NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3552 8.3049 120.3332 53.8815 34.4986 175.0248 2 H 3.7518 8.2177 113.6539 56.1942 25.6798 173.7136 3 L 4.2954 7.6621 119.5576 54.7553 43.5405 177.6998 4 N 4.8247 9.5167 121.8638 50.7335 40.7336 174.3732 5 P 4.2023 0.0000 0.0000 65.8659 31.2399 178.7404 6 A 3.9981 7.9948 118.8179 55.1570 18.3137 179.1239 7 E 3.8999 8.4998 117.0947 59.6143 29.3314 179.8966 8 K 3.9673 7.6302 116.5727 59.5645 32.3543 178.9620 9 E 4.1319 8.1715 118.7791 59.4941 29.3978 179.6613 10 K 4.1272 8.5197 118.4696 58.8416 32.0679 179.1513 11 L 4.0784 7.7628 119.5507 58.2592 41.4604 179.5660 12 Q 4.1095 8.0507 117.3413 58.6621 28.4924 178.8528 13 I 3.7401 7.6072 120.9578 64.1859 37.1186 178.0627 14 F 4.2259 8.2257 121.0859 61.2607 39.2836 176.7553 15 L 3.6113 8.1264 119.7003 58.0365 41.8186 178.8254 16 A 3.9474 8.3056 121.1245 55.0304 18.2717 179.5990 17 S 3.9629 8.2274 111.9505 61.4326 62.5049 176.1688 18 E 3.8579 7.9013 121.3534 59.1460 29.2082 178.8561 19 L 3.8450 7.7968 120.2157 58.4377 42.1051 179.1533 20 L 3.9920 8.0727 118.8164 57.7648 41.4393 179.5630 21 L 4.0463 8.4752 119.3205 57.8201 41.4909 179.8223 22 R 3.9150 7.9748 118.0554 59.0909 29.9754 179.2871 23 R 3.8921 7.9128 117.8864 59.1923 30.0496 179.0690 24 K 4.1391 8.5115 119.6490 59.4037 31.9627 178.7311 25 A 4.0786 8.1342 120.6753 54.1139 18.2758 178.6318 26 R 4.4443 7.6187 113.2836 56.2249 29.9179 177.2008 27 G 4.0257 8.0697 106.8860 45.3301 0.0000 174.0136 28 L 4.4185 7.5172 119.2674 53.7486 42.8026 176.9042 29 K 4.3382 8.4700 122.0596 56.3222 32.7649 177.0711 30 L 4.5456 9.0163 126.0087 54.8097 43.3620 176.8043 31 N 4.7225 9.3941 120.1391 52.1310 40.2777 174.6141 32 Y 4.0184 8.9000 118.3255 60.7192 38.7790 176.4836 33 P 4.0754 0.0000 0.0000 65.8270 31.3367 178.1491 34 E 3.8606 8.6364 118.0008 59.1501 29.4266 179.1156 35 A 3.9186 7.9951 120.7782 55.1217 18.4159 179.8147 36 V 3.3450 7.6633 116.5483 65.8974 31.4613 178.0335 37 A 3.9414 8.0004 120.4789 55.2626 18.2495 179.5633 38 I 3.7423 7.6611 119.5241 64.2036 37.2439 178.8699 39 I 3.8188 7.7632 120.4936 64.3814 36.8609 178.7468 40 T 3.9010 8.3822 117.1995 66.8291 68.2928 176.7597 41 S 4.1893 8.4989 115.3938 61.0516 62.3123 175.7140 42 F 4.0078 8.4551 123.6489 61.3761 39.0743 177.1126 43 I 3.7340 8.0367 119.0792 64.8511 36.9977 178.3766 44 M 3.9268 8.0058 119.3282 58.4637 31.7730 178.7900 45 E 3.9562 8.4058 119.0499 59.1794 29.5668 179.6275 46 G 3.3336 7.9407 105.7396 47.5609 0.0000 175.6796 47 A 3.3320 7.8079 123.1054 54.5830 17.9311 179.7392 48 R 3.7394 7.5232 116.4936 59.3762 30.2168 178.0150 49 D 4.5041 7.7975 117.2728 55.2302 40.8645 177.3140 50 G 3.9384 7.6885 107.5601 45.2191 0.0000 173.8401 51 K 4.2415 7.6752 118.7831 56.0928 32.8343 177.3287 52 T 4.4265 8.1283 111.4058 60.6797 71.4197 176.0442 53 V 3.4752 7.8250 119.9651 66.1102 31.0216 177.6737 54 A 3.9852 7.9316 119.9204 55.4438 18.1871 179.2480 55 M 4.0880 8.2420 117.1227 58.8065 32.0387 179.1427 56 L 4.2834 8.0665 118.7381 57.8724 41.5507 179.3801 57 M 4.0971 8.2798 118.4846 57.9840 32.2198 177.9601 58 E 4.3299 7.9105 117.1836 58.8369 30.2090 178.5139 59 E 4.2025 9.0322 119.0818 59.3429 29.3055 179.5811 60 G 3.6321 8.3074 105.0953 47.2343 0.0000 175.0631 61 K 4.5374 7.6072 119.5812 57.0554 32.2064 177.0551 62 H 4.8537 7.7578 115.4796 55.4396 29.8311 174.8984 63 V 3.6057 7.7488 121.1237 64.6476 31.6761 176.3186 64 L 4.8870 7.5130 117.2985 52.9230 44.8809 175.6980 65 T 4.6144 9.2511 112.8545 59.1719 71.5064 175.4478 66 R 3.8789 8.4043 117.5411 59.1518 29.3417 178.0552 67 D 4.6016 7.9387 115.6797 54.6128 39.9997 176.7697 68 D 4.4845 8.3459 120.8406 56.2149 41.1818 176.0263 69 V 5.0828 7.1235 110.2955 59.1224 35.5040 175.6049 70 M 4.3253 9.0191 121.8849 54.9193 33.2085 175.7280 71 E 3.9909 8.7276 121.3761 58.4489 29.8416 177.6293 72 G 4.0624 9.2261 114.0113 45.2253 0.0000 175.6139 73 V 3.6695 7.5965 118.6030 65.5462 31.4378 175.5959 74 P 4.4079 0.0000 0.0000 65.8273 30.7174 178.0986 75 E 4.1755 8.1147 115.7088 58.6306 29.4208 178.7260 76 M 4.4175 7.8931 118.4367 56.5545 32.2461 176.0895 77 I 4.3943 7.1874 119.5622 59.8995 37.0996 174.9573 78 D 4.7177 8.6490 127.0959 57.1126 41.9632 175.9371 79 D 4.9642 7.6443 114.6089 52.7136 42.5844 174.8884 80 I 4.6733 8.5989 118.9296 59.6230 40.7711 174.8188 81 Q 5.3133 8.7820 124.7822 54.2614 31.8162 174.8366 82 A 4.7456 8.9300 123.1602 50.7915 23.1817 174.7966 83 E 5.5028 9.0487 119.9499 53.9649 32.2879 175.2383 84 A 4.5943 8.3543 123.3806 50.8761 23.3412 175.5188 85 T 4.1926 8.2813 116.2579 63.0510 68.7521 175.2531 86 F 4.4911 9.0768 126.7214 55.6405 40.3076 175.3221 87 P 4.2878 0.0000 0.0000 65.3288 31.0517 177.1368 88 D 4.7402 8.1807 116.2112 53.0539 39.9753 176.2438 89 G 3.8753 8.1601 106.9510 45.0033 0.0000 173.1646 90 T 4.7618 8.1364 115.2476 63.8858 68.8856 174.5720 91 K 4.7436 9.2598 124.3900 54.6713 37.1553 174.7154 92 L 4.9661 8.4610 123.8779 53.7951 43.8201 175.5634 93 V 4.4270 9.0995 126.3045 61.4743 33.9418 174.1180 94 T 4.9303 8.6427 124.6568 61.9354 70.6012 173.9463 95 V 4.2292 8.8133 128.3841 61.5040 32.9435 174.4911 96 H 4.5185 8.9946 125.9054 56.6998 28.5713 176.1146 97 N 4.0872 9.2514 116.7385 54.0453 36.0348 173.1758 98 P 4.4414 0.0000 0.0000 64.3278 32.3888 177.1508 99 I 4.4164 7.0237 120.0744 59.3894 38.9423 175.6467 100 S 4.3533 8.6337 120.5581 58.7246 62.8260 174.1460 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 M 8.30 4.36 0.00 2.03 2.20 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.57 0.00 2 H 8.22 3.75 0.00 3.34 3.40 0.00 5.90 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 L 7.66 4.30 0.00 1.63 1.60 0.92 1.08 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 N 9.52 4.82 0.00 2.95 2.97 0.00 0.00 6.73 8.39 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 5 P 0.00 4.20 0.00 2.18 2.15 0.00 3.60 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.16 0.00 6 A 7.99 4.00 1.32 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 7 E 8.50 3.90 0.00 2.18 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 2.32 2.45 0.00 8 K 7.63 3.97 0.00 1.90 1.88 0.00 1.71 0.00 0.00 1.70 0.00 0.00 3.04 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.48 1.48 7.81 9 E 8.17 4.13 0.00 2.27 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 2.34 2.36 0.00 10 K 8.52 4.13 0.00 1.86 1.86 0.00 1.68 0.00 0.00 1.64 0.00 0.00 2.96 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.60 7.81 11 L 7.76 4.08 0.00 1.96 1.80 0.94 1.34 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 12 Q 8.05 4.11 0.00 2.19 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.82 0.00 0.00 0.00 0.00 0.00 2.40 2.56 0.00 13 I 7.61 3.74 2.08 0.00 0.00 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 1.42 0.62 0.95 0.00 0.00 14 F 8.23 4.23 0.00 3.07 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 15 L 8.13 3.61 0.00 1.81 1.79 0.84 0.76 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 16 A 8.31 3.95 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 17 S 8.23 3.96 0.00 4.09 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 18 E 7.90 3.86 0.00 1.82 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 1.49 1.47 0.00 19 L 7.80 3.84 0.00 1.78 1.85 0.89 0.53 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 20 L 8.07 3.99 0.00 1.68 1.67 0.92 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 21 L 8.48 4.05 0.00 1.74 1.70 0.92 0.91 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 22 R 7.97 3.92 0.00 1.99 1.95 0.00 3.09 0.00 0.00 3.14 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.88 0.00 23 R 7.91 3.89 0.00 2.03 1.96 0.00 3.11 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 1.64 1.71 0.00 24 K 8.51 4.14 0.00 1.77 1.93 0.00 1.62 0.00 0.00 1.64 0.00 0.00 3.04 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.44 7.81 25 A 8.13 4.08 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 26 R 7.62 4.44 0.00 1.99 2.02 0.00 3.03 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.62 0.00 27 G 8.07 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 28 L 7.52 4.42 0.00 1.67 1.60 0.92 0.79 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 29 K 8.47 4.34 0.00 1.64 1.65 0.00 1.85 0.00 0.00 1.70 0.00 0.00 3.06 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.44 1.42 7.81 30 L 9.02 4.55 0.00 1.57 1.56 0.90 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 31 N 9.39 4.72 0.00 2.84 3.01 0.00 0.00 6.73 7.43 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 32 Y 8.90 4.02 0.00 3.12 3.02 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 33 P 0.00 4.08 0.00 2.31 2.38 0.00 3.95 0.00 0.00 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.16 0.00 34 E 8.64 3.86 0.00 2.24 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 2.36 0.00 35 A 8.00 3.92 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 36 V 7.66 3.34 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 0.89 0.00 0.00 0.32 0.00 0.00 37 A 8.00 3.94 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 38 I 7.66 3.74 1.97 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.16 0.91 0.00 0.00 39 I 7.76 3.82 1.84 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 1.42 0.91 0.90 0.00 0.00 40 T 8.38 3.90 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 1.23 0.00 0.00 41 S 8.50 4.19 0.00 3.96 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 42 F 8.46 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 43 I 8.04 3.73 2.10 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.83 0.99 0.00 0.00 44 M 8.01 3.93 0.00 2.00 2.08 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 2.76 2.54 0.00 45 E 8.41 3.96 0.00 1.85 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 2.51 2.46 0.00 46 G 7.94 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 0.00 0.00 0.00 47 A 7.81 3.33 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 R 7.52 3.74 0.00 1.65 2.00 0.00 3.21 0.00 0.00 3.11 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.60 0.00 49 D 7.80 4.50 0.00 2.77 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 50 G 7.69 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 0.00 0.00 0.00 51 K 7.68 4.24 0.00 1.96 1.84 0.00 1.61 0.00 0.00 1.88 0.00 0.00 2.92 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.50 1.36 7.81 52 T 8.13 4.43 4.21 0.00 0.00 0.00 0.00 0.00 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 53 V 7.83 3.48 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 1.09 0.00 0.00 0.20 0.00 0.00 54 A 7.93 3.99 1.32 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 55 M 8.24 4.09 0.00 2.15 2.34 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 2.66 2.63 0.00 56 L 8.07 4.28 0.00 1.89 1.89 1.16 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 57 M 8.28 4.10 0.00 2.02 2.32 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.84 2.84 0.00 58 E 7.91 4.33 0.00 2.20 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 2.32 2.51 0.00 59 E 9.03 4.20 0.00 2.28 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 0.00 2.46 2.59 0.00 60 G 8.31 3.63 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 0.00 0.00 0.00 61 K 7.61 4.54 0.00 1.68 1.68 0.00 1.59 0.00 0.00 1.52 0.00 0.00 3.10 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.54 1.30 7.81 62 H 7.76 4.85 0.00 3.05 3.20 0.00 5.65 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 V 7.75 3.61 1.80 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 0.59 0.00 0.00 -0.12 0.00 0.00 64 L 7.51 4.89 0.00 1.56 1.46 0.87 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 65 T 9.25 4.61 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 1.20 0.00 0.00 66 R 8.40 3.88 0.00 2.01 2.23 0.00 2.96 0.00 0.00 3.39 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.62 0.00 67 D 7.94 4.60 0.00 2.80 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 68 D 8.35 4.48 0.00 2.88 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 69 V 7.12 5.08 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 0.67 0.00 0.00 0.97 0.00 0.00 70 M 9.02 4.33 0.00 1.94 2.01 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 2.89 2.50 0.00 71 E 8.73 3.99 0.00 1.98 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 2.30 2.36 0.00 72 G 9.23 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 0.00 0.00 0.00 73 V 7.60 3.67 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 0.93 0.00 0.00 1.04 0.00 0.00 74 P 0.00 4.41 0.00 2.20 2.24 0.00 3.59 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.19 0.00 75 E 8.11 4.18 0.00 2.19 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 2.39 2.46 0.00 76 M 7.89 4.42 0.00 2.02 2.46 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 2.83 2.49 0.00 77 I 7.19 4.39 1.90 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.85 0.95 0.00 0.00 78 D 8.65 4.72 0.00 2.63 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 79 D 7.64 4.96 0.00 2.63 2.52 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.60 4.67 1.86 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 1.18 0.62 0.91 0.00 0.00 81 Q 8.78 5.31 0.00 1.91 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.67 0.00 0.00 0.00 0.00 0.00 2.24 2.42 0.00 82 A 8.93 4.75 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 83 E 9.05 5.50 0.00 1.87 1.90 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 2.26 2.15 0.00 84 A 8.35 4.59 0.99 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 0.00 0.00 0.00 0.00 0.00 85 T 8.28 4.19 4.18 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 0.00 0.00 1.22 0.00 0.00 86 F 9.08 4.49 0.00 3.38 3.10 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 0.00 0.00 0.00 0.00 87 P 0.00 4.29 0.00 2.09 2.14 0.00 3.89 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.11 0.00 88 D 8.18 4.74 0.00 2.78 2.75 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 89 G 8.16 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 90 T 8.14 4.76 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 1.29 0.00 0.00 91 K 9.26 4.74 0.00 1.28 1.42 0.00 1.55 0.00 0.00 1.53 0.00 0.00 2.86 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.47 1.08 7.81 92 L 8.46 4.97 0.00 1.84 1.56 0.95 0.88 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 93 V 9.10 4.43 2.20 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 1.02 0.00 0.00 1.20 0.00 0.00 94 T 8.64 4.93 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 1.04 0.00 0.00 95 V 8.81 4.23 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 1.04 0.00 0.00 1.03 0.00 0.00 96 H 8.99 4.52 0.00 3.06 3.25 0.00 6.06 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 N 9.25 4.09 0.00 2.79 2.85 0.00 0.00 6.50 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 98 P 0.00 4.44 0.00 2.16 2.27 0.00 3.78 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 2.04 1.96 0.00 99 I 7.02 4.42 1.86 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 1.44 0.63 0.88 0.00 0.00 100 S 8.63 4.35 0.00 3.85 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