NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4909 8.3049 120.3259 55.1912 33.6699 174.3578 2 N 4.7602 7.9249 114.6629 49.5596 41.8566 172.9890 3 T 4.6739 8.8528 114.5001 60.0883 72.9457 173.9509 4 P 4.1848 0.0000 0.0000 65.6404 31.3394 178.8585 5 E 3.8940 8.0693 117.1261 59.5336 29.3670 178.7162 6 H 4.0733 8.1017 118.0615 59.6847 30.0196 177.3184 7 M 3.4429 7.5742 120.2330 58.4202 31.6169 179.0051 8 T 3.7914 8.0445 115.9367 66.4094 68.5509 176.7384 9 A 3.9560 8.1033 122.9063 55.0241 18.2856 179.8584 10 V 3.5553 7.9019 116.9541 66.0363 31.6198 178.4170 11 V 3.2416 7.6771 117.9936 65.9943 31.2026 178.0661 12 Q 3.8890 7.9377 117.7076 59.0716 28.5070 179.0365 13 R 3.9060 8.4092 119.4968 59.0620 30.0104 178.5895 14 Y 4.0657 8.2517 119.7558 60.7699 38.9170 178.1319 15 V 3.3670 7.7967 118.9337 65.8879 31.5897 177.8131 16 A 3.9514 8.2016 120.4203 55.0740 18.1989 179.5073 17 A 3.9207 8.1425 119.4129 55.1479 18.1060 179.8563 18 L 3.8435 7.8013 117.5292 58.0938 41.4649 179.5800 19 N 4.5130 8.0536 115.0066 55.7478 38.5454 176.5538 20 A 4.3905 7.8657 120.2218 51.5674 19.1967 177.6627 21 G 3.7796 7.4184 104.7420 46.9781 0.0000 175.2191 22 D 4.5826 7.8816 121.2825 52.0088 39.2272 175.5600 23 L 3.9367 8.0316 125.8030 57.9762 42.5207 177.7341 24 D 4.5077 8.1902 118.2582 57.3869 40.5581 178.9133 25 G 3.8649 8.2270 106.6559 47.1783 0.0000 175.6828 26 I 3.8873 7.7050 122.0065 64.3446 37.1990 178.6215 27 V 3.7949 7.9221 118.7913 66.1009 31.0914 177.7295 28 A 4.1857 8.0115 119.1501 54.4186 18.4156 178.3555 29 L 4.0760 8.0908 117.1416 56.2635 42.1932 176.9250 30 F 4.9355 7.8169 116.9571 55.7380 40.6133 175.6536 31 A 4.3165 8.6198 126.7085 51.7108 18.8744 178.5513 32 D 4.4236 8.7612 119.2602 56.5829 41.4685 177.2244 33 D 4.7468 7.8248 116.9428 52.7586 40.0361 176.1321 34 A 4.6474 7.7516 121.2757 53.1021 20.1124 177.4133 35 T 4.8836 8.6424 108.8873 59.8388 72.4093 172.9605 36 V 4.6789 8.9499 124.9777 61.0377 34.3352 173.7200 37 E 4.6431 9.3203 129.5710 54.2527 31.3403 173.7047 38 N 5.2341 8.1952 124.5554 51.0552 41.5305 171.8062 39 P 4.7550 0.0000 0.0000 60.9617 33.9320 175.4622 40 V 3.8106 8.0641 120.4381 64.6914 31.6038 175.8337 41 G 3.9839 9.3994 115.5884 45.2837 0.0000 173.8832 42 S 4.5384 7.3160 113.5985 56.1182 64.7795 173.5545 43 E 3.9110 8.4159 122.0353 55.7452 29.6456 174.8669 44 P 4.5442 0.0000 0.0000 62.7244 32.7474 175.8421 45 R 4.4721 8.9622 121.6677 54.8190 31.8699 175.4510 46 S 4.9526 8.8750 120.1765 57.7894 65.7259 175.3786 47 G 4.0666 9.1322 109.2291 45.7394 0.0000 174.3702 48 T 3.8083 8.6592 116.4348 66.6202 68.4531 176.5210 49 A 3.9701 8.0137 121.4668 55.3446 18.4981 179.4230 50 A 3.9849 7.9111 118.6641 55.3029 18.4883 179.8138 51 I 3.6851 7.8264 118.4671 64.3596 37.0872 178.5786 52 R 3.9917 8.3538 119.9911 59.4162 29.9155 178.1496 53 E 3.9161 8.2973 119.1042 59.1404 29.6497 178.3505 54 F 4.0492 8.2553 120.6029 61.8604 39.4650 176.8871 55 Y 3.7380 8.1196 115.7582 60.5174 37.3624 178.1819 56 A 4.0147 8.0137 121.5143 55.3145 18.7723 179.1413 57 N 4.3821 8.0663 114.9755 56.4223 38.3865 177.9504 58 S 3.9439 7.4815 115.7706 60.8827 62.8285 175.6410 59 L 4.4265 7.5047 119.3501 54.4766 41.5250 177.4883 60 K 4.0048 7.7096 122.7117 58.4683 32.3474 176.9796 61 L 4.8066 7.3499 116.7738 51.4896 44.1557 174.3055 62 P 4.3444 0.0000 0.0000 63.1204 31.6700 175.4374 63 L 5.0782 8.4516 121.4034 52.8165 44.6868 175.7664 64 A 4.7933 8.9014 124.7327 50.4692 20.9503 175.2042 65 V 5.0282 9.7330 123.0073 61.9333 34.0760 174.8122 66 E 4.8096 8.9985 127.2642 54.5823 33.4431 174.0665 67 L 4.8611 8.7562 127.0504 55.2644 42.1413 176.8927 68 T 4.5810 8.7465 112.5704 61.9828 69.8956 173.7997 69 Q 4.6076 7.8401 119.8271 54.3830 33.0378 173.6137 70 E 4.1126 8.4779 117.1620 56.5201 30.0763 176.8264 71 V 3.9992 8.0990 120.5759 62.8906 32.8338 175.1385 72 R 4.7407 8.8225 125.6162 54.5012 32.1837 175.1296 73 A 5.2071 8.2990 125.2597 50.3922 22.1206 175.4382 74 V 3.9964 9.3921 119.1512 62.0919 34.6897 172.6534 75 A 3.7391 9.4337 119.9904 54.5903 15.3426 175.9854 76 N 4.3260 8.0859 116.0433 53.1543 37.3071 173.7819 77 E 5.6251 8.4770 116.8409 54.9142 34.3074 174.4505 78 A 5.2881 9.3764 122.3261 50.6681 23.3142 175.1270 79 A 5.3163 9.2469 122.1032 50.3600 23.1170 175.1542 80 F 5.3290 8.6128 114.0734 55.5400 41.9895 172.9433 81 A 5.4328 8.6956 122.1592 50.7908 21.7923 175.7408 82 F 5.2542 8.1558 115.5670 56.4228 42.0864 172.5371 83 I 4.9294 8.8568 111.2324 59.1740 41.3048 174.7520 84 V 4.8325 8.9158 123.2797 61.5835 34.5090 174.2424 85 S 5.3341 9.0568 124.7126 56.9723 66.0199 173.2632 86 F 5.0263 8.0536 116.8485 56.5704 41.6698 172.4816 87 E 4.9384 9.0585 118.8572 54.7953 31.1165 175.5490 88 Y 4.6881 8.7835 125.9611 56.5430 38.7480 175.1375 89 Q 3.1727 9.4906 129.4465 57.1731 25.7350 174.3050 90 G 4.1363 7.8471 109.1530 46.1244 0.0000 174.5949 91 R 4.0694 7.7817 115.7402 54.9670 30.9922 175.3257 92 K 4.7507 8.3727 121.1521 55.7227 34.2245 175.1856 93 T 4.8761 8.7241 123.2470 61.5600 72.4712 173.0578 94 V 4.2480 8.5839 124.4750 61.1178 34.6004 174.1429 95 V 4.6336 8.8689 128.3291 61.2446 33.6318 174.3482 96 A 4.9398 9.0272 130.5317 48.6330 19.1093 173.6453 97 P 4.8156 0.0000 0.0000 61.6305 35.0371 174.4483 98 I 4.7275 8.3947 119.3020 59.7811 40.3921 174.7321 99 D 5.3579 8.5029 126.9511 52.8750 43.5410 174.9731 100 H 5.0272 9.2676 122.0583 54.5951 32.6152 172.1873 101 F 5.5755 9.9957 125.3203 55.9384 41.7668 174.9073 102 R 5.1619 8.7385 121.4095 54.5352 33.0545 174.6441 103 F 5.3282 9.5067 123.1999 55.7644 41.5215 175.7597 104 N 4.7982 9.0722 120.6909 51.3942 38.8712 176.2253 105 G 3.6238 8.6564 106.3744 48.6354 0.0000 174.4116 106 A 4.1016 7.9506 120.0860 52.7450 18.7194 177.9797 107 G 4.5443 8.3779 104.3567 45.1756 0.0000 173.8014 108 K 4.5339 7.6802 118.6283 54.6544 33.8444 175.7751 109 V 3.5821 8.2276 123.0322 62.7828 31.7535 176.6948 110 V 4.1662 8.8144 127.9457 62.1781 33.6450 175.6387 111 S 4.9726 7.6464 116.3260 56.8852 66.0283 172.0075 112 M 4.9942 9.0910 126.6451 53.9508 34.9233 174.1741 113 R 5.1140 9.1704 125.7468 54.3945 33.5571 174.6210 114 A 5.2662 8.9317 126.7329 49.7488 21.2674 175.3679 115 L 4.8928 8.8774 124.3094 53.5096 43.4992 175.9105 116 F 5.1339 8.0086 116.3133 56.2916 40.4674 173.4076 117 G 4.2462 9.3546 110.3517 43.3735 0.0000 172.9999 118 E 4.0524 8.8004 117.1630 59.5687 29.3559 179.5616 119 K 4.1862 8.0102 115.4338 58.1163 32.4141 176.8604 120 N 4.8323 8.5848 116.5036 52.9068 40.0098 174.1311 121 I 4.4492 7.4697 120.8790 60.0510 38.8205 175.2497 122 H 4.6565 9.1382 126.3091 53.8979 30.4254 173.8654 123 A 4.5152 7.9003 127.0006 48.4035 15.9773 175.1049 124 G 3.4021 7.7381 111.3508 44.6371 0.0000 171.7948 125 A 4.2762 7.7859 127.6136 52.1823 19.2732 175.7486 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 M 8.30 4.49 0.00 1.99 2.06 0.00 0.00 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.63 0.00 2 N 7.92 4.76 0.00 2.73 2.47 0.00 0.00 7.03 6.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 T 8.85 4.67 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 4 P 0.00 4.18 0.00 2.14 2.10 0.00 3.56 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.13 0.00 5 E 8.07 3.89 0.00 2.02 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.40 0.00 6 H 8.10 4.07 0.00 3.19 3.34 0.00 5.78 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 M 7.57 3.44 0.00 1.70 1.79 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 0.81 0.00 8 T 8.04 3.79 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 9 A 8.10 3.96 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 V 7.90 3.56 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.96 0.00 0.00 11 V 7.68 3.24 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 0.47 0.00 0.00 12 Q 7.94 3.89 0.00 2.23 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.57 0.00 0.00 0.00 0.00 0.00 2.28 2.57 0.00 13 R 8.41 3.91 0.00 1.97 1.99 0.00 3.13 0.00 0.00 3.09 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.75 0.00 14 Y 8.25 4.07 0.00 3.12 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 V 7.80 3.37 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.77 0.00 0.00 16 A 8.20 3.95 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 A 8.14 3.92 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 L 7.80 3.84 0.00 1.72 1.65 0.55 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 19 N 8.05 4.51 0.00 2.84 2.87 0.00 0.00 7.01 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 A 7.87 4.39 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 G 7.42 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 D 7.88 4.58 0.00 2.79 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 L 8.03 3.94 0.00 1.81 1.67 1.05 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 24 D 8.19 4.51 0.00 2.77 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 G 8.23 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 I 7.71 3.89 1.86 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.66 0.33 0.00 0.00 27 V 7.92 3.79 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 1.02 0.00 0.00 28 A 8.01 4.19 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 L 8.09 4.08 0.00 1.41 1.40 0.97 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 30 F 7.82 4.94 0.00 3.17 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 A 8.62 4.32 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 D 8.76 4.42 0.00 2.71 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 D 7.82 4.75 0.00 2.80 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 A 7.75 4.65 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 T 8.64 4.88 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 36 V 8.95 4.68 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.44 0.00 0.00 0.66 0.00 0.00 37 E 9.32 4.64 0.00 1.94 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.26 0.00 38 N 8.20 5.23 0.00 2.68 2.30 0.00 0.00 7.23 7.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 P 0.00 4.75 0.00 1.45 0.50 0.00 3.70 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.53 0.00 40 V 8.06 3.81 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 0.91 0.00 0.00 41 G 9.40 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 S 7.32 4.54 0.00 3.94 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 E 8.42 3.91 0.00 1.89 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.35 0.00 44 P 0.00 4.54 0.00 1.90 1.88 0.00 3.64 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.05 0.00 45 R 8.96 4.47 0.00 1.41 1.71 0.00 3.15 0.00 0.00 3.04 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 1.28 0.00 46 S 8.87 4.95 0.00 3.66 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 G 9.13 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 T 8.66 3.81 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 49 A 8.01 3.97 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 A 7.91 3.98 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 I 7.83 3.69 1.88 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.58 0.63 0.00 0.00 52 R 8.35 3.99 0.00 1.98 2.13 0.00 3.12 0.00 0.00 3.12 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.69 0.00 53 E 8.30 3.92 0.00 2.21 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.33 0.00 54 F 8.26 4.05 0.00 3.04 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 Y 8.12 3.74 0.00 3.20 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 A 8.01 4.01 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 N 8.07 4.38 0.00 2.73 2.76 0.00 0.00 7.05 7.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 S 7.48 3.94 0.00 3.68 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 L 7.50 4.43 0.00 1.60 1.67 0.94 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 60 K 7.71 4.00 0.00 1.79 1.79 0.00 1.63 0.00 0.00 1.68 0.00 0.00 3.07 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.42 1.44 7.81 61 L 7.35 4.81 0.00 1.53 1.54 0.95 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 62 P 0.00 4.34 0.00 2.21 2.09 0.00 3.75 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.03 0.00 63 L 8.45 5.08 0.00 1.55 1.66 0.92 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 64 A 8.90 4.79 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 V 9.73 5.03 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 1.01 0.00 0.00 66 E 9.00 4.81 0.00 2.11 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.35 0.00 67 L 8.76 4.86 0.00 1.61 1.66 0.82 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 68 T 8.75 4.58 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 69 Q 7.84 4.61 0.00 2.08 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 7.02 0.00 0.00 0.00 0.00 0.00 2.30 2.39 0.00 70 E 8.48 4.11 0.00 2.08 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.32 0.00 71 V 8.10 4.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 0.81 0.00 0.00 72 R 8.82 4.74 0.00 2.03 1.83 0.00 3.29 0.00 0.00 3.21 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.61 0.00 73 A 8.30 5.21 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 V 9.39 4.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.64 0.00 0.00 0.94 0.00 0.00 75 A 9.43 3.74 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 N 8.09 4.33 0.00 3.00 3.19 0.00 0.00 6.73 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 E 8.48 5.63 0.00 1.97 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.49 0.00 78 A 9.38 5.29 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 A 9.25 5.32 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 F 8.61 5.33 0.00 3.09 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 A 8.70 5.43 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 F 8.16 5.25 0.00 3.44 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 I 8.86 4.93 1.87 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.65 0.87 0.00 0.00 84 V 8.92 4.83 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 1.21 0.00 0.00 85 S 9.06 5.33 0.00 3.77 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 F 8.05 5.03 0.00 3.16 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 E 9.06 4.94 0.00 2.03 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.29 0.00 88 Y 8.78 4.69 0.00 3.14 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 Q 9.49 3.17 0.00 1.61 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.06 0.00 0.00 0.00 0.00 0.00 1.24 1.64 0.00 90 G 7.85 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 R 7.78 4.07 0.00 1.98 2.08 0.00 3.22 0.00 0.00 3.38 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.63 0.00 92 K 8.37 4.75 0.00 1.83 1.65 0.00 1.63 0.00 0.00 1.78 0.00 0.00 2.77 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.34 1.49 7.81 93 T 8.72 4.88 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 94 V 8.58 4.25 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.87 0.00 0.00 95 V 8.87 4.63 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.44 0.00 0.00 0.99 0.00 0.00 96 A 9.03 4.94 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 P 0.00 4.82 0.00 2.01 2.22 0.00 2.20 0.00 0.00 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.43 0.00 98 I 8.39 4.73 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.76 0.89 0.00 0.00 99 D 8.50 5.36 0.00 1.58 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 H 9.27 5.03 0.00 3.20 3.16 0.00 5.55 0.00 0.00 0.00 0.00 6.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 F 10.00 5.58 0.00 3.14 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 R 8.74 5.16 0.00 1.72 1.84 0.00 3.12 0.00 0.00 3.16 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.57 0.00 103 F 9.51 5.33 0.00 2.82 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 N 9.07 4.80 0.00 2.92 3.00 0.00 0.00 6.84 7.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 G 8.66 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 A 7.95 4.10 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 G 8.38 4.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 K 7.68 4.53 0.00 1.99 1.80 0.00 1.70 0.00 0.00 1.78 0.00 0.00 2.92 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.51 1.38 7.81 109 V 8.23 3.58 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.17 0.00 0.00 -0.10 0.00 0.00 110 V 8.81 4.17 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.00 0.93 0.00 0.00 111 S 7.65 4.97 0.00 3.84 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 M 9.09 4.99 0.00 2.17 2.05 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.04 0.00 113 R 9.17 5.11 0.00 1.81 1.80 0.00 3.13 0.00 0.00 3.14 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.54 0.00 114 A 8.93 5.27 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 L 8.88 4.89 0.00 1.77 1.63 0.94 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 116 F 8.01 5.13 0.00 2.94 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 G 9.35 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 E 8.80 4.05 0.00 2.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.29 0.00 119 K 8.01 4.19 0.00 1.75 1.86 0.00 1.73 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.44 1.40 7.81 120 N 8.58 4.83 0.00 2.88 3.02 0.00 0.00 6.73 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 I 7.47 4.45 2.01 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.88 0.93 0.00 0.00 122 H 9.14 4.66 0.00 3.04 3.22 0.00 5.80 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 A 7.90 4.52 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 G 7.74 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 A 7.79 4.28 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00