NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 T 4.2846 8.0333 117.3315 63.6631 70.5322 173.0524 2 E 4.7487 8.8200 126.7324 54.2945 28.2815 174.3212 3 L 4.3081 8.2429 124.8100 54.4808 43.7976 176.6507 4 T 4.7207 7.8099 109.1548 59.3633 72.6001 174.6192 5 K 3.2768 8.5536 122.3958 60.1490 32.0489 179.3314 6 C 4.1341 8.0214 115.6646 59.9736 39.5286 176.0483 7 K 3.7569 7.6219 119.8460 59.3782 31.5303 179.6363 8 V 3.3926 7.8262 118.6898 66.0714 31.2585 178.0153 9 S 4.1118 8.0266 113.8526 62.1201 62.9933 176.4511 10 H 4.3823 8.2649 118.2262 58.8793 28.3048 177.5224 11 A 4.0419 7.7366 121.3594 54.8770 18.3268 178.7686 12 I 4.2045 7.6898 110.0345 60.9227 38.2725 177.6726 13 K 3.7852 7.8517 123.1765 60.5236 31.9612 178.2618 14 D 4.4885 7.9940 114.8791 55.7405 41.4178 175.9405 15 I 4.0191 7.8250 118.3615 61.3398 38.5897 174.4947 16 D 4.6054 7.6530 119.6360 56.7227 41.3196 176.8843 17 G 4.0426 9.3553 114.6919 45.6482 0.0000 172.6318 18 Y 4.1114 8.0853 122.2820 58.7638 39.1538 175.5834 19 Q 3.1415 9.0595 125.9813 56.7859 27.6490 173.2004 20 G 3.8806 8.2461 101.7727 46.0601 0.0000 173.7780 21 I 4.4905 7.6868 120.9959 59.0339 38.9594 176.3141 22 S 5.0760 9.2555 121.5464 57.5579 65.4740 175.3027 23 L 4.2528 8.4380 121.2866 57.6378 41.2905 179.7267 24 L 4.1339 7.9837 118.7077 57.9960 41.7039 179.1144 25 E 3.8918 7.9830 118.2614 59.2407 29.2938 179.5961 26 W 3.9678 8.1459 118.6818 59.6253 29.2200 178.3099 27 A 4.0133 8.5156 121.1937 55.3591 17.7276 178.9611 28 C 2.0000 7.6369 116.6667 58.8848 44.2033 175.8248 29 V 3.4561 7.7167 120.1179 66.1610 31.0617 178.0065 30 L 3.9526 8.7221 119.6107 57.4955 41.3281 179.1927 31 F 3.0523 7.8576 120.3471 61.5054 39.0759 177.0719 32 H 3.9391 7.5008 113.7348 58.8150 28.4787 177.8335 33 T 4.1826 7.9115 117.4909 65.9915 68.5442 175.7178 34 S 4.4585 7.8521 111.1500 56.9742 64.7054 174.2620 35 G 3.2335 8.5047 108.4225 46.8527 0.0000 173.8081 36 Y 3.7610 7.7551 113.1852 58.5495 35.6859 168.8174 37 D 4.8909 7.8711 121.1603 52.9346 41.0725 177.2692 38 T 4.1241 8.6962 118.3213 63.7429 68.9126 175.6363 39 Q 4.6790 8.5292 120.4570 55.4084 29.4455 175.2395 40 A 4.1521 7.8543 121.3299 52.2979 19.5454 177.6897 41 V 4.5296 8.2350 121.1626 61.2116 34.3392 174.6150 42 V 4.3554 8.2772 127.1165 60.5320 34.8961 175.5054 43 N 5.1185 8.0714 124.5290 50.9416 37.6250 175.4261 44 D 4.2613 7.6640 118.1425 55.3115 42.5341 175.8192 45 N 4.1153 8.2364 128.4373 55.1444 38.1974 176.0964 46 G 3.9059 8.9506 104.4235 45.4589 0.0000 172.3440 47 S 5.0372 7.8947 114.5573 56.6741 65.8599 172.5725 48 T 5.0276 8.5501 115.7905 61.7974 71.8317 173.1979 49 E 5.1931 9.2159 125.6493 55.0166 32.0364 174.5490 50 Y 4.9097 9.4085 122.0306 57.3865 41.2118 177.7664 51 G 4.3440 8.8500 111.0819 44.8324 0.0000 173.4696 52 L 4.0355 8.7578 118.9799 57.5890 42.0345 179.0751 53 F 4.5938 8.4747 113.4337 57.1804 39.8633 175.1181 54 Q 3.5664 7.8443 118.9525 56.9861 26.6811 174.5489 55 I 4.0008 8.0266 118.9406 61.0852 38.2517 176.4291 56 S 5.0097 9.0533 120.8673 57.9411 62.9584 174.1118 57 D 5.0006 8.4311 124.6570 53.1342 39.8482 177.3666 58 R 2.5833 7.5557 121.1134 58.7012 30.2027 177.2021 59 F 4.7203 7.3655 112.1428 57.4021 42.4673 176.8801 60 W 4.2930 8.0326 120.9597 58.7912 29.2628 173.4371 61 C 5.4612 7.9715 110.8507 53.3260 43.6470 172.3017 62 K 4.7183 8.8434 121.1941 55.0505 33.4770 174.9499 63 S 4.7123 8.3832 123.6729 57.3185 65.4247 173.2319 64 S 4.4745 8.8615 113.4113 61.2403 63.5217 175.6201 65 E 4.0989 8.5033 119.0273 59.0281 29.6117 177.7028 66 F 4.6113 7.7641 118.4549 54.9326 38.0076 174.4298 67 P 4.2775 0.0000 0.0000 65.0930 31.6328 177.8206 68 E 4.6088 7.8766 113.4811 55.9580 30.1014 176.0427 69 S 4.3849 7.6238 113.4604 58.9226 63.0715 173.6912 70 E 3.9329 8.9899 125.0394 58.2268 29.2515 177.1611 71 N 4.1441 8.1700 115.3128 53.8474 37.3777 175.2759 72 I 3.6802 7.9894 119.3922 64.7835 37.5830 177.1084 73 C 4.4650 8.7014 115.4731 56.7184 40.7401 173.3547 74 G 3.9557 8.5396 109.2217 46.4456 0.0000 173.1098 75 I 4.4655 6.9318 115.5680 59.2173 41.6871 173.3408 76 S 4.6048 8.4091 120.2793 58.1156 63.0635 175.9740 77 C 4.1435 8.8233 124.7816 59.8613 33.8353 176.2104 78 D 4.1297 7.7538 120.3676 56.7106 40.1282 177.9912 79 K 4.3331 7.8027 117.0974 57.3612 32.3260 177.2753 80 L 4.7849 7.8082 118.8712 53.8336 41.8596 177.2893 81 L 5.1640 8.0393 116.5049 53.6808 42.6005 176.3725 82 D 4.9510 7.7692 119.4783 52.5802 41.5955 176.4107 83 D 4.7479 8.6556 121.7524 54.6953 41.2300 176.3448 84 E 4.4101 8.8138 120.9324 55.1871 28.7003 176.5937 85 L 4.5240 8.0715 124.9570 55.2023 42.0056 178.3204 86 D 4.3574 8.0495 120.0188 57.3865 40.9275 177.9589 87 D 4.4292 7.9691 118.4973 55.7956 39.3851 178.2653 88 D 4.2794 7.8161 120.4192 57.1125 40.8616 178.4509 89 I 2.9914 8.1346 120.4506 64.0366 37.2124 178.2798 90 A 3.7488 7.6873 121.6099 55.2553 18.1428 178.9131 91 C 4.1333 7.8954 116.2977 59.4865 43.5521 175.5548 92 A 3.7890 7.6236 122.7684 54.9326 17.7983 179.5987 93 K 3.3856 7.7566 117.1119 59.5583 32.0653 179.5799 94 K 4.0380 7.6927 118.0499 59.6740 31.9450 179.4908 95 I 3.0274 7.4020 119.9945 63.9474 36.6639 178.5270 96 L 4.2400 8.2640 120.1000 57.8125 41.2832 179.4046 97 A 4.1465 8.6029 120.2864 54.4903 18.3575 179.0194 98 I 4.1724 7.8742 117.1203 63.1181 38.1423 177.2288 99 K 4.4515 8.1080 117.6769 55.8442 33.7863 175.9111 100 G 4.0882 8.4720 104.5614 45.0049 0.0000 173.8807 101 I 3.9456 8.3599 117.5565 63.9802 37.8192 177.0614 102 D 4.6744 8.1332 118.2577 56.1068 40.8233 176.5719 103 Y 3.8543 7.8746 120.5719 59.8711 38.9274 175.9203 104 W 4.3163 8.3889 120.9647 55.1723 27.9936 176.7375 105 K 3.9369 8.4867 123.8787 59.3072 31.7959 178.4137 106 A 4.1540 8.0860 120.0366 54.3560 18.4099 178.4220 107 Y 3.9761 8.0334 118.8457 60.7622 38.5865 178.1902 108 K 3.5976 7.9716 119.4464 58.8344 32.5640 176.2860 109 P 4.3480 0.0000 0.0000 65.0711 31.4881 176.7057 110 M 4.5126 7.7718 116.0067 55.3342 33.1472 175.4764 111 C 5.0035 7.9443 116.0740 56.8063 41.3451 174.9780 112 S 4.0563 8.0729 116.0191 58.9235 63.2197 173.5019 113 E 4.6074 7.5709 116.4322 54.6287 33.0010 175.0660 114 K 3.8341 8.4217 115.2557 57.3946 29.2814 175.3964 115 L 4.7420 7.4710 119.3432 56.6274 42.6678 178.1949 116 E 3.9609 8.3760 119.4296 59.3847 29.1763 178.6695 117 Q 3.9136 7.9759 116.2624 58.5794 28.6181 177.6685 118 W 4.4799 7.9255 118.7307 56.2715 29.7233 176.4131 119 R 4.0081 7.5389 120.8285 56.1184 30.3370 175.0128 120 C 4.6045 8.6749 125.2664 55.5259 43.2175 172.7730 121 E 4.2814 8.5697 127.9683 56.5666 29.2596 176.5580 122 K 4.4020 7.6080 120.1701 54.2463 33.3858 174.6731 123 P 4.4342 0.0000 0.0000 63.1504 31.2089 176.0777 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 T 8.03 4.28 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 1.23 0.00 0.00 2 E 8.82 4.75 0.00 2.08 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 0.00 2.31 2.43 0.00 3 L 8.24 4.31 0.00 1.61 1.55 0.88 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 4 T 7.81 4.72 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 5 K 8.55 3.28 0.00 2.06 1.91 0.00 2.05 0.00 0.00 2.00 0.00 0.00 2.98 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.57 1.79 7.81 6 C 8.02 4.13 0.00 2.91 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 7 K 7.62 3.76 0.00 1.87 1.79 0.00 1.63 0.00 0.00 1.55 0.00 0.00 2.89 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.39 7.81 8 V 7.83 3.39 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 0.95 0.00 0.00 0.44 0.00 0.00 9 S 8.03 4.11 0.00 3.90 3.96 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 10 H 8.26 4.38 0.00 3.29 3.30 0.00 5.65 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 A 7.74 4.04 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 12 I 7.69 4.20 1.71 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.14 0.85 0.00 0.00 13 K 7.85 3.79 0.00 1.89 1.93 0.00 1.65 0.00 0.00 1.56 0.00 0.00 2.82 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.49 1.54 7.81 14 D 7.99 4.49 0.00 2.58 2.61 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.83 4.02 1.55 0.00 0.00 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.94 0.53 0.00 0.00 16 D 7.65 4.61 0.00 2.80 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 17 G 9.36 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 0.00 0.00 0.00 18 Y 8.09 4.11 0.00 3.19 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 19 Q 9.06 3.14 0.00 2.41 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.38 0.00 0.00 0.00 0.00 0.00 2.36 2.43 0.00 20 G 8.25 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 21 I 7.69 4.49 1.95 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 1.41 0.58 0.09 0.00 0.00 22 S 9.26 5.08 0.00 4.07 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 23 L 8.44 4.25 0.00 1.80 1.85 1.02 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 24 L 7.98 4.13 0.00 1.78 2.01 1.03 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 25 E 7.98 3.89 0.00 1.98 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 2.39 2.39 0.00 26 W 8.15 3.97 0.00 3.49 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 27 A 8.52 4.01 1.60 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 0.00 0.00 28 C 7.64 2.00 0.00 1.25 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 29 V 7.72 3.46 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 0.91 0.00 0.00 0.71 0.00 0.00 30 L 8.72 3.95 0.00 1.88 1.76 0.45 -0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 31 F 7.86 3.05 0.00 2.64 2.83 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 32 H 7.50 3.94 0.00 3.10 3.29 0.00 5.71 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 T 7.91 4.18 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 1.46 0.00 0.00 34 S 7.85 4.46 0.00 3.93 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 35 G 8.50 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 0.00 0.00 0.00 36 Y 7.76 3.76 0.00 3.27 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 37 D 7.87 4.89 0.00 2.73 2.66 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 38 T 8.70 4.12 4.45 0.00 0.00 0.00 0.00 0.00 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 39 Q 8.53 4.68 0.00 2.04 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.84 0.00 0.00 0.00 0.00 0.00 2.53 2.40 0.00 40 A 7.85 4.15 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 41 V 8.23 4.53 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 0.56 0.00 0.00 0.93 0.00 0.00 42 V 8.28 4.36 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 0.71 0.00 0.00 0.96 0.00 0.00 43 N 8.07 5.12 0.00 2.72 2.76 0.00 0.00 7.21 8.06 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 44 D 7.66 4.26 0.00 2.76 2.57 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.24 4.12 0.00 2.89 2.08 0.00 0.00 7.15 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 46 G 8.95 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 47 S 7.89 5.04 0.00 3.97 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 48 T 8.55 5.03 4.50 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 0.56 0.00 0.00 49 E 9.22 5.19 0.00 2.00 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 0.00 2.29 2.25 0.00 50 Y 9.41 4.91 0.00 2.91 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 51 G 8.85 4.34 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 0.00 52 L 8.76 4.04 0.00 1.62 1.77 0.94 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 53 F 8.47 4.59 0.00 3.22 3.54 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 54 Q 7.84 3.57 0.00 2.39 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.04 6.84 0.00 0.00 0.00 0.00 0.00 2.54 2.69 0.00 55 I 8.03 4.00 2.00 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 1.04 0.80 0.97 0.00 0.00 56 S 9.05 5.01 0.00 4.04 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 0.00 57 D 8.43 5.00 0.00 2.74 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 58 R 7.56 2.58 0.00 1.21 1.40 0.00 2.95 0.00 0.00 2.99 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 59 F 7.37 4.72 0.00 1.92 2.23 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 60 W 8.03 4.29 0.00 3.50 3.20 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 61 C 7.97 5.46 0.00 3.01 3.17 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 62 K 8.84 4.72 0.00 1.92 1.80 0.00 1.56 0.00 0.00 1.69 0.00 0.00 2.91 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.33 1.36 7.81 63 S 8.38 4.71 0.00 3.93 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 64 S 8.86 4.47 0.00 3.93 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 65 E 8.50 4.10 0.00 2.22 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 2.41 2.44 0.00 66 F 7.76 4.61 0.00 3.08 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 67 P 0.00 4.28 0.00 2.04 2.12 0.00 3.62 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.28 0.00 68 E 7.88 4.61 0.00 2.08 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 2.21 2.31 0.00 69 S 7.62 4.38 0.00 4.03 3.90 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 70 E 8.99 3.93 0.00 2.01 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 2.44 2.26 0.00 71 N 8.17 4.14 0.00 2.86 2.77 0.00 0.00 7.19 7.82 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 72 I 7.99 3.68 1.77 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.52 0.93 0.00 0.00 73 C 8.70 4.47 0.00 3.25 3.15 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 74 G 8.54 3.96 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 0.00 0.00 0.00 75 I 6.93 4.47 1.85 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 1.27 1.42 0.89 0.00 0.00 76 S 8.41 4.60 0.00 3.86 3.67 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 0.00 0.00 0.00 77 C 8.82 4.14 0.00 2.18 1.56 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 78 D 7.75 4.13 0.00 2.61 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 79 K 7.80 4.33 0.00 1.86 2.03 0.00 1.69 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.45 1.60 7.81 80 L 7.81 4.78 0.00 1.91 1.78 0.96 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 81 L 8.04 5.16 0.00 1.84 1.74 1.15 1.19 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 82 D 7.77 4.95 0.00 2.77 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 83 D 8.66 4.75 0.00 2.67 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 84 E 8.81 4.41 0.00 1.94 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 2.38 2.41 0.00 85 L 8.07 4.52 0.00 1.70 1.77 0.92 1.32 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 86 D 8.05 4.36 0.00 2.65 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 87 D 7.97 4.43 0.00 2.90 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 88 D 7.82 4.28 0.00 2.91 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 89 I 8.13 2.99 1.87 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 1.31 0.74 0.62 0.00 0.00 90 A 7.69 3.75 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 91 C 7.90 4.13 0.00 3.04 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 92 A 7.62 3.79 0.39 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 93 K 7.76 3.39 0.00 1.63 1.29 0.00 1.33 0.00 0.00 1.07 0.00 0.00 2.58 0.00 0.00 2.69 0.00 0.00 0.00 0.00 0.30 1.05 7.81 94 K 7.69 4.04 0.00 1.98 1.97 0.00 1.71 0.00 0.00 1.66 0.00 0.00 2.98 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.43 1.57 7.81 95 I 7.40 3.03 1.61 0.00 0.00 -0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.28 -0.31 0.00 0.00 96 L 8.26 4.24 0.00 2.09 2.02 1.27 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 97 A 8.60 4.15 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 98 I 7.87 4.17 2.24 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 1.51 0.88 1.05 0.00 0.00 99 K 8.11 4.45 0.00 1.95 1.94 0.00 2.07 0.00 0.00 1.99 0.00 0.00 3.18 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.43 1.58 7.81 100 G 8.47 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 0.00 0.00 0.00 0.00 101 I 8.36 3.95 1.57 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.29 0.47 0.63 0.00 0.00 102 D 8.13 4.67 0.00 2.78 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 0.00 103 Y 7.87 3.85 0.00 2.59 2.23 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 0.00 104 W 8.39 4.32 0.00 3.74 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 0.00 105 K 8.49 3.94 0.00 1.68 1.86 0.00 1.62 0.00 0.00 1.64 0.00 0.00 2.89 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.35 1.48 7.81 106 A 8.09 4.15 1.35 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 0.00 0.00 0.00 107 Y 8.03 3.98 0.00 3.01 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 0.00 108 K 7.97 3.60 0.00 1.77 1.81 0.00 1.84 0.00 0.00 1.76 0.00 0.00 3.04 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.37 1.37 7.81 109 P 0.00 4.35 0.00 2.17 2.13 0.00 3.91 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.96 0.00 110 M 7.77 4.51 0.00 1.88 2.08 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 2.33 2.52 0.00 111 C 7.94 5.00 0.00 2.78 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 0.00 112 S 8.07 4.06 0.00 3.73 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 0.00 113 E 7.57 4.61 0.00 2.01 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 2.16 2.35 0.00 114 K 8.42 3.83 0.00 1.91 1.84 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.78 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.38 1.46 7.81 115 L 7.47 4.74 0.00 1.78 1.85 0.96 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 116 E 8.38 3.96 0.00 2.10 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 2.39 2.44 0.00 117 Q 7.98 3.91 0.00 1.83 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.81 0.00 0.00 0.00 0.00 0.00 2.22 1.16 0.00 118 W 7.93 4.48 0.00 3.48 3.36 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 0.00 119 R 7.54 4.01 0.00 1.86 1.96 0.00 3.52 0.00 0.00 3.16 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.61 0.00 120 C 8.67 4.60 0.00 2.98 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 0.00 121 E 8.57 4.28 0.00 1.99 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 2.30 2.23 0.00 122 K 7.61 4.40 0.00 1.75 1.75 0.00 1.94 0.00 0.00 1.74 0.00 0.00 3.00 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.41 1.56 7.81 123 P 0.00 4.43 0.00 2.08 1.97 0.00 3.77 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.10 0.00