -0.07 -0.67 0.00 0.00 178.83 178.55 3hrr h LEU 1474N 0.21 0.51 -1.07 1.46 3.38 -0.33 -1.62 115.31 117.85 3hrr h LEU 1474Ca 0.03 -0.34 -0.04 0.00 0.09 0.00 0.00 57.88 57.61 3hrr h LEU 1474Cb 0.72 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 41.30 3hrr h LEU 1474CO 0.05 0.73 0.16 0.45 0.09 0.00 0.00 178.44 179.92 3hrr h HIS 1475N 0.29 0.84 -0.63 1.13 3.86 -1.11 -1.74 115.15 117.78 3hrr h HIS 1475Ca 0.08 -0.07 -0.06 0.00 -1.16 0.00 0.00 60.37 59.16 3hrr h HIS 1475Cb 0.48 -0.25 -0.03 0.00 1.06 0.00 0.00 27.41 28.68 3hrr h HIS 1475CO 0.04 0.69 0.17 -0.44 0.86 0.00 0.00 177.93 179.25 3hrr h ASP 1476N 0.80 0.95 -0.56 2.45 3.32 -1.06 -0.41 116.42 121.91 3hrr h ASP 1476Ca 0.18 -0.22 -0.07 0.00 0.02 0.00 0.00 57.03 56.94 3hrr h ASP 1476Cb 0.25 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.53 3hrr h ASP 1476CO -0.01 0.92 0.09 1.23 -1.72 0.00 0.00 179.24 179.76 3hrr h GLY 1477N 0.93 1.00 1.00 2.75 0.00 -1.07 -2.29 103.07 105.39 3hrr h GLY 1477Ca 0.20 -0.66 -0.05 0.00 0.00 0.00 0.00 47.33 46.82 3hrr h GLY 1477CO -0.00 0.61 0.16 0.84 0.00 0.00 0.00 176.54 178.16 3hrr h HIS 1478N 0.82 0.93 0.00 5.60 -0.00 -1.00 0.43 115.15 121.93 3hrr h HIS 1478Ca 0.17 -0.10 0.00 0.00 -0.00 0.00 0.00 60.37 60.44 3hrr h HIS 1478Cb 0.41 -0.27 0.00 0.00 -0.00 0.00 0.00 27.41 27.55 3hrr h HIS 1478CO 0.03 0.79 0.00 0.00 -0.00 0.00 0.00 177.93 178.75 3hrr h ALA 1479N 1.03 1.00 -0.49 5.26 0.00 -0.83 -1.34 119.26 123.89 3hrr h ALA 1479Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.09 3hrr h ALA 1479Cb 0.31 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.10 3hrr h ALA 1479CO -0.00 0.00 0.00 1.63 0.00 0.00 0.00 179.25 180.88 3hrr n LYS 1480N -2.52 2.56 -0.88 0.00 5.02 -0.74 -4.97 118.16 116.63 3hrr n LYS 1480Ca -0.01 -2.39 0.00 0.00 -2.02 0.00 0.00 58.31 53.89 3hrr n LYS 1480Cb 0.10 -1.52 0.00 0.00 -0.02 0.00 0.00 35.03 33.59 3hrr n LYS 1480CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3hrr n GLY 1481N 1.50 0.54 0.10 0.72 0.00 -0.50 -4.96 105.19 102.59 3hrr n GLY 1481Ca 0.21 -0.17 -0.12 0.00 0.00 0.00 0.00 46.02 45.94 3hrr n GLY 1481CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3hrr n GLN 1482N -2.88 0.67 -4.47 1.61 6.02 0.06 -4.95 117.38 113.44 3hrr n GLN 1482Ca 0.00 0.29 -0.24 0.00 -0.01 0.00 0.00 57.00 57.04 3hrr n GLN 1482Cb 0.00 -1.77 -0.13 0.00 1.02 0.00 0.00 30.24 29.35 3hrr n GLN 1482CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 177.06 175.99 3hrr s PHE 1483N -2.59 1.67 0.29 1.08 0.08 -1.23 -4.95 117.98 112.33 3hrr s PHE 1483Ca -0.09 -0.39 -0.29 0.00 0.12 0.00 0.00 56.93 56.28 3hrr s PHE 1483Cb 0.08 -0.97 -0.10 0.00 -0.57 0.00 0.00 43.02 41.46 3hrr s PHE 1483CO 0.81 0.11 1.15 -1.64 -0.10 0.00 0.00 175.22 175.55 3hrr s MET 1484N -1.40 4.57 -0.17 0.44 -1.94 -1.13 -4.44 119.30 115.23 3hrr s MET 1484Ca 0.06 1.91 0.01 0.00 -1.71 0.00 0.00 55.69 55.96 3hrr s MET 1484Cb -0.09 -3.16 0.02 0.00 2.01 0.00 0.00 34.83 33.61 3hrr s MET 1484CO 0.02 0.11 -0.20 0.50 -0.01 0.00 0.00 175.02 175.44 3hrr s ARG 1485N -1.53 2.93 -0.28 2.03 3.52 -1.26 -1.19 118.95 123.18 3hrr s ARG 1485Ca 0.46 -0.81 -0.11 0.00 -0.13 0.00 0.00 55.73 55.14 3hrr s ARG 1485Cb -0.34 -2.50 -0.05 0.00 -1.56 0.00 0.00 34.95 30.50 3hrr s ARG 1485CO 0.44 -0.17 0.18 0.71 -0.81 0.00 0.00 175.30 175.65 3hrr s TYR 1486N 1.21 3.21 0.72 5.12 2.02 0.12 -4.94 117.35 124.81 3hrr s TYR 1486Ca 0.03 0.08 -0.15 0.00 -0.37 0.00 0.00 57.07 56.66 3hrr s TYR 1486Cb -0.13 -2.37 0.03 0.00 -0.40 0.00 0.00 41.96 39.09 3hrr s TYR 1486CO -0.11 -0.17 1.20 -0.80 -1.57 0.00 0.00 175.55 174.11 3hrr s ASN 1487N 1.73 4.32 0.10 2.29 0.01 -1.26 -1.71 114.94 120.43 3hrr s ASN 1487Ca 0.07 2.34 -0.21 0.00 -0.71 0.00 0.00 52.86 54.35 3hrr s ASN 1487Cb -0.16 -2.59 -0.05 0.00 0.41 0.00 0.00 41.25 38.86 3hrr s ASN 1487CO 0.10 -2.17 1.36 -0.09 -1.51 0.00 0.00 177.10 174.79 3hrr h ARG 1488N -0.19 -0.06 -0.26 -0.60 2.43 -1.39 -0.27 114.38 114.04 3hrr h ARG 1488Ca -0.48 0.00 -0.04 0.00 -0.81 0.00 0.00 59.98 58.65 3hrr h ARG 1488Cb 1.29 0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 30.84 3hrr h ARG 1488CO 0.50 -0.04 -0.03 0.87 -1.51 0.00 0.00 179.97 179.76 3hrr h LYS 1489N -0.06 0.40 -0.24 0.20 1.57 -1.88 -1.85 116.57 114.70 3hrr h LYS 1489Ca 0.09 -0.08 -0.18 0.00 -1.87 0.00 0.00 60.65 58.61 3hrr h LYS 1489Cb 0.30 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.55 3hrr h LYS 1489CO -0.58 0.45 -0.55 1.15 -0.57 0.00 0.00 179.45 179.35 3hrr h THR 1490N 0.38 1.29 -0.26 -0.16 2.02 -1.81 -0.62 112.91 113.75 3hrr h THR 1490Ca 0.08 -1.75 0.04 0.00 0.77 0.00 0.00 66.41 65.56 3hrr h THR 1490Cb 0.31 1.76 -0.04 0.00 -1.74 0.00 0.00 68.15 68.44 3hrr h THR 1490CO 0.01 0.56 -0.00 1.23 0.37 0.00 0.00 175.52 177.69 3hrr h GLY 1491N 0.55 0.25 1.58 2.16 0.00 -0.56 -0.67 103.07 106.38 3hrr h GLY 1491Ca -0.00 0.03 -0.07 0.00 0.00 0.00 0.00 47.33 47.29 3hrr h GLY 1491CO 0.12 -0.06 -0.11 -0.97 0.00 0.00 0.00 176.54 175.52 3hrr h TYR 1492N 0.07 0.54 -0.45 5.60 0.05 -1.27 -2.27 116.97 119.25 3hrr h TYR 1492Ca 0.12 -0.08 0.00 0.00 0.05 0.00 0.00 58.73 58.82 3hrr h TYR 1492Cb 0.16 -0.15 -0.02 0.00 1.01 0.00 0.00 36.73 37.73 3hrr h TYR 1492CO -0.21 0.61 0.28 -0.22 -1.05 0.00 0.00 178.16 177.57 3hrr h LYS 1493N 0.47 0.60 -0.73 4.88 3.64 -0.82 -0.89 116.57 123.72 3hrr h LYS 1493Ca 0.09 -0.05 0.05 0.00 -1.27 0.00 0.00 60.65 59.47 3hrr h LYS 1493Cb 0.48 -0.13 -0.04 0.00 -0.41 0.00 0.00 32.23 32.13 3hrr h LYS 1493CO 0.03 0.42 0.48 1.25 -2.27 0.00 0.00 179.45 179.36 3hrr h LEU 1494N 0.60 0.71 0.00 5.20 5.85 -0.57 -1.60 115.31 125.50 3hrr h LEU 1494Ca 0.16 -0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.88 3hrr h LEU 1494Cb -0.03 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 40.84 3hrr h LEU 1494CO -0.03 0.47 -0.26 0.23 -0.34 0.00 0.00 178.44 178.51 3hrr n MET 1495N -4.47 0.02 0.27 1.25 2.81 -0.88 -4.55 117.12 111.57 3hrr n MET 1495Ca 0.10 0.01 0.15 0.00 -1.81 0.00 0.00 57.70 56.15 3hrr n MET 1495Cb 0.19 -1.52 0.74 0.00 -0.71 0.00 0.00 33.22 31.92 3hrr n MET 1495CO 0.00 0.00 0.00 0.66 1.51 0.00 0.00 175.97 178.14 3hrr h SER 1496N 0.00 0.00 0.86 7.83 4.64 -0.14 -0.84 113.55 125.91 3hrr h SER 1496Ca 0.00 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.26 3hrr h SER 1496Cb 0.52 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.60 3hrr h SER 1496CO 0.00 0.10 -0.29 0.77 -0.87 0.00 0.00 176.83 176.54 3hrr h SER 1497N 0.00 0.00 0.00 4.97 4.64 -1.80 -3.34 113.55 118.02 3hrr h SER 1497Ca -0.00 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 61.24 3hrr h SER 1497Cb 0.40 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.48 3hrr h SER 1497CO 0.01 0.29 -0.52 -0.03 -0.87 0.00 0.00 176.83 175.71 3hrr h MET 1498N 0.00 0.00 -3.03 4.77 -1.53 -1.49 -3.47 114.93 110.17 3hrr h MET 1498Ca -0.00 0.00 -0.13 0.00 -3.44 0.00 0.00 59.70 56.13 3hrr h MET 1498Cb 0.80 0.00 -0.22 0.00 -0.55 0.00 0.00 31.60 31.63 3hrr h MET 1498CO 0.04 0.68 -0.31 0.00 0.14 0.00 0.00 176.91 177.46 3hrr s ALA 1499N -2.41 -0.77 0.27 0.39 0.00 -0.76 -4.58 121.76 113.91 3hrr s ALA 1499Ca -0.19 0.51 0.08 0.00 0.00 0.00 0.00 51.96 52.36 3hrr s ALA 1499Cb 0.01 -0.14 -0.04 0.00 0.00 0.00 0.00 23.12 22.96 3hrr s ALA 1499CO 0.47 -0.22 0.15 1.03 0.00 0.00 0.00 175.76 177.18 3hrr s ARG 1500N -0.80 2.70 -0.03 0.00 0.52 0.10 -3.86 118.95 117.58 3hrr s ARG 1500Ca -0.09 -1.20 0.07 0.00 -0.52 0.00 0.00 55.73 53.99 3hrr s ARG 1500Cb -0.04 -2.42 -0.02 0.00 0.52 0.00 0.00 34.95 32.99 3hrr s ARG 1500CO 0.03 0.35 -0.24 -0.06 0.02 0.00 0.00 175.30 175.40 3hrr s PHE 1501N -2.22 2.19 0.08 -0.53 0.08 -1.26 -0.17 117.98 116.15 3hrr s PHE 1501Ca 0.33 -0.49 -0.37 0.00 0.12 0.00 0.00 56.93 56.53 3hrr s PHE 1501Cb -0.07 -1.42 -0.17 0.00 -0.57 0.00 0.00 43.02 40.78 3hrr s PHE 1501CO 0.24 -0.09 1.20 -1.71 -0.10 0.00 0.00 175.22 174.76 3hrr n ASN 1502N 2.65 1.02 0.08 1.36 2.85 -0.46 -4.83 115.26 117.92 3hrr n ASN 1502Ca -0.16 1.13 0.18 0.00 -0.11 0.00 0.00 54.58 55.62 3hrr n ASN 1502Cb 0.52 -1.11 0.71 0.00 1.24 0.00 0.00 39.78 41.14 3hrr n ASN 1502CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 3hrr h PRO 1503N 3.77 0.00 0.00 1.20 0.11 -1.94 0.15 132.00 135.30 3hrr h PRO 1503Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 3hrr h PRO 1503Cb 1.37 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.48 3hrr h PRO 1503CO 0.72 0.00 0.00 -0.44 -0.21 0.00 0.00 178.00 178.07 3hrr h ASP 1504N 0.00 0.00 0.05 -2.05 3.32 -1.88 -1.91 116.42 113.94 3hrr h ASP 1504Ca 0.19 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.24 3hrr h ASP 1504Cb 0.79 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.34 3hrr h ASP 1504CO -0.00 0.00 -0.42 -1.22 -1.72 0.00 0.00 179.24 175.87 3hrr n TYR 1505N -2.31 0.00 -2.39 4.55 4.02 0.53 -4.62 117.16 116.94 3hrr n TYR 1505Ca 0.01 0.00 -0.43 0.00 -0.01 0.00 0.00 57.90 57.48 3hrr n TYR 1505Cb 0.21 -0.03 0.00 0.00 -0.02 0.00 0.00 39.34 39.50 3hrr n TYR 1505CO 0.00 0.00 0.00 -1.33 -1.01 0.00 0.00 176.86 174.52 3hrr n MET 1506N -0.18 3.37 0.00 -0.72 2.81 -0.72 -4.61 117.12 117.07 3hrr n MET 1506Ca 0.10 -3.40 0.04 0.00 -1.81 0.00 0.00 57.70 52.63 3hrr n MET 1506Cb 0.44 -3.08 0.02 0.00 -0.71 0.00 0.00 33.22 29.89 3hrr n MET 1506CO 0.00 0.00 0.00 1.28 1.51 0.00 0.00 175.97 178.76 3hrr n LEU 1507N 5.17 1.49 -4.57 4.03 4.77 -1.26 -4.78 117.00 121.85 3hrr n LEU 1507Ca 0.42 -0.93 -0.42 0.00 -0.03 0.00 0.00 56.01 55.06 3hrr n LEU 1507Cb 0.39 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.46 3hrr n LEU 1507CO 0.78 0.30 1.13 -0.76 -1.33 0.00 0.00 177.39 177.51 3hrr s LEU 1508N -0.92 3.39 -0.00 2.23 1.02 -1.26 -0.68 118.68 122.46 3hrr s LEU 1508Ca 0.09 0.04 -0.21 0.00 0.02 0.00 0.00 54.13 54.07 3hrr s LEU 1508Cb 0.07 -3.04 -0.23 0.00 0.02 0.00 0.00 46.19 43.01 3hrr s LEU 1508CO 0.13 -1.59 1.10 -0.78 0.02 0.00 0.00 176.35 175.24 3hrr h ASP 1509N 9.90 0.46 -5.08 2.29 3.58 -0.95 -3.35 116.42 123.26 3hrr h ASP 1509Ca -0.26 -0.74 -0.08 0.00 0.42 0.00 0.00 57.03 56.37 3hrr h ASP 1509Cb 1.06 -0.14 -0.15 0.00 1.72 0.00 0.00 39.33 41.82 3hrr h ASP 1509CO 1.20 1.14 -0.20 -0.72 -2.88 0.00 0.00 179.24 177.78 3hrr s TYR 1510N -3.27 -0.10 -0.14 0.28 1.13 -1.14 -1.49 117.35 112.62 3hrr s TYR 1510Ca -0.14 -0.15 -0.06 0.00 -1.41 0.00 0.00 57.07 55.31 3hrr s TYR 1510Cb 0.03 0.13 0.06 0.00 -1.10 0.00 0.00 41.96 41.08 3hrr s TYR 1510CO 0.80 -0.59 0.31 -1.17 -2.51 0.00 0.00 175.55 172.39 3hrr s LEU 1511N -2.48 0.01 -0.22 -3.49 0.20 -0.69 -1.64 118.68 110.36 3hrr s LEU 1511Ca -0.00 0.68 -0.09 0.00 0.69 0.00 0.00 54.13 55.41 3hrr s LEU 1511Cb 0.01 0.94 -0.04 0.00 -0.43 0.00 0.00 46.19 46.67 3hrr s LEU 1511CO -0.08 -0.20 0.11 -0.69 -0.29 0.00 0.00 176.35 175.20 3hrr s VAL 1512N 1.71 4.91 -0.14 1.68 1.01 0.78 -0.71 120.40 129.64 3hrr s VAL 1512Ca -0.06 0.02 0.02 0.00 0.00 0.00 0.00 61.98 61.96 3hrr s VAL 1512Cb -0.10 -3.27 0.01 0.00 0.00 0.00 0.00 36.38 33.02 3hrr s VAL 1512CO -0.10 0.38 -0.20 -0.22 0.00 0.00 0.00 175.10 174.96 3hrr s LEU 1513N 0.96 2.04 -0.59 3.92 2.96 -0.33 -1.54 118.68 126.10 3hrr s LEU 1513Ca 0.05 -0.58 -0.17 0.00 -0.22 0.00 0.00 54.13 53.22 3hrr s LEU 1513Cb -0.14 -1.39 0.13 0.00 0.50 0.00 0.00 46.19 45.30 3hrr s LEU 1513CO 0.03 0.05 0.60 0.21 -1.32 0.00 0.00 176.35 175.92 3hrr s ASN 1514N 0.94 6.25 0.37 3.68 2.47 0.35 -2.84 114.94 126.16 3hrr s ASN 1514Ca -0.05 -1.77 0.07 0.00 0.42 0.00 0.00 52.86 51.53 3hrr s ASN 1514Cb -0.15 -2.24 0.73 0.00 -1.45 0.00 0.00 41.25 38.14 3hrr s ASN 1514CO -0.04 -0.91 1.92 -0.33 -3.72 0.00 0.00 177.10 174.02 3hrr h GLU 1515N 8.88 0.40 -0.47 0.43 5.08 -1.94 -1.96 114.58 125.00 3hrr h GLU 1515Ca -0.25 -0.08 0.11 0.00 -1.00 0.00 0.00 59.36 58.14 3hrr h GLU 1515Cb 1.09 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 30.25 3hrr h GLU 1515CO 1.03 0.44 0.33 0.00 -1.00 0.00 0.00 179.01 179.81 3hrr h ALA 1516N 1.60 2.24 0.00 3.43 0.00 -1.96 -2.56 119.26 122.02 3hrr h ALA 1516Ca 0.09 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.99 3hrr h ALA 1516Cb 0.28 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.06 3hrr h ALA 1516CO 0.01 -0.36 -0.02 0.39 0.00 0.00 0.00 179.25 179.27 3hrr n GLU 1517N -4.44 1.80 -4.06 0.00 -0.58 -1.01 -5.00 120.64 107.35 3hrr n GLU 1517Ca 0.08 -2.07 -0.27 0.00 -0.42 0.00 0.00 57.16 54.47 3hrr n GLU 1517Cb 0.44 -1.25 -0.04 0.00 -0.57 0.00 0.00 31.44 30.01 3hrr n GLU 1517CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 3hrr n ASN 1518N -1.01 -0.18 -4.14 1.62 3.02 -0.87 -2.82 115.26 110.89 3hrr n ASN 1518Ca 0.09 -1.08 -0.31 0.00 -0.03 0.00 0.00 54.58 53.25 3hrr n ASN 1518Cb 0.50 -2.66 -0.17 0.00 -0.61 0.00 0.00 39.78 36.84 3hrr n ASN 1518CO 0.00 0.00 0.00 -0.70 -2.62 0.00 0.00 177.26 173.94 3hrr s GLU 1519N -6.79 2.79 0.02 3.52 2.12 -0.79 -1.51 118.70 118.06 3hrr s GLU 1519Ca 0.05 -0.77 0.03 0.00 0.36 0.00 0.00 54.97 54.64 3hrr s GLU 1519Cb -0.03 -2.27 -0.02 0.00 0.26 0.00 0.00 34.13 32.07 3hrr s GLU 1519CO 0.92 -0.02 -0.08 0.00 -0.54 0.00 0.00 175.26 175.54 3hrr s ALA 1520N 0.85 0.65 -0.10 6.30 0.00 0.44 -0.50 121.76 129.40 3hrr s ALA 1520Ca -0.07 -0.58 0.03 0.00 0.00 0.00 0.00 51.96 51.34 3hrr s ALA 1520Cb -0.15 -0.06 0.01 0.00 0.00 0.00 0.00 23.12 22.91 3hrr s ALA 1520CO -0.01 0.08 -0.21 0.00 0.00 0.00 0.00 175.76 175.62 3hrr s ALA 1521N -0.81 1.97 0.02 0.00 0.00 -0.59 -1.41 121.76 120.94 3hrr s ALA 1521Ca -0.03 -0.86 0.01 0.00 0.00 0.00 0.00 51.96 51.08 3hrr s ALA 1521Cb -0.07 -0.80 -0.01 0.00 0.00 0.00 0.00 23.12 22.24 3hrr s ALA 1521CO 0.00 0.17 -0.05 0.45 0.00 0.00 0.00 175.76 176.34 3hrr s SER 1522N 0.53 0.56 -0.24 0.00 0.15 -0.12 -0.16 113.70 114.43 3hrr s SER 1522Ca -0.15 -0.30 -0.15 0.00 0.70 0.00 0.00 55.95 56.05 3hrr s SER 1522Cb -0.17 0.00 -0.04 0.00 -1.71 0.00 0.00 66.02 64.10 3hrr s SER 1522CO 0.05 -0.09 0.38 -0.83 1.20 0.00 0.00 173.24 173.95 3hrr s GLY 1523N -0.80 1.98 -0.17 9.45 0.00 -0.65 -0.55 107.32 116.57 3hrr s GLY 1523Ca -0.05 -0.68 -0.03 0.00 0.00 0.00 0.00 44.72 43.96 3hrr s GLY 1523CO -0.00 0.89 -0.06 -1.34 0.00 0.00 0.00 173.10 172.58 3hrr s VAL 1524N 1.68 3.49 -0.33 1.40 -7.23 -0.27 -0.23 120.40 118.91 3hrr s VAL 1524Ca 0.17 -0.48 0.03 0.00 -1.81 0.00 0.00 61.98 59.89 3hrr s VAL 1524Cb -0.15 -2.54 0.10 0.00 0.56 0.00 0.00 36.38 34.35 3hrr s VAL 1524CO 0.09 0.47 0.05 -0.62 -0.31 0.00 0.00 175.10 174.78 3hrr s ASP 1525N 0.79 4.64 0.37 4.85 -1.08 0.14 0.27 116.67 126.66 3hrr s ASP 1525Ca -0.02 -2.05 0.27 0.00 -0.52 0.00 0.00 52.55 50.23 3hrr s ASP 1525Cb -0.15 -1.51 1.25 0.00 -1.46 0.00 0.00 42.92 41.05 3hrr s ASP 1525CO 0.02 -0.38 1.82 -0.26 0.52 0.00 0.00 175.17 176.89 3hrr h PHE 1526N 7.69 0.00 0.00 -5.34 0.04 -1.43 -1.96 116.94 115.94 3hrr h PHE 1526Ca -0.06 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.71 3hrr h PHE 1526Cb 1.02 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.17 3hrr h PHE 1526CO 0.45 0.00 0.00 0.66 -0.60 0.00 0.00 178.31 178.82 3hrr h SER 1527N 0.00 0.00 0.69 2.17 4.64 -1.63 -3.09 113.55 116.33 3hrr h SER 1527Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3hrr h SER 1527Cb 0.27 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.36 3hrr h SER 1527CO 0.00 0.00 0.00 0.18 -0.87 0.00 0.00 176.83 176.14 3hrr n LEU 1528N -2.31 0.00 -4.51 5.97 4.77 -0.74 -4.83 117.00 115.35 3hrr n LEU 1528Ca 0.01 0.40 -0.25 0.00 -0.03 0.00 0.00 56.01 56.14 3hrr n LEU 1528Cb 0.17 -0.40 -0.09 0.00 -2.33 0.00 0.00 43.42 40.77 3hrr n LEU 1528CO 0.17 -0.05 -0.22 -0.83 -1.33 0.00 0.00 177.39 175.12 3hrr s GLY 1529N -2.79 2.46 -0.13 -0.72 0.00 -1.17 -4.90 107.32 100.07 3hrr s GLY 1529Ca 0.18 -1.44 -0.04 0.00 0.00 0.00 0.00 44.72 43.42 3hrr s GLY 1529CO 0.43 -1.86 0.03 -0.45 0.00 0.00 0.00 173.10 171.25 3hrr s SER 1530N -3.59 5.38 -0.35 1.64 0.15 -1.26 -5.03 113.70 110.65 3hrr s SER 1530Ca 0.26 0.12 0.15 0.00 0.70 0.00 0.00 55.95 57.18 3hrr s SER 1530Cb 0.05 -1.72 0.43 0.00 -1.71 0.00 0.00 66.02 63.07 3hrr s SER 1530CO 0.14 0.29 0.92 -1.54 1.20 0.00 0.00 173.24 174.25 3hrr n SER 1531N 2.73 1.64 -4.75 5.45 3.41 -1.26 -4.82 113.62 116.02 3hrr n SER 1531Ca -0.18 -2.87 -0.41 0.00 -0.26 0.00 0.00 58.87 55.15 3hrr n SER 1531Cb 0.53 -0.54 -0.04 0.00 -0.26 0.00 0.00 64.21 63.89 3hrr n SER 1531CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 3hrr s GLU 1532N -3.02 4.65 0.00 4.33 0.41 -1.26 -4.88 118.70 118.93 3hrr s GLU 1532Ca 0.32 1.70 0.00 0.00 -0.41 0.00 0.00 54.97 56.58 3hrr s GLU 1532Cb 0.43 -3.26 0.00 0.00 -1.78 0.00 0.00 34.13 29.52 3hrr s GLU 1532CO -0.01 0.19 0.00 0.41 -0.49 0.00 0.00 175.26 175.36 3hrr n GLY 1533N 1.72 0.98 3.18 -1.39 0.00 -1.26 -5.06 105.19 103.36 3hrr n GLY 1533Ca 0.01 -1.91 -0.27 0.00 0.00 0.00 0.00 46.02 43.84 3hrr n GLY 1533CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3hrr s THR 1534N -2.18 1.59 0.13 2.61 -4.23 -1.26 -4.98 115.64 107.32 3hrr s THR 1534Ca 0.00 -0.83 -0.11 0.00 -1.18 0.00 0.00 61.69 59.57 3hrr s THR 1534Cb 0.00 -1.34 0.01 0.00 1.34 0.00 0.00 72.50 72.50 3hrr s THR 1534CO 0.00 0.45 0.30 -0.36 -0.54 0.00 0.00 174.62 174.47 3hrr s PHE 1535N -0.18 0.10 -0.00 3.99 0.08 -1.26 -1.75 117.98 118.96 3hrr s PHE 1535Ca 0.00 -0.47 -0.19 0.00 0.12 0.00 0.00 56.93 56.39 3hrr s PHE 1535Cb -0.11 0.07 -0.27 0.00 -0.57 0.00 0.00 43.02 42.14 3hrr s PHE 1535CO 0.01 -0.67 1.03 0.00 -0.10 0.00 0.00 175.22 175.50 3hrr h ALA 1536N 2.54 0.00 -2.45 5.36 0.00 -1.97 -3.46 119.26 119.29 3hrr h ALA 1536Ca -0.33 -0.65 -0.24 0.00 0.00 0.00 0.00 54.91 53.69 3hrr h ALA 1536Cb 1.23 0.07 -0.33 0.00 0.00 0.00 0.00 17.79 18.76 3hrr h ALA 1536CO 0.50 0.43 -0.55 0.00 0.00 0.00 0.00 179.25 179.62 3hrr s ALA 1537N -2.92 -0.59 0.10 0.00 0.00 -1.26 -4.94 121.76 112.15 3hrr s ALA 1537Ca -0.13 0.65 -0.32 0.00 0.00 0.00 0.00 51.96 52.16 3hrr s ALA 1537Cb 0.03 -1.34 -0.12 0.00 0.00 0.00 0.00 23.12 21.70 3hrr s ALA 1537CO 0.85 -1.06 1.79 1.58 0.00 0.00 0.00 175.76 178.92 3hrr n HIS 1538N 5.34 2.50 0.02 0.00 -0.00 -1.26 -4.46 115.22 117.36 3hrr n HIS 1538Ca -0.05 -0.03 0.18 0.00 0.46 0.00 0.00 57.72 58.27 3hrr n HIS 1538Cb 0.50 -2.68 0.66 0.00 -0.12 0.00 0.00 29.99 28.35 3hrr n HIS 1538CO 0.00 0.00 0.00 -1.35 0.46 0.00 0.00 176.34 175.45 3hrr h PRO 1539N 8.08 0.05 -0.44 1.57 0.11 -1.95 -1.35 132.00 138.08 3hrr h PRO 1539Ca -0.46 -0.00 -0.12 0.00 0.11 0.00 0.00 66.00 65.52 3hrr h PRO 1539Cb 1.24 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.32 3hrr h PRO 1539CO 0.94 0.04 -0.19 0.00 -0.21 0.00 0.00 178.00 178.57 3hrr h ALA 1540N 1.76 0.61 -0.26 -0.75 0.00 -1.89 -1.09 119.26 117.63 3hrr h ALA 1540Ca 0.23 -0.37 -0.04 0.00 0.00 0.00 0.00 54.91 54.73 3hrr h ALA 1540Cb 0.84 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.47 3hrr h ALA 1540CO -0.01 0.57 0.02 0.45 0.00 0.00 0.00 179.25 180.28 3hrr h HIS 1541N 0.73 0.49 -0.15 0.00 3.86 -1.61 -0.80 115.15 117.67 3hrr h HIS 1541Ca 0.10 -0.08 -0.22 0.00 -1.16 0.00 0.00 60.37 59.02 3hrr h HIS 1541Cb 0.76 -0.13 0.01 0.00 1.06 0.00 0.00 27.41 29.10 3hrr h HIS 1541CO 0.05 0.58 -0.77 0.28 0.86 0.00 0.00 177.93 178.94 3hrr h VAL 1542N 0.25 1.29 -0.85 2.45 2.07 -1.41 -2.67 116.25 117.38 3hrr h VAL 1542Ca 0.08 -1.99 0.05 0.00 0.82 0.00 0.00 66.70 65.66 3hrr h VAL 1542Cb 0.38 1.99 -0.06 0.00 -1.52 0.00 0.00 31.29 32.08 3hrr h VAL 1542CO 0.01 0.63 0.53 -0.78 0.02 0.00 0.00 177.57 177.98 3hrr h ASP 1543N 0.51 0.86 -0.93 0.57 3.58 -1.17 -2.25 116.42 117.59 3hrr h ASP 1543Ca -0.05 0.01 0.05 0.00 0.42 0.00 0.00 57.03 57.46 3hrr h ASP 1543Cb 1.39 -0.18 -0.06 0.00 1.72 0.00 0.00 39.33 42.21 3hrr h ASP 1543CO 0.16 0.57 0.61 0.00 -2.88 0.00 0.00 179.24 177.69 3hrr h ALA 1544N 1.38 1.45 -0.27 -0.78 0.00 -0.93 0.25 119.26 120.36 3hrr h ALA 1544Ca 0.36 -0.03 0.04 0.00 0.00 0.00 0.00 54.91 55.27 3hrr h ALA 1544Cb 0.10 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.55 3hrr h ALA 1544CO -0.15 0.44 0.06 0.82 0.00 0.00 0.00 179.25 180.42 3hrr h ILE 1545N 1.12 0.88 0.00 0.00 2.04 -1.08 -2.66 117.51 117.81 3hrr h ILE 1545Ca 0.39 -0.06 -0.09 0.00 1.00 0.00 0.00 64.86 66.10 3hrr h ILE 1545Cb 0.11 0.71 -0.01 0.00 -0.74 0.00 0.00 36.82 36.88 3hrr h ILE 1545CO -0.13 0.03 -0.42 0.71 0.00 0.00 0.00 178.15 178.34 3hrr h THR 1546N 0.16 1.12 -0.72 -0.27 1.35 -0.94 -2.62 112.91 110.99 3hrr h THR 1546Ca 0.12 -1.53 0.13 0.00 -0.55 0.00 0.00 66.41 64.58 3hrr h THR 1546Cb 0.12 1.87 -0.05 0.00 -1.73 0.00 0.00 68.15 68.36 3hrr h THR 1546CO -0.16 0.41 0.48 1.56 -0.25 0.00 0.00 175.52 177.56 3hrr h GLN 1547N 0.00 0.45 -0.45 4.72 4.20 -0.18 -2.18 115.11 121.67 3hrr h GLN 1547Ca -0.00 -0.03 0.02 0.00 0.06 0.00 0.00 58.65 58.70 3hrr h GLN 1547Cb 0.83 -0.10 -0.03 0.00 0.30 0.00 0.00 27.48 28.48 3hrr h GLN 1547CO 0.05 0.30 0.26 0.28 -0.67 0.00 0.00 178.83 179.05 3hrr h VAL 1548N 0.46 1.03 -0.45 -0.54 2.07 -1.37 0.29 116.25 117.74 3hrr h VAL 1548Ca 0.35 -0.18 -0.13 0.00 0.82 0.00 0.00 66.70 67.56 3hrr h VAL 1548Cb 0.70 0.47 -0.01 0.00 -1.52 0.00 0.00 31.29 30.93 3hrr h VAL 1548CO -0.11 0.10 -0.21 0.00 0.02 0.00 0.00 177.57 177.36 3hrr h ALA 1549N 1.21 0.63 -0.48 1.67 0.00 -1.57 -1.30 119.26 119.42 3hrr h ALA 1549Ca 0.18 -0.39 -0.03 0.00 0.00 0.00 0.00 54.91 54.68 3hrr h ALA 1549Cb 0.03 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 3hrr h ALA 1549CO -0.09 0.61 0.18 0.78 0.00 0.00 0.00 179.25 180.74 3hrr h GLY 1550N 0.78 0.78 1.00 0.00 0.00 -1.11 -2.43 103.07 102.09 3hrr h GLY 1550Ca 0.10 -0.43 -0.00 0.00 0.00 0.00 0.00 47.33 47.00 3hrr h GLY 1550CO 0.06 0.41 0.36 -2.75 0.00 0.00 0.00 176.54 174.63 3hrr h PHE 1551N 0.64 0.76 -0.99 5.60 3.57 -0.38 -0.69 116.94 125.46 3hrr h PHE 1551Ca 0.16 0.00 0.11 0.00 3.53 0.00 0.00 57.97 61.78 3hrr h PHE 1551Cb 0.21 -0.25 -0.08 0.00 2.79 0.00 0.00 35.95 38.62 3hrr h PHE 1551CO 0.01 0.51 0.62 0.00 -2.23 0.00 0.00 178.31 177.21 3hrr h ALA 1552N 1.19 1.47 0.17 2.41 0.00 -0.91 0.21 119.26 123.80 3hrr h ALA 1552Ca 0.21 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.13 3hrr h ALA 1552Cb -0.04 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.54 3hrr h ALA 1552CO -0.04 0.24 -0.08 0.52 0.00 0.00 0.00 179.25 179.88 3hrr h MET 1553N 0.99 -0.22 0.00 0.00 2.86 -1.18 -3.33 114.93 114.04 3hrr h MET 1553Ca 0.48 0.02 -0.03 0.00 -2.06 0.00 0.00 59.70 58.11 3hrr h MET 1553Cb 0.44 0.05 -0.00 0.00 0.06 0.00 0.00 31.60 32.15 3hrr h MET 1553CO -0.25 0.18 -0.12 -0.91 1.06 0.00 0.00 176.91 176.86 3hrr h ASN 1554N -0.91 0.00 0.08 1.22 -0.26 -0.93 -2.83 115.58 111.95 3hrr h ASN 1554Ca -0.02 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.72 3hrr h ASN 1554Cb 0.50 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.76 3hrr h ASN 1554CO 0.04 0.12 -0.06 0.00 -1.06 0.00 0.00 177.43 176.47 3hrr n ALA 1555N -2.16 2.70 -1.81 -0.83 0.00 0.05 -4.80 120.51 113.66 3hrr n ALA 1555Ca 0.00 -0.37 -0.41 0.00 0.00 0.00 0.00 53.44 52.65 3hrr n ALA 1555Cb 0.38 -1.24 -0.02 0.00 0.00 0.00 0.00 19.45 18.57 3hrr n ALA 1555CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 3hrr s ASN 1556N -2.15 6.48 0.51 0.00 3.84 -1.07 -4.88 114.94 117.67 3hrr s ASN 1556Ca 0.36 2.83 0.21 0.00 0.21 0.00 0.00 52.86 56.47 3hrr s ASN 1556Cb 0.21 -2.63 1.29 0.00 -0.55 0.00 0.00 41.25 39.56 3hrr s ASN 1556CO 0.39 -0.83 2.03 -0.78 -2.79 0.00 0.00 177.10 175.11 3hrr h ASP 1557N 5.06 0.08 -0.05 -4.21 3.58 -1.91 -0.67 116.42 118.31 3hrr h ASP 1557Ca -0.46 0.00 0.00 0.00 0.42 0.00 0.00 57.03 56.99 3hrr h ASP 1557Cb 1.22 -0.02 0.00 0.00 1.72 0.00 0.00 39.33 42.25 3hrr h ASP 1557CO 0.80 0.05 0.00 0.59 -2.88 0.00 0.00 179.24 177.80 3hrr n ASN 1558N -4.44 1.42 -4.58 2.28 5.03 -1.26 -4.73 115.26 108.97 3hrr n ASN 1558Ca 0.07 -1.51 -0.40 0.00 0.87 0.00 0.00 54.58 53.61 3hrr n ASN 1558Cb 0.43 -0.02 -0.09 0.00 -1.02 0.00 0.00 39.78 39.09 3hrr n ASN 1558CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 3hrr s VAL 1559N -1.95 5.11 -0.57 2.41 1.01 -0.26 -5.02 120.40 121.13 3hrr s VAL 1559Ca 0.37 0.47 -0.20 0.00 0.00 0.00 0.00 61.98 62.62 3hrr s VAL 1559Cb 0.20 -3.81 0.07 0.00 0.00 0.00 0.00 36.38 32.84 3hrr s VAL 1559CO 0.32 0.01 0.75 -0.62 0.00 0.00 0.00 175.10 175.56 3hrr s ASP 1560N 1.67 6.22 0.00 3.32 -1.08 -1.26 -4.84 116.67 120.70 3hrr s ASP 1560Ca 0.16 -1.02 0.20 0.00 -0.52 0.00 0.00 52.55 51.37 3hrr s ASP 1560Cb -0.16 -2.34 1.04 0.00 -1.46 0.00 0.00 42.92 40.01 3hrr s ASP 1560CO 0.11 -1.11 1.61 2.30 0.52 0.00 0.00 175.17 178.60 3hrr n ILE 1561N 5.73 0.31 0.44 4.11 -5.35 -1.25 -1.03 119.36 122.32 3hrr n ILE 1561Ca -0.06 0.08 0.13 0.00 -0.27 0.00 0.00 62.75 62.63 3hrr n ILE 1561Cb 0.45 -0.76 0.43 0.00 -1.74 0.00 0.00 39.64 38.02 3hrr n ILE 1561CO 0.00 0.00 0.00 -0.33 -1.76 0.00 0.00 176.55 174.46 3hrr h GLU 1562N 0.00 0.00 0.00 6.28 4.39 -1.96 -3.39 114.58 119.89 3hrr h GLU 1562Ca 0.00 0.00 -0.06 0.00 0.34 0.00 0.00 59.36 59.64 3hrr h GLU 1562Cb 0.14 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.78 3hrr h GLU 1562CO 0.00 0.00 -1.20 1.63 -1.16 0.00 0.00 179.01 178.28 3hrr n LYS 1563N -2.51 0.08 -4.39 2.33 5.02 -0.39 -4.60 118.16 113.69 3hrr n LYS 1563Ca 0.04 0.03 -0.20 0.00 -2.02 0.00 0.00 58.31 56.15 3hrr n LYS 1563Cb 0.37 -0.75 -0.16 0.00 -0.02 0.00 0.00 35.03 34.48 3hrr n LYS 1563CO 0.00 0.00 0.00 1.14 -0.52 0.00 0.00 177.40 178.02 3hrr s GLN 1564N -2.07 0.99 0.03 1.97 -2.07 -0.20 -0.25 119.66 118.06 3hrr s GLN 1564Ca -0.05 -0.30 0.03 0.00 -1.82 0.00 0.00 55.36 53.22 3hrr s GLN 1564Cb 0.02 -0.92 -0.02 0.00 -1.09 0.00 0.00 33.01 31.00 3hrr s GLN 1564CO 0.07 0.11 -0.10 0.14 -1.32 0.00 0.00 175.29 174.18 3hrr s VAL 1565N 0.22 0.76 -0.19 3.63 -7.23 0.12 -3.90 120.40 113.82 3hrr s VAL 1565Ca -0.04 -0.85 -0.21 0.00 -1.81 0.00 0.00 61.98 59.07 3hrr s VAL 1565Cb -0.09 -0.73 -0.02 0.00 0.56 0.00 0.00 36.38 36.10 3hrr s VAL 1565CO 0.01 -0.09 0.66 -0.31 -0.31 0.00 0.00 175.10 175.05 3hrr s TYR 1566N -0.85 3.39 0.15 2.82 2.02 -1.26 -0.12 117.35 123.48 3hrr s TYR 1566Ca -0.02 0.98 0.10 0.00 -0.37 0.00 0.00 57.07 57.75 3hrr s TYR 1566Cb -0.07 -2.83 -0.04 0.00 -0.40 0.00 0.00 41.96 38.62 3hrr s TYR 1566CO 0.01 -0.18 -0.19 0.14 -1.57 0.00 0.00 175.55 173.76 3hrr s VAL 1567N 1.91 2.73 -0.08 0.71 -7.23 -0.30 -4.91 120.40 113.23 3hrr s VAL 1567Ca 0.30 -1.67 -0.30 0.00 -1.81 0.00 0.00 61.98 58.50 3hrr s VAL 1567Cb -0.16 -2.28 -0.02 0.00 0.56 0.00 0.00 36.38 34.48 3hrr s VAL 1567CO 0.11 0.02 1.15 0.21 -0.31 0.00 0.00 175.10 176.28 3hrr s ASN 1568N -2.36 7.09 -0.03 4.85 2.47 -1.26 -0.64 114.94 125.06 3hrr s ASN 1568Ca 0.19 1.72 0.17 0.00 0.42 0.00 0.00 52.86 55.36 3hrr s ASN 1568Cb -0.10 -2.56 -0.26 0.00 -1.45 0.00 0.00 41.25 36.89 3hrr s ASN 1568CO 0.10 -0.57 0.36 1.57 -3.72 0.00 0.00 177.10 174.84 3hrr n HIS 1569N 5.33 0.00 0.00 0.43 -0.00 -0.08 -4.90 115.22 116.01 3hrr n HIS 1569Ca 0.11 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.83 3hrr n HIS 1569Cb 0.47 -0.39 0.00 0.00 -0.00 0.00 0.00 29.99 30.07 3hrr n HIS 1569CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 3hrr n GLY 1570N 1.56 0.79 3.54 1.57 0.00 -1.18 -1.53 105.19 109.94 3hrr n GLY 1570Ca -0.03 -1.80 -0.07 0.00 0.00 0.00 0.00 46.02 44.12 3hrr n GLY 1570CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 3hrr s TRP 1571N -3.00 -0.28 0.02 1.61 -2.14 -0.91 -1.07 118.94 113.18 3hrr s TRP 1571Ca 0.00 0.15 -0.04 0.00 2.66 0.00 0.00 56.10 58.87 3hrr s TRP 1571Cb 0.00 0.54 -0.28 0.00 -3.10 0.00 0.00 33.47 30.63 3hrr s TRP 1571CO 0.00 -0.47 0.94 -0.44 -2.66 0.00 0.00 176.95 174.31 3hrr h ASP 1572N 2.00 0.41 -4.26 -2.66 3.32 -1.03 -0.70 116.42 113.50 3hrr h ASP 1572Ca -0.19 -0.53 -0.09 0.00 0.02 0.00 0.00 57.03 56.25 3hrr h ASP 1572Cb 1.22 -0.13 -0.22 0.00 0.22 0.00 0.00 39.33 40.42 3hrr h ASP 1572CO 0.29 1.43 -0.06 -0.55 -1.72 0.00 0.00 179.24 178.63 3hrr s SER 1573N -7.04 -0.53 -0.14 6.45 0.15 -0.76 -1.12 113.70 110.72 3hrr s SER 1573Ca -0.08 0.89 -0.04 0.00 0.70 0.00 0.00 55.95 57.42 3hrr s SER 1573Cb 0.07 0.91 0.07 0.00 -1.71 0.00 0.00 66.02 65.35 3hrr s SER 1573CO 0.86 -0.30 0.25 0.12 1.20 0.00 0.00 173.24 175.37 3hrr s PHE 1574N -0.18 -0.38 -0.01 3.44 5.99 -0.95 -0.69 117.98 125.20 3hrr s PHE 1574Ca -0.04 0.82 0.05 0.00 0.00 0.00 0.00 56.93 57.76 3hrr s PHE 1574Cb -0.03 -0.11 -0.01 0.00 0.00 0.00 0.00 43.02 42.86 3hrr s PHE 1574CO 0.03 -0.39 -0.15 -0.65 -0.00 0.00 0.00 175.22 174.06 3hrr s GLN 1575N 2.39 1.22 -0.12 10.12 -0.21 -0.89 -1.32 119.66 130.85 3hrr s GLN 1575Ca 0.03 -0.58 0.03 0.00 0.02 0.00 0.00 55.36 54.85 3hrr s GLN 1575Cb -0.13 -1.19 0.00 0.00 1.00 0.00 0.00 33.01 32.69 3hrr s GLN 1575CO -0.09 0.32 -0.21 0.42 -2.12 0.00 0.00 175.29 173.62 3hrr s ILE 1576N -0.42 2.28 -0.02 1.08 1.01 -1.26 -1.64 121.20 122.22 3hrr s ILE 1576Ca 0.06 -0.93 0.13 0.00 0.00 0.00 0.00 60.65 59.91 3hrr s ILE 1576Cb -0.06 -1.90 -0.21 0.00 0.01 0.00 0.00 42.46 40.30 3hrr s ILE 1576CO -0.00 0.55 0.29 -1.22 0.00 0.00 0.00 174.94 174.55 3hrr n TYR 1577N 3.72 0.00 -4.02 3.97 4.02 0.70 -4.92 117.16 120.63 3hrr n TYR 1577Ca -0.19 0.00 -0.09 0.00 -0.01 0.00 0.00 57.90 57.61 3hrr n TYR 1577Cb 0.52 -0.32 -0.11 0.00 -0.02 0.00 0.00 39.34 39.41 3hrr n TYR 1577CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 176.86 175.20 3hrr s GLN 1578N -2.91 0.41 0.33 -0.72 -1.52 -1.09 -5.00 119.66 109.17 3hrr s GLN 1578Ca -0.05 -0.79 -0.27 0.00 -1.95 0.00 0.00 55.36 52.29 3hrr s GLN 1578Cb 0.08 0.10 -0.13 0.00 -0.22 0.00 0.00 33.01 32.85 3hrr s GLN 1578CO 0.56 -0.06 1.10 -0.35 -0.25 0.00 0.00 175.29 176.29 3hrr n PRO 1579N 1.17 1.60 -2.95 2.91 -0.04 -1.26 -4.91 135.00 131.51 3hrr n PRO 1579Ca -0.21 0.56 -0.44 0.00 -0.04 0.00 0.00 63.50 63.37 3hrr n PRO 1579Cb 0.57 -2.03 -0.02 0.00 -0.04 0.00 0.00 33.50 31.97 3hrr n PRO 1579CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 3hrr s LEU 1580N -0.20 5.15 -0.11 1.53 1.43 -1.26 -5.01 118.68 120.21 3hrr s LEU 1580Ca 0.58 -2.28 -0.29 0.00 -1.03 0.00 0.00 54.13 51.11 3hrr s LEU 1580Cb -0.63 -2.39 -0.01 0.00 0.03 0.00 0.00 46.19 43.19 3hrr s LEU 1580CO 0.60 -0.97 0.99 -0.62 0.23 0.00 0.00 176.35 176.58 3hrr s ASP 1581N 3.38 7.22 0.00 2.29 -1.08 -1.26 -4.87 116.67 122.34 3hrr s ASP 1581Ca 0.34 1.49 0.19 0.00 -0.52 0.00 0.00 52.55 54.06 3hrr s ASP 1581Cb -0.05 -2.54 1.15 0.00 -1.46 0.00 0.00 42.92 40.02 3hrr s ASP 1581CO -0.08 -0.44 1.55 -0.46 0.52 0.00 0.00 175.17 176.27 3hrr n ASN 1582N 5.00 0.00 -0.75 -0.34 0.23 -1.26 -1.68 115.26 116.46 3hrr n ASN 1582Ca 0.08 -0.70 0.10 0.00 -0.53 0.00 0.00 54.58 53.53 3hrr n ASN 1582Cb 0.49 0.00 0.08 0.00 -2.08 0.00 0.00 39.78 38.26 3hrr n ASN 1582CO 0.00 0.00 0.00 -1.54 -0.93 0.00 0.00 177.26 174.79 3hrr n SER 1583N -0.96 2.56 -4.65 0.53 3.41 -1.26 -2.58 113.62 110.66 3hrr n SER 1583Ca 0.14 -1.78 -0.25 0.00 -0.26 0.00 0.00 58.87 56.72 3hrr n SER 1583Cb 0.07 0.02 -0.08 0.00 -0.26 0.00 0.00 64.21 63.96 3hrr n SER 1583CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 3hrr s LYS 1584N -1.63 2.35 0.13 4.33 1.02 -0.67 -4.62 119.74 120.65 3hrr s LYS 1584Ca 0.22 -1.21 0.06 0.00 0.02 0.00 0.00 55.97 55.05 3hrr s LYS 1584Cb 0.16 -2.29 -0.04 0.00 -0.52 0.00 0.00 37.83 35.14 3hrr s LYS 1584CO 0.25 0.42 0.02 -1.54 -0.92 0.00 0.00 175.35 173.58 3hrr s SER 1585N -3.17 5.01 0.10 2.83 1.04 -1.26 -1.21 113.70 117.04 3hrr s SER 1585Ca 0.28 -0.24 0.02 0.00 0.48 0.00 0.00 55.95 56.50 3hrr s SER 1585Cb -0.08 -1.17 -0.04 0.00 0.10 0.00 0.00 66.02 64.82 3hrr s SER 1585CO 0.19 0.13 -0.08 -0.31 0.98 0.00 0.00 173.24 174.16 3hrr s TYR 1586N -1.50 0.95 -0.16 5.02 2.02 0.14 -4.92 117.35 118.90 3hrr s TYR 1586Ca 0.27 -0.84 -0.07 0.00 -0.37 0.00 0.00 57.07 56.06 3hrr s TYR 1586Cb -0.11 -0.53 -0.04 0.00 -0.40 0.00 0.00 41.96 40.88 3hrr s TYR 1586CO 0.19 -0.10 0.09 -0.65 -1.57 0.00 0.00 175.55 173.51 3hrr s GLN 1587N -3.58 3.80 -0.08 -0.62 1.11 -0.19 -1.11 119.66 118.98 3hrr s GLN 1587Ca 0.11 -0.28 0.04 0.00 0.01 0.00 0.00 55.36 55.24 3hrr s GLN 1587Cb 0.03 -3.21 0.00 0.00 -1.01 0.00 0.00 33.01 28.82 3hrr s GLN 1587CO -0.03 0.44 -0.21 0.08 0.01 0.00 0.00 175.29 175.57 3hrr s VAL 1588N -0.08 1.82 -0.02 1.09 1.01 0.29 0.02 120.40 124.53 3hrr s VAL 1588Ca 0.08 -0.90 0.03 0.00 0.00 0.00 0.00 61.98 61.19 3hrr s VAL 1588Cb -0.12 -1.58 0.00 0.00 0.00 0.00 0.00 36.38 34.68 3hrr s VAL 1588CO 0.01 0.51 -0.09 -0.47 0.00 0.00 0.00 175.10 175.05 3hrr s TYR 1589N 0.27 0.93 -0.05 5.22 5.04 -0.51 -0.95 117.35 127.30 3hrr s TYR 1589Ca -0.14 -0.21 -0.08 0.00 -2.44 0.00 0.00 57.07 54.20 3hrr s TYR 1589Cb -0.16 -0.64 0.02 0.00 0.35 0.00 0.00 41.96 41.52 3hrr s TYR 1589CO 0.06 -0.08 0.20 -0.08 -1.34 0.00 0.00 175.55 174.32 3hrr s THR 1590N 0.07 0.03 -0.29 4.34 -1.32 -0.50 -1.45 115.64 116.52 3hrr s THR 1590Ca -0.01 -0.26 0.02 0.00 -1.21 0.00 0.00 61.69 60.22 3hrr s THR 1590Cb -0.07 -0.38 0.08 0.00 -1.51 0.00 0.00 72.50 70.62 3hrr s THR 1590CO 0.00 -0.14 0.01 -0.75 -2.21 0.00 0.00 174.62 171.53 3hrr s LYS 1591N -0.50 1.38 -0.15 7.08 2.20 -1.25 -0.42 119.74 128.08 3hrr s LYS 1591Ca -0.06 -1.31 -0.24 0.00 -0.36 0.00 0.00 55.97 54.00 3hrr s LYS 1591Cb -0.04 -2.65 -0.21 0.00 -1.51 0.00 0.00 37.83 33.42 3hrr s LYS 1591CO 0.01 -0.80 0.55 0.52 -0.36 0.00 0.00 175.35 175.26 3hrr h MET 1592N 7.87 0.00 0.00 4.03 2.86 -1.38 -3.40 114.93 124.92 3hrr h MET 1592Ca -0.12 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.52 3hrr h MET 1592Cb 1.04 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.70 3hrr h MET 1592CO 0.46 0.86 0.00 0.41 1.06 0.00 0.00 176.91 179.70 3hrr n GLY 1593N 1.59 -0.19 0.37 8.32 0.00 -1.13 -4.46 105.19 109.70 3hrr n GLY 1593Ca -0.13 -1.03 -0.13 0.00 0.00 0.00 0.00 46.02 44.72 3hrr n GLY 1593CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3hrr n GLN 1594N 0.00 0.40 0.00 1.61 1.13 -1.26 -4.85 117.38 114.40 3hrr n GLN 1594Ca 0.00 0.17 0.00 0.00 -1.94 0.00 0.00 57.00 55.23 3hrr n GLN 1594Cb 0.00 -1.18 0.00 0.00 0.11 0.00 0.00 30.24 29.17 3hrr n GLN 1594CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 3hrr n ALA 1595N -4.05 -0.05 0.00 -1.58 0.00 -1.26 -4.87 120.51 108.69 3hrr n ALA 1595Ca -0.23 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.21 3hrr n ALA 1595Cb 0.55 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.00 3hrr n ALA 1595CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 3hrr n ASN 1598N 0.00 0.00 -1.12 0.00 0.23 -1.26 -5.01 115.26 108.11 3hrr n ASN 1598Ca 0.00 0.00 0.04 0.00 -0.53 0.00 0.00 54.58 54.09 3hrr n ASN 1598Cb 0.00 -0.14 0.20 0.00 -2.08 0.00 0.00 39.78 37.76 3hrr n ASN 1598CO 0.00 0.00 0.00 -0.90 -0.93 0.00 0.00 177.26 175.43 3hrr n ASP 1599N -1.71 3.17 -4.38 0.53 5.75 -1.26 -4.94 116.55 113.72 3hrr n ASP 1599Ca 0.00 -2.38 -0.31 0.00 -0.01 0.00 0.00 54.79 52.09 3hrr n ASP 1599Cb 0.00 -0.53 -0.14 0.00 -1.03 0.00 0.00 41.12 39.42 3hrr n ASP 1599CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 3hrr s LEU 1600N -1.34 2.32 0.13 -2.12 1.43 -1.26 0.25 118.68 118.09 3hrr s LEU 1600Ca 0.28 -0.44 0.08 0.00 -1.03 0.00 0.00 54.13 53.02 3hrr s LEU 1600Cb 0.20 -1.40 -0.04 0.00 0.03 0.00 0.00 46.19 44.98 3hrr s LEU 1600CO 0.10 0.30 -0.19 0.68 0.23 0.00 0.00 176.35 177.46 3hrr s VAL 1601N -0.75 1.74 0.07 -1.59 -7.23 0.28 -4.64 120.40 108.29 3hrr s VAL 1601Ca 0.12 -1.72 -0.04 0.00 -1.81 0.00 0.00 61.98 58.52 3hrr s VAL 1601Cb -0.10 -1.69 -0.02 0.00 0.56 0.00 0.00 36.38 35.13 3hrr s VAL 1601CO 0.01 -0.19 0.07 -1.38 -0.31 0.00 0.00 175.10 173.30 3hrr s HIS 1602N -1.62 0.38 -0.08 2.82 -0.00 -1.26 -1.15 115.29 114.38 3hrr s HIS 1602Ca 0.11 -0.87 -0.31 0.00 -0.00 0.00 0.00 55.06 53.99 3hrr s HIS 1602Cb -0.08 -0.25 0.11 0.00 -0.00 0.00 0.00 32.58 32.37 3hrr s HIS 1602CO 0.05 -0.47 1.37 0.20 -0.00 0.00 0.00 174.74 175.90 3hrr s GLY 1603N -2.90 -0.27 0.10 -1.38 0.00 -0.46 -4.69 107.32 97.72 3hrr s GLY 1603Ca 0.07 0.32 0.02 0.00 0.00 0.00 0.00 44.72 45.13 3hrr s GLY 1603CO -0.10 5.16 0.20 0.99 0.00 0.00 0.00 173.10 179.36 3hrr s ASP 1604N -3.72 6.15 -0.09 1.64 1.01 -1.26 -0.50 116.67 119.90 3hrr s ASP 1604Ca 0.28 0.16 -0.01 0.00 0.71 0.00 0.00 52.55 53.69 3hrr s ASP 1604Cb 0.02 -1.83 0.03 0.00 1.01 0.00 0.00 42.92 42.15 3hrr s ASP 1604CO -0.03 0.13 -0.05 -0.69 0.21 0.00 0.00 175.17 174.74 3hrr s VAL 1605N -1.58 0.76 0.01 -1.27 1.01 -0.09 -3.90 120.40 115.35 3hrr s VAL 1605Ca 0.34 -0.13 0.02 0.00 0.00 0.00 0.00 61.98 62.21 3hrr s VAL 1605Cb -0.12 -0.83 -0.04 0.00 0.00 0.00 0.00 36.38 35.39 3hrr s VAL 1605CO 0.27 0.32 -0.01 0.54 0.00 0.00 0.00 175.10 176.22 3hrr s VAL 1606N 1.77 4.06 -0.12 2.92 0.11 -0.53 -0.32 120.40 128.29 3hrr s VAL 1606Ca 0.04 -0.67 0.03 0.00 -2.93 0.00 0.00 61.98 58.46 3hrr s VAL 1606Cb -0.13 -2.81 0.01 0.00 -1.53 0.00 0.00 36.38 31.92 3hrr s VAL 1606CO -0.07 0.36 -0.23 -0.69 -3.33 0.00 0.00 175.10 171.14 3hrr s VAL 1607N -1.09 2.05 0.21 2.04 1.01 -0.00 -1.42 120.40 123.19 3hrr s VAL 1607Ca 0.20 -0.99 0.11 0.00 0.00 0.00 0.00 61.98 61.29 3hrr s VAL 1607Cb -0.11 -1.79 -0.04 0.00 0.00 0.00 0.00 36.38 34.43 3hrr s VAL 1607CO 0.10 0.55 -0.18 -0.76 0.00 0.00 0.00 175.10 174.82 3hrr s LEU 1608N 0.63 2.67 -0.48 3.92 1.43 0.10 -0.91 118.68 126.03 3hrr s LEU 1608Ca -0.12 -0.80 0.03 0.00 -1.03 0.00 0.00 54.13 52.21 3hrr s LEU 1608Cb -0.16 -1.33 0.14 0.00 0.03 0.00 0.00 46.19 44.87 3hrr s LEU 1608CO 0.02 0.09 0.29 -0.62 0.23 0.00 0.00 176.35 176.37 3hrr s ASP 1609N -2.93 3.61 1.71 2.29 2.15 -0.10 -1.02 116.67 122.38 3hrr s ASP 1609Ca 0.24 -2.88 0.00 0.00 0.43 0.00 0.00 52.55 50.34 3hrr s ASP 1609Cb -0.08 -1.09 0.00 0.00 -0.30 0.00 0.00 42.92 41.45 3hrr s ASP 1609CO 0.13 -0.23 0.00 0.61 -0.17 0.00 0.00 175.17 175.51 3hrr n GLY 1610N 3.21 3.01 0.00 2.66 0.00 -1.26 -1.34 105.19 111.47 3hrr n GLY 1610Ca 0.12 0.05 0.13 0.00 0.00 0.00 0.00 46.02 46.33 3hrr n GLY 1610CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3hrr n GLU 1611N 9.03 0.03 -3.48 1.61 -0.58 -1.26 -4.94 120.64 121.06 3hrr n GLU 1611Ca 0.00 -0.01 -0.38 0.00 -0.42 0.00 0.00 57.16 56.35 3hrr n GLU 1611Cb 0.00 -1.50 -0.06 0.00 -0.57 0.00 0.00 31.44 29.31 3hrr n GLU 1611CO 0.00 0.00 0.00 -0.65 -0.48 0.00 0.00 177.13 176.00 3hrr s GLN 1612N -2.97 3.96 -0.19 3.49 -1.52 -0.45 -4.98 119.66 117.00 3hrr s GLN 1612Ca 0.14 0.43 -0.29 0.00 -1.95 0.00 0.00 55.36 53.69 3hrr s GLN 1612Cb 0.19 -3.24 -0.00 0.00 -0.22 0.00 0.00 33.01 29.74 3hrr s GLN 1612CO 0.58 0.65 1.08 0.42 -0.25 0.00 0.00 175.29 177.77 3hrr s ILE 1613N -0.96 4.61 -0.22 1.08 -1.09 -1.26 -0.92 121.20 122.43 3hrr s ILE 1613Ca 0.24 1.93 -0.02 0.00 -2.23 0.00 0.00 60.65 60.57 3hrr s ILE 1613Cb -0.17 -4.24 -0.13 0.00 -1.58 0.00 0.00 42.46 36.34 3hrr s ILE 1613CO 0.13 -0.13 -0.22 0.52 -1.23 0.00 0.00 174.94 174.01 3hrr n VAL 1614N 5.16 1.26 -3.62 2.92 0.31 -0.09 -4.54 118.33 119.73 3hrr n VAL 1614Ca 0.12 -0.44 -0.08 0.00 -0.01 0.00 0.00 64.34 63.93 3hrr n VAL 1614Cb 0.46 -1.42 -0.02 0.00 -0.91 0.00 0.00 33.84 31.96 3hrr n VAL 1614CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3hrr s ALA 1615N -2.43 -1.58 -0.20 3.52 0.00 -1.12 -0.22 121.76 119.72 3hrr s ALA 1615Ca -0.30 0.35 -0.09 0.00 0.00 0.00 0.00 51.96 51.92 3hrr s ALA 1615Cb 0.09 0.71 0.08 0.00 0.00 0.00 0.00 23.12 24.00 3hrr s ALA 1615CO 0.48 -0.87 0.46 0.12 0.00 0.00 0.00 175.76 175.94 3hrr s PHE 1616N -3.53 -0.79 -0.18 0.00 5.36 -0.65 -0.82 117.98 117.37 3hrr s PHE 1616Ca 0.07 1.55 -0.14 0.00 -0.96 0.00 0.00 56.93 57.45 3hrr s PHE 1616Cb -0.02 0.36 -0.04 0.00 -0.34 0.00 0.00 43.02 42.97 3hrr s PHE 1616CO -0.04 -0.45 0.31 -0.06 -1.46 0.00 0.00 175.22 173.53 3hrr s PHE 1617N 2.07 3.43 -0.21 10.12 0.08 0.57 -2.11 117.98 131.93 3hrr s PHE 1617Ca -0.06 0.58 -0.06 0.00 0.12 0.00 0.00 56.93 57.51 3hrr s PHE 1617Cb -0.10 -2.39 -0.03 0.00 -0.57 0.00 0.00 43.02 39.94 3hrr s PHE 1617CO -0.14 0.16 0.03 0.50 -0.10 0.00 0.00 175.22 175.67 3hrr s ARG 1618N 0.73 3.71 -0.93 0.44 3.52 0.14 -0.91 118.95 125.64 3hrr s ARG 1618Ca 0.17 -0.47 -0.05 0.00 -0.13 0.00 0.00 55.73 55.24 3hrr s ARG 1618Cb -0.13 -3.16 0.01 0.00 -1.56 0.00 0.00 34.95 30.10 3hrr s ARG 1618CO 0.05 0.03 0.81 0.41 -0.81 0.00 0.00 175.30 175.79 3hrr n GLY 1619N 4.22 -0.10 3.71 8.12 0.00 -1.15 -1.82 105.19 118.16 3hrr n GLY 1619Ca -0.17 -0.03 -0.43 0.00 0.00 0.00 0.00 46.02 45.39 3hrr n GLY 1619CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 3hrr n LEU 1620N -3.58 3.78 -4.15 0.99 7.94 0.35 -2.20 117.00 120.14 3hrr n LEU 1620Ca -0.04 1.11 -0.31 0.00 -1.11 0.00 0.00 56.01 55.67 3hrr n LEU 1620Cb 0.56 -1.53 -0.17 0.00 0.53 0.00 0.00 43.42 42.81 3hrr n LEU 1620CO 0.45 -0.04 -0.53 -0.89 -1.11 0.00 0.00 177.39 175.27 3hrr s THR 1621N 0.49 1.85 -0.03 1.96 2.01 -0.23 -1.36 115.64 120.33 3hrr s THR 1621Ca 0.71 -0.87 0.07 0.00 0.31 0.00 0.00 61.69 61.90 3hrr s THR 1621Cb -0.56 -1.64 -0.02 0.00 0.01 0.00 0.00 72.50 70.29 3hrr s THR 1621CO 0.42 0.51 -0.23 -0.76 -0.69 0.00 0.00 174.62 173.87 3hrr s LEU 1622N 0.69 2.22 -0.14 4.42 1.02 -0.30 -0.90 118.68 125.69 3hrr s LEU 1622Ca -0.11 -0.40 -0.02 0.00 0.02 0.00 0.00 54.13 53.61 3hrr s LEU 1622Cb -0.16 -1.39 -0.03 0.00 0.02 0.00 0.00 46.19 44.63 3hrr s LEU 1622CO 0.02 0.32 -0.06 -0.60 0.02 0.00 0.00 176.35 176.06 3hrr s ARG 1623N -0.61 3.49 -0.22 1.70 3.52 0.18 -0.56 118.95 126.46 3hrr s ARG 1623Ca 0.10 -0.55 -0.29 0.00 -0.13 0.00 0.00 55.73 54.86 3hrr s ARG 1623Cb -0.10 -2.82 -0.01 0.00 -1.56 0.00 0.00 34.95 30.45 3hrr s ARG 1623CO -0.00 0.31 1.38 0.45 -0.81 0.00 0.00 175.30 176.62 3hrr s SER 1624N 0.17 6.71 0.05 -2.12 0.15 0.14 -1.15 113.70 117.65 3hrr s SER 1624Ca -0.03 1.54 0.09 0.00 0.70 0.00 0.00 55.95 58.25 3hrr s SER 1624Cb -0.14 -2.54 -0.03 0.00 -1.71 0.00 0.00 66.02 61.60 3hrr s SER 1624CO 0.03 -0.99 -0.24 0.68 1.20 0.00 0.00 173.24 173.92 3hrr s VAL 1625N 4.21 1.93 0.23 4.45 -7.23 0.82 -4.92 120.40 119.89 3hrr s VAL 1625Ca 0.60 -1.35 -0.31 0.00 -1.81 0.00 0.00 61.98 59.12 3hrr s VAL 1625Cb -0.21 -1.67 -0.11 0.00 0.56 0.00 0.00 36.38 34.95 3hrr s VAL 1625CO 0.22 0.26 1.58 -2.84 -0.31 0.00 0.00 175.10 174.01 3hrr s PRO 1626N -1.31 4.18 0.22 4.82 0.02 -1.26 -0.70 135.00 140.96 3hrr s PRO 1626Ca 0.10 2.46 -0.09 0.00 0.02 0.00 0.00 61.00 63.49 3hrr s PRO 1626Cb -0.09 -3.09 0.22 0.00 0.02 0.00 0.00 34.50 31.56 3hrr s PRO 1626CO 0.02 -0.61 1.85 -0.09 -0.33 0.00 0.00 177.00 177.85 3hrr h ARG 1627N 5.91 0.87 -0.02 5.54 9.65 -0.89 0.68 114.38 136.12 3hrr h ARG 1627Ca -0.45 -0.05 -0.03 0.00 -1.10 0.00 0.00 59.98 58.35 3hrr h ARG 1627Cb 1.21 -0.20 0.00 0.00 -1.39 0.00 0.00 29.97 29.60 3hrr h ARG 1627CO 0.86 0.58 -0.11 0.78 2.80 0.00 0.00 179.97 184.88 3hrr h GLY 1628N 0.90 0.12 1.86 2.80 0.00 -1.81 -2.42 103.07 104.51 3hrr h GLY 1628Ca 0.31 -0.17 -0.03 0.00 0.00 0.00 0.00 47.33 47.43 3hrr h GLY 1628CO -0.12 0.15 -0.06 0.00 0.00 0.00 0.00 176.54 176.51 3hrr h ALA 1629N 0.34 1.67 -0.57 3.60 0.00 -1.93 -1.52 119.26 120.85 3hrr h ALA 1629Ca -0.01 -0.13 0.02 0.00 0.00 0.00 0.00 54.91 54.79 3hrr h ALA 1629Cb 0.79 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.47 3hrr h ALA 1629CO 0.02 0.25 0.35 1.25 0.00 0.00 0.00 179.25 181.12 3hrr h LEU 1630N 0.18 0.59 0.11 0.00 6.46 -0.82 -1.60 115.31 120.23 3hrr h LEU 1630Ca 0.04 -0.00 0.01 0.00 -0.12 0.00 0.00 57.88 57.81 3hrr h LEU 1630Cb 0.23 -0.13 -0.02 0.00 -0.73 0.00 0.00 40.66 40.02 3hrr h LEU 1630CO 0.01 0.41 -0.14 -0.09 -0.62 0.00 0.00 178.44 178.01 3hrr h ARG 1631N 0.71 -0.28 0.02 1.25 2.43 -0.83 -1.54 114.38 116.14 3hrr h ARG 1631Ca 0.22 0.02 0.03 0.00 -0.81 0.00 0.00 59.98 59.44 3hrr h ARG 1631Cb -0.01 0.06 -0.05 0.00 -0.42 0.00 0.00 29.97 29.56 3hrr h ARG 1631CO -0.09 -0.19 -0.32 0.28 -1.51 0.00 0.00 179.97 178.14 3hrr h VAL 1632N -0.29 0.30 -0.63 0.20 2.07 -1.19 -1.63 116.25 115.08 3hrr h VAL 1632Ca 0.01 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.53 3hrr h VAL 1632Cb 0.30 0.30 -0.03 0.00 -1.52 0.00 0.00 31.29 30.34 3hrr h VAL 1632CO -0.06 0.00 0.39 0.58 0.02 0.00 0.00 177.57 178.50 3hrr h VAL 1633N -0.49 1.18 -0.09 2.57 2.07 -1.13 0.11 116.25 120.46 3hrr h VAL 1633Ca 0.05 -0.38 -0.03 0.00 0.82 0.00 0.00 66.70 67.16 3hrr h VAL 1633Cb 0.57 0.29 -0.01 0.00 -1.52 0.00 0.00 31.29 30.62 3hrr h VAL 1633CO -0.25 0.18 -0.09 -0.07 0.02 0.00 0.00 177.57 177.36 3hrr h LEU 1634N 0.86 0.12 0.00 2.57 -0.00 -1.07 -1.93 115.31 115.86 3hrr h LEU 1634Ca 0.23 -0.02 0.00 0.00 -0.00 0.00 0.00 57.88 58.09 3hrr h LEU 1634Cb -0.04 -0.03 0.00 0.00 -0.00 0.00 0.00 40.66 40.58 3hrr h LEU 1634CO -0.04 0.23 -0.50 0.00 -0.00 0.00 0.00 178.44 178.13 3hrr n GLN 1635N -4.36 0.06 0.00 1.13 6.02 -0.63 -5.07 117.38 114.54 3hrr n GLN 1635Ca -0.01 0.02 0.16 0.00 -0.01 0.00 0.00 57.00 57.15 3hrr n GLN 1635Cb 0.21 -1.54 0.85 0.00 1.02 0.00 0.00 30.24 30.78 3hrr n GLN 1635CO 0.00 0.00 0.00 2.41 -1.01 0.00 0.00 177.06 178.46