NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.8936 8.3393 109.7365 45.8209 0.0000 175.0544 2 S 4.2535 8.3578 116.2345 57.7111 63.2485 172.2173 3 S 4.7626 8.3077 121.3908 57.7761 68.3107 175.9237 4 G 3.8398 8.1163 111.6260 45.1755 0.0000 174.4209 5 S 4.2956 8.4234 117.0339 57.7398 64.5112 172.7545 6 S 4.4946 8.2309 121.0985 57.5116 62.8348 174.6901 7 G 4.1978 7.9944 114.1220 45.4850 0.0000 171.3254 8 M 4.4770 8.5214 125.4107 54.1574 33.9845 175.9098 9 N 4.3518 8.7804 119.5753 56.2414 39.0122 174.2238 10 Y 3.2421 8.0327 124.9675 57.4999 36.1731 167.9699 11 N 5.1417 7.8632 120.5141 51.2768 40.6942 173.8675 12 S 4.6754 8.2464 111.7935 57.2460 65.6389 171.5063 13 Y 4.6285 8.0939 123.8174 56.7241 41.6820 173.1629 14 M 4.9035 7.8356 117.8709 53.4883 34.2126 174.5034 15 D 4.5403 8.7210 118.3554 53.7329 42.9295 175.6608 16 E 3.7036 7.9990 118.5152 56.4673 27.2239 172.6720 17 K 4.5837 7.7509 118.1405 54.6477 35.0523 176.2616 18 N 4.9121 8.5722 119.8851 50.8315 39.3518 174.9433 19 G 3.9125 8.3348 110.7033 43.6251 0.0000 170.9028 20 P 4.4768 0.0000 0.0000 61.3004 31.9238 173.9457 21 P 4.4861 0.0000 0.0000 61.4151 31.9158 173.9573 22 P 4.4772 0.0000 0.0000 61.4702 31.9374 174.2910 23 P 4.5255 0.0000 0.0000 62.2766 32.3640 175.5382 24 N 4.3769 8.6672 115.9828 55.3573 39.0975 174.6974 25 M 4.2878 7.3123 112.9904 54.6173 34.9003 174.2419 26 T 4.0383 8.6359 120.0222 62.6744 67.6541 171.6879 27 T 4.5026 7.8580 110.6675 62.1763 71.3600 173.5815 28 N 5.1085 7.5713 119.3415 51.3898 43.2058 175.2132 29 E 4.6283 8.4516 116.0968 56.7527 30.8332 174.7796 30 R 3.6779 8.0038 128.1368 58.4126 28.5569 176.5544 31 R 4.5973 7.6460 115.1616 54.3494 33.1747 176.0907 32 V 4.4540 8.1604 121.7047 59.9097 34.3574 174.9039 33 I 4.0803 8.2757 121.9054 61.8123 39.3777 175.8082 34 V 4.2920 7.1792 117.8285 60.6379 34.4680 171.9458 35 P 4.2203 0.0000 0.0000 64.8161 30.8195 175.7095 36 A 4.1132 6.6375 127.9836 50.7545 23.4816 175.4016 37 D 5.0211 7.1276 112.2459 50.8834 44.4102 175.9093 38 P 3.1336 0.0000 0.0000 64.8163 31.5264 177.7825 39 T 4.0163 7.6593 108.6978 63.4073 69.5778 175.0754 40 L 4.6941 7.3771 122.8585 53.7094 41.5019 175.7346 41 W 4.8158 7.8837 117.8895 55.8277 31.0627 176.2895 42 T 4.7328 7.9152 110.3519 59.8302 71.7036 174.9120 43 Q 4.1375 8.4551 118.1924 59.0701 28.5148 177.9712 44 E 4.0564 7.9873 121.0251 59.4237 29.6257 177.9660 45 H 3.9406 7.7206 115.5943 58.6100 28.0271 177.7192 46 V 4.1944 7.6570 118.9050 65.2283 31.3172 178.0962 47 R 4.1120 7.4143 118.2978 58.9394 30.4722 178.4482 48 Q 4.0447 8.4877 118.0963 58.8594 28.7206 179.0856 49 W 4.3375 7.9489 128.7693 60.4888 30.7476 177.5793 50 L 3.2678 7.5335 120.3580 58.2760 41.3014 178.8250 51 E 3.9423 8.3970 118.3064 58.8795 29.2605 179.4159 52 W 3.9161 8.2534 128.3373 60.2373 30.9328 177.7544 53 A 4.0702 8.5417 121.0906 55.6168 17.9354 179.6615 54 I 3.5875 7.7776 117.9247 64.1886 37.0200 178.6117 55 K 3.8895 7.1748 119.4066 59.1678 31.9480 178.3830 56 E 3.5301 7.5579 118.9643 59.6951 29.4823 178.4186 57 Y 3.8867 7.7754 116.8441 58.5890 39.1885 176.3697 58 S 4.0963 7.1733 112.2355 58.8977 60.2495 170.5881 59 L 4.4896 7.3806 119.7343 54.8687 43.8086 176.4922 60 M 4.5275 8.4709 114.1944 56.0100 33.5066 173.2640 61 E 3.7080 8.9048 123.6961 56.5420 26.1099 172.7060 62 I 4.7055 7.4722 119.2956 58.5679 41.6412 174.5390 63 D 4.6464 8.3839 126.2639 54.6994 41.4180 176.3091 64 T 4.8194 8.5723 112.8355 62.7483 71.0146 176.4543 65 S 4.1821 8.2120 116.3867 60.9616 63.0972 176.1343 66 F 3.7386 8.2578 122.1506 60.1024 39.2006 175.2461 67 F 5.1529 7.9125 118.6957 57.2021 39.2861 176.9885 68 Q 4.2773 7.8999 122.2151 59.1883 29.0247 176.6132 69 N 4.7911 7.5888 115.6546 51.7480 39.1849 173.5604 70 M 4.3729 8.0165 117.0885 54.2616 33.9379 175.0360 71 D 4.5731 8.5816 125.4607 54.0188 42.0794 177.5908 72 G 3.9465 9.0475 110.0824 48.2230 0.0000 176.0628 73 K 4.0834 8.0190 119.9886 59.3049 32.1848 179.0524 74 E 3.9907 8.1644 118.9778 59.3968 29.1237 179.2881 75 L 4.1220 7.3778 117.1492 57.8862 41.6428 179.0957 76 C 4.2713 7.7143 116.1087 62.5787 28.2995 175.9188 77 K 4.1410 7.9554 118.3958 58.2185 31.8469 177.6132 78 M 4.1120 7.4068 119.3646 55.6131 32.3047 175.4929 79 N 5.1728 8.8349 121.3277 50.9352 41.6627 175.0099 80 K 4.1422 8.8041 118.5824 60.2000 32.1871 178.4190 81 E 4.1350 8.1044 118.2324 59.5141 29.3922 178.4504 82 D 4.3451 8.1008 118.2957 57.7143 40.9139 179.0338 83 F 4.3737 8.7602 118.3889 60.3588 38.6706 177.7922 84 L 4.8193 7.5538 118.9692 57.3704 41.4329 179.4471 85 R 3.9954 7.5276 115.7319 58.4337 30.3497 178.3208 86 A 4.0453 7.5484 120.1493 53.3355 19.4405 176.4815 87 T 4.6791 8.2016 110.4359 59.4346 71.1227 172.6862 88 T 4.5412 8.1735 114.4756 60.9855 70.8658 175.0119 89 L 3.9232 8.3562 121.9057 58.4792 41.8901 177.8265 90 Y 4.0559 8.0979 117.8428 60.9870 38.8884 177.5707 91 N 4.3717 7.9318 116.5403 56.3524 38.7497 177.5441 92 T 3.6801 8.0409 117.3253 66.6544 68.1305 176.3814 93 E 3.8992 8.1495 120.3273 58.8627 28.9748 179.1806 94 V 3.4066 7.4041 118.2234 64.7839 31.3775 177.8255 95 L 4.0652 7.3073 118.3805 57.1509 42.0220 178.2237 96 L 3.8408 7.5400 120.1488 58.4323 41.8524 179.0958 97 S 4.1944 7.6458 113.7438 61.0341 62.1870 175.6624 98 H 4.2605 7.7579 120.5773 59.4815 28.6092 177.3678 99 L 3.8099 8.4526 121.2261 57.1958 41.4338 179.2466 100 S 4.4370 8.1259 114.0647 60.5807 63.1337 175.9437 101 Y 4.1049 8.0516 123.0177 60.5609 38.8889 177.3544 102 L 4.1246 7.8829 119.9151 58.0024 41.7722 179.8092 103 R 3.9355 7.3422 116.3646 58.5879 30.0988 178.6071 104 E 3.9039 7.8300 118.6358 59.2713 29.4316 179.1566 105 S 4.0947 7.5809 114.8994 61.3858 62.6273 176.5589 106 S 3.9971 7.8400 117.6808 61.3463 62.2201 176.4787 107 L 4.1928 7.2729 120.5131 57.3699 40.1660 178.6506 108 L 4.3792 8.0620 118.5885 57.3206 40.8856 178.6500 109 A 4.3603 7.5626 121.0967 54.2592 18.7473 177.0412 110 Y 4.3014 7.0988 112.5304 58.3222 36.3076 174.6510 111 N 5.1626 8.1795 122.1365 51.2489 42.2772 174.6779 112 T 3.7957 8.6697 113.6321 64.3761 68.9630 172.2910 113 T 3.2022 7.7748 125.7203 63.1670 65.3530 171.4669 114 S 4.4292 8.3076 121.9262 57.9141 61.1812 173.2917 115 H 4.1959 8.4348 126.0318 57.1211 26.3204 174.8873 116 T 4.6339 7.7207 102.5160 61.4126 69.4072 173.3277 117 D 4.8743 8.0607 119.9995 54.1443 43.2503 174.9346 118 Q 4.5561 8.0350 120.1736 54.2189 32.6504 175.4984 119 S 4.3322 8.6043 118.4599 58.2307 63.7165 173.7758 120 S 4.6793 8.3946 117.7472 57.1143 64.1018 175.2571 121 R 4.6292 8.2051 126.8370 54.9179 30.8135 175.6565 122 L 4.6092 7.7466 117.1465 53.0309 43.5293 176.6643 123 S 4.7423 8.3276 118.0977 55.6136 65.1467 173.8856 124 V 3.7349 8.3965 126.5704 61.7361 31.5917 175.2520 125 K 4.6206 7.9726 120.6048 55.3275 35.2205 174.0834 126 E 4.4999 8.5192 115.8341 56.3879 31.6438 173.4523 127 D 4.4896 8.6675 122.6261 52.5057 40.3394 172.4895 128 P 4.4175 0.0000 0.0000 63.2283 31.3718 176.2985 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 G 8.34 3.89 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 0.00 0.00 0.00 2 S 8.36 4.25 0.00 4.03 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 3 S 8.31 4.76 0.00 3.83 3.75 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 0.00 0.00 0.00 0.00 4 G 8.12 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 0.00 0.00 0.00 5 S 8.42 4.30 0.00 3.82 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 6 S 8.23 4.49 0.00 3.85 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 7 G 7.99 4.20 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 0.00 8 M 8.52 4.48 0.00 2.08 2.02 0.00 0.00 0.00 0.00 0.00 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.63 0.00 9 N 8.78 4.35 0.00 2.77 3.02 0.00 0.00 6.88 7.47 0.00 0.00 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 Y 8.03 3.24 0.00 3.13 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 11 N 7.86 5.14 0.00 2.88 2.80 0.00 0.00 6.01 7.63 0.00 0.00 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 S 8.25 4.68 0.00 3.78 3.73 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 13 Y 8.09 4.63 0.00 2.86 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 14 M 7.84 4.90 0.00 2.02 1.92 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.15 0.00 15 D 8.72 4.54 0.00 2.68 2.74 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 0.00 0.00 0.00 16 E 8.00 3.70 0.00 2.07 1.92 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 2.19 2.33 0.00 17 K 7.75 4.58 0.00 1.89 1.99 0.00 1.59 0.00 0.00 1.76 0.00 0.00 3.08 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.32 1.40 7.81 18 N 8.57 4.91 0.00 2.82 2.82 0.00 0.00 6.14 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 G 8.33 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 0.00 0.00 0.00 20 P 0.00 4.48 0.00 2.19 2.08 0.00 3.77 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 21 P 0.00 4.49 0.00 2.20 2.11 0.00 3.77 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 22 P 0.00 4.48 0.00 2.20 2.11 0.00 3.77 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 23 P 0.00 4.53 0.00 2.20 2.14 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 1.98 1.95 0.00 24 N 8.67 4.38 0.00 2.68 2.88 0.00 0.00 6.65 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 25 M 7.31 4.29 0.00 1.93 1.85 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.47 0.00 26 T 8.64 4.04 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 27 T 7.86 4.50 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 28 N 7.57 5.11 0.00 2.67 2.70 0.00 0.00 6.68 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 29 E 8.45 4.63 0.00 2.02 1.91 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 2.18 2.29 0.00 30 R 8.00 3.68 0.00 1.92 1.95 0.00 3.17 0.00 0.00 3.22 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.61 0.00 31 R 7.65 4.60 0.00 1.78 1.80 0.00 3.21 0.00 0.00 3.29 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.68 0.00 32 V 8.16 4.45 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 0.64 0.00 0.00 0.90 0.00 0.00 33 I 8.28 4.08 1.72 0.00 0.00 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.56 0.84 0.00 0.00 34 V 7.18 4.29 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 1.12 0.00 0.00 35 P 0.00 4.22 0.00 2.20 2.04 0.00 3.77 0.00 0.00 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 1.62 0.00 36 A 6.64 4.11 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 37 D 7.13 5.02 0.00 2.71 2.46 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 3.13 0.00 1.70 1.49 0.00 3.60 0.00 0.00 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.70 0.00 39 T 7.66 4.02 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 1.16 0.00 0.00 40 L 7.38 4.69 0.00 1.65 1.72 0.92 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 41 W 7.88 4.82 0.00 3.29 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 42 T 7.92 4.73 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 1.26 0.00 0.00 43 Q 8.46 4.14 0.00 2.38 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.63 6.97 0.00 0.00 0.00 0.00 0.00 2.42 2.48 0.00 44 E 7.99 4.06 0.00 1.98 1.78 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 2.31 2.35 0.00 45 H 7.72 3.94 0.00 2.93 1.33 0.00 5.86 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 V 7.66 4.19 2.44 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 1.44 0.00 0.00 1.33 0.00 0.00 47 R 7.41 4.11 0.00 2.19 2.00 0.00 3.44 0.00 0.00 3.25 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.89 0.00 48 Q 8.49 4.04 0.00 2.14 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.72 0.00 0.00 0.00 0.00 0.00 2.41 2.47 0.00 49 W 7.95 4.34 0.00 3.44 3.50 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.53 3.27 0.00 2.03 1.71 -0.08 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 51 E 8.40 3.94 0.00 2.25 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 0.00 2.36 2.37 0.00 52 W 8.25 3.92 0.00 3.56 3.43 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 53 A 8.54 4.07 1.09 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 0.00 0.00 54 I 7.78 3.59 1.80 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.90 0.87 0.00 0.00 55 K 7.17 3.89 0.00 1.80 1.55 0.00 1.63 0.00 0.00 1.51 0.00 0.00 2.78 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.34 1.36 7.81 56 E 7.56 3.53 0.00 1.16 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 1.59 1.69 0.00 57 Y 7.78 3.89 0.00 3.05 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 58 S 7.17 4.10 0.00 4.06 3.89 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 59 L 7.38 4.49 0.00 1.62 1.76 0.76 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 60 M 8.47 4.53 0.00 2.06 1.98 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.52 0.00 61 E 8.90 3.71 0.00 2.15 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 0.00 2.21 2.27 0.00 62 I 7.47 4.71 1.89 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 1.57 0.96 0.93 0.00 0.00 63 D 8.38 4.65 0.00 2.92 2.65 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 64 T 8.57 4.82 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 1.32 0.00 0.00 65 S 8.21 4.18 0.00 4.06 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 0.00 66 F 8.26 3.74 0.00 2.66 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 0.00 0.00 0.00 0.00 67 F 7.91 5.15 0.00 3.26 3.23 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 68 Q 7.90 4.28 0.00 2.13 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 7.33 0.00 0.00 0.00 0.00 0.00 2.40 2.35 0.00 69 N 7.59 4.79 0.00 2.66 2.75 0.00 0.00 6.88 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 70 M 8.02 4.37 0.00 2.20 2.14 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.64 0.00 71 D 8.58 4.57 0.00 2.77 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 G 9.05 3.95 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 0.00 0.00 0.00 0.00 0.00 0.00 73 K 8.02 4.08 0.00 1.82 1.86 0.00 1.68 0.00 0.00 1.81 0.00 0.00 2.95 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.51 1.64 7.81 74 E 8.16 3.99 0.00 2.21 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 2.31 2.34 0.00 75 L 7.38 4.12 0.00 1.87 1.62 1.26 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 76 C 7.71 4.27 0.00 3.13 2.93 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 0.00 0.00 0.00 77 K 7.96 4.14 0.00 1.85 1.86 0.00 1.86 0.00 0.00 1.69 0.00 0.00 3.02 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.43 1.52 7.81 78 M 7.41 4.11 0.00 0.88 1.72 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.62 0.00 79 N 8.83 5.17 0.00 2.76 2.79 0.00 0.00 6.23 7.29 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 80 K 8.80 4.14 0.00 1.78 1.91 0.00 1.68 0.00 0.00 1.74 0.00 0.00 3.16 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.46 1.66 7.81 81 E 8.10 4.14 0.00 2.07 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 2.42 2.42 0.00 82 D 8.10 4.35 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 83 F 8.76 4.37 0.00 3.26 3.06 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 84 L 7.55 4.82 0.00 1.86 1.75 0.96 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 85 R 7.53 4.00 0.00 1.77 1.85 0.00 3.09 0.00 0.00 3.20 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.76 0.00 86 A 7.55 4.05 1.03 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 87 T 8.20 4.68 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 88 T 8.17 4.54 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 1.23 0.00 0.00 89 L 8.36 3.92 0.00 1.74 1.75 0.95 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 90 Y 8.10 4.06 0.00 2.97 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 91 N 7.93 4.37 0.00 3.07 2.78 0.00 0.00 7.05 7.12 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 92 T 8.04 3.68 4.36 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 1.27 0.00 0.00 93 E 8.15 3.90 0.00 1.95 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 2.27 2.46 0.00 94 V 7.40 3.41 1.76 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 -0.14 0.00 0.00 0.47 0.00 0.00 95 L 7.31 4.07 0.00 1.15 1.56 0.72 -0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 96 L 7.54 3.84 0.00 1.67 1.64 1.07 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 97 S 7.65 4.19 0.00 4.01 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 98 H 7.76 4.26 0.00 3.47 3.69 0.00 5.64 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 99 L 8.45 3.81 0.00 1.80 1.56 -0.23 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 100 S 8.13 4.44 0.00 4.07 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 0.00 101 Y 8.05 4.10 0.00 3.10 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 0.00 102 L 7.88 4.12 0.00 1.60 1.68 0.80 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 103 R 7.34 3.94 0.00 1.92 1.92 0.00 3.06 0.00 0.00 3.14 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.39 0.00 104 E 7.83 3.90 0.00 2.07 1.67 0.00 0.00 0.00 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 2.30 0.00 105 S 7.58 4.09 0.00 3.94 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 0.00 106 S 7.84 4.00 0.00 3.83 3.68 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 0.00 107 L 7.27 4.19 0.00 1.91 1.77 0.97 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 108 L 8.06 4.38 0.00 1.90 1.89 0.90 0.63 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 0.00 109 A 7.56 4.36 1.19 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 0.00 110 Y 7.10 4.30 0.00 2.98 2.87 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 0.00 111 N 8.18 5.16 0.00 2.63 2.67 0.00 0.00 7.28 7.72 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 0.00 112 T 8.67 3.80 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 1.22 0.00 0.00 113 T 7.77 3.20 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 1.23 0.00 0.00 114 S 8.31 4.43 0.00 3.81 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 0.00 115 H 8.43 4.20 0.00 3.28 3.32 0.00 5.71 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 T 7.72 4.63 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 1.29 0.00 0.00 117 D 8.06 4.87 0.00 2.63 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 Q 8.04 4.56 0.00 2.01 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.80 0.00 0.00 0.00 0.00 0.00 2.25 2.31 0.00 119 S 8.60 4.33 0.00 3.86 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 0.00 120 S 8.39 4.68 0.00 3.95 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 0.00 121 R 8.21 4.63 0.00 1.75 1.87 0.00 3.17 0.00 0.00 3.22 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.64 0.00 122 L 7.75 4.61 0.00 1.59 1.59 0.92 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 123 S 8.33 4.74 0.00 3.77 3.68 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 0.00 124 V 8.40 3.73 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 0.75 0.00 0.00 0.93 0.00 0.00 125 K 7.97 4.62 0.00 1.84 1.81 0.00 1.61 0.00 0.00 1.76 0.00 0.00 3.03 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.29 1.38 7.81 126 E 8.52 4.50 0.00 2.04 1.94 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 2.13 2.27 0.00 127 D 8.67 4.49 0.00 2.83 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 0.00 128 P 0.00 4.42 0.00 2.17 2.03 0.00 3.79 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 1.98 1.96 0.00