NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 47 E 4.3436 8.4449 121.7141 56.3387 30.6771 175.9909 48 V 3.6644 7.4889 111.9314 59.5243 32.4830 174.1841 49 N 5.8161 8.4112 118.3074 49.7711 40.8229 173.2798 50 P 4.9648 0.0000 0.0000 60.9135 30.8116 177.2411 51 D 4.8963 8.4225 123.9006 53.8857 38.8750 176.4471 52 I 4.0787 6.9859 115.0170 59.5585 36.7027 175.3907 53 I 4.2471 8.2338 125.3424 61.4314 38.0308 176.1102 54 K 4.4369 7.7783 117.6158 58.1169 34.3832 176.6473 55 D 4.2272 7.7000 119.1500 55.3599 40.3887 176.6964 56 E 3.8803 5.9461 115.9798 56.7905 30.9756 176.8795 57 V 4.3591 7.5927 119.5464 61.5054 33.3143 174.9338 58 F 4.7357 8.3133 122.1292 56.1143 42.8355 174.1367 59 D 4.6765 8.0275 119.6439 54.0662 42.0367 176.4892 60 F 4.7160 7.5794 118.6540 58.4013 39.4195 176.5740 61 V 3.6887 8.6905 119.5915 64.2900 31.4434 178.3687 62 I 3.5709 7.7680 117.8535 63.4473 37.7846 178.0070 63 V 3.4442 7.5005 119.7448 65.7266 31.1405 177.3524 64 N 4.4774 7.9356 114.0153 55.1427 39.0797 176.9808 65 R 4.1039 7.9921 118.5236 57.7506 30.5244 176.4102 66 V 4.1946 7.2656 116.3426 64.0158 33.5008 176.9777 67 L 3.9000 8.3316 119.2521 57.8108 41.7021 179.9005 68 K 4.1262 8.1960 116.5438 58.2143 32.1380 177.8195 69 K 4.2995 7.7699 116.7552 56.2568 32.4095 176.5326 70 I 4.1263 7.2017 120.7475 60.4211 37.2980 175.9561 71 K 4.0744 8.9914 125.7595 59.3566 32.8305 177.7100 72 D 4.8384 7.8101 118.6060 52.0979 40.3337 175.8796 73 L 4.0371 7.9105 125.7074 58.1196 43.0844 179.1245 74 K 3.9668 8.0979 117.3567 59.5719 32.1637 178.3877 75 H 3.9451 7.9108 117.2659 58.6023 29.9265 175.0658 76 Y 4.4869 7.8086 116.4672 57.5666 38.3711 175.3924 77 D 4.3928 7.7060 116.7211 54.5973 39.2252 172.6188 78 P 4.7547 0.0000 0.0000 61.9916 32.2974 175.0535 *80 I 4.0818 8.1591 118.0065 61.9867 38.6362 174.6563 81 E 5.1161 8.9495 126.6590 54.5985 32.7006 175.6498 82 K 4.9327 9.5243 122.8686 55.5371 33.8599 176.1653 83 I 4.1202 7.6975 123.1548 59.4687 39.7783 178.2924 84 F 3.8522 6.6675 125.1356 59.0226 35.4845 175.8997 *90 E 3.9672 7.7309 118.8232 55.9696 30.9706 174.5660 *92 G 3.7311 8.1528 111.5932 46.0908 0.0000 170.7604 93 L 5.0143 8.3864 121.1015 52.9673 45.5341 174.4105 94 N 5.2283 8.8195 125.0882 52.0123 40.7276 173.3470 95 V 4.6148 8.8452 126.7595 61.0086 34.5775 173.9305 96 E 5.0532 8.5091 126.7764 54.6976 33.1768 173.6619 97 I 4.6045 8.8357 127.2519 59.5475 40.9548 174.6485 98 Q 4.6296 8.7804 125.7376 55.1239 28.5731 176.1506 99 I 3.9667 8.8816 126.9876 63.3449 38.0599 176.2787 100 N 5.0434 8.1325 120.4322 50.4335 38.6054 172.3401 101 P 4.3346 0.0000 0.0000 64.7960 31.9550 177.9557 102 E 4.0326 8.1624 116.6224 58.4866 29.7449 177.0101 103 V 4.1812 7.9177 117.9261 59.9215 32.1817 173.0655 104 K 3.9862 8.5297 126.0945 57.8581 32.2614 176.0226 105 D 4.5928 8.9645 124.4771 55.4055 38.4100 174.9535 106 F 4.1745 8.3927 124.1711 60.6902 39.6414 174.8173 107 F 5.6109 8.1807 124.3668 57.1738 41.9993 173.1564 108 T 5.1078 9.5333 116.4114 59.8209 72.8680 172.2893 109 F 5.4319 8.8449 124.5549 56.4765 41.8822 174.3018 110 K 4.8002 8.7813 125.1417 54.5307 35.7690 175.1117 111 S 4.8648 8.8137 117.7891 56.6441 66.1397 172.4854 112 I 4.7738 9.3322 128.3070 59.8227 39.3696 174.5599 113 S 5.2556 9.4262 125.2109 56.7428 65.6632 173.7033 114 T 4.4281 8.3248 113.8576 61.1890 72.0352 176.0013 115 T 3.2652 7.5719 112.2930 63.2742 70.0767 173.1622 116 N 5.0406 8.1596 118.6560 52.9023 39.9800 174.4971 117 K 4.7099 8.6023 119.4931 54.5782 35.3624 174.6497 118 Q 5.0655 8.4538 124.2224 54.5103 32.4611 174.1353 119 R 4.5954 9.1890 124.0795 54.5219 34.1827 173.5161 120 C 5.2961 8.3364 120.0444 55.1268 38.7800 172.9177 121 F 5.4885 9.2774 121.2155 55.6752 43.3146 173.6151 122 L 5.3315 9.0143 121.5631 53.1126 44.6688 175.2998 123 S 5.3308 9.4328 118.7695 56.3913 65.2369 172.2144 124 L 4.3119 8.4453 129.0552 53.3575 44.4527 176.5651 125 R 3.4645 9.4281 127.2035 57.1554 28.1770 177.5591 126 G 3.8435 8.3003 104.6200 45.0943 0.0000 173.1888 127 E 4.4880 8.1587 122.2943 55.3221 30.9483 174.6890 128 T 5.2056 8.5055 123.8875 61.2700 70.5574 174.2097 129 R 4.7691 9.4830 125.5772 54.0818 33.5812 175.0021 130 E 4.2669 8.9102 124.1421 56.2152 30.5749 175.5443 131 I 4.6013 8.4387 125.0067 58.6294 41.5785 174.6198 132 L 3.7844 8.5234 130.0500 55.5667 42.0763 178.0358 133 C 4.3523 8.5290 124.2780 56.4932 39.6517 172.4752 134 D 4.6777 7.4304 124.1161 50.2707 43.8134 175.7282 135 N 4.2903 8.4838 115.7476 56.4581 38.1615 177.2670 136 K 3.7675 7.9705 118.1184 59.5724 32.2155 178.3007 137 L 3.9810 7.9511 118.8676 58.5197 42.2953 178.1998 138 Y 4.6316 7.6052 116.5707 61.2232 37.7496 179.0980 139 N 4.2791 8.5014 114.4496 53.8905 38.3747 176.9402 *141 L 3.8092 7.8379 122.0237 54.7786 43.9128 179.1981 142 L 4.0366 7.9088 118.1191 57.8930 41.6471 179.3853 143 A 4.1123 7.9858 120.5869 55.1280 17.9732 179.9789 144 V 3.8498 7.0964 116.6568 65.6326 31.8068 177.9412 145 F 4.7814 8.0727 119.0348 59.3076 38.5496 176.6460 146 N 4.8054 8.6011 114.2307 53.7116 39.0787 176.5197 147 S 4.4266 7.8782 115.1640 58.8475 63.6060 173.5052 148 Y 4.2334 7.0155 124.6298 57.9889 39.1001 175.3186 149 D 3.9299 7.5260 125.7337 52.7924 42.3716 173.8617 150 P 4.0256 0.0000 0.0000 64.7007 31.4576 177.2782 151 N 4.5168 8.1606 114.2040 53.4645 38.9569 174.9029 152 D 4.2571 7.9573 116.9739 52.9475 42.6591 175.1558 153 L 4.5057 8.2125 126.6958 54.6695 42.3676 178.0663 154 L 3.9402 8.0059 121.2426 58.0106 42.0407 178.1718 155 K 3.8256 8.1548 118.9757 60.0267 31.9859 177.7424 156 H 4.7605 8.1802 118.8461 58.9461 29.7978 176.9095 157 I 3.7036 8.2442 121.9514 64.5500 37.0699 178.3936 158 S 4.1264 8.2925 114.1498 61.6154 62.2671 176.3186 159 T 3.9763 8.1032 112.5243 64.4876 68.5736 176.7936 160 V 3.5958 7.9284 121.3484 65.9651 31.4387 177.5402 161 E 3.9923 8.0810 118.6239 59.5013 29.2742 179.0125 162 S 4.1403 7.9691 114.9509 61.4275 62.7955 176.4180 163 L 4.0735 8.0071 123.2275 57.7499 41.8214 179.0809 164 K 3.6529 8.0989 118.6723 59.3947 31.8361 178.8052 165 K 4.0244 8.1253 118.5187 59.9375 32.2406 178.4276 166 I 3.8809 7.6202 119.6602 64.3168 37.1921 177.7344 167 F 4.0247 8.3539 121.6439 61.9562 38.9273 176.8368 168 Y 4.3675 7.9842 113.3227 60.0900 37.7403 177.1096 169 T 4.3438 7.5770 112.8897 61.7605 68.2394 174.7781 170 I 3.7939 6.9830 121.9975 61.6413 37.5566 175.4524 171 T 4.5707 8.1639 114.0792 60.0324 71.5271 173.6978 172 C 4.5188 8.5126 121.7367 58.2437 27.8811 172.8425 173 E 4.7667 8.3397 122.5627 54.0832 32.4305 175.5945 174 A 4.5957 8.0547 122.4983 50.0958 21.9705 176.0333 175 V 3.8953 8.0080 120.4157 62.2436 32.2141 175.8589 176 Y 4.2224 8.5919 123.9044 58.2940 37.8764 175.3372 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 47 E 8.44 4.34 0.00 2.07 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 2.28 2.46 0.00 48 V 7.49 3.66 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 0.79 0.00 0.00 0.97 0.00 0.00 49 N 8.41 5.82 0.00 2.71 2.84 0.00 0.00 6.42 7.75 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 50 P 0.00 4.96 0.00 2.28 1.64 0.00 4.07 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 2.03 2.06 0.00 51 D 8.42 4.90 0.00 2.83 2.82 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 52 I 6.99 4.08 1.91 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 1.34 0.87 0.93 0.00 0.00 53 I 8.23 4.25 1.83 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.40 0.88 0.00 0.00 54 K 7.78 4.44 0.00 1.90 1.93 0.00 1.54 0.00 0.00 1.65 0.00 0.00 3.04 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.34 1.49 7.81 55 D 7.70 4.23 0.00 2.69 2.71 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 56 E 5.95 3.88 0.00 1.66 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 0.00 0.00 0.00 2.22 2.24 0.00 57 V 7.59 4.36 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 0.79 0.00 0.00 0.88 0.00 0.00 58 F 8.31 4.74 0.00 2.95 2.87 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 0.00 0.00 0.00 0.00 59 D 8.03 4.68 0.00 2.40 2.49 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 60 F 7.58 4.72 0.00 3.15 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 61 V 8.69 3.69 2.13 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 0.91 0.00 0.00 1.04 0.00 0.00 62 I 7.77 3.57 2.32 0.00 0.00 1.17 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 1.29 0.90 0.00 0.00 63 V 7.50 3.44 2.36 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 0.94 0.00 0.00 0.48 0.00 0.00 64 N 7.94 4.48 0.00 2.71 2.84 0.00 0.00 6.91 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 65 R 7.99 4.10 0.00 0.82 1.56 0.00 3.25 0.00 0.00 3.20 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.48 0.00 66 V 7.27 4.19 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 1.01 0.00 0.00 0.82 0.00 0.00 67 L 8.33 3.90 0.00 1.82 1.59 0.84 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 68 K 8.20 4.13 0.00 1.88 1.87 0.00 1.86 0.00 0.00 1.76 0.00 0.00 3.15 0.00 0.00 3.29 0.00 0.00 0.00 0.00 1.51 1.54 7.81 69 K 7.77 4.30 0.00 1.87 1.85 0.00 1.89 0.00 0.00 1.69 0.00 0.00 2.97 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.42 1.38 7.81 70 I 7.20 4.13 1.82 0.00 0.00 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.67 1.00 0.00 0.00 71 K 8.99 4.07 0.00 1.84 1.93 0.00 1.76 0.00 0.00 1.68 0.00 0.00 3.04 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.49 1.50 7.81 72 D 7.81 4.84 0.00 2.83 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 73 L 7.91 4.04 0.00 1.75 1.66 0.79 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 74 K 8.10 3.97 0.00 1.84 1.82 0.00 1.73 0.00 0.00 1.73 0.00 0.00 2.86 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.51 1.42 7.81 75 H 7.91 3.95 0.00 2.91 2.74 0.00 5.92 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 Y 7.81 4.49 0.00 2.94 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 77 D 7.71 4.39 0.00 2.77 2.66 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 78 P 0.00 4.75 0.00 2.13 2.05 0.00 3.37 0.00 0.00 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.92 0.00 *80 I 8.16 4.08 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 1.26 0.84 0.84 0.00 0.00 81 E 8.95 5.12 0.00 1.80 1.77 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 2.75 2.20 0.00 82 K 9.52 4.93 0.00 1.52 1.78 0.00 1.73 0.00 0.00 1.84 0.00 0.00 3.11 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.58 1.54 7.81 83 I 7.70 4.12 1.82 0.00 0.00 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 0.96 0.43 0.55 0.00 0.00 84 F 6.67 3.85 0.00 3.10 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 *90 E 7.73 3.97 0.00 1.99 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 2.30 2.45 0.00 *92 G 8.15 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 93 L 8.39 5.01 0.00 0.84 0.82 0.98 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 94 N 8.82 5.23 0.00 2.74 2.55 0.00 0.00 6.27 7.16 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 95 V 8.85 4.61 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 0.94 0.00 0.00 0.81 0.00 0.00 96 E 8.51 5.05 0.00 1.94 1.65 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 2.24 2.29 0.00 97 I 8.84 4.60 1.98 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.66 0.69 0.00 0.00 98 Q 8.78 4.63 0.00 2.10 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.68 7.01 0.00 0.00 0.00 0.00 0.00 2.38 2.50 0.00 99 I 8.88 3.97 1.74 0.00 0.00 -0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.32 0.89 0.00 0.00 100 N 8.13 5.04 0.00 3.01 2.80 0.00 0.00 7.24 7.71 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 0.00 101 P 0.00 4.33 0.00 1.93 2.02 0.00 3.77 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 1.54 2.00 0.00 102 E 8.16 4.03 0.00 1.94 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 2.34 2.28 0.00 103 V 7.92 4.18 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 0.90 0.00 0.00 0.74 0.00 0.00 104 K 8.53 3.99 0.00 1.77 1.77 0.00 1.95 0.00 0.00 1.72 0.00 0.00 2.82 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.45 1.51 7.81 105 D 8.96 4.59 0.00 2.93 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 0.00 106 F 8.39 4.17 0.00 3.26 3.15 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.18 5.61 0.00 3.12 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 0.00 108 T 9.53 5.11 4.39 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 1.30 0.00 0.00 109 F 8.84 5.43 0.00 3.07 2.98 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 0.00 110 K 8.78 4.80 0.00 1.59 1.48 0.00 1.46 0.00 0.00 1.65 0.00 0.00 2.74 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.23 1.27 7.81 111 S 8.81 4.86 0.00 3.46 3.50 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 0.00 112 I 9.33 4.77 1.93 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.90 0.86 0.00 0.00 113 S 9.43 5.26 0.00 2.94 3.37 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 0.00 114 T 8.32 4.43 4.27 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 1.17 0.00 0.00 115 T 7.57 3.27 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 1.26 0.00 0.00 116 N 8.16 5.04 0.00 2.72 2.82 0.00 0.00 6.55 7.61 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 0.00 117 K 8.60 4.71 0.00 1.66 1.60 0.00 1.60 0.00 0.00 1.58 0.00 0.00 2.85 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.33 1.49 7.81 118 Q 8.45 5.07 0.00 2.08 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.67 6.46 0.00 0.00 0.00 0.00 0.00 2.26 2.38 0.00 119 R 9.19 4.60 0.00 1.82 1.58 0.00 3.15 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 1.47 1.57 0.00 120 C 8.34 5.30 0.00 3.00 3.15 0.00 0.00 0.00 0.00 0.00 0.00 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 F 9.28 5.49 0.00 2.80 2.96 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 0.00 122 L 9.01 5.33 0.00 1.94 1.97 1.09 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 123 S 9.43 5.33 0.00 3.85 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 0.00 124 L 8.45 4.31 0.00 0.31 0.13 0.06 -0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 125 R 9.43 3.46 0.00 1.67 1.80 0.00 3.20 0.00 0.00 3.22 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.73 0.00 126 G 8.30 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 0.00 127 E 8.16 4.49 0.00 2.13 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.37 0.00 128 T 8.51 5.21 4.25 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 1.18 0.00 0.00 129 R 9.48 4.77 0.00 1.55 1.66 0.00 2.21 0.00 0.00 2.56 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.36 0.00 130 E 8.91 4.27 0.00 1.95 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 2.02 1.74 0.00 131 I 8.44 4.60 1.87 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 1.06 1.02 0.99 0.00 0.00 132 L 8.52 3.78 0.00 1.54 1.50 0.85 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 133 C 8.53 4.35 0.00 2.98 3.06 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 0.00 134 D 7.43 4.68 0.00 2.71 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 0.00 135 N 8.48 4.29 0.00 2.73 2.94 0.00 0.00 6.79 7.68 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 0.00 136 K 7.97 3.77 0.00 2.00 1.84 0.00 1.86 0.00 0.00 1.59 0.00 0.00 2.97 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.48 7.81 137 L 7.95 3.98 0.00 1.58 1.45 0.86 0.91 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 0.00 138 Y 7.61 4.63 0.00 3.15 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 0.00 139 N 8.50 4.28 0.00 2.85 2.83 0.00 0.00 7.01 6.67 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 *141 L 7.84 3.81 0.00 1.62 1.55 0.22 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 142 L 7.91 4.04 0.00 1.85 1.74 0.94 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 143 A 7.99 4.11 1.31 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 0.00 0.00 0.00 144 V 7.10 3.85 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 0.82 0.00 0.00 0.79 0.00 0.00 145 F 8.07 4.78 0.00 2.96 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 0.00 146 N 8.60 4.81 0.00 2.89 2.93 0.00 0.00 7.05 7.61 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 0.00 147 S 7.88 4.43 0.00 4.22 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 0.00 148 Y 7.02 4.23 0.00 2.78 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 0.00 149 D 7.53 3.93 0.00 2.54 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 0.00 150 P 0.00 4.03 0.00 1.96 2.00 0.00 3.41 0.00 0.00 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.84 0.00 151 N 8.16 4.52 0.00 2.77 2.80 0.00 0.00 6.71 8.91 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 0.00 152 D 7.96 4.26 0.00 2.54 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 0.00 153 L 8.21 4.51 0.00 1.75 1.75 0.97 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 154 L 8.01 3.94 0.00 1.76 1.68 0.93 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 155 K 8.15 3.83 0.00 1.92 1.84 0.00 1.69 0.00 0.00 1.76 0.00 0.00 3.02 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.54 1.62 7.81 156 H 8.18 4.76 0.00 3.57 3.62 0.00 5.97 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 0.00 157 I 8.24 3.70 2.03 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.42 0.94 0.00 0.00 158 S 8.29 4.13 0.00 3.91 4.01 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 0.00 159 T 8.10 3.98 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 1.27 0.00 0.00 160 V 7.93 3.60 2.27 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 1.16 0.00 0.00 0.86 0.00 0.00 161 E 8.08 3.99 0.00 2.12 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 0.00 2.33 2.44 0.00 162 S 7.97 4.14 0.00 4.17 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 0.00 163 L 8.01 4.07 0.00 1.78 2.04 0.88 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 164 K 8.10 3.65 0.00 2.01 1.77 0.00 1.26 0.00 0.00 0.61 0.00 0.00 2.35 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.62 1.53 7.81 165 K 8.13 4.02 0.00 1.81 2.15 0.00 1.85 0.00 0.00 1.74 0.00 0.00 3.05 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.52 1.59 7.81 166 I 7.62 3.88 2.14 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 0.49 0.95 0.00 0.00 167 F 8.35 4.02 0.00 3.09 2.98 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 0.00 168 Y 7.98 4.37 0.00 3.12 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 0.00 169 T 7.58 4.34 4.66 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 1.30 0.00 0.00 170 I 6.98 3.79 1.75 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 1.30 0.78 0.84 0.00 0.00 171 T 8.16 4.57 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 1.24 0.00 0.00 172 C 8.51 4.52 0.00 2.95 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 0.00 173 E 8.34 4.77 0.00 1.90 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 0.00 2.23 2.27 0.00 174 A 8.05 4.60 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175 V 8.01 3.90 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 0.84 0.00 0.00 0.90 0.00 0.00 176 Y 8.59 4.22 0.00 3.01 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 * Residues marked with a * may have inaccurate shift predictions.