NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 T 4.4759 8.0333 115.5271 62.2808 70.3309 173.6429 2 T 4.9659 7.8459 116.9788 60.4936 72.4324 172.5981 3 F 5.0412 9.4063 121.7008 55.6937 42.3753 172.3927 4 N 5.3289 8.7281 117.4520 51.6230 40.2729 174.7374 5 I 4.1914 8.5287 125.8128 61.6507 37.1463 176.3007 6 Q 4.2205 9.4473 127.4918 58.3886 29.3066 175.8910 7 D 4.6969 7.5790 115.3708 51.4599 42.9030 176.7419 8 G 3.7023 8.4350 105.9739 47.6639 0.0000 173.9783 9 P 4.3697 0.0000 0.0000 65.2905 31.2261 178.1950 10 D 4.3339 8.5771 117.0551 57.2053 41.1597 178.0384 11 F 4.0123 8.3898 121.3382 61.2088 39.5225 176.8337 12 Q 4.0119 8.3923 119.2626 59.2316 28.6307 177.8191 13 D 4.2228 8.0218 117.7585 57.3762 41.5516 177.9300 14 R 4.1193 8.0684 116.4197 57.0166 30.6999 177.4202 15 V 4.0031 7.1049 116.0433 64.4412 32.7222 177.4271 16 V 3.5056 7.2428 116.7528 65.7435 31.6030 177.0100 17 N 4.6939 7.4852 112.0560 52.0510 39.0888 175.3429 18 S 4.1784 7.2085 116.4351 58.4733 62.9167 174.0997 19 E 4.2037 8.7155 126.1443 58.1144 29.8817 176.5627 20 T 4.7191 7.2882 114.3716 60.5384 71.2488 172.6577 21 P 4.4015 0.0000 0.0000 63.4967 32.6079 175.1580 22 V 4.8655 8.7891 122.9137 61.1979 34.8352 174.3788 23 V 4.7981 8.8856 120.4195 59.7004 34.1325 174.8442 24 V 4.5151 9.0192 126.0302 61.3534 33.4304 174.0646 25 D 4.9969 8.7911 129.9377 52.7203 42.4613 175.1057 26 F 4.9368 9.2742 127.3071 57.0863 40.1649 174.9588 27 H 5.2849 8.8810 118.5137 54.3152 32.8188 171.8353 28 A 4.4693 7.8792 117.9377 50.4304 21.6521 177.2518 29 Q 3.8616 8.7568 119.6296 58.8274 28.8563 178.6308 30 W 4.3894 7.0408 111.7608 57.2114 29.2079 176.4940 31 C 4.5273 7.6579 121.3414 55.1648 42.4888 174.0540 32 G 3.7255 8.8644 117.0590 48.3750 0.0000 172.6914 33 P 4.2063 0.0000 0.0000 65.5930 31.1615 179.2792 34 C 4.2722 7.8426 113.7199 59.7600 39.7731 176.2801 35 K 3.7807 8.0566 119.8560 58.8609 31.6697 179.0581 36 I 3.9924 7.4457 119.7082 63.8883 37.4988 177.8511 37 L 4.0479 8.1059 121.3478 58.0295 41.9801 178.6722 38 G 3.7748 8.1456 105.7872 47.8027 0.0000 173.6449 39 P 4.2488 0.0000 0.0000 64.9603 31.3479 178.7438 40 R 3.8777 7.7847 117.6117 59.2854 29.8879 178.3488 41 L 3.9720 8.6523 120.6033 58.1120 42.0662 178.8337 42 E 3.9390 8.2279 118.6549 59.0177 29.2940 178.9191 43 K 3.8108 8.1417 119.7699 60.2100 32.0382 178.7759 44 M 4.1487 8.1234 117.3624 58.0233 32.0508 178.7401 45 V 3.7335 8.2521 118.9998 65.9155 31.8089 178.0138 46 A 4.0037 8.0864 120.5376 54.9247 17.9745 179.5785 47 K 3.9551 7.7274 115.7976 58.8944 32.4473 178.3458 48 Q 4.1817 8.2306 117.4051 55.0151 29.5494 174.9154 49 H 4.0980 8.9363 116.9374 56.9967 26.7968 175.5075 50 G 3.9736 8.2170 102.4596 45.9737 0.0000 174.5745 51 K 4.1623 7.8180 119.7546 58.3027 32.3147 177.4137 52 V 4.8195 7.4442 117.2584 61.1062 34.7758 174.3960 53 V 4.7458 8.7707 125.7417 60.0750 35.1630 173.8586 54 M 5.0145 8.6699 120.9274 53.6839 35.0507 173.9087 55 A 3.8853 8.6585 128.6762 49.8669 21.0987 175.5767 56 K 4.5128 8.7408 123.1142 55.9709 34.1918 176.5992 57 V 4.2304 8.5163 124.2200 60.8132 34.4263 174.3698 58 D 4.3577 8.5771 128.8695 53.3256 41.1902 176.4816 59 I 3.8326 8.6441 129.1931 64.1015 38.1843 177.6464 60 D 4.5941 8.2442 119.2221 56.3215 40.6644 176.3629 61 D 4.8599 8.0350 116.6977 54.1453 42.2300 175.8771 62 H 5.0706 8.0516 114.4857 54.0112 30.1376 174.9466 63 T 3.9407 8.2132 119.4740 66.8265 68.6276 175.6768 64 D 4.3643 8.1299 120.3343 56.7532 39.4015 178.7018 65 L 3.9505 7.9459 120.0911 56.9882 41.6305 178.8509 66 A 3.8661 8.2231 120.8712 55.5801 18.1245 179.8588 67 I 3.6563 7.9911 118.1319 64.3811 36.9111 178.2872 68 E 3.7826 8.2119 119.4654 58.8068 29.4392 177.5711 69 Y 4.5379 7.4826 113.0520 56.4957 38.8067 175.3137 70 E 3.6759 7.5799 118.0222 57.2371 27.6131 175.3333 71 V 3.7475 7.9505 118.5223 62.2321 32.0673 175.3740 72 S 4.6480 8.4703 119.7259 57.8918 64.1806 173.3168 73 A 4.7312 7.4739 121.9348 51.3882 21.7498 175.7339 74 V 4.6086 8.0664 112.6841 58.5462 35.2703 174.2621 75 P 5.0433 0.0000 0.0000 62.7519 32.9219 175.1339 76 T 4.8782 8.3543 116.6548 61.8058 72.9874 172.8246 77 V 4.6683 8.1800 124.9124 61.0013 34.4877 173.9458 78 L 5.1495 8.9177 127.7490 53.0392 44.3402 175.1548 79 A 5.0208 9.2059 125.8118 50.8743 20.8506 175.7646 80 M 5.2478 9.0649 122.5802 53.4397 35.8141 174.9078 81 K 4.6451 8.8203 123.2421 55.4707 36.3862 175.6778 82 N 3.8823 10.0149 122.1965 54.3149 36.2721 175.5226 83 G 3.9636 8.3489 103.9137 45.7725 0.0000 173.9953 84 D 4.8509 7.7225 119.9360 52.4959 42.4359 176.0384 85 V 4.2567 8.4070 122.1529 63.2707 31.6303 176.0501 86 V 4.4236 8.2827 119.9415 61.4154 33.2287 174.8672 87 D 4.8205 7.6605 119.0202 53.6581 44.5638 173.6217 88 K 5.1729 8.7478 118.8996 56.5831 34.9270 174.1360 89 F 5.1814 8.6445 116.0260 55.6985 41.5685 173.2471 90 V 4.4375 8.5586 119.1512 61.3037 33.8764 177.2540 91 G 3.8423 8.4598 110.1749 45.0669 0.0000 172.3061 92 I 4.3817 8.1105 119.5823 59.9702 38.5669 175.2270 93 K 4.5635 8.1021 123.0209 54.0728 35.1308 176.2392 94 D 4.6418 8.7711 122.1992 52.4824 41.6803 177.4115 95 E 3.9086 8.6116 118.8600 59.9903 29.4446 179.4693 96 D 4.3403 8.0931 118.0209 57.5368 40.8949 178.8327 97 Q 3.9882 8.5217 118.6517 58.7814 28.6384 178.6244 98 L 3.9732 8.0762 120.2925 57.5390 41.6042 179.0562 99 E 3.9404 8.5486 119.4694 59.1761 29.5721 178.7596 100 A 3.9853 7.9847 120.7258 55.0487 18.4897 179.2592 101 F 4.0924 8.3137 119.1329 61.6364 39.4095 177.3843 102 L 4.0174 8.5384 118.9128 57.7424 41.2723 179.6558 103 K 3.9381 8.2777 118.5739 59.2624 31.7303 179.3497 104 K 3.8924 7.8049 119.0693 59.2202 32.1973 178.2909 105 L 3.9486 7.4879 119.5049 58.1660 42.0497 178.6219 106 I 3.9502 7.7464 118.7383 63.7474 37.2266 176.3239 107 G 3.7095 7.7583 111.5478 45.8208 0.0000 172.0938 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 4.48 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 1.25 0.00 0.00 2 T 7.85 4.97 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 1.23 0.00 0.00 3 F 9.41 5.04 0.00 3.01 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 4 N 8.73 5.33 0.00 2.66 2.81 0.00 0.00 6.99 7.45 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 5 I 8.53 4.19 1.87 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.89 0.94 0.00 0.00 6 Q 9.45 4.22 0.00 2.08 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.72 0.00 0.00 0.00 0.00 0.00 2.55 2.47 0.00 7 D 7.58 4.70 0.00 2.93 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 8 G 8.44 3.70 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 0.00 0.00 0.00 9 P 0.00 4.37 0.00 2.20 2.15 0.00 3.83 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.18 0.00 10 D 8.58 4.33 0.00 2.99 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 11 F 8.39 4.01 0.00 3.24 3.30 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 0.00 0.00 0.00 0.00 12 Q 8.39 4.01 0.00 2.34 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.60 0.00 0.00 0.00 0.00 0.00 2.40 2.44 0.00 13 D 8.02 4.22 0.00 2.76 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 14 R 8.07 4.12 0.00 1.82 1.64 0.00 3.32 0.00 0.00 2.88 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.44 0.00 15 V 7.10 4.00 0.88 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 0.63 0.00 0.00 0.70 0.00 0.00 16 V 7.24 3.51 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 0.97 0.00 0.00 1.06 0.00 0.00 17 N 7.49 4.69 0.00 2.95 2.80 0.00 0.00 7.04 6.84 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 18 S 7.21 4.18 0.00 4.09 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 19 E 8.72 4.20 0.00 1.98 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 2.28 2.25 0.00 20 T 7.29 4.72 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 1.29 0.00 0.00 21 P 0.00 4.40 0.00 2.04 1.97 0.00 3.63 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.10 0.00 22 V 8.79 4.87 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 0.99 0.00 0.00 0.97 0.00 0.00 23 V 8.89 4.80 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 0.81 0.00 0.00 0.97 0.00 0.00 24 V 9.02 4.52 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 0.81 0.00 0.00 0.91 0.00 0.00 25 D 8.79 5.00 0.00 2.72 2.41 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 26 F 9.27 4.94 0.00 3.10 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 27 H 8.88 5.28 0.00 3.10 3.28 0.00 5.47 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 28 A 7.88 4.47 -0.06 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 29 Q 8.76 3.86 0.00 2.06 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.97 0.00 0.00 0.00 0.00 0.00 2.38 2.37 0.00 30 W 7.04 4.39 0.00 3.57 3.26 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 31 C 7.66 4.53 0.00 2.33 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 32 G 8.86 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 0.00 0.00 0.00 33 P 0.00 4.21 0.00 2.18 2.15 0.00 3.63 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.22 0.00 34 C 7.84 4.27 0.00 3.14 3.07 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 0.00 0.00 0.00 0.00 35 K 8.06 3.78 0.00 1.81 1.86 0.00 1.69 0.00 0.00 1.70 0.00 0.00 3.04 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.46 7.81 36 I 7.45 3.99 1.99 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 1.52 1.28 0.90 0.00 0.00 37 L 8.11 4.05 0.00 1.78 1.66 1.03 1.18 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 38 G 8.15 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 0.00 0.00 0.00 39 P 0.00 4.25 0.00 2.15 2.09 0.00 3.73 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.11 0.00 40 R 7.78 3.88 0.00 1.90 2.05 0.00 3.18 0.00 0.00 3.15 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.63 0.00 41 L 8.65 3.97 0.00 1.95 1.63 0.92 1.24 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 42 E 8.23 3.94 0.00 2.17 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 2.30 2.27 0.00 43 K 8.14 3.81 0.00 1.82 1.98 0.00 1.63 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.44 1.50 7.81 44 M 8.12 4.15 0.00 2.04 2.13 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.81 0.00 45 V 8.25 3.73 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 1.13 0.00 0.00 0.98 0.00 0.00 46 A 8.09 4.00 1.43 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 0.00 0.00 47 K 7.73 3.96 0.00 1.86 1.84 0.00 1.69 0.00 0.00 1.69 0.00 0.00 3.02 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.72 7.81 48 Q 8.23 4.18 0.00 2.15 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.21 0.00 0.00 0.00 0.00 0.00 2.50 2.53 0.00 49 H 8.94 4.10 0.00 3.28 3.29 0.00 5.72 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 G 8.22 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 0.00 0.00 0.00 51 K 7.82 4.16 0.00 1.88 1.88 0.00 1.67 0.00 0.00 1.63 0.00 0.00 2.90 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.48 1.55 7.81 52 V 7.44 4.82 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 0.88 0.00 0.00 0.93 0.00 0.00 53 V 8.77 4.75 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 0.90 0.00 0.00 1.14 0.00 0.00 54 M 8.67 5.01 0.00 1.94 1.83 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.25 0.00 55 A 8.66 3.89 0.96 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 56 K 8.74 4.51 0.00 1.77 1.63 0.00 1.44 0.00 0.00 1.53 0.00 0.00 2.66 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.43 1.19 7.81 57 V 8.52 4.23 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 0.53 0.00 0.00 0.55 0.00 0.00 58 D 8.58 4.36 0.00 2.65 2.55 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.64 3.83 2.01 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.41 1.06 0.00 0.00 60 D 8.24 4.59 0.00 2.98 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 61 D 8.03 4.86 0.00 2.56 2.50 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 62 H 8.05 5.07 0.00 3.22 3.17 0.00 5.69 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 T 8.21 3.94 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 1.23 0.00 0.00 64 D 8.13 4.36 0.00 2.86 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 65 L 7.95 3.95 0.00 1.99 1.87 0.67 0.76 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 66 A 8.22 3.87 1.43 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 0.00 0.00 67 I 7.99 3.66 1.99 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 1.39 0.77 0.88 0.00 0.00 68 E 8.21 3.78 0.00 1.87 1.85 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 1.47 2.00 0.00 69 Y 7.48 4.54 0.00 3.10 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 70 E 7.58 3.68 0.00 2.06 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 2.22 2.19 0.00 71 V 7.95 3.75 1.64 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 0.44 0.00 0.00 -0.17 0.00 0.00 72 S 8.47 4.65 0.00 3.96 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 73 A 7.47 4.73 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 74 V 8.07 4.61 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 0.82 0.00 0.00 0.67 0.00 0.00 75 P 0.00 5.04 0.00 2.08 2.14 0.00 3.81 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 2.09 1.85 0.00 76 T 8.35 4.88 4.07 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 0.00 0.00 0.00 1.03 0.00 0.00 77 V 8.18 4.67 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 0.00 0.00 0.99 0.00 0.00 0.52 0.00 0.00 78 L 8.92 5.15 0.00 1.63 1.54 0.70 0.75 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 79 A 9.21 5.02 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 0.00 0.00 0.00 0.00 0.00 80 M 9.06 5.25 0.00 1.90 1.88 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.44 0.00 81 K 8.82 4.65 0.00 1.75 1.55 0.00 1.75 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.31 1.38 7.81 82 N 10.01 3.88 0.00 2.85 2.84 0.00 0.00 7.04 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 83 G 8.35 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 84 D 7.72 4.85 0.00 2.77 2.63 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 0.00 0.00 0.00 0.00 85 V 8.41 4.26 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 0.91 0.00 0.00 1.11 0.00 0.00 86 V 8.28 4.42 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 0.77 0.00 0.00 0.93 0.00 0.00 87 D 7.66 4.82 0.00 2.57 2.34 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 88 K 8.75 5.17 0.00 1.88 1.80 0.00 1.64 0.00 0.00 1.79 0.00 0.00 2.78 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.32 1.39 7.81 89 F 8.64 5.18 0.00 2.99 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 90 V 8.56 4.44 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 0.80 0.00 0.00 1.01 0.00 0.00 91 G 8.46 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 92 I 8.11 4.38 1.87 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.65 0.90 0.00 0.00 93 K 8.10 4.56 0.00 1.14 1.32 0.00 0.61 0.00 0.00 0.88 0.00 0.00 2.23 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.85 0.53 7.81 94 D 8.77 4.64 0.00 2.89 2.76 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 95 E 8.61 3.91 0.00 2.01 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 2.39 2.40 0.00 96 D 8.09 4.34 0.00 2.78 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 97 Q 8.52 3.99 0.00 2.06 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.82 0.00 0.00 0.00 0.00 0.00 2.30 2.45 0.00 98 L 8.08 3.97 0.00 1.80 1.74 0.91 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 99 E 8.55 3.94 0.00 2.07 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.38 0.00 100 A 7.98 3.99 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 0.00 101 F 8.31 4.09 0.00 3.19 3.26 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 0.00 102 L 8.54 4.02 0.00 1.76 1.73 1.02 0.94 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 0.00 103 K 8.28 3.94 0.00 1.98 1.85 0.00 1.67 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.56 7.81 104 K 7.80 3.89 0.00 1.85 1.89 0.00 1.80 0.00 0.00 1.60 0.00 0.00 3.00 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.37 1.41 7.81 105 L 7.49 3.95 0.00 1.33 1.71 0.82 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 106 I 7.75 3.95 1.85 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.77 0.90 0.00 0.00 107 G 7.76 3.71 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 0.00 0.00 0.00