NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 H 4.7872 8.4449 120.3931 54.5200 32.8923 174.7363 2 K 3.4508 7.6980 117.8528 58.4517 31.4686 178.0117 3 C 4.5350 8.5502 121.8985 56.8746 37.9588 172.3104 4 D 4.5972 7.6408 125.0667 51.8938 42.3057 177.2141 5 I 3.7709 8.1054 112.6780 64.2869 37.4096 178.2792 6 T 3.8280 7.8251 117.3652 66.4388 68.3493 176.1236 7 L 3.9737 7.9467 122.2996 58.2426 42.1784 178.9621 8 Q 4.0727 8.1835 118.0746 59.0584 28.6396 178.7542 9 E 3.9448 8.4488 119.7868 59.1930 29.3965 179.4027 10 I 3.6197 7.5806 119.4980 64.4243 37.1275 178.3953 11 I 3.5428 7.6176 120.4472 64.3781 36.9365 178.5297 12 K 3.7872 7.8895 119.0671 59.8909 31.8400 179.5797 13 T 3.5483 7.8143 115.8014 66.3805 68.1908 176.8585 14 L 4.0093 8.1577 121.3553 57.9566 41.3943 179.3912 15 N 4.3660 8.1513 115.7294 56.1308 38.5462 177.3243 16 S 4.3463 7.9997 116.4228 60.7836 62.9232 176.6512 17 L 4.2374 8.4036 122.8608 58.0161 41.3632 179.3167 18 T 3.9816 7.4672 107.4155 64.0102 68.6240 173.9958 19 E 4.4722 7.3110 120.1641 55.7375 29.6374 176.0079 20 Q 4.4376 7.6522 112.2570 55.8533 30.4914 173.4312 21 K 4.5110 8.6018 122.8034 55.4498 33.8757 176.5112 22 T 4.7723 7.8078 116.0793 61.1821 71.7919 175.1494 23 L 3.9226 8.7017 124.1870 59.4683 40.3437 179.6584 24 C 4.4246 8.1744 114.3687 58.0203 36.2920 174.6673 25 T 4.0043 8.2539 110.5879 62.8331 68.4515 175.6276 26 E 4.3617 7.5170 121.1340 57.4400 30.4472 176.6902 27 L 4.3634 7.7959 119.9131 55.1064 42.8715 176.3690 28 T 5.0396 8.4254 111.8082 61.1029 70.7109 174.0218 29 V 4.6405 9.0257 116.7639 59.4433 36.4715 174.8826 30 T 4.2944 8.3212 118.6423 63.9830 69.1288 175.3445 31 D 4.9339 9.2635 127.8198 52.9737 39.9540 176.3864 32 I 3.9453 7.9694 111.1968 61.0118 37.7659 177.5309 33 F 4.6684 8.1300 120.0774 58.4320 39.6109 177.5860 34 A 3.8548 8.3017 123.2575 54.4599 18.5487 178.2324 35 A 3.7593 7.4110 113.5520 53.5134 15.6370 175.9535 36 S 4.1051 7.3976 120.3888 60.1165 63.5502 178.6733 37 K 4.2863 7.9805 126.6257 56.2990 34.1066 175.4485 38 N 4.7508 8.4936 117.3177 52.7461 39.1964 174.6139 39 T 4.6739 8.1327 116.8247 59.8481 71.0206 173.3767 40 T 4.3003 8.6864 120.0737 60.7679 69.7766 175.2919 41 E 3.6736 8.3950 123.5188 59.2153 29.4058 178.8939 42 K 3.7822 7.7195 117.8907 59.4901 32.0833 179.0020 43 E 3.9511 8.0375 118.3123 59.4868 29.2730 179.4855 44 T 3.8670 7.6546 115.5346 66.7028 68.5502 176.6252 45 F 4.5821 8.3031 119.8640 60.9143 38.8843 176.9305 46 C 4.4836 8.6650 118.1571 60.0543 42.6784 175.9591 47 R 3.8483 8.4598 119.5932 58.9918 29.4912 179.0120 48 A 4.2120 8.5189 120.8818 55.1462 18.4333 179.4450 49 A 4.0859 8.4329 119.4459 55.8467 18.5048 180.0451 50 T 3.7868 8.3189 114.4770 66.7253 68.3505 177.1984 51 V 3.5313 8.1646 120.6335 65.8356 31.5271 178.1226 52 L 3.9375 8.2026 119.0572 57.6136 41.5308 179.4387 53 R 2.7258 8.0217 118.7191 59.2389 29.8631 178.6140 54 Q 3.8566 7.8144 117.7661 58.6613 28.5214 178.8058 55 F 4.0149 7.7432 122.0590 61.4557 39.5686 177.0112 56 Y 4.2274 7.9206 117.3940 60.0817 37.5993 178.0962 57 S 4.1236 7.2886 115.9668 61.5985 62.9740 175.5383 58 H 4.4659 7.6694 119.4852 57.9597 30.1653 175.9013 59 H 4.6037 7.7626 115.7230 55.1435 28.8529 176.0548 60 E 3.9279 8.1565 122.9741 58.9878 29.5389 177.6469 61 K 4.2767 7.8034 114.4359 56.0724 32.5760 175.9731 62 D 4.3957 7.7252 119.9948 54.1171 40.6408 176.5132 63 T 3.9318 8.6502 125.0861 66.8716 68.6115 176.9386 64 R 3.9847 8.0110 119.0318 58.7423 30.0754 176.7907 65 C 4.5282 8.1130 113.9919 57.4179 40.5774 174.3583 66 L 3.9425 7.7721 119.2353 54.6413 42.4251 179.2443 67 G 3.8267 8.0922 106.0436 45.9691 0.0000 173.7349 68 A 4.6175 9.2299 121.5468 51.0667 21.0717 176.3361 69 T 4.6683 7.7343 105.2395 59.2571 72.9967 174.7959 70 A 4.0340 8.3925 122.3633 55.4764 18.4087 179.8311 71 Q 4.0387 8.1068 116.0226 59.3828 28.9739 178.9693 72 Q 4.0883 7.9597 118.6549 58.4493 28.7274 178.4625 73 F 4.0921 8.1939 121.9921 61.7592 39.5180 177.0482 74 H 4.1293 8.3835 115.6719 58.4466 28.3238 177.8449 75 R 3.8634 7.8170 120.8618 59.5224 29.8246 178.0639 76 H 4.0691 8.0295 117.8998 58.8929 29.9467 177.1083 77 K 3.5858 7.6727 121.4065 59.5354 31.9600 178.8060 78 Q 3.4534 8.2324 118.5192 58.4946 28.5508 178.2805 79 L 3.7701 7.7444 121.5153 58.3602 41.9812 179.1302 80 I 3.6555 7.6304 119.6053 64.2616 36.8478 178.3715 81 R 3.7491 7.5665 119.1941 59.6074 29.8581 178.7020 82 F 4.5651 8.0903 117.4363 60.4185 38.7699 177.7978 83 L 4.1093 8.0462 118.9890 57.5484 41.3118 179.6348 84 K 3.6981 7.6573 118.4248 59.2309 31.9628 179.5401 85 R 3.8972 7.7318 118.4356 59.1194 29.9325 178.6662 86 L 3.8962 8.1280 120.1287 58.2681 42.0318 178.1617 87 D 4.4843 8.4528 118.0504 57.9244 41.2044 178.7949 88 R 4.0626 8.3056 118.3033 59.2726 29.9668 178.9612 89 N 4.4482 8.2658 116.3681 56.2243 38.5304 177.5297 90 L 3.9028 8.2981 120.7554 57.4588 41.7878 179.3471 91 W 4.3860 8.8372 128.9091 60.5762 30.4406 178.3548 92 G 3.6769 8.3090 104.7119 47.4850 0.0000 175.2408 93 L 4.1644 7.9922 121.8771 58.0584 42.2422 178.6290 94 A 4.2330 8.2396 119.9403 53.0704 18.3058 178.0858 95 G 3.7518 7.6765 103.2665 46.4726 0.0000 173.1970 96 L 4.5519 7.2524 117.5617 52.6238 44.2823 176.3501 97 N 4.6306 8.2781 117.3509 53.1391 39.6979 175.0214 98 S 4.7233 7.5012 112.7099 57.3909 65.3957 173.5494 99 C 4.9573 8.4649 121.4212 53.5023 42.2922 170.2076 100 P 4.3395 0.0000 0.0000 63.5794 31.6323 176.8558 101 V 4.0816 8.3081 122.7569 61.8211 32.1534 175.3560 102 K 4.5161 8.4426 124.6130 55.7379 34.3514 176.1467 103 E 3.8724 8.3018 118.9475 56.8788 29.8923 176.2411 104 A 4.3213 8.6249 127.9283 54.3140 20.0183 177.5779 105 N 4.2261 8.1904 112.4816 54.1826 39.4987 174.8262 106 Q 5.0800 8.6342 121.2324 54.7980 31.7010 174.5262 107 S 4.7573 9.0970 114.3313 57.3880 66.6308 173.6966 108 T 4.5525 8.5367 120.8394 62.9642 69.3373 175.6856 109 L 3.8701 8.4749 126.5731 58.3172 41.9561 179.2507 110 E 3.9625 8.1593 119.1643 59.4594 29.5441 178.6570 111 N 4.4223 8.1535 116.0504 55.9169 38.7152 177.0282 112 F 4.1892 8.3992 122.1495 61.5429 39.5422 177.2693 113 L 4.0723 8.6013 118.9870 57.5907 41.4835 179.1992 114 E 3.8519 8.1430 119.3516 59.4631 29.7270 179.2051 115 R 3.6766 8.1938 118.4803 58.8728 29.9719 178.8549 116 L 3.5101 7.5213 120.2953 57.7122 41.9674 178.8693 117 K 3.9038 8.0588 119.7425 59.6751 32.0541 178.9332 118 T 3.7855 7.6243 115.6105 66.7164 68.3998 176.7299 119 I 3.7166 7.3840 121.1609 64.7236 37.0355 178.5076 120 M 4.1888 8.5571 119.8771 58.0093 31.7198 178.8605 121 R 3.9039 8.1498 119.5034 59.4681 30.0511 178.4666 122 E 4.0347 8.1770 117.4217 59.1090 29.6604 179.1658 123 K 4.1536 8.1879 118.5990 59.6863 32.2445 178.4872 124 Y 4.0480 8.3418 119.9514 61.0810 38.5250 178.4774 125 S 4.2542 8.1343 113.8950 60.8925 62.9586 176.2280 126 K 4.2574 8.1878 120.8610 57.6396 31.8838 174.9213 127 C 5.0120 7.4561 113.9973 54.4756 41.8968 174.6727 128 S 4.4303 7.6547 110.9948 57.6929 62.6617 175.1317 129 S 4.2596 8.4609 122.7171 60.2779 62.5184 174.5745 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 H 8.44 4.79 0.00 3.13 3.38 0.00 5.85 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 2 K 7.70 3.45 0.00 1.98 0.86 0.00 1.76 0.00 0.00 1.69 0.00 0.00 2.94 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.35 1.53 7.81 3 C 8.55 4.53 0.00 2.83 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 4 D 7.64 4.60 0.00 2.57 2.28 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 5 I 8.11 3.77 1.87 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 1.63 0.53 0.91 0.00 0.00 6 T 7.83 3.83 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 1.24 0.00 0.00 7 L 7.95 3.97 0.00 1.84 1.87 0.96 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 8 Q 8.18 4.07 0.00 2.30 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.59 0.00 0.00 0.00 0.00 0.00 2.56 2.69 0.00 9 E 8.45 3.94 0.00 2.18 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 2.29 2.49 0.00 10 I 7.58 3.62 1.95 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 1.46 0.78 0.80 0.00 0.00 11 I 7.62 3.54 1.76 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.58 0.52 0.00 0.00 12 K 7.89 3.79 0.00 1.81 1.73 0.00 1.58 0.00 0.00 1.58 0.00 0.00 2.92 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.37 1.68 7.81 13 T 7.81 3.55 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 1.09 0.00 0.00 14 L 8.16 4.01 0.00 1.74 1.65 0.84 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 15 N 8.15 4.37 0.00 2.73 2.81 0.00 0.00 7.11 8.37 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 16 S 8.00 4.35 0.00 3.66 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 17 L 8.40 4.24 0.00 1.85 1.77 0.99 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 18 T 7.47 3.98 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 1.24 0.00 0.00 19 E 7.31 4.47 0.00 2.16 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 2.47 2.32 0.00 20 Q 7.65 4.44 0.00 2.12 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.95 6.80 0.00 0.00 0.00 0.00 0.00 2.40 2.30 0.00 21 K 8.60 4.51 0.00 1.77 1.78 0.00 1.86 0.00 0.00 1.72 0.00 0.00 2.84 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.40 1.40 7.81 22 T 7.81 4.77 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 1.30 0.00 0.00 23 L 8.70 3.92 0.00 1.82 1.97 0.95 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 24 C 8.17 4.42 0.00 3.11 3.29 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 25 T 8.25 4.00 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 1.24 0.00 0.00 26 E 7.52 4.36 0.00 1.88 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 2.32 2.43 0.00 27 L 7.80 4.36 0.00 1.95 1.67 0.55 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 28 T 8.43 5.04 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 1.27 0.00 0.00 29 V 9.03 4.64 1.83 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 0.70 0.00 0.00 0.55 0.00 0.00 30 T 8.32 4.29 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 1.26 0.00 0.00 31 D 9.26 4.93 0.00 2.88 2.64 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.97 3.95 1.74 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 1.38 0.61 0.90 0.00 0.00 33 F 8.13 4.67 0.00 3.39 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 34 A 8.30 3.85 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 35 A 7.41 3.76 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 36 S 7.40 4.11 0.00 3.88 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 37 K 7.98 4.29 0.00 1.75 1.79 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.45 1.40 7.81 38 N 8.49 4.75 0.00 2.70 2.75 0.00 0.00 6.49 7.54 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 39 T 8.13 4.67 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 1.26 0.00 0.00 40 T 8.69 4.30 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 1.27 0.00 0.00 41 E 8.40 3.67 0.00 1.87 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 1.47 1.94 0.00 42 K 7.72 3.78 0.00 1.75 1.77 0.00 1.67 0.00 0.00 2.05 0.00 0.00 2.94 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.48 1.42 7.81 43 E 8.04 3.95 0.00 2.15 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 0.00 2.38 2.36 0.00 44 T 7.65 3.87 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 1.43 0.00 0.00 45 F 8.30 4.58 0.00 3.16 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 46 C 8.66 4.48 0.00 3.08 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 47 R 8.46 3.85 0.00 2.02 1.98 0.00 3.22 0.00 0.00 3.17 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.89 0.00 48 A 8.52 4.21 1.57 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 0.00 0.00 49 A 8.43 4.09 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 0.00 0.00 0.00 0.00 0.00 0.00 50 T 8.32 3.79 4.46 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 1.21 0.00 0.00 51 V 8.16 3.53 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 0.55 0.00 0.00 0.93 0.00 0.00 52 L 8.20 3.94 0.00 2.01 1.87 1.12 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 53 R 8.02 2.73 0.00 1.92 1.88 0.00 2.84 0.00 0.00 2.92 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.28 0.00 54 Q 7.81 3.86 0.00 2.09 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.60 0.00 0.00 0.00 0.00 0.00 2.28 2.57 0.00 55 F 7.74 4.01 0.00 2.97 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 56 Y 7.92 4.23 0.00 3.24 3.29 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 57 S 7.29 4.12 0.00 3.89 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 58 H 7.67 4.47 0.00 2.84 2.94 0.00 5.92 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 59 H 7.76 4.60 0.00 2.55 2.94 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 60 E 8.16 3.93 0.00 2.03 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 0.00 2.33 2.28 0.00 61 K 7.80 4.28 0.00 1.76 1.81 0.00 1.80 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.40 1.42 7.81 62 D 7.73 4.40 0.00 2.62 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 63 T 8.65 3.93 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 64 R 8.01 3.98 0.00 1.90 1.97 0.00 3.13 0.00 0.00 3.21 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.58 0.00 65 C 8.11 4.53 0.00 2.73 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 66 L 7.77 3.94 0.00 1.70 1.88 1.09 0.65 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 67 G 8.09 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 68 A 9.23 4.62 1.24 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 0.00 0.00 0.00 69 T 7.73 4.67 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 1.22 0.00 0.00 70 A 8.39 4.03 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 71 Q 8.11 4.04 0.00 2.14 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.86 0.00 0.00 0.00 0.00 0.00 2.49 2.49 0.00 72 Q 7.96 4.09 0.00 2.26 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.81 0.00 0.00 0.00 0.00 0.00 2.40 2.38 0.00 73 F 8.19 4.09 0.00 3.06 3.09 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 74 H 8.38 4.13 0.00 3.24 3.30 0.00 5.67 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 75 R 7.82 3.86 0.00 2.12 1.90 0.00 3.22 0.00 0.00 3.11 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.62 0.00 76 H 8.03 4.07 0.00 3.37 3.27 0.00 5.84 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 77 K 7.67 3.59 0.00 1.37 1.59 0.00 1.69 0.00 0.00 1.61 0.00 0.00 2.91 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.25 1.31 7.81 78 Q 8.23 3.45 0.00 1.86 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.54 0.00 0.00 0.00 0.00 0.00 2.36 2.34 0.00 79 L 7.74 3.77 0.00 1.74 1.80 0.93 1.45 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 80 I 7.63 3.66 1.80 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 1.31 1.25 0.80 0.00 0.00 81 R 7.57 3.75 0.00 1.89 1.80 0.00 2.99 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.63 0.00 82 F 8.09 4.57 0.00 3.01 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 83 L 8.05 4.11 0.00 1.94 1.95 1.05 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 84 K 7.66 3.70 0.00 1.69 1.58 0.00 1.36 0.00 0.00 1.34 0.00 0.00 2.58 0.00 0.00 2.51 0.00 0.00 0.00 0.00 0.30 0.77 7.81 85 R 7.73 3.90 0.00 2.02 1.96 0.00 3.09 0.00 0.00 3.04 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.95 0.00 86 L 8.13 3.90 0.00 2.09 1.85 0.90 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 87 D 8.45 4.48 0.00 3.03 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 88 R 8.31 4.06 0.00 1.94 2.04 0.00 3.20 0.00 0.00 3.17 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.93 0.00 89 N 8.27 4.45 0.00 2.94 2.85 0.00 0.00 6.98 6.72 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 90 L 8.30 3.90 0.00 1.92 1.94 0.99 0.67 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 91 W 8.84 4.39 0.00 3.46 3.33 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 92 G 8.31 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 L 7.99 4.16 0.00 1.92 1.98 0.98 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 94 A 8.24 4.23 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 95 G 7.68 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 0.00 0.00 0.00 96 L 7.25 4.55 0.00 1.26 1.30 0.85 0.94 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 97 N 8.28 4.63 0.00 2.65 2.91 0.00 0.00 6.69 7.57 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 98 S 7.50 4.72 0.00 3.82 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 99 C 8.46 4.96 0.00 3.11 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 0.00 100 P 0.00 4.34 0.00 2.21 2.13 0.00 3.77 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.97 0.00 101 V 8.31 4.08 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 0.83 0.00 0.00 0.95 0.00 0.00 102 K 8.44 4.52 0.00 1.72 1.79 0.00 1.90 0.00 0.00 1.64 0.00 0.00 3.06 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.32 1.44 7.81 103 E 8.30 3.87 0.00 1.91 1.89 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 2.55 2.42 0.00 104 A 8.62 4.32 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 0.00 105 N 8.19 4.23 0.00 3.00 2.86 0.00 0.00 6.92 7.32 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 0.00 106 Q 8.63 5.08 0.00 1.95 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.75 0.00 0.00 0.00 0.00 0.00 2.29 2.29 0.00 107 S 9.10 4.76 0.00 3.95 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 0.00 108 T 8.54 4.55 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 1.30 0.00 0.00 109 L 8.47 3.87 0.00 1.37 1.67 0.49 -0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 110 E 8.16 3.96 0.00 2.23 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 2.32 2.36 0.00 111 N 8.15 4.42 0.00 2.98 2.90 0.00 0.00 6.75 8.13 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 0.00 112 F 8.40 4.19 0.00 3.25 3.29 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 0.00 113 L 8.60 4.07 0.00 1.94 1.74 0.93 0.83 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 0.00 114 E 8.14 3.85 0.00 2.31 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 2.28 2.35 0.00 115 R 8.19 3.68 0.00 1.44 1.15 0.00 3.20 0.00 0.00 2.98 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.70 0.00 116 L 7.52 3.51 0.00 1.61 1.69 1.01 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 117 K 8.06 3.90 0.00 1.94 1.86 0.00 1.64 0.00 0.00 1.60 0.00 0.00 2.88 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.37 1.41 7.81 118 T 7.62 3.79 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 1.20 0.00 0.00 119 I 7.38 3.72 1.97 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.72 1.10 0.00 0.00 120 M 8.56 4.19 0.00 1.92 2.04 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.76 0.00 121 R 8.15 3.90 0.00 2.14 2.02 0.00 3.08 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.63 0.00 122 E 8.18 4.03 0.00 2.14 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 2.35 2.46 0.00 123 K 8.19 4.15 0.00 2.15 1.98 0.00 1.80 0.00 0.00 1.92 0.00 0.00 3.31 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.61 1.94 7.81 124 Y 8.34 4.05 0.00 3.18 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 0.00 125 S 8.13 4.25 0.00 4.06 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 0.00 126 K 8.19 4.26 0.00 1.89 1.85 0.00 1.65 0.00 0.00 1.92 0.00 0.00 3.11 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.43 7.81 127 C 7.46 5.01 0.00 2.90 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 0.00 128 S 7.65 4.43 0.00 3.85 3.74 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 0.00 129 S 8.46 4.26 0.00 3.85 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