NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.3131 8.3149 119.9983 56.5469 33.9029 174.8260 2 K 4.3389 8.2162 118.5739 52.1743 35.2727 174.2284 3 P 4.8412 0.0000 0.0000 62.8610 34.1346 174.8672 4 K 5.0059 8.5890 118.2938 55.2195 37.1119 175.5790 5 L 4.9352 8.5157 122.5364 53.9161 44.1909 176.0360 6 L 5.1862 8.7146 120.8235 53.5193 44.8258 174.9224 7 Y 4.7895 9.0546 127.1556 55.8419 40.1027 174.2297 8 C 4.0213 8.9923 130.1140 58.7470 31.8517 174.0224 9 S 4.0829 8.4567 122.5239 61.1612 62.9993 174.1961 10 N 4.1993 7.7933 119.2414 54.0447 38.8900 175.6726 11 G 3.9779 9.0791 115.5839 44.6056 0.0000 172.9035 12 G 3.2006 7.3491 106.3084 44.8435 0.0000 173.0129 13 H 4.8195 7.1501 115.0014 53.2004 32.2018 174.7975 14 F 4.9199 8.5323 121.9990 57.0707 40.0472 174.7132 15 L 4.4033 9.4037 126.5195 55.7769 43.1973 175.7207 16 R 4.8434 9.1265 125.5490 54.6573 33.7413 173.8049 17 I 4.4667 8.1029 126.9721 59.3622 38.8429 175.7385 18 L 4.1384 9.2380 128.1430 53.5647 42.1484 177.1416 19 P 4.3279 0.0000 0.0000 65.2101 31.3060 177.2613 20 D 4.5192 7.9129 115.6240 53.4064 40.0203 177.0553 21 G 4.1369 8.1748 108.9936 45.6517 0.0000 173.8638 22 T 4.2914 8.3375 117.9588 63.2045 69.0339 173.6199 23 V 4.8938 8.3058 125.4080 61.0687 34.6512 173.4122 24 D 4.4318 8.7123 130.3649 52.4761 44.0505 174.4649 25 G 4.5700 8.4021 103.2518 45.3990 0.0000 172.0019 26 T 5.0219 8.9289 116.3717 60.4610 71.2549 174.4994 27 R 4.4060 8.7532 122.6171 56.2935 31.2604 176.2506 28 D 4.5712 8.1285 119.5586 53.8729 40.8183 176.8722 29 R 3.9258 8.5327 126.3455 58.3566 30.4698 178.1003 30 S 4.2499 7.8440 112.6918 59.7926 63.0671 174.2000 31 D 4.4641 7.6304 120.8128 54.1438 41.3333 176.4535 32 Q 4.0227 8.6646 124.8251 58.5869 29.0072 176.6497 33 H 4.7623 9.4917 115.1264 55.4930 28.9926 176.0556 34 I 4.5044 7.3622 111.9863 60.6615 38.6523 175.7150 35 Q 4.1602 7.9012 121.9962 55.9957 29.7921 174.9604 36 L 5.1350 8.9070 124.2636 52.8415 45.6771 175.3550 37 Q 4.5879 9.6096 126.5041 55.0698 30.3715 174.0632 38 L 5.3027 8.5443 126.9349 53.3511 43.6117 176.1846 39 S 4.7647 8.9237 117.1143 56.5665 66.6963 172.9470 40 A 4.8319 8.7227 125.4642 50.8294 18.6832 176.6114 41 E 4.0225 9.1301 123.5093 59.5770 30.0981 177.2911 42 S 4.8598 7.4954 112.7727 56.0798 65.7046 173.8319 43 V 3.5020 8.0819 119.0620 66.8284 31.4653 176.5137 44 G 4.1119 7.8837 103.3515 46.1123 0.0000 171.3640 45 E 5.1911 8.1105 121.2387 54.5546 31.7601 175.6010 46 V 5.0441 8.9941 118.5161 59.8002 35.4961 174.6526 47 Y 5.2673 8.8536 120.1994 56.6214 40.9569 175.0611 48 I 4.6507 8.6133 122.7116 59.6705 39.9711 174.1503 49 K 4.6778 9.2221 129.8826 53.9194 35.0168 175.2531 50 S 4.7373 8.8962 123.2173 59.0991 62.6780 174.8132 51 T 4.0307 8.4542 117.5281 63.6785 68.8774 175.7797 52 E 4.1140 8.3071 122.8773 58.1672 29.9906 176.7522 53 T 4.3085 7.5513 105.9159 60.4154 70.0882 175.0358 54 G 3.7710 7.8731 109.4519 46.2383 0.0000 173.4427 55 Q 4.4300 7.4129 118.4453 55.3847 30.3442 174.6274 56 Y 4.9688 8.9093 121.1968 56.4621 39.9390 175.0259 57 L 4.4708 8.8352 126.0154 55.6921 43.5931 175.6217 58 A 5.0520 8.9677 126.2463 50.9201 23.5632 174.4976 59 M 5.4843 8.5866 118.3326 54.3467 35.2263 175.0238 60 D 5.1915 9.2282 126.8848 52.2820 41.3441 177.0282 61 T 4.1808 8.5966 108.5339 64.1178 68.5009 174.3536 62 D 4.6574 8.5006 120.3830 54.4026 42.0698 177.2012 63 G 3.4910 8.5547 108.0099 44.7502 0.0000 172.7433 64 L 4.5624 8.3436 121.9811 54.1287 42.9198 175.8098 65 L 5.1556 8.3349 125.1688 54.7468 42.9741 175.2622 66 Y 5.0752 8.8405 119.6386 55.9053 42.4713 173.5703 67 G 4.3152 8.9644 107.5492 44.7780 0.0000 173.2288 68 S 5.0126 9.2710 121.9717 57.0426 63.6061 175.3988 69 Q 4.2388 9.0774 125.9649 58.1323 28.9868 176.5604 70 T 4.8040 7.6351 106.5723 58.5199 71.5891 171.9397 71 P 4.0438 0.0000 0.0000 63.1052 32.0268 175.0596 72 N 4.8410 8.1539 115.8296 51.9850 39.4868 174.4093 73 E 3.8903 8.9226 115.0674 59.8055 29.7127 178.8946 74 E 3.9993 8.2514 118.0251 58.4912 29.6205 177.3546 75 C 4.9844 7.6924 114.6068 58.6082 29.2981 173.2167 76 L 4.1999 7.1379 122.3344 53.5354 43.3281 175.2944 77 F 5.0843 8.8294 123.9505 55.6197 43.4416 173.9105 78 L 5.0826 8.6814 121.8894 53.4479 43.2442 175.0250 79 E 4.5470 8.8853 126.1861 54.6948 31.0165 175.2188 80 R 4.6889 8.1842 125.5707 54.0714 33.3564 174.8552 81 L 4.6352 8.4365 125.6587 54.6082 42.7099 176.3302 82 E 4.6972 8.9453 128.5036 55.5707 31.7116 175.1713 83 E 4.1483 8.8775 119.3703 59.3754 30.4205 177.8148 84 N 5.0770 7.7191 113.8740 52.3008 38.9037 174.9418 85 H 4.4323 8.2788 112.9249 55.8745 27.7046 175.4879 86 Y 4.6636 7.7616 116.2713 57.5007 39.2673 174.4093 87 N 5.5618 10.0810 120.3040 51.9147 42.2703 173.8331 88 T 5.0925 8.2044 110.1279 59.4608 72.5499 172.8434 89 Y 5.2317 8.7955 119.2714 55.4576 41.7486 173.8749 90 I 4.8646 8.4121 124.9410 58.6843 40.8912 174.3553 91 S 3.8243 9.2344 124.6908 58.7924 62.6720 174.2538 92 K 3.7516 8.2133 129.6864 59.6209 31.6106 178.2303 93 K 3.8465 7.9761 118.4116 58.8941 32.4713 175.8976 94 H 4.5649 8.1579 116.1360 54.9133 29.5445 174.3714 95 A 4.1614 7.5942 123.2360 53.5268 19.9753 179.6144 96 E 4.0171 7.9800 112.5071 58.1908 29.8065 177.6820 97 K 4.1614 7.5482 117.4669 55.7619 33.3501 175.6663 98 N 3.9854 7.4677 114.8051 53.9298 36.0938 174.5985 99 W 4.8910 7.8952 118.6418 56.9508 30.0671 176.3249 100 F 5.5484 8.9042 123.9452 55.4264 41.1343 176.1273 101 V 3.8466 9.4936 122.8440 63.4143 32.2884 175.2498 102 G 4.6157 8.7079 113.1125 45.3470 0.0000 171.3283 103 L 5.3399 8.3660 120.1298 52.4254 45.3486 177.1695 104 K 4.2692 9.8916 122.2866 55.6616 32.8866 178.5305 105 K 3.9790 8.4000 119.4169 59.5088 31.9303 178.1456 106 N 4.4771 8.0373 113.5310 53.0093 37.1939 175.8739 107 G 3.5116 8.0017 108.1782 45.4788 0.0000 173.8429 108 S 4.4539 7.7903 115.8333 58.1543 64.2382 173.2695 109 C 4.2896 8.4923 116.8273 57.9369 30.7324 172.6249 110 K 4.4694 8.5563 123.5177 54.9300 33.0324 176.7074 111 R 4.2458 8.5358 126.2013 55.6943 31.2580 177.7269 112 G 3.3194 8.0070 109.9677 48.1889 0.0000 174.4046 113 P 4.1348 0.0000 0.0000 65.3270 31.3537 177.4574 114 R 4.2022 7.8992 114.5130 56.9037 30.0023 176.2855 115 T 5.0883 7.3336 107.8725 59.9657 70.8197 173.4610 116 H 4.9832 8.3279 120.4779 54.8422 32.8275 172.1839 117 Y 3.9560 8.3063 125.4081 59.4173 38.9208 176.6952 118 G 3.6606 7.9208 114.6624 45.0762 0.0000 173.7372 119 Q 4.1100 7.3223 119.3055 55.4517 29.3972 177.3618 120 K 3.8705 8.3393 119.6641 58.3985 32.8529 179.1211 121 A 3.9351 7.9734 122.2303 54.5148 18.0114 178.5377 122 I 4.6961 7.3732 106.1262 59.7866 38.2411 174.1334 123 L 5.2183 7.2274 122.3846 53.4701 43.5194 175.3678 124 F 5.4489 9.5591 122.9966 55.5976 42.7657 173.9073 125 L 4.7576 8.8332 126.8100 52.8976 43.0042 173.7179 126 P 5.1161 0.0000 0.0000 62.7251 32.6413 175.6160 127 L 4.7684 8.7243 123.2011 52.2232 45.0427 173.9215 128 P 4.5987 0.0000 0.0000 61.7266 31.8542 176.5973 129 V 3.5238 7.6962 125.5307 64.2853 31.7861 176.7869 130 S 4.4825 8.7215 120.9180 58.5216 62.1050 169.0994 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 K 8.31 4.31 0.00 1.97 1.94 0.00 1.49 0.00 0.00 1.72 0.00 0.00 2.95 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.31 1.47 7.81 2 K 8.22 4.34 0.00 1.79 1.72 0.00 1.76 0.00 0.00 1.74 0.00 0.00 2.99 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.34 1.44 7.81 3 P 0.00 4.84 0.00 2.08 2.14 0.00 3.67 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 2.04 1.97 0.00 4 K 8.59 5.01 0.00 1.73 1.71 0.00 1.68 0.00 0.00 1.69 0.00 0.00 2.85 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.48 1.43 7.81 5 L 8.52 4.94 0.00 1.73 1.54 0.43 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 6 L 8.71 5.19 0.00 1.65 1.76 0.48 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 7 Y 9.05 4.79 0.00 3.23 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 8 C 8.99 4.02 0.00 2.60 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 9 S 8.46 4.08 0.00 3.73 3.60 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 10 N 7.79 4.20 0.00 2.78 2.52 0.00 0.00 7.19 7.95 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 11 G 9.08 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 0.00 0.00 0.00 12 G 7.35 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 0.00 0.00 0.00 13 H 7.15 4.82 0.00 3.00 3.13 0.00 5.82 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 F 8.53 4.92 0.00 3.14 3.12 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 15 L 9.40 4.40 0.00 1.77 1.55 0.89 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 16 R 9.13 4.84 0.00 1.96 1.95 0.00 3.22 0.00 0.00 3.27 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.69 0.00 17 I 8.10 4.47 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 1.19 0.75 0.91 0.00 0.00 18 L 9.24 4.14 0.00 1.88 1.56 0.92 1.12 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 19 P 0.00 4.33 0.00 2.01 2.12 0.00 3.56 0.00 0.00 3.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.96 0.00 20 D 7.91 4.52 0.00 2.79 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 21 G 8.17 4.14 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 0.00 0.00 0.00 22 T 8.34 4.29 4.36 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 1.23 0.00 0.00 23 V 8.31 4.89 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 0.90 0.00 0.00 1.01 0.00 0.00 24 D 8.71 4.43 0.00 2.87 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 25 G 8.40 4.57 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 0.00 26 T 8.93 5.02 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 1.41 0.00 0.00 27 R 8.75 4.41 0.00 1.88 2.00 0.00 3.22 0.00 0.00 3.10 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.54 0.00 28 D 8.13 4.57 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 29 R 8.53 3.93 0.00 1.81 1.82 0.00 3.49 0.00 0.00 3.31 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.72 0.00 30 S 7.84 4.25 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 31 D 7.63 4.46 0.00 2.80 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 32 Q 8.66 4.02 0.00 1.72 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.80 0.00 0.00 0.00 0.00 0.00 2.33 2.28 0.00 33 H 9.49 4.76 0.00 3.32 3.53 0.00 5.80 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 I 7.36 4.50 1.92 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.34 1.10 0.00 0.00 35 Q 7.90 4.16 0.00 2.03 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.90 0.00 0.00 0.00 0.00 0.00 2.39 2.39 0.00 36 L 8.91 5.14 0.00 1.60 1.46 0.90 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 37 Q 9.61 4.59 0.00 2.04 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.80 0.00 0.00 0.00 0.00 0.00 2.30 2.39 0.00 38 L 8.54 5.30 0.00 1.59 1.65 0.91 0.90 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 39 S 8.92 4.76 0.00 3.97 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 40 A 8.72 4.83 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 E 9.13 4.02 0.00 2.19 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 2.44 2.31 0.00 42 S 7.50 4.86 0.00 4.05 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 43 V 8.08 3.50 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 0.78 0.00 0.00 0.93 0.00 0.00 44 G 7.88 4.11 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 0.00 0.00 0.00 45 E 8.11 5.19 0.00 1.82 1.76 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 2.09 2.18 0.00 46 V 8.99 5.04 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 0.91 0.00 0.00 1.12 0.00 0.00 47 Y 8.85 5.27 0.00 3.04 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 48 I 8.61 4.65 1.70 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.61 0.72 0.00 0.00 49 K 9.22 4.68 0.00 1.47 1.46 0.00 1.18 0.00 0.00 1.15 0.00 0.00 2.69 0.00 0.00 2.74 0.00 0.00 0.00 0.00 0.94 0.24 7.81 50 S 8.90 4.74 0.00 3.84 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 51 T 8.45 4.03 4.20 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 1.17 0.00 0.00 52 E 8.31 4.11 0.00 1.94 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 2.16 2.32 0.00 53 T 7.55 4.31 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 1.26 0.00 0.00 54 G 7.87 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 55 Q 7.41 4.43 0.00 1.99 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.35 6.82 0.00 0.00 0.00 0.00 0.00 2.39 2.33 0.00 56 Y 8.91 4.97 0.00 2.97 2.95 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 57 L 8.84 4.47 0.00 1.68 1.54 0.78 0.24 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 58 A 8.97 5.05 0.44 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 59 M 8.59 5.48 0.00 2.26 2.27 0.00 0.00 0.00 0.00 0.00 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.79 0.00 60 D 9.23 5.19 0.00 2.95 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 61 T 8.60 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 1.30 0.00 0.00 62 D 8.50 4.66 0.00 2.83 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 63 G 8.55 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 L 8.34 4.56 0.00 1.75 1.73 0.93 0.54 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 65 L 8.33 5.16 0.00 1.62 1.61 0.92 0.91 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 66 Y 8.84 5.08 0.00 3.21 3.01 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 0.00 0.00 0.00 67 G 8.96 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 68 S 9.27 5.01 0.00 3.82 3.81 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 69 Q 9.08 4.24 0.00 2.16 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.48 0.00 0.00 0.00 0.00 0.00 2.43 2.42 0.00 70 T 7.64 4.80 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 1.25 0.00 0.00 71 P 0.00 4.04 0.00 1.72 0.63 0.00 3.73 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.37 0.00 72 N 8.15 4.84 0.00 2.90 2.97 0.00 0.00 5.83 7.66 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 73 E 8.92 3.89 0.00 2.09 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 0.00 2.36 2.33 0.00 74 E 8.25 4.00 0.00 2.15 2.32 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 2.46 2.42 0.00 75 C 7.69 4.98 0.00 3.14 3.18 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 0.00 76 L 7.14 4.20 0.00 1.62 1.19 -0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 77 F 8.83 5.08 0.00 3.09 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 78 L 8.68 5.08 0.00 1.64 1.59 0.85 0.78 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 79 E 8.89 4.55 0.00 2.26 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 2.25 2.12 0.00 80 R 8.18 4.69 0.00 1.79 1.78 0.00 3.31 0.00 0.00 3.08 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.65 0.00 81 L 8.44 4.64 0.00 1.66 1.59 1.01 1.04 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 82 E 8.95 4.70 0.00 2.20 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 2.49 2.52 0.00 83 E 8.88 4.15 0.00 1.94 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 2.27 2.39 0.00 84 N 7.72 5.08 0.00 2.82 2.84 0.00 0.00 7.28 8.16 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 85 H 8.28 4.43 0.00 3.37 3.58 0.00 5.89 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 Y 7.76 4.66 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 87 N 10.08 5.56 0.00 2.51 2.32 0.00 0.00 6.71 6.93 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 88 T 8.20 5.09 4.61 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 1.43 0.00 0.00 89 Y 8.80 5.23 0.00 2.88 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 90 I 8.41 4.86 1.16 0.00 0.00 0.58 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 1.30 0.50 0.00 0.00 91 S 9.23 3.82 0.00 4.10 3.93 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 92 K 8.21 3.75 0.00 1.69 1.62 0.00 1.72 0.00 0.00 1.45 0.00 0.00 2.76 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.32 1.28 7.81 93 K 7.98 3.85 0.00 1.57 1.56 0.00 1.72 0.00 0.00 1.60 0.00 0.00 2.86 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.15 1.50 7.81 94 H 8.16 4.56 0.00 2.94 2.19 0.00 5.66 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 A 7.59 4.16 1.20 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 0.00 0.00 96 E 7.98 4.02 0.00 2.00 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 2.12 2.16 0.00 97 K 7.55 4.16 0.00 1.15 1.17 0.00 1.02 0.00 0.00 0.61 0.00 0.00 2.79 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.06 1.05 7.81 98 N 7.47 3.99 0.00 2.94 3.03 0.00 0.00 7.03 7.52 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 99 W 7.90 4.89 0.00 3.34 3.19 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 0.00 100 F 8.90 5.55 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 0.00 101 V 9.49 3.85 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 0.52 0.00 0.00 0.54 0.00 0.00 102 G 8.71 4.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.37 5.34 0.00 1.46 1.49 1.02 0.95 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 0.00 104 K 9.89 4.27 0.00 1.99 1.70 0.00 1.64 0.00 0.00 1.62 0.00 0.00 2.97 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.48 7.81 105 K 8.40 3.98 0.00 1.70 1.84 0.00 1.70 0.00 0.00 1.78 0.00 0.00 2.96 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.46 1.38 7.81 106 N 8.04 4.48 0.00 2.81 2.90 0.00 0.00 6.12 7.00 0.00 0.00 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 G 8.00 3.51 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 0.00 108 S 7.79 4.45 0.00 4.00 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 0.00 109 C 8.49 4.29 0.00 3.00 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 0.00 110 K 8.56 4.47 0.00 1.78 1.76 0.00 1.77 0.00 0.00 1.69 0.00 0.00 3.06 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.37 1.38 7.81 111 R 8.54 4.25 0.00 1.73 1.58 0.00 3.10 0.00 0.00 3.29 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.56 0.00 112 G 8.01 3.32 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 0.00 113 P 0.00 4.13 0.00 1.89 2.08 0.00 3.15 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.44 0.00 114 R 7.90 4.20 0.00 1.89 1.94 0.00 3.27 0.00 0.00 3.25 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.65 0.00 115 T 7.33 5.09 4.43 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 1.34 0.00 0.00 116 H 8.33 4.98 0.00 3.19 3.14 0.00 5.68 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 0.00 117 Y 8.31 3.96 0.00 2.96 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 0.00 118 G 7.92 3.66 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 0.00 0.00 0.00 119 Q 7.32 4.11 0.00 2.02 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.80 6.77 0.00 0.00 0.00 0.00 0.00 2.30 2.33 0.00 120 K 8.34 3.87 0.00 1.77 1.65 0.00 1.55 0.00 0.00 1.70 0.00 0.00 2.68 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.30 1.26 7.81 121 A 7.97 3.94 1.25 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 0.00 0.00 122 I 7.37 4.70 1.77 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 1.34 1.69 0.72 0.00 0.00 123 L 7.23 5.22 0.00 1.31 1.57 0.57 1.04 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 0.00 124 F 9.56 5.45 0.00 3.26 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 0.00 125 L 8.83 4.76 0.00 0.60 1.46 0.41 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 126 P 0.00 5.12 0.00 2.18 2.15 0.00 3.76 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.11 0.00 127 L 8.72 4.77 0.00 1.62 1.58 0.87 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 128 P 0.00 4.60 0.00 1.93 2.01 0.00 3.67 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 2.02 2.08 0.00 129 V 7.70 3.52 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 0.67 0.00 0.00 0.86 0.00 0.00 130 S 8.72 4.48 0.00 3.91 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 0.00