NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 10 Q 4.4446 8.3444 118.8578 56.2214 30.1653 176.8189 11 F 4.7927 7.9878 121.1187 57.5971 38.1360 169.6452 12 V 3.8877 8.5027 118.2173 59.2684 33.9169 174.1419 13 P 4.0707 0.0000 0.0000 62.7169 31.9021 177.4943 14 A 3.1812 8.6536 124.3541 55.4009 18.2877 179.2644 15 D 4.8328 7.8100 112.2042 55.5169 41.2706 177.1375 16 Q 4.1320 7.8377 117.9164 57.5477 29.6990 177.1104 17 A 3.2539 7.3979 120.4362 53.8283 18.6234 175.8343 18 F 5.3317 7.9735 114.2932 55.6116 41.7003 173.8286 19 A 4.5768 9.1809 126.4337 51.0341 19.2234 175.5703 20 F 4.7765 8.6641 124.2861 57.7973 40.9515 174.3201 21 D 4.4092 7.4865 123.9504 53.0922 45.1230 173.3661 22 F 5.2034 7.4870 115.4364 55.4214 41.5594 173.6577 23 Q 4.3726 8.7458 119.9820 54.8328 32.5018 172.9644 24 Q 4.9984 8.7999 127.0031 54.4941 32.3043 174.7475 25 N 4.8506 9.0776 124.0709 52.3840 40.6584 175.8889 26 Q 3.3892 8.2091 126.9926 56.9562 27.9542 177.2573 27 H 4.4938 8.9384 127.6018 58.2360 29.0480 173.7779 28 D 5.1110 8.0686 120.7432 52.6671 42.4625 175.3404 29 L 5.2080 9.0033 125.6788 53.1250 45.7645 174.3968 30 N 5.4575 9.1372 124.1131 51.7848 42.0331 172.6223 31 L 4.8448 9.0528 126.3482 53.2970 44.3880 175.6729 32 T 5.2821 8.1715 119.3112 61.5599 73.1799 173.0013 33 W 5.3225 9.1698 123.8113 55.1815 33.0502 174.2841 34 Q 4.7207 9.3945 125.1610 54.9461 29.7312 174.9836 35 I 4.7091 8.2240 126.4478 59.2063 38.2443 175.8599 36 K 3.9064 8.4331 129.4368 56.4224 33.2095 175.7276 37 D 4.3836 8.6795 125.6768 56.0318 41.7693 176.3628 38 G 4.3731 9.8071 113.6179 45.1550 0.0000 171.7455 39 Y 5.2174 7.5432 115.6871 56.5159 42.2108 173.9712 40 Y 5.2389 8.5895 117.7138 56.2140 41.9691 173.4329 41 L 4.7746 8.8134 120.2950 53.2123 44.9737 175.2634 42 Y 4.4484 8.2331 120.5242 57.1237 38.8523 176.3941 43 R 3.5084 8.4551 125.7360 59.3525 30.1640 178.6498 44 K 4.0827 7.7361 114.2434 58.4733 31.9723 177.4259 45 Q 4.3077 7.8108 117.5099 55.8000 29.0554 174.7771 46 I 4.6305 7.3231 120.0536 60.5805 38.2113 175.4235 47 R 4.6786 9.3927 127.2596 54.5414 33.4986 173.7364 48 I 5.0996 8.5608 126.0346 59.9246 40.2647 174.8707 49 T 4.6954 8.9608 124.4556 61.0032 71.3733 171.9655 50 P 4.9584 0.0000 0.0000 62.3340 33.2800 175.4964 51 E 4.3883 8.8565 120.8412 55.1954 33.0427 175.8338 52 H 4.0309 9.1600 122.0440 56.1827 26.1622 173.9677 53 A 5.1798 7.6868 117.5531 50.9751 22.5381 176.5967 54 K 4.7316 9.3622 119.0629 54.5234 35.3030 175.7788 55 I 5.1392 8.3289 117.2915 58.6026 40.6716 175.0785 56 A 4.3219 8.6581 125.5205 51.5190 19.2174 177.3446 57 D 4.3302 8.6571 119.0066 54.7812 41.4072 176.5948 58 V 4.0871 8.2554 122.7961 61.3579 32.5714 174.6981 59 Q 4.4584 8.4964 128.6382 54.1901 29.5034 174.7830 60 L 4.2312 8.3820 126.4858 53.5834 42.4043 175.4699 61 P 4.4561 0.0000 0.0000 62.2260 32.0501 175.5284 62 Q 4.3321 8.5954 120.7152 55.9330 29.5946 175.4234 63 G 4.3555 9.6384 118.1075 44.4625 0.0000 172.5137 64 V 4.4952 7.8198 112.2265 59.3669 34.8874 175.2565 65 W 4.7917 8.6398 122.4214 56.3657 30.2708 175.2533 66 H 4.9917 9.4716 122.9193 54.5712 33.7200 171.2973 67 E 5.4090 8.1489 122.2091 54.4752 32.2404 174.1943 68 D 5.0804 9.1728 125.1029 51.8281 43.2701 176.3037 69 E 4.0829 9.0688 117.8366 59.0769 29.7401 179.0055 70 F 4.2166 8.6799 117.1420 60.4064 39.1774 175.7476 71 Y 4.6988 9.0352 114.8168 57.0294 40.1032 177.1941 72 G 3.8054 8.1043 112.1957 46.7484 0.0000 176.3967 73 K 4.9457 8.8898 129.3867 56.0333 32.2994 175.0249 74 S 4.8635 9.5319 123.2600 56.7856 68.1710 172.6611 75 E 3.7528 7.9268 123.0975 55.0105 30.6153 175.1450 76 I 4.7542 8.6272 119.9079 59.0979 41.8846 173.5689 77 Y 5.2263 8.5843 119.3557 56.3784 40.9421 175.4242 78 R 4.9159 8.4173 121.1401 55.5984 34.2604 174.5949 79 D 4.9100 9.6269 123.4030 54.1528 39.2539 173.8602 80 R 5.0486 7.1201 114.3908 55.4518 33.2154 172.8157 81 L 4.6098 8.7438 126.5531 53.4853 45.0234 174.9863 82 T 5.1152 8.5227 122.4697 61.6990 71.2226 173.4396 83 L 4.7413 9.2735 128.5166 52.5786 44.8881 173.4860 84 P 5.0046 0.0000 0.0000 62.5622 32.6510 175.8705 85 V 4.4995 9.4210 122.5201 61.5547 35.2992 174.0333 86 T 4.8411 8.5287 123.7978 62.2339 70.2036 173.6965 87 I 4.4093 9.0265 129.1924 60.2853 37.6977 176.4270 88 N 4.6701 9.1784 126.6678 55.9128 39.9243 175.3723 89 Q 5.0811 7.9406 117.0233 55.1991 32.9374 173.3451 90 A 5.0268 8.9034 127.2070 51.0448 23.1680 176.5197 91 S 4.7286 8.9014 118.3119 57.1814 65.4318 173.6312 92 A 4.1935 8.3163 123.5539 53.6418 18.2855 177.9716 93 G 3.8838 8.9785 111.1096 44.8548 0.0000 173.3019 94 A 4.5310 7.6920 121.5832 52.3943 19.8030 176.8991 95 T 5.0900 8.7115 108.7201 60.1093 73.3802 172.3963 96 L 5.0443 8.6243 123.4228 53.6239 45.1484 175.1377 97 T 4.7366 9.1686 124.1942 62.6045 70.1413 173.9479 98 V 4.7756 8.9542 127.9016 61.5193 33.7905 174.3841 99 T 5.1930 9.0866 125.3590 62.1587 71.8318 172.9073 100 Y 5.1955 7.9435 121.5424 57.0050 42.2359 173.0588 101 Q 4.6590 8.4670 119.9976 54.6829 32.9472 173.4302 102 G 4.0194 8.4257 111.3934 44.8009 0.0000 171.2046 103 C 5.3836 8.4599 116.2267 54.9829 46.0769 172.8489 104 A 4.5903 7.9803 121.4675 49.9195 20.5153 177.8063 105 D 4.4920 8.6754 121.5882 57.2111 41.4016 178.9710 106 A 3.9519 7.8137 120.4903 53.7464 18.6426 176.9052 107 G 4.3358 7.2903 105.9765 45.4969 0.0000 173.7376 108 F 5.1187 7.5875 111.2013 55.8457 40.4213 173.1814 109 C 5.1166 8.7520 119.0288 55.4055 42.8176 173.4808 110 Y 4.8487 8.7623 120.3968 56.7612 38.9071 173.5518 111 P 4.7356 0.0000 0.0000 61.6522 32.8154 174.1655 112 P 4.5113 0.0000 0.0000 62.7901 32.1277 175.6126 113 E 4.5909 8.8394 123.3202 54.5520 32.9636 174.5714 114 T 5.0259 8.2651 121.1157 61.6113 71.7284 173.3939 115 K 4.6158 9.1576 125.0688 54.8018 35.8135 175.1889 116 T 4.8441 8.4787 120.4339 61.9475 70.4269 173.8517 117 V 3.7714 8.5796 128.3572 60.4845 33.1248 173.0313 118 P 4.7215 0.0000 0.0000 62.5450 31.9902 175.6129 119 L 4.6495 8.4230 125.3426 53.5064 42.7816 177.1100 120 S 4.3455 9.2872 120.3740 57.7975 63.6092 173.9096 121 E 4.2520 8.6137 124.9347 56.9562 30.2665 176.3132 122 V 4.3406 8.7935 125.6639 61.1772 34.9571 174.1870 123 V 4.1534 8.5094 128.1773 62.1237 32.2002 175.4241 124 A 4.8850 8.4876 129.3064 51.8395 19.2521 177.0966 125 N 4.5817 8.7238 114.6951 53.6820 38.0577 174.9738 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 10 Q 8.34 4.44 0.00 2.41 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 7.35 0.00 0.00 0.00 0.00 0.00 2.39 2.53 0.00 11 F 7.99 4.79 0.00 2.59 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 12 V 8.50 3.89 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 0.82 0.00 0.00 0.81 0.00 0.00 13 P 0.00 4.07 0.00 2.07 1.90 0.00 3.51 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.98 0.00 14 A 8.65 3.18 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 15 D 7.81 4.83 0.00 2.67 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 16 Q 7.84 4.13 0.00 2.06 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.01 0.00 0.00 0.00 0.00 0.00 2.27 2.21 0.00 17 A 7.40 3.25 -0.01 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 0.00 0.00 18 F 7.97 5.33 0.00 3.08 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 19 A 9.18 4.58 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 20 F 8.66 4.78 0.00 2.65 2.88 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 21 D 7.49 4.41 0.00 2.51 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 0.00 0.00 0.00 0.00 22 F 7.49 5.20 0.00 2.89 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 23 Q 8.75 4.37 0.00 1.98 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.79 0.00 0.00 0.00 0.00 0.00 2.19 2.20 0.00 24 Q 8.80 5.00 0.00 2.16 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 6.88 0.00 0.00 0.00 0.00 0.00 2.29 2.34 0.00 25 N 9.08 4.85 0.00 2.64 2.62 0.00 0.00 7.02 6.71 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 26 Q 8.21 3.39 0.00 2.26 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.89 6.87 0.00 0.00 0.00 0.00 0.00 2.25 2.36 0.00 27 H 8.94 4.49 0.00 3.20 3.35 0.00 5.88 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 28 D 8.07 5.11 0.00 2.64 2.60 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 29 L 9.00 5.21 0.00 1.73 1.66 1.08 0.62 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 30 N 9.14 5.46 0.00 2.75 2.57 0.00 0.00 6.81 6.19 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 31 L 9.05 4.84 0.00 1.72 1.27 1.12 0.40 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 32 T 8.17 5.28 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 1.19 0.00 0.00 33 W 9.17 5.32 0.00 3.18 2.92 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 34 Q 9.39 4.72 0.00 1.96 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.54 6.77 0.00 0.00 0.00 0.00 0.00 2.33 2.32 0.00 35 I 8.22 4.71 1.98 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 1.43 0.87 1.14 0.00 0.00 36 K 8.43 3.91 0.00 1.52 1.27 0.00 1.30 0.00 0.00 1.62 0.00 0.00 2.74 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.54 1.37 7.81 37 D 8.68 4.38 0.00 2.70 2.62 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 38 G 9.81 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 0.00 0.00 0.00 0.00 39 Y 7.54 5.22 0.00 2.61 2.54 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 0.00 0.00 0.00 0.00 40 Y 8.59 5.24 0.00 3.01 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 41 L 8.81 4.77 0.00 1.56 1.37 0.22 -0.02 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 42 Y 8.23 4.45 0.00 2.73 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 43 R 8.46 3.51 0.00 0.89 1.58 0.00 3.22 0.00 0.00 3.11 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.58 0.00 44 K 7.74 4.08 0.00 1.59 1.76 0.00 1.77 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.30 1.33 7.81 45 Q 7.81 4.31 0.00 2.21 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.86 6.94 0.00 0.00 0.00 0.00 0.00 2.02 2.50 0.00 46 I 7.32 4.63 1.96 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.57 0.94 0.00 0.00 47 R 9.39 4.68 0.00 1.80 1.72 0.00 3.03 0.00 0.00 3.17 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.59 0.00 48 I 8.56 5.10 1.93 0.00 0.00 1.00 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 0.91 0.97 0.00 0.00 49 T 8.96 4.70 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 1.29 0.00 0.00 50 P 0.00 4.96 0.00 2.23 2.04 0.00 3.71 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.00 0.00 51 E 8.86 4.39 0.00 1.87 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 2.16 2.23 0.00 52 H 9.16 4.03 0.00 3.38 3.38 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 53 A 7.69 5.18 1.21 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 0.00 0.00 0.00 54 K 9.36 4.73 0.00 1.64 1.69 0.00 1.62 0.00 0.00 1.71 0.00 0.00 2.89 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.35 1.35 7.81 55 I 8.33 5.14 1.98 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 1.29 0.69 0.93 0.00 0.00 56 A 8.66 4.32 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 57 D 8.66 4.33 0.00 2.69 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 58 V 8.26 4.09 2.12 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 0.83 0.00 0.00 1.03 0.00 0.00 59 Q 8.50 4.46 0.00 2.04 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 6.71 0.00 0.00 0.00 0.00 0.00 2.28 2.44 0.00 60 L 8.38 4.23 0.00 1.74 1.72 0.95 1.15 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 61 P 0.00 4.46 0.00 2.09 2.00 0.00 3.67 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.67 0.00 62 Q 8.60 4.33 0.00 2.09 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.76 0.00 0.00 0.00 0.00 0.00 2.42 2.37 0.00 63 G 9.64 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 0.00 0.00 0.00 0.00 64 V 7.82 4.50 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 0.82 0.00 0.00 0.94 0.00 0.00 65 W 8.64 4.79 0.00 3.20 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 66 H 9.47 4.99 0.00 2.91 2.81 0.00 5.52 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 E 8.15 5.41 0.00 1.98 1.73 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 2.21 2.33 0.00 68 D 9.17 5.08 0.00 3.24 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 69 E 9.07 4.08 0.00 1.68 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 2.25 2.37 0.00 70 F 8.68 4.22 0.00 3.62 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 71 Y 9.04 4.70 0.00 2.75 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 72 G 8.10 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 0.00 0.00 0.00 73 K 8.89 4.95 0.00 1.87 1.87 0.00 1.66 0.00 0.00 1.57 0.00 0.00 2.13 0.00 0.00 2.61 0.00 0.00 0.00 0.00 1.84 1.69 7.81 74 S 9.53 4.86 0.00 3.87 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 75 E 7.93 3.75 0.00 1.16 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 1.68 1.47 0.00 76 I 8.63 4.75 1.70 0.00 0.00 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.30 0.56 0.00 0.00 77 Y 8.58 5.23 0.00 2.78 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 78 R 8.42 4.92 0.00 1.69 1.87 0.00 3.33 0.00 0.00 3.26 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.65 0.00 79 D 9.63 4.91 0.00 2.91 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 80 R 7.12 5.05 0.00 1.79 1.75 0.00 3.18 0.00 0.00 3.15 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.74 0.00 81 L 8.74 4.61 0.00 1.47 1.42 0.07 -0.45 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 82 T 8.52 5.12 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 1.21 0.00 0.00 83 L 9.27 4.74 0.00 1.88 1.77 0.98 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 84 P 0.00 5.00 0.00 2.13 2.04 0.00 3.78 0.00 0.00 3.60 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 85 V 9.42 4.50 2.12 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 1.09 0.00 0.00 1.00 0.00 0.00 86 T 8.53 4.84 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 87 I 9.03 4.41 1.88 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 1.24 1.21 0.94 0.00 0.00 88 N 9.18 4.67 0.00 2.80 2.88 0.00 0.00 6.10 7.11 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 89 Q 7.94 5.08 0.00 2.08 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.79 0.00 0.00 0.00 0.00 0.00 2.47 2.31 0.00 90 A 8.90 5.03 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 91 S 8.90 4.73 0.00 3.92 4.02 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 92 A 8.32 4.19 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 93 G 8.98 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 94 A 7.69 4.53 1.38 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 0.00 0.00 0.00 95 T 8.71 5.09 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 1.26 0.00 0.00 96 L 8.62 5.04 0.00 1.71 1.45 0.93 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 97 T 9.17 4.74 4.31 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 1.19 0.00 0.00 98 V 8.95 4.78 1.91 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 1.13 0.00 0.00 1.00 0.00 0.00 99 T 9.09 5.19 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 1.16 0.00 0.00 100 Y 7.94 5.20 0.00 2.84 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 0.00 101 Q 8.47 4.66 0.00 2.07 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.76 0.00 0.00 0.00 0.00 0.00 2.39 2.52 0.00 102 G 8.43 4.02 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 0.00 0.00 0.00 103 C 8.46 5.38 0.00 1.62 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 0.00 104 A 7.98 4.59 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 D 8.68 4.49 0.00 2.49 2.74 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 0.00 106 A 7.81 3.95 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 0.00 107 G 7.29 4.34 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 0.00 108 F 7.59 5.12 0.00 3.11 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 0.00 109 C 8.75 5.12 0.00 2.48 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 0.00 110 Y 8.76 4.85 0.00 3.17 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 0.00 111 P 0.00 4.74 0.00 2.13 2.14 0.00 4.13 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.12 0.00 112 P 0.00 4.51 0.00 1.91 1.96 0.00 3.63 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.10 0.00 113 E 8.84 4.59 0.00 1.64 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 1.98 2.12 0.00 114 T 8.27 5.03 4.16 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 1.15 0.00 0.00 115 K 9.16 4.62 0.00 1.17 1.57 0.00 1.73 0.00 0.00 1.65 0.00 0.00 3.15 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.23 0.94 7.81 116 T 8.48 4.84 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 1.17 0.00 0.00 117 V 8.58 3.77 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 -0.06 0.00 0.00 0.76 0.00 0.00 118 P 0.00 4.72 0.00 2.13 2.05 0.00 3.32 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.09 0.00 119 L 8.42 4.65 0.00 1.66 1.62 0.92 0.76 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 0.00 120 S 9.29 4.35 0.00 3.92 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 0.00 121 E 8.61 4.25 0.00 1.97 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 2.28 2.57 0.00 122 V 8.79 4.34 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 0.77 0.00 0.00 0.92 0.00 0.00 123 V 8.51 4.15 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 0.82 0.00 0.00 0.93 0.00 0.00 124 A 8.49 4.88 1.27 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 0.00 0.00 125 N 8.72 4.58 0.00 2.80 3.17 0.00 0.00 6.73 7.56 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