NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.5203 8.2493 122.4718 52.0237 20.2826 176.0960 2 T 4.2128 8.4514 110.9518 60.8357 70.6087 172.2469 3 K 5.3364 8.9482 123.7607 55.0143 37.3727 175.9952 4 A 5.3664 9.0809 123.4481 50.9701 23.4301 175.1738 5 V 4.9886 8.8082 117.3978 60.9358 35.4404 173.3756 6 C 4.9448 9.1623 121.9804 58.0792 35.4580 172.5783 7 V 4.5730 8.4559 126.0325 61.4945 33.1266 174.1581 8 L 4.8682 8.8510 129.1795 53.8920 43.1162 176.1550 9 K 4.9568 9.0491 122.1128 55.6765 37.0871 176.1636 10 G 4.3831 7.9067 108.3616 46.2879 0.0000 172.6297 11 D 4.5934 8.8429 118.7010 55.5025 42.0542 176.9890 12 G 4.3078 7.6536 109.2216 44.6284 0.0000 171.7569 13 P 4.5261 0.0000 0.0000 62.9178 32.0210 176.0023 14 V 4.3014 7.5286 120.5058 62.8224 32.0704 174.9929 15 Q 5.1907 8.1804 124.7557 55.4371 32.5058 173.5452 16 G 4.2851 8.0577 106.1572 46.1293 0.0000 171.7778 17 I 5.1200 8.1463 119.4462 59.4015 40.7983 175.0764 18 I 4.6914 8.7885 127.6247 59.4667 40.3121 174.4233 19 N 4.9712 8.4321 123.9864 51.4396 41.2011 173.9531 20 F 5.4357 8.8404 119.4839 55.9152 43.5138 173.6696 21 E 5.2030 9.6676 122.6674 54.9161 33.6842 173.7417 22 Q 4.8528 9.5007 127.8166 54.2306 30.7516 175.7748 23 K 4.1612 8.8988 126.8275 58.4595 32.7681 177.7029 24 E 4.7753 7.7675 116.6368 53.8891 33.2735 175.0582 25 S 4.2576 8.7278 118.0322 60.4338 63.2627 173.8253 26 N 4.1528 8.9552 119.9517 54.0216 36.1426 174.4531 27 G 4.0049 7.8158 107.9548 43.5835 0.0000 172.0927 28 P 4.6158 0.0000 0.0000 62.1990 32.2198 176.5038 29 V 4.5815 8.8488 123.4598 61.1914 33.5093 174.6065 30 K 4.7475 9.1866 130.6398 56.1210 33.6503 175.5391 31 V 4.9004 9.1515 127.5317 60.8573 34.3915 174.1207 32 W 6.0162 7.6409 123.6835 55.3984 31.7291 175.3703 33 G 3.8156 7.7806 106.7644 46.3501 0.0000 170.7392 34 S 5.1302 7.6795 114.1163 57.0194 66.6913 174.4247 35 I 5.1766 8.7005 125.4100 59.4019 41.1468 174.5323 36 K 4.8211 9.2779 125.3322 55.6144 36.1708 176.8716 37 G 3.6923 9.0211 107.8706 45.6862 0.0000 173.4907 38 V 4.4335 7.3923 112.4404 58.8521 34.2930 175.5956 39 T 4.3354 8.1735 111.6280 61.0052 69.4386 174.0577 40 E 4.0720 8.6070 123.9376 58.1266 30.2949 175.7330 41 G 3.7842 8.7438 110.4115 43.9281 0.0000 172.0894 42 L 4.9227 8.1368 118.3374 54.5882 42.9346 176.4889 43 H 5.0414 9.2723 119.5454 53.6578 32.8788 173.4641 44 G 4.0304 9.1867 110.8060 46.7141 0.0000 172.7006 45 F 5.4088 8.8574 124.7532 57.3069 42.3306 172.8719 46 H 5.0483 8.8703 122.7002 54.1664 33.9154 172.6828 47 V 4.4304 8.6372 121.0722 62.5037 32.6262 175.0326 48 H 5.1497 9.2552 125.4153 54.3719 30.8080 175.8902 49 E 3.7372 8.7732 122.2218 58.8830 29.5766 177.2014 50 F 5.0167 7.7760 118.2063 55.7967 41.0785 176.3506 51 G 4.1233 8.4624 113.7280 44.7570 0.0000 173.8786 52 D 4.7778 8.0308 118.1638 52.5496 43.0610 174.2707 53 N 5.1154 8.5301 124.6127 53.4720 39.3870 176.1921 54 T 3.8772 8.6527 109.8905 63.5408 68.7478 174.6799 55 A 4.6333 8.0639 124.7523 51.4651 20.0877 177.5512 56 G 3.8653 7.9348 110.9213 47.1148 0.0000 174.4428 57 C 4.3533 8.6142 114.6443 60.0680 34.2886 175.6357 58 T 3.7396 7.9453 114.5314 65.1243 66.7112 175.6897 59 S 4.3626 7.9112 115.2968 60.3397 63.1717 175.5524 60 A 4.5049 7.5592 124.8169 53.8157 18.4065 178.5788 61 G 4.0550 8.2206 105.3357 44.4319 0.0000 170.8449 62 P 4.6851 0.0000 0.0000 61.9585 33.7472 175.3857 63 H 4.3279 8.4071 116.4262 55.7013 29.6163 175.6106 64 F 4.3067 9.0728 124.9368 58.0350 40.2803 175.0956 65 N 5.1375 7.9770 126.3337 51.6084 38.8044 173.0882 66 P 4.2174 0.0000 0.0000 65.0131 32.1705 177.9010 67 L 4.3604 7.6084 116.7694 53.7597 41.9778 176.1223 68 S 3.6417 7.5812 113.2446 59.7716 60.5584 172.0355 69 R 4.5131 8.0162 117.7473 54.3925 32.2215 176.7542 70 K 4.3388 8.8439 118.8023 56.2057 33.4117 176.5883 71 H 3.9366 8.6445 123.3554 56.8563 30.4679 175.0264 72 G 4.1288 7.4773 109.8885 45.6477 0.0000 172.0207 73 G 4.1711 8.9139 109.5764 43.1929 0.0000 173.3076 74 P 4.3973 0.0000 0.0000 65.1996 31.3839 177.5942 75 K 4.2381 7.9631 116.0810 57.0830 32.4837 176.3270 76 D 4.8025 7.6066 119.3638 52.8092 42.1669 176.4240 77 E 3.8927 8.6938 123.1989 58.8248 29.6020 176.4528 78 E 4.2623 7.9808 121.3456 55.4082 28.9745 174.7413 79 R 4.6449 7.6253 120.1759 56.0879 32.2072 174.4534 80 H 4.4978 8.9724 116.5881 55.2270 29.4704 177.0565 81 V 3.4416 8.2391 122.2578 66.3498 31.3650 177.1916 82 G 3.9240 8.2253 104.5231 47.0901 0.0000 173.3932 83 D 4.9962 8.1925 121.4007 53.5620 40.3118 175.7428 84 L 4.5697 8.4341 122.2146 53.0589 42.7029 178.2575 85 G 4.0773 8.5053 109.5808 46.5538 0.0000 174.5049 86 N 5.6650 8.6936 120.5271 51.3114 42.0097 173.2420 87 V 4.3877 8.5360 114.1551 59.9107 35.2114 174.8024 88 T 5.0193 8.2622 118.9198 61.8826 71.1122 173.0597 89 A 4.8491 8.9884 129.1808 50.5366 21.5171 177.0004 90 D 4.8445 8.6276 120.9448 51.9510 41.4463 177.1362 91 K 3.9195 8.4710 119.1151 59.6980 32.1407 177.5226 92 D 4.4264 8.1130 116.3965 55.0923 41.1972 176.8104 93 G 4.3282 8.6138 108.4336 44.6749 0.0000 172.4186 94 V 4.8163 8.1465 119.6404 60.6364 34.0991 174.1278 95 A 5.1996 8.8931 130.1360 49.5656 21.1021 175.0110 96 D 5.0080 8.6801 123.3601 53.7166 42.0519 176.1175 97 V 4.1564 8.7051 124.7505 61.3874 33.6446 175.0045 98 S 4.6596 8.4240 122.7340 57.7690 64.1223 172.8784 99 I 4.8167 9.1646 128.3485 59.3343 41.3223 174.2395 100 E 5.2272 8.8467 125.5279 54.5456 32.2963 174.4197 101 D 4.8739 9.3591 125.4664 52.8549 44.7594 175.5496 102 S 4.7129 8.8448 118.9982 58.4676 64.1035 175.8740 103 V 3.8507 8.0947 121.1797 64.9227 31.8495 176.5761 104 I 4.0574 7.8702 111.5133 61.1631 38.1484 174.6019 105 S 4.6776 8.4159 114.4852 57.4086 65.4999 174.0384 106 L 4.4215 8.8544 122.5271 54.1531 41.4832 176.2845 107 S 4.4447 7.8943 112.8856 58.2622 66.2665 174.9902 108 G 3.8795 8.5590 109.2215 44.6580 0.0000 173.6303 109 D 4.5108 8.6961 116.9572 56.0448 39.5588 176.5589 110 H 5.0158 8.1303 116.3230 55.5348 29.0134 173.8186 111 C 4.5127 8.0145 121.2044 59.6737 31.8212 173.5220 112 I 3.8790 8.1945 119.1173 60.6553 38.1193 175.7562 113 I 3.7393 7.2774 122.9414 62.6703 37.6727 176.3430 114 G 3.7996 9.3709 112.8599 45.4797 0.0000 173.0060 115 R 4.8774 7.4508 119.1630 54.8041 33.5646 174.5996 116 T 4.9760 7.9349 115.9981 61.9911 71.1995 173.8043 117 L 4.6669 8.5589 128.5593 54.1553 43.9580 175.3890 118 V 4.9622 8.6953 125.7357 60.9938 34.9908 174.1703 119 V 5.0703 8.6002 127.1161 60.5402 33.6543 174.8610 120 H 5.2901 8.9574 121.3982 54.1480 30.6637 174.7108 121 E 4.2100 9.2764 121.7596 58.6886 30.1266 176.7326 122 K 4.6912 8.3054 117.7670 53.8977 35.4217 176.0280 123 A 4.4567 8.2643 123.5919 52.1072 18.9455 176.3320 124 D 4.8902 9.2426 122.0421 53.9950 41.7771 176.1399 125 D 4.5876 9.2133 125.5303 53.0424 39.9145 176.9426 126 L 3.5360 9.8999 119.4594 56.0579 39.5875 175.9901 127 G 4.0608 8.6964 105.1441 45.7856 0.0000 174.7111 128 K 4.5591 7.9844 117.4548 55.9085 32.9064 177.0073 129 G 4.0242 7.5376 110.3424 44.8474 0.0000 174.9566 130 G 4.0253 8.9749 106.5087 45.7376 0.0000 172.9124 131 N 5.1447 7.6280 115.0856 50.4352 40.5344 174.2780 132 E 4.1093 8.6495 116.6218 59.3444 30.0985 179.1319 133 E 4.0585 8.1499 118.7995 58.8875 29.2626 178.7982 134 S 4.1439 8.1830 113.9733 61.1798 62.2244 175.2798 135 T 4.6194 7.4414 109.4072 61.4355 68.6500 175.3319 136 K 4.2760 7.7796 118.9317 58.3426 34.0123 177.1710 137 T 4.0366 8.0305 106.5259 60.1369 70.2464 175.4972 138 G 3.9940 8.1369 110.4957 45.4934 0.0000 173.6503 139 N 4.3201 8.0801 114.9888 54.1293 36.6882 175.7260 140 A 4.0869 7.0222 119.7517 51.6947 19.4570 180.0779 141 G 4.0983 7.3723 104.7401 45.0798 0.0000 173.6939 142 S 4.3896 8.4381 114.7625 58.6312 64.8354 174.1213 143 R 4.5271 8.3788 120.0607 55.1570 29.7900 176.3250 144 L 4.3662 8.9192 125.6844 56.9788 43.2124 176.8929 145 A 4.7641 7.7530 117.9733 51.5605 22.7002 173.9068 146 C 5.5511 8.3549 113.2254 55.9332 46.6994 172.7161 147 G 4.6576 8.0420 104.1863 46.2548 0.0000 172.5344 148 V 4.4870 8.2848 120.7975 62.2543 32.8328 175.4820 149 I 4.1504 8.7858 129.4479 60.9057 37.9838 175.2928 150 G 4.3996 8.9325 114.8458 43.9048 0.0000 172.3175 151 I 4.2478 8.3173 121.8574 61.1831 37.5841 175.4726 152 A 4.9404 8.5130 128.2715 49.5695 22.0984 176.3936 153 Q 4.1043 8.5105 115.9146 56.5166 28.8946 176.2187 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 A 8.25 4.52 1.33 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 0.00 0.00 2 T 8.45 4.21 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 1.24 0.00 0.00 3 K 8.95 5.34 0.00 1.73 1.75 0.00 1.92 0.00 0.00 1.96 0.00 0.00 3.12 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.56 1.50 7.81 4 A 9.08 5.37 1.10 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 0.00 0.00 0.00 5 V 8.81 4.99 2.06 0.00 0.00 0.00 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 0.95 0.00 0.00 6 C 9.16 4.94 0.00 3.12 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 7 V 8.46 4.57 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 0.92 0.00 0.00 8 L 8.85 4.87 0.00 1.83 1.59 1.04 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 9 K 9.05 4.96 0.00 1.65 1.62 0.00 1.69 0.00 0.00 1.65 0.00 0.00 2.81 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.35 1.39 7.81 10 G 7.91 4.38 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 0.00 11 D 8.84 4.59 0.00 2.68 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 12 G 7.65 4.31 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 0.00 13 P 0.00 4.53 0.00 2.18 2.16 0.00 3.76 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.94 0.00 14 V 7.53 4.30 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 0.80 0.00 0.00 0.94 0.00 0.00 15 Q 8.18 5.19 0.00 2.22 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.38 0.00 0.00 0.00 0.00 0.00 2.23 2.15 0.00 16 G 8.06 4.29 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 0.00 17 I 8.15 5.12 1.82 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 1.20 1.13 0.83 0.00 0.00 18 I 8.79 4.69 1.83 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.22 0.45 0.00 0.00 19 N 8.43 4.97 0.00 1.44 1.42 0.00 0.00 6.42 8.29 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 20 F 8.84 5.44 0.00 2.88 2.91 0.00 0.00 0.00 0.00 0.00 0.00 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 E 9.67 5.20 0.00 2.44 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 2.31 2.54 0.00 22 Q 9.50 4.85 0.00 2.17 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.78 6.62 0.00 0.00 0.00 0.00 0.00 2.46 2.63 0.00 23 K 8.90 4.16 0.00 1.81 1.88 0.00 1.74 0.00 0.00 1.71 0.00 0.00 2.86 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.47 1.49 7.81 24 E 7.77 4.78 0.00 1.98 1.79 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 2.30 2.31 0.00 25 S 8.73 4.26 0.00 3.87 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 26 N 8.96 4.15 0.00 2.85 2.89 0.00 0.00 7.00 7.65 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 27 G 7.82 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 28 P 0.00 4.62 0.00 2.08 2.04 0.00 3.73 0.00 0.00 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.95 0.00 29 V 8.85 4.58 2.31 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 1.27 0.00 0.00 1.05 0.00 0.00 30 K 9.19 4.75 0.00 1.93 1.87 0.00 1.32 0.00 0.00 0.96 0.00 0.00 2.13 0.00 0.00 2.30 0.00 0.00 0.00 0.00 1.60 1.37 7.81 31 V 9.15 4.90 2.16 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 0.69 0.00 0.00 1.08 0.00 0.00 32 W 7.64 6.02 0.00 3.48 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 33 G 7.78 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.68 5.13 0.00 3.89 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 35 I 8.70 5.18 1.80 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 1.28 0.45 0.88 0.00 0.00 36 K 9.28 4.82 0.00 1.74 1.85 0.00 1.32 0.00 0.00 1.64 0.00 0.00 2.85 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.45 1.34 7.81 37 G 9.02 3.69 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 0.00 0.00 0.00 38 V 7.39 4.43 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 0.85 0.00 0.00 39 T 8.17 4.34 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 1.24 0.00 0.00 40 E 8.61 4.07 0.00 1.95 1.93 0.00 0.00 0.00 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 2.45 0.00 41 G 8.74 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 42 L 8.14 4.92 0.00 1.50 1.59 0.91 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 43 H 9.27 5.04 0.00 3.00 3.32 0.00 5.62 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 44 G 9.19 4.03 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 0.00 0.00 0.00 45 F 8.86 5.41 0.00 2.95 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 46 H 8.87 5.05 0.00 3.08 3.11 0.00 5.85 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 V 8.64 4.43 2.16 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 0.86 0.00 0.00 0.90 0.00 0.00 48 H 9.26 5.15 0.00 3.04 3.38 0.00 5.69 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 8.77 3.74 0.00 1.64 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 1.76 2.18 0.00 50 F 7.78 5.02 0.00 3.16 2.85 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 51 G 8.46 4.12 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 0.00 52 D 8.03 4.78 0.00 2.62 2.80 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 53 N 8.53 5.12 0.00 2.76 2.70 0.00 0.00 6.90 7.22 0.00 0.00 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 T 8.65 3.88 4.23 0.00 0.00 0.00 0.00 0.00 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 55 A 8.06 4.63 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 56 G 7.93 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 57 C 8.61 4.35 0.00 2.96 3.10 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 0.00 58 T 7.95 3.74 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 1.28 0.00 0.00 59 S 7.91 4.36 0.00 4.20 4.05 0.00 0.00 0.00 0.00 0.00 0.00 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 7.56 4.50 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.22 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.69 0.00 2.04 2.19 0.00 3.43 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.96 0.00 63 H 8.41 4.33 0.00 2.82 3.17 0.00 5.72 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 F 9.07 4.31 0.00 2.97 2.96 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 0.00 0.00 0.00 0.00 65 N 7.98 5.14 0.00 2.46 2.44 0.00 0.00 6.80 7.93 0.00 0.00 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 P 0.00 4.22 0.00 2.10 2.04 0.00 2.99 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.15 0.00 67 L 7.61 4.36 0.00 1.57 1.69 0.95 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 68 S 7.58 3.64 0.00 4.03 3.91 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.02 4.51 0.00 1.87 1.98 0.00 3.37 0.00 0.00 3.20 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.77 0.00 70 K 8.84 4.34 0.00 1.75 1.69 0.00 1.65 0.00 0.00 1.56 0.00 0.00 2.77 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.45 1.37 7.81 71 H 8.64 3.94 0.00 3.18 3.14 0.00 5.95 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 G 7.48 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 73 G 8.91 4.17 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 0.00 74 P 0.00 4.40 0.00 2.23 2.39 0.00 3.79 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.04 0.00 75 K 7.96 4.24 0.00 1.77 1.90 0.00 1.74 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.47 7.81 76 D 7.61 4.80 0.00 2.78 2.56 0.00 0.00 0.00 0.00 0.00 0.00 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 8.69 3.89 0.00 1.92 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 0.00 2.28 2.29 0.00 78 E 7.98 4.26 0.00 2.06 1.81 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 2.31 2.30 0.00 79 R 7.63 4.64 0.00 1.84 1.89 0.00 2.85 0.00 0.00 2.25 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.55 0.00 80 H 8.97 4.50 0.00 3.49 3.37 0.00 5.65 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 V 8.24 3.44 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 0.67 0.00 0.00 0.35 0.00 0.00 82 G 8.23 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 83 D 8.19 5.00 0.00 2.70 2.77 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 84 L 8.43 4.57 0.00 1.81 1.90 0.96 0.97 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 85 G 8.51 4.08 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 0.00 0.00 0.00 86 N 8.69 5.67 0.00 2.59 2.70 0.00 0.00 6.63 8.04 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 87 V 8.54 4.39 1.79 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 -0.04 0.00 0.00 0.73 0.00 0.00 88 T 8.26 5.02 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 1.20 0.00 0.00 89 A 8.99 4.85 1.28 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 0.00 0.00 0.00 90 D 8.63 4.84 0.00 2.86 2.84 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 0.00 0.00 0.00 0.00 91 K 8.47 3.92 0.00 1.82 1.88 0.00 1.66 0.00 0.00 1.79 0.00 0.00 3.08 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.42 1.52 7.81 92 D 8.11 4.43 0.00 2.91 2.70 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 93 G 8.61 4.33 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 0.00 0.00 0.00 94 V 8.15 4.82 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 1.00 0.00 0.00 0.92 0.00 0.00 95 A 8.89 5.20 1.16 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 0.00 0.00 96 D 8.68 5.01 0.00 2.56 2.62 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 97 V 8.71 4.16 1.99 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 0.72 0.00 0.00 0.62 0.00 0.00 98 S 8.42 4.66 0.00 3.90 3.72 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 99 I 9.16 4.82 1.98 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.69 1.02 0.00 0.00 100 E 8.85 5.23 0.00 1.96 1.81 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 2.21 2.31 0.00 101 D 9.36 4.87 0.00 2.86 2.52 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 0.00 102 S 8.84 4.71 0.00 3.92 3.84 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 0.00 0.00 0.00 0.00 103 V 8.09 3.85 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 0.96 0.00 0.00 104 I 7.87 4.06 1.96 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.82 1.05 0.00 0.00 105 S 8.42 4.68 0.00 3.86 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 0.00 106 L 8.85 4.42 0.00 1.79 1.63 1.03 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 107 S 7.89 4.44 0.00 3.88 3.81 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 0.00 108 G 8.56 3.88 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 0.00 0.00 0.00 109 D 8.70 4.51 0.00 2.87 2.86 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 0.00 110 H 8.13 5.02 0.00 3.28 3.48 0.00 5.82 0.00 0.00 0.00 0.00 6.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 C 8.01 4.51 0.00 3.12 2.84 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 0.00 0.00 0.00 0.00 112 I 8.19 3.88 1.64 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 1.32 0.14 1.00 0.00 0.00 113 I 7.28 3.74 1.77 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.37 0.83 0.00 0.00 114 G 9.37 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 0.00 0.00 0.00 115 R 7.45 4.88 0.00 1.60 1.82 0.00 2.21 0.00 0.00 2.25 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.22 0.00 116 T 7.93 4.98 4.22 0.00 0.00 0.00 0.00 0.00 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 0.00 117 L 8.56 4.67 0.00 1.77 1.51 0.39 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 118 V 8.70 4.96 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 0.72 0.00 0.00 0.72 0.00 0.00 119 V 8.60 5.07 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 1.03 0.00 0.00 120 H 8.96 5.29 0.00 3.13 3.58 0.00 5.66 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 E 9.28 4.21 0.00 2.01 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 2.36 2.34 0.00 122 K 8.31 4.69 0.00 1.78 1.70 0.00 1.73 0.00 0.00 1.66 0.00 0.00 2.83 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.37 1.39 7.81 123 A 8.26 4.46 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 0.00 124 D 9.24 4.89 0.00 2.71 2.79 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 0.00 125 D 9.21 4.59 0.00 2.94 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 0.00 126 L 9.90 3.54 0.00 1.85 1.79 0.94 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 127 G 8.70 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 K 7.98 4.56 0.00 1.74 1.79 0.00 1.70 0.00 0.00 1.71 0.00 0.00 2.81 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.36 1.49 7.81 129 G 7.54 4.02 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 0.00 0.00 0.00 130 G 8.97 4.03 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 0.00 0.00 0.00 131 N 7.63 5.14 0.00 2.78 2.75 0.00 0.00 6.09 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 0.00 132 E 8.65 4.11 0.00 2.21 2.25 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 2.36 2.39 0.00 133 E 8.15 4.06 0.00 2.18 2.02 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 2.39 2.41 0.00 134 S 8.18 4.14 0.00 4.08 3.99 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 0.00 0.00 0.00 0.00 135 T 7.44 4.62 4.24 0.00 0.00 0.00 0.00 0.00 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 0.00 136 K 7.78 4.28 0.00 1.79 1.79 0.00 1.74 0.00 0.00 1.73 0.00 0.00 3.06 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.31 1.50 7.81 137 T 8.03 4.04 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 1.12 0.00 0.00 138 G 8.14 3.99 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 N 8.08 4.32 0.00 3.05 2.90 0.00 0.00 7.29 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 A 7.02 4.09 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 G 7.37 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 0.00 0.00 0.00 0.00 142 S 8.44 4.39 0.00 3.94 4.04 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 0.00 143 R 8.38 4.53 0.00 1.68 1.85 0.00 3.19 0.00 0.00 3.14 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.66 0.00 144 L 8.92 4.37 0.00 1.60 1.70 0.95 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 145 A 7.75 4.76 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 C 8.35 5.55 0.00 3.02 3.11 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 0.00 147 G 8.04 4.66 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 0.00 0.00 0.00 148 V 8.28 4.49 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 0.91 0.00 0.00 149 I 8.79 4.15 1.79 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.29 0.42 0.00 0.00 150 G 8.93 4.40 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 0.00 151 I 8.32 4.25 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 1.25 0.54 0.91 0.00 0.00 152 A 8.51 4.94 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 Q 8.51 4.10 0.00 2.19 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.79 6.60 0.00 0.00 0.00 0.00 0.00 2.34 2.38 0.00