NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 R 4.1823 8.0976 119.6936 57.2741 30.9993 174.6554 3 H 3.9470 8.9466 117.1880 55.4151 27.8279 173.3034 4 L 4.3447 8.3719 121.6239 55.6520 42.8434 179.4008 5 K 3.9989 8.0239 117.2259 59.1654 32.2450 176.7150 6 S 4.6018 7.5087 113.0695 56.8544 65.3260 172.8541 7 G 3.7914 8.5685 109.3861 45.8352 0.0000 175.0298 8 R 3.5630 8.6107 120.7314 56.6696 30.0840 174.8642 9 K 4.7380 8.0749 113.2338 56.0928 35.4085 175.0925 10 L 4.4913 8.0900 118.0477 53.9747 45.4497 174.5592 11 N 4.6272 8.3410 120.0390 52.5084 41.0576 174.7878 12 R 3.9652 9.0937 121.8552 55.2743 30.7270 177.3919 13 H 5.0593 7.8674 121.8338 55.6409 26.9673 175.9000 14 S 4.6463 8.6952 110.7056 59.6294 64.5890 175.0407 15 S 4.2296 8.0917 118.1327 60.9475 62.5029 175.9126 16 H 4.0484 8.1326 121.6428 59.0200 29.8252 177.0970 17 R 3.7198 7.8514 117.4069 59.2051 29.1270 178.1562 18 L 4.0588 8.6760 120.9880 58.1159 42.1763 178.8864 19 A 4.0571 8.0899 120.5428 54.6558 18.1190 179.4295 20 L 3.7282 7.9786 119.5733 58.5080 42.1422 178.6033 21 Y 3.8131 7.4438 116.4816 61.1407 37.6433 178.9367 22 R 4.0152 7.7708 118.7551 59.4387 30.2515 178.9247 23 N 4.3238 8.4001 116.5483 56.5127 38.5773 177.5870 24 Q 4.0332 8.3855 119.5081 58.6727 28.7044 178.5247 25 A 4.1134 8.5091 122.4522 54.9280 18.2575 179.5981 26 K 3.8931 8.3191 117.1907 60.1278 32.2811 179.8511 27 S 4.2071 8.0287 114.4440 61.2146 62.6242 176.5844 28 L 4.0652 8.0238 123.5286 57.8776 41.6607 178.4569 29 L 4.1708 8.1257 117.3214 56.6483 41.7376 178.7161 30 T 4.1779 7.3543 115.4722 65.6898 68.9710 175.7647 31 H 4.7945 8.2623 115.1280 54.6280 30.4112 175.2739 32 G 4.3249 8.4528 113.9727 45.1629 0.0000 173.2709 33 R 4.9113 7.7800 119.4337 54.1865 31.9337 175.8418 34 I 4.6787 8.2505 125.4822 59.5310 40.6111 175.0420 35 T 4.7739 8.5105 117.6172 61.5334 70.4721 173.7548 36 T 4.3945 8.2719 117.6269 61.6209 72.0188 172.2113 37 T 4.3309 8.2642 112.6571 61.6326 69.2547 174.9675 38 V 3.5453 8.0175 124.1920 65.9641 31.8995 176.5515 39 P 4.3827 0.0000 0.0000 65.6741 31.2499 178.4262 40 K 3.8198 7.9135 116.5900 59.6343 31.9197 179.0462 41 A 4.0049 7.9791 120.5906 55.2696 17.9861 179.7408 42 K 3.9076 7.9300 116.5582 59.8360 31.5993 179.4650 43 E 4.0241 8.1949 118.2772 59.1848 29.6844 178.8253 44 L 4.2913 8.5876 120.6698 57.6398 41.8957 178.9936 45 R 3.9852 8.2139 119.3848 59.6437 30.2728 178.8139 46 G 3.6477 7.7330 105.0455 47.2542 0.0000 175.5990 47 F 4.0409 7.9182 122.0808 61.1647 39.4072 177.4472 48 V 3.6201 7.9065 117.7227 66.3221 31.3362 177.4578 49 D 4.3834 7.8687 118.5716 57.8614 40.6408 178.6791 50 H 4.0484 7.7535 117.5419 59.2172 29.7998 177.3585 51 L 3.7865 7.2468 120.1246 57.6119 41.2656 179.5809 52 I 3.3075 7.6402 119.8634 64.6172 36.8537 178.1068 53 H 3.6784 7.6192 117.5521 58.6089 29.8576 176.7267 54 L 4.0035 7.6412 122.3434 57.8631 41.7194 178.5476 55 A 3.5749 7.7180 119.8852 54.1356 18.2665 179.0726 56 K 3.9111 7.6888 117.7108 57.6350 32.5404 177.5096 57 R 4.6651 8.0554 122.9888 55.2758 28.9532 175.6983 58 G 4.0273 9.0221 108.4947 46.0162 0.0000 173.0265 59 D 4.4342 7.7310 121.2427 52.8831 39.7527 177.7362 60 L 3.8779 8.4238 121.3947 58.8851 40.2486 179.0695 61 H 4.0454 8.1984 118.9275 59.3199 29.6790 176.8588 62 A 4.0410 7.8575 120.6688 55.2009 18.4323 179.1685 63 R 4.0902 7.7624 117.0136 59.7381 30.0763 178.6914 64 R 3.9725 8.6317 118.2710 59.1197 30.2281 178.9605 65 L 3.9100 7.9026 120.3948 58.0099 42.1708 178.8877 66 V 3.8462 7.9244 117.4736 64.9733 31.3191 177.7953 67 L 4.5861 7.3075 119.1492 56.9047 41.3882 179.2275 68 R 4.0992 7.3450 116.9416 59.3894 30.0948 178.3509 69 D 4.6644 7.9596 116.8341 55.9763 41.5579 176.4266 70 L 4.3202 7.6734 119.6703 54.3431 42.3080 177.7581 71 Q 4.0863 8.6529 124.8575 57.9358 30.1208 176.0069 72 D 4.4178 7.9360 118.0253 54.1942 42.1987 176.9274 73 V 3.7026 8.4477 126.6726 65.8462 31.6300 178.0343 74 K 4.0732 8.4321 118.6386 59.0112 31.9370 179.1097 75 L 3.9726 7.6623 120.7874 58.0958 42.0800 179.4435 76 V 3.7052 7.7812 118.8218 64.7519 31.3656 178.2436 77 R 4.0063 8.1319 119.4248 59.2222 29.8791 178.3843 78 K 4.0375 8.3135 119.3712 58.8307 32.1040 178.7505 79 L 3.8920 7.6538 120.6242 58.0340 41.8905 178.4528 80 F 4.3458 8.2068 115.0712 58.9759 38.9733 176.2827 81 D 4.7335 7.5500 116.9845 55.7291 41.9749 177.2840 82 E 4.3533 8.0116 118.4302 58.3478 30.2081 177.9603 83 I 3.8280 7.6759 117.4691 64.3847 37.6867 177.8289 84 A 4.1015 8.3037 121.7269 54.8600 18.1955 177.8732 85 P 4.2377 0.0000 0.0000 65.8539 31.2170 178.8928 86 R 3.8635 7.5840 115.9578 58.6832 29.8651 177.0275 87 Y 4.6747 7.4563 114.0863 57.4656 38.4824 175.7338 88 R 3.9541 8.0557 121.4802 57.9098 30.4994 177.9058 89 D 4.6415 8.8328 121.9215 55.2094 40.2105 174.5340 90 R 4.2249 7.7439 121.2735 54.4554 28.6378 176.4805 91 Q 4.0251 7.2472 116.5531 56.6173 29.4476 177.9814 92 G 3.6839 8.4856 111.1467 45.4741 0.0000 172.1053 93 G 3.7638 8.0264 104.0524 46.8149 0.0000 174.8197 94 Y 4.2766 7.5040 114.5947 58.7575 38.1082 175.0205 95 T 4.8798 7.3016 112.9472 60.9216 71.2394 172.5275 96 R 4.7790 9.2502 124.1995 54.5164 33.9151 173.9857 97 V 4.9858 8.4588 117.5379 59.5887 34.4983 175.0044 98 L 4.8210 8.8987 124.7151 52.5995 45.4548 176.1630 99 K 4.4160 8.8608 123.6349 56.5192 32.6521 176.3967 100 L 4.7368 8.5598 124.6046 53.1999 43.0410 176.9582 101 A 4.1198 8.6372 124.5002 54.6341 18.9340 177.7921 102 E 4.3040 7.8875 114.3455 57.0213 30.6788 177.1745 103 R 4.6750 8.1384 119.1454 54.6805 34.0884 175.3825 104 R 3.9155 8.7295 125.5987 56.4391 30.9228 176.2074 105 R 4.1524 8.5823 126.6514 57.7367 30.9006 175.3753 106 G 4.3478 9.0762 118.2377 45.5655 0.0000 174.2796 107 D 4.5335 7.8156 116.8555 51.7904 40.4226 176.9056 108 G 3.8894 8.3356 107.2208 46.1549 0.0000 173.4042 109 A 4.2393 8.0477 122.3705 50.9121 19.4892 176.1187 110 P 4.6400 0.0000 0.0000 62.8370 32.7881 175.9025 111 L 4.7527 8.4477 122.8710 53.9525 44.9080 174.8402 112 A 5.1342 8.2552 120.8519 51.5184 23.2876 174.6069 113 L 4.9760 9.0117 119.1483 53.7204 45.7733 176.0431 114 V 4.6288 8.8008 126.5471 61.3724 32.2864 172.6855 115 E 4.6853 9.0217 128.5145 54.2070 31.5565 174.7217 116 L 4.6582 8.3772 127.6073 54.3409 41.5924 177.1311 117 V 3.7551 8.4311 123.7304 62.5209 31.9061 176.0585 118 E 4.3019 8.5051 121.8025 57.0755 29.3820 175.1146 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 2 R 8.10 4.18 0.00 1.72 1.80 0.00 3.43 0.00 0.00 3.35 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.57 0.00 3 H 8.95 3.95 0.00 3.45 3.40 0.00 5.52 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 L 8.37 4.34 0.00 1.75 1.64 0.92 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 5 K 8.02 4.00 0.00 1.77 1.88 0.00 1.67 0.00 0.00 1.82 0.00 0.00 3.15 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.46 1.51 7.81 6 S 7.51 4.60 0.00 4.02 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 7 G 8.57 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 0.00 0.00 0.00 8 R 8.61 3.56 0.00 2.06 2.03 0.00 3.01 0.00 0.00 3.32 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.61 0.00 9 K 8.07 4.74 0.00 1.84 1.78 0.00 1.63 0.00 0.00 1.85 0.00 0.00 3.05 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.32 1.41 7.81 10 L 8.09 4.49 0.00 1.64 1.64 0.97 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 11 N 8.34 4.63 0.00 2.62 2.65 0.00 0.00 7.08 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 12 R 9.09 3.97 0.00 1.69 1.65 0.00 2.98 0.00 0.00 2.86 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 1.34 0.00 13 H 7.87 5.06 0.00 3.25 2.40 0.00 5.67 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 S 8.70 4.65 0.00 4.08 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 15 S 8.09 4.23 0.00 4.10 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 16 H 8.13 4.05 0.00 2.82 2.97 0.00 5.68 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 R 7.85 3.72 0.00 1.99 2.30 0.00 3.12 0.00 0.00 3.48 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.87 0.00 18 L 8.68 4.06 0.00 1.83 1.94 0.98 1.32 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 19 A 8.09 4.06 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 20 L 7.98 3.73 0.00 1.69 1.52 0.78 0.59 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 21 Y 7.44 3.81 0.00 2.59 1.45 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 0.00 22 R 7.77 4.02 0.00 2.04 2.04 0.00 3.17 0.00 0.00 3.23 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.87 0.00 23 N 8.40 4.32 0.00 2.86 2.83 0.00 0.00 7.05 6.86 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 24 Q 8.39 4.03 0.00 2.05 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.33 2.45 0.00 25 A 8.51 4.11 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 0.00 0.00 26 K 8.32 3.89 0.00 2.05 1.90 0.00 1.69 0.00 0.00 1.67 0.00 0.00 3.03 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.50 1.75 7.81 27 S 8.03 4.21 0.00 3.92 3.97 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 28 L 8.02 4.07 0.00 1.94 1.88 0.95 0.53 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 29 L 8.13 4.17 0.00 1.78 1.70 0.89 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 30 T 7.35 4.18 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 0.97 0.00 0.00 31 H 8.26 4.79 0.00 3.13 3.33 0.00 5.72 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 G 8.45 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 0.00 0.00 0.00 0.00 33 R 7.78 4.91 0.00 1.69 1.89 0.00 3.24 0.00 0.00 3.26 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.71 0.00 34 I 8.25 4.68 1.89 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 1.32 1.02 0.92 0.00 0.00 35 T 8.51 4.77 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 1.21 0.00 0.00 36 T 8.27 4.39 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 1.21 0.00 0.00 37 T 8.26 4.33 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 1.19 0.00 0.00 38 V 8.02 3.55 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 0.86 0.00 0.00 0.97 0.00 0.00 39 P 0.00 4.38 0.00 2.19 2.08 0.00 3.61 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.17 0.00 40 K 7.91 3.82 0.00 1.95 2.00 0.00 1.62 0.00 0.00 1.56 0.00 0.00 2.90 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.37 1.43 7.81 41 A 7.98 4.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.93 3.91 0.00 2.01 1.91 0.00 1.68 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.77 7.81 43 E 8.19 4.02 0.00 2.26 2.45 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 2.67 2.51 0.00 44 L 8.59 4.29 0.00 1.87 1.99 0.99 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 45 R 8.21 3.99 0.00 2.05 2.19 0.00 3.16 0.00 0.00 3.19 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.68 0.00 46 G 7.73 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 0.00 0.00 0.00 47 F 7.92 4.04 0.00 3.00 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 48 V 7.91 3.62 2.22 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 1.03 0.00 0.00 1.12 0.00 0.00 49 D 7.87 4.38 0.00 2.80 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 50 H 7.75 4.05 0.00 3.23 3.26 0.00 5.79 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 51 L 7.25 3.79 0.00 1.73 1.53 0.93 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 52 I 7.64 3.31 1.44 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.66 -0.01 0.00 0.00 53 H 7.62 3.68 0.00 3.05 3.21 0.00 5.75 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 L 7.64 4.00 0.00 1.79 1.59 0.79 0.94 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 55 A 7.72 3.57 0.56 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 0.00 0.00 56 K 7.69 3.91 0.00 1.58 1.76 0.00 1.73 0.00 0.00 1.62 0.00 0.00 3.59 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.37 1.45 7.81 57 R 8.06 4.67 0.00 1.87 1.09 0.00 3.57 0.00 0.00 3.25 7.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.59 0.00 58 G 9.02 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 59 D 7.73 4.43 0.00 2.85 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 60 L 8.42 3.88 0.00 1.80 1.89 0.89 0.57 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 61 H 8.20 4.05 0.00 3.19 3.51 0.00 5.68 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 62 A 7.86 4.04 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 R 7.76 4.09 0.00 1.44 1.94 0.00 2.83 0.00 0.00 3.17 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.26 0.00 64 R 8.63 3.97 0.00 1.79 1.96 0.00 3.17 0.00 0.00 3.08 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.82 0.00 65 L 7.90 3.91 0.00 1.87 1.79 0.89 0.68 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 66 V 7.92 3.85 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 0.93 0.00 0.00 0.94 0.00 0.00 67 L 7.31 4.59 0.00 1.77 1.74 1.01 0.95 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 68 R 7.34 4.10 0.00 2.02 2.02 0.00 3.16 0.00 0.00 3.24 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.86 0.00 69 D 7.96 4.66 0.00 2.75 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 70 L 7.67 4.32 0.00 1.78 1.63 0.92 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 71 Q 8.65 4.09 0.00 2.01 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.95 0.00 0.00 0.00 0.00 0.00 2.31 2.41 0.00 72 D 7.94 4.42 0.00 2.80 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 73 V 8.45 3.70 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 1.03 0.00 0.00 0.94 0.00 0.00 74 K 8.43 4.07 0.00 2.14 1.85 0.00 1.73 0.00 0.00 1.58 0.00 0.00 2.89 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.47 1.45 7.81 75 L 7.66 3.97 0.00 1.78 1.81 0.93 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 76 V 7.78 3.71 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 0.91 0.00 0.00 1.22 0.00 0.00 77 R 8.13 4.01 0.00 2.15 2.15 0.00 3.11 0.00 0.00 3.11 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.67 0.00 78 K 8.31 4.04 0.00 1.95 2.02 0.00 1.69 0.00 0.00 1.58 0.00 0.00 2.91 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.44 1.45 7.81 79 L 7.65 3.89 0.00 1.86 1.42 0.70 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 80 F 8.21 4.35 0.00 3.08 3.05 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 81 D 7.55 4.73 0.00 2.87 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 82 E 8.01 4.35 0.00 2.06 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 0.00 2.25 2.33 0.00 83 I 7.68 3.83 1.98 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.91 0.94 0.00 0.00 84 A 8.30 4.10 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 85 P 0.00 4.24 0.00 2.18 2.13 0.00 3.73 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.21 0.00 86 R 7.58 3.86 0.00 1.73 1.60 0.00 3.11 0.00 0.00 3.36 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.73 0.00 87 Y 7.46 4.67 0.00 3.07 3.31 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 88 R 8.06 3.95 0.00 2.07 1.83 0.00 3.27 0.00 0.00 3.20 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.69 0.00 89 D 8.83 4.64 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 90 R 7.74 4.22 0.00 1.88 2.24 0.00 3.61 0.00 0.00 3.31 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.58 0.00 91 Q 7.25 4.03 0.00 2.07 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.70 0.00 0.00 0.00 0.00 0.00 2.45 2.56 0.00 92 G 8.49 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 0.00 0.00 0.00 93 G 8.03 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 94 Y 7.50 4.28 0.00 2.84 2.27 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 95 T 7.30 4.88 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 96 R 9.25 4.78 0.00 1.88 1.88 0.00 3.29 0.00 0.00 3.18 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.59 0.00 97 V 8.46 4.99 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 0.81 0.00 0.00 0.94 0.00 0.00 98 L 8.90 4.82 0.00 1.54 1.52 0.93 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 99 K 8.86 4.42 0.00 1.64 1.75 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.78 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.45 1.42 7.81 100 L 8.56 4.74 0.00 1.70 1.58 0.92 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 101 A 8.64 4.12 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 0.00 102 E 7.89 4.30 0.00 1.86 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 2.31 2.35 0.00 103 R 8.14 4.68 0.00 1.63 1.79 0.00 3.22 0.00 0.00 3.15 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.62 0.00 104 R 8.73 3.92 0.00 1.90 2.08 0.00 3.09 0.00 0.00 3.08 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.59 0.00 105 R 8.58 4.15 0.00 1.80 1.81 0.00 3.29 0.00 0.00 3.22 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.63 0.00 106 G 9.08 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 0.00 0.00 0.00 0.00 107 D 7.82 4.53 0.00 2.78 2.78 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 0.00 108 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 0.00 109 A 8.05 4.24 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 0.00 110 P 0.00 4.64 0.00 2.12 2.19 0.00 3.67 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.99 0.00 111 L 8.45 4.75 0.00 1.61 1.61 0.92 0.71 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 0.00 112 A 8.26 5.13 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 0.00 113 L 9.01 4.98 0.00 1.71 1.46 0.98 0.88 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 0.00 114 V 8.80 4.63 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 0.91 0.00 0.00 0.96 0.00 0.00 115 E 9.02 4.69 0.00 2.11 1.82 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 2.29 2.31 0.00 116 L 8.38 4.66 0.00 1.64 1.91 1.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 117 V 8.43 3.76 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 1.06 0.00 0.00 1.00 0.00 0.00 118 E 8.51 4.30 0.00 1.86 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 2.08 2.24 0.00