NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 11 K 4.2315 8.3144 120.1666 55.7849 33.9864 174.3358 12 R 4.4345 7.9212 119.3485 54.1254 32.4927 173.8724 13 Q 4.6223 8.9453 117.9639 53.5121 31.1664 174.1368 14 V 4.2840 8.0684 115.2944 59.3931 33.1568 176.0329 15 A 4.1473 8.0281 125.6535 54.6354 18.4068 176.7808 16 S 4.6900 7.3349 110.5558 56.8794 63.1236 173.5420 17 G 4.0013 9.0191 116.1375 45.1826 0.0000 171.4697 18 R 4.7226 8.4338 121.6238 55.4158 33.9329 173.9868 19 A 5.1130 8.3209 125.0588 50.6329 22.7601 174.5604 20 Y 4.9800 9.6089 120.7069 56.2769 41.1024 174.8540 21 I 4.9091 8.7954 123.8819 59.8038 40.2814 174.0691 22 H 5.8638 9.9228 126.5198 53.3737 32.9671 172.0816 23 A 4.9509 8.4132 127.8999 50.1745 21.2217 174.4454 24 S 4.8033 9.0463 116.6818 57.9054 65.0053 175.4460 25 Y 4.0821 8.9762 119.3319 60.5422 37.9630 177.2606 26 N 4.7112 7.9435 115.5215 54.5432 39.9714 174.1042 27 N 4.7083 7.9194 113.9102 53.8395 42.1004 172.7372 28 T 5.0443 8.1940 117.4275 61.7639 72.0693 172.7177 29 I 4.9011 9.7089 128.0057 59.1945 41.1790 174.4541 30 V 5.6455 9.0007 121.8704 59.0161 35.0651 174.4426 31 T 5.1628 8.6105 118.9730 60.4334 70.7644 172.1080 32 I 4.8175 8.8996 130.2709 60.4895 38.7300 174.5634 33 T 4.9756 9.0061 120.3219 60.9950 71.6984 171.3559 34 D 4.9384 8.2003 118.7466 51.4965 42.4255 174.2243 35 P 4.4527 0.0000 0.0000 64.7467 31.3792 176.5894 36 D 4.7381 9.4160 118.5249 55.0689 43.0097 176.5387 37 G 3.9153 7.7131 105.0891 45.3263 0.0000 173.6953 38 N 4.5954 8.1190 117.1930 51.9608 37.8091 172.6532 39 P 4.2944 0.0000 0.0000 59.0351 32.6049 175.9735 40 I 4.1870 8.4894 122.4729 62.1774 39.8402 175.3221 41 T 4.2324 7.4989 114.6959 62.1593 70.5853 171.0529 42 W 5.5077 7.4202 119.6324 57.0037 30.9709 172.8904 43 S 4.3063 8.5669 113.8063 58.2176 65.4609 175.6759 44 S 5.0185 8.2344 117.2283 58.8276 63.5336 179.7518 45 G 4.0733 7.1817 107.0567 50.7384 0.0000 177.3513 46 G 4.1263 8.2390 109.4380 46.8924 0.0000 175.4648 47 V 3.3551 7.9274 119.4174 65.9527 31.2567 177.1806 48 I 3.6695 7.7555 118.8370 61.9500 37.0883 177.2134 49 G 4.7149 6.8440 118.8237 46.3847 0.0000 172.3013 50 Y 4.7603 6.7547 117.7661 57.4991 39.0174 174.0428 51 K 4.6677 8.5995 118.4454 57.2150 35.7770 175.1863 52 G 4.0691 8.5307 113.9932 46.3819 0.0000 175.1416 53 S 4.1909 8.7775 118.5282 60.9678 62.8923 174.6779 54 R 4.3211 7.5889 119.0833 55.1712 28.0677 175.7999 55 K 4.6037 7.4432 115.8315 57.4324 38.4750 179.0267 56 G 3.8276 7.9541 105.9204 46.9503 0.0000 174.5009 57 T 3.9838 7.6917 115.4627 61.0366 69.1225 172.5584 58 P 4.2337 0.0000 0.0000 66.3740 31.3161 177.7911 59 Y 4.4094 8.2579 119.1060 60.6303 38.5071 177.5804 60 A 3.8825 8.1918 120.4267 55.2815 18.4379 178.9075 61 A 3.9417 7.9441 117.9415 56.3442 18.4668 178.6647 62 Q 3.8652 8.5864 116.7567 58.9851 28.7268 178.4731 63 L 3.8709 7.9915 118.1957 58.8594 42.1246 178.7267 64 A 3.9363 8.3074 119.2428 54.8707 18.0748 178.9771 65 A 3.6487 8.5247 117.3821 55.0534 18.6253 180.0838 66 L 3.8884 7.8910 117.2275 58.1181 41.8938 179.0235 67 D 3.8830 8.9149 118.6025 57.8604 41.0146 177.5230 68 A 3.9681 9.0062 122.2795 54.9903 18.2303 179.2277 69 A 3.9596 8.4866 117.6933 54.7544 18.4720 179.5242 70 K 3.7449 8.7436 118.6483 59.8580 32.3534 178.7075 71 K 4.1521 7.8937 117.7603 59.1742 32.0191 178.9008 72 A 3.9718 7.9409 121.0589 55.6064 18.0341 179.3733 73 M 3.9790 8.3634 116.9970 58.4991 31.8285 178.4206 74 A 4.0546 7.8551 120.7202 55.7871 18.1326 178.2905 75 Y 4.1296 8.3625 111.3254 58.2761 38.2328 173.2159 76 G 3.8714 8.6895 111.9425 45.4569 0.0000 172.0246 77 M 4.8753 7.9760 122.1545 54.2677 34.6184 173.9906 78 Q 4.5446 8.0245 122.3197 55.9771 32.9385 174.0709 79 S 5.1179 7.8672 113.5897 57.3981 65.1566 173.1995 80 V 4.6143 7.8807 116.7361 59.3250 35.5327 174.9003 81 D 4.7301 8.7471 125.3238 54.6151 42.6350 175.1377 82 V 4.5555 8.4656 118.2584 61.7263 35.1908 173.6508 83 I 4.8861 8.2525 128.0311 59.5251 40.5867 174.7234 84 V 4.8506 8.7102 120.1411 59.6954 34.7050 175.2080 85 R 4.7024 9.8900 123.3468 54.8841 34.1013 174.9217 86 G 4.1935 7.5672 110.8855 44.5422 0.0000 174.1814 87 T 4.4946 7.8831 115.2211 63.6949 70.7085 174.0177 88 G 3.5183 7.7691 110.2842 45.5466 0.0000 175.4846 89 A 4.2675 8.3910 123.9922 52.1904 18.2751 178.4962 90 G 4.1755 8.0871 102.1018 46.4853 0.0000 174.0863 91 R 4.2331 7.5513 122.1053 58.6129 31.9499 177.5475 92 E 3.9517 8.3776 117.1017 60.0112 29.3760 179.1427 93 Q 4.0567 8.3427 116.8346 59.3119 28.6528 179.2037 94 A 3.9768 8.0614 121.4486 55.1851 18.4398 179.4074 95 I 3.5987 7.7261 117.0759 65.3960 37.2279 177.9622 96 R 4.0678 8.7923 119.4757 58.5823 29.6189 178.4539 97 A 3.9576 8.6540 123.6047 55.9833 18.7154 179.3557 98 L 4.0556 7.9360 117.6477 57.4436 41.5125 179.1335 99 Q 3.9091 8.4611 117.4339 59.4568 28.9382 180.1329 100 A 4.2468 8.2048 116.5823 52.4005 17.8773 176.6156 101 S 4.8140 8.1556 114.5164 57.3557 65.6698 175.4943 102 G 3.9416 8.6014 104.1917 45.9461 0.0000 173.0754 103 L 4.6683 8.1527 119.4272 52.4242 44.6839 176.0287 104 Q 4.3411 8.9912 124.6616 54.5856 29.8922 176.5123 105 V 4.1635 8.1548 122.3138 60.9643 29.2689 177.1766 106 K 3.8196 7.5801 121.1544 57.9125 33.0560 175.9956 107 S 5.0707 6.9371 116.1334 58.4544 66.6076 175.8126 108 I 4.9140 8.3534 126.4887 59.5990 39.5814 174.9044 109 V 4.4572 9.2231 127.1887 60.9145 35.3065 173.8463 110 D 5.0728 8.7258 125.2522 52.1092 42.4147 175.7321 111 D 5.0689 8.0743 127.8674 53.3969 40.0162 176.2397 112 T 4.1803 7.7394 116.2322 62.2281 69.6888 173.8154 113 P 4.4166 0.0000 0.0000 63.2450 31.7508 176.2179 114 V 4.1325 7.7250 114.2319 60.2235 33.1745 170.9316 115 P 4.3888 0.0000 0.0000 63.0240 32.0926 176.4893 116 H 4.5295 8.6231 120.4325 55.8251 28.4064 174.9062 117 N 4.2163 8.0321 118.5753 53.6441 38.0517 173.1621 118 G 3.7606 8.5036 110.7866 45.0997 0.0000 173.0208 119 C 4.3401 9.1778 112.5994 56.7668 31.3564 174.0840 120 R 3.7906 8.6054 123.4305 56.4853 29.9038 174.2150 121 P 4.7063 0.0000 0.0000 61.0436 33.8103 178.0836 122 K 4.3657 7.9917 115.4589 56.1893 31.1741 178.9375 123 K 4.1296 8.6429 120.7297 58.5019 33.7455 177.7811 124 K 4.1671 8.3580 117.8776 58.2474 32.2266 177.3462 125 F 4.6164 8.2462 115.6249 59.1164 41.3940 176.9220 126 R 4.0485 7.8085 117.5229 58.6955 29.5402 178.2409 127 K 4.0993 7.5310 117.5101 58.0074 32.1016 176.0030 128 A 4.4710 7.4745 122.1885 51.1609 18.8002 177.2321 129 S 4.2208 8.3443 116.1176 59.6477 62.4661 175.0499 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 11 K 8.31 4.23 0.00 1.81 1.94 0.00 1.70 0.00 0.00 1.72 0.00 0.00 2.92 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.38 1.50 7.81 12 R 7.92 4.43 0.00 1.87 1.90 0.00 3.22 0.00 0.00 3.27 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.75 0.00 13 Q 8.95 4.62 0.00 2.04 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.05 6.53 0.00 0.00 0.00 0.00 0.00 2.24 2.31 0.00 14 V 8.07 4.28 2.11 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 0.74 0.00 0.00 1.00 0.00 0.00 15 A 8.03 4.15 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 16 S 7.33 4.69 0.00 3.90 3.77 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 0.00 0.00 0.00 17 G 9.02 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.43 4.72 0.00 1.88 1.78 0.00 3.28 0.00 0.00 3.26 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.50 0.00 19 A 8.32 5.11 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 20 Y 9.61 4.98 0.00 3.05 2.89 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 0.00 0.00 0.00 0.00 21 I 8.80 4.91 2.01 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.56 0.92 0.00 0.00 22 H 9.92 5.86 0.00 3.21 3.27 0.00 5.76 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 23 A 8.41 4.95 1.17 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 0.00 0.00 0.00 0.00 0.00 0.00 24 S 9.05 4.80 0.00 3.98 4.01 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 25 Y 8.98 4.08 0.00 2.96 3.14 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 26 N 7.94 4.71 0.00 2.77 2.91 0.00 0.00 6.72 8.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 N 7.92 4.71 0.00 2.75 2.64 0.00 0.00 6.91 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 T 8.19 5.04 4.26 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 1.23 0.00 0.00 29 I 9.71 4.90 1.96 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.91 0.98 0.00 0.00 30 V 9.00 5.65 2.15 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 0.88 0.00 0.00 1.00 0.00 0.00 31 T 8.61 5.16 4.32 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 1.26 0.00 0.00 32 I 8.90 4.82 1.86 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.71 0.96 0.00 0.00 33 T 9.01 4.98 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 34 D 8.20 4.94 0.00 2.88 2.81 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.45 0.00 2.08 2.17 0.00 3.64 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 2.13 0.00 36 D 9.42 4.74 0.00 2.61 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 G 7.71 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 N 8.12 4.60 0.00 3.08 2.81 0.00 0.00 6.92 7.90 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 39 P 0.00 4.29 0.00 2.05 1.96 0.00 3.58 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 2.11 0.00 40 I 8.49 4.19 1.60 0.00 0.00 0.81 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 0.83 nan 0.00 0.00 41 T 7.50 4.23 4.09 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 1.12 0.00 0.00 42 W 7.42 5.51 0.00 3.58 3.02 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.57 4.31 0.00 3.70 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 44 S 8.23 5.02 0.00 4.28 4.13 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 0.00 0.00 0.00 45 G 7.18 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 46 G 8.24 4.13 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 0.00 0.00 0.00 0.00 0.00 0.00 47 V 7.93 3.36 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 0.47 0.00 0.00 0.92 0.00 0.00 48 I 7.76 3.67 1.84 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.84 0.67 0.00 0.00 49 G 6.84 4.71 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 0.00 0.00 0.00 50 Y 6.75 4.76 0.00 3.30 3.03 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 0.00 0.00 0.00 51 K 8.60 4.67 0.00 1.71 1.68 0.00 1.85 0.00 0.00 1.74 0.00 0.00 3.03 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.29 1.40 7.81 52 G 8.53 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 53 S 8.78 4.19 0.00 3.87 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 R 7.59 4.32 0.00 1.60 1.36 0.00 3.15 0.00 0.00 3.20 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.59 0.00 55 K 7.44 4.60 0.00 2.02 2.03 0.00 1.88 0.00 0.00 1.89 0.00 0.00 3.16 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.51 1.47 7.81 56 G 7.95 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.69 3.98 4.16 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 0.98 0.00 0.00 58 P 0.00 4.23 0.00 2.35 2.32 0.00 3.80 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.06 0.00 59 Y 8.26 4.41 0.00 3.03 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 60 A 8.19 3.88 1.39 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 0.00 0.00 0.00 61 A 7.94 3.94 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 62 Q 8.59 3.87 0.00 2.24 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.58 0.00 0.00 0.00 0.00 0.00 2.47 2.50 0.00 63 L 7.99 3.87 0.00 1.54 1.62 0.45 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 64 A 8.31 3.94 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.52 3.65 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 L 7.89 3.89 0.00 1.96 1.72 0.96 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 67 D 8.91 3.88 0.00 2.66 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 A 9.01 3.97 1.39 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 0.00 0.00 0.00 69 A 8.49 3.96 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 70 K 8.74 3.74 0.00 1.75 1.98 0.00 1.78 0.00 0.00 1.69 0.00 0.00 2.99 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.45 1.50 7.81 71 K 7.89 4.15 0.00 2.02 1.84 0.00 1.59 0.00 0.00 1.55 0.00 0.00 2.86 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.42 1.69 7.81 72 A 7.94 3.97 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 M 8.36 3.98 0.00 2.05 2.32 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 3.00 0.00 74 A 7.86 4.05 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 Y 8.36 4.13 0.00 3.08 3.04 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 0.00 0.00 0.00 0.00 76 G 8.69 3.87 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 0.00 0.00 0.00 0.00 0.00 0.00 77 M 7.98 4.88 0.00 1.95 2.04 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.58 0.00 78 Q 8.02 4.54 0.00 1.98 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.62 0.00 0.00 0.00 0.00 0.00 2.28 2.35 0.00 79 S 7.87 5.12 0.00 3.89 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.88 4.61 2.12 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 0.88 0.00 0.00 0.92 0.00 0.00 81 D 8.75 4.73 0.00 2.59 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 82 V 8.47 4.56 2.21 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 0.89 0.00 0.00 0.88 0.00 0.00 83 I 8.25 4.89 1.34 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.20 0.92 0.00 0.00 84 V 8.71 4.85 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 0.89 0.00 0.00 1.02 0.00 0.00 85 R 9.89 4.70 0.00 1.88 1.85 0.00 3.29 0.00 0.00 3.26 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.66 0.00 86 G 7.57 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.88 4.49 4.10 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 0.00 0.00 0.00 1.24 0.00 0.00 88 G 7.77 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.39 4.27 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 90 G 8.09 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 0.00 0.00 0.00 0.00 91 R 7.55 4.23 0.00 1.78 1.86 0.00 3.19 0.00 0.00 3.30 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.61 0.00 92 E 8.38 3.95 0.00 2.09 2.01 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 2.41 2.49 0.00 93 Q 8.34 4.06 0.00 2.09 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.91 0.00 0.00 0.00 0.00 0.00 2.49 2.58 0.00 94 A 8.06 3.98 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 I 7.73 3.60 1.95 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.71 0.90 0.00 0.00 96 R 8.79 4.07 0.00 1.97 1.92 0.00 3.19 0.00 0.00 3.28 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.68 0.00 97 A 8.65 3.96 1.39 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 0.00 0.00 0.00 98 L 7.94 4.06 0.00 1.99 1.67 0.92 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 99 Q 8.46 3.91 0.00 2.20 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 7.07 0.00 0.00 0.00 0.00 0.00 2.39 2.65 0.00 100 A 8.20 4.25 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 0.00 101 S 8.16 4.81 0.00 3.96 4.16 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 0.00 102 G 8.60 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 L 8.15 4.67 0.00 1.55 1.54 0.92 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 104 Q 8.99 4.34 0.00 2.03 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.98 7.15 0.00 0.00 0.00 0.00 0.00 2.29 2.31 0.00 105 V 8.15 4.16 2.07 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 0.66 0.00 0.00 0.92 0.00 0.00 106 K 7.58 3.82 0.00 1.70 1.80 0.00 1.88 0.00 0.00 1.72 0.00 0.00 2.92 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.42 1.46 7.81 107 S 6.94 5.07 0.00 3.97 3.79 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 0.00 0.00 0.00 0.00 108 I 8.35 4.91 1.85 0.00 0.00 0.84 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 0.64 0.89 0.00 0.00 109 V 9.22 4.46 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 1.01 0.00 0.00 0.90 0.00 0.00 110 D 8.73 5.07 0.00 2.67 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 0.00 111 D 8.07 5.07 0.00 2.75 2.58 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.74 4.18 4.27 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 1.25 0.00 0.00 113 P 0.00 4.42 0.00 2.20 2.09 0.00 3.85 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.01 0.00 114 V 7.73 4.13 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 0.74 0.00 0.00 0.98 0.00 0.00 115 P 0.00 4.39 0.00 2.23 2.12 0.00 3.80 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.02 0.00 116 H 8.62 4.53 0.00 3.12 3.35 0.00 6.01 0.00 0.00 0.00 0.00 8.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 N 8.03 4.22 0.00 2.87 2.87 0.00 0.00 7.05 7.98 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 0.00 118 G 8.50 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 C 9.18 4.34 0.00 3.08 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 R 8.61 3.79 0.00 1.79 1.90 0.00 3.22 0.00 0.00 3.28 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.66 0.00 121 P 0.00 4.71 0.00 2.23 2.07 0.00 3.84 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 1.99 2.03 0.00 122 K 7.99 4.37 0.00 1.65 1.61 0.00 1.36 0.00 0.00 1.67 0.00 0.00 2.73 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.41 1.15 7.81 123 K 8.64 4.13 0.00 1.80 1.78 0.00 1.73 0.00 0.00 1.76 0.00 0.00 2.92 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.42 1.47 7.81 124 K 8.36 4.17 0.00 1.95 2.33 0.00 2.00 0.00 0.00 1.64 0.00 0.00 3.17 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.25 1.53 7.81 125 F 8.25 4.62 0.00 2.88 3.08 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 0.00 0.00 0.00 0.00 126 R 7.81 4.05 0.00 1.91 2.03 0.00 3.15 0.00 0.00 3.18 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.71 0.00 127 K 7.53 4.10 0.00 1.70 1.90 0.00 1.75 0.00 0.00 1.71 0.00 0.00 3.06 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.89 1.63 7.81 128 A 7.47 4.47 1.26 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 0.00 0.00 129 S 8.34 4.22 0.00 3.94 3.79 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 0.00 0.00 0.00 0.00