#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hqc s THR 1265N 0.00 4.09 0.14 0.44 -4.23 -1.26 -4.86 115.64 109.95 3hqc s THR 1265Ca 0.00 0.68 -0.25 0.00 -1.18 0.00 0.00 61.69 60.94 3hqc s THR 1265Cb 0.00 -3.52 -0.02 0.00 1.34 0.00 0.00 72.50 70.30 3hqc s THR 1265CO 0.00 -0.89 1.62 0.00 -0.54 0.00 0.00 174.62 174.81 3hqc h ALA 1266N -0.63 -0.32 -0.40 3.99 0.00 -2.05 0.20 119.26 120.06 3hqc h ALA 1266Ca -0.44 0.03 -0.10 0.00 0.00 0.00 0.00 54.91 54.40 3hqc h ALA 1266Cb 1.21 0.55 -0.02 0.00 0.00 0.00 0.00 17.79 19.54 3hqc h ALA 1266CO 0.59 -0.76 -0.15 0.00 0.00 0.00 0.00 179.25 178.93 3hqc h ALA 1267N 0.50 1.00 -0.19 0.00 0.00 -1.99 0.68 119.26 119.26 3hqc h ALA 1267Ca 0.10 -0.33 -0.07 0.00 0.00 0.00 0.00 54.91 54.61 3hqc h ALA 1267Cb 0.51 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.14 3hqc h ALA 1267CO -0.33 0.60 -0.15 0.38 0.00 0.00 0.00 179.25 179.75 3hqc h ASP 1268N 0.65 0.46 -0.27 0.00 3.04 -1.88 -1.81 116.42 116.62 3hqc h ASP 1268Ca 0.11 -0.45 0.05 0.00 -3.24 0.00 0.00 57.03 53.49 3hqc h ASP 1268Cb 0.62 -0.13 -0.05 0.00 -1.04 0.00 0.00 39.33 38.74 3hqc h ASP 1268CO 0.04 0.82 -0.02 -0.07 -2.04 0.00 0.00 179.24 177.97 3hqc h LEU 1269N 0.12 -0.14 -1.34 0.15 3.38 -0.67 -1.73 115.31 115.08 3hqc h LEU 1269Ca 0.04 0.07 -0.02 0.00 0.09 0.00 0.00 57.88 58.05 3hqc h LEU 1269Cb 0.67 0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.52 3hqc h LEU 1269CO 0.04 -0.04 0.19 -0.07 0.09 0.00 0.00 178.44 178.65 3hqc h LEU 1270N 0.06 0.58 -1.62 1.67 3.38 -0.77 0.10 115.31 118.72 3hqc h LEU 1270Ca 0.13 -0.06 -0.04 0.00 0.09 0.00 0.00 57.88 58.00 3hqc h LEU 1270Cb 0.18 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 3hqc h LEU 1270CO -0.23 0.52 -0.21 0.03 0.09 0.00 0.00 178.44 178.64 3hqc h ARG 1271N 0.65 0.00 0.00 1.13 3.08 -0.60 -2.11 114.38 116.52 3hqc h ARG 1271Ca 0.16 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.21 3hqc h ARG 1271Cb 0.12 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.17 3hqc h ARG 1271CO -0.02 0.21 0.00 1.96 -1.07 0.00 0.00 179.97 181.05 3hqc h GLN 1272N 0.00 0.00 0.00 0.04 1.08 0.06 -2.75 115.11 113.54 3hqc h GLN 1272Ca -0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 3hqc h GLN 1272Cb 0.40 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.83 3hqc h GLN 1272CO 0.03 0.00 0.00 0.41 -0.95 0.00 0.00 178.83 178.32 3hqc n GLY 1273N -0.12 0.37 3.24 3.46 0.00 -0.80 -4.66 105.19 106.68 3hqc n GLY 1273Ca 0.01 -0.90 -0.29 0.00 0.00 0.00 0.00 46.02 44.84 3hqc n GLY 1273CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hqc s ALA 1274N -1.72 1.95 0.03 4.61 0.00 -0.49 -4.97 121.76 121.16 3hqc s ALA 1274Ca 0.00 -0.96 0.06 0.00 0.00 0.00 0.00 51.96 51.06 3hqc s ALA 1274Cb 0.00 -0.57 -0.02 0.00 0.00 0.00 0.00 23.12 22.53 3hqc s ALA 1274CO 0.00 0.41 -0.17 0.00 0.00 0.00 0.00 175.76 176.00 3hqc s ALA 1275N -0.28 1.45 0.32 0.00 0.00 -1.26 -0.85 121.76 121.15 3hqc s ALA 1275Ca 0.01 -0.88 -0.13 0.00 0.00 0.00 0.00 51.96 50.96 3hqc s ALA 1275Cb -0.11 -0.29 0.02 0.00 0.00 0.00 0.00 23.12 22.74 3hqc s ALA 1275CO 0.02 0.32 0.63 0.00 0.00 0.00 0.00 175.76 176.73 3hqc s SER 1277N -3.07 6.93 0.13 0.00 0.01 -1.26 0.05 113.70 116.49 3hqc s SER 1277Ca 0.20 1.12 -0.05 0.00 1.31 0.00 0.00 55.95 58.52 3hqc s SER 1277Cb -0.03 -2.31 -0.02 0.00 0.21 0.00 0.00 66.02 63.87 3hqc s SER 1277CO 0.12 0.28 0.15 0.68 0.41 0.00 0.00 173.24 174.88 3hqc s VAL 1278N -1.13 0.11 -0.04 3.43 -7.23 -0.54 -4.37 120.40 110.63 3hqc s VAL 1278Ca 0.28 -1.60 -0.20 0.00 -1.81 0.00 0.00 61.98 58.64 3hqc s VAL 1278Cb -0.18 -1.81 -0.05 0.00 0.56 0.00 0.00 36.38 34.90 3hqc s VAL 1278CO 0.17 -0.49 0.59 -0.76 -0.31 0.00 0.00 175.10 174.30 3hqc s LEU 1279N -2.98 4.37 -0.45 1.32 1.43 -0.40 -0.75 118.68 121.22 3hqc s LEU 1279Ca 0.17 1.10 -0.18 0.00 -1.03 0.00 0.00 54.13 54.18 3hqc s LEU 1279Cb 0.06 -2.90 0.04 0.00 0.03 0.00 0.00 46.19 43.41 3hqc s LEU 1279CO -0.02 0.05 0.53 -0.47 0.23 0.00 0.00 176.35 176.66 3hqc s TYR 1280N 0.13 3.12 -0.14 0.29 6.04 0.57 -1.33 117.35 126.03 3hqc s TYR 1280Ca 0.31 -0.41 -0.16 0.00 0.04 0.00 0.00 57.07 56.86 3hqc s TYR 1280Cb -0.17 -3.19 -0.14 0.00 -1.04 0.00 0.00 41.96 37.42 3hqc s TYR 1280CO 0.16 -0.84 0.33 -0.07 -1.54 0.00 0.00 175.55 173.59 3hqc h LEU 1281N 9.35 0.00 -7.62 6.97 3.38 -0.98 -3.30 115.31 123.10 3hqc h LEU 1281Ca -0.27 -0.48 0.22 0.00 0.09 0.00 0.00 57.88 57.44 3hqc h LEU 1281Cb 1.10 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 41.77 3hqc h LEU 1281CO 0.87 0.87 0.60 0.28 0.09 0.00 0.00 178.44 181.15 3hqc s THR 1282N -2.01 0.00 -0.02 0.22 -1.32 -1.15 -4.93 115.64 106.43 3hqc s THR 1282Ca -0.13 -0.53 0.02 0.00 -1.21 0.00 0.00 61.69 59.83 3hqc s THR 1282Cb -0.00 -2.20 0.01 0.00 -1.51 0.00 0.00 72.50 68.80 3hqc s THR 1282CO 0.39 0.00 -0.06 -0.55 -2.21 0.00 0.00 174.62 172.19 3hqc s SER 1283N -3.07 0.87 -0.02 8.08 0.15 -1.26 -0.86 113.70 117.60 3hqc s SER 1283Ca 0.15 -0.13 0.01 0.00 0.70 0.00 0.00 55.95 56.68 3hqc s SER 1283Cb -0.00 -0.25 0.01 0.00 -1.71 0.00 0.00 66.02 64.07 3hqc s SER 1283CO 0.01 0.03 -0.04 -0.69 1.20 0.00 0.00 173.24 173.76 3hqc s VAL 1284N 0.30 0.36 0.27 4.45 1.01 -0.44 -4.98 120.40 121.37 3hqc s VAL 1284Ca -0.04 -0.11 -0.29 0.00 0.00 0.00 0.00 61.98 61.53 3hqc s VAL 1284Cb -0.08 -0.36 -0.10 0.00 0.00 0.00 0.00 36.38 35.85 3hqc s VAL 1284CO -0.00 0.14 1.27 -0.70 0.00 0.00 0.00 175.10 175.81 3hqc s GLU 1285N 0.39 4.42 -0.40 2.72 2.12 -1.26 -0.64 118.70 126.06 3hqc s GLU 1285Ca -0.04 2.08 0.09 0.00 0.36 0.00 0.00 54.97 57.45 3hqc s GLU 1285Cb -0.08 -3.14 0.27 0.00 0.26 0.00 0.00 34.13 31.44 3hqc s GLU 1285CO -0.00 -0.14 0.57 0.25 -0.54 0.00 0.00 175.26 175.40 3hqc n THR 1286N 1.59 -0.48 -2.72 -1.70 -2.24 -0.26 -4.89 114.28 103.58 3hqc n THR 1286Ca 0.02 -4.16 -0.37 0.00 -2.27 0.00 0.00 64.05 57.27 3hqc n THR 1286Cb 0.43 -1.65 -0.06 0.00 -2.10 0.00 0.00 70.33 66.94 3hqc n THR 1286CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 3hqc s GLU 1287N -1.46 4.53 -1.62 -0.78 0.41 -1.26 -4.10 118.70 114.42 3hqc s GLU 1287Ca 0.36 1.40 0.00 0.00 -0.41 0.00 0.00 54.97 56.32 3hqc s GLU 1287Cb 0.20 -2.81 0.00 0.00 -1.78 0.00 0.00 34.13 29.75 3hqc s GLU 1287CO -0.10 0.22 0.00 0.43 -0.49 0.00 0.00 175.26 175.31 3hqc n SER 1288N 0.54 -5.26 -4.60 -0.19 7.64 -1.26 -4.98 113.62 105.52 3hqc n SER 1288Ca 0.02 0.10 -0.30 0.00 1.01 0.00 0.00 58.87 59.70 3hqc n SER 1288Cb 0.49 -4.44 -0.10 0.00 -1.01 0.00 0.00 64.21 59.16 3hqc n SER 1288CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 3hqc s LEU 1289N -5.71 3.12 0.97 -3.43 1.43 -1.26 -5.13 118.68 108.67 3hqc s LEU 1289Ca 0.00 -0.34 -0.12 0.00 -1.03 0.00 0.00 54.13 52.64 3hqc s LEU 1289Cb 0.00 -1.90 0.17 0.00 0.03 0.00 0.00 46.19 44.50 3hqc s LEU 1289CO 0.00 0.18 1.08 0.42 0.23 0.00 0.00 176.35 178.26 3hqc s THR 1290N -1.23 2.37 0.11 5.49 -4.23 -1.26 -4.75 115.64 112.14 3hqc s THR 1290Ca 0.22 0.12 -0.27 0.00 -1.18 0.00 0.00 61.69 60.58 3hqc s THR 1290Cb -0.11 -2.42 -0.09 0.00 1.34 0.00 0.00 72.50 71.22 3hqc s THR 1290CO 0.14 -0.15 1.65 1.23 -0.54 0.00 0.00 174.62 176.94 3hqc h GLY 1291N -1.90 -0.47 0.89 3.99 0.00 -1.99 0.01 103.07 103.60 3hqc h GLY 1291Ca -0.52 0.28 0.06 0.00 0.00 0.00 0.00 47.33 47.16 3hqc h GLY 1291CO 0.51 -0.21 0.57 -2.55 0.00 0.00 0.00 176.54 174.86 3hqc h PRO 1292N -0.46 0.96 -0.88 4.80 0.11 -1.97 -1.56 132.00 133.00 3hqc h PRO 1292Ca 0.02 -0.06 -0.02 0.00 0.11 0.00 0.00 66.00 66.05 3hqc h PRO 1292Cb 0.47 -0.22 -0.04 0.00 0.11 0.00 0.00 31.00 31.32 3hqc h PRO 1292CO -0.12 0.64 0.47 1.96 -0.21 0.00 0.00 178.00 180.73 3hqc h GLN 1293N 0.99 1.23 0.09 1.05 4.20 -1.80 -0.82 115.11 120.05 3hqc h GLN 1293Ca 0.38 -0.15 -0.00 0.00 0.06 0.00 0.00 58.65 58.93 3hqc h GLN 1293Cb 0.20 -0.24 0.00 0.00 0.30 0.00 0.00 27.48 27.74 3hqc h GLN 1293CO -0.14 0.91 -0.04 0.00 -0.67 0.00 0.00 178.83 178.89 3hqc h ALA 1294N 1.28 -0.13 -0.73 3.87 0.00 -0.15 0.41 119.26 123.81 3hqc h ALA 1294Ca 0.31 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 55.14 3hqc h ALA 1294Cb 0.05 0.05 -0.03 0.00 0.00 0.00 0.00 17.79 17.85 3hqc h ALA 1294CO -0.05 -0.54 0.35 0.28 0.00 0.00 0.00 179.25 179.29 3hqc h VAL 1295N -0.18 1.24 -0.86 0.00 2.07 -1.22 -1.67 116.25 115.62 3hqc h VAL 1295Ca -0.01 -0.67 -0.01 0.00 0.82 0.00 0.00 66.70 66.82 3hqc h VAL 1295Cb 0.14 0.33 -0.04 0.00 -1.52 0.00 0.00 31.29 30.20 3hqc h VAL 1295CO 0.02 0.28 0.51 0.00 0.02 0.00 0.00 177.57 178.40 3hqc h ALA 1296N 1.17 1.27 -0.20 1.67 0.00 -0.92 -1.28 119.26 120.97 3hqc h ALA 1296Ca 0.25 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 3hqc h ALA 1296Cb 0.12 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 3hqc h ALA 1296CO -0.03 0.62 0.09 -0.09 0.00 0.00 0.00 179.25 179.84 3hqc h ARG 1297N 1.19 0.29 -0.41 0.00 9.65 -0.50 -1.34 114.38 123.27 3hqc h ARG 1297Ca 0.31 -0.04 0.00 0.00 -1.10 0.00 0.00 59.98 59.14 3hqc h ARG 1297Cb -0.03 -0.05 -0.02 0.00 -1.39 0.00 0.00 29.97 28.48 3hqc h ARG 1297CO -0.06 0.32 0.26 0.00 2.80 0.00 0.00 179.97 183.29 3hqc h ALA 1298N 0.96 0.52 -0.82 2.80 0.00 -1.07 -2.02 119.26 119.63 3hqc h ALA 1298Ca 0.07 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 3hqc h ALA 1298Cb 0.13 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.71 3hqc h ALA 1298CO -0.01 -0.00 0.42 0.77 0.00 0.00 0.00 179.25 180.43 3hqc h SER 1299N 0.55 1.04 -0.66 0.00 0.02 -1.13 -0.38 113.55 112.99 3hqc h SER 1299Ca 0.15 -0.10 -0.01 0.00 -0.84 0.00 0.00 61.79 60.99 3hqc h SER 1299Cb -0.03 -0.27 -0.03 0.00 0.14 0.00 0.00 62.40 62.21 3hqc h SER 1299CO -0.03 0.85 0.38 0.28 -1.14 0.00 0.00 176.83 177.17 3hqc h SER 1300N 1.15 0.81 -0.24 3.07 0.02 -0.96 -0.36 113.55 117.05 3hqc h SER 1300Ca 0.29 -0.08 -0.01 0.00 -0.84 0.00 0.00 61.79 61.14 3hqc h SER 1300Cb 0.07 -0.20 -0.01 0.00 0.14 0.00 0.00 62.40 62.39 3hqc h SER 1300CO -0.04 0.65 0.10 0.00 -1.14 0.00 0.00 176.83 176.41 3hqc h ALA 1301N 1.19 0.31 -0.64 3.77 0.00 -1.03 -1.29 119.26 121.57 3hqc h ALA 1301Ca 0.23 -0.11 -0.06 0.00 0.00 0.00 0.00 54.91 54.98 3hqc h ALA 1301Cb 0.01 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.68 3hqc h ALA 1301CO -0.04 -0.10 0.18 0.00 0.00 0.00 0.00 179.25 179.28 3hqc h ALA 1302N 0.95 0.84 0.00 0.00 0.00 -0.81 -2.39 119.26 117.86 3hqc h ALA 1302Ca 0.08 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.77 3hqc h ALA 1302Cb 0.16 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.70 3hqc h ALA 1302CO -0.01 0.54 0.00 -0.07 0.00 0.00 0.00 179.25 179.71 3hqc h LEU 1303N 0.93 0.00 0.00 0.00 3.38 -0.92 -3.14 115.31 115.57 3hqc h LEU 1303Ca 0.20 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.17 3hqc h LEU 1303Cb 0.33 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.08 3hqc h LEU 1303CO -0.00 0.00 -0.95 -1.54 0.09 0.00 0.00 178.44 176.03 3hqc n SER 1304N -2.68 0.63 -4.71 -0.43 3.41 -0.50 -4.98 113.62 104.35 3hqc n SER 1304Ca 0.04 -0.13 -0.30 0.00 -0.26 0.00 0.00 58.87 58.22 3hqc n SER 1304Cb 0.41 0.67 0.14 0.00 -0.26 0.00 0.00 64.21 65.17 3hqc n SER 1304CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3hqc n SER 1306N -3.93 0.00 -4.55 0.00 2.88 -1.26 -5.07 113.62 101.70 3hqc n SER 1306Ca 0.07 0.05 -0.35 0.00 -1.33 0.00 0.00 58.87 57.31 3hqc n SER 1306Cb 0.55 0.00 -0.11 0.00 -0.75 0.00 0.00 64.21 63.90 3hqc n SER 1306CO 0.00 0.00 0.00 -0.89 -1.23 0.00 0.00 175.04 172.92 3hqc s THR 1310N -0.10 4.37 0.61 2.46 2.01 -1.26 -5.18 115.64 118.55 3hqc s THR 1310Ca 0.00 -0.18 -0.19 0.00 0.31 0.00 0.00 61.69 61.63 3hqc s THR 1310Cb 0.00 -2.97 -0.03 0.00 0.01 0.00 0.00 72.50 69.52 3hqc s THR 1310CO 0.00 0.45 1.29 -2.84 -0.69 0.00 0.00 174.62 172.83 3hqc s PRO 1311N 0.62 2.80 0.33 4.92 0.02 -1.26 -4.99 135.00 137.43 3hqc s PRO 1311Ca 0.01 2.06 -0.25 0.00 0.02 0.00 0.00 61.00 62.85 3hqc s PRO 1311Cb -0.14 -1.98 -0.10 0.00 0.02 0.00 0.00 34.50 32.31 3hqc s PRO 1311CO 0.02 -1.40 0.92 0.00 -0.33 0.00 0.00 177.00 176.21 3hqc s ALA 1312N -1.41 3.21 -0.13 -1.55 0.00 -1.25 -4.83 121.76 115.81 3hqc s ALA 1312Ca 0.79 0.46 -0.26 0.00 0.00 0.00 0.00 51.96 52.94 3hqc s ALA 1312Cb -0.37 -3.14 -0.02 0.00 0.00 0.00 0.00 23.12 19.60 3hqc s ALA 1312CO 0.40 0.19 0.87 0.08 0.00 0.00 0.00 175.76 177.30 3hqc s VAL 1313N -1.69 4.88 0.22 0.00 1.01 -1.26 -0.31 120.40 123.24 3hqc s VAL 1313Ca 0.51 1.74 0.11 0.00 0.00 0.00 0.00 61.98 64.34 3hqc s VAL 1313Cb -0.17 -4.18 -0.05 0.00 0.00 0.00 0.00 36.38 31.98 3hqc s VAL 1313CO 0.22 0.06 -0.21 0.68 0.00 0.00 0.00 175.10 175.85 3hqc s VAL 1314N 1.85 2.24 -0.11 2.92 -7.23 0.07 -4.88 120.40 115.26 3hqc s VAL 1314Ca 0.42 -2.14 -0.25 0.00 -1.81 0.00 0.00 61.98 58.19 3hqc s VAL 1314Cb -0.17 -2.12 -0.03 0.00 0.56 0.00 0.00 36.38 34.62 3hqc s VAL 1314CO 0.16 -0.29 0.79 -2.28 -0.31 0.00 0.00 175.10 173.17 3hqc s HIS 1315N -2.12 3.51 -0.25 2.82 2.46 0.42 -1.47 115.29 120.66 3hqc s HIS 1315Ca 0.23 1.29 0.02 0.00 0.47 0.00 0.00 55.06 57.07 3hqc s HIS 1315Cb -0.06 -2.93 0.06 0.00 -0.13 0.00 0.00 32.58 29.52 3hqc s HIS 1315CO 0.11 -0.08 -0.11 0.12 -2.47 0.00 0.00 174.74 172.31 3hqc s PHE 1316N 1.46 3.08 -0.13 3.88 5.36 0.11 -1.51 117.98 130.23 3hqc s PHE 1316Ca 0.39 -2.18 -0.01 0.00 -0.96 0.00 0.00 56.93 54.17 3hqc s PHE 1316Cb -0.18 -1.87 -0.02 0.00 -0.34 0.00 0.00 43.02 40.62 3hqc s PHE 1316CO 0.16 -0.86 -0.11 0.21 -1.46 0.00 0.00 175.22 173.17 3hqc s LYS 1317N 1.16 3.37 -0.14 10.12 2.20 0.01 -1.13 119.74 135.35 3hqc s LYS 1317Ca -0.08 -0.65 0.02 0.00 -0.36 0.00 0.00 55.97 54.91 3hqc s LYS 1317Cb -0.19 -2.67 0.01 0.00 -1.51 0.00 0.00 37.83 33.47 3hqc s LYS 1317CO -0.06 0.26 -0.21 0.54 -0.36 0.00 0.00 175.35 175.52 3hqc s VAL 1318N 0.25 1.97 0.29 4.02 0.11 -0.03 -0.94 120.40 126.07 3hqc s VAL 1318Ca -0.08 -0.92 0.03 0.00 -2.93 0.00 0.00 61.98 58.08 3hqc s VAL 1318Cb -0.15 -1.75 -0.01 0.00 -1.53 0.00 0.00 36.38 32.94 3hqc s VAL 1318CO 0.05 0.53 0.33 -1.54 -3.33 0.00 0.00 175.10 171.14 3hqc n SER 1319N 4.10 -0.88 -0.02 3.54 3.41 -0.28 -1.40 113.62 122.09 3hqc n SER 1319Ca -0.20 -2.76 0.22 0.00 -0.26 0.00 0.00 58.87 55.87 3hqc n SER 1319Cb 0.51 1.79 0.71 0.00 -0.26 0.00 0.00 64.21 66.97 3hqc n SER 1319CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3hqc h ALA 1320N 1.93 2.52 -0.01 7.33 0.00 -1.79 -1.78 119.26 127.46 3hqc h ALA 1320Ca -0.22 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.67 3hqc h ALA 1320Cb 1.02 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.86 3hqc h ALA 1320CO 0.30 -0.74 -0.10 1.04 0.00 0.00 0.00 179.25 179.75 3hqc n GLN 1321N -4.27 0.90 0.00 0.00 1.13 -1.26 -4.80 117.38 109.08 3hqc n GLN 1321Ca 0.11 -0.36 0.00 0.00 -1.94 0.00 0.00 57.00 54.81 3hqc n GLN 1321Cb 0.68 -1.49 0.00 0.00 0.11 0.00 0.00 30.24 29.53 3hqc n GLN 1321CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3hqc n GLY 1322N 1.24 0.22 3.39 1.08 0.00 -0.67 -3.41 105.19 107.04 3hqc n GLY 1322Ca 0.16 -1.93 -0.33 0.00 0.00 0.00 0.00 46.02 43.92 3hqc n GLY 1322CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3hqc s ILE 1323N 0.00 2.93 -0.10 -0.61 1.01 -0.12 -1.12 121.20 123.19 3hqc s ILE 1323Ca 0.00 -0.73 0.03 0.00 0.00 0.00 0.00 60.65 59.95 3hqc s ILE 1323Cb 0.00 -2.19 0.01 0.00 0.01 0.00 0.00 42.46 40.29 3hqc s ILE 1323CO 0.00 0.55 -0.18 -0.89 0.00 0.00 0.00 174.94 174.42 3hqc s THR 1324N -0.04 1.64 -0.15 2.92 2.01 -0.12 -0.21 115.64 121.69 3hqc s THR 1324Ca -0.04 -0.76 -0.01 0.00 0.31 0.00 0.00 61.69 61.19 3hqc s THR 1324Cb -0.14 -1.46 -0.01 0.00 0.01 0.00 0.00 72.50 70.89 3hqc s THR 1324CO 0.04 0.47 -0.11 -0.76 -0.69 0.00 0.00 174.62 173.57 3hqc s LEU 1325N 0.65 2.76 0.05 4.42 1.43 0.02 -0.81 118.68 127.21 3hqc s LEU 1325Ca -0.13 -0.34 0.00 0.00 -1.03 0.00 0.00 54.13 52.63 3hqc s LEU 1325Cb -0.16 -1.64 -0.03 0.00 0.03 0.00 0.00 46.19 44.38 3hqc s LEU 1325CO 0.04 0.13 -0.04 0.42 0.23 0.00 0.00 176.35 177.12 3hqc s THR 1326N 0.59 0.35 -0.21 5.49 -4.23 -0.57 -1.46 115.64 115.61 3hqc s THR 1326Ca -0.07 -1.54 -0.20 0.00 -1.18 0.00 0.00 61.69 58.71 3hqc s THR 1326Cb -0.15 -1.15 0.05 0.00 1.34 0.00 0.00 72.50 72.59 3hqc s THR 1326CO 0.03 -0.77 0.56 -0.62 -0.54 0.00 0.00 174.62 173.28 3hqc s ASP 1327N -2.44 -0.58 -0.01 3.99 2.15 -0.64 -0.44 116.67 118.70 3hqc s ASP 1327Ca 0.01 1.11 0.03 0.00 0.43 0.00 0.00 52.55 54.12 3hqc s ASP 1327Cb 0.01 1.13 -0.00 0.00 -0.30 0.00 0.00 42.92 43.75 3hqc s ASP 1327CO -0.05 -0.20 -0.09 0.21 -0.17 0.00 0.00 175.17 174.86 3hqc s ASN 1328N 0.25 1.11 -0.25 -0.34 3.84 -1.26 -0.14 114.94 118.15 3hqc s ASN 1328Ca -0.00 -0.17 -0.01 0.00 0.21 0.00 0.00 52.86 52.88 3hqc s ASN 1328Cb -0.04 -0.20 0.08 0.00 -0.55 0.00 0.00 41.25 40.54 3hqc s ASN 1328CO 0.01 0.09 0.04 0.00 -2.79 0.00 0.00 177.10 174.46 3hqc s GLN 1329N -0.04 0.85 7.56 0.43 0.00 -0.57 -5.00 119.66 122.88 3hqc s GLN 1329Ca 0.01 -0.79 0.00 0.00 -0.00 0.00 0.00 55.36 54.58 3hqc s GLN 1329Cb -0.06 -2.15 0.00 0.00 0.00 0.00 0.00 33.01 30.80 3hqc s GLN 1329CO -0.00 -0.78 0.00 2.89 0.00 0.00 0.00 175.29 177.40 3hqc n ARG 1330N 4.90 0.00 -0.13 9.60 -4.01 -1.26 -1.38 116.66 124.38 3hqc n ARG 1330Ca -0.07 0.00 0.09 0.00 -1.04 0.00 0.00 57.85 56.84 3hqc n ARG 1330Cb 0.44 0.00 0.16 0.00 -3.04 0.00 0.00 32.46 30.02 3hqc n ARG 1330CO 0.00 0.00 0.00 1.63 -3.04 0.00 0.00 177.63 176.22 3hqc n LYS 1331N 10.85 2.11 -2.80 2.89 5.02 -1.26 -4.93 118.16 130.05 3hqc n LYS 1331Ca 0.00 -1.97 -0.40 0.00 -2.02 0.00 0.00 58.31 53.92 3hqc n LYS 1331Cb 0.00 -1.40 -0.06 0.00 -0.02 0.00 0.00 35.03 33.56 3hqc n LYS 1331CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3hqc s LEU 1332N -1.30 4.61 -0.02 -0.35 1.43 -0.48 -5.06 118.68 117.52 3hqc s LEU 1332Ca 0.29 1.85 -0.00 0.00 -1.03 0.00 0.00 54.13 55.24 3hqc s LEU 1332Cb 0.17 -3.54 0.03 0.00 0.03 0.00 0.00 46.19 42.89 3hqc s LEU 1332CO 0.24 0.13 0.03 0.12 0.23 0.00 0.00 176.35 177.10 3hqc s PHE 1333N -0.97 0.09 -0.10 0.29 5.36 -1.26 -1.51 117.98 119.88 3hqc s PHE 1333Ca 0.41 0.12 -0.01 0.00 -0.96 0.00 0.00 56.93 56.49 3hqc s PHE 1333Cb -0.25 -0.30 -0.03 0.00 -0.34 0.00 0.00 43.02 42.11 3hqc s PHE 1333CO 0.30 -0.11 -0.06 0.12 -1.46 0.00 0.00 175.22 174.01 3hqc s PHE 1334N 1.19 2.96 -0.19 10.12 5.36 0.80 -4.99 117.98 133.23 3hqc s PHE 1334Ca -0.08 -0.11 -0.13 0.00 -0.96 0.00 0.00 56.93 55.66 3hqc s PHE 1334Cb -0.13 -1.79 0.06 0.00 -0.34 0.00 0.00 43.02 40.82 3hqc s PHE 1334CO -0.03 0.20 0.47 0.50 -1.46 0.00 0.00 175.22 174.90 3hqc s ARG 1335N -0.41 0.49 -0.00 10.12 3.52 -1.26 -1.63 118.95 129.78 3hqc s ARG 1335Ca 0.06 0.81 0.00 0.00 -0.13 0.00 0.00 55.73 56.47 3hqc s ARG 1335Cb -0.12 0.10 0.00 0.00 -1.56 0.00 0.00 34.95 33.37 3hqc s ARG 1335CO 0.02 -0.13 -0.00 1.03 -0.81 0.00 0.00 175.30 175.41 3hqc s ARG 1336N 1.05 0.06 -0.04 5.12 1.81 -0.53 -5.02 118.95 121.40 3hqc s ARG 1336Ca -0.06 0.01 0.06 0.00 -1.72 0.00 0.00 55.73 54.01 3hqc s ARG 1336Cb -0.06 -0.10 -0.02 0.00 -0.45 0.00 0.00 34.95 34.32 3hqc s ARG 1336CO -0.09 -0.02 -0.23 -1.58 -0.68 0.00 0.00 175.30 172.71 3hqc s HIS 1337N 0.17 2.46 -0.30 -0.53 5.65 -1.26 -0.80 115.29 120.68 3hqc s HIS 1337Ca -0.01 -0.45 0.03 0.00 0.25 0.00 0.00 55.06 54.87 3hqc s HIS 1337Cb -0.03 -1.57 0.08 0.00 -1.18 0.00 0.00 32.58 29.89 3hqc s HIS 1337CO -0.00 -0.04 -0.01 0.71 -0.65 0.00 0.00 174.74 174.75 3hqc s TYR 1338N -0.50 3.29 0.75 3.88 2.02 0.71 -4.92 117.35 122.59 3hqc s TYR 1338Ca 0.06 -2.56 -0.14 0.00 -0.37 0.00 0.00 57.07 54.06 3hqc s TYR 1338Cb -0.11 -2.37 0.05 0.00 -0.40 0.00 0.00 41.96 39.13 3hqc s TYR 1338CO 0.01 -0.90 1.21 -2.14 -1.57 0.00 0.00 175.55 172.16 3hqc s PRO 1339N 1.08 1.99 0.23 -1.71 0.02 -1.26 -0.94 135.00 134.40 3hqc s PRO 1339Ca 0.03 1.77 -0.09 0.00 0.02 0.00 0.00 61.00 62.73 3hqc s PRO 1339Cb -0.19 -1.81 0.35 0.00 0.02 0.00 0.00 34.50 32.87 3hqc s PRO 1339CO -0.08 -1.95 1.64 0.28 -0.33 0.00 0.00 177.00 176.56 3hqc h VAL 1340N -0.47 0.40 0.00 3.83 2.07 -1.86 -0.79 116.25 119.43 3hqc h VAL 1340Ca -0.47 -0.03 0.00 0.00 0.82 0.00 0.00 66.70 67.01 3hqc h VAL 1340Cb 1.30 0.30 0.00 0.00 -1.52 0.00 0.00 31.29 31.37 3hqc h VAL 1340CO 0.49 0.02 0.00 -0.46 0.02 0.00 0.00 177.57 177.63 3hqc n ASN 1341N -5.33 0.00 0.05 0.57 0.23 -1.26 -2.35 115.26 107.16 3hqc n ASN 1341Ca 0.11 0.10 0.11 0.00 -0.53 0.00 0.00 54.58 54.37 3hqc n ASN 1341Cb 0.41 -0.32 0.06 0.00 -2.08 0.00 0.00 39.78 37.85 3hqc n ASN 1341CO 0.00 0.00 0.00 -1.54 -0.93 0.00 0.00 177.26 174.79 3hqc n SER 1342N -1.32 0.65 -4.64 0.53 3.41 -0.30 -4.90 113.62 107.04 3hqc n SER 1342Ca 0.08 -0.03 -0.40 0.00 -0.26 0.00 0.00 58.87 58.26 3hqc n SER 1342Cb 0.16 0.60 -0.07 0.00 -0.26 0.00 0.00 64.21 64.64 3hqc n SER 1342CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 3hqc s ILE 1343N -3.22 5.05 -0.35 -1.33 1.01 -0.99 -1.52 121.20 119.85 3hqc s ILE 1343Ca 0.04 1.01 0.12 0.00 0.00 0.00 0.00 60.65 61.82 3hqc s ILE 1343Cb 0.13 -3.88 -0.15 0.00 0.01 0.00 0.00 42.46 38.58 3hqc s ILE 1343CO 0.78 0.11 0.41 0.35 0.00 0.00 0.00 174.94 176.58 3hqc n THR 1344N 4.89 0.00 -3.60 2.92 -2.24 -0.02 -5.00 114.28 111.23 3hqc n THR 1344Ca -0.03 -0.24 -0.09 0.00 -2.27 0.00 0.00 64.05 61.42 3hqc n THR 1344Cb 0.50 0.71 -0.05 0.00 -2.10 0.00 0.00 70.33 69.39 3hqc n THR 1344CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 3hqc s PHE 1345N -2.37 -0.32 -0.06 4.78 5.36 -1.22 -4.99 117.98 119.16 3hqc s PHE 1345Ca 0.01 0.61 -0.11 0.00 -0.96 0.00 0.00 56.93 56.48 3hqc s PHE 1345Cb 0.08 0.44 0.02 0.00 -0.34 0.00 0.00 43.02 43.23 3hqc s PHE 1345CO 0.49 -0.26 0.27 0.45 -1.46 0.00 0.00 175.22 174.71 3hqc s SER 1346N -0.78 -0.21 0.12 6.13 0.15 -1.26 -0.68 113.70 117.17 3hqc s SER 1346Ca 0.01 0.29 -0.25 0.00 0.70 0.00 0.00 55.95 56.70 3hqc s SER 1346Cb -0.02 0.44 0.07 0.00 -1.71 0.00 0.00 66.02 64.80 3hqc s SER 1346CO -0.02 -0.26 0.80 -0.94 1.20 0.00 0.00 173.24 174.01 3hqc s SER 1347N -0.60 -0.36 0.89 5.45 1.04 -0.89 -4.98 113.70 114.25 3hqc s SER 1347Ca -0.07 -0.19 -0.12 0.00 0.48 0.00 0.00 55.95 56.05 3hqc s SER 1347Cb -0.04 0.52 0.13 0.00 0.10 0.00 0.00 66.02 66.73 3hqc s SER 1347CO 0.02 -0.90 1.12 0.42 0.98 0.00 0.00 173.24 174.88 3hqc s THR 1348N -3.46 2.36 0.12 2.02 -4.23 -1.26 -1.06 115.64 110.12 3hqc s THR 1348Ca 0.06 0.12 -0.31 0.00 -1.18 0.00 0.00 61.69 60.38 3hqc s THR 1348Cb -0.02 -2.81 -0.11 0.00 1.34 0.00 0.00 72.50 70.90 3hqc s THR 1348CO -0.05 -0.15 1.83 -0.67 -0.54 0.00 0.00 174.62 175.03 3hqc n ASP 1349N -3.74 3.99 0.01 3.99 2.03 -0.39 -4.84 116.55 117.60 3hqc n ASP 1349Ca 0.06 0.99 0.08 0.00 0.52 0.00 0.00 54.79 56.44 3hqc n ASP 1349Cb 0.58 -1.54 0.34 0.00 -0.72 0.00 0.00 41.12 39.78 3hqc n ASP 1349CO 0.00 0.00 0.00 -0.81 -1.92 0.00 0.00 177.20 174.47 3hqc n PRO 1350N 5.52 0.01 -0.28 -0.67 -0.04 -1.26 -1.91 135.00 136.37 3hqc n PRO 1350Ca 0.18 0.25 0.12 0.00 -0.04 0.00 0.00 63.50 64.00 3hqc n PRO 1350Cb 0.37 -1.52 0.27 0.00 -0.04 0.00 0.00 33.50 32.58 3hqc n PRO 1350CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 3hqc n GLN 1351N -1.54 2.59 -2.21 0.54 6.02 -1.26 -4.97 117.38 116.55 3hqc n GLN 1351Ca 0.04 -2.43 -0.19 0.00 -0.01 0.00 0.00 57.00 54.40 3hqc n GLN 1351Cb 0.18 -1.54 -0.03 0.00 1.02 0.00 0.00 30.24 29.88 3hqc n GLN 1351CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.06 175.80 3hqc n ASP 1352N 1.54 -5.47 -4.78 1.08 8.00 -0.80 -4.97 116.55 111.16 3hqc n ASP 1352Ca 0.22 0.13 -0.37 0.00 0.71 0.00 0.00 54.79 55.47 3hqc n ASP 1352Cb 0.61 -4.63 -0.05 0.00 -0.02 0.00 0.00 41.12 37.03 3hqc n ASP 1352CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 3hqc s ARG 1353N -4.71 4.35 0.29 -1.24 0.52 -1.26 -5.05 118.95 111.85 3hqc s ARG 1353Ca 0.00 1.54 0.10 0.00 -0.52 0.00 0.00 55.73 56.85 3hqc s ARG 1353Cb 0.00 -2.73 -0.05 0.00 0.52 0.00 0.00 34.95 32.69 3hqc s ARG 1353CO 0.00 0.02 -0.08 1.03 0.02 0.00 0.00 175.30 176.29 3hqc s ARG 1354N -2.18 1.99 -0.07 3.54 1.81 -1.26 -4.16 118.95 118.62 3hqc s ARG 1354Ca 0.53 -1.65 -0.16 0.00 -1.72 0.00 0.00 55.73 52.73 3hqc s ARG 1354Cb -0.23 -1.94 -0.05 0.00 -0.45 0.00 0.00 34.95 32.28 3hqc s ARG 1354CO 0.30 0.28 0.41 -0.46 -0.68 0.00 0.00 175.30 175.15 3hqc s TRP 1355N -2.45 3.60 -0.36 -0.53 -0.11 0.12 -4.88 118.94 114.32 3hqc s TRP 1355Ca 0.32 0.87 -0.14 0.00 1.22 0.00 0.00 56.10 58.38 3hqc s TRP 1355Cb -0.04 -2.39 -0.01 0.00 -1.50 0.00 0.00 33.47 29.54 3hqc s TRP 1355CO 0.18 0.40 0.27 0.99 -4.62 0.00 0.00 176.95 174.16 3hqc s THR 1356N -0.17 5.27 0.80 5.86 2.01 -1.26 -0.57 115.64 127.58 3hqc s THR 1356Ca 0.23 -0.33 -0.11 0.00 0.31 0.00 0.00 61.69 61.79 3hqc s THR 1356Cb -0.15 -3.78 0.07 0.00 0.01 0.00 0.00 72.50 68.65 3hqc s THR 1356CO 0.10 -0.10 1.09 0.20 -0.69 0.00 0.00 174.62 175.22 3hqc s ASN 1357N 1.71 4.33 0.52 3.53 0.02 -0.10 -4.89 114.94 120.06 3hqc s ASN 1357Ca 0.06 1.57 0.25 0.00 -1.02 0.00 0.00 52.86 53.72 3hqc s ASN 1357Cb -0.18 -2.30 1.36 0.00 0.02 0.00 0.00 41.25 40.15 3hqc s ASN 1357CO 0.10 -2.11 1.96 -0.65 0.02 0.00 0.00 177.10 176.43 3hqc h PRO 1358N -1.18 0.06 -0.02 -0.60 0.11 -1.98 0.77 132.00 129.17 3hqc h PRO 1358Ca -0.46 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 3hqc h PRO 1358Cb 1.25 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.35 3hqc h PRO 1358CO 0.55 0.04 0.00 -0.40 -0.21 0.00 0.00 178.00 177.98 3hqc n ASP 1359N -4.37 0.19 0.00 -2.05 5.68 -1.26 -4.92 116.55 109.82 3hqc n ASP 1359Ca 0.12 -1.49 0.00 0.00 -0.50 0.00 0.00 54.79 52.92 3hqc n ASP 1359Cb 0.68 -0.01 0.00 0.00 -1.14 0.00 0.00 41.12 40.64 3hqc n ASP 1359CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3hqc n GLY 1360N 0.81 1.57 3.88 6.12 0.00 0.26 -5.04 105.19 112.78 3hqc n GLY 1360Ca 0.13 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.85 3hqc n GLY 1360CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3hqc s THR 1361N -3.13 4.23 0.16 2.61 -4.23 -1.26 -4.76 115.64 109.26 3hqc s THR 1361Ca 0.00 0.72 0.07 0.00 -1.18 0.00 0.00 61.69 61.30 3hqc s THR 1361Cb 0.00 -3.72 -0.04 0.00 1.34 0.00 0.00 72.50 70.08 3hqc s THR 1361CO 0.00 -0.95 -0.01 0.42 -0.54 0.00 0.00 174.62 173.55 3hqc s THR 1362N -3.25 3.72 -0.01 3.99 -4.23 -1.26 -0.93 115.64 113.68 3hqc s THR 1362Ca 0.56 -1.38 0.03 0.00 -1.18 0.00 0.00 61.69 59.71 3hqc s THR 1362Cb -0.11 -2.86 -0.01 0.00 1.34 0.00 0.00 72.50 70.87 3hqc s THR 1362CO 0.53 -0.08 -0.08 -0.44 -0.54 0.00 0.00 174.62 174.01 3hqc s SER 1363N -2.86 0.98 0.46 3.99 0.01 0.26 -4.95 113.70 111.60 3hqc s SER 1363Ca 0.27 -0.15 -0.25 0.00 1.31 0.00 0.00 55.95 57.13 3hqc s SER 1363Cb -0.10 -0.12 -0.08 0.00 0.21 0.00 0.00 66.02 65.94 3hqc s SER 1363CO 0.18 0.10 1.35 -1.59 0.41 0.00 0.00 173.24 173.69 3hqc s LYS 1364N -0.18 3.66 -0.11 12.44 0.00 -1.26 -0.71 119.74 133.59 3hqc s LYS 1364Ca 0.03 2.23 -0.03 0.00 0.00 0.00 0.00 55.97 58.20 3hqc s LYS 1364Cb -0.03 -2.58 -0.03 0.00 0.00 0.00 0.00 37.83 35.18 3hqc s LYS 1364CO -0.00 -0.77 0.01 0.42 0.00 0.00 0.00 175.35 175.01 3hqc s ILE 1365N -1.27 4.40 0.07 3.79 1.01 -1.26 -1.04 121.20 126.89 3hqc s ILE 1365Ca 0.62 -0.21 -0.05 0.00 0.00 0.00 0.00 60.65 61.02 3hqc s ILE 1365Cb -0.40 -2.88 -0.02 0.00 0.01 0.00 0.00 42.46 39.17 3hqc s ILE 1365CO 0.50 0.58 0.08 0.72 0.00 0.00 0.00 174.94 176.82 3hqc s PHE 1366N -0.59 0.33 0.22 3.97 -0.12 -0.38 -1.26 117.98 120.15 3hqc s PHE 1366Ca 0.10 -0.82 -0.07 0.00 -0.05 0.00 0.00 56.93 56.09 3hqc s PHE 1366Cb -0.12 -0.22 -0.02 0.00 -0.63 0.00 0.00 43.02 42.03 3hqc s PHE 1366CO 0.02 -0.47 0.31 0.20 -0.05 0.00 0.00 175.22 175.24 3hqc s GLY 1367N -2.89 0.91 0.08 1.99 0.00 -0.22 -0.30 107.32 106.88 3hqc s GLY 1367Ca 0.06 -1.23 0.02 0.00 0.00 0.00 0.00 44.72 43.58 3hqc s GLY 1367CO -0.10 -0.97 -0.08 -0.11 0.00 0.00 0.00 173.10 171.83 3hqc s PHE 1368N -4.07 0.87 -0.13 1.90 -0.12 -0.52 -2.08 117.98 113.82 3hqc s PHE 1368Ca 0.29 -0.71 -0.02 0.00 -0.05 0.00 0.00 56.93 56.45 3hqc s PHE 1368Cb 0.03 -0.50 -0.02 0.00 -0.63 0.00 0.00 43.02 41.90 3hqc s PHE 1368CO 0.09 -0.09 -0.08 0.08 -0.05 0.00 0.00 175.22 175.18 3hqc s VAL 1369N -2.55 3.56 0.05 -2.49 1.01 0.14 -0.50 120.40 119.62 3hqc s VAL 1369Ca 0.03 -0.49 -0.08 0.00 0.00 0.00 0.00 61.98 61.44 3hqc s VAL 1369Cb -0.02 -2.52 -0.00 0.00 0.00 0.00 0.00 36.38 33.84 3hqc s VAL 1369CO -0.02 0.52 0.16 0.00 0.00 0.00 0.00 175.10 175.76 3hqc s ALA 1370N 0.14 -0.21 0.43 5.51 0.00 -0.48 -0.84 121.76 126.31 3hqc s ALA 1370Ca -0.04 -0.48 -0.26 0.00 0.00 0.00 0.00 51.96 51.18 3hqc s ALA 1370Cb -0.14 0.33 -0.09 0.00 0.00 0.00 0.00 23.12 23.22 3hqc s ALA 1370CO 0.04 -0.39 1.44 0.15 0.00 0.00 0.00 175.76 176.99 3hqc s LYS 1371N -3.00 3.82 -0.27 0.00 -0.14 -0.57 -1.36 119.74 118.22 3hqc s LYS 1371Ca -0.02 2.45 -0.29 0.00 -1.36 0.00 0.00 55.97 56.75 3hqc s LYS 1371Cb 0.01 -2.75 0.01 0.00 -1.68 0.00 0.00 37.83 33.42 3hqc s LYS 1371CO -0.06 -0.72 1.13 0.21 -0.76 0.00 0.00 175.35 175.15 3hqc s LYS 1372N -2.34 4.11 0.28 1.68 2.20 -0.19 -4.88 119.74 120.60 3hqc s LYS 1372Ca 0.58 1.26 0.00 0.00 -0.36 0.00 0.00 55.97 57.45 3hqc s LYS 1372Cb -0.44 -3.74 0.64 0.00 -1.51 0.00 0.00 37.83 32.78 3hqc s LYS 1372CO 0.58 -0.85 1.65 -1.35 -0.36 0.00 0.00 175.35 175.02 3hqc h PRO 1373N 8.15 0.20 -0.41 4.03 0.11 -1.91 -0.19 132.00 141.99 3hqc h PRO 1373Ca -0.22 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.88 3hqc h PRO 1373Cb 1.07 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.14 3hqc h PRO 1373CO 1.01 0.13 0.00 0.41 -0.21 0.00 0.00 178.00 179.34 3hqc n GLY 1374N -1.38 1.56 2.34 -0.55 0.00 -1.26 -4.42 105.19 101.47 3hqc n GLY 1374Ca 0.19 -0.68 -0.19 0.00 0.00 0.00 0.00 46.02 45.34 3hqc n GLY 1374CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3hqc n SER 1375N 1.29 -0.49 0.30 1.61 7.64 -0.15 -5.05 113.62 118.77 3hqc n SER 1375Ca 0.19 -2.94 0.19 0.00 1.01 0.00 0.00 58.87 57.32 3hqc n SER 1375Cb 0.55 0.03 1.02 0.00 -1.01 0.00 0.00 64.21 64.79 3hqc n SER 1375CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 3hqc h PRO 1376N 3.75 0.00 0.00 1.43 0.13 -1.57 0.12 132.00 135.86 3hqc h PRO 1376Ca 0.02 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.15 3hqc h PRO 1376Cb 0.94 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.07 3hqc h PRO 1376CO 0.42 0.00 0.00 0.11 -0.23 0.00 0.00 178.00 178.30 3hqc h TRP 1377N 0.00 0.00 -3.26 1.56 0.09 -1.97 -3.42 115.95 108.95 3hqc h TRP 1377Ca 0.02 0.00 -0.58 0.00 0.09 0.00 0.00 58.89 58.42 3hqc h TRP 1377Cb 0.23 0.00 -0.07 0.00 0.08 0.00 0.00 29.16 29.40 3hqc h TRP 1377CO 0.00 0.00 -0.12 -1.21 0.09 0.00 0.00 178.44 177.20 3hqc s GLU 1378N -3.52 4.25 -0.21 0.12 2.02 0.43 -5.01 118.70 116.78 3hqc s GLU 1378Ca 0.03 0.51 -0.10 0.00 0.02 0.00 0.00 54.97 55.42 3hqc s GLU 1378Cb 0.09 -3.37 -0.05 0.00 0.10 0.00 0.00 34.13 30.90 3hqc s GLU 1378CO 0.52 0.32 0.15 -0.80 0.02 0.00 0.00 175.26 175.47 3hqc s ASN 1379N 0.06 6.18 -0.04 -0.19 0.01 -1.26 -1.02 114.94 118.68 3hqc s ASN 1379Ca 0.27 0.20 0.03 0.00 -0.71 0.00 0.00 52.86 52.64 3hqc s ASN 1379Cb -0.16 -2.10 0.01 0.00 0.41 0.00 0.00 41.25 39.41 3hqc s ASN 1379CO 0.13 0.14 -0.10 -0.69 -1.51 0.00 0.00 177.10 175.06 3hqc s VAL 1380N 0.61 0.93 -0.23 1.60 1.01 -0.46 -1.10 120.40 122.75 3hqc s VAL 1380Ca 0.08 -0.42 -0.12 0.00 0.00 0.00 0.00 61.98 61.53 3hqc s VAL 1380Cb -0.12 -0.83 -0.05 0.00 0.00 0.00 0.00 36.38 35.38 3hqc s VAL 1380CO 0.00 0.29 0.22 0.00 0.00 0.00 0.00 175.10 175.62 3hqc s HIS 1382N 1.16 3.16 -0.04 0.00 3.76 0.34 -1.33 115.29 122.34 3hqc s HIS 1382Ca 0.10 -0.15 0.06 0.00 -0.15 0.00 0.00 55.06 54.92 3hqc s HIS 1382Cb -0.14 -2.19 -0.02 0.00 1.11 0.00 0.00 32.58 31.34 3hqc s HIS 1382CO 0.06 -0.13 -0.21 -1.17 -0.85 0.00 0.00 174.74 172.44 3hqc s LEU 1383N 1.13 2.35 0.11 0.89 2.96 -0.04 -1.44 118.68 124.64 3hqc s LEU 1383Ca 0.05 -0.36 0.01 0.00 -0.22 0.00 0.00 54.13 53.60 3hqc s LEU 1383Cb -0.14 -1.44 -0.04 0.00 0.50 0.00 0.00 46.19 45.06 3hqc s LEU 1383CO 0.04 0.31 -0.03 -0.36 -1.32 0.00 0.00 176.35 174.99 3hqc s PHE 1384N -0.55 0.90 0.08 5.38 0.08 0.58 -0.31 117.98 124.14 3hqc s PHE 1384Ca 0.08 -1.00 0.09 0.00 0.12 0.00 0.00 56.93 56.21 3hqc s PHE 1384Cb -0.11 -0.53 -0.03 0.00 -0.57 0.00 0.00 43.02 41.78 3hqc s PHE 1384CO 0.01 -0.25 -0.23 0.00 -0.10 0.00 0.00 175.22 174.65 3hqc s ALA 1385N -3.73 1.97 0.59 5.36 0.00 -0.44 -1.25 121.76 124.26 3hqc s ALA 1385Ca 0.15 -1.23 -0.19 0.00 0.00 0.00 0.00 51.96 50.70 3hqc s ALA 1385Cb 0.06 -0.34 -0.04 0.00 0.00 0.00 0.00 23.12 22.80 3hqc s ALA 1385CO -0.03 0.43 1.22 -1.83 0.00 0.00 0.00 175.76 175.55 3hqc s GLU 1386N -1.57 2.96 -0.02 0.00 -1.05 -0.21 -1.28 118.70 117.54 3hqc s GLU 1386Ca 0.09 1.86 0.03 0.00 -0.15 0.00 0.00 54.97 56.79 3hqc s GLU 1386Cb -0.10 -1.94 -0.04 0.00 -0.44 0.00 0.00 34.13 31.61 3hqc s GLU 1386CO 0.03 -1.22 0.03 1.28 0.95 0.00 0.00 175.26 176.33 3hqc n LEU 1387N -1.57 0.00 -3.98 1.83 4.77 -1.26 -4.72 117.00 112.07 3hqc n LEU 1387Ca 0.14 0.00 -0.27 0.00 -0.03 0.00 0.00 56.01 55.85 3hqc n LEU 1387Cb 0.49 0.05 -0.17 0.00 -2.33 0.00 0.00 43.42 41.46 3hqc n LEU 1387CO 0.45 0.05 -0.46 -0.62 -1.33 0.00 0.00 177.39 175.47 3hqc s ASP 1388N -3.01 2.20 0.38 -1.43 2.15 -1.26 -5.01 116.67 110.69 3hqc s ASP 1388Ca -0.01 -0.35 0.27 0.00 0.43 0.00 0.00 52.55 52.89 3hqc s ASP 1388Cb 0.01 -0.93 1.32 0.00 -0.30 0.00 0.00 42.92 43.02 3hqc s ASP 1388CO 0.12 -0.05 1.81 1.55 -0.17 0.00 0.00 175.17 178.43 3hqc h PRO 1389N 7.74 0.00 -0.00 4.34 0.13 -1.99 -1.34 132.00 140.88 3hqc h PRO 1389Ca -0.32 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.81 3hqc h PRO 1389Cb 1.15 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.28 3hqc h PRO 1389CO 0.46 0.00 -0.48 -0.25 -0.23 0.00 0.00 178.00 177.50 3hqc n ASP 1390N -2.46 0.93 -3.42 1.44 8.00 -1.26 -4.00 116.55 115.78 3hqc n ASP 1390Ca -0.00 -0.72 -0.26 0.00 0.71 0.00 0.00 54.79 54.51 3hqc n ASP 1390Cb 0.13 0.34 -0.08 0.00 -0.02 0.00 0.00 41.12 41.48 3hqc n ASP 1390CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3hqc n GLN 1391N -1.03 1.67 -2.00 -1.24 1.13 -0.51 -5.12 117.38 110.27 3hqc n GLN 1391Ca 0.08 -4.08 -0.30 0.00 -1.94 0.00 0.00 57.00 50.76 3hqc n GLN 1391Cb 0.35 -1.90 0.01 0.00 0.11 0.00 0.00 30.24 28.82 3hqc n GLN 1391CO 0.00 0.00 0.00 -1.25 -1.44 0.00 0.00 177.06 174.37 3hqc s PRO 1392N -1.71 3.50 0.25 -1.09 0.04 -1.17 -4.40 135.00 130.43 3hqc s PRO 1392Ca 0.36 0.61 -0.02 0.00 0.04 0.00 0.00 61.00 61.99 3hqc s PRO 1392Cb 0.12 -2.12 0.50 0.00 0.04 0.00 0.00 34.50 33.03 3hqc s PRO 1392CO -0.08 -0.57 1.76 0.00 0.04 0.00 0.00 177.00 178.15 3hqc h ALA 1393N -0.27 1.20 -0.87 8.56 0.00 -1.89 -2.07 119.26 123.92 3hqc h ALA 1393Ca -0.45 0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.54 3hqc h ALA 1393Cb 1.20 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.95 3hqc h ALA 1393CO 0.62 -0.11 0.49 0.78 0.00 0.00 0.00 179.25 181.03 3hqc h GLY 1394N 0.58 1.29 1.00 0.00 0.00 -1.96 -1.02 103.07 102.96 3hqc h GLY 1394Ca 0.44 -0.57 -0.07 0.00 0.00 0.00 0.00 47.33 47.13 3hqc h GLY 1394CO -0.36 0.55 0.04 0.00 0.00 0.00 0.00 176.54 176.76 3hqc h ALA 1395N 1.32 0.67 -0.40 3.60 0.00 -1.77 -0.86 119.26 121.83 3hqc h ALA 1395Ca 0.31 -0.26 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 3hqc h ALA 1395Cb 0.01 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 3hqc h ALA 1395CO -0.05 0.45 0.12 0.82 0.00 0.00 0.00 179.25 180.59 3hqc h ILE 1396N 0.73 1.22 -0.63 0.00 2.04 -1.06 0.04 117.51 119.85 3hqc h ILE 1396Ca 0.15 -0.71 0.04 0.00 1.00 0.00 0.00 64.86 65.33 3hqc h ILE 1396Cb 0.46 0.93 -0.04 0.00 -0.74 0.00 0.00 36.82 37.43 3hqc h ILE 1396CO 0.02 0.25 0.37 0.58 0.00 0.00 0.00 178.15 179.37 3hqc h VAL 1397N 0.49 1.04 -0.76 1.67 2.07 -1.09 -0.86 116.25 118.82 3hqc h VAL 1397Ca 0.13 -0.25 -0.05 0.00 0.82 0.00 0.00 66.70 67.35 3hqc h VAL 1397Cb 0.26 0.26 -0.03 0.00 -1.52 0.00 0.00 31.29 30.26 3hqc h VAL 1397CO -0.00 0.13 0.29 0.71 0.02 0.00 0.00 177.57 178.72 3hqc h THR 1398N 0.72 1.26 -0.62 2.57 1.35 -0.55 -0.81 112.91 116.83 3hqc h THR 1398Ca 0.26 -0.82 -0.05 0.00 -0.55 0.00 0.00 66.41 65.26 3hqc h THR 1398Cb 0.07 0.35 -0.03 0.00 -1.73 0.00 0.00 68.15 66.81 3hqc h THR 1398CO -0.12 0.33 0.21 -0.26 -0.25 0.00 0.00 175.52 175.43 3hqc h PHE 1399N 1.11 0.98 -0.53 4.73 0.04 -0.55 -0.82 116.94 121.90 3hqc h PHE 1399Ca 0.25 -0.09 -0.02 0.00 2.80 0.00 0.00 57.97 60.91 3hqc h PHE 1399Cb 0.22 -0.29 -0.02 0.00 2.20 0.00 0.00 35.95 38.06 3hqc h PHE 1399CO 0.02 0.80 0.26 0.82 -0.60 0.00 0.00 178.31 179.61 3hqc h ILE 1400N 0.88 1.20 -0.97 -0.55 2.04 -0.80 -2.09 117.51 117.22 3hqc h ILE 1400Ca 0.20 -0.54 0.01 0.00 1.00 0.00 0.00 64.86 65.53 3hqc h ILE 1400Cb 0.26 0.58 -0.05 0.00 -0.74 0.00 0.00 36.82 36.88 3hqc h ILE 1400CO -0.01 0.22 0.64 0.74 0.00 0.00 0.00 178.15 179.74 3hqc h THR 1401N 0.71 1.25 -0.36 -0.27 2.02 -0.90 -2.60 112.91 112.76 3hqc h THR 1401Ca 0.18 -0.45 -0.03 0.00 0.77 0.00 0.00 66.41 66.89 3hqc h THR 1401Cb 0.11 -0.18 -0.02 0.00 -1.74 0.00 0.00 68.15 66.33 3hqc h THR 1401CO -0.02 0.24 0.12 0.11 0.37 0.00 0.00 175.52 176.33 3hqc h LYS 1402N 1.31 0.56 -1.80 6.66 6.56 -0.81 0.91 116.57 129.96 3hqc h LYS 1402Ca 0.35 -0.12 0.00 0.00 -1.06 0.00 0.00 60.65 59.83 3hqc h LYS 1402Cb -0.15 -0.08 0.00 0.00 -0.57 0.00 0.00 32.23 31.43 3hqc h LYS 1402CO -0.08 0.57 0.00 1.33 -2.06 0.00 0.00 179.45 179.22 3hqc n VAL 1403N -4.64 1.24 0.00 0.50 0.24 -0.82 -0.44 118.33 114.41 3hqc n VAL 1403Ca -0.01 -0.26 0.00 0.00 -2.04 0.00 0.00 64.34 62.03 3hqc n VAL 1403Cb 0.17 -1.22 0.00 0.00 -1.47 0.00 0.00 33.84 31.32 3hqc n VAL 1403CO 0.00 0.00 0.00 -0.11 -2.14 0.00 0.00 176.83 174.58 3hqc n LEU 1405N 1.36 0.00 0.00 1.34 7.94 0.31 -4.97 117.00 122.98 3hqc n LEU 1405Ca 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.90 3hqc n LEU 1405Cb 0.36 0.00 0.02 0.00 0.53 0.00 0.00 43.42 44.33 3hqc n LEU 1405CO 0.00 0.00 0.26 0.61 -1.11 0.00 0.00 177.39 177.15