A0A087Y5Q3_POEFO Loading...

Cohesin subunit SA

Component of cohesin complex, a complex required for the cohesion of sister chromatids after DNA replication. The cohesin complex apparently forms a large proteinaceous ring within which sister chromatids can be trapped. At anaphase, the complex is cleaved and dissociates from chromatin, allowing sister chromatids to segregate.

AlphaFold DB (A0A3B3U1F0), UniProt , Accession A0A087Y5Q3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,260 aa.

						>A0A087Y5Q3_POEFO|A0A087Y5Q3
MITSELPVLQDSSNESGATDTVSLSMNMTEMEDPEIKGKKKRGRPGKQTQTSNKKPRKSPTDKTLSMTRGRGKANGVAQQNGNGGEPVTLFEVVKLGKSAMQSVVDEWIEAYKQDRDLALLDLINFFIQCSGCKGTVRIEMFRNMQNAEIIRKMTEEFDEDSGDYPLTMPGPMWKKFRYNFCEFIGVLIRQCQYSIIYDEYMMDTVISLLTGLSDSQVRAFRHTSTLAAMKLMTALVNVALNLSIHQDNTQRQYEAERNKIAGKRANEKLELLLQKRKELQENQDEIENMMNSIFKGIFVHRYRDAIAEIRAICIEEIGVWMKMYSDAFLNDSYLKYVGWTLHDRQGEVRLKCLKALQNLYTNRELFPKLELFTNRFKDRIVSMTLDKEYDVAVEAIRLVTLILQGSEDALSNEDCENVYHLVYSAHRPVAVAAGEFLHRKLFSRHDPQAEEALAKRRGRSSPNGNLIRMLVLFFLESELHEHAAYLVDSLWESSQELLKDWECMTELLLEEPVQGEEMLSDRQESALIELTVCTIRQAAEAHPPVGRGTGKRVLTAKERKTQIDDKNKLTEHFIMALPMLLSKYQADAEKVANLLQIPQFFDLDVYSAGRMEKHLDALLKQIRLVVEKHIETDVLEACSKTYSILCSEEYTIMNRVDIARSQLIDEMTDRFAHSVEELLQEGEEADDDDIYNVLSTLKRLTAFHNAHDLTRWDLFGNCYRLLKAGIEQGSMPEQIAVQALQCSHYSILWQLVKITEGVPSKDDLLALRRVVKSFLAVCQQCLSNVNTPVKEQAFMLLCDLLMIFSHQLITGGREGLQPLVFNPDGTLQNELLNFVLDHVFIDQDDENQSMEGDEEDEANKIEALHKRRNLLAAFCKLIIYDIVDMPAAADIFKHYMKYYNDYGDIIKETLSKTRQTDKILCAKTLILSLQQLFNELLQDQGPNLDRTSSHVSGIKELARRFALTFGLDQIKTREAVATLHKDGIEFAFKYQNARGSEFPPINLAFLEVLSEFSSKLIRQDKKTVHSYLEKFMSESMSERREDVWLPLISYRNSLLTGGDEDHMSVTSGSSSKTGSVRSKKGRPPLHKKRIEEESSVEGSWMMRNDTLQTPSALQTPQLTSTVLRENRPAEHMPDPDSEPGSENDYVHNPQIQMSWLGQQKMEEVNRKDRTSMNYIKSRSNQGVRQTVRGLMEDDAEPIFEDVMMSSRGQLEDMNEEFEDTMVIDLPPSRNRRERAELRPDFFDSAAMIEDESGFSMPMF
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32.6	Very low	31.3	Very low	242 Å²	242	154.4 Å²	154.4	100%	1.192	84%	0.836	S	S	*	*				0	116.1	0	-85.5	-176.8	169.8	0	0	109.3
2	I	28.3	Very low	31.1	Very low	175 Å²	175	151.5 Å²	151.5	90%	0.897	84%	0.836	S	S	*	*			trans	-175.3	136.5	139.4	-97.2	156.9	0	0	0	105.1
3	T	28.7	Very low	30.9	Very low	133 Å²	133	147.8 Å²	147.8	82%	0.816	83%	0.828	S	S	*	*			trans	-118.9	147.2	-168.2	46.5	0	0	0	0	111.8
4	S	28.7	Very low	30.7	Very low	123 Å²	123	148 Å²	148	86%	0.86	83%	0.826	S	S	*	*			trans	-151.2	89.6	161.5	60.3	0	0	0	0	110.7
5	E	30.7	Very low	30.6	Very low	171 Å²	171	149.8 Å²	149.8	80%	0.799	83%	0.825	S	S	*	*			trans	-83.9	150	166.9	-59	174.9	124.5	0	0	110.4
6	L	30.1	Very low	30.5	Very low	161 Å²	161	147.8 Å²	147.8	84%	0.843	83%	0.825	S	S	*	*				163.7	158.3	111.3	-82	177.4	0	0	0	112.2
7	P	52.7	Low	30.3	Very low	109 Å²	109	143.2 Å²	143.2	71%	0.708	82%	0.819	S	S	*	*			trans	-122.2	-130.6	-160.9	42.7	-26.8	0	0	0	113.4
8	V	28.8	Very low	30.3	Very low	125 Å²	125	140.4 Å²	140.4	76%	0.758	82%	0.816	S	S	*	*			trans	83.2	127.4	174.3	179.6	0	0	0	0	113.7
9	L	27.8	Very low	30.2	Very low	137 Å²	137	139.2 Å²	139.2	72%	0.717	81%	0.811	S	S	*	*			cis	-150.7	-177	-2.4	-107.8	168	0	0	0	107.2
10	Q	28.2	Very low	30.2	Very low	176 Å²	176	139.1 Å²	139.1	82%	0.822	81%	0.807	S	S	*	*			cis	-165.2	151.5	34.1	-158.9	165	14.6	0	0	113.1
11	D	28.3	Very low	30	Very low	146 Å²	146	138 Å²	138	78%	0.781	80%	0.803	S	S	*	*			trans	-79.2	155	176.1	-55.9	-82.4	0	0	0	115.4
12	S	28.3	Very low	29.8	Very low	120 Å²	120	132.5 Å²	132.5	84%	0.839	78%	0.782	S	S	*	*			trans	-162.1	128.2	130.2	65	0	0	0	0	112.4
13	S	29.2	Very low	29.6	Very low	104 Å²	104	128.2 Å²	128.2	73%	0.727	77%	0.768	S	S	*	*			trans	-85.2	159.6	178.7	57.6	0	0	0	0	114.1
14	N	27.9	Very low	29.6	Very low	150 Å²	150	129.4 Å²	129.4	80%	0.802	77%	0.768	S	S	*	*				-170.8	157.7	114.4	-100.8	13	0	0	0	114.8
15	E	29	Very low	29.4	Very low	175 Å²	175	127.5 Å²	127.5	82%	0.818	76%	0.755	S	S	*	*			trans	-79.1	165.5	-177.3	-53	160.1	115.1	0	0	111.4
16	S	29.1	Very low	29.2	Very low	117 Å²	117	127.6 Å²	127.6	82%	0.818	76%	0.758	S	S	*	*				173.3	158.8	58.8	41	0	0	0	0	112.4
17	G	27	Very low	29	Very low	70 Å²	70	125.9 Å²	125.9	72%	0.722	75%	0.749	S	S	*	*			trans	84.1	119.7	171	0	0	0	0	0	114.3
18	A	29.4	Very low	27.7	Very low	94 Å²	94	127.5 Å²	127.5	78%	0.777	75%	0.749	S	S	*	*			cis	63.9	129.4	29.6	0	0	0	0	0	113.6
19	T	29.1	Very low	27.6	Very low	116 Å²	116	126.8 Å²	126.8	71%	0.712	75%	0.745	S	S	*	*			cis	-163	156.3	0.6	3.7	0	0	0	0	109.7
20	D	30.1	Very low	27.6	Very low	138 Å²	138	127.4 Å²	127.4	74%	0.738	75%	0.745	S	S	*	*			trans	57.9	152.5	146.2	-58.9	-20.3	0	0	0	120.2
21	T	26.8	Very low	27.4	Very low	116 Å²	116	125.7 Å²	125.7	71%	0.712	74%	0.738	S	S	*	*			cis	-158.2	151.9	13.4	0.8	0	0	0	0	110.8
22	V	27.4	Very low	27.3	Very low	126 Å²	126	127.6 Å²	127.6	76%	0.764	74%	0.742	S	S	*	*				27.3	134.3	120.9	176.3	0	0	0	0	117.6
23	S	25	Very low	27.4	Very low	85 Å²	85	129 Å²	129	59%	0.594	74%	0.741	S	S	*	*			cis	-178.8	-169.7	-4.8	56.7	0	0	0	0	110.2
24	L	27.3	Very low	28.1	Very low	158 Å²	158	129.1 Å²	129.1	83%	0.827	74%	0.739	S	S	*	*			trans	70.2	153.3	161.4	-63.2	160.3	0	0	0	117.2
25	S	24.9	Very low	28.2	Very low	84 Å²	84	129.4 Å²	129.4	59%	0.587	74%	0.735	S	S	*	*			cis	-177.8	162.8	-24.5	56.5	0	0	0	0	110.4
26	M	26.9	Very low	28.2	Very low	173 Å²	173	125.8 Å²	125.8	85%	0.852	72%	0.721	S	S	*	*			trans	66.9	158.8	154	-76.9	-172.4	170.9	0	0	118.3
27	N	26.4	Very low	28.2	Very low	124 Å²	124	129.4 Å²	129.4	66%	0.663	72%	0.722	S	S	*	*			cis	-166.7	-178.7	-38.4	-136.8	8.1	0	0	0	108.5
28	M	26	Very low	28.1	Very low	143 Å²	143	129.7 Å²	129.7	70%	0.704	72%	0.724	S	S	*	*			trans	71.1	119.6	166.6	-60.1	-31	-164.1	0	0	115.5
29	T	26.3	Very low	28.1	Very low	110 Å²	110	134.7 Å²	134.7	68%	0.675	73%	0.729	S	S	*	*				64.8	148.2	77.9	74.4	0	0	0	0	113.4
30	E	27.1	Very low	28.3	Very low	151 Å²	151	138.4 Å²	138.4	71%	0.706	74%	0.735	S	S	*	*			cis	-159.1	163	21.6	-148.8	155.6	-125.3	0	0	114.1
31	M	24.7	Very low	28.3	Very low	140 Å²	140	140.7 Å²	140.7	69%	0.69	74%	0.738	S	S	*	*			trans	26.2	142.8	152.9	-77.6	-173.7	-76.6	0	0	126.2
32	E	24.9	Very low	28.4	Very low	185 Å²	185	147 Å²	147	86%	0.864	75%	0.749	S	S	*	*			trans	92.5	149.9	135.4	-81.3	-178.5	166.7	0	0	124.6
33	D	30.7	Very low	28.3	Very low	150 Å²	150	145 Å²	145	80%	0.802	75%	0.753	S	S	*	*			trans	-90.5	-161.5	-176.8	-136.7	-9.4	0	0	0	109.3
34	P	45	Very low	28.4	Very low	107 Å²	107	151.9 Å²	151.9	70%	0.695	77%	0.766	S	S	*	*			cis	-139.4	169.1	8.7	44.6	-25.3	0	0	0	118.5
35	E	28.6	Very low	28.9	Very low	155 Å²	155	150.5 Å²	150.5	72%	0.724	77%	0.767	S	S	*	*			trans	38.4	124.3	136.7	-70.6	-137.1	120.5	0	0	124.5
36	I	29.7	Very low	29	Very low	100 Å²	100	149.5 Å²	149.5	51%	0.513	77%	0.77	S	S	.	*				98	129	119.1	-81.4	-170.6	0	0	0	125.7
37	K	29.1	Very low	29.2	Very low	193 Å²	193	150.7 Å²	150.7	84%	0.839	77%	0.771	S	S	*	*			trans	64.7	141.3	152.3	-75.1	158.7	-150	136	0	122.1
38	G	25.2	Very low	29.1	Very low	75 Å²	75	152.8 Å²	152.8	77%	0.773	78%	0.776	S	S	*	*			trans	-156	-81.1	173.2	0	0	0	0	0	120.4
39	K	29.8	Very low	29.1	Very low	199 Å²	199	153 Å²	153	87%	0.865	79%	0.786	S	S	*	*			trans	51.7	125.6	178.7	-67.7	-178.2	178.1	174.3	0	120.4
40	K	31.3	Very low	29.1	Very low	194 Å²	194	156.7 Å²	156.7	84%	0.843	80%	0.795	S	S	*	*			trans	146.4	158.1	138.1	-81.2	157.3	-172.2	161.7	0	111.4
41	K	31.7	Very low	29.1	Very low	186 Å²	186	156 Å²	156	81%	0.809	80%	0.801	S	S	*	*			cis	-160.7	176.6	6.2	-135.3	175	-180	-178.8	0	112.4
42	R	27.6	Very low	29.3	Very low	249 Å²	249	154.9 Å²	154.9	94%	0.94	81%	0.808	S	S	*	*			trans	82.2	143.1	173.1	-61.5	176.9	161.4	170.9	-5.8	114.8
43	G	25.4	Very low	29.5	Very low	83 Å²	83	153.4 Å²	153.4	86%	0.856	81%	0.806	S	S	*	*			cis	-159	177.8	-2	0	0	0	0	0	113.1
44	R	28.2	Very low	29.3	Very low	230 Å²	230	156.4 Å²	156.4	87%	0.868	81%	0.812	S	S	*	*			trans	-139	153.8	-175.5	-142.5	-164.2	-177.2	178.4	3.8	110.2
45	P	36.5	Very low	28.4	Very low	130 Å²	130	160.8 Å²	160.8	84%	0.844	82%	0.82	S	S	*	*				-126.8	-179.6	79.2	9.5	14.1	0	0	0	111.8
46	G	28.3	Very low	29	Very low	63 Å²	63	158.9 Å²	158.9	65%	0.649	82%	0.821	S	S	*	*			cis	128.5	140.2	13.2	0	0	0	0	0	109
47	K	29.9	Very low	28.9	Very low	198 Å²	198	164.5 Å²	164.5	86%	0.861	84%	0.836	S	S	*	*			cis	-151.8	-174	4	-154.5	178.1	178.4	-175.8	0	109.8
48	Q	25.4	Very low	28.8	Very low	168 Å²	168	164.3 Å²	164.3	79%	0.785	84%	0.835	S	S	*	*			trans	-94.6	162.5	-164.7	-51.2	135.4	-78.6	0	0	116.1
49	T	24.8	Very low	28.9	Very low	146 Å²	146	165.5 Å²	165.5	90%	0.896	83%	0.831	S	S	*	*			trans	-149.9	157.2	136.4	19.5	0	0	0	0	111
50	Q	28	Very low	29.2	Very low	188 Å²	188	162.1 Å²	162.1	88%	0.879	83%	0.83	S	S	*	*			trans	-133.3	146.9	170.8	-80.5	-175.3	-21.2	0	0	109.2
51	T	26.3	Very low	29	Very low	136 Å²	136	159 Å²	159	83%	0.834	83%	0.827	S	S	*	*			trans	-170.4	140.1	149.5	4.9	0	0	0	0	115.1
52	S	28.4	Very low	28.9	Very low	118 Å²	118	157.3 Å²	157.3	83%	0.825	83%	0.827	S	S	*	*			trans	77.9	151.8	146.8	77.7	0	0	0	0	122
53	N	29	Very low	29.1	Very low	154 Å²	154	154 Å²	154	82%	0.824	82%	0.819	S	S	*	*			trans	-103.5	146.7	-179.7	-77.7	-47.2	0	0	0	111.9
54	K	27.2	Very low	29.2	Very low	212 Å²	212	156 Å²	156	92%	0.922	82%	0.815	S	S	*	*				171.6	157.4	125.6	-92.8	161.2	-176.3	-179.9	0	114.4
55	K	26.2	Very low	29.2	Very low	199 Å²	199	152.4 Å²	152.4	87%	0.865	81%	0.812	S	S	*	*			trans	-87	-172.9	171.1	-66.7	179.8	174.4	177.5	0	111
56	P	41.6	Very low	28.6	Very low	115 Å²	115	150.1 Å²	150.1	75%	0.747	80%	0.799	S	S	*	*			cis	-136.6	175.3	-26.2	25	-2.2	0	0	0	115.8
57	R	26.1	Very low	28.6	Very low	219 Å²	219	155.1 Å²	155.1	83%	0.826	81%	0.808	S	S	*	*				142	141	127.6	-85.8	-173	162.9	179.3	-2.7	116.3
58	K	28.2	Very low	28.7	Very low	188 Å²	188	151.9 Å²	151.9	82%	0.817	81%	0.805	S	S	*	*			trans	38.5	148.9	140.5	-65.7	-168.3	174.3	-166.4	0	120.5
59	S	27.9	Very low	28.8	Very low	101 Å²	101	155.9 Å²	155.9	71%	0.706	81%	0.813	S	S	*	*			cis	-165.5	175.8	-1.3	38.9	0	0	0	0	108.8
60	P	34.6	Very low	28.8	Very low	127 Å²	127	152.1 Å²	152.1	83%	0.825	80%	0.803	S	S	*	*				-149.1	-173.9	103.1	39.9	-23.1	0	0	0	114.7
61	T	28.7	Very low	28.9	Very low	129 Å²	129	155.7 Å²	155.7	79%	0.791	81%	0.809	S	S	*	*			trans	-139.8	143	177.9	48.3	0	0	0	0	110.5
62	D	28.8	Very low	28.8	Very low	150 Å²	150	153.1 Å²	153.1	80%	0.802	81%	0.809	S	S	*	*				-165.9	179.5	115.1	-131.8	-44.5	0	0	0	113
63	K	32.1	Very low	29	Very low	181 Å²	181	157.8 Å²	157.8	79%	0.787	81%	0.814	S	S	*	*			trans	-98.4	174.1	-175.4	-48.8	171.3	-173	169.2	0	111
64	T	27.6	Very low	29	Very low	125 Å²	125	154.8 Å²	154.8	77%	0.767	81%	0.811	S	S	*	*			cis	-151.6	-161.7	16.8	-18.7	0	0	0	0	107
65	L	27.3	Very low	29.1	Very low	153 Å²	153	152.4 Å²	152.4	80%	0.801	81%	0.808	S	S	*	*			cis	-159.9	157.4	8.1	-134.6	164	0	0	0	109.5
66	S	25.1	Very low	29.2	Very low	82 Å²	82	146.7 Å²	146.7	57%	0.573	81%	0.806	S	S	*	*			trans	41.5	110.1	152.5	-176.8	0	0	0	0	122.8
67	M	28	Very low	28.6	Very low	168 Å²	168	148 Å²	148	83%	0.828	81%	0.811	S	S	*	*			trans	54.1	142.4	133.5	-54.3	-157.8	-72.2	0	0	120.7
68	T	32.5	Very low	29.3	Very low	131 Å²	131	142.6 Å²	142.6	80%	0.804	81%	0.813	S	S	*	*			cis	-147.6	140.6	7.2	-29.2	0	0	0	0	110.1
69	R	26.3	Very low	29.3	Very low	251 Å²	251	142 Å²	142	95%	0.947	81%	0.814	S	S	*	*			trans	-162.8	153.5	163.2	-118.3	176.1	-173.3	-176.6	2.1	112.1
70	G	24.8	Very low	29.9	Very low	67 Å²	67	146.4 Å²	146.4	69%	0.691	82%	0.823	S	S	*	*			trans	-104.8	-175.7	172.3	0	0	0	0	0	113.5
71	R	29.5	Very low	29.6	Very low	264 Å²	264	147.8 Å²	147.8	100%	0.996	82%	0.823	S	S	*	*			trans	64.2	112.2	-178	-77.6	-177.3	166.1	174.7	-4.1	116.4
72	G	24.9	Very low	30	Very low	81 Å²	81	145.6 Å²	145.6	84%	0.835	83%	0.827	S	S	*	*			trans	174.4	122.8	164.5	0	0	0	0	0	111.1
73	K	32.6	Very low	30.1	Very low	216 Å²	216	146.5 Å²	146.5	94%	0.939	83%	0.831	S	S	*	*			trans	-82.9	140.9	178.8	-70.7	-178.6	174.1	-174.8	0	111.3
74	A	29.5	Very low	30.2	Very low	92 Å²	92	142 Å²	142	76%	0.76	84%	0.837	S	S	*	*				-174.9	139.7	126.5	0	0	0	0	0	112.2
75	N	29.9	Very low	30.5	Very low	162 Å²	162	139.3 Å²	139.3	87%	0.866	83%	0.834	S	S	*	*			trans	35.1	109.5	159.2	-61.2	18.5	0	0	0	119.5
76	G	26.9	Very low	31.4	Very low	79 Å²	79	140.7 Å²	140.7	81%	0.814	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-79.7	151.4	157.8	0	0	0	0	0	112.3
77	V	29.6	Very low	33.3	Very low	142 Å²	142	142.2 Å²	142.2	86%	0.861	84%	0.844	S	S	*	*	P	Polyproline II helix	trans	-99	144.7	152	173.5	0	0	0	0	106.3	Q79	V77-Q79 PolarHBondContact O-N 2.8Å
78	A	40.9	Very low	35.7	Very low	105 Å²	105	139 Å²	139	87%	0.868	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-56	128.7	-174.2	0	0	0	0	0	112.4
79	Q	27.4	Very low	38.5	Very low	177 Å²	177	134.9 Å²	134.9	83%	0.827	81%	0.808	S	S	*	*			trans	-127.9	112	167.3	-166.7	168.6	23.8	0	0	108.1	V77 N81	V77-Q79 PolarHBondContact O-N 2.8Å; Q79-N81 PolarHBondContact O-N 2.95Å
80	Q	41	Very low	41.6	Very low	193 Å²	193	124.3 Å²	124.3	90%	0.902	77%	0.771	S	S	*	*			trans	-63.3	128	174.6	-71.2	174.7	-30	0	0	109.7
81	N	28.6	Very low	45	Very low	155 Å²	155	122.5 Å²	122.5	83%	0.829	74%	0.744	S	S	*	*			trans	-148.5	128.3	151.5	-95.9	-36.1	0	0	0	106.8	Q79	Q79-N81 PolarHBondContact O-N 2.95Å
82	G	36	Very low	48	Very low	84 Å²	84	114.1 Å²	114.1	87%	0.866	72%	0.716	S	S	*	*			trans	-81.1	130.5	-167.5	0	0	0	0	0	113.2
83	N	31.7	Very low	51.3	Low	168 Å²	168	112.3 Å²	112.3	90%	0.898	69%	0.689	S	S	*	*			trans	-145.5	136	139.2	-147.6	24.9	0	0	0	108	G85	N83-G85 PolarHBondContact O-N 2.94Å
84	G	34.5	Very low	54.3	Low	88 Å²	88	102.1 Å²	102.1	91%	0.907	64%	0.644	S	S	*	*			trans	-79.4	82.3	-169	0	0	0	0	0	113.4
85	G	34	Very low	57.3	Low	68 Å²	68	100.3 Å²	100.3	70%	0.701	62%	0.62	S	S	*	*	P	Polyproline II helix	trans	-94.9	144.1	159.3	0	0	0	0	0	110.3	N83	N83-G85 PolarHBondContact O-N 2.94Å
86	E	45.8	Very low	60.2	Low	181 Å²	181	96.5 Å²	96.5	85%	0.846	60%	0.599	S	S	*	*	P	Polyproline II helix	trans	-66.9	152.8	173.4	-66.5	-175.7	141.7	0	0	111	V88	E86-V88 PolarHBondContact O-N 3.46Å
87	P	64.1	Low	63	Low	114 Å²	114	93.7 Å²	93.7	74%	0.74	57%	0.569	S	S	*	*	P	Polyproline II helix	trans	-66.2	119.2	177.2	27.4	-33.7	0	0	0	110.3	T89	P87-T89 PolarHBondContact O-N 3.44Å
88	V	80.3	Confident	65.8	Low	100 Å²	100	95.2 Å²	95.2	61%	0.606	56%	0.564	S	S	*	*	P	Polyproline II helix	trans	-54	119.9	-178.2	-178.6	0	0	0	0	110.4	E86 E92 V93	E86-V88 PolarHBondContact O-N 3.46Å; V88-E92 WeakPolarHBondContact CA-OE2 3.4Å; V88-E92 HydrophobicContact CG1-CB 4Å; V88-V93 HydrophobicContact CG1-CG2 3.99Å
89	T	89.4	Confident	67.9	Low	45 Å²	45	93.6 Å²	93.6	28%	0.276	55%	0.547	S	S	.	.	P	Polyproline II helix	trans	-81.7	158.8	-171.9	89.7	0	0	0	0	112.2	P87 F91 E92 V93 Q129	P87-T89 PolarHBondContact O-N 3.44Å; T89-F91 PolarHBondContact O-N 3.41Å; T89-F91 PolarHBondContact OG1-N 2.96Å; T89-E92 PolarHBondContact N-OE2 3.42Å; T89-E92 WeakPolarHBondContact O-CB 3.46Å; T89-E92 PolarHBondContact O-N 3.16Å; T89-E92 PolarHBondContact OG1-N 3.43Å; T89-V93 PolarHBondContact O-N 3.15Å; T89-V93 VanDerWaalsContact O-N 3.07Å; T89-Q129 PolarHBondContact OG1-OE1 3.04Å
90	L	92.8	Very high	70.9	Confident	29 Å²	29	88.4 Å²	88.4	15%	0.152	53%	0.534	C	S	.	.	H	α-helix	trans	-57.3	-32.2	175.2	-177.6	57	0	0	0	112.1	V93 V94 V104 F126 F184	L90-V93 PolarHBondContact O-N 3.42Å; L90-V94 HydrophobicContact CD1-CG2 4.31Å; L90-V94 WeakPolarHBondContact O-CG2 3.4Å; L90-V94 PolarHBondContact O-N 3.16Å; L90-V94 VanDerWaalsContact O-N 3.07Å; L90-V104 HydrophobicContact CD1-CG1 3.51Å; L90-F126 HydrophobicContact CB-CB 4.3Å; L90-F126 HydrophobicContact CB-CD2 4.1Å; L90-F126 HydrophobicContact CD2-CB 3.9Å; L90-F126 HydrophobicContact CD2-CD2 4.11Å; L90-F126 HydrophobicContact CD2-CG 3.93Å; L90-F126 HydrophobicContact CG-CB 4.21Å; L90-F126 HydrophobicContact CG-CD2 3.67Å; L90-F126 HydrophobicContact CG-CE2 4.2Å; L90-F126 HydrophobicContact CG-CG 4.02Å; L90-F184 HydrophobicContact CD1-CE2 4.07Å; L90-F184 HydrophobicContact CD1-CZ 4.28Å; L90-F184 HydrophobicContact CD2-CE1 4.33Å; L90-F184 HydrophobicContact CD2-CE2 4.43Å; L90-F184 HydrophobicContact CD2-CZ 3.81Å; L90-F184 HydrophobicContact CG-CZ 4.45Å
91	F	94.9	Very high	73.4	Confident	29 Å²	29	79.7 Å²	79.7	13%	0.127	49%	0.494	C	S	.	.	H	α-helix	trans	-64.1	-44.6	173.5	165.4	-112.6	0	0	0	111.7	T89 V93 V94 K95 F126 Q129 C130 P166 W174 F177	T89-F91 PolarHBondContact O-N 3.41Å; T89-F91 PolarHBondContact OG1-N 2.96Å; F91-V93 PolarHBondContact O-N 3.17Å; F91-V94 PolarHBondContact O-N 3.24Å; F91-K95 HydrophobicContact CE1-CD 4.21Å; F91-K95 HydrophobicContact CE2-CD 4.45Å; F91-K95 HydrophobicContact CZ-CD 3.94Å; F91-K95 WeakPolarHBondContact O-CB 3.43Å; F91-K95 PolarHBondContact O-N 3.08Å; F91-F126 HydrophobicContact CB-CD2 4.27Å; F91-Q129 HydrophobicContact CB-CB 3.82Å; F91-Q129 HydrophobicContact CD1-CB 4.07Å; F91-Q129 HydrophobicContact CG-CB 3.89Å; F91-C130 HydrophobicContact CD2-CB 4.49Å; F91-P166 HydrophobicContact CE2-CG 4.17Å; F91-P166 HydrophobicContact CZ-CG 4.12Å; F91-W174 HydrophobicContact CZ-CZ3 4.35Å; F91-F177 AromaticContact CD2-CE2 3.84Å; F91-F177 HydrophobicContact CD2-CE2 3.84Å; F91-F177 HydrophobicContact CD2-CZ 4.24Å; F91-F177 HydrophobicContact CE2-CD2 4.37Å; F91-F177 AromaticContact CE2-CE2 3.71Å; F91-F177 HydrophobicContact CE2-CE2 3.71Å; F91-F177 AromaticContact CE2-CZ 3.88Å; F91-F177 HydrophobicContact CE2-CZ 3.88Å
92	E	93.5	Very high	76.5	Confident	88 Å²	88	76.9 Å²	76.9	41%	0.411	48%	0.475	S	S	.	.	H	α-helix	trans	-64.2	-41.2	177.2	-62.2	-169.8	109.6	0	0	112.5	V88 T89 K95 L96	V88-E92 WeakPolarHBondContact CA-OE2 3.4Å; V88-E92 HydrophobicContact CG1-CB 4Å; T89-E92 PolarHBondContact N-OE2 3.42Å; T89-E92 WeakPolarHBondContact O-CB 3.46Å; T89-E92 PolarHBondContact O-N 3.16Å; T89-E92 PolarHBondContact OG1-N 3.43Å; E92-K95 PolarHBondContact O-N 3.36Å; E92-L96 WeakPolarHBondContact O-CB 3.38Å; E92-L96 VanDerWaalsContact O-CG 3.27Å; E92-L96 WeakPolarHBondContact O-CG 3.27Å; E92-L96 PolarHBondContact O-N 3.42Å
93	V	94.4	Very high	79.4	Confident	44 Å²	44	75.3 Å²	75.3	27%	0.267	45%	0.451	S	S	.	.	H	α-helix	trans	-59.6	-48.3	176.7	176.4	0	0	0	0	110.8	V88 T89 L90 F91 G97 V104	V88-V93 HydrophobicContact CG1-CG2 3.99Å; T89-V93 PolarHBondContact O-N 3.15Å; T89-V93 VanDerWaalsContact O-N 3.07Å; L90-V93 PolarHBondContact O-N 3.42Å; F91-V93 PolarHBondContact O-N 3.17Å; V93-G97 PolarHBondContact O-N 2.9Å; V93-V104 HydrophobicContact CG1-CB 4.48Å; V93-V104 HydrophobicContact CG1-CG1 3.9Å; V93-V104 HydrophobicContact CG1-CG2 3.67Å
94	V	94.7	Very high	82.4	Confident	1 Å²	1	67.9 Å²	67.9	1%	0.006	41%	0.412	C	S	.	.	H	α-helix	trans	-69.9	-40	179.2	173.1	0	0	0	0	111.7	L90 F91 G97 M101 F126 F177 N180 F184	L90-V94 HydrophobicContact CD1-CG2 4.31Å; L90-V94 WeakPolarHBondContact O-CG2 3.4Å; L90-V94 PolarHBondContact O-N 3.16Å; L90-V94 VanDerWaalsContact O-N 3.07Å; F91-V94 PolarHBondContact O-N 3.24Å; V94-G97 PolarHBondContact O-N 3.08Å; V94-M101 HydrophobicContact CG2-SD 4.39Å; V94-F126 HydrophobicContact CB-CE2 3.91Å; V94-F126 HydrophobicContact CB-CZ 4.45Å; V94-F126 HydrophobicContact CG1-CE2 4.17Å; V94-F126 HydrophobicContact CG1-CZ 4.29Å; V94-F126 HydrophobicContact CG2-CE2 3.74Å; V94-F126 HydrophobicContact CG2-CZ 4.14Å; V94-F177 HydrophobicContact CG1-CD2 4.43Å; V94-F177 HydrophobicContact CG1-CE2 4.41Å; V94-N180 HydrophobicContact CG1-CB 3.8Å; V94-N180 WeakPolarHBondContact O-CB 3.37Å; V94-N180 PolarHBondContact O-ND2 3.25Å; V94-F184 HydrophobicContact CG2-CB 4.41Å; V94-F184 HydrophobicContact CG2-CD2 4.2Å; V94-F184 HydrophobicContact CG2-CG 4.28Å
95	K	93.3	Very high	85.4	Confident	55 Å²	55	63.7 Å²	63.7	24%	0.239	37%	0.369	C	S	.	.	H	α-helix	trans	-61.8	-45.9	176.2	-178.4	-179.6	178.3	-178.4	0	112.3	F91 E92 W174 F177	F91-K95 HydrophobicContact CE1-CD 4.21Å; F91-K95 HydrophobicContact CE2-CD 4.45Å; F91-K95 HydrophobicContact CZ-CD 3.94Å; F91-K95 WeakPolarHBondContact O-CB 3.43Å; F91-K95 PolarHBondContact O-N 3.08Å; E92-K95 PolarHBondContact O-N 3.36Å; K95-W174 HydrophobicContact CD-CH2 4.16Å; K95-W174 HydrophobicContact CD-CZ3 4.04Å; K95-W174 HydrophobicContact CG-CZ3 4.48Å; K95-F177 HydrophobicContact CB-CD2 4.04Å; K95-F177 HydrophobicContact CG-CD2 4.49Å
96	L	90.4	Very high	88.3	Confident	82 Å²	82	63.8 Å²	63.8	43%	0.429	35%	0.353	S	S	.	.	H	α-helix	trans	-70.9	-39.9	177.3	-67.6	171.7	0	0	0	111.5	E92 K98 K176	E92-L96 WeakPolarHBondContact O-CB 3.38Å; E92-L96 VanDerWaalsContact O-CG 3.27Å; E92-L96 WeakPolarHBondContact O-CG 3.27Å; E92-L96 PolarHBondContact O-N 3.42Å; L96-K98 HydrophobicContact CB-CD 4.18Å; L96-K98 HydrophobicContact CB-CG 4.16Å; L96-K98 HydrophobicContact CD1-CD 4.45Å; L96-K98 PolarHBondContact O-N 3.2Å; L96-K176 PolarHBondContact O-NZ 3.04Å
97	G	85.9	Confident	90.7	Very high	19 Å²	19	61.7 Å²	61.7	20%	0.196	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	55.1	51.3	180	0	0	0	0	0	112.1	V93 V94 K176	V93-G97 PolarHBondContact O-N 2.9Å; V94-G97 PolarHBondContact O-N 3.08Å; G97-K176 PolarHBondContact O-NZ 3.36Å
98	K	87.4	Confident	92.2	Very high	174 Å²	174	57 Å²	57	76%	0.757	31%	0.311	S	S	*	.			trans	-94.7	-19.5	178.9	-71.7	172.1	179.2	170.9	0	113.1	L96	L96-K98 HydrophobicContact CB-CD 4.18Å; L96-K98 HydrophobicContact CB-CG 4.16Å; L96-K98 HydrophobicContact CD1-CD 4.45Å; L96-K98 PolarHBondContact O-N 3.2Å
99	S	85.3	Confident	93	Very high	72 Å²	72	53 Å²	53	50%	0.503	29%	0.286	S	S	.	.	S	Bend	trans	-102.6	158.9	175.7	-62.2	0	0	0	0	110.4
100	A	90.5	Very high	93.3	Very high	67 Å²	67	55.1 Å²	55.1	55%	0.554	29%	0.293	S	S	*	.			trans	-67.6	134.6	168.5	0	0	0	0	0	109.6	Q102 S103 V104	A100-Q102 VanDerWaalsContact C-N 3.27Å; A100-Q102 PolarHBondContact O-N 3.01Å; A100-S103 WeakPolarHBondContact O-CB 3.42Å; A100-S103 PolarHBondContact O-N 3.05Å; A100-V104 PolarHBondContact O-N 2.93Å
101	M	94.3	Very high	93.5	Very high	11 Å²	11	55.7 Å²	55.7	5%	0.054	30%	0.302	C	S	.	.	H	α-helix	trans	-59.6	-38.3	-170.9	-165.6	57.2	67.1	0	0	112.9	V94 S103 V104 V105 N180 E183 F184 V187	V94-M101 HydrophobicContact CG2-SD 4.39Å; M101-S103 VanDerWaalsContact C-N 3.31Å; M101-S103 PolarHBondContact O-N 3.35Å; M101-V104 PolarHBondContact O-N 2.87Å; M101-V105 PolarHBondContact O-N 3.27Å; M101-V105 VanDerWaalsContact O-N 3.11Å; M101-N180 HydrophobicContact CE-CB 3.75Å; M101-N180 WeakPolarHBondContact CE-O 3.33Å; M101-E183 HydrophobicContact CB-CG 4.23Å; M101-E183 WeakPolarHBondContact CB-OE1 3.4Å; M101-E183 HydrophobicContact CG-CB 4.31Å; M101-E183 HydrophobicContact CG-CG 4.04Å; M101-F184 HydrophobicContact CE-CB 4.48Å; M101-F184 HydrophobicContact CG-CB 4.28Å; M101-F184 HydrophobicContact SD-CB 3.62Å; M101-F184 HydrophobicContact SD-CD2 3.81Å; M101-F184 HydrophobicContact SD-CG 4.21Å; M101-V187 HydrophobicContact CG-CG2 4.28Å
102	Q	94.3	Very high	93.6	Very high	95 Å²	95	54.5 Å²	54.5	44%	0.444	30%	0.296	S	S	.	.	H	α-helix	trans	-59.9	-37.1	174.6	-178.2	175.5	-11.8	0	0	112.8	A100 V104 V105 D106 V187 Q191	A100-Q102 VanDerWaalsContact C-N 3.27Å; A100-Q102 PolarHBondContact O-N 3.01Å; Q102-V104 VanDerWaalsContact C-N 3.33Å; Q102-V104 PolarHBondContact O-N 3.45Å; Q102-V105 PolarHBondContact O-N 3.11Å; Q102-D106 WeakPolarHBondContact CG-OD2 3.4Å; Q102-D106 WeakPolarHBondContact O-CB 3.4Å; Q102-D106 PolarHBondContact O-N 3.03Å; Q102-V187 HydrophobicContact CB-CG1 4.1Å; Q102-V187 HydrophobicContact CG-CG1 4.45Å; Q102-Q191 VanDerWaalsContact CD-NE2 3.27Å
103	S	95.1	Very high	93.6	Very high	52 Å²	52	56.2 Å²	56.2	36%	0.364	30%	0.302	S	S	.	.	H	α-helix	trans	-66	-37.1	178.7	-55.6	0	0	0	0	112.3	A100 M101 V105 D106 E107	A100-S103 WeakPolarHBondContact O-CB 3.42Å; A100-S103 PolarHBondContact O-N 3.05Å; M101-S103 VanDerWaalsContact C-N 3.31Å; M101-S103 PolarHBondContact O-N 3.35Å; S103-V105 VanDerWaalsContact C-N 3.34Å; S103-D106 PolarHBondContact O-N 2.98Å; S103-E107 WeakPolarHBondContact O-CB 3.48Å; S103-E107 VanDerWaalsContact O-CG 3.24Å; S103-E107 WeakPolarHBondContact O-CG 3.3Å; S103-E107 PolarHBondContact O-N 3.48Å
104	V	95.4	Very high	93.7	Very high	12 Å²	12	61.4 Å²	61.4	7%	0.073	32%	0.324	C	S	.	.	H	α-helix	trans	-66.2	-39.4	175.7	-173.7	0	0	0	0	110.8	L90 V93 A100 M101 Q102 W108 F184	L90-V104 HydrophobicContact CD1-CG1 3.51Å; V93-V104 HydrophobicContact CG1-CB 4.48Å; V93-V104 HydrophobicContact CG1-CG1 3.9Å; V93-V104 HydrophobicContact CG1-CG2 3.67Å; A100-V104 PolarHBondContact O-N 2.93Å; M101-V104 PolarHBondContact O-N 2.87Å; Q102-V104 VanDerWaalsContact C-N 3.33Å; Q102-V104 PolarHBondContact O-N 3.45Å; V104-W108 PolarHBondContact O-N 2.82Å; V104-F184 HydrophobicContact CG1-CE2 4.31Å
105	V	96.8	Very high	93.7	Very high	0 Å²	0	64.3 Å²	64.3	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-67.2	-45.1	174.1	163.8	0	0	0	0	112	M101 Q102 S103 E107 W108 I109 F184 V187 L188 Q191	M101-V105 PolarHBondContact O-N 3.27Å; M101-V105 VanDerWaalsContact O-N 3.11Å; Q102-V105 PolarHBondContact O-N 3.11Å; S103-V105 VanDerWaalsContact C-N 3.34Å; V105-E107 VanDerWaalsContact C-N 3.31Å; V105-E107 PolarHBondContact O-N 3.29Å; V105-W108 PolarHBondContact O-N 3.07Å; V105-I109 HydrophobicContact CG1-CD1 3.67Å; V105-I109 HydrophobicContact CG1-CG1 4.34Å; V105-I109 WeakPolarHBondContact O-CB 3.3Å; V105-I109 VanDerWaalsContact O-CG1 3.32Å; V105-I109 WeakPolarHBondContact O-CG1 3.42Å; V105-I109 PolarHBondContact O-N 3.1Å; V105-F184 HydrophobicContact CG2-CD2 3.75Å; V105-F184 HydrophobicContact CG2-CE2 3.66Å; V105-V187 HydrophobicContact CB-CG1 4.09Å; V105-V187 HydrophobicContact CG1-CG1 4.19Å; V105-V187 HydrophobicContact CG2-CB 4.14Å; V105-V187 HydrophobicContact CG2-CG1 3.92Å; V105-L188 HydrophobicContact CG1-CB 4.4Å; V105-L188 HydrophobicContact CG1-CD1 4.16Å; V105-L188 HydrophobicContact CG2-CB 4.13Å; V105-Q191 HydrophobicContact CG1-CB 4Å; V105-Q191 HydrophobicContact CG1-CG 3.73Å
106	D	95.8	Very high	93.7	Very high	69 Å²	69	67.1 Å²	67.1	37%	0.369	35%	0.348	S	S	.	.	H	α-helix	trans	-63.8	-38.3	179.6	-68.2	-18.3	0	0	0	110.9	Q102 S103 E110	Q102-D106 WeakPolarHBondContact CG-OD2 3.4Å; Q102-D106 WeakPolarHBondContact O-CB 3.4Å; Q102-D106 PolarHBondContact O-N 3.03Å; S103-D106 PolarHBondContact O-N 2.98Å; D106-E110 PolarHBondContact O-N 3.19Å
107	E	95.6	Very high	93.9	Very high	137 Å²	137	65 Å²	65	64%	0.64	34%	0.338	S	S	*	.	H	α-helix	trans	-64.8	-45.4	173.1	-75.3	168	-167.8	0	0	111.8	S103 V105 E110 A111	S103-E107 WeakPolarHBondContact O-CB 3.48Å; S103-E107 VanDerWaalsContact O-CG 3.24Å; S103-E107 WeakPolarHBondContact O-CG 3.3Å; S103-E107 PolarHBondContact O-N 3.48Å; V105-E107 VanDerWaalsContact C-N 3.31Å; V105-E107 PolarHBondContact O-N 3.29Å; E107-E110 PolarHBondContact O-N 3.13Å; E107-A111 PolarHBondContact O-N 2.89Å
108	W	96.8	Very high	94.3	Very high	16 Å²	16	68.1 Å²	68.1	6%	0.061	35%	0.349	C	S	.	.	H	α-helix	trans	-64.2	-40.6	174.9	-176.4	88.8	0	0	0	112.6	V104 V105 E110 A111 Y112 A119 L120 L123 L188 M202	V104-W108 PolarHBondContact O-N 2.82Å; V105-W108 PolarHBondContact O-N 3.07Å; W108-E110 VanDerWaalsContact C-N 3.29Å; W108-E110 PolarHBondContact O-N 2.88Å; W108-A111 WeakPolarHBondContact O-CB 3.3Å; W108-A111 PolarHBondContact O-N 3.07Å; W108-Y112 AromaticContact CH2-CD2 3.89Å; W108-Y112 HydrophobicContact CH2-CD2 3.89Å; W108-Y112 HydrophobicContact CH2-CG 4.08Å; W108-Y112 HydrophobicContact CZ2-CD2 4.29Å; W108-Y112 HydrophobicContact CZ3-CG 4.29Å; W108-Y112 PolarHBondContact O-N 2.99Å; W108-A119 HydrophobicContact CZ2-CB 4.18Å; W108-A119 WeakPolarHBondContact CZ2-O 3.45Å; W108-A119 PolarHBondContact NE1-O 3.16Å; W108-L120 HydrophobicContact CH2-CD2 4.49Å; W108-L120 HydrophobicContact CZ2-CD2 4.36Å; W108-L123 HydrophobicContact CH2-CD2 4.02Å; W108-L123 HydrophobicContact CZ2-CB 3.93Å; W108-L123 HydrophobicContact CZ2-CD2 3.66Å; W108-L123 HydrophobicContact CZ2-CG 4.37Å; W108-L188 HydrophobicContact CD2-CD1 4.46Å; W108-L188 HydrophobicContact CE3-CD1 3.54Å; W108-L188 HydrophobicContact CZ3-CD1 3.68Å; W108-M202 HydrophobicContact CH2-CE 3.8Å; W108-M202 HydrophobicContact CH2-CG 4.08Å; W108-M202 HydrophobicContact CZ3-CE 4.04Å
109	I	96.8	Very high	94.6	Very high	15 Å²	15	60 Å²	60	8%	0.077	31%	0.314	C	S	.	.	H	α-helix	trans	-63.2	-35.5	176.6	-79.1	174.8	0	0	0	111.4	V105 K113 L188 Q191 I196	V105-I109 HydrophobicContact CG1-CD1 3.67Å; V105-I109 HydrophobicContact CG1-CG1 4.34Å; V105-I109 WeakPolarHBondContact O-CB 3.3Å; V105-I109 VanDerWaalsContact O-CG1 3.32Å; V105-I109 WeakPolarHBondContact O-CG1 3.42Å; V105-I109 PolarHBondContact O-N 3.1Å; I109-K113 VanDerWaalsContact CG2-CE 3.44Å; I109-K113 WeakPolarHBondContact O-CE 3.41Å; I109-K113 WeakPolarHBondContact O-CG 3.26Å; I109-K113 PolarHBondContact O-N 3.43Å; I109-L188 HydrophobicContact CD1-CD1 4.42Å; I109-L188 HydrophobicContact CG1-CD1 4.27Å; I109-Q191 HydrophobicContact CD1-CB 3.42Å; I109-Q191 VanDerWaalsContact CD1-CB 3.42Å; I109-Q191 HydrophobicContact CD1-CG 4.41Å; I109-I196 HydrophobicContact CG1-CD1 4.45Å; I109-I196 HydrophobicContact CG2-CD1 3.86Å
110	E	96.3	Very high	95.1	Very high	90 Å²	90	56.6 Å²	56.6	42%	0.421	29%	0.29	S	S	.	.	H	α-helix	trans	-74.7	-32.8	175.4	-166.3	58.6	-153.6	0	0	112.3	D106 E107 W108 K113 Q114	D106-E110 PolarHBondContact O-N 3.19Å; E107-E110 PolarHBondContact O-N 3.13Å; W108-E110 VanDerWaalsContact C-N 3.29Å; W108-E110 PolarHBondContact O-N 2.88Å; E110-K113 PolarHBondContact O-N 3.43Å; E110-K113 IonicContact OE2-NZ 2.74Å; E110-K113 PolarHBondContact OE2-NZ 3.02Å; E110-Q114 WeakPolarHBondContact O-CG 3.06Å; E110-Q114 PolarHBondContact O-N 3.16Å; E110-Q114 PolarHBondContact O-NE2 2.9Å
111	A	95.4	Very high	95.3	Very high	42 Å²	42	54.1 Å²	54.1	35%	0.347	27%	0.268	S	S	.	.	H	α-helix	trans	-63.4	-44.7	169.1	0	0	0	0	0	111.8	E107 W108 K113 Q114 D115 A119	E107-A111 PolarHBondContact O-N 2.89Å; W108-A111 WeakPolarHBondContact O-CB 3.3Å; W108-A111 PolarHBondContact O-N 3.07Å; A111-K113 VanDerWaalsContact C-N 3.26Å; A111-K113 PolarHBondContact O-N 3.22Å; A111-Q114 WeakPolarHBondContact O-CA 3.35Å; A111-Q114 WeakPolarHBondContact O-CB 3.29Å; A111-Q114 PolarHBondContact O-N 2.96Å; A111-D115 PolarHBondContact O-N 2.54Å; A111-A119 HydrophobicContact CB-CB 4.33Å
112	Y	96.9	Very high	95.3	Very high	3 Å²	3	58.1 Å²	58.1	1%	0.012	29%	0.289	C	S	.	.	H	α-helix	trans	-61.3	-30.3	177.9	-176.9	-98.2	0	0	0	113.6	W108 Q114 R116 A119 L120 I196 D199 M202	W108-Y112 AromaticContact CH2-CD2 3.89Å; W108-Y112 HydrophobicContact CH2-CD2 3.89Å; W108-Y112 HydrophobicContact CH2-CG 4.08Å; W108-Y112 HydrophobicContact CZ2-CD2 4.29Å; W108-Y112 HydrophobicContact CZ3-CG 4.29Å; W108-Y112 PolarHBondContact O-N 2.99Å; Y112-Q114 VanDerWaalsContact C-N 3.3Å; Y112-R116 HydrophobicContact CD2-CB 4.16Å; Y112-R116 HydrophobicContact CD2-CG 4.22Å; Y112-R116 HydrophobicContact CE1-CG 4.08Å; Y112-R116 HydrophobicContact CE2-CB 3.67Å; Y112-R116 HydrophobicContact CE2-CG 3.74Å; Y112-R116 WeakPolarHBondContact O-CG 3.45Å; Y112-A119 VanDerWaalsContact CA-CB 3.48Å; Y112-A119 HydrophobicContact CD2-CB 4.05Å; Y112-A119 HydrophobicContact CG-CB 4.44Å; Y112-L120 HydrophobicContact CD2-CG 4.3Å; Y112-L120 HydrophobicContact CE2-CD1 4.05Å; Y112-L120 HydrophobicContact CE2-CD2 4.37Å; Y112-L120 HydrophobicContact CE2-CG 3.89Å; Y112-I196 HydrophobicContact CD1-CD1 4.02Å; Y112-I196 HydrophobicContact CD1-CG1 4.24Å; Y112-I196 HydrophobicContact CD1-CG2 3.96Å; Y112-I196 HydrophobicContact CE1-CG1 4.29Å; Y112-I196 HydrophobicContact CE1-CG2 3.64Å; Y112-D199 VanDerWaalsContact CE1-OD2 3.28Å; Y112-D199 WeakPolarHBondContact CE1-OD2 3.44Å; Y112-D199 PolarHBondContact OH-OD1 2.77Å; Y112-D199 PolarHBondContact OH-OD2 3.47Å; Y112-M202 HydrophobicContact CE1-CB 4.49Å; Y112-M202 HydrophobicContact CE2-CB 4.3Å; Y112-M202 HydrophobicContact CE2-CG 4.42Å
113	K	94.4	Very high	95.4	Very high	124 Å²	124	53.7 Å²	53.7	54%	0.539	27%	0.269	S	S	.	.	H	α-helix	trans	-72.6	-21	171.9	-70.1	172.3	-135.9	154.9	0	113.7	I109 E110 A111	I109-K113 VanDerWaalsContact CG2-CE 3.44Å; I109-K113 WeakPolarHBondContact O-CE 3.41Å; I109-K113 WeakPolarHBondContact O-CG 3.26Å; I109-K113 PolarHBondContact O-N 3.43Å; E110-K113 PolarHBondContact O-N 3.43Å; E110-K113 IonicContact OE2-NZ 2.74Å; E110-K113 PolarHBondContact OE2-NZ 3.02Å; A111-K113 VanDerWaalsContact C-N 3.26Å; A111-K113 PolarHBondContact O-N 3.22Å
114	Q	95.8	Very high	95.5	Very high	153 Å²	153	51.4 Å²	51.4	72%	0.715	25%	0.252	S	S	*	.	H	α-helix	trans	-92.2	-47.5	-179.6	-67.8	171.9	44.1	0	0	111.4	E110 A111 Y112	E110-Q114 WeakPolarHBondContact O-CG 3.06Å; E110-Q114 PolarHBondContact O-N 3.16Å; E110-Q114 PolarHBondContact O-NE2 2.9Å; A111-Q114 WeakPolarHBondContact O-CA 3.35Å; A111-Q114 WeakPolarHBondContact O-CB 3.29Å; A111-Q114 PolarHBondContact O-N 2.96Å; Y112-Q114 VanDerWaalsContact C-N 3.3Å
115	D	95	Very high	95.5	Very high	62 Å²	62	51.4 Å²	51.4	33%	0.332	25%	0.252	S	S	.	.			trans	-145.7	113.4	172.5	-169	-44.5	0	0	0	109.8	A111 D117 L118 A119	A111-D115 PolarHBondContact O-N 2.54Å; D115-D117 WeakPolarHBondContact OD1-CB 3.22Å; D115-D117 PolarHBondContact OD1-N 2.87Å; D115-L118 HydrophobicContact CB-CB 4.18Å; D115-L118 HydrophobicContact CB-CD1 4.11Å; D115-L118 HydrophobicContact CB-CG 4.28Å; D115-L118 PolarHBondContact OD1-N 3.18Å; D115-L118 WeakPolarHBondContact OD2-CD1 3.4Å; D115-A119 WeakPolarHBondContact O-CB 3.48Å; D115-A119 PolarHBondContact O-N 3.14Å
116	R	94.7	Very high	95.5	Very high	114 Å²	114	51.4 Å²	51.4	43%	0.43	25%	0.252	S	S	.	.	H	α-helix	trans	-69.9	-38.7	-178.2	-65.6	-176.5	172.8	-156.7	-7	112.4	Y112 L120 D199 Y201	Y112-R116 HydrophobicContact CD2-CB 4.16Å; Y112-R116 HydrophobicContact CD2-CG 4.22Å; Y112-R116 HydrophobicContact CE1-CG 4.08Å; Y112-R116 HydrophobicContact CE2-CB 3.67Å; Y112-R116 HydrophobicContact CE2-CG 3.74Å; Y112-R116 WeakPolarHBondContact O-CG 3.45Å; R116-L120 WeakPolarHBondContact O-CB 3.49Å; R116-L120 WeakPolarHBondContact O-CG 3.14Å; R116-L120 PolarHBondContact O-N 2.96Å; R116-D199 IonicContact CZ-OD2 3.75Å; R116-D199 IonicContact NE-OD2 3.07Å; R116-D199 IonicContact NH1-OD2 3.67Å; R116-D199 PolarHBondContact NH1-OD2 3.42Å; R116-D199 VanDerWaalsContact NH1-OD2 3.13Å; R116-D199 IonicContact NH2-OD2 3.58Å; R116-D199 PolarHBondContact NH2-OD2 3.28Å; R116-D199 VanDerWaalsContact NH2-OD2 3.13Å; R116-Y201 HydrophobicContact CB-CD1 4.26Å; R116-Y201 HydrophobicContact CB-CE1 3.97Å
117	D	93.5	Very high	95.6	Very high	38 Å²	38	48.5 Å²	48.5	20%	0.203	24%	0.236	C	C	.	.	H	α-helix	trans	-67.3	-44.8	-176.7	-73.8	22.6	0	0	0	110.2	D115 L121 I139 F142 R143 Y201	D115-D117 WeakPolarHBondContact OD1-CB 3.22Å; D115-D117 PolarHBondContact OD1-N 2.87Å; D117-L121 VanDerWaalsContact O-CB 3.32Å; D117-L121 WeakPolarHBondContact O-CB 3.43Å; D117-L121 PolarHBondContact O-N 3.19Å; D117-I139 HydrophobicContact CB-CD1 4.03Å; D117-F142 HydrophobicContact CB-CE1 4.21Å; D117-R143 IonicContact OD2-CZ 2.69Å; D117-R143 IonicContact OD2-NE 3.35Å; D117-R143 PolarHBondContact OD2-NE 2.95Å; D117-R143 IonicContact OD2-NH2 3.37Å; D117-R143 PolarHBondContact OD2-NH2 3.21Å; D117-Y201 PolarHBondContact OD1-OH 3.14Å
118	L	93.6	Very high	95.7	Very high	85 Å²	85	42 Å²	42	45%	0.445	21%	0.206	S	C	.	.	H	α-helix	trans	-69.3	-44.1	-179.3	-65.4	178.3	0	0	0	111.8	D115 L120 L121 D122 I139	D115-L118 HydrophobicContact CB-CB 4.18Å; D115-L118 HydrophobicContact CB-CD1 4.11Å; D115-L118 HydrophobicContact CB-CG 4.28Å; D115-L118 PolarHBondContact OD1-N 3.18Å; D115-L118 WeakPolarHBondContact OD2-CD1 3.4Å; L118-L120 VanDerWaalsContact C-N 3.35Å; L118-L120 PolarHBondContact O-N 3.36Å; L118-L121 WeakPolarHBondContact O-CB 3.5Å; L118-L121 PolarHBondContact O-N 3.01Å; L118-D122 PolarHBondContact O-N 3.31Å; L118-I139 HydrophobicContact CD2-CD1 4.33Å
119	A	94.5	Very high	95.6	Very high	2 Å²	2	42.7 Å²	42.7	2%	0.017	21%	0.21	C	C	.	.	H	α-helix	trans	-65.7	-36.1	177.9	0	0	0	0	0	112.6	W108 A111 Y112 D115 L123	W108-A119 HydrophobicContact CZ2-CB 4.18Å; W108-A119 WeakPolarHBondContact CZ2-O 3.45Å; W108-A119 PolarHBondContact NE1-O 3.16Å; A111-A119 HydrophobicContact CB-CB 4.33Å; Y112-A119 VanDerWaalsContact CA-CB 3.48Å; Y112-A119 HydrophobicContact CD2-CB 4.05Å; Y112-A119 HydrophobicContact CG-CB 4.44Å; D115-A119 WeakPolarHBondContact O-CB 3.48Å; D115-A119 PolarHBondContact O-N 3.14Å; A119-L123 PolarHBondContact O-N 3.17Å; A119-L123 VanDerWaalsContact O-N 3.14Å
120	L	95.3	Very high	95.7	Very high	1 Å²	1	42 Å²	42	1%	0.005	21%	0.206	C	C	.	.	H	α-helix	trans	-69.1	-38.1	171.3	-75.3	173.7	0	0	0	112.2	W108 Y112 R116 L118 D122 L123 I124 F142 Y201 M202 T205	W108-L120 HydrophobicContact CH2-CD2 4.49Å; W108-L120 HydrophobicContact CZ2-CD2 4.36Å; Y112-L120 HydrophobicContact CD2-CG 4.3Å; Y112-L120 HydrophobicContact CE2-CD1 4.05Å; Y112-L120 HydrophobicContact CE2-CD2 4.37Å; Y112-L120 HydrophobicContact CE2-CG 3.89Å; R116-L120 WeakPolarHBondContact O-CB 3.49Å; R116-L120 WeakPolarHBondContact O-CG 3.14Å; R116-L120 PolarHBondContact O-N 2.96Å; L118-L120 VanDerWaalsContact C-N 3.35Å; L118-L120 PolarHBondContact O-N 3.36Å; L120-D122 VanDerWaalsContact C-N 3.29Å; L120-D122 PolarHBondContact O-N 3.12Å; L120-L123 HydrophobicContact CD2-CD2 4.46Å; L120-L123 PolarHBondContact O-N 3.07Å; L120-L123 VanDerWaalsContact O-N 3.12Å; L120-I124 WeakPolarHBondContact O-CB 3.44Å; L120-I124 WeakPolarHBondContact O-CG1 3.23Å; L120-I124 PolarHBondContact O-N 3.3Å; L120-F142 HydrophobicContact CB-CZ 4.16Å; L120-F142 HydrophobicContact CD1-CZ 4.36Å; L120-Y201 HydrophobicContact CD1-CD1 3.7Å; L120-Y201 HydrophobicContact CD1-CE1 3.32Å; L120-M202 HydrophobicContact CD2-CG 4.22Å; L120-T205 HydrophobicContact CD1-CG2 4.22Å; L120-T205 HydrophobicContact CD2-CG2 4.46Å
121	L	95.2	Very high	95.7	Very high	16 Å²	16	37.7 Å²	37.7	8%	0.084	19%	0.186	C	C	.	.	H	α-helix	trans	-59	-41.2	174.7	-173.2	68.2	0	0	0	111.9	D117 L118 I124 N125 V137 I139 F142	D117-L121 VanDerWaalsContact O-CB 3.32Å; D117-L121 WeakPolarHBondContact O-CB 3.43Å; D117-L121 PolarHBondContact O-N 3.19Å; L118-L121 WeakPolarHBondContact O-CB 3.5Å; L118-L121 PolarHBondContact O-N 3.01Å; L121-I124 PolarHBondContact O-N 3.19Å; L121-N125 WeakPolarHBondContact O-CB 3.3Å; L121-N125 PolarHBondContact O-N 3.07Å; L121-N125 PolarHBondContact O-ND2 2.89Å; L121-V137 HydrophobicContact CD1-CB 4.21Å; L121-V137 HydrophobicContact CD1-CG1 3.87Å; L121-V137 WeakPolarHBondContact CD1-O 3.47Å; L121-I139 HydrophobicContact CD2-CB 3.89Å; L121-I139 HydrophobicContact CD2-CD1 4.35Å; L121-F142 HydrophobicContact CD1-CB 3.84Å; L121-F142 HydrophobicContact CD1-CG 4.41Å
122	D	95.1	Very high	95.7	Very high	94 Å²	94	36.9 Å²	36.9	50%	0.503	18%	0.182	S	C	.	.	H	α-helix	trans	-65.8	-37.6	174.5	-73.7	-15	0	0	0	112.1	L118 L120 F126	L118-D122 PolarHBondContact O-N 3.31Å; L120-D122 VanDerWaalsContact C-N 3.29Å; L120-D122 PolarHBondContact O-N 3.12Å; D122-F126 WeakPolarHBondContact O-CB 3.5Å; D122-F126 PolarHBondContact O-N 3.34Å
123	L	96.3	Very high	95.6	Very high	2 Å²	2	36.9 Å²	36.9	1%	0.01	18%	0.182	C	C	.	.	H	α-helix	trans	-71.7	-35.7	177	-174.7	60.7	0	0	0	112.6	W108 A119 L120 F126 F127 F184 L188 M202 V206	W108-L123 HydrophobicContact CH2-CD2 4.02Å; W108-L123 HydrophobicContact CZ2-CB 3.93Å; W108-L123 HydrophobicContact CZ2-CD2 3.66Å; W108-L123 HydrophobicContact CZ2-CG 4.37Å; A119-L123 PolarHBondContact O-N 3.17Å; A119-L123 VanDerWaalsContact O-N 3.14Å; L120-L123 HydrophobicContact CD2-CD2 4.46Å; L120-L123 PolarHBondContact O-N 3.07Å; L120-L123 VanDerWaalsContact O-N 3.12Å; L123-F126 HydrophobicContact CD1-CD1 4.08Å; L123-F126 WeakPolarHBondContact O-CB 3.17Å; L123-F126 PolarHBondContact O-N 2.88Å; L123-F127 HydrophobicContact CD1-CE2 3.86Å; L123-F127 HydrophobicContact CD1-CZ 4.23Å; L123-F127 HydrophobicContact CD2-CE2 4.5Å; L123-F127 HydrophobicContact CG-CD2 4.4Å; L123-F127 HydrophobicContact CG-CE2 3.86Å; L123-F127 WeakPolarHBondContact O-CD2 3.31Å; L123-F127 PolarHBondContact O-N 3.11Å; L123-F184 HydrophobicContact CD1-CE1 3.85Å; L123-F184 HydrophobicContact CD1-CZ 4.33Å; L123-L188 HydrophobicContact CD1-CD2 4.26Å; L123-L188 HydrophobicContact CD2-CD2 4.14Å; L123-M202 HydrophobicContact CD2-CE 3.93Å; L123-V206 HydrophobicContact CD2-CG2 3.64Å; L123-V206 HydrophobicContact CG-CG2 4.45Å
124	I	95.9	Very high	95.5	Very high	4 Å²	4	35.5 Å²	35.5	2%	0.021	18%	0.176	C	C	.	.	H	α-helix	trans	-63.4	-51.4	172.1	-68.3	163.2	0	0	0	109.3	L120 L121 F126 F127 I128 V137 F142 T205 L209	L120-I124 WeakPolarHBondContact O-CB 3.44Å; L120-I124 WeakPolarHBondContact O-CG1 3.23Å; L120-I124 PolarHBondContact O-N 3.3Å; L121-I124 PolarHBondContact O-N 3.19Å; I124-F126 VanDerWaalsContact C-N 3.27Å; I124-F126 PolarHBondContact O-N 3.23Å; I124-F127 PolarHBondContact O-N 3.03Å; I124-F127 VanDerWaalsContact O-N 3.16Å; I124-I128 WeakPolarHBondContact O-CG1 3.2Å; I124-I128 PolarHBondContact O-N 3Å; I124-I128 VanDerWaalsContact O-N 3.12Å; I124-V137 HydrophobicContact CG2-CB 4.32Å; I124-V137 HydrophobicContact CG2-CG1 4.41Å; I124-V137 HydrophobicContact CG2-CG2 3.98Å; I124-F142 HydrophobicContact CD1-CD2 3.4Å; I124-F142 VanDerWaalsContact CD1-CD2 3.4Å; I124-F142 HydrophobicContact CD1-CE2 3.42Å; I124-F142 VanDerWaalsContact CD1-CE2 3.42Å; I124-F142 HydrophobicContact CD1-CG 4.27Å; I124-F142 HydrophobicContact CD1-CZ 4.29Å; I124-T205 HydrophobicContact CD1-CG2 4.17Å; I124-L209 HydrophobicContact CB-CD2 4.22Å; I124-L209 HydrophobicContact CG1-CD2 4.09Å; I124-L209 HydrophobicContact CG2-CD1 4.09Å; I124-L209 HydrophobicContact CG2-CD2 3.97Å
125	N	95.8	Very high	95.3	Very high	12 Å²	12	28.6 Å²	28.6	6%	0.064	15%	0.146	C	C	.	.	H	α-helix	trans	-61.3	-35.2	177.4	-80.3	-58.6	0	0	0	112.4	L121 F127 I128 Q129 T136 V137	L121-N125 WeakPolarHBondContact O-CB 3.3Å; L121-N125 PolarHBondContact O-N 3.07Å; L121-N125 PolarHBondContact O-ND2 2.89Å; N125-F127 PolarHBondContact O-N 3.06Å; N125-I128 PolarHBondContact O-N 2.66Å; N125-Q129 WeakPolarHBondContact O-CB 3.11Å; N125-Q129 VanDerWaalsContact O-CG 3.3Å; N125-Q129 WeakPolarHBondContact O-CG 3.45Å; N125-Q129 PolarHBondContact O-N 3.27Å; N125-T136 WeakPolarHBondContact OD1-CA 3.27Å; N125-V137 PolarHBondContact ND2-O 3.45Å; N125-V137 PolarHBondContact OD1-N 2.66Å
126	F	97.6	Very high	95.2	Very high	1 Å²	1	28.7 Å²	28.7	0%	0.004	15%	0.149	C	C	.	.	H	α-helix	trans	-57.5	-47.3	172.2	169	-104.5	0	0	0	112.7	L90 F91 V94 D122 L123 I124 Q129 C130 F181 F184	L90-F126 HydrophobicContact CB-CB 4.3Å; L90-F126 HydrophobicContact CB-CD2 4.1Å; L90-F126 HydrophobicContact CD2-CB 3.9Å; L90-F126 HydrophobicContact CD2-CD2 4.11Å; L90-F126 HydrophobicContact CD2-CG 3.93Å; L90-F126 HydrophobicContact CG-CB 4.21Å; L90-F126 HydrophobicContact CG-CD2 3.67Å; L90-F126 HydrophobicContact CG-CE2 4.2Å; L90-F126 HydrophobicContact CG-CG 4.02Å; F91-F126 HydrophobicContact CB-CD2 4.27Å; V94-F126 HydrophobicContact CB-CE2 3.91Å; V94-F126 HydrophobicContact CB-CZ 4.45Å; V94-F126 HydrophobicContact CG1-CE2 4.17Å; V94-F126 HydrophobicContact CG1-CZ 4.29Å; V94-F126 HydrophobicContact CG2-CE2 3.74Å; V94-F126 HydrophobicContact CG2-CZ 4.14Å; D122-F126 WeakPolarHBondContact O-CB 3.5Å; D122-F126 PolarHBondContact O-N 3.34Å; L123-F126 HydrophobicContact CD1-CD1 4.08Å; L123-F126 WeakPolarHBondContact O-CB 3.17Å; L123-F126 PolarHBondContact O-N 2.88Å; I124-F126 VanDerWaalsContact C-N 3.27Å; I124-F126 PolarHBondContact O-N 3.23Å; F126-Q129 PolarHBondContact O-N 3.39Å; F126-C130 WeakPolarHBondContact CE2-SG 3.48Å; F126-C130 VanDerWaalsContact O-CB 3.26Å; F126-C130 WeakPolarHBondContact O-CB 3.04Å; F126-C130 PolarHBondContact O-N 2.78Å; F126-C130 PolarHBondContact O-SG 3.45Å; F126-F181 AromaticContact CE1-CD2 3.98Å; F126-F181 HydrophobicContact CE1-CD2 3.98Å; F126-F181 AromaticContact CE1-CE2 3.88Å; F126-F181 HydrophobicContact CE1-CE2 3.88Å; F126-F181 AromaticContact CZ-CD2 3.67Å; F126-F181 HydrophobicContact CZ-CD2 3.67Å; F126-F181 HydrophobicContact CZ-CE2 4.03Å; F126-F184 HydrophobicContact CD1-CD1 4.37Å; F126-F184 HydrophobicContact CD1-CE1 4.11Å; F126-F184 AromaticContact CE1-CD1 3.5Å; F126-F184 HydrophobicContact CE1-CD1 3.5Å; F126-F184 AromaticContact CE1-CE1 3.7Å; F126-F184 HydrophobicContact CE1-CE1 3.7Å; F126-F184 HydrophobicContact CE1-CG 4.48Å; F126-F184 AromaticContact CZ-CD1 3.65Å; F126-F184 HydrophobicContact CZ-CD1 3.65Å; F126-F184 HydrophobicContact CZ-CE1 4.12Å; F126-F184 HydrophobicContact CZ-CG 4.21Å
127	F	97.8	Very high	95.2	Very high	8 Å²	8	23.4 Å²	23.4	4%	0.035	13%	0.129	C	C	.	.	H	α-helix	trans	-66.7	-36	177.4	-69.6	-58.7	0	0	0	113.1	L123 I124 N125 S131 F181 I185 V206 L209 L210 A228	L123-F127 HydrophobicContact CD1-CE2 3.86Å; L123-F127 HydrophobicContact CD1-CZ 4.23Å; L123-F127 HydrophobicContact CD2-CE2 4.5Å; L123-F127 HydrophobicContact CG-CD2 4.4Å; L123-F127 HydrophobicContact CG-CE2 3.86Å; L123-F127 WeakPolarHBondContact O-CD2 3.31Å; L123-F127 PolarHBondContact O-N 3.11Å; I124-F127 PolarHBondContact O-N 3.03Å; I124-F127 VanDerWaalsContact O-N 3.16Å; N125-F127 PolarHBondContact O-N 3.06Å; F127-S131 PolarHBondContact O-N 3Å; F127-S131 PolarHBondContact O-OG 2.86Å; F127-F181 HydrophobicContact CD1-CE2 4.08Å; F127-F181 HydrophobicContact CD1-CZ 4.17Å; F127-F181 HydrophobicContact CE1-CE2 4.26Å; F127-F181 HydrophobicContact CE1-CZ 4.34Å; F127-I185 HydrophobicContact CE1-CD1 3.87Å; F127-I185 HydrophobicContact CE1-CG1 4.16Å; F127-I185 HydrophobicContact CZ-CG1 4.43Å; F127-V206 HydrophobicContact CE2-CG1 4.01Å; F127-V206 HydrophobicContact CZ-CG1 4.41Å; F127-L209 HydrophobicContact CB-CD2 4.3Å; F127-L209 HydrophobicContact CD2-CD2 4.18Å; F127-L210 HydrophobicContact CD1-CD2 4.08Å; F127-L210 HydrophobicContact CD2-CD2 4.29Å; F127-L210 HydrophobicContact CE1-CD2 4.34Å; F127-L210 HydrophobicContact CG-CD2 4.07Å; F127-L210 HydrophobicContact CZ-CD1 4.46Å; F127-A228 HydrophobicContact CD1-CB 4.05Å; F127-A228 HydrophobicContact CE1-CB 3.72Å
128	I	96.3	Very high	95.2	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-64.3	-51	174.2	-64.5	-63.1	0	0	0	110.8	I124 N125 C130 S131 C133 V137 M154 L213 F221	I124-I128 WeakPolarHBondContact O-CG1 3.2Å; I124-I128 PolarHBondContact O-N 3Å; I124-I128 VanDerWaalsContact O-N 3.12Å; N125-I128 PolarHBondContact O-N 2.66Å; I128-C130 PolarHBondContact O-N 2.76Å; I128-S131 WeakPolarHBondContact O-CA 3.34Å; I128-S131 VanDerWaalsContact O-CB 3.22Å; I128-S131 WeakPolarHBondContact O-CB 3.41Å; I128-S131 PolarHBondContact O-N 3.25Å; I128-C133 HydrophobicContact CG2-CB 3.66Å; I128-C133 VanDerWaalsContact CG2-SG 3.5Å; I128-V137 HydrophobicContact CG1-CG2 4.33Å; I128-M154 HydrophobicContact CD1-CB 4.25Å; I128-M154 HydrophobicContact CD1-CG 4.16Å; I128-M154 HydrophobicContact CG1-CG 4.43Å; I128-M154 HydrophobicContact CG2-CB 4.4Å; I128-M154 HydrophobicContact CG2-CG 4.27Å; I128-M154 HydrophobicContact CG2-SD 4.03Å; I128-L213 HydrophobicContact CD1-CD1 4.29Å; I128-L213 HydrophobicContact CD1-CD2 3.86Å; I128-F221 HydrophobicContact CD1-CD1 4.33Å; I128-F221 HydrophobicContact CD1-CE1 3.78Å; I128-F221 HydrophobicContact CD1-CZ 4.34Å; I128-F221 HydrophobicContact CG2-CE1 4.22Å
129	Q	96.4	Very high	95.2	Very high	31 Å²	31	26.7 Å²	26.7	15%	0.145	14%	0.136	C	C	.	.	H	α-helix	trans	-66.9	-35.3	179.6	-69.7	175.2	4.1	0	0	112.8	T89 F91 N125 F126 S131 G132	T89-Q129 PolarHBondContact OG1-OE1 3.04Å; F91-Q129 HydrophobicContact CB-CB 3.82Å; F91-Q129 HydrophobicContact CD1-CB 4.07Å; F91-Q129 HydrophobicContact CG-CB 3.89Å; N125-Q129 WeakPolarHBondContact O-CB 3.11Å; N125-Q129 VanDerWaalsContact O-CG 3.3Å; N125-Q129 WeakPolarHBondContact O-CG 3.45Å; N125-Q129 PolarHBondContact O-N 3.27Å; F126-Q129 PolarHBondContact O-N 3.39Å; Q129-S131 PolarHBondContact O-N 3.06Å; Q129-G132 PolarHBondContact O-N 3.35Å
130	C	97.4	Very high	95	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-61.7	-21.7	170.6	-71.9	0	0	0	0	112.9	F91 F126 I128 G132 P166 F177 F181 T224	F91-C130 HydrophobicContact CD2-CB 4.49Å; F126-C130 WeakPolarHBondContact CE2-SG 3.48Å; F126-C130 VanDerWaalsContact O-CB 3.26Å; F126-C130 WeakPolarHBondContact O-CB 3.04Å; F126-C130 PolarHBondContact O-N 2.78Å; F126-C130 PolarHBondContact O-SG 3.45Å; I128-C130 PolarHBondContact O-N 2.76Å; C130-G132 VanDerWaalsContact C-N 3.31Å; C130-P166 WeakPolarHBondContact O-CB 3.43Å; C130-P166 WeakPolarHBondContact O-CG 3.29Å; C130-F177 HydrophobicContact CB-CZ 3.93Å; C130-F181 HydrophobicContact CB-CD2 4.01Å; C130-F181 HydrophobicContact CB-CE2 3.55Å; C130-F181 HydrophobicContact CB-CZ 4.24Å; C130-F181 VanDerWaalsContact SG-CD2 3.53Å; C130-F181 VanDerWaalsContact SG-CE2 3.52Å; C130-T224 HydrophobicContact CB-CG2 3.95Å
131	S	97	Very high	94.9	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86	0.9	174.6	-49.7	0	0	0	0	113.1	F127 I128 Q129 C133 F158 Y165 A220 F221 T224	F127-S131 PolarHBondContact O-N 3Å; F127-S131 PolarHBondContact O-OG 2.86Å; I128-S131 WeakPolarHBondContact O-CA 3.34Å; I128-S131 VanDerWaalsContact O-CB 3.22Å; I128-S131 WeakPolarHBondContact O-CB 3.41Å; I128-S131 PolarHBondContact O-N 3.25Å; Q129-S131 PolarHBondContact O-N 3.06Å; S131-C133 VanDerWaalsContact C-N 3.35Å; S131-F158 WeakPolarHBondContact O-CZ 3.47Å; S131-Y165 WeakPolarHBondContact O-CB 3.48Å; S131-A220 WeakPolarHBondContact O-CB 3.42Å; S131-F221 VanDerWaalsContact CB-CD1 3.45Å; S131-T224 WeakPolarHBondContact OG-CB 3.42Å
132	G	94.8	Very high	94.7	Very high	25 Å²	25	34.2 Å²	34.2	26%	0.258	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	89.6	-11.8	-180	0	0	0	0	0	115.3	Q129 C130 K134	Q129-G132 PolarHBondContact O-N 3.35Å; C130-G132 VanDerWaalsContact C-N 3.31Å; G132-K134 PolarHBondContact O-N 3.16Å
133	C	95.4	Very high	94.5	Very high	2 Å²	2	36.8 Å²	36.8	1%	0.014	17%	0.173	C	C	.	.			trans	-63.1	127.2	175.7	173.2	0	0	0	0	110.7	I128 S131 G135 M154 F158 F221	I128-C133 HydrophobicContact CG2-CB 3.66Å; I128-C133 VanDerWaalsContact CG2-SG 3.5Å; S131-C133 VanDerWaalsContact C-N 3.35Å; C133-G135 PolarHBondContact SG-N 3.5Å; C133-M154 PolarHBondContact SG-O 3.07Å; C133-F158 HydrophobicContact CB-CD1 4.42Å; C133-F158 HydrophobicContact CB-CD2 3.63Å; C133-F158 HydrophobicContact CB-CE1 4.47Å; C133-F158 HydrophobicContact CB-CE2 3.7Å; C133-F158 HydrophobicContact CB-CG 4.02Å; C133-F158 HydrophobicContact CB-CZ 4.13Å; C133-F221 HydrophobicContact CB-CE1 3.72Å; C133-F221 HydrophobicContact CB-CZ 3.71Å
134	K	92.6	Very high	94.3	Very high	95 Å²	95	43 Å²	43	41%	0.413	21%	0.206	S	C	.	.			trans	-83.8	-19.1	174.6	-58.9	171.7	-172.1	158.5	0	112.3	G132 F158 D159 D161	G132-K134 PolarHBondContact O-N 3.16Å; K134-F158 PolarHBondContact N-O 2.82Å; K134-D159 HydrophobicContact CB-CB 4.28Å; K134-D159 HydrophobicContact CD-CB 4.02Å; K134-D159 VanDerWaalsContact CD-O 3.24Å; K134-D159 WeakPolarHBondContact CD-O 3.33Å; K134-D159 WeakPolarHBondContact CD-OD2 3.45Å; K134-D159 WeakPolarHBondContact CE-O 3.5Å; K134-D159 PolarHBondContact NZ-O 3.01Å; K134-D159 IonicContact NZ-OD2 3.9Å; K134-D159 PolarHBondContact NZ-OD2 3.09Å; K134-D161 WeakPolarHBondContact CE-OD2 3.36Å; K134-D161 IonicContact NZ-OD1 3.66Å; K134-D161 PolarHBondContact NZ-OD1 2.99Å; K134-D161 IonicContact NZ-OD2 3.29Å; K134-D161 PolarHBondContact NZ-OD2 2.87Å
135	G	91.8	Very high	94.1	Very high	8 Å²	8	45.5 Å²	45.5	8%	0.082	22%	0.218	C	C	.	.			trans	-55.1	150.4	173.2	0	0	0	0	0	113.2	C133 E157	C133-G135 PolarHBondContact SG-N 3.5Å; G135-E157 WeakPolarHBondContact CA-O 3.49Å; G135-E157 PolarHBondContact N-O 3.27Å
136	T	93.1	Very high	93.9	Very high	65 Å²	65	51.9 Å²	51.9	40%	0.399	25%	0.248	S	C	.	.			trans	-132.4	119.9	-174.2	-64.8	0	0	0	0	111.2	N125 R138	N125-T136 WeakPolarHBondContact OD1-CA 3.27Å; T136-R138 PolarHBondContact O-N 3.07Å
137	V	94.2	Very high	93.6	Very high	2 Å²	2	53.4 Å²	53.4	1%	0.012	26%	0.256	C	S	.	.			trans	-66.7	126.7	173.4	-173.4	0	0	0	0	108.9	L121 I124 N125 I128 M141 I150 M154	L121-V137 HydrophobicContact CD1-CB 4.21Å; L121-V137 HydrophobicContact CD1-CG1 3.87Å; L121-V137 WeakPolarHBondContact CD1-O 3.47Å; I124-V137 HydrophobicContact CG2-CB 4.32Å; I124-V137 HydrophobicContact CG2-CG1 4.41Å; I124-V137 HydrophobicContact CG2-CG2 3.98Å; N125-V137 PolarHBondContact ND2-O 3.45Å; N125-V137 PolarHBondContact OD1-N 2.66Å; I128-V137 HydrophobicContact CG1-CG2 4.33Å; V137-M141 HydrophobicContact CG1-CB 4.15Å; V137-M141 HydrophobicContact CG1-CE 4.37Å; V137-I150 HydrophobicContact CG1-CG2 4.01Å; V137-I150 HydrophobicContact CG2-CG2 3.65Å; V137-M154 HydrophobicContact CG2-CG 3.86Å; V137-M154 HydrophobicContact CG2-SD 3.62Å
138	R	93.5	Very high	93.3	Very high	143 Å²	143	56.4 Å²	56.4	54%	0.54	28%	0.283	S	S	.	.			trans	-98	156.7	179.8	-54	-177.1	-168.8	177.4	3	110.7	T136 E140 M141 F142	T136-R138 PolarHBondContact O-N 3.07Å; R138-E140 PolarHBondContact O-N 3.21Å; R138-E140 VanDerWaalsContact O-N 3.15Å; R138-M141 HydrophobicContact CB-CG 4.31Å; R138-M141 HydrophobicContact CB-SD 4.28Å; R138-M141 HydrophobicContact CG-SD 4.3Å; R138-M141 WeakPolarHBondContact O-CA 3.43Å; R138-M141 WeakPolarHBondContact O-CB 3.45Å; R138-M141 PolarHBondContact O-N 3.49Å; R138-F142 PolarHBondContact O-N 2.88Å
139	I	92.3	Very high	93.1	Very high	49 Å²	49	61 Å²	61	25%	0.251	30%	0.304	S	S	.	.	H	α-helix	trans	-56	-33.5	178.1	-171.7	59.1	0	0	0	113	D117 L118 L121 M141 F142 R143	D117-I139 HydrophobicContact CB-CD1 4.03Å; L118-I139 HydrophobicContact CD2-CD1 4.33Å; L121-I139 HydrophobicContact CD2-CB 3.89Å; L121-I139 HydrophobicContact CD2-CD1 4.35Å; I139-M141 VanDerWaalsContact C-N 3.32Å; I139-M141 PolarHBondContact O-N 3.31Å; I139-F142 HydrophobicContact CD1-CD1 4.22Å; I139-R143 HydrophobicContact CD1-CG 4.33Å; I139-R143 WeakPolarHBondContact O-CB 3.46Å; I139-R143 WeakPolarHBondContact O-CG 3.41Å; I139-R143 PolarHBondContact O-N 2.9Å; I139-R143 VanDerWaalsContact O-N 3.1Å
140	E	91.9	Very high	92.9	Very high	138 Å²	138	59.7 Å²	59.7	65%	0.645	30%	0.298	S	S	*	.	H	α-helix	trans	-66.3	-32.8	174.4	-62	174.8	157	0	0	112.6	R138 N144	R138-E140 PolarHBondContact O-N 3.21Å; R138-E140 VanDerWaalsContact O-N 3.15Å; E140-N144 WeakPolarHBondContact O-CB 3.47Å; E140-N144 PolarHBondContact O-N 3.26Å; E140-N144 PolarHBondContact O-ND2 3.21Å
141	M	91.9	Very high	92.8	Very high	10 Å²	10	60.2 Å²	60.2	5%	0.049	30%	0.301	C	S	.	.	H	α-helix	trans	-74.9	-49.4	176.3	-60.9	172.9	46.9	0	0	109.9	V137 R138 I139 R143 N144 M145 I150 K153 M154	V137-M141 HydrophobicContact CG1-CB 4.15Å; V137-M141 HydrophobicContact CG1-CE 4.37Å; R138-M141 HydrophobicContact CB-CG 4.31Å; R138-M141 HydrophobicContact CB-SD 4.28Å; R138-M141 HydrophobicContact CG-SD 4.3Å; R138-M141 WeakPolarHBondContact O-CA 3.43Å; R138-M141 WeakPolarHBondContact O-CB 3.45Å; R138-M141 PolarHBondContact O-N 3.49Å; I139-M141 VanDerWaalsContact C-N 3.32Å; I139-M141 PolarHBondContact O-N 3.31Å; M141-R143 PolarHBondContact O-N 3.35Å; M141-N144 PolarHBondContact O-N 3.41Å; M141-M145 HydrophobicContact CB-CG 4.49Å; M141-M145 HydrophobicContact CB-SD 3.73Å; M141-M145 HydrophobicContact CE-SD 4.16Å; M141-M145 HydrophobicContact CG-SD 3.66Å; M141-M145 WeakPolarHBondContact O-CB 3.31Å; M141-M145 PolarHBondContact O-N 2.88Å; M141-I150 HydrophobicContact CE-CG2 4.35Å; M141-K153 HydrophobicContact CE-CB 4.37Å; M141-K153 HydrophobicContact CE-CD 3.7Å; M141-K153 HydrophobicContact CE-CG 4.24Å; M141-K153 HydrophobicContact SD-CD 4.07Å; M141-M154 HydrophobicContact CE-CE 4.11Å
142	F	91.4	Very high	92.6	Very high	30 Å²	30	68.2 Å²	68.2	13%	0.132	33%	0.331	C	S	.	.	H	α-helix	trans	-56.9	-35.8	179	177	-120.4	0	0	0	113.3	D117 L120 L121 I124 R138 I139 T205	D117-F142 HydrophobicContact CB-CE1 4.21Å; L120-F142 HydrophobicContact CB-CZ 4.16Å; L120-F142 HydrophobicContact CD1-CZ 4.36Å; L121-F142 HydrophobicContact CD1-CB 3.84Å; L121-F142 HydrophobicContact CD1-CG 4.41Å; I124-F142 HydrophobicContact CD1-CD2 3.4Å; I124-F142 VanDerWaalsContact CD1-CD2 3.4Å; I124-F142 HydrophobicContact CD1-CE2 3.42Å; I124-F142 VanDerWaalsContact CD1-CE2 3.42Å; I124-F142 HydrophobicContact CD1-CG 4.27Å; I124-F142 HydrophobicContact CD1-CZ 4.29Å; R138-F142 PolarHBondContact O-N 2.88Å; I139-F142 HydrophobicContact CD1-CD1 4.22Å; F142-T205 HydrophobicContact CE2-CG2 3.82Å; F142-T205 HydrophobicContact CZ-CG2 4.2Å
143	R	90.4	Very high	92.6	Very high	147 Å²	147	69.6 Å²	69.6	56%	0.555	33%	0.33	S	S	*	.	H	α-helix	trans	-83.7	-18.5	179.4	-72.2	-179.8	173.4	156	0.8	115.5	D117 I139 M141	D117-R143 IonicContact OD2-CZ 2.69Å; D117-R143 IonicContact OD2-NE 3.35Å; D117-R143 PolarHBondContact OD2-NE 2.95Å; D117-R143 IonicContact OD2-NH2 3.37Å; D117-R143 PolarHBondContact OD2-NH2 3.21Å; I139-R143 HydrophobicContact CD1-CG 4.33Å; I139-R143 WeakPolarHBondContact O-CB 3.46Å; I139-R143 WeakPolarHBondContact O-CG 3.41Å; I139-R143 PolarHBondContact O-N 2.9Å; I139-R143 VanDerWaalsContact O-N 3.1Å; M141-R143 PolarHBondContact O-N 3.35Å
144	N	92.2	Very high	92.6	Very high	132 Å²	132	69.5 Å²	69.5	71%	0.706	33%	0.329	S	S	*	.	H	α-helix	trans	-129.8	-10.4	-169.6	-57.8	-77.3	0	0	0	115.4	E140 M141	E140-N144 WeakPolarHBondContact O-CB 3.47Å; E140-N144 PolarHBondContact O-N 3.26Å; E140-N144 PolarHBondContact O-ND2 3.21Å; M141-N144 PolarHBondContact O-N 3.41Å
145	M	92.2	Very high	92.6	Very high	57 Å²	57	67.7 Å²	67.7	28%	0.281	33%	0.326	S	S	.	.	S	Bend	trans	-115.3	148	-178.5	-63	175.6	64.3	0	0	111	M141 E149 I150 K153	M141-M145 HydrophobicContact CB-CG 4.49Å; M141-M145 HydrophobicContact CB-SD 3.73Å; M141-M145 HydrophobicContact CE-SD 4.16Å; M141-M145 HydrophobicContact CG-SD 3.66Å; M141-M145 WeakPolarHBondContact O-CB 3.31Å; M141-M145 PolarHBondContact O-N 2.88Å; M145-E149 WeakPolarHBondContact CA-OE2 3.38Å; M145-E149 HydrophobicContact CB-CB 4.29Å; M145-E149 HydrophobicContact CE-CB 3.64Å; M145-I150 HydrophobicContact CB-CD1 4.26Å; M145-I150 HydrophobicContact CB-CG1 3.74Å; M145-I150 HydrophobicContact CE-CG1 4.47Å; M145-K153 HydrophobicContact CE-CB 4.42Å
146	Q	92.2	Very high	92.5	Very high	146 Å²	146	73.3 Å²	73.3	68%	0.682	35%	0.35	S	S	*	.			trans	-79.1	155.8	171.1	-63	-168.2	-5.4	0	0	111.4	A148 E149 I150	Q146-A148 PolarHBondContact O-N 3.15Å; Q146-A148 VanDerWaalsContact O-N 3.12Å; Q146-E149 HydrophobicContact CB-CG 4.4Å; Q146-E149 PolarHBondContact N-OE2 3.4Å; Q146-E149 WeakPolarHBondContact O-CA 3.42Å; Q146-E149 WeakPolarHBondContact O-CB 3.4Å; Q146-E149 PolarHBondContact O-N 2.88Å; Q146-I150 PolarHBondContact O-N 3.31Å
147	N	91	Very high	92.5	Very high	33 Å²	33	73.2 Å²	73.2	18%	0.176	35%	0.345	C	S	.	.	H	α-helix	trans	-52.7	-37.8	179.9	-80.4	-26.2	0	0	0	113.2	E149 I150 I151 S208 L209	N147-E149 VanDerWaalsContact C-N 3.33Å; N147-E149 PolarHBondContact O-N 3.5Å; N147-I150 PolarHBondContact O-N 3.34Å; N147-I151 WeakPolarHBondContact O-CB 3.43Å; N147-I151 VanDerWaalsContact O-CD1 3.31Å; N147-I151 WeakPolarHBondContact O-CD1 3.45Å; N147-I151 WeakPolarHBondContact O-CG1 3.27Å; N147-I151 PolarHBondContact O-N 3.05Å; N147-S208 PolarHBondContact ND2-OG 3.01Å; N147-L209 PolarHBondContact ND2-N 3.03Å
148	A	90.6	Very high	92.4	Very high	72 Å²	72	73.8 Å²	73.8	60%	0.595	35%	0.347	S	S	*	.	H	α-helix	trans	-62	-37.8	175.7	0	0	0	0	0	113.2	Q146 R152	Q146-A148 PolarHBondContact O-N 3.15Å; Q146-A148 VanDerWaalsContact O-N 3.12Å; A148-R152 WeakPolarHBondContact O-CB 3.45Å; A148-R152 PolarHBondContact O-N 3.09Å
149	E	93.1	Very high	92.1	Very high	97 Å²	97	72.2 Å²	72.2	45%	0.453	35%	0.35	S	S	.	.	H	α-helix	trans	-74.4	-38.9	178	-54.3	174.3	136.1	0	0	111	M145 Q146 N147 K153	M145-E149 WeakPolarHBondContact CA-OE2 3.38Å; M145-E149 HydrophobicContact CB-CB 4.29Å; M145-E149 HydrophobicContact CE-CB 3.64Å; Q146-E149 HydrophobicContact CB-CG 4.4Å; Q146-E149 PolarHBondContact N-OE2 3.4Å; Q146-E149 WeakPolarHBondContact O-CA 3.42Å; Q146-E149 WeakPolarHBondContact O-CB 3.4Å; Q146-E149 PolarHBondContact O-N 2.88Å; N147-E149 VanDerWaalsContact C-N 3.33Å; N147-E149 PolarHBondContact O-N 3.5Å; E149-K153 WeakPolarHBondContact O-CB 3.31Å; E149-K153 PolarHBondContact O-N 3.15Å
150	I	92.8	Very high	91.8	Very high	3 Å²	3	75.7 Å²	75.7	2%	0.015	37%	0.365	C	S	.	.	H	α-helix	trans	-62.7	-48.8	174.2	-64.3	172.5	0	0	0	110.1	V137 M141 M145 Q146 N147 R152 K153 M154	V137-I150 HydrophobicContact CG1-CG2 4.01Å; V137-I150 HydrophobicContact CG2-CG2 3.65Å; M141-I150 HydrophobicContact CE-CG2 4.35Å; M145-I150 HydrophobicContact CB-CD1 4.26Å; M145-I150 HydrophobicContact CB-CG1 3.74Å; M145-I150 HydrophobicContact CE-CG1 4.47Å; Q146-I150 PolarHBondContact O-N 3.31Å; N147-I150 PolarHBondContact O-N 3.34Å; I150-R152 PolarHBondContact O-N 3.46Å; I150-K153 CarbonylContact O-C 3.6Å; I150-K153 PolarHBondContact O-N 2.93Å; I150-K153 VanDerWaalsContact O-N 3.15Å; I150-M154 HydrophobicContact CG2-CG 4.26Å; I150-M154 VanDerWaalsContact O-CG 3.29Å; I150-M154 WeakPolarHBondContact O-CG 3.23Å; I150-M154 PolarHBondContact O-N 3.02Å
151	I	94.4	Very high	91.3	Very high	11 Å²	11	76.2 Å²	76.2	6%	0.056	37%	0.372	C	S	.	.	H	α-helix	trans	-64.4	-41.3	-179.7	-67	162.5	0	0	0	111.1	N147 K153 M154 T155 L213	N147-I151 WeakPolarHBondContact O-CB 3.43Å; N147-I151 VanDerWaalsContact O-CD1 3.31Å; N147-I151 WeakPolarHBondContact O-CD1 3.45Å; N147-I151 WeakPolarHBondContact O-CG1 3.27Å; N147-I151 PolarHBondContact O-N 3.05Å; I151-K153 VanDerWaalsContact C-N 3.34Å; I151-K153 PolarHBondContact O-N 3.11Å; I151-M154 CarbonylContact O-C 3.54Å; I151-M154 PolarHBondContact O-N 2.92Å; I151-T155 PolarHBondContact O-N 2.94Å; I151-T155 PolarHBondContact O-OG1 2.84Å; I151-L213 HydrophobicContact CD1-CD2 4.1Å; I151-L213 HydrophobicContact CD1-CG 3.96Å; I151-L213 HydrophobicContact CG1-CD2 3.73Å; I151-L213 HydrophobicContact CG1-CG 4.08Å; I151-L213 HydrophobicContact CG2-CD2 4.12Å
152	R	93.4	Very high	91.1	Very high	168 Å²	168	78.6 Å²	78.6	63%	0.634	39%	0.39	S	S	*	.	H	α-helix	trans	-57.4	-49.3	171.4	177	-178.7	165.3	161.9	2.3	110.6	A148 I150 M154 T155 E156	A148-R152 WeakPolarHBondContact O-CB 3.45Å; A148-R152 PolarHBondContact O-N 3.09Å; I150-R152 PolarHBondContact O-N 3.46Å; R152-M154 PolarHBondContact O-N 2.96Å; R152-T155 WeakPolarHBondContact O-CA 3.49Å; R152-T155 VanDerWaalsContact O-CB 3.26Å; R152-T155 WeakPolarHBondContact O-CB 3.25Å; R152-T155 PolarHBondContact O-N 3.13Å; R152-E156 IonicContact CZ-OE1 3.14Å; R152-E156 VanDerWaalsContact CZ-OE1 3.24Å; R152-E156 IonicContact NE-OE1 3.92Å; R152-E156 PolarHBondContact NE-OE1 3.24Å; R152-E156 IonicContact NH2-OE1 2.66Å; R152-E156 PolarHBondContact NH2-OE1 3.32Å; R152-E156 PolarHBondContact O-N 3.43Å
153	K	93.6	Very high	90.9	Very high	54 Å²	54	80.8 Å²	80.8	24%	0.235	42%	0.421	C	S	.	.	H	α-helix	trans	-65.7	-35.7	-179.9	-175.9	172	170.8	-162.4	0	112.9	M141 M145 E149 I150 I151 T155 E156 E157	M141-K153 HydrophobicContact CE-CB 4.37Å; M141-K153 HydrophobicContact CE-CD 3.7Å; M141-K153 HydrophobicContact CE-CG 4.24Å; M141-K153 HydrophobicContact SD-CD 4.07Å; M145-K153 HydrophobicContact CE-CB 4.42Å; E149-K153 WeakPolarHBondContact O-CB 3.31Å; E149-K153 PolarHBondContact O-N 3.15Å; I150-K153 CarbonylContact O-C 3.6Å; I150-K153 PolarHBondContact O-N 2.93Å; I150-K153 VanDerWaalsContact O-N 3.15Å; I151-K153 VanDerWaalsContact C-N 3.34Å; I151-K153 PolarHBondContact O-N 3.11Å; K153-T155 PolarHBondContact O-N 3.27Å; K153-E156 CarbonylContact O-C 3.58Å; K153-E156 PolarHBondContact O-N 3.08Å; K153-E157 WeakPolarHBondContact CE-OE1 3.45Å; K153-E157 WeakPolarHBondContact CE-OE2 3.26Å; K153-E157 HydrophobicContact CG-CG 4.4Å; K153-E157 IonicContact NZ-OE1 2.67Å; K153-E157 PolarHBondContact NZ-OE1 3.2Å; K153-E157 IonicContact NZ-OE2 2.73Å; K153-E157 WeakPolarHBondContact O-CB 3.4Å; K153-E157 PolarHBondContact O-N 2.91Å
154	M	95.8	Very high	90.9	Very high	0 Å²	0	77.7 Å²	77.7	0%	0	42%	0.416	C	S	.	.	H	α-helix	trans	-73.3	-10.2	172	-62.5	-68.1	90.2	0	0	113.4	I128 C133 V137 M141 I150 I151 R152 E157 F158 F221	I128-M154 HydrophobicContact CD1-CB 4.25Å; I128-M154 HydrophobicContact CD1-CG 4.16Å; I128-M154 HydrophobicContact CG1-CG 4.43Å; I128-M154 HydrophobicContact CG2-CB 4.4Å; I128-M154 HydrophobicContact CG2-CG 4.27Å; I128-M154 HydrophobicContact CG2-SD 4.03Å; C133-M154 PolarHBondContact SG-O 3.07Å; V137-M154 HydrophobicContact CG2-CG 3.86Å; V137-M154 HydrophobicContact CG2-SD 3.62Å; M141-M154 HydrophobicContact CE-CE 4.11Å; I150-M154 HydrophobicContact CG2-CG 4.26Å; I150-M154 VanDerWaalsContact O-CG 3.29Å; I150-M154 WeakPolarHBondContact O-CG 3.23Å; I150-M154 PolarHBondContact O-N 3.02Å; I151-M154 CarbonylContact O-C 3.54Å; I151-M154 PolarHBondContact O-N 2.92Å; R152-M154 PolarHBondContact O-N 2.96Å; M154-E157 HydrophobicContact CE-CB 4.19Å; M154-E157 WeakPolarHBondContact CE-OE2 3.49Å; M154-F158 PolarHBondContact O-N 2.72Å; M154-F221 HydrophobicContact CB-CE2 4.49Å; M154-F221 HydrophobicContact CB-CZ 3.92Å; M154-F221 WeakPolarHBondContact O-CZ 3.31Å
155	T	91.9	Very high	91.1	Very high	57 Å²	57	71.9 Å²	71.9	35%	0.35	38%	0.384	S	S	.	.	H	α-helix	trans	-86.1	-37.8	166	-51.9	0	0	0	0	110.7	I151 R152 K153 V218	I151-T155 PolarHBondContact O-N 2.94Å; I151-T155 PolarHBondContact O-OG1 2.84Å; R152-T155 WeakPolarHBondContact O-CA 3.49Å; R152-T155 VanDerWaalsContact O-CB 3.26Å; R152-T155 WeakPolarHBondContact O-CB 3.25Å; R152-T155 PolarHBondContact O-N 3.13Å; K153-T155 PolarHBondContact O-N 3.27Å; T155-V218 HydrophobicContact CG2-CG2 3.54Å
156	E	91.3	Very high	91.2	Very high	125 Å²	125	69.4 Å²	69.4	58%	0.584	37%	0.372	S	S	*	.	H	α-helix	trans	-71.3	-27.8	173.8	-66.7	171.5	179	0	0	112.6	R152 K153	R152-E156 IonicContact CZ-OE1 3.14Å; R152-E156 VanDerWaalsContact CZ-OE1 3.24Å; R152-E156 IonicContact NE-OE1 3.92Å; R152-E156 PolarHBondContact NE-OE1 3.24Å; R152-E156 IonicContact NH2-OE1 2.66Å; R152-E156 PolarHBondContact NH2-OE1 3.32Å; R152-E156 PolarHBondContact O-N 3.43Å; K153-E156 CarbonylContact O-C 3.58Å; K153-E156 PolarHBondContact O-N 3.08Å
157	E	92.8	Very high	91.4	Very high	64 Å²	64	63.2 Å²	63.2	30%	0.299	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106	26.3	175.5	-62.8	-177.7	168.6	0	0	112.5	G135 K153 M154	G135-E157 WeakPolarHBondContact CA-O 3.49Å; G135-E157 PolarHBondContact N-O 3.27Å; K153-E157 WeakPolarHBondContact CE-OE1 3.45Å; K153-E157 WeakPolarHBondContact CE-OE2 3.26Å; K153-E157 HydrophobicContact CG-CG 4.4Å; K153-E157 IonicContact NZ-OE1 2.67Å; K153-E157 PolarHBondContact NZ-OE1 3.2Å; K153-E157 IonicContact NZ-OE2 2.73Å; K153-E157 WeakPolarHBondContact O-CB 3.4Å; K153-E157 PolarHBondContact O-N 2.91Å; M154-E157 HydrophobicContact CE-CB 4.19Å; M154-E157 WeakPolarHBondContact CE-OE2 3.49Å
158	F	91.4	Very high	91.5	Very high	13 Å²	13	63.7 Å²	63.7	6%	0.057	35%	0.347	C	S	.	.			trans	-68.3	-42.6	-176.6	-161.5	-73.1	0	0	0	112.7	S131 C133 K134 M154 E160 V218 A220 F221	S131-F158 WeakPolarHBondContact O-CZ 3.47Å; C133-F158 HydrophobicContact CB-CD1 4.42Å; C133-F158 HydrophobicContact CB-CD2 3.63Å; C133-F158 HydrophobicContact CB-CE1 4.47Å; C133-F158 HydrophobicContact CB-CE2 3.7Å; C133-F158 HydrophobicContact CB-CG 4.02Å; C133-F158 HydrophobicContact CB-CZ 4.13Å; K134-F158 PolarHBondContact N-O 2.82Å; M154-F158 PolarHBondContact O-N 2.72Å; F158-E160 HydrophobicContact CD1-CB 3.82Å; F158-E160 HydrophobicContact CD1-CG 4.43Å; F158-E160 WeakPolarHBondContact CD1-OE2 3.08Å; F158-E160 HydrophobicContact CE1-CB 4.03Å; F158-V218 HydrophobicContact CD2-CG1 4.47Å; F158-V218 HydrophobicContact CE2-CG1 4.08Å; F158-A220 HydrophobicContact CE2-CB 4.18Å; F158-A220 HydrophobicContact CZ-CB 3.81Å; F158-F221 HydrophobicContact CD2-CD2 4.46Å; F158-F221 HydrophobicContact CD2-CE1 4.27Å; F158-F221 AromaticContact CD2-CE2 3.65Å; F158-F221 HydrophobicContact CD2-CE2 3.65Å; F158-F221 AromaticContact CD2-CZ 3.53Å; F158-F221 HydrophobicContact CD2-CZ 3.53Å; F158-F221 HydrophobicContact CE2-CD1 4.41Å; F158-F221 HydrophobicContact CE2-CD2 4.32Å; F158-F221 AromaticContact CE2-CE1 3.96Å; F158-F221 HydrophobicContact CE2-CE1 3.96Å; F158-F221 AromaticContact CE2-CE2 3.87Å; F158-F221 HydrophobicContact CE2-CE2 3.87Å; F158-F221 AromaticContact CE2-CZ 3.66Å; F158-F221 HydrophobicContact CE2-CZ 3.66Å
159	D	87.8	Confident	91.7	Very high	110 Å²	110	63.4 Å²	63.4	59%	0.588	34%	0.335	S	S	*	.			trans	58.9	48	174.1	-168.5	62.6	0	0	0	113.6	K134	K134-D159 HydrophobicContact CB-CB 4.28Å; K134-D159 HydrophobicContact CD-CB 4.02Å; K134-D159 VanDerWaalsContact CD-O 3.24Å; K134-D159 WeakPolarHBondContact CD-O 3.33Å; K134-D159 WeakPolarHBondContact CD-OD2 3.45Å; K134-D159 WeakPolarHBondContact CE-O 3.5Å; K134-D159 PolarHBondContact NZ-O 3.01Å; K134-D159 IonicContact NZ-OD2 3.9Å; K134-D159 PolarHBondContact NZ-OD2 3.09Å
160	E	86.6	Confident	91.6	Very high	122 Å²	122	62.8 Å²	62.8	57%	0.57	34%	0.339	S	S	*	.			trans	-75.2	141.9	179.4	65.2	-86.6	-146.2	0	0	114.7	F158 S162	F158-E160 HydrophobicContact CD1-CB 3.82Å; F158-E160 HydrophobicContact CD1-CG 4.43Å; F158-E160 WeakPolarHBondContact CD1-OE2 3.08Å; F158-E160 HydrophobicContact CE1-CB 4.03Å; E160-S162 WeakPolarHBondContact CB-O 3.32Å
161	D	80.9	Confident	91.6	Very high	149 Å²	149	64 Å²	64	80%	0.797	35%	0.352	S	S	*	.	S	Bend	trans	-93.5	-19.1	171.9	-53	-76.8	0	0	0	112.5	K134	K134-D161 WeakPolarHBondContact CE-OD2 3.36Å; K134-D161 IonicContact NZ-OD1 3.66Å; K134-D161 PolarHBondContact NZ-OD1 2.99Å; K134-D161 IonicContact NZ-OD2 3.29Å; K134-D161 PolarHBondContact NZ-OD2 2.87Å
162	S	87.9	Confident	91.5	Very high	60 Å²	60	69 Å²	69	42%	0.42	39%	0.385	S	S	.	.	S	Bend	trans	-152.8	178.8	176.1	77.5	0	0	0	0	110.6	E160 D164	E160-S162 WeakPolarHBondContact CB-O 3.32Å; S162-D164 WeakPolarHBondContact CB-OD2 3.25Å; S162-D164 PolarHBondContact O-N 2.78Å; S162-D164 WeakPolarHBondContact OG-CB 3.28Å; S162-D164 PolarHBondContact OG-N 2.67Å; S162-D164 PolarHBondContact OG-OD2 3.22Å
163	G	85.6	Confident	91.5	Very high	76 Å²	76	66.2 Å²	66.2	78%	0.784	38%	0.381	S	S	*	.	S	Bend	trans	-74	4.4	173.8	0	0	0	0	0	115.2
164	D	91.4	Very high	91.5	Very high	83 Å²	83	65.7 Å²	65.7	44%	0.444	38%	0.378	S	S	.	.			trans	-91.1	150.5	-172	-58.2	-71.3	0	0	0	113.2	S162 M169	S162-D164 WeakPolarHBondContact CB-OD2 3.25Å; S162-D164 PolarHBondContact O-N 2.78Å; S162-D164 WeakPolarHBondContact OG-CB 3.28Å; S162-D164 PolarHBondContact OG-N 2.67Å; S162-D164 PolarHBondContact OG-OD2 3.22Å; D164-M169 HydrophobicContact CB-CG 4.43Å; D164-M169 HydrophobicContact CB-SD 3.66Å
165	Y	95.5	Very high	91.4	Very high	9 Å²	9	73.4 Å²	73.4	4%	0.035	41%	0.411	C	S	.	.			trans	-146	163.2	178	56.3	-78.5	0	0	0	110.3	S131 L167 T168 M169 R219 A220 H223	S131-Y165 WeakPolarHBondContact O-CB 3.48Å; Y165-L167 HydrophobicContact CD2-CB 4.23Å; Y165-L167 HydrophobicContact CE2-CB 4.05Å; Y165-L167 PolarHBondContact O-N 2.84Å; Y165-T168 HydrophobicContact CD1-CG2 4.32Å; Y165-T168 HydrophobicContact CE1-CG2 3.57Å; Y165-T168 HydrophobicContact CE2-CG2 4.13Å; Y165-T168 VanDerWaalsContact CZ-CG2 3.44Å; Y165-T168 PolarHBondContact N-OG1 2.75Å; Y165-T168 PolarHBondContact O-N 2.75Å; Y165-T168 PolarHBondContact O-OG1 3.02Å; Y165-T168 WeakPolarHBondContact OH-CG2 3.48Å; Y165-M169 WeakPolarHBondContact O-CG 3.36Å; Y165-M169 PolarHBondContact O-N 3.23Å; Y165-R219 HydrophobicContact CE1-CG 4.33Å; Y165-R219 PolarHBondContact OH-NE 2.87Å; Y165-A220 HydrophobicContact CD1-CB 3.68Å; Y165-A220 HydrophobicContact CD2-CB 3.88Å; Y165-A220 HydrophobicContact CE1-CB 4.25Å; Y165-A220 HydrophobicContact CE2-CB 4.4Å; Y165-A220 HydrophobicContact CG-CB 3.5Å; Y165-H223 HydrophobicContact CE2-CB 3.94Å; Y165-H223 AromaticContact CE2-ND1 3.54Å; Y165-H223 AromaticContact CZ-ND1 3.65Å; Y165-H223 PolarHBondContact OH-ND1 2.96Å
166	P	95.9	Very high	91.5	Very high	6 Å²	6	75 Å²	75	4%	0.039	41%	0.413	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-11.1	-168.5	-34.9	40.7	0	0	0	118.7	F91 C130 W174 F177	F91-P166 HydrophobicContact CE2-CG 4.17Å; F91-P166 HydrophobicContact CZ-CG 4.12Å; C130-P166 WeakPolarHBondContact O-CB 3.43Å; C130-P166 WeakPolarHBondContact O-CG 3.29Å; P166-W174 HydrophobicContact CB-CE3 3.92Å; P166-W174 HydrophobicContact CB-CH2 4.37Å; P166-W174 HydrophobicContact CB-CZ3 3.54Å; P166-W174 HydrophobicContact CG-CH2 4.24Å; P166-W174 HydrophobicContact CG-CZ3 3.83Å; P166-F177 HydrophobicContact CB-CD1 3.84Å; P166-F177 HydrophobicContact CB-CE1 3.33Å; P166-F177 HydrophobicContact CB-CZ 4Å; P166-F177 WeakPolarHBondContact O-CD1 2.92Å
167	L	95.3	Very high	91.7	Very high	15 Å²	15	69.1 Å²	69.1	8%	0.079	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.4	-17.3	176.9	-63.1	-178.9	0	0	0	114.7	Y165 F177 R178 T224 L227	Y165-L167 HydrophobicContact CD2-CB 4.23Å; Y165-L167 HydrophobicContact CE2-CB 4.05Å; Y165-L167 PolarHBondContact O-N 2.84Å; L167-F177 HydrophobicContact CD2-CE1 4.16Å; L167-R178 HydrophobicContact CD2-CB 4.11Å; L167-R178 HydrophobicContact CD2-CG 3.95Å; L167-T224 HydrophobicContact CD1-CG2 4.19Å; L167-L227 HydrophobicContact CD1-CB 4.43Å; L167-L227 HydrophobicContact CD1-CD2 3.75Å; L167-L227 HydrophobicContact CD2-CD2 3.83Å; L167-L227 HydrophobicContact CG-CD2 4.47Å
168	T	94.4	Very high	91.9	Very high	43 Å²	43	70.6 Å²	70.6	26%	0.264	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.2	-24.1	173	55.2	0	0	0	0	113.1	Y165	Y165-T168 HydrophobicContact CD1-CG2 4.32Å; Y165-T168 HydrophobicContact CE1-CG2 3.57Å; Y165-T168 HydrophobicContact CE2-CG2 4.13Å; Y165-T168 VanDerWaalsContact CZ-CG2 3.44Å; Y165-T168 PolarHBondContact N-OG1 2.75Å; Y165-T168 PolarHBondContact O-N 2.75Å; Y165-T168 PolarHBondContact O-OG1 3.02Å; Y165-T168 WeakPolarHBondContact OH-CG2 3.48Å
169	M	93.8	Very high	92.1	Very high	67 Å²	67	77.3 Å²	77.3	33%	0.33	42%	0.415	S	S	.	.			trans	-53.9	127.6	-179.7	-71.1	-71	-71.2	0	0	112.5	D164 Y165 W174	D164-M169 HydrophobicContact CB-CG 4.43Å; D164-M169 HydrophobicContact CB-SD 3.66Å; Y165-M169 WeakPolarHBondContact O-CG 3.36Å; Y165-M169 PolarHBondContact O-N 3.23Å; M169-W174 HydrophobicContact CB-CB 3.99Å; M169-W174 VanDerWaalsContact CB-CD1 3.42Å; M169-W174 HydrophobicContact CB-CD2 3.79Å; M169-W174 HydrophobicContact CB-CG 3.48Å; M169-W174 VanDerWaalsContact CB-CG 3.48Å; M169-W174 HydrophobicContact CE-CZ2 4.19Å; M169-W174 HydrophobicContact CG-CD2 4.3Å; M169-W174 HydrophobicContact CG-CG 4.46Å; M169-W174 HydrophobicContact CG-CZ2 4.29Å; M169-W174 VanDerWaalsContact O-CB 3.28Å; M169-W174 WeakPolarHBondContact O-CB 3.48Å
170	P	91.2	Very high	92.5	Very high	83 Å²	83	72.5 Å²	72.5	54%	0.539	39%	0.389	S	S	.	.			trans	-74.7	171.9	-178.3	29.2	-34.9	0	0	0	113.6
171	G	92.3	Very high	93.1	Very high	29 Å²	29	66.7 Å²	66.7	30%	0.299	36%	0.362	S	S	.	.	S	Bend	trans	88.4	170.4	171.4	0	0	0	0	0	117	M173 W174 K175	G171-M173 PolarHBondContact O-N 2.98Å; G171-W174 PolarHBondContact O-N 2.89Å; G171-K175 WeakPolarHBondContact O-CG 3.36Å; G171-K175 PolarHBondContact O-N 2.95Å
172	P	92.6	Very high	93.9	Very high	115 Å²	115	60.7 Å²	60.7	75%	0.747	33%	0.331	S	S	*	.	H	α-helix	trans	-67.1	-32.1	-166.9	-23.9	35.2	0	0	0	115.2	K176	P172-K176 WeakPolarHBondContact O-CB 3.26Å; P172-K176 PolarHBondContact O-N 3.18Å
173	M	93.4	Very high	94.3	Very high	111 Å²	111	61 Å²	61	55%	0.547	33%	0.326	S	S	.	.	H	α-helix	trans	-63.4	-45	-179.7	-173	-170.9	-62.5	0	0	111.4	G171 K176 F177	G171-M173 PolarHBondContact O-N 2.98Å; M173-K176 WeakPolarHBondContact O-CB 3.28Å; M173-K176 PolarHBondContact O-N 2.81Å; M173-F177 PolarHBondContact O-N 3.4Å
174	W	94	Very high	94.9	Very high	43 Å²	43	57.3 Å²	57.3	16%	0.163	29%	0.289	C	S	.	.	H	α-helix	trans	-78.2	-33.6	-177.3	-62.3	111.4	0	0	0	112	F91 K95 P166 M169 G171 K176 F177 R178	F91-W174 HydrophobicContact CZ-CZ3 4.35Å; K95-W174 HydrophobicContact CD-CH2 4.16Å; K95-W174 HydrophobicContact CD-CZ3 4.04Å; K95-W174 HydrophobicContact CG-CZ3 4.48Å; P166-W174 HydrophobicContact CB-CE3 3.92Å; P166-W174 HydrophobicContact CB-CH2 4.37Å; P166-W174 HydrophobicContact CB-CZ3 3.54Å; P166-W174 HydrophobicContact CG-CH2 4.24Å; P166-W174 HydrophobicContact CG-CZ3 3.83Å; M169-W174 HydrophobicContact CB-CB 3.99Å; M169-W174 VanDerWaalsContact CB-CD1 3.42Å; M169-W174 HydrophobicContact CB-CD2 3.79Å; M169-W174 HydrophobicContact CB-CG 3.48Å; M169-W174 VanDerWaalsContact CB-CG 3.48Å; M169-W174 HydrophobicContact CE-CZ2 4.19Å; M169-W174 HydrophobicContact CG-CD2 4.3Å; M169-W174 HydrophobicContact CG-CG 4.46Å; M169-W174 HydrophobicContact CG-CZ2 4.29Å; M169-W174 VanDerWaalsContact O-CB 3.28Å; M169-W174 WeakPolarHBondContact O-CB 3.48Å; G171-W174 PolarHBondContact O-N 2.89Å; W174-K176 VanDerWaalsContact C-N 3.31Å; W174-K176 PolarHBondContact O-N 3.22Å; W174-F177 HydrophobicContact CE3-CB 4.24Å; W174-F177 HydrophobicContact CE3-CD1 4.02Å; W174-F177 HydrophobicContact CE3-CG 4.25Å; W174-F177 HydrophobicContact CZ3-CD1 4.43Å; W174-F177 PolarHBondContact O-N 3.2Å; W174-R178 PolarHBondContact O-N 3.01Å
175	K	93.1	Very high	95.2	Very high	161 Å²	161	53.7 Å²	53.7	70%	0.7	27%	0.269	S	S	*	.	H	α-helix	trans	-56.3	-43.1	165	-70.7	176.9	-179.7	176	0	111.6	G171 Y179	G171-K175 WeakPolarHBondContact O-CG 3.36Å; G171-K175 PolarHBondContact O-N 2.95Å; K175-Y179 PolarHBondContact O-N 2.6Å
176	K	94.1	Very high	95.3	Very high	92 Å²	92	53.8 Å²	53.8	40%	0.4	27%	0.273	S	S	.	.	H	α-helix	trans	-66.3	-44.3	173.1	-168.5	-163.5	175.7	-165.5	0	112.1	L96 G97 P172 M173 W174 R178 Y179 N180	L96-K176 PolarHBondContact O-NZ 3.04Å; G97-K176 PolarHBondContact O-NZ 3.36Å; P172-K176 WeakPolarHBondContact O-CB 3.26Å; P172-K176 PolarHBondContact O-N 3.18Å; M173-K176 WeakPolarHBondContact O-CB 3.28Å; M173-K176 PolarHBondContact O-N 2.81Å; W174-K176 VanDerWaalsContact C-N 3.31Å; W174-K176 PolarHBondContact O-N 3.22Å; K176-R178 PolarHBondContact O-N 3.37Å; K176-Y179 WeakPolarHBondContact O-CB 3.45Å; K176-Y179 PolarHBondContact O-N 3.35Å; K176-N180 PolarHBondContact O-N 3.48Å; K176-N180 PolarHBondContact O-OD1 3.48Å
177	F	96.6	Very high	95.3	Very high	0 Å²	0	54 Å²	54	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-57.6	-46.3	176.5	162.9	-101	0	0	0	111.9	F91 V94 K95 C130 P166 L167 M173 W174 Y179 N180 F181	F91-F177 AromaticContact CD2-CE2 3.84Å; F91-F177 HydrophobicContact CD2-CE2 3.84Å; F91-F177 HydrophobicContact CD2-CZ 4.24Å; F91-F177 HydrophobicContact CE2-CD2 4.37Å; F91-F177 AromaticContact CE2-CE2 3.71Å; F91-F177 HydrophobicContact CE2-CE2 3.71Å; F91-F177 AromaticContact CE2-CZ 3.88Å; F91-F177 HydrophobicContact CE2-CZ 3.88Å; V94-F177 HydrophobicContact CG1-CD2 4.43Å; V94-F177 HydrophobicContact CG1-CE2 4.41Å; K95-F177 HydrophobicContact CB-CD2 4.04Å; K95-F177 HydrophobicContact CG-CD2 4.49Å; C130-F177 HydrophobicContact CB-CZ 3.93Å; P166-F177 HydrophobicContact CB-CD1 3.84Å; P166-F177 HydrophobicContact CB-CE1 3.33Å; P166-F177 HydrophobicContact CB-CZ 4Å; P166-F177 WeakPolarHBondContact O-CD1 2.92Å; L167-F177 HydrophobicContact CD2-CE1 4.16Å; M173-F177 PolarHBondContact O-N 3.4Å; W174-F177 HydrophobicContact CE3-CB 4.24Å; W174-F177 HydrophobicContact CE3-CD1 4.02Å; W174-F177 HydrophobicContact CE3-CG 4.25Å; W174-F177 HydrophobicContact CZ3-CD1 4.43Å; W174-F177 PolarHBondContact O-N 3.2Å; F177-Y179 VanDerWaalsContact C-N 3.27Å; F177-Y179 PolarHBondContact O-N 2.91Å; F177-N180 PolarHBondContact O-N 3.09Å; F177-N180 VanDerWaalsContact O-N 3.14Å; F177-F181 HydrophobicContact CE2-CB 4.23Å; F177-F181 HydrophobicContact CZ-CB 4.19Å; F177-F181 HydrophobicContact CZ-CD2 4.24Å; F177-F181 HydrophobicContact CZ-CG 4.33Å; F177-F181 VanDerWaalsContact O-CB 3.3Å; F177-F181 WeakPolarHBondContact O-CB 3.42Å; F177-F181 PolarHBondContact O-N 3.01Å
178	R	96.2	Very high	95.4	Very high	95 Å²	95	53.6 Å²	53.6	36%	0.358	27%	0.272	S	S	.	.	H	α-helix	trans	-57.8	-39.2	177.3	-179	172.7	174.7	171.3	-1.3	112.1	L167 W174 K176 C182 L227	L167-R178 HydrophobicContact CD2-CB 4.11Å; L167-R178 HydrophobicContact CD2-CG 3.95Å; W174-R178 PolarHBondContact O-N 3.01Å; K176-R178 PolarHBondContact O-N 3.37Å; R178-C182 PolarHBondContact O-N 3.32Å; R178-C182 PolarHBondContact O-SG 2.75Å; R178-L227 HydrophobicContact CG-CD2 4.31Å
179	Y	95.9	Very high	95.5	Very high	154 Å²	154	51.7 Å²	51.7	60%	0.604	26%	0.26	S	S	*	.	H	α-helix	trans	-64.1	-54.5	171.6	178.9	-88.8	0	0	0	111.7	K175 K176 F177 F181 C182 E183	K175-Y179 PolarHBondContact O-N 2.6Å; K176-Y179 WeakPolarHBondContact O-CB 3.45Å; K176-Y179 PolarHBondContact O-N 3.35Å; F177-Y179 VanDerWaalsContact C-N 3.27Å; F177-Y179 PolarHBondContact O-N 2.91Å; Y179-F181 VanDerWaalsContact C-N 3.27Å; Y179-F181 PolarHBondContact O-N 3.38Å; Y179-C182 WeakPolarHBondContact O-CB 3.31Å; Y179-C182 PolarHBondContact O-N 3Å; Y179-C182 VanDerWaalsContact O-N 3.12Å; Y179-E183 HydrophobicContact CE1-CB 4.37Å; Y179-E183 PolarHBondContact O-N 3.47Å
180	N	96.9	Very high	95.5	Very high	9 Å²	9	53.4 Å²	53.4	5%	0.048	26%	0.263	C	S	.	.	H	α-helix	trans	-57.9	-38	-178	-61.9	-7.6	0	0	0	112.3	V94 M101 K176 F177 E183 F184	V94-N180 HydrophobicContact CG1-CB 3.8Å; V94-N180 WeakPolarHBondContact O-CB 3.37Å; V94-N180 PolarHBondContact O-ND2 3.25Å; M101-N180 HydrophobicContact CE-CB 3.75Å; M101-N180 WeakPolarHBondContact CE-O 3.33Å; K176-N180 PolarHBondContact O-N 3.48Å; K176-N180 PolarHBondContact O-OD1 3.48Å; F177-N180 PolarHBondContact O-N 3.09Å; F177-N180 VanDerWaalsContact O-N 3.14Å; N180-E183 PolarHBondContact O-N 3.19Å; N180-F184 WeakPolarHBondContact O-CB 3.22Å; N180-F184 PolarHBondContact O-N 3.48Å
181	F	97.9	Very high	95.7	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-63.5	-46.6	176.3	177.2	-107.5	0	0	0	111.8	F126 F127 C130 F177 Y179 E183 I185 T224 L227 A228	F126-F181 AromaticContact CE1-CD2 3.98Å; F126-F181 HydrophobicContact CE1-CD2 3.98Å; F126-F181 AromaticContact CE1-CE2 3.88Å; F126-F181 HydrophobicContact CE1-CE2 3.88Å; F126-F181 AromaticContact CZ-CD2 3.67Å; F126-F181 HydrophobicContact CZ-CD2 3.67Å; F126-F181 HydrophobicContact CZ-CE2 4.03Å; F127-F181 HydrophobicContact CD1-CE2 4.08Å; F127-F181 HydrophobicContact CD1-CZ 4.17Å; F127-F181 HydrophobicContact CE1-CE2 4.26Å; F127-F181 HydrophobicContact CE1-CZ 4.34Å; C130-F181 HydrophobicContact CB-CD2 4.01Å; C130-F181 HydrophobicContact CB-CE2 3.55Å; C130-F181 HydrophobicContact CB-CZ 4.24Å; C130-F181 VanDerWaalsContact SG-CD2 3.53Å; C130-F181 VanDerWaalsContact SG-CE2 3.52Å; F177-F181 HydrophobicContact CE2-CB 4.23Å; F177-F181 HydrophobicContact CZ-CB 4.19Å; F177-F181 HydrophobicContact CZ-CD2 4.24Å; F177-F181 HydrophobicContact CZ-CG 4.33Å; F177-F181 VanDerWaalsContact O-CB 3.3Å; F177-F181 WeakPolarHBondContact O-CB 3.42Å; F177-F181 PolarHBondContact O-N 3.01Å; Y179-F181 VanDerWaalsContact C-N 3.27Å; Y179-F181 PolarHBondContact O-N 3.38Å; F181-E183 VanDerWaalsContact C-N 3.34Å; F181-I185 HydrophobicContact CD1-CD1 4.39Å; F181-I185 HydrophobicContact CE1-CD1 4.06Å; F181-I185 HydrophobicContact CE2-CD1 4.26Å; F181-I185 HydrophobicContact CZ-CD1 4Å; F181-I185 WeakPolarHBondContact O-CG1 3.33Å; F181-I185 PolarHBondContact O-N 3.24Å; F181-T224 HydrophobicContact CE1-CG2 4.22Å; F181-T224 HydrophobicContact CE2-CG2 4.44Å; F181-T224 HydrophobicContact CZ-CG2 3.74Å; F181-L227 HydrophobicContact CD1-CD2 4.12Å; F181-L227 HydrophobicContact CD1-CG 4.46Å; F181-L227 HydrophobicContact CE1-CD2 4.19Å; F181-L227 HydrophobicContact CE1-CG 4.24Å; F181-A228 HydrophobicContact CE1-CB 4.21Å; F181-A228 HydrophobicContact CZ-CB 3.89Å
182	C	97.8	Very high	95.8	Very high	24 Å²	24	51.5 Å²	51.5	16%	0.162	24%	0.239	C	C	.	.	H	α-helix	trans	-64.6	-39.2	174.5	-64.7	0	0	0	0	111.9	R178 Y179 G186 K231	R178-C182 PolarHBondContact O-N 3.32Å; R178-C182 PolarHBondContact O-SG 2.75Å; Y179-C182 WeakPolarHBondContact O-CB 3.31Å; Y179-C182 PolarHBondContact O-N 3Å; Y179-C182 VanDerWaalsContact O-N 3.12Å; C182-G186 PolarHBondContact O-N 2.85Å; C182-K231 HydrophobicContact CB-CD 3.89Å; C182-K231 HydrophobicContact CB-CG 4.02Å
183	E	96.7	Very high	95.8	Very high	65 Å²	65	46.9 Å²	46.9	30%	0.304	21%	0.208	S	C	.	.	H	α-helix	trans	-65.4	-47.4	177.6	-164.9	-164.7	169.5	0	0	111.3	M101 Y179 N180 F181 I185 G186 V187	M101-E183 HydrophobicContact CB-CG 4.23Å; M101-E183 WeakPolarHBondContact CB-OE1 3.4Å; M101-E183 HydrophobicContact CG-CB 4.31Å; M101-E183 HydrophobicContact CG-CG 4.04Å; Y179-E183 HydrophobicContact CE1-CB 4.37Å; Y179-E183 PolarHBondContact O-N 3.47Å; N180-E183 PolarHBondContact O-N 3.19Å; F181-E183 VanDerWaalsContact C-N 3.34Å; E183-I185 PolarHBondContact O-N 2.91Å; E183-G186 CarbonylContact O-C 3.54Å; E183-G186 PolarHBondContact O-N 3.01Å; E183-G186 VanDerWaalsContact O-N 3.15Å; E183-V187 HydrophobicContact CG-CG2 4Å; E183-V187 WeakPolarHBondContact O-CB 3.41Å; E183-V187 VanDerWaalsContact O-CG2 3.29Å; E183-V187 WeakPolarHBondContact O-CG2 3.11Å; E183-V187 PolarHBondContact O-N 3.2Å
184	F	98.1	Very high	95.6	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-52	-54.2	-179.9	176.3	-101.3	0	0	0	111.8	L90 V94 M101 V104 V105 L123 F126 N180 G186 V187 L188	L90-F184 HydrophobicContact CD1-CE2 4.07Å; L90-F184 HydrophobicContact CD1-CZ 4.28Å; L90-F184 HydrophobicContact CD2-CE1 4.33Å; L90-F184 HydrophobicContact CD2-CE2 4.43Å; L90-F184 HydrophobicContact CD2-CZ 3.81Å; L90-F184 HydrophobicContact CG-CZ 4.45Å; V94-F184 HydrophobicContact CG2-CB 4.41Å; V94-F184 HydrophobicContact CG2-CD2 4.2Å; V94-F184 HydrophobicContact CG2-CG 4.28Å; M101-F184 HydrophobicContact CE-CB 4.48Å; M101-F184 HydrophobicContact CG-CB 4.28Å; M101-F184 HydrophobicContact SD-CB 3.62Å; M101-F184 HydrophobicContact SD-CD2 3.81Å; M101-F184 HydrophobicContact SD-CG 4.21Å; V104-F184 HydrophobicContact CG1-CE2 4.31Å; V105-F184 HydrophobicContact CG2-CD2 3.75Å; V105-F184 HydrophobicContact CG2-CE2 3.66Å; L123-F184 HydrophobicContact CD1-CE1 3.85Å; L123-F184 HydrophobicContact CD1-CZ 4.33Å; F126-F184 HydrophobicContact CD1-CD1 4.37Å; F126-F184 HydrophobicContact CD1-CE1 4.11Å; F126-F184 AromaticContact CE1-CD1 3.5Å; F126-F184 HydrophobicContact CE1-CD1 3.5Å; F126-F184 AromaticContact CE1-CE1 3.7Å; F126-F184 HydrophobicContact CE1-CE1 3.7Å; F126-F184 HydrophobicContact CE1-CG 4.48Å; F126-F184 AromaticContact CZ-CD1 3.65Å; F126-F184 HydrophobicContact CZ-CD1 3.65Å; F126-F184 HydrophobicContact CZ-CE1 4.12Å; F126-F184 HydrophobicContact CZ-CG 4.21Å; N180-F184 WeakPolarHBondContact O-CB 3.22Å; N180-F184 PolarHBondContact O-N 3.48Å; F184-G186 VanDerWaalsContact C-N 3.34Å; F184-G186 PolarHBondContact O-N 2.96Å; F184-V187 PolarHBondContact O-N 3.15Å; F184-L188 HydrophobicContact CE1-CD2 4.09Å; F184-L188 HydrophobicContact CZ-CD2 4.27Å; F184-L188 VanDerWaalsContact O-CB 3.31Å; F184-L188 WeakPolarHBondContact O-CB 3.4Å; F184-L188 PolarHBondContact O-N 3.06Å
185	I	97.9	Very high	95.5	Very high	6 Å²	6	51 Å²	51	3%	0.031	23%	0.23	C	C	.	.	H	α-helix	trans	-60	-46.8	179.3	-59.7	167.8	0	0	0	110.1	F127 F181 E183 V187 L188 I189 A228 K231 L232	F127-I185 HydrophobicContact CE1-CD1 3.87Å; F127-I185 HydrophobicContact CE1-CG1 4.16Å; F127-I185 HydrophobicContact CZ-CG1 4.43Å; F181-I185 HydrophobicContact CD1-CD1 4.39Å; F181-I185 HydrophobicContact CE1-CD1 4.06Å; F181-I185 HydrophobicContact CE2-CD1 4.26Å; F181-I185 HydrophobicContact CZ-CD1 4Å; F181-I185 WeakPolarHBondContact O-CG1 3.33Å; F181-I185 PolarHBondContact O-N 3.24Å; E183-I185 PolarHBondContact O-N 2.91Å; I185-V187 VanDerWaalsContact C-N 3.33Å; I185-V187 PolarHBondContact O-N 2.99Å; I185-L188 PolarHBondContact O-N 2.91Å; I185-I189 WeakPolarHBondContact O-CG1 3.44Å; I185-I189 PolarHBondContact O-N 3.03Å; I185-A228 HydrophobicContact CD1-CB 3.67Å; I185-K231 HydrophobicContact CG2-CB 4.3Å; I185-L232 HydrophobicContact CG2-CB 4.1Å
186	G	96.4	Very high	95.6	Very high	12 Å²	12	44.2 Å²	44.2	12%	0.124	20%	0.201	C	C	.	.	H	α-helix	trans	-64	-33.7	179	0	0	0	0	0	113.7	C182 E183 F184 R190	C182-G186 PolarHBondContact O-N 2.85Å; E183-G186 CarbonylContact O-C 3.54Å; E183-G186 PolarHBondContact O-N 3.01Å; E183-G186 VanDerWaalsContact O-N 3.15Å; F184-G186 VanDerWaalsContact C-N 3.34Å; F184-G186 PolarHBondContact O-N 2.96Å; G186-R190 WeakPolarHBondContact O-CG 3.36Å; G186-R190 PolarHBondContact O-NE 2.65Å; G186-R190 PolarHBondContact O-NH2 3.07Å
187	V	97.2	Very high	95.6	Very high	9 Å²	9	39.9 Å²	39.9	6%	0.055	18%	0.182	C	C	.	.	H	α-helix	trans	-77.2	-43.5	177	176.7	0	0	0	0	111	M101 Q102 V105 E183 F184 I185 I189 R190 Q191	M101-V187 HydrophobicContact CG-CG2 4.28Å; Q102-V187 HydrophobicContact CB-CG1 4.1Å; Q102-V187 HydrophobicContact CG-CG1 4.45Å; V105-V187 HydrophobicContact CB-CG1 4.09Å; V105-V187 HydrophobicContact CG1-CG1 4.19Å; V105-V187 HydrophobicContact CG2-CB 4.14Å; V105-V187 HydrophobicContact CG2-CG1 3.92Å; E183-V187 HydrophobicContact CG-CG2 4Å; E183-V187 WeakPolarHBondContact O-CB 3.41Å; E183-V187 VanDerWaalsContact O-CG2 3.29Å; E183-V187 WeakPolarHBondContact O-CG2 3.11Å; E183-V187 PolarHBondContact O-N 3.2Å; F184-V187 PolarHBondContact O-N 3.15Å; I185-V187 VanDerWaalsContact C-N 3.33Å; I185-V187 PolarHBondContact O-N 2.99Å; V187-I189 PolarHBondContact O-N 3.28Å; V187-R190 PolarHBondContact O-N 3.44Å; V187-R190 VanDerWaalsContact O-N 3.14Å; V187-Q191 HydrophobicContact CG1-CG 4.26Å; V187-Q191 PolarHBondContact O-N 3.1Å
188	L	97.3	Very high	95.6	Very high	7 Å²	7	42.1 Å²	42.1	4%	0.037	19%	0.191	C	C	.	.	H	α-helix	trans	-50.8	-55.2	179.3	176.5	57.1	0	0	0	111.9	V105 W108 I109 L123 F184 I185 R190 Q191 C192 M202	V105-L188 HydrophobicContact CG1-CB 4.4Å; V105-L188 HydrophobicContact CG1-CD1 4.16Å; V105-L188 HydrophobicContact CG2-CB 4.13Å; W108-L188 HydrophobicContact CD2-CD1 4.46Å; W108-L188 HydrophobicContact CE3-CD1 3.54Å; W108-L188 HydrophobicContact CZ3-CD1 3.68Å; I109-L188 HydrophobicContact CD1-CD1 4.42Å; I109-L188 HydrophobicContact CG1-CD1 4.27Å; L123-L188 HydrophobicContact CD1-CD2 4.26Å; L123-L188 HydrophobicContact CD2-CD2 4.14Å; F184-L188 HydrophobicContact CE1-CD2 4.09Å; F184-L188 HydrophobicContact CZ-CD2 4.27Å; F184-L188 VanDerWaalsContact O-CB 3.31Å; F184-L188 WeakPolarHBondContact O-CB 3.4Å; F184-L188 PolarHBondContact O-N 3.06Å; I185-L188 PolarHBondContact O-N 2.91Å; L188-R190 VanDerWaalsContact C-N 3.32Å; L188-R190 PolarHBondContact O-N 3.36Å; L188-Q191 PolarHBondContact O-N 3.28Å; L188-C192 PolarHBondContact O-N 3.39Å; L188-C192 PolarHBondContact O-SG 2.73Å; L188-C192 VanDerWaalsContact O-SG 3.41Å; L188-M202 HydrophobicContact CD1-CE 4.34Å; L188-M202 HydrophobicContact CD2-CE 3.83Å; L188-M202 HydrophobicContact CG-CE 4.1Å
189	I	96.9	Very high	95.5	Very high	3 Å²	3	39.1 Å²	39.1	2%	0.015	18%	0.182	C	C	.	.	H	α-helix	trans	-63.9	-37.6	-179	-59.2	-60.8	0	0	0	111.8	I185 V187 Q191 C192 Q193 I197 M203 L232 A235 L236 V239	I185-I189 WeakPolarHBondContact O-CG1 3.44Å; I185-I189 PolarHBondContact O-N 3.03Å; V187-I189 PolarHBondContact O-N 3.28Å; I189-Q191 PolarHBondContact O-N 3.47Å; I189-C192 PolarHBondContact O-N 2.85Å; I189-Q193 PolarHBondContact O-N 3.16Å; I189-I197 HydrophobicContact CG2-CD1 3.76Å; I189-M203 HydrophobicContact CD1-CE 4.11Å; I189-M203 HydrophobicContact CD1-SD 3.55Å; I189-M203 VanDerWaalsContact CD1-SD 3.55Å; I189-L232 HydrophobicContact CD1-CD1 3.37Å; I189-L232 HydrophobicContact CG1-CD1 3.55Å; I189-A235 HydrophobicContact CB-CB 3.68Å; I189-A235 HydrophobicContact CG1-CB 4.16Å; I189-A235 HydrophobicContact CG2-CB 3.66Å; I189-L236 HydrophobicContact CG2-CD2 4.43Å; I189-V239 HydrophobicContact CG2-CG2 4.3Å
190	R	93.3	Very high	95.3	Very high	104 Å²	104	40.1 Å²	40.1	39%	0.392	19%	0.192	S	C	.	.	H	α-helix	trans	-67.5	-29.6	176	-80.2	-179.2	-70.1	149.8	-1	113.6	G186 V187 L188 Q193	G186-R190 WeakPolarHBondContact O-CG 3.36Å; G186-R190 PolarHBondContact O-NE 2.65Å; G186-R190 PolarHBondContact O-NH2 3.07Å; V187-R190 PolarHBondContact O-N 3.44Å; V187-R190 VanDerWaalsContact O-N 3.14Å; L188-R190 VanDerWaalsContact C-N 3.32Å; L188-R190 PolarHBondContact O-N 3.36Å; R190-Q193 WeakPolarHBondContact O-CG 3.39Å; R190-Q193 PolarHBondContact O-NE2 3.41Å
191	Q	95	Very high	95.2	Very high	71 Å²	71	43.1 Å²	43.1	33%	0.332	20%	0.203	S	C	.	.	H	α-helix	trans	-80.2	-35.1	172.9	-60.1	-53.9	-20.1	0	0	111.8	Q102 V105 I109 V187 L188 I189 Q193	Q102-Q191 VanDerWaalsContact CD-NE2 3.27Å; V105-Q191 HydrophobicContact CG1-CB 4Å; V105-Q191 HydrophobicContact CG1-CG 3.73Å; I109-Q191 HydrophobicContact CD1-CB 3.42Å; I109-Q191 VanDerWaalsContact CD1-CB 3.42Å; I109-Q191 HydrophobicContact CD1-CG 4.41Å; V187-Q191 HydrophobicContact CG1-CG 4.26Å; V187-Q191 PolarHBondContact O-N 3.1Å; L188-Q191 PolarHBondContact O-N 3.28Å; I189-Q191 PolarHBondContact O-N 3.47Å; Q191-Q193 VanDerWaalsContact C-N 3.3Å; Q191-Q193 PolarHBondContact O-N 2.71Å
192	C	95.3	Very high	95.1	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-72.2	-16.2	177.1	-68.6	0	0	0	0	114.6	L188 I189 Y194 S195 I196 I197	L188-C192 PolarHBondContact O-N 3.39Å; L188-C192 PolarHBondContact O-SG 2.73Å; L188-C192 VanDerWaalsContact O-SG 3.41Å; I189-C192 PolarHBondContact O-N 2.85Å; C192-Y194 PolarHBondContact O-N 2.94Å; C192-S195 PolarHBondContact O-N 3.38Å; C192-I196 HydrophobicContact CB-CB 4.02Å; C192-I196 HydrophobicContact CB-CG2 4.31Å; C192-I196 PolarHBondContact O-N 3.06Å; C192-I197 HydrophobicContact CB-CB 4.25Å; C192-I197 PolarHBondContact O-N 2.88Å
193	Q	91.7	Very high	95	Very high	19 Å²	19	42.2 Å²	42.2	9%	0.089	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57	-14.6	-165.4	81.1	-179.8	-78.6	0	0	117.4	I189 R190 Q191 Y198 V239 N242	I189-Q193 PolarHBondContact O-N 3.16Å; R190-Q193 WeakPolarHBondContact O-CG 3.39Å; R190-Q193 PolarHBondContact O-NE2 3.41Å; Q191-Q193 VanDerWaalsContact C-N 3.3Å; Q191-Q193 PolarHBondContact O-N 2.71Å; Q193-Y198 WeakPolarHBondContact O-CE2 3.41Å; Q193-Y198 PolarHBondContact O-OH 2.73Å; Q193-V239 HydrophobicContact CB-CG1 4.09Å; Q193-V239 HydrophobicContact CB-CG2 3.63Å; Q193-N242 PolarHBondContact OE1-ND2 3.12Å
194	Y	89.6	Confident	94.9	Very high	163 Å²	163	43.6 Å²	43.6	64%	0.639	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-110.8	0.2	-177.6	-57.6	-58.3	0	0	0	114.2	C192	C192-Y194 PolarHBondContact O-N 2.94Å
195	S	92.1	Very high	94.7	Very high	77 Å²	77	44.6 Å²	44.6	54%	0.538	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-158.1	-76.1	179.2	49.9	0	0	0	0	113.2	C192 I197 Y198	C192-S195 PolarHBondContact O-N 3.38Å; S195-I197 PolarHBondContact O-N 3.44Å; S195-I197 VanDerWaalsContact O-N 3.09Å; S195-Y198 PolarHBondContact O-N 2.72Å
196	I	94.2	Very high	94.6	Very high	18 Å²	18	44.7 Å²	44.7	9%	0.092	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-56.6	-30.7	-171.5	-68	165.9	0	0	0	112.7	I109 Y112 C192 Y198 D199 M202	I109-I196 HydrophobicContact CG1-CD1 4.45Å; I109-I196 HydrophobicContact CG2-CD1 3.86Å; Y112-I196 HydrophobicContact CD1-CD1 4.02Å; Y112-I196 HydrophobicContact CD1-CG1 4.24Å; Y112-I196 HydrophobicContact CD1-CG2 3.96Å; Y112-I196 HydrophobicContact CE1-CG1 4.29Å; Y112-I196 HydrophobicContact CE1-CG2 3.64Å; C192-I196 HydrophobicContact CB-CB 4.02Å; C192-I196 HydrophobicContact CB-CG2 4.31Å; C192-I196 PolarHBondContact O-N 3.06Å; I196-Y198 PolarHBondContact O-N 3.14Å; I196-D199 WeakPolarHBondContact O-CB 3.49Å; I196-D199 VanDerWaalsContact O-CG 3.29Å; I196-D199 PolarHBondContact O-N 3.18Å; I196-M202 HydrophobicContact CG2-CB 3.98Å; I196-M202 HydrophobicContact CG2-CG 3.95Å
197	I	95.3	Very high	94.7	Very high	2 Å²	2	44.7 Å²	44.7	1%	0.01	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-63.7	-22.2	179.7	-155.5	167	0	0	0	113.6	I189 C192 S195 M203 L236 V239 I287 M290	I189-I197 HydrophobicContact CG2-CD1 3.76Å; C192-I197 HydrophobicContact CB-CB 4.25Å; C192-I197 PolarHBondContact O-N 2.88Å; S195-I197 PolarHBondContact O-N 3.44Å; S195-I197 VanDerWaalsContact O-N 3.09Å; I197-M203 HydrophobicContact CG1-CG 3.73Å; I197-M203 HydrophobicContact CG1-SD 3.91Å; I197-L236 HydrophobicContact CD1-CD2 3.8Å; I197-V239 HydrophobicContact CD1-CG2 4.41Å; I197-I287 HydrophobicContact CD1-CD1 3.68Å; I197-I287 HydrophobicContact CG1-CD1 4.04Å; I197-I287 HydrophobicContact CG2-CD1 4.39Å; I197-M290 HydrophobicContact CG1-CE 4.46Å; I197-M290 HydrophobicContact CG1-SD 4.29Å; I197-M290 VanDerWaalsContact O-CE 3.28Å; I197-M290 WeakPolarHBondContact O-CE 3.35Å
198	Y	94.8	Very high	94.7	Very high	47 Å²	47	47.4 Å²	47.4	18%	0.184	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-107.1	23.9	179.8	-41.6	-80.4	0	0	0	112.4	Q193 S195 I196 E200 N283 I287	Q193-Y198 WeakPolarHBondContact O-CE2 3.41Å; Q193-Y198 PolarHBondContact O-OH 2.73Å; S195-Y198 PolarHBondContact O-N 2.72Å; I196-Y198 PolarHBondContact O-N 3.14Å; Y198-E200 VanDerWaalsContact C-N 3.34Å; Y198-N283 HydrophobicContact CD1-CB 4.17Å; Y198-N283 HydrophobicContact CE1-CB 3.56Å; Y198-N283 WeakPolarHBondContact CE2-ND2 3.45Å; Y198-N283 VanDerWaalsContact CZ-ND2 3.32Å; Y198-I287 HydrophobicContact CE1-CD1 4.04Å; Y198-I287 HydrophobicContact CE1-CG1 3.88Å
199	D	94.1	Very high	94.6	Very high	31 Å²	31	47.1 Å²	47.1	17%	0.166	23%	0.228	C	C	.	.	S	Bend	trans	-92.2	12.4	-173.2	91	-18.9	0	0	0	115.5	Y112 R116 I196 Y201 M202	Y112-D199 VanDerWaalsContact CE1-OD2 3.28Å; Y112-D199 WeakPolarHBondContact CE1-OD2 3.44Å; Y112-D199 PolarHBondContact OH-OD1 2.77Å; Y112-D199 PolarHBondContact OH-OD2 3.47Å; R116-D199 IonicContact CZ-OD2 3.75Å; R116-D199 IonicContact NE-OD2 3.07Å; R116-D199 IonicContact NH1-OD2 3.67Å; R116-D199 PolarHBondContact NH1-OD2 3.42Å; R116-D199 VanDerWaalsContact NH1-OD2 3.13Å; R116-D199 IonicContact NH2-OD2 3.58Å; R116-D199 PolarHBondContact NH2-OD2 3.28Å; R116-D199 VanDerWaalsContact NH2-OD2 3.13Å; I196-D199 WeakPolarHBondContact O-CB 3.49Å; I196-D199 VanDerWaalsContact O-CG 3.29Å; I196-D199 PolarHBondContact O-N 3.18Å; D199-Y201 PolarHBondContact O-N 2.97Å; D199-Y201 VanDerWaalsContact O-N 3.1Å; D199-Y201 PolarHBondContact OD1-N 3.29Å; D199-M202 PolarHBondContact OD1-N 3.14Å
200	E	92.6	Very high	94.7	Very high	176 Å²	176	47 Å²	47	82%	0.822	23%	0.228	S	C	*	.	S	Bend	trans	54.1	21.9	179.5	-62.7	175.2	-150.4	0	0	114	Y198	Y198-E200 VanDerWaalsContact C-N 3.34Å
201	Y	94.3	Very high	94.9	Very high	71 Å²	71	44.1 Å²	44.1	28%	0.278	22%	0.222	S	C	.	.	S	Bend	trans	-143.3	-49	-174.8	-168.9	-121.2	0	0	0	114.9	R116 D117 L120 D199 T205	R116-Y201 HydrophobicContact CB-CD1 4.26Å; R116-Y201 HydrophobicContact CB-CE1 3.97Å; D117-Y201 PolarHBondContact OD1-OH 3.14Å; L120-Y201 HydrophobicContact CD1-CD1 3.7Å; L120-Y201 HydrophobicContact CD1-CE1 3.32Å; D199-Y201 PolarHBondContact O-N 2.97Å; D199-Y201 VanDerWaalsContact O-N 3.1Å; D199-Y201 PolarHBondContact OD1-N 3.29Å; Y201-T205 WeakPolarHBondContact O-CB 3.27Å; Y201-T205 PolarHBondContact O-N 3.3Å; Y201-T205 PolarHBondContact O-OG1 3.26Å
202	M	95.5	Very high	95	Very high	2 Å²	2	42.1 Å²	42.1	1%	0.01	22%	0.22	C	C	.	.	H	α-helix	trans	-65.6	-49.9	-174.6	-175.8	-90.2	174.1	0	0	112.2	W108 Y112 L120 L123 L188 I196 D199 V206	W108-M202 HydrophobicContact CH2-CE 3.8Å; W108-M202 HydrophobicContact CH2-CG 4.08Å; W108-M202 HydrophobicContact CZ3-CE 4.04Å; Y112-M202 HydrophobicContact CE1-CB 4.49Å; Y112-M202 HydrophobicContact CE2-CB 4.3Å; Y112-M202 HydrophobicContact CE2-CG 4.42Å; L120-M202 HydrophobicContact CD2-CG 4.22Å; L123-M202 HydrophobicContact CD2-CE 3.93Å; L188-M202 HydrophobicContact CD1-CE 4.34Å; L188-M202 HydrophobicContact CD2-CE 3.83Å; L188-M202 HydrophobicContact CG-CE 4.1Å; I196-M202 HydrophobicContact CG2-CB 3.98Å; I196-M202 HydrophobicContact CG2-CG 3.95Å; D199-M202 PolarHBondContact OD1-N 3.14Å; M202-V206 HydrophobicContact CE-CG2 4.42Å; M202-V206 WeakPolarHBondContact O-CG2 3.47Å; M202-V206 PolarHBondContact O-N 3.16Å
203	M	96.1	Very high	95.1	Very high	4 Å²	4	42.1 Å²	42.1	2%	0.02	22%	0.22	C	C	.	.	H	α-helix	trans	-70.3	-45.5	-176.3	-70	-61.8	-57.9	0	0	112.2	I189 I197 T205 V206 I207 L232 L236 M290	I189-M203 HydrophobicContact CD1-CE 4.11Å; I189-M203 HydrophobicContact CD1-SD 3.55Å; I189-M203 VanDerWaalsContact CD1-SD 3.55Å; I197-M203 HydrophobicContact CG1-CG 3.73Å; I197-M203 HydrophobicContact CG1-SD 3.91Å; M203-T205 VanDerWaalsContact C-N 3.33Å; M203-T205 PolarHBondContact O-N 2.71Å; M203-V206 PolarHBondContact O-N 3.48Å; M203-I207 HydrophobicContact CB-CD1 4.49Å; M203-I207 HydrophobicContact CE-CD1 3.97Å; M203-I207 HydrophobicContact CE-CG1 4.43Å; M203-I207 WeakPolarHBondContact O-CB 3.4Å; M203-I207 WeakPolarHBondContact O-CG1 3.29Å; M203-I207 PolarHBondContact O-N 3.24Å; M203-L232 HydrophobicContact CE-CD1 3.78Å; M203-L232 HydrophobicContact CE-CG 4.44Å; M203-L236 HydrophobicContact CE-CD1 4.09Å; M203-L236 HydrophobicContact CE-CD2 3.95Å; M203-L236 HydrophobicContact CE-CG 4.39Å; M203-M290 HydrophobicContact CB-SD 3.84Å; M203-M290 HydrophobicContact CE-SD 3.75Å; M203-M290 HydrophobicContact CG-CE 4.41Å; M203-M290 HydrophobicContact CG-SD 3.73Å
204	D	94.6	Very high	95.4	Very high	94 Å²	94	41.3 Å²	41.3	50%	0.503	22%	0.217	S	C	.	.	H	α-helix	trans	-58	-43.9	178.6	-78.4	31.5	0	0	0	112.1	V206 S208	D204-V206 PolarHBondContact O-N 3.3Å; D204-S208 WeakPolarHBondContact O-CB 3.38Å; D204-S208 PolarHBondContact O-N 3.2Å
205	T	94.9	Very high	95.8	Very high	21 Å²	21	38.4 Å²	38.4	13%	0.129	21%	0.212	C	C	.	.	H	α-helix	trans	-60.3	-47.1	176.7	-58.5	0	0	0	0	111.2	L120 I124 F142 Y201 M203 L209	L120-T205 HydrophobicContact CD1-CG2 4.22Å; L120-T205 HydrophobicContact CD2-CG2 4.46Å; I124-T205 HydrophobicContact CD1-CG2 4.17Å; F142-T205 HydrophobicContact CE2-CG2 3.82Å; F142-T205 HydrophobicContact CZ-CG2 4.2Å; Y201-T205 WeakPolarHBondContact O-CB 3.27Å; Y201-T205 PolarHBondContact O-N 3.3Å; Y201-T205 PolarHBondContact O-OG1 3.26Å; M203-T205 VanDerWaalsContact C-N 3.33Å; M203-T205 PolarHBondContact O-N 2.71Å; T205-L209 WeakPolarHBondContact O-CB 3.4Å; T205-L209 PolarHBondContact O-N 3.08Å
206	V	96.4	Very high	96	Very high	8 Å²	8	35.5 Å²	35.5	5%	0.048	19%	0.192	C	C	.	.	H	α-helix	trans	-69	-46.2	-179.1	172.4	0	0	0	0	111.7	L123 F127 M202 M203 D204 S208 L209 L210 L232	L123-V206 HydrophobicContact CD2-CG2 3.64Å; L123-V206 HydrophobicContact CG-CG2 4.45Å; F127-V206 HydrophobicContact CE2-CG1 4.01Å; F127-V206 HydrophobicContact CZ-CG1 4.41Å; M202-V206 HydrophobicContact CE-CG2 4.42Å; M202-V206 WeakPolarHBondContact O-CG2 3.47Å; M202-V206 PolarHBondContact O-N 3.16Å; M203-V206 PolarHBondContact O-N 3.48Å; D204-V206 PolarHBondContact O-N 3.3Å; V206-S208 PolarHBondContact O-N 3.34Å; V206-L209 PolarHBondContact O-N 2.73Å; V206-L210 HydrophobicContact CG1-CD1 3.79Å; V206-L210 HydrophobicContact CG1-CG 4.28Å; V206-L210 WeakPolarHBondContact O-CB 3.42Å; V206-L210 VanDerWaalsContact O-CG 3.29Å; V206-L210 WeakPolarHBondContact O-CG 3.38Å; V206-L210 PolarHBondContact O-N 3.07Å; V206-L232 HydrophobicContact CG1-CD2 4.03Å
207	I	97.3	Very high	96	Very high	12 Å²	12	42.4 Å²	42.4	6%	0.062	22%	0.223	C	C	.	.	H	α-helix	trans	-64.5	-41.7	179.4	-67.7	171.5	0	0	0	110.4	M203 T211 L232 M290 I294	M203-I207 HydrophobicContact CB-CD1 4.49Å; M203-I207 HydrophobicContact CE-CD1 3.97Å; M203-I207 HydrophobicContact CE-CG1 4.43Å; M203-I207 WeakPolarHBondContact O-CB 3.4Å; M203-I207 WeakPolarHBondContact O-CG1 3.29Å; M203-I207 PolarHBondContact O-N 3.24Å; I207-T211 VanDerWaalsContact O-CB 3.28Å; I207-T211 WeakPolarHBondContact O-CB 3.24Å; I207-T211 PolarHBondContact O-N 3.19Å; I207-T211 PolarHBondContact O-OG1 3.07Å; I207-L232 HydrophobicContact CG1-CD2 4.01Å; I207-M290 HydrophobicContact CD1-CB 3.84Å; I207-M290 HydrophobicContact CD1-CG 4.07Å; I207-I294 HydrophobicContact CD1-CD1 4.07Å; I207-I294 HydrophobicContact CD1-CG1 4.15Å; I207-I294 HydrophobicContact CG1-CD1 4.08Å; I207-I294 HydrophobicContact CG1-CG1 4.01Å; I207-I294 HydrophobicContact CG2-CG1 4.08Å
208	S	96.8	Very high	96	Very high	65 Å²	65	44.1 Å²	44.1	46%	0.455	23%	0.234	S	C	.	.	H	α-helix	trans	-62.7	-44.9	176.3	-177	0	0	0	0	112.2	N147 D204 V206 G212	N147-S208 PolarHBondContact ND2-OG 3.01Å; D204-S208 WeakPolarHBondContact O-CB 3.38Å; D204-S208 PolarHBondContact O-N 3.2Å; V206-S208 PolarHBondContact O-N 3.34Å; S208-G212 PolarHBondContact O-N 3.1Å; S208-G212 VanDerWaalsContact O-N 3.11Å
209	L	96.6	Very high	96.1	Very high	1 Å²	1	46.2 Å²	46.2	1%	0.005	24%	0.242	C	C	.	.	H	α-helix	trans	-62.4	-52.1	175.8	-178.1	80.7	0	0	0	111.3	I124 F127 N147 T205 V206 T211 G212 L213	I124-L209 HydrophobicContact CB-CD2 4.22Å; I124-L209 HydrophobicContact CG1-CD2 4.09Å; I124-L209 HydrophobicContact CG2-CD1 4.09Å; I124-L209 HydrophobicContact CG2-CD2 3.97Å; F127-L209 HydrophobicContact CB-CD2 4.3Å; F127-L209 HydrophobicContact CD2-CD2 4.18Å; N147-L209 PolarHBondContact ND2-N 3.03Å; T205-L209 WeakPolarHBondContact O-CB 3.4Å; T205-L209 PolarHBondContact O-N 3.08Å; V206-L209 PolarHBondContact O-N 2.73Å; L209-T211 VanDerWaalsContact C-N 3.28Å; L209-T211 PolarHBondContact O-N 3.45Å; L209-G212 PolarHBondContact O-N 3.08Å; L209-L213 HydrophobicContact CD1-CD1 4.33Å; L209-L213 HydrophobicContact CD2-CD1 4.02Å; L209-L213 HydrophobicContact CG-CD1 3.79Å; L209-L213 HydrophobicContact CG-CG 4.35Å; L209-L213 WeakPolarHBondContact O-CG 3.09Å; L209-L213 PolarHBondContact O-N 3.25Å
210	L	98.1	Very high	96.3	Very high	1 Å²	1	45.1 Å²	45.1	1%	0.005	24%	0.237	C	C	.	.	H	α-helix	trans	-63.5	-35.8	-177.1	-68.9	178.9	0	0	0	111.7	F127 V206 S214 A228 A229 L232 I298	F127-L210 HydrophobicContact CD1-CD2 4.08Å; F127-L210 HydrophobicContact CD2-CD2 4.29Å; F127-L210 HydrophobicContact CE1-CD2 4.34Å; F127-L210 HydrophobicContact CG-CD2 4.07Å; F127-L210 HydrophobicContact CZ-CD1 4.46Å; V206-L210 HydrophobicContact CG1-CD1 3.79Å; V206-L210 HydrophobicContact CG1-CG 4.28Å; V206-L210 WeakPolarHBondContact O-CB 3.42Å; V206-L210 VanDerWaalsContact O-CG 3.29Å; V206-L210 WeakPolarHBondContact O-CG 3.38Å; V206-L210 PolarHBondContact O-N 3.07Å; L210-S214 VanDerWaalsContact O-CB 3.26Å; L210-S214 WeakPolarHBondContact O-CB 3.48Å; L210-S214 PolarHBondContact O-N 3.06Å; L210-S214 PolarHBondContact O-OG 2.89Å; L210-A228 HydrophobicContact CD1-CB 4.03Å; L210-A228 HydrophobicContact CD2-CB 3.77Å; L210-A229 HydrophobicContact CD1-CB 4.48Å; L210-L232 HydrophobicContact CD1-CD2 3.82Å; L210-I298 HydrophobicContact CB-CD1 4.27Å
211	T	98.1	Very high	96.5	Very high	43 Å²	43	36.8 Å²	36.8	26%	0.264	20%	0.198	S	C	.	.	H	α-helix	trans	-62.4	-50.8	174.2	-56.4	0	0	0	0	110.5	I207 L209 L213 S214 D215 I298	I207-T211 VanDerWaalsContact O-CB 3.28Å; I207-T211 WeakPolarHBondContact O-CB 3.24Å; I207-T211 PolarHBondContact O-N 3.19Å; I207-T211 PolarHBondContact O-OG1 3.07Å; L209-T211 VanDerWaalsContact C-N 3.28Å; L209-T211 PolarHBondContact O-N 3.45Å; T211-L213 PolarHBondContact O-N 3.11Å; T211-S214 PolarHBondContact O-N 3.32Å; T211-S214 VanDerWaalsContact O-N 3.14Å; T211-S214 PolarHBondContact O-OG 3.33Å; T211-D215 PolarHBondContact O-N 2.84Å; T211-I298 HydrophobicContact CG2-CG1 4.28Å
212	G	97.1	Very high	96.7	Very high	29 Å²	29	34.5 Å²	34.5	30%	0.299	19%	0.189	S	C	.	.	H	α-helix	trans	-60	-44.4	177	0	0	0	0	0	113.2	S208 L209 S214 D215 S216	S208-G212 PolarHBondContact O-N 3.1Å; S208-G212 VanDerWaalsContact O-N 3.11Å; L209-G212 PolarHBondContact O-N 3.08Å; G212-S214 PolarHBondContact O-N 2.92Å; G212-D215 PolarHBondContact O-N 2.88Å; G212-S216 PolarHBondContact O-N 3.21Å
213	L	97.6	Very high	96.9	Very high	1 Å²	1	34.4 Å²	34.4	1%	0.005	19%	0.189	C	C	.	.	H	α-helix	trans	-63.3	-32.9	176.8	-74.2	169.7	0	0	0	111.8	I128 I151 L209 T211 D215 S216 F221 R222 S225	I128-L213 HydrophobicContact CD1-CD1 4.29Å; I128-L213 HydrophobicContact CD1-CD2 3.86Å; I151-L213 HydrophobicContact CD1-CD2 4.1Å; I151-L213 HydrophobicContact CD1-CG 3.96Å; I151-L213 HydrophobicContact CG1-CD2 3.73Å; I151-L213 HydrophobicContact CG1-CG 4.08Å; I151-L213 HydrophobicContact CG2-CD2 4.12Å; L209-L213 HydrophobicContact CD1-CD1 4.33Å; L209-L213 HydrophobicContact CD2-CD1 4.02Å; L209-L213 HydrophobicContact CG-CD1 3.79Å; L209-L213 HydrophobicContact CG-CG 4.35Å; L209-L213 WeakPolarHBondContact O-CG 3.09Å; L209-L213 PolarHBondContact O-N 3.25Å; T211-L213 PolarHBondContact O-N 3.11Å; L213-D215 VanDerWaalsContact C-N 3.28Å; L213-D215 PolarHBondContact O-N 3.17Å; L213-S216 WeakPolarHBondContact O-CB 3.45Å; L213-S216 PolarHBondContact O-N 2.87Å; L213-F221 HydrophobicContact CD2-CB 3.85Å; L213-F221 HydrophobicContact CD2-CD1 3.67Å; L213-F221 HydrophobicContact CD2-CD2 4.34Å; L213-F221 HydrophobicContact CD2-CE1 4.32Å; L213-F221 HydrophobicContact CD2-CG 3.71Å; L213-R222 WeakPolarHBondContact O-CA 3.47Å; L213-S225 WeakPolarHBondContact CB-OG 3.34Å; L213-S225 PolarHBondContact O-OG 3.03Å
214	S	98.1	Very high	97	Very high	2 Å²	2	34.3 Å²	34.3	1%	0.014	19%	0.188	C	C	.	.	H	α-helix	trans	-75.9	-11.4	178.8	80.3	0	0	0	0	114.1	L210 T211 G212 R222 S225 R302	L210-S214 VanDerWaalsContact O-CB 3.26Å; L210-S214 WeakPolarHBondContact O-CB 3.48Å; L210-S214 PolarHBondContact O-N 3.06Å; L210-S214 PolarHBondContact O-OG 2.89Å; T211-S214 PolarHBondContact O-N 3.32Å; T211-S214 VanDerWaalsContact O-N 3.14Å; T211-S214 PolarHBondContact O-OG 3.33Å; G212-S214 PolarHBondContact O-N 2.92Å; S214-R222 VanDerWaalsContact O-CD 3.26Å; S214-R222 WeakPolarHBondContact O-CD 3.25Å; S214-R222 VanDerWaalsContact O-CG 3.29Å; S214-R222 WeakPolarHBondContact O-CG 3.45Å; S214-S225 VanDerWaalsContact CA-OG 3.31Å; S214-S225 WeakPolarHBondContact CA-OG 3.2Å; S214-S225 PolarHBondContact N-OG 3.14Å; S214-S225 VanDerWaalsContact N-OG 3.1Å; S214-R302 WeakPolarHBondContact O-CD 3.08Å; S214-R302 PolarHBondContact O-NE 3.21Å
215	D	97.1	Very high	97.2	Very high	101 Å²	101	29.9 Å²	29.9	54%	0.54	17%	0.165	S	C	.	.	H	α-helix	trans	-101.7	-3	171.5	-151.2	48.2	0	0	0	112.9	T211 G212 L213 R302	T211-D215 PolarHBondContact O-N 2.84Å; G212-D215 PolarHBondContact O-N 2.88Å; L213-D215 VanDerWaalsContact C-N 3.28Å; L213-D215 PolarHBondContact O-N 3.17Å; D215-R302 IonicContact OD1-NH2 3.08Å; D215-R302 PolarHBondContact OD1-NH2 3.36Å
216	S	96.6	Very high	97.3	Very high	16 Å²	16	28.9 Å²	28.9	11%	0.112	16%	0.159	C	C	.	.			trans	-62.6	138.9	175	-173.3	0	0	0	0	111.8	G212 L213 V218 R222	G212-S216 PolarHBondContact O-N 3.21Å; L213-S216 WeakPolarHBondContact O-CB 3.45Å; L213-S216 PolarHBondContact O-N 2.87Å; S216-V218 PolarHBondContact O-N 2.72Å; S216-V218 PolarHBondContact OG-N 2.87Å; S216-R222 WeakPolarHBondContact O-CD 3.19Å; S216-R222 PolarHBondContact O-NH1 3.26Å
217	Q	94.8	Very high	97.4	Very high	163 Å²	163	28.8 Å²	28.8	76%	0.762	16%	0.158	S	C	*	.	S	Bend	trans	-67.8	-26	173.9	-61.3	-55.6	-48.1	0	0	111.9	R219 R222	Q217-R219 PolarHBondContact O-N 3.38Å; Q217-R219 VanDerWaalsContact O-N 3.13Å; Q217-R222 PolarHBondContact O-NH1 3.14Å
218	V	95.6	Very high	97.5	Very high	38 Å²	38	28.2 Å²	28.2	23%	0.23	16%	0.155	C	C	.	.			trans	-61.8	112.4	175.1	-176.7	0	0	0	0	109.8	T155 F158 S216 A220 F221 R222	T155-V218 HydrophobicContact CG2-CG2 3.54Å; F158-V218 HydrophobicContact CD2-CG1 4.47Å; F158-V218 HydrophobicContact CE2-CG1 4.08Å; S216-V218 PolarHBondContact O-N 2.72Å; S216-V218 PolarHBondContact OG-N 2.87Å; V218-A220 HydrophobicContact CG1-CB 4.18Å; V218-A220 PolarHBondContact O-N 2.91Å; V218-F221 HydrophobicContact CB-CB 4.38Å; V218-F221 HydrophobicContact CB-CD2 3.78Å; V218-F221 HydrophobicContact CB-CG 4.47Å; V218-F221 HydrophobicContact CG1-CB 4.5Å; V218-F221 HydrophobicContact CG1-CD2 3.81Å; V218-F221 HydrophobicContact CG1-CE2 4.4Å; V218-F221 HydrophobicContact CG1-CG 4.34Å; V218-F221 HydrophobicContact CG2-CD2 4.11Å; V218-F221 PolarHBondContact O-N 3.21Å; V218-R222 WeakPolarHBondContact O-CB 3.32Å; V218-R222 PolarHBondContact O-N 3.26Å
219	R	96.6	Very high	97.6	Very high	91 Å²	91	25.1 Å²	25.1	34%	0.343	13%	0.133	S	C	.	.	H	α-helix	trans	-54.8	-41.2	-178.6	178.9	179.2	173.1	-171.3	-4.5	112.1	Y165 Q217 R222 H223 I307 E309	Y165-R219 HydrophobicContact CE1-CG 4.33Å; Y165-R219 PolarHBondContact OH-NE 2.87Å; Q217-R219 PolarHBondContact O-N 3.38Å; Q217-R219 VanDerWaalsContact O-N 3.13Å; R219-R222 PolarHBondContact O-N 3.09Å; R219-H223 VanDerWaalsContact O-CB 3.26Å; R219-H223 WeakPolarHBondContact O-CB 3.46Å; R219-H223 PolarHBondContact O-N 3.23Å; R219-I307 HydrophobicContact CG-CG1 4.25Å; R219-E309 IonicContact CZ-OE1 2.83Å; R219-E309 IonicContact CZ-OE2 2.69Å; R219-E309 IonicContact NH2-OE1 3.4Å; R219-E309 PolarHBondContact NH2-OE1 3.35Å; R219-E309 IonicContact NH2-OE2 3.4Å; R219-E309 PolarHBondContact NH2-OE2 2.64Å
220	A	97.3	Very high	97.7	Very high	9 Å²	9	25 Å²	25	7%	0.074	13%	0.133	C	C	.	.	H	α-helix	trans	-62.1	-49.1	-176.5	0	0	0	0	0	112.9	S131 F158 Y165 V218 T224	S131-A220 WeakPolarHBondContact O-CB 3.42Å; F158-A220 HydrophobicContact CE2-CB 4.18Å; F158-A220 HydrophobicContact CZ-CB 3.81Å; Y165-A220 HydrophobicContact CD1-CB 3.68Å; Y165-A220 HydrophobicContact CD2-CB 3.88Å; Y165-A220 HydrophobicContact CE1-CB 4.25Å; Y165-A220 HydrophobicContact CE2-CB 4.4Å; Y165-A220 HydrophobicContact CG-CB 3.5Å; V218-A220 HydrophobicContact CG1-CB 4.18Å; V218-A220 PolarHBondContact O-N 2.91Å; A220-T224 VanDerWaalsContact O-CB 3.29Å; A220-T224 WeakPolarHBondContact O-CB 3.28Å; A220-T224 PolarHBondContact O-N 2.94Å; A220-T224 PolarHBondContact O-OG1 3.22Å
221	F	97.9	Very high	97.7	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-62.1	-47	171.5	-71.7	-42.7	0	0	0	111.8	I128 S131 C133 M154 F158 L213 V218 T224 S225	I128-F221 HydrophobicContact CD1-CD1 4.33Å; I128-F221 HydrophobicContact CD1-CE1 3.78Å; I128-F221 HydrophobicContact CD1-CZ 4.34Å; I128-F221 HydrophobicContact CG2-CE1 4.22Å; S131-F221 VanDerWaalsContact CB-CD1 3.45Å; C133-F221 HydrophobicContact CB-CE1 3.72Å; C133-F221 HydrophobicContact CB-CZ 3.71Å; M154-F221 HydrophobicContact CB-CE2 4.49Å; M154-F221 HydrophobicContact CB-CZ 3.92Å; M154-F221 WeakPolarHBondContact O-CZ 3.31Å; F158-F221 HydrophobicContact CD2-CD2 4.46Å; F158-F221 HydrophobicContact CD2-CE1 4.27Å; F158-F221 AromaticContact CD2-CE2 3.65Å; F158-F221 HydrophobicContact CD2-CE2 3.65Å; F158-F221 AromaticContact CD2-CZ 3.53Å; F158-F221 HydrophobicContact CD2-CZ 3.53Å; F158-F221 HydrophobicContact CE2-CD1 4.41Å; F158-F221 HydrophobicContact CE2-CD2 4.32Å; F158-F221 AromaticContact CE2-CE1 3.96Å; F158-F221 HydrophobicContact CE2-CE1 3.96Å; F158-F221 AromaticContact CE2-CE2 3.87Å; F158-F221 HydrophobicContact CE2-CE2 3.87Å; F158-F221 AromaticContact CE2-CZ 3.66Å; F158-F221 HydrophobicContact CE2-CZ 3.66Å; L213-F221 HydrophobicContact CD2-CB 3.85Å; L213-F221 HydrophobicContact CD2-CD1 3.67Å; L213-F221 HydrophobicContact CD2-CD2 4.34Å; L213-F221 HydrophobicContact CD2-CE1 4.32Å; L213-F221 HydrophobicContact CD2-CG 3.71Å; V218-F221 HydrophobicContact CB-CB 4.38Å; V218-F221 HydrophobicContact CB-CD2 3.78Å; V218-F221 HydrophobicContact CB-CG 4.47Å; V218-F221 HydrophobicContact CG1-CB 4.5Å; V218-F221 HydrophobicContact CG1-CD2 3.81Å; V218-F221 HydrophobicContact CG1-CE2 4.4Å; V218-F221 HydrophobicContact CG1-CG 4.34Å; V218-F221 HydrophobicContact CG2-CD2 4.11Å; V218-F221 PolarHBondContact O-N 3.21Å; F221-T224 PolarHBondContact O-N 2.96Å; F221-S225 VanDerWaalsContact O-CB 3.26Å; F221-S225 WeakPolarHBondContact O-CB 3.35Å; F221-S225 PolarHBondContact O-N 3.4Å; F221-S225 PolarHBondContact O-OG 3.41Å
222	R	98.2	Very high	97.7	Very high	23 Å²	23	25.4 Å²	25.4	9%	0.087	13%	0.131	C	C	.	.	H	α-helix	trans	-65.9	-42	-174.7	-172.8	163.2	77.7	-98.4	1.1	113.5	L213 S214 S216 Q217 V218 R219 S225 T226 D305 I310	L213-R222 WeakPolarHBondContact O-CA 3.47Å; S214-R222 VanDerWaalsContact O-CD 3.26Å; S214-R222 WeakPolarHBondContact O-CD 3.25Å; S214-R222 VanDerWaalsContact O-CG 3.29Å; S214-R222 WeakPolarHBondContact O-CG 3.45Å; S216-R222 WeakPolarHBondContact O-CD 3.19Å; S216-R222 PolarHBondContact O-NH1 3.26Å; Q217-R222 PolarHBondContact O-NH1 3.14Å; V218-R222 WeakPolarHBondContact O-CB 3.32Å; V218-R222 PolarHBondContact O-N 3.26Å; R219-R222 PolarHBondContact O-N 3.09Å; R222-S225 PolarHBondContact O-OG 3.46Å; R222-T226 VanDerWaalsContact O-CB 3.28Å; R222-T226 WeakPolarHBondContact O-CB 3.36Å; R222-T226 PolarHBondContact O-N 3.42Å; R222-T226 VanDerWaalsContact O-N 3.09Å; R222-T226 PolarHBondContact O-OG1 2.95Å; R222-D305 WeakPolarHBondContact CD-OD2 3.3Å; R222-D305 IonicContact CZ-OD1 2.68Å; R222-D305 IonicContact CZ-OD2 2.8Å; R222-D305 IonicContact NE-OD1 3.03Å; R222-D305 PolarHBondContact NE-OD1 3.35Å; R222-D305 IonicContact NE-OD2 3.42Å; R222-D305 PolarHBondContact NE-OD2 3.29Å; R222-D305 IonicContact NH2-OD1 2.87Å; R222-D305 PolarHBondContact NH2-OD1 2.87Å; R222-D305 IonicContact NH2-OD2 3.95Å; R222-I310 HydrophobicContact CG-CD1 4.24Å
223	H	98.4	Very high	97.8	Very high	1 Å²	1	24.1 Å²	24.1	1%	0.005	12%	0.117	C	C	.	.	H	α-helix	trans	-65.7	-50.1	175.9	-175	178.3	0	0	0	110.4	Y165 R219 S225 T226 L227 E309 I310 I313	Y165-H223 HydrophobicContact CE2-CB 3.94Å; Y165-H223 AromaticContact CE2-ND1 3.54Å; Y165-H223 AromaticContact CZ-ND1 3.65Å; Y165-H223 PolarHBondContact OH-ND1 2.96Å; R219-H223 VanDerWaalsContact O-CB 3.26Å; R219-H223 WeakPolarHBondContact O-CB 3.46Å; R219-H223 PolarHBondContact O-N 3.23Å; H223-S225 PolarHBondContact O-N 3.5Å; H223-T226 PolarHBondContact O-N 3.39Å; H223-L227 PolarHBondContact O-N 3.07Å; H223-E309 IonicContact CE1-OE2 3.22Å; H223-E309 PolarHBondContact CE1-OE2 3.02Å; H223-E309 IonicContact ND1-OE2 3.88Å; H223-E309 PolarHBondContact ND1-OE2 2.91Å; H223-I310 HydrophobicContact CB-CD1 3.89Å; H223-I310 HydrophobicContact CB-CG1 4.04Å; H223-I313 WeakPolarHBondContact NE2-CD1 3.36Å
224	T	98.5	Very high	97.8	Very high	1 Å²	1	25.1 Å²	25.1	1%	0.006	12%	0.123	C	C	.	.	H	α-helix	trans	-66.5	-42.7	-174.7	-52.2	0	0	0	0	112.3	C130 S131 L167 F181 A220 F221 L227 A228	C130-T224 HydrophobicContact CB-CG2 3.95Å; S131-T224 WeakPolarHBondContact OG-CB 3.42Å; L167-T224 HydrophobicContact CD1-CG2 4.19Å; F181-T224 HydrophobicContact CE1-CG2 4.22Å; F181-T224 HydrophobicContact CE2-CG2 4.44Å; F181-T224 HydrophobicContact CZ-CG2 3.74Å; A220-T224 VanDerWaalsContact O-CB 3.29Å; A220-T224 WeakPolarHBondContact O-CB 3.28Å; A220-T224 PolarHBondContact O-N 2.94Å; A220-T224 PolarHBondContact O-OG1 3.22Å; F221-T224 PolarHBondContact O-N 2.96Å; T224-L227 PolarHBondContact O-N 3.35Å; T224-A228 WeakPolarHBondContact O-CB 3.46Å; T224-A228 PolarHBondContact O-N 3.14Å
225	S	98.4	Very high	97.8	Very high	2 Å²	2	25.4 Å²	25.4	1%	0.014	13%	0.125	C	C	.	.	H	α-helix	trans	-68.3	-36.3	175.6	58.6	0	0	0	0	113.1	L213 S214 F221 R222 H223 A228 A229	L213-S225 WeakPolarHBondContact CB-OG 3.34Å; L213-S225 PolarHBondContact O-OG 3.03Å; S214-S225 VanDerWaalsContact CA-OG 3.31Å; S214-S225 WeakPolarHBondContact CA-OG 3.2Å; S214-S225 PolarHBondContact N-OG 3.14Å; S214-S225 VanDerWaalsContact N-OG 3.1Å; F221-S225 VanDerWaalsContact O-CB 3.26Å; F221-S225 WeakPolarHBondContact O-CB 3.35Å; F221-S225 PolarHBondContact O-N 3.4Å; F221-S225 PolarHBondContact O-OG 3.41Å; R222-S225 PolarHBondContact O-OG 3.46Å; H223-S225 PolarHBondContact O-N 3.5Å; S225-A228 PolarHBondContact O-N 3.35Å; S225-A229 WeakPolarHBondContact O-CB 3.23Å; S225-A229 PolarHBondContact O-N 2.82Å
226	T	98.8	Very high	97.9	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-63.7	-46.9	173.3	-56.7	0	0	0	0	110.6	R222 H223 A228 A229 M230 I298 R302 I310	R222-T226 VanDerWaalsContact O-CB 3.28Å; R222-T226 WeakPolarHBondContact O-CB 3.36Å; R222-T226 PolarHBondContact O-N 3.42Å; R222-T226 VanDerWaalsContact O-N 3.09Å; R222-T226 PolarHBondContact O-OG1 2.95Å; H223-T226 PolarHBondContact O-N 3.39Å; T226-A228 VanDerWaalsContact C-N 3.32Å; T226-A228 PolarHBondContact O-N 2.87Å; T226-A229 PolarHBondContact O-N 3.31Å; T226-M230 HydrophobicContact CG2-CG 4.21Å; T226-M230 VanDerWaalsContact O-CG 3.31Å; T226-M230 WeakPolarHBondContact O-CG 3.45Å; T226-M230 PolarHBondContact O-N 3Å; T226-I298 HydrophobicContact CG2-CG2 4.46Å; T226-R302 HydrophobicContact CG2-CB 3.75Å; T226-R302 HydrophobicContact CG2-CG 4.05Å; T226-R302 WeakPolarHBondContact OG1-CG 2.99Å; T226-I310 HydrophobicContact CG2-CG2 3.9Å
227	L	98.6	Very high	97.9	Very high	5 Å²	5	19.8 Å²	19.8	3%	0.026	9%	0.094	C	C	.	.	H	α-helix	trans	-58.9	-44.6	176	-179.2	59.6	0	0	0	111.6	L167 R178 F181 H223 T224 M230 K231 I313	L167-L227 HydrophobicContact CD1-CB 4.43Å; L167-L227 HydrophobicContact CD1-CD2 3.75Å; L167-L227 HydrophobicContact CD2-CD2 3.83Å; L167-L227 HydrophobicContact CG-CD2 4.47Å; R178-L227 HydrophobicContact CG-CD2 4.31Å; F181-L227 HydrophobicContact CD1-CD2 4.12Å; F181-L227 HydrophobicContact CD1-CG 4.46Å; F181-L227 HydrophobicContact CE1-CD2 4.19Å; F181-L227 HydrophobicContact CE1-CG 4.24Å; H223-L227 PolarHBondContact O-N 3.07Å; T224-L227 PolarHBondContact O-N 3.35Å; L227-M230 PolarHBondContact O-N 3.19Å; L227-K231 HydrophobicContact CD1-CG 4.35Å; L227-K231 WeakPolarHBondContact O-CG 3.33Å; L227-K231 PolarHBondContact O-N 2.73Å; L227-K231 VanDerWaalsContact O-N 3.11Å; L227-I313 HydrophobicContact CB-CD1 4.36Å; L227-I313 HydrophobicContact CB-CG2 4.48Å; L227-I313 HydrophobicContact CD1-CD1 4.2Å; L227-I313 HydrophobicContact CD1-CG1 4.35Å; L227-I313 HydrophobicContact CD1-CG2 3.94Å
228	A	98.6	Very high	98	Very high	0 Å²	0	14.3 Å²	14.3	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-60.2	-47.7	175.8	0	0	0	0	0	112.2	F127 F181 I185 L210 T224 S225 T226 K231 L232	F127-A228 HydrophobicContact CD1-CB 4.05Å; F127-A228 HydrophobicContact CE1-CB 3.72Å; F181-A228 HydrophobicContact CE1-CB 4.21Å; F181-A228 HydrophobicContact CZ-CB 3.89Å; I185-A228 HydrophobicContact CD1-CB 3.67Å; L210-A228 HydrophobicContact CD1-CB 4.03Å; L210-A228 HydrophobicContact CD2-CB 3.77Å; T224-A228 WeakPolarHBondContact O-CB 3.46Å; T224-A228 PolarHBondContact O-N 3.14Å; S225-A228 PolarHBondContact O-N 3.35Å; T226-A228 VanDerWaalsContact C-N 3.32Å; T226-A228 PolarHBondContact O-N 2.87Å; A228-K231 PolarHBondContact O-N 3.33Å; A228-L232 VanDerWaalsContact O-CB 3.24Å; A228-L232 WeakPolarHBondContact O-CB 3.44Å; A228-L232 PolarHBondContact O-N 3.19Å
229	A	98.6	Very high	98.1	Very high	0 Å²	0	12.6 Å²	12.6	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-64.3	-39.5	-179.6	0	0	0	0	0	113	L210 S225 T226 L232 M233 I294 I298	L210-A229 HydrophobicContact CD1-CB 4.48Å; S225-A229 WeakPolarHBondContact O-CB 3.23Å; S225-A229 PolarHBondContact O-N 2.82Å; T226-A229 PolarHBondContact O-N 3.31Å; A229-L232 WeakPolarHBondContact O-CB 3.43Å; A229-L232 PolarHBondContact O-N 3.44Å; A229-M233 WeakPolarHBondContact O-CB 3.41Å; A229-M233 PolarHBondContact O-N 2.87Å; A229-I294 HydrophobicContact CB-CG2 4.19Å; A229-I298 HydrophobicContact CB-CB 4.5Å; A229-I298 HydrophobicContact CB-CD1 3.42Å; A229-I298 VanDerWaalsContact CB-CD1 3.42Å; A229-I298 HydrophobicContact CB-CG2 4.04Å
230	M	98.6	Very high	98.1	Very high	0 Å²	0	8.2 Å²	8.2	0%	0	4%	0.043	C	C	.	.	H	α-helix	trans	-70.1	-36.7	177.2	-58.5	-57.1	89.5	0	0	111.2	T226 L227 M233 T234 I294 I298 F299 I313 C314 E317 W321	T226-M230 HydrophobicContact CG2-CG 4.21Å; T226-M230 VanDerWaalsContact O-CG 3.31Å; T226-M230 WeakPolarHBondContact O-CG 3.45Å; T226-M230 PolarHBondContact O-N 3Å; L227-M230 PolarHBondContact O-N 3.19Å; M230-M233 WeakPolarHBondContact O-CB 3.35Å; M230-M233 PolarHBondContact O-N 3.45Å; M230-T234 PolarHBondContact O-N 2.95Å; M230-T234 PolarHBondContact O-OG1 3.27Å; M230-I294 HydrophobicContact CE-CG2 3.96Å; M230-I298 HydrophobicContact CE-CB 4.25Å; M230-I298 HydrophobicContact CE-CG2 3.87Å; M230-F299 HydrophobicContact CE-CB 4.14Å; M230-F299 HydrophobicContact SD-CB 4.15Å; M230-F299 HydrophobicContact SD-CD2 3.89Å; M230-I313 HydrophobicContact CB-CG2 4.41Å; M230-I313 HydrophobicContact CG-CG2 4.09Å; M230-C314 HydrophobicContact SD-CB 4.46Å; M230-E317 HydrophobicContact CB-CB 3.86Å; M230-E317 HydrophobicContact CB-CG 3.7Å; M230-W321 HydrophobicContact CB-CZ2 4.45Å; M230-W321 HydrophobicContact SD-CH2 3.78Å; M230-W321 HydrophobicContact SD-CZ2 4Å
231	K	98.4	Very high	98	Very high	48 Å²	48	9.8 Å²	9.8	21%	0.209	5%	0.05	C	C	.	.	H	α-helix	trans	-69.3	-35.5	173.4	-66.1	-68.6	167.4	-161.6	0	113	C182 I185 L227 A228 T234 A235 E317	C182-K231 HydrophobicContact CB-CD 3.89Å; C182-K231 HydrophobicContact CB-CG 4.02Å; I185-K231 HydrophobicContact CG2-CB 4.3Å; L227-K231 HydrophobicContact CD1-CG 4.35Å; L227-K231 WeakPolarHBondContact O-CG 3.33Å; L227-K231 PolarHBondContact O-N 2.73Å; L227-K231 VanDerWaalsContact O-N 3.11Å; A228-K231 PolarHBondContact O-N 3.33Å; K231-T234 PolarHBondContact O-N 3.03Å; K231-A235 PolarHBondContact O-N 3.49Å; K231-E317 WeakPolarHBondContact CD-OE2 3.46Å; K231-E317 WeakPolarHBondContact CE-OE2 3.26Å; K231-E317 IonicContact NZ-OE1 3.6Å; K231-E317 PolarHBondContact NZ-OE1 3.44Å; K231-E317 IonicContact NZ-OE2 3.13Å; K231-E317 PolarHBondContact NZ-OE2 2.9Å
232	L	98.2	Very high	97.9	Very high	4 Å²	4	12 Å²	12	2%	0.021	6%	0.062	C	C	.	.	H	α-helix	trans	-60.8	-48.2	170.8	178.7	59.2	0	0	0	111	I185 I189 M203 V206 I207 L210 A228 A229 A235 L236 I294	I185-L232 HydrophobicContact CG2-CB 4.1Å; I189-L232 HydrophobicContact CD1-CD1 3.37Å; I189-L232 HydrophobicContact CG1-CD1 3.55Å; M203-L232 HydrophobicContact CE-CD1 3.78Å; M203-L232 HydrophobicContact CE-CG 4.44Å; V206-L232 HydrophobicContact CG1-CD2 4.03Å; I207-L232 HydrophobicContact CG1-CD2 4.01Å; L210-L232 HydrophobicContact CD1-CD2 3.82Å; A228-L232 VanDerWaalsContact O-CB 3.24Å; A228-L232 WeakPolarHBondContact O-CB 3.44Å; A228-L232 PolarHBondContact O-N 3.19Å; A229-L232 WeakPolarHBondContact O-CB 3.43Å; A229-L232 PolarHBondContact O-N 3.44Å; L232-A235 PolarHBondContact O-N 3.44Å; L232-L236 HydrophobicContact CG-CD1 4.43Å; L232-L236 WeakPolarHBondContact O-CG 3.41Å; L232-L236 PolarHBondContact O-N 3.04Å; L232-I294 HydrophobicContact CB-CD1 4.41Å; L232-I294 HydrophobicContact CD2-CD1 3.77Å; L232-I294 HydrophobicContact CG-CD1 3.74Å
233	M	98.3	Very high	97.7	Very high	2 Å²	2	11.3 Å²	11.3	1%	0.01	6%	0.06	C	C	.	.	H	α-helix	trans	-58.4	-48.6	173.4	-175	71.7	178	0	0	111.7	A229 M230 A235 L236 V237 M291 I294 F295 W321 F329	A229-M233 WeakPolarHBondContact O-CB 3.41Å; A229-M233 PolarHBondContact O-N 2.87Å; M230-M233 WeakPolarHBondContact O-CB 3.35Å; M230-M233 PolarHBondContact O-N 3.45Å; M233-A235 PolarHBondContact O-N 3.31Å; M233-L236 PolarHBondContact O-N 3.31Å; M233-V237 HydrophobicContact CE-CG2 4.42Å; M233-V237 WeakPolarHBondContact O-CG2 3.41Å; M233-V237 PolarHBondContact O-N 3.15Å; M233-M291 HydrophobicContact CE-CB 3.77Å; M233-M291 HydrophobicContact CE-CG 4.04Å; M233-M291 HydrophobicContact CE-SD 4.29Å; M233-M291 HydrophobicContact SD-CB 3.73Å; M233-M291 HydrophobicContact SD-CG 3.73Å; M233-I294 HydrophobicContact CB-CG2 4.1Å; M233-I294 HydrophobicContact SD-CB 4.33Å; M233-I294 HydrophobicContact SD-CG2 4.46Å; M233-F295 HydrophobicContact CE-CB 4.39Å; M233-W321 HydrophobicContact CB-CH2 4.4Å; M233-W321 HydrophobicContact CB-CZ2 3.72Å; M233-W321 HydrophobicContact CE-CE3 4.24Å; M233-W321 HydrophobicContact CE-CZ3 4.36Å; M233-W321 HydrophobicContact CG-CD2 3.98Å; M233-W321 VanDerWaalsContact CG-CE2 3.45Å; M233-W321 HydrophobicContact CG-CE3 4.29Å; M233-W321 HydrophobicContact CG-CH2 3.77Å; M233-W321 HydrophobicContact CG-CZ2 3.36Å; M233-W321 HydrophobicContact CG-CZ3 4.2Å; M233-F329 HydrophobicContact CE-CE1 3.88Å; M233-F329 HydrophobicContact CE-CZ 3.94Å
234	T	98.4	Very high	97.6	Very high	22 Å²	22	12.6 Å²	12.6	14%	0.135	7%	0.069	C	C	.	.	H	α-helix	trans	-56.9	-34.8	176.3	-61.6	0	0	0	0	112.6	M230 K231 N238 E317 V320 W321 M324	M230-T234 PolarHBondContact O-N 2.95Å; M230-T234 PolarHBondContact O-OG1 3.27Å; K231-T234 PolarHBondContact O-N 3.03Å; T234-N238 PolarHBondContact O-N 3.02Å; T234-E317 PolarHBondContact OG1-OE2 3.04Å; T234-V320 HydrophobicContact CG2-CG1 3.8Å; T234-W321 PolarHBondContact OG1-NE1 3.46Å; T234-M324 HydrophobicContact CG2-CE 4.06Å
235	A	98	Very high	97.4	Very high	7 Å²	7	16.2 Å²	16.2	6%	0.058	9%	0.087	C	C	.	.	H	α-helix	trans	-74.3	-38.8	174.9	0	0	0	0	0	112.8	I189 K231 L232 M233 N238 V239	I189-A235 HydrophobicContact CB-CB 3.68Å; I189-A235 HydrophobicContact CG1-CB 4.16Å; I189-A235 HydrophobicContact CG2-CB 3.66Å; K231-A235 PolarHBondContact O-N 3.49Å; L232-A235 PolarHBondContact O-N 3.44Å; M233-A235 PolarHBondContact O-N 3.31Å; A235-N238 WeakPolarHBondContact O-CB 3.18Å; A235-N238 PolarHBondContact O-N 3.5Å; A235-V239 PolarHBondContact O-N 2.7Å; A235-V239 VanDerWaalsContact O-N 3.15Å
236	L	98.1	Very high	97.1	Very high	0 Å²	0	20 Å²	20	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-63.9	-39.6	174.6	-71.1	166.6	0	0	0	112.4	I189 I197 M203 L232 M233 N238 V239 A240 I287 M290 M291 I294	I189-L236 HydrophobicContact CG2-CD2 4.43Å; I197-L236 HydrophobicContact CD1-CD2 3.8Å; M203-L236 HydrophobicContact CE-CD1 4.09Å; M203-L236 HydrophobicContact CE-CD2 3.95Å; M203-L236 HydrophobicContact CE-CG 4.39Å; L232-L236 HydrophobicContact CG-CD1 4.43Å; L232-L236 WeakPolarHBondContact O-CG 3.41Å; L232-L236 PolarHBondContact O-N 3.04Å; M233-L236 PolarHBondContact O-N 3.31Å; L236-N238 PolarHBondContact O-N 3.09Å; L236-V239 PolarHBondContact O-N 2.67Å; L236-A240 PolarHBondContact O-N 3.15Å; L236-I287 HydrophobicContact CB-CG2 4.3Å; L236-I287 HydrophobicContact CD2-CD1 3.77Å; L236-I287 HydrophobicContact CD2-CG2 4.21Å; L236-M290 HydrophobicContact CD1-CB 3.92Å; L236-M290 HydrophobicContact CD2-CB 4.42Å; L236-M290 HydrophobicContact CD2-SD 3.91Å; L236-M291 HydrophobicContact CB-CG 3.64Å; L236-M291 HydrophobicContact CB-SD 4.18Å; L236-M291 HydrophobicContact CD1-CG 4.25Å; L236-I294 HydrophobicContact CD1-CD1 3.62Å
237	V	98.1	Very high	96.8	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-58.5	-37	174.3	173.1	0	0	0	0	111.5	M233 L241 M291 W321 M324 Y325 F329	M233-V237 HydrophobicContact CE-CG2 4.42Å; M233-V237 WeakPolarHBondContact O-CG2 3.41Å; M233-V237 PolarHBondContact O-N 3.15Å; V237-L241 WeakPolarHBondContact O-CB 3.27Å; V237-L241 PolarHBondContact O-N 2.88Å; V237-M291 HydrophobicContact CB-SD 4.43Å; V237-M291 HydrophobicContact CG2-SD 3.7Å; V237-W321 HydrophobicContact CG1-CB 4.49Å; V237-W321 HydrophobicContact CG2-CB 4.23Å; V237-W321 HydrophobicContact CG2-CG 4.01Å; V237-M324 HydrophobicContact CG1-CB 4.47Å; V237-M324 HydrophobicContact CG1-SD 4.27Å; V237-Y325 HydrophobicContact CG1-CD1 4.48Å; V237-F329 HydrophobicContact CB-CE2 4.44Å; V237-F329 HydrophobicContact CG1-CD2 4.25Å; V237-F329 HydrophobicContact CG1-CE2 4Å; V237-F329 HydrophobicContact CG2-CD2 4.48Å; V237-F329 HydrophobicContact CG2-CE1 4.47Å; V237-F329 HydrophobicContact CG2-CE2 3.69Å; V237-F329 HydrophobicContact CG2-CZ 3.68Å
238	N	96.8	Very high	96.6	Very high	48 Å²	48	25.6 Å²	25.6	26%	0.257	13%	0.134	S	C	.	.	H	α-helix	trans	-67.2	-42.2	174.2	-166.2	-47.6	0	0	0	111.6	T234 A235 L236 L241 N242 M324	T234-N238 PolarHBondContact O-N 3.02Å; A235-N238 WeakPolarHBondContact O-CB 3.18Å; A235-N238 PolarHBondContact O-N 3.5Å; L236-N238 PolarHBondContact O-N 3.09Å; N238-L241 PolarHBondContact O-N 3.44Å; N238-N242 VanDerWaalsContact O-CG 3.25Å; N238-N242 PolarHBondContact O-N 2.62Å; N238-N242 PolarHBondContact O-ND2 3.18Å; N238-N242 PolarHBondContact OD1-ND2 3.35Å; N238-M324 HydrophobicContact CB-SD 3.88Å
239	V	97	Very high	96.4	Very high	1 Å²	1	28.4 Å²	28.4	1%	0.006	15%	0.149	C	C	.	.	H	α-helix	trans	-62.7	-45.2	175.2	179.3	0	0	0	0	111.3	I189 Q193 I197 A235 L236 L241 N242 L243 I287	I189-V239 HydrophobicContact CG2-CG2 4.3Å; Q193-V239 HydrophobicContact CB-CG1 4.09Å; Q193-V239 HydrophobicContact CB-CG2 3.63Å; I197-V239 HydrophobicContact CD1-CG2 4.41Å; A235-V239 PolarHBondContact O-N 2.7Å; A235-V239 VanDerWaalsContact O-N 3.15Å; L236-V239 PolarHBondContact O-N 2.67Å; V239-L241 PolarHBondContact O-N 2.83Å; V239-N242 PolarHBondContact O-N 3.27Å; V239-L243 HydrophobicContact CG1-CD1 4.16Å; V239-L243 HydrophobicContact CG1-CG 4.38Å; V239-L243 WeakPolarHBondContact O-CG 3.49Å; V239-L243 PolarHBondContact O-N 3.34Å; V239-I287 HydrophobicContact CB-CD1 4.47Å; V239-I287 HydrophobicContact CG1-CD1 3.87Å; V239-I287 HydrophobicContact CG1-CG1 4.05Å
240	A	96.8	Very high	96.2	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-59.8	-42.4	175.7	0	0	0	0	0	112.4	L236 L243 S244 Q284 I287 M291 Y325	L236-A240 PolarHBondContact O-N 3.15Å; A240-L243 PolarHBondContact O-N 3.04Å; A240-S244 WeakPolarHBondContact O-CB 3.29Å; A240-S244 PolarHBondContact O-N 3.44Å; A240-Q284 PolarHBondContact O-OE1 3.17Å; A240-I287 HydrophobicContact CB-CG2 3.96Å; A240-M291 HydrophobicContact CB-CE 3.87Å; A240-M291 HydrophobicContact CB-SD 4.42Å; A240-Y325 HydrophobicContact CB-CD1 4.43Å; A240-Y325 HydrophobicContact CB-CE1 4.1Å
241	L	96.1	Very high	95.9	Very high	42 Å²	42	31 Å²	31	22%	0.22	16%	0.161	C	C	.	.	H	α-helix	trans	-61.7	-44.1	174.2	178.5	62.9	0	0	0	111.8	V237 N238 V239 S244 I245 M324 Y325	V237-L241 WeakPolarHBondContact O-CB 3.27Å; V237-L241 PolarHBondContact O-N 2.88Å; N238-L241 PolarHBondContact O-N 3.44Å; V239-L241 PolarHBondContact O-N 2.83Å; L241-S244 PolarHBondContact O-N 3.2Å; L241-I245 HydrophobicContact CD1-CD1 4.05Å; L241-I245 HydrophobicContact CD1-CG1 4.46Å; L241-I245 HydrophobicContact CG-CD1 3.99Å; L241-I245 WeakPolarHBondContact O-CB 3.38Å; L241-I245 WeakPolarHBondContact O-CD1 3.43Å; L241-I245 VanDerWaalsContact O-CG1 3.26Å; L241-I245 WeakPolarHBondContact O-CG1 3.39Å; L241-I245 PolarHBondContact O-N 2.67Å; L241-M324 HydrophobicContact CD2-CG 4.36Å; L241-M324 WeakPolarHBondContact CD2-O 3.32Å; L241-Y325 HydrophobicContact CB-CD1 4.12Å; L241-Y325 HydrophobicContact CB-CE1 4.47Å; L241-Y325 HydrophobicContact CB-CG 4.24Å; L241-Y325 HydrophobicContact CD1-CD2 3.76Å; L241-Y325 HydrophobicContact CD1-CE2 4Å; L241-Y325 HydrophobicContact CD1-CG 4.11Å
242	N	94.9	Very high	95.7	Very high	45 Å²	45	35 Å²	35	24%	0.241	18%	0.175	C	C	.	.	H	α-helix	trans	-65.7	-38.8	177	-65.9	-38.3	0	0	0	112.1	Q193 N238 V239 I245 H246	Q193-N242 PolarHBondContact OE1-ND2 3.12Å; N238-N242 VanDerWaalsContact O-CG 3.25Å; N238-N242 PolarHBondContact O-N 2.62Å; N238-N242 PolarHBondContact O-ND2 3.18Å; N238-N242 PolarHBondContact OD1-ND2 3.35Å; V239-N242 PolarHBondContact O-N 3.27Å; N242-I245 PolarHBondContact O-N 3.24Å; N242-H246 WeakPolarHBondContact O-CB 3.38Å; N242-H246 PolarHBondContact O-CD2 2.86Å; N242-H246 VanDerWaalsContact O-CG 3.31Å; N242-H246 PolarHBondContact O-N 2.85Å
243	L	94.6	Very high	95.4	Very high	10 Å²	10	39.5 Å²	39.5	5%	0.052	20%	0.196	C	C	.	.	H	α-helix	trans	-62.6	-49	174	-76.2	174.2	0	0	0	111.3	V239 A240 I245 H246 Q247 L280 N283 Q284 I287	V239-L243 HydrophobicContact CG1-CD1 4.16Å; V239-L243 HydrophobicContact CG1-CG 4.38Å; V239-L243 WeakPolarHBondContact O-CG 3.49Å; V239-L243 PolarHBondContact O-N 3.34Å; A240-L243 PolarHBondContact O-N 3.04Å; L243-I245 PolarHBondContact O-N 3.1Å; L243-H246 CarbonylContact O-C 3.55Å; L243-H246 WeakPolarHBondContact O-CA 3.29Å; L243-H246 WeakPolarHBondContact O-CB 3.34Å; L243-H246 PolarHBondContact O-N 3.16Å; L243-Q247 WeakPolarHBondContact O-CG 3.45Å; L243-Q247 PolarHBondContact O-N 2.93Å; L243-L280 HydrophobicContact CD2-CD2 3.87Å; L243-N283 HydrophobicContact CD1-CB 4.16Å; L243-N283 HydrophobicContact CD2-CB 4.1Å; L243-Q284 VanDerWaalsContact CB-OE1 3.24Å; L243-I287 HydrophobicContact CD1-CB 4.47Å; L243-I287 HydrophobicContact CD1-CG1 3.89Å
244	S	95.1	Very high	95.1	Very high	27 Å²	27	41.5 Å²	41.5	19%	0.189	20%	0.204	C	C	.	.	H	α-helix	trans	-55.9	-48.3	174.6	173	0	0	0	0	111.9	A240 L241 H246 Q247 D248 Y325	A240-S244 WeakPolarHBondContact O-CB 3.29Å; A240-S244 PolarHBondContact O-N 3.44Å; L241-S244 PolarHBondContact O-N 3.2Å; S244-H246 VanDerWaalsContact C-N 3.27Å; S244-H246 PolarHBondContact O-N 2.89Å; S244-Q247 WeakPolarHBondContact O-CB 3.47Å; S244-Q247 PolarHBondContact O-N 3.26Å; S244-Q247 VanDerWaalsContact O-N 3.14Å; S244-D248 PolarHBondContact O-N 3.05Å; S244-Y325 WeakPolarHBondContact CB-OH 3.44Å; S244-Y325 PolarHBondContact OG-OH 3.16Å
245	I	94.5	Very high	94.8	Very high	77 Å²	77	44.1 Å²	44.1	40%	0.395	22%	0.215	S	C	.	.	H	α-helix	trans	-59.5	-37.4	175.1	-68.7	165.6	0	0	0	111.2	L241 N242 L243 N249	L241-I245 HydrophobicContact CD1-CD1 4.05Å; L241-I245 HydrophobicContact CD1-CG1 4.46Å; L241-I245 HydrophobicContact CG-CD1 3.99Å; L241-I245 WeakPolarHBondContact O-CB 3.38Å; L241-I245 WeakPolarHBondContact O-CD1 3.43Å; L241-I245 VanDerWaalsContact O-CG1 3.26Å; L241-I245 WeakPolarHBondContact O-CG1 3.39Å; L241-I245 PolarHBondContact O-N 2.67Å; N242-I245 PolarHBondContact O-N 3.24Å; L243-I245 PolarHBondContact O-N 3.1Å; I245-N249 WeakPolarHBondContact CG2-ND2 3.2Å; I245-N249 WeakPolarHBondContact O-CB 3.47Å; I245-N249 PolarHBondContact O-N 3.13Å; I245-N249 VanDerWaalsContact O-N 3.1Å; I245-N249 PolarHBondContact O-ND2 3.46Å
246	H	93.4	Very high	94.5	Very high	82 Å²	82	46.9 Å²	46.9	38%	0.38	24%	0.237	S	C	.	.	H	α-helix	trans	-72.6	-35.8	175.3	-74.6	-40.2	0	0	0	113.7	N242 L243 S244 T250 L280	N242-H246 WeakPolarHBondContact O-CB 3.38Å; N242-H246 PolarHBondContact O-CD2 2.86Å; N242-H246 VanDerWaalsContact O-CG 3.31Å; N242-H246 PolarHBondContact O-N 2.85Å; L243-H246 CarbonylContact O-C 3.55Å; L243-H246 WeakPolarHBondContact O-CA 3.29Å; L243-H246 WeakPolarHBondContact O-CB 3.34Å; L243-H246 PolarHBondContact O-N 3.16Å; S244-H246 VanDerWaalsContact C-N 3.27Å; S244-H246 PolarHBondContact O-N 2.89Å; H246-T250 VanDerWaalsContact O-CB 3.3Å; H246-T250 WeakPolarHBondContact O-CB 3.48Å; H246-T250 PolarHBondContact O-N 3.43Å; H246-T250 PolarHBondContact O-OG1 3.35Å; H246-L280 HydrophobicContact CB-CD1 4.18Å; H246-L280 HydrophobicContact CB-CD2 4.23Å
247	Q	92.2	Very high	94.1	Very high	35 Å²	35	47.2 Å²	47.2	16%	0.164	24%	0.239	C	C	.	.	H	α-helix	trans	-60.7	-52	172.3	-72.8	-178.8	4.7	0	0	110.1	L243 S244 N249 T250 Q251 L280 Q284	L243-Q247 WeakPolarHBondContact O-CG 3.45Å; L243-Q247 PolarHBondContact O-N 2.93Å; S244-Q247 WeakPolarHBondContact O-CB 3.47Å; S244-Q247 PolarHBondContact O-N 3.26Å; S244-Q247 VanDerWaalsContact O-N 3.14Å; Q247-N249 PolarHBondContact O-N 2.93Å; Q247-T250 CarbonylContact O-C 3.58Å; Q247-T250 WeakPolarHBondContact O-CA 3.24Å; Q247-T250 WeakPolarHBondContact O-CB 3.22Å; Q247-T250 PolarHBondContact O-N 2.91Å; Q247-Q251 WeakPolarHBondContact O-CB 3.49Å; Q247-Q251 PolarHBondContact O-N 3.33Å; Q247-L280 HydrophobicContact CG-CB 3.81Å; Q247-L280 PolarHBondContact NE2-O 3.49Å; Q247-Q284 VanDerWaalsContact NE2-CB 3.31Å
248	D	93	Very high	93.7	Very high	88 Å²	88	53.7 Å²	53.7	47%	0.471	26%	0.263	S	S	.	.	H	α-helix	trans	-57.6	-45.9	178.5	-103.9	15.4	0	0	0	113	S244 T250 Q251 R252	S244-D248 PolarHBondContact O-N 3.05Å; D248-T250 VanDerWaalsContact C-N 3.26Å; D248-T250 PolarHBondContact O-N 3.26Å; D248-Q251 PolarHBondContact O-N 3.14Å; D248-R252 WeakPolarHBondContact O-CB 3.15Å; D248-R252 WeakPolarHBondContact O-CG 3.44Å; D248-R252 PolarHBondContact O-N 3.47Å; D248-R252 PolarHBondContact O-NE 3.27Å
249	N	94.8	Very high	93.4	Very high	59 Å²	59	57.4 Å²	57.4	32%	0.316	28%	0.283	S	S	.	.	H	α-helix	trans	-65.8	-30.4	176.2	-79.1	-59	0	0	0	112	I245 Q247 R252 Q253	I245-N249 WeakPolarHBondContact CG2-ND2 3.2Å; I245-N249 WeakPolarHBondContact O-CB 3.47Å; I245-N249 PolarHBondContact O-N 3.13Å; I245-N249 VanDerWaalsContact O-N 3.1Å; I245-N249 PolarHBondContact O-ND2 3.46Å; Q247-N249 PolarHBondContact O-N 2.93Å; N249-R252 PolarHBondContact OD1-NH1 3.14Å; N249-R252 PolarHBondContact OD1-NH2 2.88Å; N249-Q253 WeakPolarHBondContact O-CB 3.47Å; N249-Q253 VanDerWaalsContact O-CG 3.24Å; N249-Q253 WeakPolarHBondContact O-CG 3.43Å; N249-Q253 PolarHBondContact O-N 3.24Å; N249-Q253 PolarHBondContact O-NE2 3.26Å; N249-Q253 VanDerWaalsContact O-NE2 3.13Å
250	T	94.1	Very high	93.1	Very high	8 Å²	8	61.2 Å²	61.2	5%	0.049	30%	0.3	C	S	.	.	H	α-helix	trans	-76.7	-39.9	175.7	-57.4	0	0	0	0	111.2	H246 Q247 D248 Q253 Y254 L273 K276 R277	H246-T250 VanDerWaalsContact O-CB 3.3Å; H246-T250 WeakPolarHBondContact O-CB 3.48Å; H246-T250 PolarHBondContact O-N 3.43Å; H246-T250 PolarHBondContact O-OG1 3.35Å; Q247-T250 CarbonylContact O-C 3.58Å; Q247-T250 WeakPolarHBondContact O-CA 3.24Å; Q247-T250 WeakPolarHBondContact O-CB 3.22Å; Q247-T250 PolarHBondContact O-N 2.91Å; D248-T250 VanDerWaalsContact C-N 3.26Å; D248-T250 PolarHBondContact O-N 3.26Å; T250-Q253 WeakPolarHBondContact O-CB 3.18Å; T250-Q253 PolarHBondContact O-N 3.33Å; T250-Y254 WeakPolarHBondContact O-CB 3.28Å; T250-Y254 PolarHBondContact O-N 2.99Å; T250-L273 HydrophobicContact CG2-CD2 4.01Å; T250-K276 HydrophobicContact CG2-CG 4.46Å; T250-R277 HydrophobicContact CG2-CB 4.16Å
251	Q	92.9	Very high	92.5	Very high	47 Å²	47	67.7 Å²	67.7	22%	0.22	33%	0.333	C	S	.	.	H	α-helix	trans	-62.1	-48.6	174.7	-179.5	62.9	22.8	0	0	111.1	Q247 D248 Q253 Y254 E255 R277	Q247-Q251 WeakPolarHBondContact O-CB 3.49Å; Q247-Q251 PolarHBondContact O-N 3.33Å; D248-Q251 PolarHBondContact O-N 3.14Å; Q251-Q253 VanDerWaalsContact C-N 3.28Å; Q251-Q253 PolarHBondContact O-N 2.99Å; Q251-Y254 WeakPolarHBondContact O-CB 3.43Å; Q251-Y254 PolarHBondContact O-N 3.3Å; Q251-Y254 VanDerWaalsContact O-N 3.13Å; Q251-E255 PolarHBondContact NE2-OE1 3.35Å; Q251-E255 WeakPolarHBondContact O-CG 3.3Å; Q251-E255 PolarHBondContact O-N 3.07Å; Q251-R277 VanDerWaalsContact OE1-CD 3.23Å
252	R	94.1	Very high	91.4	Very high	130 Å²	130	69.3 Å²	69.3	49%	0.491	35%	0.352	S	S	.	.	H	α-helix	trans	-60.8	-35.4	174.8	-74.8	-177.9	-92.7	114.8	-6.1	112.4	D248 N249 A256	D248-R252 WeakPolarHBondContact O-CB 3.15Å; D248-R252 WeakPolarHBondContact O-CG 3.44Å; D248-R252 PolarHBondContact O-N 3.47Å; D248-R252 PolarHBondContact O-NE 3.27Å; N249-R252 PolarHBondContact OD1-NH1 3.14Å; N249-R252 PolarHBondContact OD1-NH2 2.88Å; R252-A256 VanDerWaalsContact O-CB 3.24Å; R252-A256 WeakPolarHBondContact O-CB 3.4Å; R252-A256 PolarHBondContact O-N 2.8Å
253	Q	91.9	Very high	90.3	Very high	100 Å²	100	71 Å²	71	47%	0.467	38%	0.381	S	S	.	.	H	α-helix	trans	-69.3	-40.2	172.6	-77.9	174.9	61.3	0	0	113.1	N249 T250 Q251 A256 E257 L273	N249-Q253 WeakPolarHBondContact O-CB 3.47Å; N249-Q253 VanDerWaalsContact O-CG 3.24Å; N249-Q253 WeakPolarHBondContact O-CG 3.43Å; N249-Q253 PolarHBondContact O-N 3.24Å; N249-Q253 PolarHBondContact O-NE2 3.26Å; N249-Q253 VanDerWaalsContact O-NE2 3.13Å; T250-Q253 WeakPolarHBondContact O-CB 3.18Å; T250-Q253 PolarHBondContact O-N 3.33Å; Q251-Q253 VanDerWaalsContact C-N 3.28Å; Q251-Q253 PolarHBondContact O-N 2.99Å; Q253-A256 PolarHBondContact O-N 2.81Å; Q253-E257 WeakPolarHBondContact O-CB 3.36Å; Q253-E257 PolarHBondContact O-N 3.13Å; Q253-L273 HydrophobicContact CB-CD1 4.17Å; Q253-L273 HydrophobicContact CB-CD2 4.11Å
254	Y	92.3	Very high	89.4	Confident	43 Å²	43	78.4 Å²	78.4	17%	0.169	41%	0.412	C	S	.	.	H	α-helix	trans	-62.6	-46.7	176.2	174.4	-98.4	0	0	0	111	T250 Q251 E257 R258 L270 L273 L274	T250-Y254 WeakPolarHBondContact O-CB 3.28Å; T250-Y254 PolarHBondContact O-N 2.99Å; Q251-Y254 WeakPolarHBondContact O-CB 3.43Å; Q251-Y254 PolarHBondContact O-N 3.3Å; Q251-Y254 VanDerWaalsContact O-N 3.13Å; Y254-E257 PolarHBondContact O-N 2.85Å; Y254-R258 VanDerWaalsContact O-CB 3.25Å; Y254-R258 WeakPolarHBondContact O-CB 3.41Å; Y254-R258 PolarHBondContact O-N 3.38Å; Y254-L270 HydrophobicContact CD2-CD2 3.52Å; Y254-L270 HydrophobicContact CE2-CB 4.28Å; Y254-L270 HydrophobicContact CE2-CD2 3.56Å; Y254-L270 HydrophobicContact CG-CD2 4.21Å; Y254-L270 WeakPolarHBondContact O-CD2 3.12Å; Y254-L273 HydrophobicContact CD2-CB 4.18Å; Y254-L274 HydrophobicContact CD2-CB 4.4Å; Y254-L274 HydrophobicContact CE2-CB 4.04Å; Y254-L274 HydrophobicContact CE2-CD1 4.07Å
255	E	92.4	Very high	88.9	Confident	78 Å²	78	81.9 Å²	81.9	36%	0.364	42%	0.421	S	S	.	.	H	α-helix	trans	-63.8	-44.2	175.8	-71.3	175.1	-174.9	0	0	112.6	Q251 E257 R258 N259	Q251-E255 PolarHBondContact NE2-OE1 3.35Å; Q251-E255 WeakPolarHBondContact O-CG 3.3Å; Q251-E255 PolarHBondContact O-N 3.07Å; E255-E257 VanDerWaalsContact C-N 3.25Å; E255-E257 PolarHBondContact O-N 3.06Å; E255-R258 PolarHBondContact O-N 3.33Å; E255-N259 VanDerWaalsContact O-CB 3.29Å; E255-N259 WeakPolarHBondContact O-CB 3.41Å; E255-N259 PolarHBondContact O-N 3.25Å; E255-N259 PolarHBondContact O-ND2 3.35Å
256	A	92.1	Very high	88.6	Confident	65 Å²	65	80.3 Å²	80.3	54%	0.537	42%	0.42	S	S	.	.	H	α-helix	trans	-63.5	-28.5	176.6	0	0	0	0	0	113.3	R252 Q253 K260	R252-A256 VanDerWaalsContact O-CB 3.24Å; R252-A256 WeakPolarHBondContact O-CB 3.4Å; R252-A256 PolarHBondContact O-N 2.8Å; Q253-A256 PolarHBondContact O-N 2.81Å; A256-K260 WeakPolarHBondContact O-CG 3.31Å
257	E	89.9	Confident	88.2	Confident	6 Å²	6	81.6 Å²	81.6	3%	0.028	43%	0.43	C	S	.	.	H	α-helix	trans	-80.4	-39.4	172.6	-163.5	64.7	-129.4	0	0	111.6	Q253 Y254 E255 K260 A266 K269 L270 L273	Q253-E257 WeakPolarHBondContact O-CB 3.36Å; Q253-E257 PolarHBondContact O-N 3.13Å; Y254-E257 PolarHBondContact O-N 2.85Å; E255-E257 VanDerWaalsContact C-N 3.25Å; E255-E257 PolarHBondContact O-N 3.06Å; E257-K260 WeakPolarHBondContact O-CB 3.2Å; E257-K260 PolarHBondContact O-N 2.78Å; E257-K260 WeakPolarHBondContact OE1-CD 3.27Å; E257-K260 WeakPolarHBondContact OE1-CE 3.32Å; E257-K260 IonicContact OE1-NZ 2.71Å; E257-K260 PolarHBondContact OE1-NZ 3Å; E257-K260 IonicContact OE2-NZ 2.72Å; E257-K260 PolarHBondContact OE2-NZ 3.15Å; E257-A266 PolarHBondContact OE1-N 3.4Å; E257-K269 HydrophobicContact CG-CD 4.21Å; E257-K269 WeakPolarHBondContact OE2-CD 3.33Å; E257-K269 IonicContact OE2-NZ 3.01Å; E257-K269 PolarHBondContact OE2-NZ 2.94Å; E257-L270 HydrophobicContact CB-CD2 3.86Å; E257-L270 HydrophobicContact CB-CG 4.18Å; E257-L270 HydrophobicContact CG-CD2 4.14Å; E257-L270 HydrophobicContact CG-CG 3.88Å; E257-L273 HydrophobicContact CB-CD1 4.49Å
258	R	89.1	Confident	87.9	Confident	136 Å²	136	88 Å²	88	51%	0.513	46%	0.459	S	S	.	.	H	α-helix	trans	-64.1	-43.4	179.4	-176.3	-178.6	-178.7	-162	0.9	111.6	Y254 E255 K260 R265 L270	Y254-R258 VanDerWaalsContact O-CB 3.25Å; Y254-R258 WeakPolarHBondContact O-CB 3.41Å; Y254-R258 PolarHBondContact O-N 3.38Å; E255-R258 PolarHBondContact O-N 3.33Å; R258-K260 PolarHBondContact O-N 3.25Å; R258-R265 VanDerWaalsContact O-CZ 3.24Å; R258-R265 PolarHBondContact O-NE 2.82Å; R258-R265 PolarHBondContact O-NH2 3.09Å; R258-L270 HydrophobicContact CB-CD2 3.94Å
259	N	90.6	Very high	87.7	Confident	127 Å²	127	88 Å²	88	68%	0.679	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.3	-0.8	-175.7	-65.9	-14.2	0	0	0	113.5	E255	E255-N259 VanDerWaalsContact O-CB 3.29Å; E255-N259 WeakPolarHBondContact O-CB 3.41Å; E255-N259 PolarHBondContact O-N 3.25Å; E255-N259 PolarHBondContact O-ND2 3.35Å
260	K	90.2	Very high	87.4	Confident	80 Å²	80	86.1 Å²	86.1	35%	0.348	45%	0.445	S	S	.	.	S	Bend	trans	-67.3	145.2	169.4	-63.2	-177.1	-170.2	169.7	0	111.6	A256 E257 R258 K264 R265	A256-K260 WeakPolarHBondContact O-CG 3.31Å; E257-K260 WeakPolarHBondContact O-CB 3.2Å; E257-K260 PolarHBondContact O-N 2.78Å; E257-K260 WeakPolarHBondContact OE1-CD 3.27Å; E257-K260 WeakPolarHBondContact OE1-CE 3.32Å; E257-K260 IonicContact OE1-NZ 2.71Å; E257-K260 PolarHBondContact OE1-NZ 3Å; E257-K260 IonicContact OE2-NZ 2.72Å; E257-K260 PolarHBondContact OE2-NZ 3.15Å; R258-K260 PolarHBondContact O-N 3.25Å; K260-K264 VanDerWaalsContact CD-O 3.29Å; K260-K264 WeakPolarHBondContact CD-O 3.24Å; K260-R265 HydrophobicContact CB-CB 4.37Å; K260-R265 PolarHBondContact O-NH2 3.48Å; K260-R265 VanDerWaalsContact O-NH2 3.16Å
261	I	84.7	Confident	87.2	Confident	137 Å²	137	92.7 Å²	92.7	70%	0.703	48%	0.475	S	S	*	.			trans	-51.7	136.6	168.5	-56.9	170.2	0	0	0	108.9	G263 K264 R265	I261-G263 VanDerWaalsContact C-N 3.3Å; I261-G263 PolarHBondContact O-N 3.45Å; I261-G263 VanDerWaalsContact O-N 3.08Å; I261-K264 WeakPolarHBondContact O-CA 3.44Å; I261-K264 PolarHBondContact O-N 3.12Å; I261-R265 PolarHBondContact O-N 3.01Å
262	A	73.2	Confident	87.2	Confident	76 Å²	76	96.4 Å²	96.4	63%	0.628	50%	0.496	S	S	*	.	G	3₁₀ helix	trans	-49	-43	-168.9	0	0	0	0	0	114.7	K264 R265	A262-K264 PolarHBondContact O-N 2.78Å; A262-K264 VanDerWaalsContact O-N 3.13Å; A262-R265 PolarHBondContact O-N 3.46Å
263	G	72	Confident	87.1	Confident	81 Å²	81	90.9 Å²	90.9	84%	0.835	48%	0.476	S	S	*	.	G	3₁₀ helix	trans	-72.5	5.1	177.2	0	0	0	0	0	116.3	I261	I261-G263 VanDerWaalsContact C-N 3.3Å; I261-G263 PolarHBondContact O-N 3.45Å; I261-G263 VanDerWaalsContact O-N 3.08Å
264	K	75.7	Confident	87.1	Confident	164 Å²	164	89.9 Å²	89.9	71%	0.713	47%	0.473	S	S	*	.	G	3₁₀ helix	trans	-131.1	8.3	176.3	-67.3	-174.2	177.6	179.5	0	113	K260 I261 A262	K260-K264 VanDerWaalsContact CD-O 3.29Å; K260-K264 WeakPolarHBondContact CD-O 3.24Å; I261-K264 WeakPolarHBondContact O-CA 3.44Å; I261-K264 PolarHBondContact O-N 3.12Å; A262-K264 PolarHBondContact O-N 2.78Å; A262-K264 VanDerWaalsContact O-N 3.13Å
265	R	84.7	Confident	87.2	Confident	100 Å²	100	91.9 Å²	91.9	38%	0.377	48%	0.484	S	S	.	.			trans	-90.4	124.4	-179.6	-179.5	-175	-66.2	160.3	2.8	109.8	R258 K260 I261 A262 N267 L270	R258-R265 VanDerWaalsContact O-CZ 3.24Å; R258-R265 PolarHBondContact O-NE 2.82Å; R258-R265 PolarHBondContact O-NH2 3.09Å; K260-R265 HydrophobicContact CB-CB 4.37Å; K260-R265 PolarHBondContact O-NH2 3.48Å; K260-R265 VanDerWaalsContact O-NH2 3.16Å; I261-R265 PolarHBondContact O-N 3.01Å; A262-R265 PolarHBondContact O-N 3.46Å; R265-N267 WeakPolarHBondContact CD-OD1 3.15Å; R265-N267 PolarHBondContact O-N 3.06Å; R265-L270 HydrophobicContact CG-CD1 3.54Å
266	A	87.3	Confident	87.2	Confident	44 Å²	44	93.2 Å²	93.2	36%	0.364	49%	0.489	S	S	.	.			trans	-88.2	98.2	173.9	0	0	0	0	0	110.4	E257 K269 L270	E257-A266 PolarHBondContact OE1-N 3.4Å; A266-K269 HydrophobicContact CB-CB 3.8Å; A266-K269 WeakPolarHBondContact O-CB 3.49Å; A266-K269 PolarHBondContact O-N 3.03Å; A266-L270 PolarHBondContact O-N 3.38Å; A266-L270 VanDerWaalsContact O-N 3.09Å
267	N	84.3	Confident	87.1	Confident	110 Å²	110	94.8 Å²	94.8	59%	0.588	48%	0.481	S	S	*	.	H	α-helix	trans	-63.4	-42.5	-177	-71	-10	0	0	0	112.7	R265 K269 L270 E271	R265-N267 WeakPolarHBondContact CD-OD1 3.15Å; R265-N267 PolarHBondContact O-N 3.06Å; N267-K269 PolarHBondContact O-N 3.19Å; N267-L270 WeakPolarHBondContact O-CA 3.39Å; N267-L270 WeakPolarHBondContact O-CB 3.39Å; N267-L270 PolarHBondContact O-N 3.09Å; N267-E271 PolarHBondContact O-N 2.84Å
268	E	87	Confident	87.3	Confident	169 Å²	169	99.3 Å²	99.3	79%	0.79	50%	0.501	S	S	*	.	H	α-helix	trans	-56.1	-36.6	174.3	-62.4	168.1	179.8	0	0	112.1	L272	E268-L272 WeakPolarHBondContact O-CB 3.43Å; E268-L272 PolarHBondContact O-N 3.06Å
269	K	88.6	Confident	87.5	Confident	87 Å²	87	97 Å²	97	38%	0.378	50%	0.496	S	S	.	.	H	α-helix	trans	-73.7	-33.1	176.9	-173.3	-175.1	164.2	-155.4	0	112	E257 A266 N267 L273	E257-K269 HydrophobicContact CG-CD 4.21Å; E257-K269 WeakPolarHBondContact OE2-CD 3.33Å; E257-K269 IonicContact OE2-NZ 3.01Å; E257-K269 PolarHBondContact OE2-NZ 2.94Å; A266-K269 HydrophobicContact CB-CB 3.8Å; A266-K269 WeakPolarHBondContact O-CB 3.49Å; A266-K269 PolarHBondContact O-N 3.03Å; N267-K269 PolarHBondContact O-N 3.19Å; K269-L273 HydrophobicContact CG-CD1 4.15Å; K269-L273 WeakPolarHBondContact O-CB 3.38Å; K269-L273 VanDerWaalsContact O-CG 3.25Å; K269-L273 WeakPolarHBondContact O-CG 3.34Å; K269-L273 PolarHBondContact O-N 3.24Å
270	L	87.9	Confident	87.6	Confident	21 Å²	21	91.9 Å²	91.9	11%	0.11	47%	0.468	C	S	.	.	H	α-helix	trans	-66.1	-41.3	172.7	-80.3	166.1	0	0	0	111.6	Y254 E257 R258 R265 A266 N267 L273 L274	Y254-L270 HydrophobicContact CD2-CD2 3.52Å; Y254-L270 HydrophobicContact CE2-CB 4.28Å; Y254-L270 HydrophobicContact CE2-CD2 3.56Å; Y254-L270 HydrophobicContact CG-CD2 4.21Å; Y254-L270 WeakPolarHBondContact O-CD2 3.12Å; E257-L270 HydrophobicContact CB-CD2 3.86Å; E257-L270 HydrophobicContact CB-CG 4.18Å; E257-L270 HydrophobicContact CG-CD2 4.14Å; E257-L270 HydrophobicContact CG-CG 3.88Å; R258-L270 HydrophobicContact CB-CD2 3.94Å; R265-L270 HydrophobicContact CG-CD1 3.54Å; A266-L270 PolarHBondContact O-N 3.38Å; A266-L270 VanDerWaalsContact O-N 3.09Å; N267-L270 WeakPolarHBondContact O-CA 3.39Å; N267-L270 WeakPolarHBondContact O-CB 3.39Å; N267-L270 PolarHBondContact O-N 3.09Å; L270-L273 PolarHBondContact O-N 2.93Å; L270-L274 VanDerWaalsContact O-CB 3.31Å; L270-L274 WeakPolarHBondContact O-CB 3.43Å; L270-L274 PolarHBondContact O-N 3.4Å
271	E	91	Very high	87.8	Confident	146 Å²	146	92 Å²	92	68%	0.682	47%	0.47	S	S	*	.	H	α-helix	trans	-63.6	-47.9	175.4	-171.1	167.2	-161.5	0	0	111.1	N267 L273 L274 Q275	N267-E271 PolarHBondContact O-N 2.84Å; E271-L273 PolarHBondContact O-N 3.15Å; E271-L274 PolarHBondContact O-N 3.06Å; E271-Q275 WeakPolarHBondContact O-CB 3.49Å; E271-Q275 PolarHBondContact O-N 2.66Å
272	L	92.3	Very high	88.3	Confident	124 Å²	124	90 Å²	90	65%	0.649	46%	0.458	S	S	*	.	H	α-helix	trans	-58.8	-41.7	174.2	-174.2	71.5	0	0	0	113	E268 K276	E268-L272 WeakPolarHBondContact O-CB 3.43Å; E268-L272 PolarHBondContact O-N 3.06Å; L272-K276 WeakPolarHBondContact O-CB 3.5Å; L272-K276 PolarHBondContact O-N 3.28Å
273	L	92.3	Very high	89.3	Confident	14 Å²	14	88.7 Å²	88.7	7%	0.073	44%	0.44	C	S	.	.	H	α-helix	trans	-69.5	-34.6	177.3	-76.7	169.1	0	0	0	112.3	T250 Q253 Y254 E257 K269 L270 E271 R277	T250-L273 HydrophobicContact CG2-CD2 4.01Å; Q253-L273 HydrophobicContact CB-CD1 4.17Å; Q253-L273 HydrophobicContact CB-CD2 4.11Å; Y254-L273 HydrophobicContact CD2-CB 4.18Å; E257-L273 HydrophobicContact CB-CD1 4.49Å; K269-L273 HydrophobicContact CG-CD1 4.15Å; K269-L273 WeakPolarHBondContact O-CB 3.38Å; K269-L273 VanDerWaalsContact O-CG 3.25Å; K269-L273 WeakPolarHBondContact O-CG 3.34Å; K269-L273 PolarHBondContact O-N 3.24Å; L270-L273 PolarHBondContact O-N 2.93Å; E271-L273 PolarHBondContact O-N 3.15Å; L273-R277 WeakPolarHBondContact O-CB 3.46Å; L273-R277 PolarHBondContact O-N 3.07Å
274	L	91.8	Very high	90.3	Very high	79 Å²	79	85.2 Å²	85.2	41%	0.414	40%	0.402	S	S	.	.	H	α-helix	trans	-72	-41.3	176.8	-173.9	144.9	0	0	0	111.5	Y254 L270 E271 R277 K278	Y254-L274 HydrophobicContact CD2-CB 4.4Å; Y254-L274 HydrophobicContact CE2-CB 4.04Å; Y254-L274 HydrophobicContact CE2-CD1 4.07Å; L270-L274 VanDerWaalsContact O-CB 3.31Å; L270-L274 WeakPolarHBondContact O-CB 3.43Å; L270-L274 PolarHBondContact O-N 3.4Å; E271-L274 PolarHBondContact O-N 3.06Å; L274-R277 PolarHBondContact O-N 3.27Å; L274-K278 PolarHBondContact O-N 2.67Å
275	Q	93.4	Very high	91.3	Very high	85 Å²	85	81 Å²	81	40%	0.397	39%	0.387	S	S	.	.	H	α-helix	trans	-61.5	-49.3	172	174.4	55.6	28.4	0	0	111	E271 R277 K278 E279	E271-Q275 WeakPolarHBondContact O-CB 3.49Å; E271-Q275 PolarHBondContact O-N 2.66Å; Q275-R277 VanDerWaalsContact C-N 3.27Å; Q275-R277 PolarHBondContact O-N 3.44Å; Q275-K278 WeakPolarHBondContact O-CA 3.32Å; Q275-K278 WeakPolarHBondContact O-CB 3.19Å; Q275-K278 PolarHBondContact O-N 3.08Å; Q275-E279 WeakPolarHBondContact CG-OE1 3.22Å; Q275-E279 PolarHBondContact NE2-OE1 3.36Å; Q275-E279 PolarHBondContact O-N 3.29Å
276	K	92.9	Very high	91.8	Very high	106 Å²	106	79.5 Å²	79.5	46%	0.461	39%	0.385	S	S	.	.	H	α-helix	trans	-60.7	-34.7	175.6	179.3	166.2	-179.3	166.8	0	113	T250 L272 K278 L280	T250-K276 HydrophobicContact CG2-CG 4.46Å; L272-K276 WeakPolarHBondContact O-CB 3.5Å; L272-K276 PolarHBondContact O-N 3.28Å; K276-K278 VanDerWaalsContact C-N 3.32Å; K276-L280 HydrophobicContact CG-CD1 4.16Å; K276-L280 HydrophobicContact CG-CG 4.45Å; K276-L280 WeakPolarHBondContact O-CB 3.44Å; K276-L280 VanDerWaalsContact O-CG 3.32Å; K276-L280 WeakPolarHBondContact O-CG 3.41Å; K276-L280 PolarHBondContact O-N 3.44Å
277	R	90.5	Very high	92.2	Very high	99 Å²	99	77.4 Å²	77.4	37%	0.374	37%	0.367	S	S	.	.	H	α-helix	trans	-68.4	-32.2	174.7	-165.7	-168.6	68.4	158.4	10.8	111.8	T250 Q251 L273 L274 Q275 Q281	T250-R277 HydrophobicContact CG2-CB 4.16Å; Q251-R277 VanDerWaalsContact OE1-CD 3.23Å; L273-R277 WeakPolarHBondContact O-CB 3.46Å; L273-R277 PolarHBondContact O-N 3.07Å; L274-R277 PolarHBondContact O-N 3.27Å; Q275-R277 VanDerWaalsContact C-N 3.27Å; Q275-R277 PolarHBondContact O-N 3.44Å; R277-Q281 PolarHBondContact O-N 2.91Å; R277-Q281 VanDerWaalsContact O-N 3.13Å
278	K	93.8	Very high	92.7	Very high	101 Å²	101	76 Å²	76	44%	0.439	36%	0.357	S	S	.	.	H	α-helix	trans	-68	-47.5	173.2	-174	-177.8	169.3	-71.5	0	111	L274 Q275 K276 L280 Q281 E282	L274-K278 PolarHBondContact O-N 2.67Å; Q275-K278 WeakPolarHBondContact O-CA 3.32Å; Q275-K278 WeakPolarHBondContact O-CB 3.19Å; Q275-K278 PolarHBondContact O-N 3.08Å; K276-K278 VanDerWaalsContact C-N 3.32Å; K278-L280 VanDerWaalsContact C-N 3.33Å; K278-L280 PolarHBondContact O-N 2.85Å; K278-Q281 WeakPolarHBondContact O-CA 3.36Å; K278-Q281 WeakPolarHBondContact O-CB 3.45Å; K278-Q281 PolarHBondContact O-N 3.29Å; K278-E282 IonicContact NZ-OE1 3.83Å; K278-E282 PolarHBondContact NZ-OE1 2.9Å; K278-E282 IonicContact NZ-OE2 2.73Å; K278-E282 PolarHBondContact NZ-OE2 3.18Å; K278-E282 WeakPolarHBondContact O-CG 3.35Å; K278-E282 PolarHBondContact O-N 3.33Å
279	E	93.4	Very high	93.2	Very high	88 Å²	88	72 Å²	72	41%	0.411	34%	0.341	S	S	.	.	H	α-helix	trans	-56.8	-44.1	173.9	-67.1	160.3	-173.4	0	0	112	Q275 Q281 E282 N283	Q275-E279 WeakPolarHBondContact CG-OE1 3.22Å; Q275-E279 PolarHBondContact NE2-OE1 3.36Å; Q275-E279 PolarHBondContact O-N 3.29Å; E279-Q281 VanDerWaalsContact C-N 3.26Å; E279-Q281 PolarHBondContact O-N 3.34Å; E279-E282 PolarHBondContact O-N 3.05Å; E279-N283 WeakPolarHBondContact O-CB 3.47Å; E279-N283 PolarHBondContact O-N 3.47Å; E279-N283 PolarHBondContact O-OD1 3Å
280	L	92.6	Very high	93.6	Very high	19 Å²	19	68 Å²	68	10%	0.099	32%	0.324	C	S	.	.	H	α-helix	trans	-68.9	-19.7	175.8	-73.2	171.9	0	0	0	114	L243 H246 Q247 K276 K278 Q284	L243-L280 HydrophobicContact CD2-CD2 3.87Å; H246-L280 HydrophobicContact CB-CD1 4.18Å; H246-L280 HydrophobicContact CB-CD2 4.23Å; Q247-L280 HydrophobicContact CG-CB 3.81Å; Q247-L280 PolarHBondContact NE2-O 3.49Å; K276-L280 HydrophobicContact CG-CD1 4.16Å; K276-L280 HydrophobicContact CG-CG 4.45Å; K276-L280 WeakPolarHBondContact O-CB 3.44Å; K276-L280 VanDerWaalsContact O-CG 3.32Å; K276-L280 WeakPolarHBondContact O-CG 3.41Å; K276-L280 PolarHBondContact O-N 3.44Å; K278-L280 VanDerWaalsContact C-N 3.33Å; K278-L280 PolarHBondContact O-N 2.85Å; L280-Q284 WeakPolarHBondContact O-CB 3.48Å; L280-Q284 PolarHBondContact O-N 3.22Å
281	Q	94.3	Very high	94.1	Very high	82 Å²	82	67.6 Å²	67.6	38%	0.383	32%	0.322	S	S	.	.	H	α-helix	trans	-81.5	-46.2	171.7	-172.7	67.6	60.8	0	0	110.5	R277 K278 E279 N283 Q284 D285	R277-Q281 PolarHBondContact O-N 2.91Å; R277-Q281 VanDerWaalsContact O-N 3.13Å; K278-Q281 WeakPolarHBondContact O-CA 3.36Å; K278-Q281 WeakPolarHBondContact O-CB 3.45Å; K278-Q281 PolarHBondContact O-N 3.29Å; E279-Q281 VanDerWaalsContact C-N 3.26Å; E279-Q281 PolarHBondContact O-N 3.34Å; Q281-N283 VanDerWaalsContact C-N 3.26Å; Q281-N283 PolarHBondContact O-N 3.11Å; Q281-Q284 WeakPolarHBondContact O-CA 3.1Å; Q281-Q284 WeakPolarHBondContact O-CB 3.18Å; Q281-Q284 PolarHBondContact O-N 3.49Å; Q281-D285 PolarHBondContact NE2-OD1 3.17Å; Q281-D285 VanDerWaalsContact O-CG 3.22Å; Q281-D285 PolarHBondContact O-N 3.11Å
282	E	94.6	Very high	94.3	Very high	95 Å²	95	63.5 Å²	63.5	44%	0.444	31%	0.305	S	S	.	.	H	α-helix	trans	-59.6	-39.4	178.3	-68.9	171.4	137.5	0	0	110.9	K278 E279 Q284 E286	K278-E282 IonicContact NZ-OE1 3.83Å; K278-E282 PolarHBondContact NZ-OE1 2.9Å; K278-E282 IonicContact NZ-OE2 2.73Å; K278-E282 PolarHBondContact NZ-OE2 3.18Å; K278-E282 WeakPolarHBondContact O-CG 3.35Å; K278-E282 PolarHBondContact O-N 3.33Å; E279-E282 PolarHBondContact O-N 3.05Å; E282-Q284 PolarHBondContact O-N 2.88Å; E282-E286 WeakPolarHBondContact O-CB 3.3Å; E282-E286 PolarHBondContact O-N 3.39Å
283	N	94.8	Very high	94.6	Very high	49 Å²	49	60.6 Å²	60.6	26%	0.262	30%	0.295	S	S	.	.	H	α-helix	trans	-65.9	-32.8	171	-74.4	23.6	0	0	0	113.9	Y198 L243 E279 Q281 I287	Y198-N283 HydrophobicContact CD1-CB 4.17Å; Y198-N283 HydrophobicContact CE1-CB 3.56Å; Y198-N283 WeakPolarHBondContact CE2-ND2 3.45Å; Y198-N283 VanDerWaalsContact CZ-ND2 3.32Å; L243-N283 HydrophobicContact CD1-CB 4.16Å; L243-N283 HydrophobicContact CD2-CB 4.1Å; E279-N283 WeakPolarHBondContact O-CB 3.47Å; E279-N283 PolarHBondContact O-N 3.47Å; E279-N283 PolarHBondContact O-OD1 3Å; Q281-N283 VanDerWaalsContact C-N 3.26Å; Q281-N283 PolarHBondContact O-N 3.11Å; N283-I287 VanDerWaalsContact O-CG1 3.29Å; N283-I287 WeakPolarHBondContact O-CG1 3.42Å; N283-I287 PolarHBondContact O-N 3.11Å
284	Q	93.9	Very high	94.9	Very high	7 Å²	7	60 Å²	60	3%	0.033	29%	0.291	C	S	.	.	H	α-helix	trans	-72.6	-48.4	179.2	176	70.5	24.8	0	0	110.4	A240 L243 Q247 L280 Q281 E282 E286 I287 E288	A240-Q284 PolarHBondContact O-OE1 3.17Å; L243-Q284 VanDerWaalsContact CB-OE1 3.24Å; Q247-Q284 VanDerWaalsContact NE2-CB 3.31Å; L280-Q284 WeakPolarHBondContact O-CB 3.48Å; L280-Q284 PolarHBondContact O-N 3.22Å; Q281-Q284 WeakPolarHBondContact O-CA 3.1Å; Q281-Q284 WeakPolarHBondContact O-CB 3.18Å; Q281-Q284 PolarHBondContact O-N 3.49Å; E282-Q284 PolarHBondContact O-N 2.88Å; Q284-E286 PolarHBondContact O-N 2.93Å; Q284-I287 PolarHBondContact O-N 3.03Å; Q284-E288 PolarHBondContact NE2-OE1 2.96Å; Q284-E288 WeakPolarHBondContact O-CG 3.24Å; Q284-E288 PolarHBondContact O-N 2.82Å
285	D	95.1	Very high	95.2	Very high	76 Å²	76	57.1 Å²	57.1	41%	0.406	28%	0.276	S	S	.	.	H	α-helix	trans	-55.1	-39.3	177.3	-60.5	-7.8	0	0	0	110.2	Q281 E288 N289	Q281-D285 PolarHBondContact NE2-OD1 3.17Å; Q281-D285 VanDerWaalsContact O-CG 3.22Å; Q281-D285 PolarHBondContact O-N 3.11Å; D285-E288 PolarHBondContact O-N 2.66Å; D285-N289 VanDerWaalsContact O-CG 3.28Å; D285-N289 PolarHBondContact O-N 3Å; D285-N289 PolarHBondContact O-ND2 3.01Å
286	E	95.6	Very high	95.4	Very high	69 Å²	69	59.2 Å²	59.2	32%	0.322	28%	0.283	S	S	.	.	H	α-helix	trans	-75.3	-38.8	-179.3	-165.3	44	-132	0	0	113.7	E282 Q284 E288 N289 M290	E282-E286 WeakPolarHBondContact O-CB 3.3Å; E282-E286 PolarHBondContact O-N 3.39Å; Q284-E286 PolarHBondContact O-N 2.93Å; E286-E288 VanDerWaalsContact C-N 3.25Å; E286-E288 PolarHBondContact O-N 3.26Å; E286-N289 WeakPolarHBondContact O-CB 3.46Å; E286-N289 PolarHBondContact O-N 3.41Å; E286-N289 VanDerWaalsContact O-N 3.16Å; E286-N289 PolarHBondContact OE2-ND2 3.13Å; E286-M290 HydrophobicContact CG-CE 3.84Å; E286-M290 WeakPolarHBondContact O-CG 3.22Å; E286-M290 PolarHBondContact O-N 2.91Å
287	I	96.7	Very high	95.5	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-63.7	-35.6	169.9	-64.6	-70.9	0	0	0	110.5	I197 Y198 L236 V239 A240 L243 N283 Q284 M290 M291	I197-I287 HydrophobicContact CD1-CD1 3.68Å; I197-I287 HydrophobicContact CG1-CD1 4.04Å; I197-I287 HydrophobicContact CG2-CD1 4.39Å; Y198-I287 HydrophobicContact CE1-CD1 4.04Å; Y198-I287 HydrophobicContact CE1-CG1 3.88Å; L236-I287 HydrophobicContact CB-CG2 4.3Å; L236-I287 HydrophobicContact CD2-CD1 3.77Å; L236-I287 HydrophobicContact CD2-CG2 4.21Å; V239-I287 HydrophobicContact CB-CD1 4.47Å; V239-I287 HydrophobicContact CG1-CD1 3.87Å; V239-I287 HydrophobicContact CG1-CG1 4.05Å; A240-I287 HydrophobicContact CB-CG2 3.96Å; L243-I287 HydrophobicContact CD1-CB 4.47Å; L243-I287 HydrophobicContact CD1-CG1 3.89Å; N283-I287 VanDerWaalsContact O-CG1 3.29Å; N283-I287 WeakPolarHBondContact O-CG1 3.42Å; N283-I287 PolarHBondContact O-N 3.11Å; Q284-I287 PolarHBondContact O-N 3.03Å; I287-M290 HydrophobicContact CD1-CE 4.02Å; I287-M290 HydrophobicContact CD1-SD 4.12Å; I287-M290 PolarHBondContact O-N 2.97Å; I287-M291 HydrophobicContact CG2-CE 4.18Å; I287-M291 HydrophobicContact CG2-CG 4.43Å; I287-M291 HydrophobicContact CG2-SD 4.44Å; I287-M291 WeakPolarHBondContact O-CB 3.5Å; I287-M291 VanDerWaalsContact O-CG 3.29Å; I287-M291 WeakPolarHBondContact O-CG 3.34Å; I287-M291 PolarHBondContact O-N 3.12Å
288	E	95.1	Very high	95.9	Very high	81 Å²	81	50.8 Å²	50.8	38%	0.379	26%	0.258	S	S	.	.	H	α-helix	trans	-66.8	-34	173	-74.7	-176.2	-149.3	0	0	112.9	Q284 D285 E286 M291 N292	Q284-E288 PolarHBondContact NE2-OE1 2.96Å; Q284-E288 WeakPolarHBondContact O-CG 3.24Å; Q284-E288 PolarHBondContact O-N 2.82Å; D285-E288 PolarHBondContact O-N 2.66Å; E286-E288 VanDerWaalsContact C-N 3.25Å; E286-E288 PolarHBondContact O-N 3.26Å; E288-M291 HydrophobicContact CB-CE 4.45Å; E288-M291 HydrophobicContact CG-CE 3.77Å; E288-N292 VanDerWaalsContact O-CB 3.24Å; E288-N292 WeakPolarHBondContact O-CB 3.5Å; E288-N292 PolarHBondContact O-N 3.34Å; E288-N292 PolarHBondContact O-ND2 3.43Å
289	N	96.4	Very high	96.1	Very high	83 Å²	83	46 Å²	46	44%	0.444	24%	0.237	S	C	.	.	H	α-helix	trans	-62.8	-47.9	171.5	-71	-30.7	0	0	0	111.7	D285 E286 N292 S293	D285-N289 VanDerWaalsContact O-CG 3.28Å; D285-N289 PolarHBondContact O-N 3Å; D285-N289 PolarHBondContact O-ND2 3.01Å; E286-N289 WeakPolarHBondContact O-CB 3.46Å; E286-N289 PolarHBondContact O-N 3.41Å; E286-N289 VanDerWaalsContact O-N 3.16Å; E286-N289 PolarHBondContact OE2-ND2 3.13Å; N289-N292 PolarHBondContact O-N 3.11Å; N289-S293 WeakPolarHBondContact O-CB 3.46Å; N289-S293 PolarHBondContact O-N 3.1Å; N289-S293 PolarHBondContact O-OG 3.09Å
290	M	97.6	Very high	96.4	Very high	5 Å²	5	43.2 Å²	43.2	3%	0.025	23%	0.226	C	C	.	.	H	α-helix	trans	-60	-47.7	175.6	-64	175	-140.2	0	0	111.8	I197 M203 I207 L236 E286 I287 N292 S293 I294	I197-M290 HydrophobicContact CG1-CE 4.46Å; I197-M290 HydrophobicContact CG1-SD 4.29Å; I197-M290 VanDerWaalsContact O-CE 3.28Å; I197-M290 WeakPolarHBondContact O-CE 3.35Å; M203-M290 HydrophobicContact CB-SD 3.84Å; M203-M290 HydrophobicContact CE-SD 3.75Å; M203-M290 HydrophobicContact CG-CE 4.41Å; M203-M290 HydrophobicContact CG-SD 3.73Å; I207-M290 HydrophobicContact CD1-CB 3.84Å; I207-M290 HydrophobicContact CD1-CG 4.07Å; L236-M290 HydrophobicContact CD1-CB 3.92Å; L236-M290 HydrophobicContact CD2-CB 4.42Å; L236-M290 HydrophobicContact CD2-SD 3.91Å; E286-M290 HydrophobicContact CG-CE 3.84Å; E286-M290 WeakPolarHBondContact O-CG 3.22Å; E286-M290 PolarHBondContact O-N 2.91Å; I287-M290 HydrophobicContact CD1-CE 4.02Å; I287-M290 HydrophobicContact CD1-SD 4.12Å; I287-M290 PolarHBondContact O-N 2.97Å; M290-N292 PolarHBondContact O-N 3.19Å; M290-S293 WeakPolarHBondContact O-CB 3.46Å; M290-S293 PolarHBondContact O-N 3.37Å; M290-I294 PolarHBondContact O-N 3.16Å
291	M	97.7	Very high	96.6	Very high	11 Å²	11	46.5 Å²	46.5	5%	0.054	24%	0.24	C	C	.	.	H	α-helix	trans	-61.2	-44.4	177.6	-75.6	-166.8	-57.2	0	0	111.9	M233 L236 V237 A240 I287 E288 S293 I294 F295 F329	M233-M291 HydrophobicContact CE-CB 3.77Å; M233-M291 HydrophobicContact CE-CG 4.04Å; M233-M291 HydrophobicContact CE-SD 4.29Å; M233-M291 HydrophobicContact SD-CB 3.73Å; M233-M291 HydrophobicContact SD-CG 3.73Å; L236-M291 HydrophobicContact CB-CG 3.64Å; L236-M291 HydrophobicContact CB-SD 4.18Å; L236-M291 HydrophobicContact CD1-CG 4.25Å; V237-M291 HydrophobicContact CB-SD 4.43Å; V237-M291 HydrophobicContact CG2-SD 3.7Å; A240-M291 HydrophobicContact CB-CE 3.87Å; A240-M291 HydrophobicContact CB-SD 4.42Å; I287-M291 HydrophobicContact CG2-CE 4.18Å; I287-M291 HydrophobicContact CG2-CG 4.43Å; I287-M291 HydrophobicContact CG2-SD 4.44Å; I287-M291 WeakPolarHBondContact O-CB 3.5Å; I287-M291 VanDerWaalsContact O-CG 3.29Å; I287-M291 WeakPolarHBondContact O-CG 3.34Å; I287-M291 PolarHBondContact O-N 3.12Å; E288-M291 HydrophobicContact CB-CE 4.45Å; E288-M291 HydrophobicContact CG-CE 3.77Å; M291-S293 VanDerWaalsContact C-N 3.27Å; M291-S293 PolarHBondContact O-N 2.94Å; M291-I294 PolarHBondContact O-N 3.39Å; M291-F295 VanDerWaalsContact O-CB 3.23Å; M291-F295 WeakPolarHBondContact O-CB 3.33Å; M291-F295 PolarHBondContact O-N 2.91Å; M291-F329 HydrophobicContact CE-CZ 4.49Å; M291-F329 HydrophobicContact SD-CE2 4.43Å; M291-F329 HydrophobicContact SD-CZ 4.04Å
292	N	96.8	Very high	96.8	Very high	61 Å²	61	43.9 Å²	43.9	33%	0.326	23%	0.227	S	C	.	.	H	α-helix	trans	-60.1	-38.6	175.2	-93.2	-88.8	0	0	0	112.1	E288 N289 M290 F295 K296	E288-N292 VanDerWaalsContact O-CB 3.24Å; E288-N292 WeakPolarHBondContact O-CB 3.5Å; E288-N292 PolarHBondContact O-N 3.34Å; E288-N292 PolarHBondContact O-ND2 3.43Å; N289-N292 PolarHBondContact O-N 3.11Å; M290-N292 PolarHBondContact O-N 3.19Å; N292-F295 PolarHBondContact O-N 3.36Å; N292-K296 VanDerWaalsContact O-CB 3.28Å; N292-K296 WeakPolarHBondContact O-CB 3.44Å; N292-K296 WeakPolarHBondContact O-CG 3.45Å; N292-K296 PolarHBondContact O-N 3.48Å; N292-K296 WeakPolarHBondContact OD1-CE 3.46Å; N292-K296 PolarHBondContact OD1-NZ 3.28Å
293	S	97	Very high	97	Very high	63 Å²	63	40.8 Å²	40.8	44%	0.441	21%	0.211	S	C	.	.	H	α-helix	trans	-68.1	-47.2	-178.2	-60.1	0	0	0	0	111.5	N289 M290 M291 G297	N289-S293 WeakPolarHBondContact O-CB 3.46Å; N289-S293 PolarHBondContact O-N 3.1Å; N289-S293 PolarHBondContact O-OG 3.09Å; M290-S293 WeakPolarHBondContact O-CB 3.46Å; M290-S293 PolarHBondContact O-N 3.37Å; M291-S293 VanDerWaalsContact C-N 3.27Å; M291-S293 PolarHBondContact O-N 2.94Å; S293-G297 WeakPolarHBondContact O-CA 3.19Å; S293-G297 PolarHBondContact O-N 3.35Å
294	I	98.3	Very high	97.1	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-63.6	-42.3	173.6	-62.8	165.6	0	0	0	111	I207 A229 M230 L232 M233 L236 M290 M291 I298 F299	I207-I294 HydrophobicContact CD1-CD1 4.07Å; I207-I294 HydrophobicContact CD1-CG1 4.15Å; I207-I294 HydrophobicContact CG1-CD1 4.08Å; I207-I294 HydrophobicContact CG1-CG1 4.01Å; I207-I294 HydrophobicContact CG2-CG1 4.08Å; A229-I294 HydrophobicContact CB-CG2 4.19Å; M230-I294 HydrophobicContact CE-CG2 3.96Å; L232-I294 HydrophobicContact CB-CD1 4.41Å; L232-I294 HydrophobicContact CD2-CD1 3.77Å; L232-I294 HydrophobicContact CG-CD1 3.74Å; M233-I294 HydrophobicContact CB-CG2 4.1Å; M233-I294 HydrophobicContact SD-CB 4.33Å; M233-I294 HydrophobicContact SD-CG2 4.46Å; L236-I294 HydrophobicContact CD1-CD1 3.62Å; M290-I294 PolarHBondContact O-N 3.16Å; M291-I294 PolarHBondContact O-N 3.39Å; I294-I298 HydrophobicContact CG2-CD1 4.44Å; I294-I298 WeakPolarHBondContact O-CA 3.42Å; I294-I298 VanDerWaalsContact O-CB 3.3Å; I294-I298 WeakPolarHBondContact O-CB 3.24Å; I294-I298 PolarHBondContact O-N 3.46Å; I294-F299 PolarHBondContact O-N 3.49Å; I294-F299 VanDerWaalsContact O-N 3.15Å
295	F	98.3	Very high	97.4	Very high	20 Å²	20	45.2 Å²	45.2	9%	0.088	23%	0.225	C	C	.	.	I	π-helix	trans	-65.1	-48.3	-177.9	-171.4	-98.1	0	0	0	112.2	M233 M291 N292 F299 V300 I318 W321 Y334 Y337	M233-F295 HydrophobicContact CE-CB 4.39Å; M291-F295 VanDerWaalsContact O-CB 3.23Å; M291-F295 WeakPolarHBondContact O-CB 3.33Å; M291-F295 PolarHBondContact O-N 2.91Å; N292-F295 PolarHBondContact O-N 3.36Å; F295-F299 HydrophobicContact CD2-CB 3.96Å; F295-F299 AromaticContact CD2-CD1 3.72Å; F295-F299 HydrophobicContact CD2-CD1 3.72Å; F295-F299 HydrophobicContact CD2-CE1 4.5Å; F295-F299 AromaticContact CD2-CG 3.92Å; F295-F299 HydrophobicContact CD2-CG 3.92Å; F295-F299 HydrophobicContact CE1-CD1 4.41Å; F295-F299 HydrophobicContact CE2-CB 4.34Å; F295-F299 AromaticContact CE2-CD1 3.21Å; F295-F299 HydrophobicContact CE2-CD1 3.21Å; F295-F299 AromaticContact CE2-CE1 3.59Å; F295-F299 HydrophobicContact CE2-CE1 3.59Å; F295-F299 AromaticContact CE2-CG 3.8Å; F295-F299 HydrophobicContact CE2-CG 3.8Å; F295-F299 HydrophobicContact CE2-CZ 4.41Å; F295-F299 HydrophobicContact CG-CD1 4.49Å; F295-F299 AromaticContact CZ-CD1 3.62Å; F295-F299 HydrophobicContact CZ-CD1 3.62Å; F295-F299 AromaticContact CZ-CE1 3.82Å; F295-F299 HydrophobicContact CZ-CE1 3.82Å; F295-F299 WeakPolarHBondContact O-CB 3.4Å; F295-F299 PolarHBondContact O-N 3.03Å; F295-V300 HydrophobicContact CD1-CG2 3.97Å; F295-V300 HydrophobicContact CE1-CG2 3.71Å; F295-V300 HydrophobicContact CZ-CG2 4.28Å; F295-V300 WeakPolarHBondContact O-CG2 3.28Å; F295-V300 PolarHBondContact O-N 3.43Å; F295-I318 HydrophobicContact CE2-CD1 4.33Å; F295-W321 AromaticContact CD2-CZ3 3.94Å; F295-W321 HydrophobicContact CD2-CZ3 3.94Å; F295-W321 HydrophobicContact CE2-CZ3 4.1Å; F295-Y334 HydrophobicContact CD2-CE1 4.09Å; F295-Y334 HydrophobicContact CE1-CE1 4.18Å; F295-Y334 AromaticContact CE2-CD1 3.72Å; F295-Y334 HydrophobicContact CE2-CD1 3.72Å; F295-Y334 AromaticContact CE2-CE1 3.58Å; F295-Y334 HydrophobicContact CE2-CE1 3.58Å; F295-Y334 AromaticContact CZ-CD1 3.73Å; F295-Y334 HydrophobicContact CZ-CD1 3.73Å; F295-Y334 AromaticContact CZ-CE1 3.62Å; F295-Y334 HydrophobicContact CZ-CE1 3.62Å; F295-Y337 HydrophobicContact CE1-CE2 4.34Å; F295-Y337 HydrophobicContact CZ-CD2 4.31Å; F295-Y337 AromaticContact CZ-CE2 3.69Å; F295-Y337 HydrophobicContact CZ-CE2 3.69Å
296	K	97.2	Very high	97.5	Very high	128 Å²	128	45.9 Å²	45.9	56%	0.557	24%	0.241	S	C	*	.	I	π-helix	trans	-75.2	-43.5	-178.6	-69.8	164	177	158	0	112.2	N292 H301	N292-K296 VanDerWaalsContact O-CB 3.28Å; N292-K296 WeakPolarHBondContact O-CB 3.44Å; N292-K296 WeakPolarHBondContact O-CG 3.45Å; N292-K296 PolarHBondContact O-N 3.48Å; N292-K296 WeakPolarHBondContact OD1-CE 3.46Å; N292-K296 PolarHBondContact OD1-NZ 3.28Å; K296-H301 PolarHBondContact O-CD2 2.99Å
297	G	96.4	Very high	97.6	Very high	29 Å²	29	44.5 Å²	44.5	30%	0.299	24%	0.235	S	C	.	.	I	π-helix	trans	-74.5	-35.6	-178	0	0	0	0	0	114	S293	S293-G297 WeakPolarHBondContact O-CA 3.19Å; S293-G297 PolarHBondContact O-N 3.35Å
298	I	98.4	Very high	97.6	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	24%	0.241	C	C	.	.	I	π-helix	trans	-115.5	-64.7	-171.5	-50.5	-178.1	0	0	0	111.3	L210 T211 T226 A229 M230 I294 V300 H301 R302	L210-I298 HydrophobicContact CB-CD1 4.27Å; T211-I298 HydrophobicContact CG2-CG1 4.28Å; T226-I298 HydrophobicContact CG2-CG2 4.46Å; A229-I298 HydrophobicContact CB-CB 4.5Å; A229-I298 HydrophobicContact CB-CD1 3.42Å; A229-I298 VanDerWaalsContact CB-CD1 3.42Å; A229-I298 HydrophobicContact CB-CG2 4.04Å; M230-I298 HydrophobicContact CE-CB 4.25Å; M230-I298 HydrophobicContact CE-CG2 3.87Å; I294-I298 HydrophobicContact CG2-CD1 4.44Å; I294-I298 WeakPolarHBondContact O-CA 3.42Å; I294-I298 VanDerWaalsContact O-CB 3.3Å; I294-I298 WeakPolarHBondContact O-CB 3.24Å; I294-I298 PolarHBondContact O-N 3.46Å; I298-V300 PolarHBondContact O-N 3.33Å; I298-H301 PolarHBondContact O-N 3.09Å; I298-R302 HydrophobicContact CG2-CG 3.92Å; I298-R302 WeakPolarHBondContact O-CB 3.33Å; I298-R302 WeakPolarHBondContact O-CG 3.46Å; I298-R302 PolarHBondContact O-N 3.35Å
299	F	98.7	Very high	97.7	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	24%	0.237	C	C	.	.	I	π-helix	trans	-56.3	-49.6	-171.8	173.2	-87.3	0	0	0	112.4	M230 I294 F295 H301 R302 Y303 C314 I318 W321 Y337	M230-F299 HydrophobicContact CE-CB 4.14Å; M230-F299 HydrophobicContact SD-CB 4.15Å; M230-F299 HydrophobicContact SD-CD2 3.89Å; I294-F299 PolarHBondContact O-N 3.49Å; I294-F299 VanDerWaalsContact O-N 3.15Å; F295-F299 HydrophobicContact CD2-CB 3.96Å; F295-F299 AromaticContact CD2-CD1 3.72Å; F295-F299 HydrophobicContact CD2-CD1 3.72Å; F295-F299 HydrophobicContact CD2-CE1 4.5Å; F295-F299 AromaticContact CD2-CG 3.92Å; F295-F299 HydrophobicContact CD2-CG 3.92Å; F295-F299 HydrophobicContact CE1-CD1 4.41Å; F295-F299 HydrophobicContact CE2-CB 4.34Å; F295-F299 AromaticContact CE2-CD1 3.21Å; F295-F299 HydrophobicContact CE2-CD1 3.21Å; F295-F299 AromaticContact CE2-CE1 3.59Å; F295-F299 HydrophobicContact CE2-CE1 3.59Å; F295-F299 AromaticContact CE2-CG 3.8Å; F295-F299 HydrophobicContact CE2-CG 3.8Å; F295-F299 HydrophobicContact CE2-CZ 4.41Å; F295-F299 HydrophobicContact CG-CD1 4.49Å; F295-F299 AromaticContact CZ-CD1 3.62Å; F295-F299 HydrophobicContact CZ-CD1 3.62Å; F295-F299 AromaticContact CZ-CE1 3.82Å; F295-F299 HydrophobicContact CZ-CE1 3.82Å; F295-F299 WeakPolarHBondContact O-CB 3.4Å; F295-F299 PolarHBondContact O-N 3.03Å; F299-H301 PolarHBondContact O-N 2.9Å; F299-R302 PolarHBondContact O-N 2.94Å; F299-R302 VanDerWaalsContact O-N 3.16Å; F299-Y303 HydrophobicContact CE1-CD1 4.35Å; F299-Y303 HydrophobicContact CE1-CG 4.43Å; F299-Y303 HydrophobicContact CZ-CG 4.44Å; F299-Y303 WeakPolarHBondContact O-CD1 3.38Å; F299-Y303 PolarHBondContact O-N 2.92Å; F299-C314 HydrophobicContact CD2-CB 3.83Å; F299-C314 HydrophobicContact CE2-CB 3.78Å; F299-C314 WeakPolarHBondContact CE2-O 3.45Å; F299-I318 HydrophobicContact CE1-CD1 3.96Å; F299-I318 HydrophobicContact CE2-CB 3.89Å; F299-I318 HydrophobicContact CE2-CD1 4Å; F299-I318 HydrophobicContact CE2-CG2 4.05Å; F299-I318 HydrophobicContact CZ-CB 4.19Å; F299-I318 HydrophobicContact CZ-CD1 3.45Å; F299-I318 VanDerWaalsContact CZ-CD1 3.45Å; F299-I318 HydrophobicContact CZ-CG1 4.4Å; F299-I318 HydrophobicContact CZ-CG2 4.21Å; F299-W321 AromaticContact CD2-CH2 3.82Å; F299-W321 HydrophobicContact CD2-CH2 3.82Å; F299-W321 HydrophobicContact CD2-CZ3 4.05Å; F299-W321 HydrophobicContact CE2-CH2 4.43Å; F299-W321 HydrophobicContact CE2-CZ3 4.4Å; F299-W321 HydrophobicContact CG-CH2 4.35Å; F299-W321 HydrophobicContact CG-CZ3 4.42Å; F299-Y337 AromaticContact CE1-CD1 3.91Å; F299-Y337 HydrophobicContact CE1-CD1 3.91Å; F299-Y337 AromaticContact CE1-CD2 3.82Å; F299-Y337 HydrophobicContact CE1-CD2 3.82Å; F299-Y337 HydrophobicContact CE1-CE1 4.22Å; F299-Y337 HydrophobicContact CE1-CE2 4.15Å; F299-Y337 AromaticContact CE1-CG 3.71Å; F299-Y337 HydrophobicContact CE1-CG 3.71Å; F299-Y337 HydrophobicContact CZ-CD1 4.44Å; F299-Y337 HydrophobicContact CZ-CD2 4.32Å; F299-Y337 HydrophobicContact CZ-CG 4.01Å
300	V	98.3	Very high	97.9	Very high	29 Å²	29	40.3 Å²	40.3	18%	0.176	22%	0.216	C	C	.	.	H	α-helix	trans	-61.7	-17.6	-178.1	167.6	0	0	0	0	113.2	F295 I298 Y303 R304	F295-V300 HydrophobicContact CD1-CG2 3.97Å; F295-V300 HydrophobicContact CE1-CG2 3.71Å; F295-V300 HydrophobicContact CZ-CG2 4.28Å; F295-V300 WeakPolarHBondContact O-CG2 3.28Å; F295-V300 PolarHBondContact O-N 3.43Å; I298-V300 PolarHBondContact O-N 3.33Å; V300-Y303 WeakPolarHBondContact O-CE1 3.4Å; V300-R304 VanDerWaalsContact O-CZ 3.27Å; V300-R304 PolarHBondContact O-NE 2.74Å; V300-R304 PolarHBondContact O-NH2 2.73Å
301	H	98.1	Very high	97.9	Very high	89 Å²	89	41.3 Å²	41.3	41%	0.412	22%	0.219	S	C	.	.	H	α-helix	trans	-98.3	-39.7	173.9	-67.4	-98.1	0	0	0	112.2	K296 I298 F299 R304	K296-H301 PolarHBondContact O-CD2 2.99Å; I298-H301 PolarHBondContact O-N 3.09Å; F299-H301 PolarHBondContact O-N 2.9Å; H301-R304 WeakPolarHBondContact O-CG 3.34Å
302	R	98.4	Very high	97.9	Very high	27 Å²	27	41 Å²	41	10%	0.102	22%	0.218	C	C	.	.	H	α-helix	trans	-87.3	-21.8	-171.4	-61.9	-63.9	125.6	-114.1	-5.9	115.5	S214 D215 T226 I298 F299 R304 D305 I310	S214-R302 WeakPolarHBondContact O-CD 3.08Å; S214-R302 PolarHBondContact O-NE 3.21Å; D215-R302 IonicContact OD1-NH2 3.08Å; D215-R302 PolarHBondContact OD1-NH2 3.36Å; T226-R302 HydrophobicContact CG2-CB 3.75Å; T226-R302 HydrophobicContact CG2-CG 4.05Å; T226-R302 WeakPolarHBondContact OG1-CG 2.99Å; I298-R302 HydrophobicContact CG2-CG 3.92Å; I298-R302 WeakPolarHBondContact O-CB 3.33Å; I298-R302 WeakPolarHBondContact O-CG 3.46Å; I298-R302 PolarHBondContact O-N 3.35Å; F299-R302 PolarHBondContact O-N 2.94Å; F299-R302 VanDerWaalsContact O-N 3.16Å; R302-R304 PolarHBondContact O-N 2.7Å; R302-D305 WeakPolarHBondContact CD-OD2 3.32Å; R302-D305 IonicContact CZ-OD2 3.33Å; R302-D305 IonicContact NE-OD2 2.69Å; R302-D305 IonicContact NH1-OD2 2.64Å; R302-D305 PolarHBondContact NH1-OD2 3.16Å; R302-D305 PolarHBondContact O-N 3.01Å; R302-D305 VanDerWaalsContact O-N 3.1Å; R302-I310 HydrophobicContact CB-CG2 4.06Å
303	Y	98.3	Very high	98	Very high	29 Å²	29	38.4 Å²	38.4	11%	0.114	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-16.2	171.2	91.9	-88.2	0	0	0	113.1	F299 V300 R311 Y337	F299-Y303 HydrophobicContact CE1-CD1 4.35Å; F299-Y303 HydrophobicContact CE1-CG 4.43Å; F299-Y303 HydrophobicContact CZ-CG 4.44Å; F299-Y303 WeakPolarHBondContact O-CD1 3.38Å; F299-Y303 PolarHBondContact O-N 2.92Å; V300-Y303 WeakPolarHBondContact O-CE1 3.4Å; Y303-R311 WeakPolarHBondContact O-CB 3.45Å; Y303-R311 VanDerWaalsContact O-CD 3.31Å; Y303-R311 WeakPolarHBondContact O-CD 3.4Å; Y303-R311 VanDerWaalsContact O-CG 3.28Å; Y303-R311 WeakPolarHBondContact O-CG 3.11Å; Y303-Y337 HydrophobicContact CD1-CD1 4Å; Y303-Y337 HydrophobicContact CD1-CE1 4.2Å; Y303-Y337 HydrophobicContact CD2-CD1 4.09Å; Y303-Y337 AromaticContact CE1-CD1 3.71Å; Y303-Y337 HydrophobicContact CE1-CD1 3.71Å; Y303-Y337 AromaticContact CE1-CE1 3.67Å; Y303-Y337 HydrophobicContact CE1-CE1 3.67Å; Y303-Y337 AromaticContact CE2-CD1 3.82Å; Y303-Y337 HydrophobicContact CE2-CD1 3.82Å; Y303-Y337 HydrophobicContact CG-CD1 4.19Å; Y303-Y337 AromaticContact CZ-CD1 3.62Å; Y303-Y337 AromaticContact CZ-CE1 3.85Å
304	R	97.9	Very high	98.1	Very high	143 Å²	143	35.4 Å²	35.4	54%	0.54	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-125.9	31.9	179.8	56.8	-179.5	159.4	164.1	-2.6	112.4	V300 H301 R302	V300-R304 VanDerWaalsContact O-CZ 3.27Å; V300-R304 PolarHBondContact O-NE 2.74Å; V300-R304 PolarHBondContact O-NH2 2.73Å; H301-R304 WeakPolarHBondContact O-CG 3.34Å; R302-R304 PolarHBondContact O-N 2.7Å
305	D	98.6	Very high	98.1	Very high	6 Å²	6	35.4 Å²	35.4	3%	0.032	18%	0.183	C	C	.	.			trans	-59.8	158.5	170	-152.9	-77.4	0	0	0	111.7	R222 R302 I307 I310 R311	R222-D305 WeakPolarHBondContact CD-OD2 3.3Å; R222-D305 IonicContact CZ-OD1 2.68Å; R222-D305 IonicContact CZ-OD2 2.8Å; R222-D305 IonicContact NE-OD1 3.03Å; R222-D305 PolarHBondContact NE-OD1 3.35Å; R222-D305 IonicContact NE-OD2 3.42Å; R222-D305 PolarHBondContact NE-OD2 3.29Å; R222-D305 IonicContact NH2-OD1 2.87Å; R222-D305 PolarHBondContact NH2-OD1 2.87Å; R222-D305 IonicContact NH2-OD2 3.95Å; R302-D305 WeakPolarHBondContact CD-OD2 3.32Å; R302-D305 IonicContact CZ-OD2 3.33Å; R302-D305 IonicContact NE-OD2 2.69Å; R302-D305 IonicContact NH1-OD2 2.64Å; R302-D305 PolarHBondContact NH1-OD2 3.16Å; R302-D305 PolarHBondContact O-N 3.01Å; R302-D305 VanDerWaalsContact O-N 3.1Å; D305-I307 VanDerWaalsContact C-N 3.27Å; D305-I307 PolarHBondContact O-N 3.03Å; D305-I307 PolarHBondContact OD1-N 3.33Å; D305-I310 HydrophobicContact CB-CB 3.96Å; D305-I310 HydrophobicContact CB-CG2 3.84Å; D305-R311 HydrophobicContact CB-CG 4.28Å; D305-R311 VanDerWaalsContact O-CD 3.22Å; D305-R311 WeakPolarHBondContact O-CD 3.45Å; D305-R311 WeakPolarHBondContact O-CG 3.18Å; D305-R311 PolarHBondContact O-NH1 3.4Å
306	A	97.4	Very high	98.1	Very high	90 Å²	90	37.9 Å²	37.9	74%	0.744	20%	0.195	S	C	*	.	S	Bend	trans	-64	-36.1	169.3	0	0	0	0	0	111.4	R311	A306-R311 PolarHBondContact O-NH1 2.58Å
307	I	97.6	Very high	98.2	Very high	41 Å²	41	32.1 Å²	32.1	21%	0.21	17%	0.17	C	C	.	.	S	Bend	trans	-79.5	124.3	-179.4	-51.1	-57.1	0	0	0	110.7	R219 D305 E309 I310 R311	R219-I307 HydrophobicContact CG-CG1 4.25Å; D305-I307 VanDerWaalsContact C-N 3.27Å; D305-I307 PolarHBondContact O-N 3.03Å; D305-I307 PolarHBondContact OD1-N 3.33Å; I307-E309 HydrophobicContact CG2-CB 4.22Å; I307-I310 HydrophobicContact CB-CB 4.41Å; I307-I310 HydrophobicContact CB-CD1 3.86Å; I307-I310 HydrophobicContact CB-CG1 3.94Å; I307-I310 HydrophobicContact CG1-CD1 4.2Å; I307-I310 HydrophobicContact CG2-CD1 4.24Å; I307-I310 HydrophobicContact CG2-CG1 3.98Å; I307-I310 PolarHBondContact O-N 3.05Å; I307-R311 PolarHBondContact O-N 2.97Å
308	A	98	Very high	98.3	Very high	15 Å²	15	30.8 Å²	30.8	12%	0.124	16%	0.156	C	C	.	.	H	α-helix	trans	-68.3	-43.8	-173.6	0	0	0	0	0	113.5	I310 R311 A312 Q346 E348 V349	A308-I310 PolarHBondContact O-N 3.18Å; A308-I310 VanDerWaalsContact O-N 3.11Å; A308-R311 WeakPolarHBondContact O-CA 3.27Å; A308-R311 WeakPolarHBondContact O-CB 2.99Å; A308-R311 PolarHBondContact O-N 3.23Å; A308-A312 WeakPolarHBondContact O-CB 3.36Å; A308-A312 PolarHBondContact O-N 2.67Å; A308-Q346 HydrophobicContact CB-CB 3.98Å; A308-Q346 HydrophobicContact CB-CG 3.85Å; A308-E348 HydrophobicContact CB-CG 4.26Å; A308-E348 WeakPolarHBondContact CB-OE1 3.41Å; A308-V349 HydrophobicContact CB-CG2 3.9Å
309	E	97.4	Very high	98.2	Very high	61 Å²	61	30.9 Å²	30.9	29%	0.285	16%	0.157	S	C	.	.	H	α-helix	trans	-46.1	-41.3	170.2	-64.7	160.4	-157.2	0	0	113.4	R219 H223 I307 A312 I313 E348	R219-E309 IonicContact CZ-OE1 2.83Å; R219-E309 IonicContact CZ-OE2 2.69Å; R219-E309 IonicContact NH2-OE1 3.4Å; R219-E309 PolarHBondContact NH2-OE1 3.35Å; R219-E309 IonicContact NH2-OE2 3.4Å; R219-E309 PolarHBondContact NH2-OE2 2.64Å; H223-E309 IonicContact CE1-OE2 3.22Å; H223-E309 PolarHBondContact CE1-OE2 3.02Å; H223-E309 IonicContact ND1-OE2 3.88Å; H223-E309 PolarHBondContact ND1-OE2 2.91Å; I307-E309 HydrophobicContact CG2-CB 4.22Å; E309-A312 PolarHBondContact O-N 2.89Å; E309-I313 WeakPolarHBondContact O-CD1 3.48Å; E309-I313 VanDerWaalsContact O-CG1 3.31Å; E309-I313 WeakPolarHBondContact O-CG1 3.37Å; E309-I313 PolarHBondContact O-N 2.85Å; E309-E348 PolarHBondContact N-OE1 3.39Å; E309-E348 VanDerWaalsContact N-OE1 3.15Å
310	I	98.6	Very high	98.1	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-70.6	-41.9	-178.8	-58.4	-175.9	0	0	0	110.2	R222 H223 T226 R302 D305 I307 A308 I313 C314	R222-I310 HydrophobicContact CG-CD1 4.24Å; H223-I310 HydrophobicContact CB-CD1 3.89Å; H223-I310 HydrophobicContact CB-CG1 4.04Å; T226-I310 HydrophobicContact CG2-CG2 3.9Å; R302-I310 HydrophobicContact CB-CG2 4.06Å; D305-I310 HydrophobicContact CB-CB 3.96Å; D305-I310 HydrophobicContact CB-CG2 3.84Å; I307-I310 HydrophobicContact CB-CB 4.41Å; I307-I310 HydrophobicContact CB-CD1 3.86Å; I307-I310 HydrophobicContact CB-CG1 3.94Å; I307-I310 HydrophobicContact CG1-CD1 4.2Å; I307-I310 HydrophobicContact CG2-CD1 4.24Å; I307-I310 HydrophobicContact CG2-CG1 3.98Å; I307-I310 PolarHBondContact O-N 3.05Å; A308-I310 PolarHBondContact O-N 3.18Å; A308-I310 VanDerWaalsContact O-N 3.11Å; I310-I313 PolarHBondContact O-N 3.25Å; I310-C314 PolarHBondContact O-N 3.38Å
311	R	98.8	Very high	98.1	Very high	26 Å²	26	31.9 Å²	31.9	10%	0.098	16%	0.163	C	C	.	.	H	α-helix	trans	-62.5	-45.7	173.4	-57.7	-162.4	-63.4	-76.9	1.7	111.1	Y303 D305 A306 I307 A308 I313 C314 I315 D344 V349	Y303-R311 WeakPolarHBondContact O-CB 3.45Å; Y303-R311 VanDerWaalsContact O-CD 3.31Å; Y303-R311 WeakPolarHBondContact O-CD 3.4Å; Y303-R311 VanDerWaalsContact O-CG 3.28Å; Y303-R311 WeakPolarHBondContact O-CG 3.11Å; D305-R311 HydrophobicContact CB-CG 4.28Å; D305-R311 VanDerWaalsContact O-CD 3.22Å; D305-R311 WeakPolarHBondContact O-CD 3.45Å; D305-R311 WeakPolarHBondContact O-CG 3.18Å; D305-R311 PolarHBondContact O-NH1 3.4Å; A306-R311 PolarHBondContact O-NH1 2.58Å; I307-R311 PolarHBondContact O-N 2.97Å; A308-R311 WeakPolarHBondContact O-CA 3.27Å; A308-R311 WeakPolarHBondContact O-CB 2.99Å; A308-R311 PolarHBondContact O-N 3.23Å; R311-I313 VanDerWaalsContact C-N 3.34Å; R311-I313 PolarHBondContact O-N 3Å; R311-C314 PolarHBondContact O-N 3.34Å; R311-I315 WeakPolarHBondContact O-CG1 3.34Å; R311-I315 PolarHBondContact O-N 2.88Å; R311-D344 IonicContact CZ-OD1 3.8Å; R311-D344 IonicContact CZ-OD2 3.52Å; R311-D344 VanDerWaalsContact CZ-OD2 3.31Å; R311-D344 IonicContact NE-OD1 2.74Å; R311-D344 IonicContact NE-OD2 3.49Å; R311-D344 PolarHBondContact NE-OD2 3.09Å; R311-D344 IonicContact NH2-OD1 2.66Å; R311-D344 PolarHBondContact NH2-OD1 3.37Å; R311-D344 IonicContact NH2-OD2 2.81Å; R311-D344 PolarHBondContact NH2-OD2 3.17Å; R311-D344 VanDerWaalsContact NH2-OD2 3.13Å; R311-V349 HydrophobicContact CB-CG1 3.98Å; R311-V349 HydrophobicContact CB-CG2 4.25Å
312	A	98.5	Very high	98.1	Very high	4 Å²	4	27.6 Å²	27.6	3%	0.033	14%	0.144	C	C	.	.	H	α-helix	trans	-57.1	-42.6	176.7	0	0	0	0	0	112.5	A308 E309 I315 E316 V349 K352	A308-A312 WeakPolarHBondContact O-CB 3.36Å; A308-A312 PolarHBondContact O-N 2.67Å; E309-A312 PolarHBondContact O-N 2.89Å; A312-I315 PolarHBondContact O-N 3.03Å; A312-E316 WeakPolarHBondContact O-CB 3.32Å; A312-E316 PolarHBondContact O-N 3.33Å; A312-V349 HydrophobicContact CB-CG2 4.37Å; A312-K352 HydrophobicContact CB-CG 3.88Å
313	I	98.5	Very high	97.9	Very high	6 Å²	6	31 Å²	31	3%	0.031	16%	0.159	C	C	.	.	H	α-helix	trans	-62.4	-44.6	175.4	-76	163.5	0	0	0	112.1	H223 L227 M230 E309 I310 R311 E317	H223-I313 WeakPolarHBondContact NE2-CD1 3.36Å; L227-I313 HydrophobicContact CB-CD1 4.36Å; L227-I313 HydrophobicContact CB-CG2 4.48Å; L227-I313 HydrophobicContact CD1-CD1 4.2Å; L227-I313 HydrophobicContact CD1-CG1 4.35Å; L227-I313 HydrophobicContact CD1-CG2 3.94Å; M230-I313 HydrophobicContact CB-CG2 4.41Å; M230-I313 HydrophobicContact CG-CG2 4.09Å; E309-I313 WeakPolarHBondContact O-CD1 3.48Å; E309-I313 VanDerWaalsContact O-CG1 3.31Å; E309-I313 WeakPolarHBondContact O-CG1 3.37Å; E309-I313 PolarHBondContact O-N 2.85Å; I310-I313 PolarHBondContact O-N 3.25Å; R311-I313 VanDerWaalsContact C-N 3.34Å; R311-I313 PolarHBondContact O-N 3Å; I313-E317 PolarHBondContact O-N 2.83Å
314	C	98.8	Very high	97.8	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-62.8	-43.9	176.4	-72.4	0	0	0	0	112	M230 F299 I310 R311 E317 I318	M230-C314 HydrophobicContact SD-CB 4.46Å; F299-C314 HydrophobicContact CD2-CB 3.83Å; F299-C314 HydrophobicContact CE2-CB 3.78Å; F299-C314 WeakPolarHBondContact CE2-O 3.45Å; I310-C314 PolarHBondContact O-N 3.38Å; R311-C314 PolarHBondContact O-N 3.34Å; C314-E317 PolarHBondContact O-N 2.91Å; C314-I318 WeakPolarHBondContact O-CG2 3.29Å; C314-I318 PolarHBondContact O-N 2.98Å; C314-I318 VanDerWaalsContact O-N 3.11Å
315	I	98.6	Very high	97.7	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-67.7	-36.2	-179.8	-67.8	-60.6	0	0	0	112.6	R311 A312 I318 G319 T341 V349 K352 C353	R311-I315 WeakPolarHBondContact O-CG1 3.34Å; R311-I315 PolarHBondContact O-N 2.88Å; A312-I315 PolarHBondContact O-N 3.03Å; I315-I318 WeakPolarHBondContact O-CG2 3.42Å; I315-G319 PolarHBondContact O-N 3.42Å; I315-T341 HydrophobicContact CD1-CG2 4.02Å; I315-T341 HydrophobicContact CG1-CG2 3.88Å; I315-V349 HydrophobicContact CG1-CG1 4.47Å; I315-K352 HydrophobicContact CB-CB 4.36Å; I315-K352 HydrophobicContact CG2-CB 3.87Å; I315-C353 HydrophobicContact CG2-CB 4.3Å; I315-C353 VanDerWaalsContact CG2-SG 3.58Å
316	E	98.1	Very high	97.6	Very high	73 Å²	73	28.1 Å²	28.1	34%	0.341	16%	0.155	S	C	.	.	H	α-helix	trans	-62.2	-49.5	174.9	-173.8	153.3	-127.1	0	0	111.5	A312 G319 V320 K352	A312-E316 WeakPolarHBondContact O-CB 3.32Å; A312-E316 PolarHBondContact O-N 3.33Å; E316-G319 PolarHBondContact O-N 3.49Å; E316-V320 PolarHBondContact O-N 3.25Å; E316-V320 VanDerWaalsContact O-N 3.15Å; E316-K352 HydrophobicContact CB-CD 4.16Å; E316-K352 HydrophobicContact CG-CD 4.38Å; E316-K352 IonicContact OE1-NZ 3.2Å; E316-K352 PolarHBondContact OE1-NZ 3.47Å; E316-K352 IonicContact OE2-NZ 3.24Å; E316-K352 PolarHBondContact OE2-NZ 2.96Å
317	E	98.3	Very high	97.4	Very high	7 Å²	7	30 Å²	30	3%	0.033	15%	0.152	C	C	.	.	H	α-helix	trans	-75.4	-34	-173.6	-64.1	-66.9	110.2	0	0	113.1	M230 K231 T234 I313 C314 G319 V320 W321	M230-E317 HydrophobicContact CB-CB 3.86Å; M230-E317 HydrophobicContact CB-CG 3.7Å; K231-E317 WeakPolarHBondContact CD-OE2 3.46Å; K231-E317 WeakPolarHBondContact CE-OE2 3.26Å; K231-E317 IonicContact NZ-OE1 3.6Å; K231-E317 PolarHBondContact NZ-OE1 3.44Å; K231-E317 IonicContact NZ-OE2 3.13Å; K231-E317 PolarHBondContact NZ-OE2 2.9Å; T234-E317 PolarHBondContact OG1-OE2 3.04Å; I313-E317 PolarHBondContact O-N 2.83Å; C314-E317 PolarHBondContact O-N 2.91Å; E317-G319 PolarHBondContact O-N 3.22Å; E317-V320 CarbonylContact O-C 3.48Å; E317-V320 WeakPolarHBondContact O-CA 3.22Å; E317-V320 WeakPolarHBondContact O-CB 3.4Å; E317-V320 PolarHBondContact O-N 3.49Å; E317-W321 HydrophobicContact CB-CZ2 3.83Å; E317-W321 VanDerWaalsContact O-CG 3.23Å; E317-W321 PolarHBondContact O-N 3.49Å; E317-W321 PolarHBondContact O-NE1 3.44Å
318	I	98.4	Very high	97.2	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-63.2	-32.9	171	-168.1	169.3	0	0	0	111.8	F295 F299 C314 I315 V320 W321 M322 Y334 Y337 V338	F295-I318 HydrophobicContact CE2-CD1 4.33Å; F299-I318 HydrophobicContact CE1-CD1 3.96Å; F299-I318 HydrophobicContact CE2-CB 3.89Å; F299-I318 HydrophobicContact CE2-CD1 4Å; F299-I318 HydrophobicContact CE2-CG2 4.05Å; F299-I318 HydrophobicContact CZ-CB 4.19Å; F299-I318 HydrophobicContact CZ-CD1 3.45Å; F299-I318 VanDerWaalsContact CZ-CD1 3.45Å; F299-I318 HydrophobicContact CZ-CG1 4.4Å; F299-I318 HydrophobicContact CZ-CG2 4.21Å; C314-I318 WeakPolarHBondContact O-CG2 3.29Å; C314-I318 PolarHBondContact O-N 2.98Å; C314-I318 VanDerWaalsContact O-N 3.11Å; I315-I318 WeakPolarHBondContact O-CG2 3.42Å; I318-V320 VanDerWaalsContact C-N 3.35Å; I318-W321 HydrophobicContact CB-CE3 3.91Å; I318-W321 HydrophobicContact CB-CZ3 3.89Å; I318-W321 HydrophobicContact CG1-CE3 3.86Å; I318-W321 HydrophobicContact CG1-CZ3 4.05Å; I318-W321 PolarHBondContact O-N 2.89Å; I318-M322 HydrophobicContact CG1-CE 4.32Å; I318-M322 WeakPolarHBondContact O-CG 3.43Å; I318-M322 PolarHBondContact O-N 3.23Å; I318-Y334 HydrophobicContact CD1-CD1 4.02Å; I318-Y337 HydrophobicContact CD1-CD2 4.12Å; I318-V338 HydrophobicContact CG2-CG2 4.12Å
319	G	97.1	Very high	97.1	Very high	3 Å²	3	29.6 Å²	29.6	3%	0.031	15%	0.154	C	C	.	.	H	α-helix	trans	-60.6	-42.4	168.8	0	0	0	0	0	112.6	I315 E316 E317 K323	I315-G319 PolarHBondContact O-N 3.42Å; E316-G319 PolarHBondContact O-N 3.49Å; E317-G319 PolarHBondContact O-N 3.22Å; G319-K323 WeakPolarHBondContact O-CB 3.4Å; G319-K323 PolarHBondContact O-N 3.02Å; G319-K323 VanDerWaalsContact O-N 3.08Å
320	V	97.4	Very high	97.1	Very high	49 Å²	49	27 Å²	27	30%	0.297	14%	0.142	S	C	.	.	H	α-helix	trans	-63.3	-43.6	174.6	176.2	0	0	0	0	111.6	T234 E316 E317 I318 K323 M324	T234-V320 HydrophobicContact CG2-CG1 3.8Å; E316-V320 PolarHBondContact O-N 3.25Å; E316-V320 VanDerWaalsContact O-N 3.15Å; E317-V320 CarbonylContact O-C 3.48Å; E317-V320 WeakPolarHBondContact O-CA 3.22Å; E317-V320 WeakPolarHBondContact O-CB 3.4Å; E317-V320 PolarHBondContact O-N 3.49Å; I318-V320 VanDerWaalsContact C-N 3.35Å; V320-K323 PolarHBondContact O-N 2.75Å; V320-M324 HydrophobicContact CG1-CE 3.9Å; V320-M324 VanDerWaalsContact O-CB 3.22Å; V320-M324 WeakPolarHBondContact O-CB 3.28Å; V320-M324 PolarHBondContact O-N 3.01Å
321	W	98	Very high	96.9	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-63.3	-46.2	179	-48.8	-24.6	0	0	0	111.7	M230 M233 T234 V237 F295 F299 E317 I318 K323 M324 Y325 F329	M230-W321 HydrophobicContact CB-CZ2 4.45Å; M230-W321 HydrophobicContact SD-CH2 3.78Å; M230-W321 HydrophobicContact SD-CZ2 4Å; M233-W321 HydrophobicContact CB-CH2 4.4Å; M233-W321 HydrophobicContact CB-CZ2 3.72Å; M233-W321 HydrophobicContact CE-CE3 4.24Å; M233-W321 HydrophobicContact CE-CZ3 4.36Å; M233-W321 HydrophobicContact CG-CD2 3.98Å; M233-W321 VanDerWaalsContact CG-CE2 3.45Å; M233-W321 HydrophobicContact CG-CE3 4.29Å; M233-W321 HydrophobicContact CG-CH2 3.77Å; M233-W321 HydrophobicContact CG-CZ2 3.36Å; M233-W321 HydrophobicContact CG-CZ3 4.2Å; T234-W321 PolarHBondContact OG1-NE1 3.46Å; V237-W321 HydrophobicContact CG1-CB 4.49Å; V237-W321 HydrophobicContact CG2-CB 4.23Å; V237-W321 HydrophobicContact CG2-CG 4.01Å; F295-W321 AromaticContact CD2-CZ3 3.94Å; F295-W321 HydrophobicContact CD2-CZ3 3.94Å; F295-W321 HydrophobicContact CE2-CZ3 4.1Å; F299-W321 AromaticContact CD2-CH2 3.82Å; F299-W321 HydrophobicContact CD2-CH2 3.82Å; F299-W321 HydrophobicContact CD2-CZ3 4.05Å; F299-W321 HydrophobicContact CE2-CH2 4.43Å; F299-W321 HydrophobicContact CE2-CZ3 4.4Å; F299-W321 HydrophobicContact CG-CH2 4.35Å; F299-W321 HydrophobicContact CG-CZ3 4.42Å; E317-W321 HydrophobicContact CB-CZ2 3.83Å; E317-W321 VanDerWaalsContact O-CG 3.23Å; E317-W321 PolarHBondContact O-N 3.49Å; E317-W321 PolarHBondContact O-NE1 3.44Å; I318-W321 HydrophobicContact CB-CE3 3.91Å; I318-W321 HydrophobicContact CB-CZ3 3.89Å; I318-W321 HydrophobicContact CG1-CE3 3.86Å; I318-W321 HydrophobicContact CG1-CZ3 4.05Å; I318-W321 PolarHBondContact O-N 2.89Å; W321-K323 VanDerWaalsContact C-N 3.29Å; W321-K323 PolarHBondContact O-N 3.44Å; W321-M324 PolarHBondContact O-N 2.9Å; W321-Y325 PolarHBondContact O-N 3.46Å; W321-F329 HydrophobicContact CB-CB 4.41Å; W321-F329 HydrophobicContact CB-CD1 3.99Å; W321-F329 HydrophobicContact CB-CD2 4.43Å; W321-F329 HydrophobicContact CB-CE1 4.42Å; W321-F329 HydrophobicContact CB-CG 4.01Å; W321-F329 HydrophobicContact CE3-CD1 4.49Å; W321-F329 HydrophobicContact CE3-CE1 4.38Å
322	M	97.6	Very high	96.7	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-61.9	-33.9	177.3	-70.4	-171.8	-65.3	0	0	112.9	I318 S326 F329 L330 L335 V338 L360	I318-M322 HydrophobicContact CG1-CE 4.32Å; I318-M322 WeakPolarHBondContact O-CG 3.43Å; I318-M322 PolarHBondContact O-N 3.23Å; M322-S326 WeakPolarHBondContact O-CA 3.44Å; M322-S326 VanDerWaalsContact O-CB 3.3Å; M322-S326 WeakPolarHBondContact O-CB 3.48Å; M322-F329 HydrophobicContact CG-CB 4.09Å; M322-F329 WeakPolarHBondContact CG-O 3.27Å; M322-L330 HydrophobicContact CB-CD1 4.19Å; M322-L330 HydrophobicContact CG-CD1 4.5Å; M322-L330 HydrophobicContact SD-CD1 4.18Å; M322-L335 HydrophobicContact CE-CD2 4.13Å; M322-L335 HydrophobicContact SD-CD2 3.67Å; M322-L335 HydrophobicContact SD-CG 3.84Å; M322-V338 HydrophobicContact CE-CG2 3.86Å; M322-L360 HydrophobicContact CB-CD1 4.32Å; M322-L360 HydrophobicContact CB-CD2 3.97Å; M322-L360 HydrophobicContact CE-CD1 4.17Å
323	K	95.1	Very high	96.6	Very high	99 Å²	99	34.9 Å²	34.9	43%	0.43	19%	0.19	S	C	.	.	H	α-helix	trans	-76.2	-39.2	174.7	-167.2	-176.8	-167.9	174.7	0	112.6	G319 V320 W321 N359 L360	G319-K323 WeakPolarHBondContact O-CB 3.4Å; G319-K323 PolarHBondContact O-N 3.02Å; G319-K323 VanDerWaalsContact O-N 3.08Å; V320-K323 PolarHBondContact O-N 2.75Å; W321-K323 VanDerWaalsContact C-N 3.29Å; W321-K323 PolarHBondContact O-N 3.44Å; K323-N359 HydrophobicContact CD-CB 4.14Å; K323-N359 WeakPolarHBondContact CE-O 3.25Å; K323-N359 PolarHBondContact NZ-OD1 2.67Å; K323-L360 HydrophobicContact CB-CD2 3.96Å
324	M	95.5	Very high	96.5	Very high	63 Å²	63	36.5 Å²	36.5	31%	0.31	20%	0.196	S	C	.	.	H	α-helix	trans	-76.1	-41.2	-173.4	-172.1	179.9	-59.8	0	0	112.8	T234 V237 N238 L241 V320 W321	T234-M324 HydrophobicContact CG2-CE 4.06Å; V237-M324 HydrophobicContact CG1-CB 4.47Å; V237-M324 HydrophobicContact CG1-SD 4.27Å; N238-M324 HydrophobicContact CB-SD 3.88Å; L241-M324 HydrophobicContact CD2-CG 4.36Å; L241-M324 WeakPolarHBondContact CD2-O 3.32Å; V320-M324 HydrophobicContact CG1-CE 3.9Å; V320-M324 VanDerWaalsContact O-CB 3.22Å; V320-M324 WeakPolarHBondContact O-CB 3.28Å; V320-M324 PolarHBondContact O-N 3.01Å; W321-M324 PolarHBondContact O-N 2.9Å
325	Y	95.9	Very high	96.5	Very high	30 Å²	30	36.6 Å²	36.6	12%	0.118	20%	0.196	C	C	.	.	S	Bend	trans	-136.2	68.5	-178.3	-168	-173.3	0	0	0	110.4	V237 A240 L241 S244 W321 D327 A328 F329	V237-Y325 HydrophobicContact CG1-CD1 4.48Å; A240-Y325 HydrophobicContact CB-CD1 4.43Å; A240-Y325 HydrophobicContact CB-CE1 4.1Å; L241-Y325 HydrophobicContact CB-CD1 4.12Å; L241-Y325 HydrophobicContact CB-CE1 4.47Å; L241-Y325 HydrophobicContact CB-CG 4.24Å; L241-Y325 HydrophobicContact CD1-CD2 3.76Å; L241-Y325 HydrophobicContact CD1-CE2 4Å; L241-Y325 HydrophobicContact CD1-CG 4.11Å; S244-Y325 WeakPolarHBondContact CB-OH 3.44Å; S244-Y325 PolarHBondContact OG-OH 3.16Å; W321-Y325 PolarHBondContact O-N 3.46Å; Y325-D327 HydrophobicContact CE2-CB 4.31Å; Y325-D327 PolarHBondContact O-N 2.99Å; Y325-A328 HydrophobicContact CD1-CB 3.85Å; Y325-A328 HydrophobicContact CD2-CB 4.21Å; Y325-A328 HydrophobicContact CE1-CB 3.86Å; Y325-A328 HydrophobicContact CE2-CB 4.23Å; Y325-A328 HydrophobicContact CG-CB 4.03Å; Y325-A328 PolarHBondContact O-N 3.23Å; Y325-A328 VanDerWaalsContact O-N 3.14Å; Y325-F329 HydrophobicContact CD1-CE2 4.48Å; Y325-F329 PolarHBondContact O-N 3.36Å
326	S	95.3	Very high	96.4	Very high	23 Å²	23	39.5 Å²	39.5	16%	0.161	21%	0.209	C	C	.	.	H	α-helix	trans	-65.9	-16.6	-171.4	72.5	0	0	0	0	114.7	M322 L330 L366 K369	M322-S326 WeakPolarHBondContact O-CA 3.44Å; M322-S326 VanDerWaalsContact O-CB 3.3Å; M322-S326 WeakPolarHBondContact O-CB 3.48Å; S326-L330 VanDerWaalsContact O-CB 3.27Å; S326-L330 WeakPolarHBondContact O-CB 3.38Å; S326-L330 PolarHBondContact O-N 3.08Å; S326-L366 WeakPolarHBondContact OG-CD2 3.42Å; S326-K369 PolarHBondContact O-NZ 3.16Å
327	D	93.2	Very high	96.4	Very high	129 Å²	129	37 Å²	37	69%	0.69	20%	0.197	S	C	*	.	H	α-helix	trans	-77.2	-29.4	174.2	-66.7	-42.5	0	0	0	113.1	Y325 K369	Y325-D327 HydrophobicContact CE2-CB 4.31Å; Y325-D327 PolarHBondContact O-N 2.99Å; D327-K369 IonicContact OD1-NZ 3.68Å; D327-K369 PolarHBondContact OD1-NZ 3.23Å
328	A	94.4	Very high	96.4	Very high	41 Å²	41	36.7 Å²	36.7	34%	0.339	20%	0.195	S	C	.	.	H	α-helix	trans	-91.7	-40.1	174.2	0	0	0	0	0	112.6	Y325 N331	Y325-A328 HydrophobicContact CD1-CB 3.85Å; Y325-A328 HydrophobicContact CD2-CB 4.21Å; Y325-A328 HydrophobicContact CE1-CB 3.86Å; Y325-A328 HydrophobicContact CE2-CB 4.23Å; Y325-A328 HydrophobicContact CG-CB 4.03Å; Y325-A328 PolarHBondContact O-N 3.23Å; Y325-A328 VanDerWaalsContact O-N 3.14Å; A328-N331 PolarHBondContact O-ND2 2.95Å
329	F	96.4	Very high	96.4	Very high	7 Å²	7	36.7 Å²	36.7	3%	0.031	20%	0.195	C	C	.	.	H	α-helix	trans	-105.3	-26.6	-168.6	-72.8	-87.3	0	0	0	115.6	M233 V237 M291 W321 M322 Y325 N331 Y334	M233-F329 HydrophobicContact CE-CE1 3.88Å; M233-F329 HydrophobicContact CE-CZ 3.94Å; V237-F329 HydrophobicContact CB-CE2 4.44Å; V237-F329 HydrophobicContact CG1-CD2 4.25Å; V237-F329 HydrophobicContact CG1-CE2 4Å; V237-F329 HydrophobicContact CG2-CD2 4.48Å; V237-F329 HydrophobicContact CG2-CE1 4.47Å; V237-F329 HydrophobicContact CG2-CE2 3.69Å; V237-F329 HydrophobicContact CG2-CZ 3.68Å; M291-F329 HydrophobicContact CE-CZ 4.49Å; M291-F329 HydrophobicContact SD-CE2 4.43Å; M291-F329 HydrophobicContact SD-CZ 4.04Å; W321-F329 HydrophobicContact CB-CB 4.41Å; W321-F329 HydrophobicContact CB-CD1 3.99Å; W321-F329 HydrophobicContact CB-CD2 4.43Å; W321-F329 HydrophobicContact CB-CE1 4.42Å; W321-F329 HydrophobicContact CB-CG 4.01Å; W321-F329 HydrophobicContact CE3-CD1 4.49Å; W321-F329 HydrophobicContact CE3-CE1 4.38Å; M322-F329 HydrophobicContact CG-CB 4.09Å; M322-F329 WeakPolarHBondContact CG-O 3.27Å; Y325-F329 HydrophobicContact CD1-CE2 4.48Å; Y325-F329 PolarHBondContact O-N 3.36Å; F329-N331 PolarHBondContact O-N 3.22Å; F329-Y334 HydrophobicContact CB-CD2 4.4Å; F329-Y334 AromaticContact CD1-CD1 4Å; F329-Y334 HydrophobicContact CD1-CD1 4Å; F329-Y334 HydrophobicContact CD1-CD2 4.05Å; F329-Y334 AromaticContact CD1-CE1 3.68Å; F329-Y334 HydrophobicContact CD1-CE1 3.68Å; F329-Y334 AromaticContact CD1-CE2 3.72Å; F329-Y334 HydrophobicContact CD1-CE2 3.72Å; F329-Y334 HydrophobicContact CD1-CG 4.18Å; F329-Y334 AromaticContact CD1-CZ 3.52Å; F329-Y334 HydrophobicContact CE1-CD1 4.48Å; F329-Y334 AromaticContact CE1-CE1 3.76Å; F329-Y334 HydrophobicContact CE1-CE1 3.76Å; F329-Y334 HydrophobicContact CE1-CE2 4.22Å; F329-Y334 AromaticContact CE1-CZ 3.6Å; F329-Y334 HydrophobicContact CG-CE2 4.37Å; F329-Y334 WeakPolarHBondContact O-CB 3.41Å; F329-Y334 WeakPolarHBondContact O-CD2 3.44Å
330	L	97	Very high	96.5	Very high	7 Å²	7	42.3 Å²	42.3	4%	0.037	22%	0.216	C	C	.	.	S	Bend	trans	-83.4	82.6	-177.4	-172.5	63.9	0	0	0	111.3	M322 S326 L335 L360 L366 K369 L370	M322-L330 HydrophobicContact CB-CD1 4.19Å; M322-L330 HydrophobicContact CG-CD1 4.5Å; M322-L330 HydrophobicContact SD-CD1 4.18Å; S326-L330 VanDerWaalsContact O-CB 3.27Å; S326-L330 WeakPolarHBondContact O-CB 3.38Å; S326-L330 PolarHBondContact O-N 3.08Å; L330-L335 HydrophobicContact CD1-CD1 3.9Å; L330-L335 HydrophobicContact CD1-CD2 3.87Å; L330-L335 HydrophobicContact CD1-CG 4.01Å; L330-L360 HydrophobicContact CD1-CD1 3.84Å; L330-L360 HydrophobicContact CD1-CD2 4.32Å; L330-L366 HydrophobicContact CD2-CB 3.85Å; L330-L366 HydrophobicContact CD2-CD1 4.1Å; L330-L366 HydrophobicContact CD2-CD2 4.01Å; L330-L366 HydrophobicContact CD2-CG 4.19Å; L330-K369 HydrophobicContact CB-CD 4.32Å; L330-K369 HydrophobicContact CD2-CB 3.81Å; L330-K369 HydrophobicContact CD2-CD 3.98Å; L330-K369 HydrophobicContact CG-CB 4.02Å; L330-K369 HydrophobicContact CG-CD 4.27Å; L330-L370 HydrophobicContact CD1-CD2 3.95Å; L330-L370 HydrophobicContact CD2-CG 4.49Å
331	N	95.2	Very high	96.5	Very high	55 Å²	55	40.4 Å²	40.4	29%	0.294	20%	0.204	S	C	.	.	S	Bend	trans	-156.5	165.6	175.3	58.6	74.1	0	0	0	111.2	A328 F329 S333 Y334 L335	A328-N331 PolarHBondContact O-ND2 2.95Å; F329-N331 PolarHBondContact O-N 3.22Å; N331-S333 PolarHBondContact O-N 3.4Å; N331-S333 VanDerWaalsContact OD1-CB 3.29Å; N331-S333 WeakPolarHBondContact OD1-CB 3.36Å; N331-S333 PolarHBondContact OD1-N 3.11Å; N331-S333 VanDerWaalsContact OD1-N 3.14Å; N331-S333 PolarHBondContact OD1-OG 2.93Å; N331-Y334 PolarHBondContact O-N 2.91Å; N331-L335 PolarHBondContact O-N 3.5Å
332	D	94.5	Very high	96.6	Very high	82 Å²	82	40.4 Å²	40.4	44%	0.439	20%	0.204	S	C	.	.	H	α-helix	trans	-47.2	-32.9	179.8	-77.8	26.8	0	0	0	114.9	Y334 K336	D332-Y334 PolarHBondContact O-N 3.11Å; D332-K336 WeakPolarHBondContact O-CB 3.31Å; D332-K336 WeakPolarHBondContact O-CG 3.48Å; D332-K336 PolarHBondContact O-N 3.39Å
333	S	95	Very high	96.6	Very high	58 Å²	58	45.5 Å²	45.5	41%	0.406	23%	0.228	S	C	.	.	H	α-helix	trans	-65.9	-25.2	-177.9	84.7	0	0	0	0	112.3	N331 K336 Y337	N331-S333 PolarHBondContact O-N 3.4Å; N331-S333 VanDerWaalsContact OD1-CB 3.29Å; N331-S333 WeakPolarHBondContact OD1-CB 3.36Å; N331-S333 PolarHBondContact OD1-N 3.11Å; N331-S333 VanDerWaalsContact OD1-N 3.14Å; N331-S333 PolarHBondContact OD1-OG 2.93Å; S333-K336 PolarHBondContact O-NZ 2.84Å; S333-Y337 WeakPolarHBondContact O-CE2 3.48Å
334	Y	97.4	Very high	96.8	Very high	41 Å²	41	42 Å²	42	16%	0.161	21%	0.213	C	C	.	.	H	α-helix	trans	-104.8	-44.5	174.7	-64.7	-75.5	0	0	0	112.2	F295 I318 F329 N331 D332 K336 Y337	F295-Y334 HydrophobicContact CD2-CE1 4.09Å; F295-Y334 HydrophobicContact CE1-CE1 4.18Å; F295-Y334 AromaticContact CE2-CD1 3.72Å; F295-Y334 HydrophobicContact CE2-CD1 3.72Å; F295-Y334 AromaticContact CE2-CE1 3.58Å; F295-Y334 HydrophobicContact CE2-CE1 3.58Å; F295-Y334 AromaticContact CZ-CD1 3.73Å; F295-Y334 HydrophobicContact CZ-CD1 3.73Å; F295-Y334 AromaticContact CZ-CE1 3.62Å; F295-Y334 HydrophobicContact CZ-CE1 3.62Å; I318-Y334 HydrophobicContact CD1-CD1 4.02Å; F329-Y334 HydrophobicContact CB-CD2 4.4Å; F329-Y334 AromaticContact CD1-CD1 4Å; F329-Y334 HydrophobicContact CD1-CD1 4Å; F329-Y334 HydrophobicContact CD1-CD2 4.05Å; F329-Y334 AromaticContact CD1-CE1 3.68Å; F329-Y334 HydrophobicContact CD1-CE1 3.68Å; F329-Y334 AromaticContact CD1-CE2 3.72Å; F329-Y334 HydrophobicContact CD1-CE2 3.72Å; F329-Y334 HydrophobicContact CD1-CG 4.18Å; F329-Y334 AromaticContact CD1-CZ 3.52Å; F329-Y334 HydrophobicContact CE1-CD1 4.48Å; F329-Y334 AromaticContact CE1-CE1 3.76Å; F329-Y334 HydrophobicContact CE1-CE1 3.76Å; F329-Y334 HydrophobicContact CE1-CE2 4.22Å; F329-Y334 AromaticContact CE1-CZ 3.6Å; F329-Y334 HydrophobicContact CG-CE2 4.37Å; F329-Y334 WeakPolarHBondContact O-CB 3.41Å; F329-Y334 WeakPolarHBondContact O-CD2 3.44Å; N331-Y334 PolarHBondContact O-N 2.91Å; D332-Y334 PolarHBondContact O-N 3.11Å; Y334-K336 PolarHBondContact O-N 3.43Å; Y334-K336 VanDerWaalsContact O-N 3.14Å; Y334-Y337 WeakPolarHBondContact O-CD2 3.49Å; Y334-Y337 PolarHBondContact O-N 3.25Å; Y334-Y337 VanDerWaalsContact O-N 3.08Å
335	L	97.2	Very high	96.9	Very high	1 Å²	1	49.8 Å²	49.8	1%	0.005	24%	0.239	C	C	.	.	H	α-helix	trans	-55.7	-34.2	-178.8	-81	169.8	0	0	0	113.1	M322 L330 N331 Y337 V338 G339 L360 L370 F373	M322-L335 HydrophobicContact CE-CD2 4.13Å; M322-L335 HydrophobicContact SD-CD2 3.67Å; M322-L335 HydrophobicContact SD-CG 3.84Å; L330-L335 HydrophobicContact CD1-CD1 3.9Å; L330-L335 HydrophobicContact CD1-CD2 3.87Å; L330-L335 HydrophobicContact CD1-CG 4.01Å; N331-L335 PolarHBondContact O-N 3.5Å; L335-Y337 PolarHBondContact O-N 2.98Å; L335-Y337 VanDerWaalsContact O-N 3.13Å; L335-V338 PolarHBondContact O-N 2.97Å; L335-G339 PolarHBondContact O-N 3.02Å; L335-L360 HydrophobicContact CD2-CD1 4.33Å; L335-L370 HydrophobicContact CD1-CD2 4.33Å; L335-L370 HydrophobicContact CD2-CD2 4.16Å; L335-F373 HydrophobicContact CB-CD2 3.85Å; L335-F373 HydrophobicContact CB-CE2 4.3Å; L335-F373 HydrophobicContact CD1-CB 4.25Å; L335-F373 HydrophobicContact CD2-CD2 4.36Å; L335-F373 WeakPolarHBondContact O-CE2 3.36Å
336	K	97.4	Very high	97	Very high	61 Å²	61	53 Å²	53	27%	0.265	26%	0.255	S	S	.	.	H	α-helix	trans	-53.7	-33.3	177.7	72.1	-176.7	-161.9	-96.6	0	113.8	D332 S333 Y334 G339 W340	D332-K336 WeakPolarHBondContact O-CB 3.31Å; D332-K336 WeakPolarHBondContact O-CG 3.48Å; D332-K336 PolarHBondContact O-N 3.39Å; S333-K336 PolarHBondContact O-NZ 2.84Å; Y334-K336 PolarHBondContact O-N 3.43Å; Y334-K336 VanDerWaalsContact O-N 3.14Å; K336-G339 PolarHBondContact O-N 3.34Å; K336-W340 HydrophobicContact CB-CZ2 4.27Å; K336-W340 HydrophobicContact CD-CH2 3.65Å; K336-W340 HydrophobicContact CD-CZ2 4Å; K336-W340 HydrophobicContact CD-CZ3 4.14Å; K336-W340 HydrophobicContact CG-CE3 4.46Å; K336-W340 HydrophobicContact CG-CH2 4.04Å; K336-W340 HydrophobicContact CG-CZ2 4.28Å; K336-W340 HydrophobicContact CG-CZ3 4.12Å; K336-W340 WeakPolarHBondContact O-CB 3.19Å; K336-W340 VanDerWaalsContact O-CD2 3.29Å; K336-W340 PolarHBondContact O-N 2.93Å
337	Y	98.6	Very high	97.1	Very high	22 Å²	22	52 Å²	52	9%	0.086	25%	0.249	C	C	.	.	H	α-helix	trans	-69	-37.5	-179.6	-65	-76	0	0	0	111.4	F295 F299 Y303 I318 S333 Y334 L335 W340 T341	F295-Y337 HydrophobicContact CE1-CE2 4.34Å; F295-Y337 HydrophobicContact CZ-CD2 4.31Å; F295-Y337 AromaticContact CZ-CE2 3.69Å; F295-Y337 HydrophobicContact CZ-CE2 3.69Å; F299-Y337 AromaticContact CE1-CD1 3.91Å; F299-Y337 HydrophobicContact CE1-CD1 3.91Å; F299-Y337 AromaticContact CE1-CD2 3.82Å; F299-Y337 HydrophobicContact CE1-CD2 3.82Å; F299-Y337 HydrophobicContact CE1-CE1 4.22Å; F299-Y337 HydrophobicContact CE1-CE2 4.15Å; F299-Y337 AromaticContact CE1-CG 3.71Å; F299-Y337 HydrophobicContact CE1-CG 3.71Å; F299-Y337 HydrophobicContact CZ-CD1 4.44Å; F299-Y337 HydrophobicContact CZ-CD2 4.32Å; F299-Y337 HydrophobicContact CZ-CG 4.01Å; Y303-Y337 HydrophobicContact CD1-CD1 4Å; Y303-Y337 HydrophobicContact CD1-CE1 4.2Å; Y303-Y337 HydrophobicContact CD2-CD1 4.09Å; Y303-Y337 AromaticContact CE1-CD1 3.71Å; Y303-Y337 HydrophobicContact CE1-CD1 3.71Å; Y303-Y337 AromaticContact CE1-CE1 3.67Å; Y303-Y337 HydrophobicContact CE1-CE1 3.67Å; Y303-Y337 AromaticContact CE2-CD1 3.82Å; Y303-Y337 HydrophobicContact CE2-CD1 3.82Å; Y303-Y337 HydrophobicContact CG-CD1 4.19Å; Y303-Y337 AromaticContact CZ-CD1 3.62Å; Y303-Y337 AromaticContact CZ-CE1 3.85Å; I318-Y337 HydrophobicContact CD1-CD2 4.12Å; S333-Y337 WeakPolarHBondContact O-CE2 3.48Å; Y334-Y337 WeakPolarHBondContact O-CD2 3.49Å; Y334-Y337 PolarHBondContact O-N 3.25Å; Y334-Y337 VanDerWaalsContact O-N 3.08Å; L335-Y337 PolarHBondContact O-N 2.98Å; L335-Y337 VanDerWaalsContact O-N 3.13Å; Y337-W340 HydrophobicContact CD1-CE3 4.08Å; Y337-W340 AromaticContact CD1-CZ3 3.96Å; Y337-W340 HydrophobicContact CD1-CZ3 3.96Å; Y337-W340 HydrophobicContact CE1-CE3 4.46Å; Y337-W340 AromaticContact CE1-CZ3 3.88Å; Y337-W340 HydrophobicContact CE1-CZ3 3.88Å; Y337-T341 VanDerWaalsContact O-CB 3.29Å; Y337-T341 WeakPolarHBondContact O-CB 3.22Å; Y337-T341 PolarHBondContact O-N 2.66Å; Y337-T341 PolarHBondContact O-OG1 3.48Å
338	V	98.5	Very high	97.3	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-69.1	-45.9	173	-176.5	0	0	0	0	110.3	I318 M322 L335 W340 T341 L342 C353 L357	I318-V338 HydrophobicContact CG2-CG2 4.12Å; M322-V338 HydrophobicContact CE-CG2 3.86Å; L335-V338 PolarHBondContact O-N 2.97Å; V338-W340 PolarHBondContact O-N 3.25Å; V338-T341 CarbonylContact O-C 3.54Å; V338-T341 PolarHBondContact O-N 3.28Å; V338-L342 PolarHBondContact O-N 3.19Å; V338-C353 HydrophobicContact CG1-CB 3.84Å; V338-L357 HydrophobicContact CG1-CD1 4.14Å; V338-L357 HydrophobicContact CG1-CD2 4.16Å; V338-L357 HydrophobicContact CG1-CG 3.92Å
339	G	97.9	Very high	97.5	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-61.1	-41	180	0	0	0	0	0	114.2	L335 K336 T341 H343 F377	L335-G339 PolarHBondContact O-N 3.02Å; K336-G339 PolarHBondContact O-N 3.34Å; G339-T341 VanDerWaalsContact C-N 3.35Å; G339-H343 PolarHBondContact O-CE1 2.69Å; G339-H343 PolarHBondContact O-ND1 2.79Å; G339-H343 VanDerWaalsContact O-ND1 3.15Å; G339-F377 WeakPolarHBondContact O-CE1 3.37Å
340	W	98.4	Very high	97.6	Very high	121 Å²	121	48 Å²	48	46%	0.458	22%	0.218	S	C	.	.	H	α-helix	trans	-63.1	-42.4	170.7	-64.4	-27	0	0	0	111.6	K336 Y337 V338 L342 H343	K336-W340 HydrophobicContact CB-CZ2 4.27Å; K336-W340 HydrophobicContact CD-CH2 3.65Å; K336-W340 HydrophobicContact CD-CZ2 4Å; K336-W340 HydrophobicContact CD-CZ3 4.14Å; K336-W340 HydrophobicContact CG-CE3 4.46Å; K336-W340 HydrophobicContact CG-CH2 4.04Å; K336-W340 HydrophobicContact CG-CZ2 4.28Å; K336-W340 HydrophobicContact CG-CZ3 4.12Å; K336-W340 WeakPolarHBondContact O-CB 3.19Å; K336-W340 VanDerWaalsContact O-CD2 3.29Å; K336-W340 PolarHBondContact O-N 2.93Å; Y337-W340 HydrophobicContact CD1-CE3 4.08Å; Y337-W340 AromaticContact CD1-CZ3 3.96Å; Y337-W340 HydrophobicContact CD1-CZ3 3.96Å; Y337-W340 HydrophobicContact CE1-CE3 4.46Å; Y337-W340 AromaticContact CE1-CZ3 3.88Å; Y337-W340 HydrophobicContact CE1-CZ3 3.88Å; V338-W340 PolarHBondContact O-N 3.25Å; W340-L342 VanDerWaalsContact C-N 3.33Å; W340-L342 PolarHBondContact O-N 2.85Å; W340-H343 WeakPolarHBondContact O-CB 3.47Å; W340-H343 PolarHBondContact O-N 3.42Å; W340-H343 VanDerWaalsContact O-N 3.12Å; W340-H343 PolarHBondContact O-ND1 3.14Å; W340-H343 VanDerWaalsContact O-ND1 3.16Å
341	T	98.6	Very high	97.7	Very high	9 Å²	9	49.3 Å²	49.3	6%	0.055	23%	0.225	C	C	.	.	H	α-helix	trans	-80.9	-8.9	-171.4	-45.4	0	0	0	0	113.7	I315 Y337 V338 G339 H343 D344 V349	I315-T341 HydrophobicContact CD1-CG2 4.02Å; I315-T341 HydrophobicContact CG1-CG2 3.88Å; Y337-T341 VanDerWaalsContact O-CB 3.29Å; Y337-T341 WeakPolarHBondContact O-CB 3.22Å; Y337-T341 PolarHBondContact O-N 2.66Å; Y337-T341 PolarHBondContact O-OG1 3.48Å; V338-T341 CarbonylContact O-C 3.54Å; V338-T341 PolarHBondContact O-N 3.28Å; G339-T341 VanDerWaalsContact C-N 3.35Å; T341-H343 PolarHBondContact O-N 3.35Å; T341-D344 HydrophobicContact CG2-CB 4.14Å; T341-D344 WeakPolarHBondContact O-CB 3.45Å; T341-D344 PolarHBondContact O-N 3.01Å; T341-V349 HydrophobicContact CG2-CG1 3.4Å; T341-V349 VanDerWaalsContact CG2-CG1 3.4Å
342	L	98.6	Very high	97.8	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57	-15.8	160.3	-70.9	170.2	0	0	0	113.3	V338 W340 C353 L354 L357 F373 F377 R380 I381 M384	V338-L342 PolarHBondContact O-N 3.19Å; W340-L342 VanDerWaalsContact C-N 3.33Å; W340-L342 PolarHBondContact O-N 2.85Å; L342-C353 HydrophobicContact CD2-CB 3.55Å; L342-C353 HydrophobicContact CG-CB 4.08Å; L342-L354 HydrophobicContact CD2-CD2 4.08Å; L342-L354 HydrophobicContact CD2-CG 4.43Å; L342-L357 HydrophobicContact CD1-CD1 4.21Å; L342-L357 HydrophobicContact CD2-CD1 4.3Å; L342-F373 HydrophobicContact CD1-CZ 4.36Å; L342-F377 HydrophobicContact CD1-CB 4.4Å; L342-R380 HydrophobicContact CB-CG 4.1Å; L342-R380 PolarHBondContact O-NE 3.41Å; L342-R380 PolarHBondContact O-NH2 3.33Å; L342-I381 HydrophobicContact CD1-CD1 4.49Å; L342-I381 HydrophobicContact CD1-CG1 4.04Å; L342-M384 HydrophobicContact CB-SD 4.15Å; L342-M384 HydrophobicContact CD2-CE 3.99Å; L342-M384 HydrophobicContact CD2-SD 3.89Å
343	H	98.4	Very high	98	Very high	107 Å²	107	45.2 Å²	45.2	50%	0.495	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.6	13.1	177.5	-52	79.4	0	0	0	112.9	G339 W340 T341	G339-H343 PolarHBondContact O-CE1 2.69Å; G339-H343 PolarHBondContact O-ND1 2.79Å; G339-H343 VanDerWaalsContact O-ND1 3.15Å; W340-H343 WeakPolarHBondContact O-CB 3.47Å; W340-H343 PolarHBondContact O-N 3.42Å; W340-H343 VanDerWaalsContact O-N 3.12Å; W340-H343 PolarHBondContact O-ND1 3.14Å; W340-H343 VanDerWaalsContact O-ND1 3.16Å; T341-H343 PolarHBondContact O-N 3.35Å
344	D	98.6	Very high	98.2	Very high	24 Å²	24	42.4 Å²	42.4	13%	0.128	18%	0.182	C	C	.	.			trans	-63.2	145.7	176.3	-158.6	-70.1	0	0	0	111.9	R311 T341 Q346 V349 R350	R311-D344 IonicContact CZ-OD1 3.8Å; R311-D344 IonicContact CZ-OD2 3.52Å; R311-D344 VanDerWaalsContact CZ-OD2 3.31Å; R311-D344 IonicContact NE-OD1 2.74Å; R311-D344 IonicContact NE-OD2 3.49Å; R311-D344 PolarHBondContact NE-OD2 3.09Å; R311-D344 IonicContact NH2-OD1 2.66Å; R311-D344 PolarHBondContact NH2-OD1 3.37Å; R311-D344 IonicContact NH2-OD2 2.81Å; R311-D344 PolarHBondContact NH2-OD2 3.17Å; R311-D344 VanDerWaalsContact NH2-OD2 3.13Å; T341-D344 HydrophobicContact CG2-CB 4.14Å; T341-D344 WeakPolarHBondContact O-CB 3.45Å; T341-D344 PolarHBondContact O-N 3.01Å; D344-Q346 VanDerWaalsContact C-N 3.31Å; D344-Q346 PolarHBondContact O-N 3.26Å; D344-Q346 PolarHBondContact OD1-N 3.2Å; D344-V349 HydrophobicContact CB-CB 3.93Å; D344-V349 HydrophobicContact CB-CG1 4.07Å; D344-R350 HydrophobicContact CB-CG 4.2Å; D344-R350 VanDerWaalsContact O-CD 3.27Å; D344-R350 WeakPolarHBondContact O-CD 3.09Å; D344-R350 WeakPolarHBondContact O-CG 3.25Å; D344-R350 PolarHBondContact O-NH1 3.46Å
345	R	97.6	Very high	98.2	Very high	228 Å²	228	44 Å²	44	86%	0.86	19%	0.189	S	C	*	.	S	Bend	trans	-70.5	-25.4	178.7	-65.6	-176.7	177.8	-176	-1.9	112.9	R350	R345-R350 PolarHBondContact O-NH1 3Å
346	Q	98.3	Very high	98.2	Very high	96 Å²	96	44.3 Å²	44.3	45%	0.449	19%	0.192	S	C	.	.	S	Bend	trans	-101.9	127.8	-177.5	-55.7	-59.5	-12.8	0	0	111.9	A308 D344 E348 V349 R350	A308-Q346 HydrophobicContact CB-CB 3.98Å; A308-Q346 HydrophobicContact CB-CG 3.85Å; D344-Q346 VanDerWaalsContact C-N 3.31Å; D344-Q346 PolarHBondContact O-N 3.26Å; D344-Q346 PolarHBondContact OD1-N 3.2Å; Q346-E348 VanDerWaalsContact C-N 3.32Å; Q346-E348 HydrophobicContact CB-CG 4.47Å; Q346-E348 PolarHBondContact O-N 3.47Å; Q346-V349 HydrophobicContact CB-CG2 4.28Å; Q346-V349 PolarHBondContact O-N 3.49Å; Q346-V349 VanDerWaalsContact O-N 3.14Å; Q346-R350 PolarHBondContact O-N 2.91Å
347	G	97.8	Very high	98.2	Very high	2 Å²	2	41.4 Å²	41.4	2%	0.021	18%	0.179	C	C	.	.	H	α-helix	trans	-66.2	-29.5	-174.6	0	0	0	0	0	114.2	V349 R350 L351 E389 V392	G347-V349 PolarHBondContact O-N 2.82Å; G347-V349 VanDerWaalsContact O-N 3.14Å; G347-R350 VanDerWaalsContact CA-CZ 3.5Å; G347-R350 PolarHBondContact O-N 3.25Å; G347-L351 WeakPolarHBondContact O-CB 3.28Å; G347-L351 PolarHBondContact O-N 3.47Å; G347-E389 VanDerWaalsContact CA-CD 3.46Å; G347-E389 VanDerWaalsContact CA-OE1 3.24Å; G347-E389 WeakPolarHBondContact CA-OE1 3.37Å; G347-E389 WeakPolarHBondContact CA-OE2 3.24Å; G347-E389 PolarHBondContact N-OE1 2.99Å; G347-E389 PolarHBondContact N-OE2 3.04Å; G347-V392 WeakPolarHBondContact O-CG2 3.35Å
348	E	97.4	Very high	98.1	Very high	80 Å²	80	41.6 Å²	41.6	37%	0.374	18%	0.181	S	C	.	.	H	α-helix	trans	-55.2	-34.7	173.4	68	159.9	149.2	0	0	112.3	A308 E309 Q346 K352	A308-E348 HydrophobicContact CB-CG 4.26Å; A308-E348 WeakPolarHBondContact CB-OE1 3.41Å; E309-E348 PolarHBondContact N-OE1 3.39Å; E309-E348 VanDerWaalsContact N-OE1 3.15Å; Q346-E348 VanDerWaalsContact C-N 3.32Å; Q346-E348 HydrophobicContact CB-CG 4.47Å; Q346-E348 PolarHBondContact O-N 3.47Å; E348-K352 WeakPolarHBondContact O-CG 3.46Å; E348-K352 PolarHBondContact O-N 3.43Å
349	V	98.7	Very high	97.9	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-79.4	-43.9	-179.3	-167.3	0	0	0	0	109.9	A308 R311 A312 I315 T341 D344 Q346 G347 L351 K352 C353	A308-V349 HydrophobicContact CB-CG2 3.9Å; R311-V349 HydrophobicContact CB-CG1 3.98Å; R311-V349 HydrophobicContact CB-CG2 4.25Å; A312-V349 HydrophobicContact CB-CG2 4.37Å; I315-V349 HydrophobicContact CG1-CG1 4.47Å; T341-V349 HydrophobicContact CG2-CG1 3.4Å; T341-V349 VanDerWaalsContact CG2-CG1 3.4Å; D344-V349 HydrophobicContact CB-CB 3.93Å; D344-V349 HydrophobicContact CB-CG1 4.07Å; Q346-V349 HydrophobicContact CB-CG2 4.28Å; Q346-V349 PolarHBondContact O-N 3.49Å; Q346-V349 VanDerWaalsContact O-N 3.14Å; G347-V349 PolarHBondContact O-N 2.82Å; G347-V349 VanDerWaalsContact O-N 3.14Å; V349-L351 VanDerWaalsContact C-N 3.27Å; V349-L351 PolarHBondContact O-N 3.41Å; V349-K352 PolarHBondContact O-N 3.35Å; V349-K352 VanDerWaalsContact O-N 3.15Å; V349-C353 PolarHBondContact O-N 2.79Å; V349-C353 PolarHBondContact O-SG 2.73Å
350	R	98.8	Very high	97.7	Very high	13 Å²	13	44.8 Å²	44.8	5%	0.049	20%	0.198	C	C	.	.	H	α-helix	trans	-58.2	-40.4	173.7	-62.7	-163.3	-63.2	-70.7	-5.4	111.6	D344 R345 Q346 G347 K352 C353 L354 M384 D387 E389 V392	D344-R350 HydrophobicContact CB-CG 4.2Å; D344-R350 VanDerWaalsContact O-CD 3.27Å; D344-R350 WeakPolarHBondContact O-CD 3.09Å; D344-R350 WeakPolarHBondContact O-CG 3.25Å; D344-R350 PolarHBondContact O-NH1 3.46Å; R345-R350 PolarHBondContact O-NH1 3Å; Q346-R350 PolarHBondContact O-N 2.91Å; G347-R350 VanDerWaalsContact CA-CZ 3.5Å; G347-R350 PolarHBondContact O-N 3.25Å; R350-K352 PolarHBondContact O-N 3.09Å; R350-C353 WeakPolarHBondContact O-CB 3.46Å; R350-C353 PolarHBondContact O-N 3.21Å; R350-L354 WeakPolarHBondContact O-CG 3.45Å; R350-L354 PolarHBondContact O-N 2.92Å; R350-M384 HydrophobicContact CB-CE 3.82Å; R350-M384 HydrophobicContact CG-CE 4.39Å; R350-D387 IonicContact CZ-OD1 2.69Å; R350-D387 IonicContact CZ-OD2 2.67Å; R350-D387 IonicContact NE-OD1 2.92Å; R350-D387 IonicContact NE-OD2 3.58Å; R350-D387 PolarHBondContact NE-OD2 3.04Å; R350-D387 IonicContact NH2-OD1 2.71Å; R350-D387 PolarHBondContact NH2-OD1 3.3Å; R350-D387 IonicContact NH2-OD2 2.88Å; R350-D387 PolarHBondContact NH2-OD2 2.92Å; R350-E389 IonicContact CZ-OE1 3.14Å; R350-E389 IonicContact NH1-OE1 3.91Å; R350-E389 IonicContact NH2-OE1 2.76Å; R350-E389 PolarHBondContact NH2-OE1 3.36Å; R350-V392 HydrophobicContact CB-CG1 3.89Å; R350-V392 HydrophobicContact CB-CG2 4.4Å
351	L	98.5	Very high	97.5	Very high	35 Å²	35	39.2 Å²	39.2	18%	0.183	18%	0.177	C	C	.	.	H	α-helix	trans	-60.7	-42	176	-168.5	72	0	0	0	111.8	G347 V349 L354 K355 D391 V392 E395	G347-L351 WeakPolarHBondContact O-CB 3.28Å; G347-L351 PolarHBondContact O-N 3.47Å; V349-L351 VanDerWaalsContact C-N 3.27Å; V349-L351 PolarHBondContact O-N 3.41Å; L351-L354 PolarHBondContact O-N 3.02Å; L351-K355 HydrophobicContact CG-CD 4.35Å; L351-K355 WeakPolarHBondContact O-CB 3.16Å; L351-K355 WeakPolarHBondContact O-CG 3.19Å; L351-K355 PolarHBondContact O-N 2.93Å; L351-D391 HydrophobicContact CD1-CB 4.17Å; L351-D391 VanDerWaalsContact CD1-O 3.28Å; L351-D391 WeakPolarHBondContact CD1-O 3.41Å; L351-V392 HydrophobicContact CB-CG2 4.35Å; L351-E395 HydrophobicContact CD1-CB 4.17Å; L351-E395 HydrophobicContact CD1-CG 3.65Å
352	K	98.4	Very high	97.1	Very high	51 Å²	51	43.2 Å²	43.2	22%	0.222	20%	0.202	C	C	.	.	H	α-helix	trans	-66.7	-37.9	173.9	-64.7	-66.1	-179.8	160	0	112	A312 I315 E316 E348 V349 R350 K355 A356	A312-K352 HydrophobicContact CB-CG 3.88Å; I315-K352 HydrophobicContact CB-CB 4.36Å; I315-K352 HydrophobicContact CG2-CB 3.87Å; E316-K352 HydrophobicContact CB-CD 4.16Å; E316-K352 HydrophobicContact CG-CD 4.38Å; E316-K352 IonicContact OE1-NZ 3.2Å; E316-K352 PolarHBondContact OE1-NZ 3.47Å; E316-K352 IonicContact OE2-NZ 3.24Å; E316-K352 PolarHBondContact OE2-NZ 2.96Å; E348-K352 WeakPolarHBondContact O-CG 3.46Å; E348-K352 PolarHBondContact O-N 3.43Å; V349-K352 PolarHBondContact O-N 3.35Å; V349-K352 VanDerWaalsContact O-N 3.15Å; R350-K352 PolarHBondContact O-N 3.09Å; K352-K355 PolarHBondContact O-N 2.75Å; K352-A356 VanDerWaalsContact O-CB 3.26Å; K352-A356 WeakPolarHBondContact O-CB 3.21Å; K352-A356 PolarHBondContact O-N 3.43Å
353	C	98.8	Very high	96.6	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-59	-49	173.4	-65.2	0	0	0	0	111.6	I315 V338 L342 V349 R350 A356 L357	I315-C353 HydrophobicContact CG2-CB 4.3Å; I315-C353 VanDerWaalsContact CG2-SG 3.58Å; V338-C353 HydrophobicContact CG1-CB 3.84Å; L342-C353 HydrophobicContact CD2-CB 3.55Å; L342-C353 HydrophobicContact CG-CB 4.08Å; V349-C353 PolarHBondContact O-N 2.79Å; V349-C353 PolarHBondContact O-SG 2.73Å; R350-C353 WeakPolarHBondContact O-CB 3.46Å; R350-C353 PolarHBondContact O-N 3.21Å; C353-A356 PolarHBondContact O-N 3.11Å; C353-L357 WeakPolarHBondContact O-CG 3.47Å; C353-L357 PolarHBondContact O-N 3.21Å
354	L	98.6	Very high	95.9	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-61.2	-48.1	178.3	-66.5	171.3	0	0	0	111.7	L342 R350 L351 A356 L357 Q358 M384 V392 E395 A396 L399	L342-L354 HydrophobicContact CD2-CD2 4.08Å; L342-L354 HydrophobicContact CD2-CG 4.43Å; R350-L354 WeakPolarHBondContact O-CG 3.45Å; R350-L354 PolarHBondContact O-N 2.92Å; L351-L354 PolarHBondContact O-N 3.02Å; L354-A356 VanDerWaalsContact C-N 3.32Å; L354-A356 PolarHBondContact O-N 3.14Å; L354-L357 PolarHBondContact O-N 3.11Å; L354-L357 VanDerWaalsContact O-N 3.11Å; L354-Q358 WeakPolarHBondContact O-CG 3.28Å; L354-Q358 PolarHBondContact O-N 3.49Å; L354-M384 HydrophobicContact CD1-CE 3.83Å; L354-M384 HydrophobicContact CD2-CE 3.98Å; L354-M384 HydrophobicContact CG-CE 3.89Å; L354-V392 HydrophobicContact CD1-CG1 3.65Å; L354-V392 WeakPolarHBondContact CD1-O 3.46Å; L354-E395 HydrophobicContact CB-CB 4.17Å; L354-E395 HydrophobicContact CD1-CB 3.97Å; L354-A396 HydrophobicContact CD1-CB 4.01Å; L354-A396 HydrophobicContact CD2-CB 4.19Å; L354-L399 HydrophobicContact CD2-CD2 3.59Å
355	K	97.8	Very high	95.4	Very high	74 Å²	74	55.4 Å²	55.4	32%	0.322	25%	0.253	S	S	.	.	H	α-helix	trans	-66.2	-32.1	179.8	-69.3	-176.7	-174.6	-154.5	0	112.9	L351 K352 N359 E395	L351-K355 HydrophobicContact CG-CD 4.35Å; L351-K355 WeakPolarHBondContact O-CB 3.16Å; L351-K355 WeakPolarHBondContact O-CG 3.19Å; L351-K355 PolarHBondContact O-N 2.93Å; K352-K355 PolarHBondContact O-N 2.75Å; K355-N359 WeakPolarHBondContact O-CB 3.3Å; K355-N359 PolarHBondContact O-N 3.09Å; K355-N359 PolarHBondContact O-ND2 3.22Å; K355-E395 VanDerWaalsContact CE-CG 3.44Å; K355-E395 WeakPolarHBondContact CE-OE1 3.44Å; K355-E395 IonicContact NZ-OE1 2.82Å; K355-E395 PolarHBondContact NZ-OE1 3.26Å
356	A	96.9	Very high	95	Very high	7 Å²	7	45 Å²	45	6%	0.058	21%	0.214	C	C	.	.	H	α-helix	trans	-64.4	-43.9	170.2	0	0	0	0	0	111.5	K352 C353 L354 N359	K352-A356 VanDerWaalsContact O-CB 3.26Å; K352-A356 WeakPolarHBondContact O-CB 3.21Å; K352-A356 PolarHBondContact O-N 3.43Å; C353-A356 PolarHBondContact O-N 3.11Å; L354-A356 VanDerWaalsContact C-N 3.32Å; L354-A356 PolarHBondContact O-N 3.14Å; A356-N359 WeakPolarHBondContact O-CB 3.26Å; A356-N359 PolarHBondContact O-N 3.02Å
357	L	97.6	Very high	94.5	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-68.1	-49.1	178.3	-68.8	171.2	0	0	0	112.6	V338 L342 C353 L354 N359 L360 Y361 F373 I381 L399	V338-L357 HydrophobicContact CG1-CD1 4.14Å; V338-L357 HydrophobicContact CG1-CD2 4.16Å; V338-L357 HydrophobicContact CG1-CG 3.92Å; L342-L357 HydrophobicContact CD1-CD1 4.21Å; L342-L357 HydrophobicContact CD2-CD1 4.3Å; C353-L357 WeakPolarHBondContact O-CG 3.47Å; C353-L357 PolarHBondContact O-N 3.21Å; L354-L357 PolarHBondContact O-N 3.11Å; L354-L357 VanDerWaalsContact O-N 3.11Å; L357-N359 PolarHBondContact O-N 3.25Å; L357-N359 VanDerWaalsContact O-N 3.16Å; L357-L360 WeakPolarHBondContact O-CA 3.4Å; L357-L360 WeakPolarHBondContact O-CB 3.47Å; L357-L360 PolarHBondContact O-N 2.74Å; L357-Y361 HydrophobicContact CB-CD2 4.31Å; L357-Y361 HydrophobicContact CB-CE2 4.15Å; L357-Y361 HydrophobicContact CD2-CE2 4.42Å; L357-Y361 WeakPolarHBondContact O-CD2 3.47Å; L357-Y361 PolarHBondContact O-N 2.76Å; L357-F373 HydrophobicContact CD1-CE1 3.79Å; L357-F373 HydrophobicContact CD1-CZ 4.05Å; L357-F373 HydrophobicContact CD2-CD1 4.21Å; L357-F373 HydrophobicContact CD2-CE1 3.52Å; L357-F373 HydrophobicContact CD2-CZ 3.85Å; L357-F373 HydrophobicContact CG-CE1 4.33Å; L357-I381 HydrophobicContact CD1-CD1 4.43Å; L357-L399 HydrophobicContact CB-CD1 3.88Å; L357-L399 HydrophobicContact CB-CD2 3.84Å; L357-L399 HydrophobicContact CD1-CD2 3.86Å
358	Q	96.4	Very high	94.2	Very high	26 Å²	26	46.7 Å²	46.7	12%	0.121	23%	0.23	C	C	.	.	H	α-helix	trans	-50.2	-42.3	175.2	-71.9	174.8	-6.9	0	0	111.3	L354 L360 Y361 T362 E395 L399 L402	L354-Q358 WeakPolarHBondContact O-CG 3.28Å; L354-Q358 PolarHBondContact O-N 3.49Å; Q358-L360 PolarHBondContact O-N 3.49Å; Q358-Y361 PolarHBondContact O-N 3.47Å; Q358-T362 PolarHBondContact O-N 3.15Å; Q358-T362 PolarHBondContact O-OG1 3.25Å; Q358-E395 PolarHBondContact NE2-O 3.47Å; Q358-E395 PolarHBondContact NE2-OE2 3.39Å; Q358-L399 HydrophobicContact CG-CB 4.1Å; Q358-L399 HydrophobicContact CG-CD1 4.19Å; Q358-L402 HydrophobicContact CB-CD1 3.95Å; Q358-L402 HydrophobicContact CG-CD1 4.12Å
359	N	93.1	Very high	93.8	Very high	67 Å²	67	46.4 Å²	46.4	36%	0.358	23%	0.228	S	C	.	.	H	α-helix	trans	-62.2	-22.6	178.5	-98.2	-77.4	0	0	0	114.4	K323 K355 A356 L357	K323-N359 HydrophobicContact CD-CB 4.14Å; K323-N359 WeakPolarHBondContact CE-O 3.25Å; K323-N359 PolarHBondContact NZ-OD1 2.67Å; K355-N359 WeakPolarHBondContact O-CB 3.3Å; K355-N359 PolarHBondContact O-N 3.09Å; K355-N359 PolarHBondContact O-ND2 3.22Å; A356-N359 WeakPolarHBondContact O-CB 3.26Å; A356-N359 PolarHBondContact O-N 3.02Å; L357-N359 PolarHBondContact O-N 3.25Å; L357-N359 VanDerWaalsContact O-N 3.16Å
360	L	94.9	Very high	93.6	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-89.7	-49	174.8	-58.4	169	0	0	0	110.7	M322 K323 L330 L335 L357 Q358 T362 N363 L366 L370	M322-L360 HydrophobicContact CB-CD1 4.32Å; M322-L360 HydrophobicContact CB-CD2 3.97Å; M322-L360 HydrophobicContact CE-CD1 4.17Å; K323-L360 HydrophobicContact CB-CD2 3.96Å; L330-L360 HydrophobicContact CD1-CD1 3.84Å; L330-L360 HydrophobicContact CD1-CD2 4.32Å; L335-L360 HydrophobicContact CD2-CD1 4.33Å; L357-L360 WeakPolarHBondContact O-CA 3.4Å; L357-L360 WeakPolarHBondContact O-CB 3.47Å; L357-L360 PolarHBondContact O-N 2.74Å; Q358-L360 PolarHBondContact O-N 3.49Å; L360-T362 PolarHBondContact O-N 3.11Å; L360-T362 VanDerWaalsContact O-N 3.13Å; L360-N363 PolarHBondContact O-N 2.97Å; L360-L366 HydrophobicContact CD2-CD1 4.26Å; L360-L370 HydrophobicContact CB-CD1 3.99Å; L360-L370 HydrophobicContact CB-CD2 4.4Å; L360-L370 HydrophobicContact CD1-CD2 4.25Å
361	Y	93.7	Very high	93.2	Very high	4 Å²	4	51.4 Å²	51.4	2%	0.016	25%	0.252	C	S	.	.	H	α-helix	trans	-66.1	-10.5	176.2	-65.9	-77.3	0	0	0	114.2	L357 Q358 N363 F367 L370 T374 L399 I403	L357-Y361 HydrophobicContact CB-CD2 4.31Å; L357-Y361 HydrophobicContact CB-CE2 4.15Å; L357-Y361 HydrophobicContact CD2-CE2 4.42Å; L357-Y361 WeakPolarHBondContact O-CD2 3.47Å; L357-Y361 PolarHBondContact O-N 2.76Å; Q358-Y361 PolarHBondContact O-N 3.47Å; Y361-N363 VanDerWaalsContact C-N 3.25Å; Y361-N363 PolarHBondContact O-N 3.33Å; Y361-F367 HydrophobicContact CD1-CD1 4.11Å; Y361-F367 AromaticContact CD1-CE1 3.66Å; Y361-F367 HydrophobicContact CD1-CE1 3.66Å; Y361-F367 HydrophobicContact CD1-CE2 4.18Å; Y361-F367 AromaticContact CD1-CZ 3.72Å; Y361-F367 HydrophobicContact CD1-CZ 3.72Å; Y361-F367 HydrophobicContact CE1-CE1 4.37Å; Y361-F367 HydrophobicContact CG-CZ 4.34Å; Y361-F367 WeakPolarHBondContact O-CE2 3.32Å; Y361-F367 WeakPolarHBondContact O-CZ 3.48Å; Y361-L370 HydrophobicContact CD1-CD1 3.69Å; Y361-L370 HydrophobicContact CD2-CD1 4.41Å; Y361-L370 HydrophobicContact CE1-CB 3.8Å; Y361-L370 HydrophobicContact CE1-CD1 3.65Å; Y361-L370 HydrophobicContact CE1-CG 4.25Å; Y361-L370 HydrophobicContact CE2-CD1 4.37Å; Y361-L370 HydrophobicContact CG-CD1 4.08Å; Y361-T374 PolarHBondContact OH-OG1 3.42Å; Y361-L399 HydrophobicContact CD2-CD1 3.4Å; Y361-L399 HydrophobicContact CE2-CD1 3.77Å; Y361-L399 HydrophobicContact CG-CD1 4.32Å; Y361-I403 HydrophobicContact CD1-CG1 4.21Å; Y361-I403 HydrophobicContact CE1-CG1 3.99Å; Y361-I403 HydrophobicContact CE2-CG1 4.34Å; Y361-I403 HydrophobicContact CG-CG1 4.48Å
362	T	91.3	Very high	92.9	Very high	94 Å²	94	55.2 Å²	55.2	58%	0.577	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-25.7	167.9	-55.3	0	0	0	0	111.9	Q358 L360	Q358-T362 PolarHBondContact O-N 3.15Å; Q358-T362 PolarHBondContact O-OG1 3.25Å; L360-T362 PolarHBondContact O-N 3.11Å; L360-T362 VanDerWaalsContact O-N 3.13Å
363	N	87.3	Confident	92.8	Very high	60 Å²	60	53 Å²	53	32%	0.321	26%	0.262	S	S	.	.	S	Bend	trans	-100.2	109.8	174.5	-175.6	2.1	0	0	0	111.1	L360 Y361 E365 L366	L360-N363 PolarHBondContact O-N 2.97Å; Y361-N363 VanDerWaalsContact C-N 3.25Å; Y361-N363 PolarHBondContact O-N 3.33Å; N363-E365 PolarHBondContact O-N 3.34Å; N363-E365 WeakPolarHBondContact OD1-CB 3.23Å; N363-E365 PolarHBondContact OD1-N 2.8Å; N363-L366 HydrophobicContact CB-CD1 3.96Å; N363-L366 HydrophobicContact CB-CG 3.98Å; N363-L366 PolarHBondContact O-N 2.95Å
364	R	83.8	Confident	92.5	Very high	165 Å²	165	53.4 Å²	53.4	62%	0.623	26%	0.264	S	S	*	.	G	3₁₀ helix	trans	-58	-27.2	178.6	-71.1	-173.8	172	-166.2	-6	114.1	L366 F367 Q405	R364-L366 PolarHBondContact O-N 3.28Å; R364-F367 HydrophobicContact CG-CE2 4.37Å; R364-F367 PolarHBondContact O-N 2.9Å; R364-Q405 PolarHBondContact NH2-O 2.94Å; R364-Q405 VanDerWaalsContact NH2-O 3.08Å
365	E	88.1	Confident	92.2	Very high	161 Å²	161	58.1 Å²	58.1	75%	0.752	29%	0.29	S	S	*	.	G	3₁₀ helix	trans	-67.3	-18.5	177.4	-59.6	178.4	151.9	0	0	113.4	N363	N363-E365 PolarHBondContact O-N 3.34Å; N363-E365 WeakPolarHBondContact OD1-CB 3.23Å; N363-E365 PolarHBondContact OD1-N 2.8Å
366	L	89.3	Confident	92.1	Very high	11 Å²	11	62.6 Å²	62.6	6%	0.058	30%	0.304	C	S	.	.	G	3₁₀ helix	trans	-91.4	-11.1	-176.3	-57.1	-176.9	0	0	0	114	S326 L330 L360 N363 R364 K369 L370	S326-L366 WeakPolarHBondContact OG-CD2 3.42Å; L330-L366 HydrophobicContact CD2-CB 3.85Å; L330-L366 HydrophobicContact CD2-CD1 4.1Å; L330-L366 HydrophobicContact CD2-CD2 4.01Å; L330-L366 HydrophobicContact CD2-CG 4.19Å; L360-L366 HydrophobicContact CD2-CD1 4.26Å; N363-L366 HydrophobicContact CB-CD1 3.96Å; N363-L366 HydrophobicContact CB-CG 3.98Å; N363-L366 PolarHBondContact O-N 2.95Å; R364-L366 PolarHBondContact O-N 3.28Å; L366-K369 WeakPolarHBondContact O-CB 3.31Å; L366-K369 PolarHBondContact O-N 2.73Å; L366-L370 HydrophobicContact CB-CD1 4.28Å; L366-L370 PolarHBondContact O-N 3.25Å
367	F	88.1	Confident	92.1	Very high	29 Å²	29	63.2 Å²	63.2	13%	0.127	31%	0.306	C	S	.	.	H	α-helix	trans	-57.2	-41.9	-174.2	-82	-114.9	0	0	0	114.1	Y361 R364 K369 L370 E371 G406	Y361-F367 HydrophobicContact CD1-CD1 4.11Å; Y361-F367 AromaticContact CD1-CE1 3.66Å; Y361-F367 HydrophobicContact CD1-CE1 3.66Å; Y361-F367 HydrophobicContact CD1-CE2 4.18Å; Y361-F367 AromaticContact CD1-CZ 3.72Å; Y361-F367 HydrophobicContact CD1-CZ 3.72Å; Y361-F367 HydrophobicContact CE1-CE1 4.37Å; Y361-F367 HydrophobicContact CG-CZ 4.34Å; Y361-F367 WeakPolarHBondContact O-CE2 3.32Å; Y361-F367 WeakPolarHBondContact O-CZ 3.48Å; R364-F367 HydrophobicContact CG-CE2 4.37Å; R364-F367 PolarHBondContact O-N 2.9Å; F367-K369 PolarHBondContact O-N 2.91Å; F367-K369 VanDerWaalsContact O-N 3.15Å; F367-L370 WeakPolarHBondContact O-CA 3.44Å; F367-L370 PolarHBondContact O-N 3.11Å; F367-E371 PolarHBondContact O-N 3.38Å; F367-G406 VanDerWaalsContact CE1-CA 3.41Å
368	P	89.9	Confident	92	Very high	104 Å²	104	65.1 Å²	65.1	68%	0.675	31%	0.314	S	S	*	.	H	α-helix	trans	-63.7	-19.2	176.3	-24.1	35.5	0	0	0	114.5
369	K	90.3	Very high	92	Very high	74 Å²	74	69.1 Å²	69.1	32%	0.322	34%	0.336	S	S	.	.	H	α-helix	trans	-88.2	-10.2	172	-65.3	179.9	175.9	178.3	0	112.9	S326 D327 L330 L366 F367	S326-K369 PolarHBondContact O-NZ 3.16Å; D327-K369 IonicContact OD1-NZ 3.68Å; D327-K369 PolarHBondContact OD1-NZ 3.23Å; L330-K369 HydrophobicContact CB-CD 4.32Å; L330-K369 HydrophobicContact CD2-CB 3.81Å; L330-K369 HydrophobicContact CD2-CD 3.98Å; L330-K369 HydrophobicContact CG-CB 4.02Å; L330-K369 HydrophobicContact CG-CD 4.27Å; L366-K369 WeakPolarHBondContact O-CB 3.31Å; L366-K369 PolarHBondContact O-N 2.73Å; F367-K369 PolarHBondContact O-N 2.91Å; F367-K369 VanDerWaalsContact O-N 3.15Å
370	L	93.7	Very high	92.2	Very high	0 Å²	0	68.6 Å²	68.6	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-105.1	-27.4	-177.4	-70.1	166.4	0	0	0	113	L330 L335 L360 Y361 L366 F367 L372 F373 T374	L330-L370 HydrophobicContact CD1-CD2 3.95Å; L330-L370 HydrophobicContact CD2-CG 4.49Å; L335-L370 HydrophobicContact CD1-CD2 4.33Å; L335-L370 HydrophobicContact CD2-CD2 4.16Å; L360-L370 HydrophobicContact CB-CD1 3.99Å; L360-L370 HydrophobicContact CB-CD2 4.4Å; L360-L370 HydrophobicContact CD1-CD2 4.25Å; Y361-L370 HydrophobicContact CD1-CD1 3.69Å; Y361-L370 HydrophobicContact CD2-CD1 4.41Å; Y361-L370 HydrophobicContact CE1-CB 3.8Å; Y361-L370 HydrophobicContact CE1-CD1 3.65Å; Y361-L370 HydrophobicContact CE1-CG 4.25Å; Y361-L370 HydrophobicContact CE2-CD1 4.37Å; Y361-L370 HydrophobicContact CG-CD1 4.08Å; L366-L370 HydrophobicContact CB-CD1 4.28Å; L366-L370 PolarHBondContact O-N 3.25Å; F367-L370 WeakPolarHBondContact O-CA 3.44Å; F367-L370 PolarHBondContact O-N 3.11Å; L370-L372 VanDerWaalsContact C-N 3.34Å; L370-L372 PolarHBondContact O-N 3.24Å; L370-L372 VanDerWaalsContact O-N 3.15Å; L370-F373 CarbonylContact O-C 3.58Å; L370-F373 WeakPolarHBondContact O-CA 3.14Å; L370-F373 VanDerWaalsContact O-CB 3.27Å; L370-F373 WeakPolarHBondContact O-CB 3.4Å; L370-F373 PolarHBondContact O-N 3.02Å; L370-T374 PolarHBondContact O-N 2.91Å; L370-T374 PolarHBondContact O-OG1 3.41Å; L370-T374 VanDerWaalsContact O-OG1 3.12Å
371	E	90.6	Very high	92.4	Very high	118 Å²	118	68.6 Å²	68.6	55%	0.551	33%	0.329	S	S	*	.	H	α-helix	trans	-46.1	-48.3	-173.5	-169.2	-171.8	153.8	0	0	114.5	F367 F373 T374 N375	F367-E371 PolarHBondContact O-N 3.38Å; E371-F373 VanDerWaalsContact C-N 3.29Å; E371-F373 PolarHBondContact O-N 3.02Å; E371-T374 WeakPolarHBondContact O-CB 3.41Å; E371-T374 PolarHBondContact O-N 2.98Å; E371-N375 WeakPolarHBondContact O-CB 3.17Å; E371-N375 VanDerWaalsContact O-CG 3.23Å; E371-N375 PolarHBondContact O-N 3.2Å; E371-N375 PolarHBondContact O-OD1 2.97Å
372	L	92	Very high	92.5	Very high	114 Å²	114	69 Å²	69	60%	0.597	33%	0.332	S	S	*	.	H	α-helix	trans	-64.8	-31.2	178	-178.4	61.7	0	0	0	113	L370 R376	L370-L372 VanDerWaalsContact C-N 3.34Å; L370-L372 PolarHBondContact O-N 3.24Å; L370-L372 VanDerWaalsContact O-N 3.15Å; L372-R376 VanDerWaalsContact O-CB 3.31Å; L372-R376 WeakPolarHBondContact O-CB 3.38Å; L372-R376 PolarHBondContact O-N 3.47Å
373	F	95.6	Very high	92.8	Very high	6 Å²	6	67.2 Å²	67.2	3%	0.026	32%	0.324	C	S	.	.	H	α-helix	trans	-73.5	-43.7	172.2	177.8	-83	0	0	0	110.8	L335 L342 L357 L370 E371 R376 F377	L335-F373 HydrophobicContact CB-CD2 3.85Å; L335-F373 HydrophobicContact CB-CE2 4.3Å; L335-F373 HydrophobicContact CD1-CB 4.25Å; L335-F373 HydrophobicContact CD2-CD2 4.36Å; L335-F373 WeakPolarHBondContact O-CE2 3.36Å; L342-F373 HydrophobicContact CD1-CZ 4.36Å; L357-F373 HydrophobicContact CD1-CE1 3.79Å; L357-F373 HydrophobicContact CD1-CZ 4.05Å; L357-F373 HydrophobicContact CD2-CD1 4.21Å; L357-F373 HydrophobicContact CD2-CE1 3.52Å; L357-F373 HydrophobicContact CD2-CZ 3.85Å; L357-F373 HydrophobicContact CG-CE1 4.33Å; L370-F373 CarbonylContact O-C 3.58Å; L370-F373 WeakPolarHBondContact O-CA 3.14Å; L370-F373 VanDerWaalsContact O-CB 3.27Å; L370-F373 WeakPolarHBondContact O-CB 3.4Å; L370-F373 PolarHBondContact O-N 3.02Å; E371-F373 VanDerWaalsContact C-N 3.29Å; E371-F373 PolarHBondContact O-N 3.02Å; F373-R376 PolarHBondContact O-N 3.44Å; F373-F377 HydrophobicContact CD1-CD2 4.31Å; F373-F377 AromaticContact CD2-CD2 3.55Å; F373-F377 HydrophobicContact CD2-CD2 3.55Å; F373-F377 AromaticContact CD2-CE2 3.75Å; F373-F377 HydrophobicContact CD2-CE2 3.75Å; F373-F377 HydrophobicContact CE1-CB 4.28Å; F373-F377 HydrophobicContact CE1-CD2 4.18Å; F373-F377 AromaticContact CE2-CD2 3.43Å; F373-F377 HydrophobicContact CE2-CD2 3.43Å; F373-F377 VanDerWaalsContact CE2-CD2 3.43Å; F373-F377 AromaticContact CE2-CE2 3.62Å; F373-F377 HydrophobicContact CE2-CE2 3.62Å; F373-F377 HydrophobicContact CE2-CG 4.29Å; F373-F377 HydrophobicContact CG-CD2 4.01Å; F373-F377 HydrophobicContact CZ-CB 4.37Å; F373-F377 AromaticContact CZ-CD2 3.76Å; F373-F377 HydrophobicContact CZ-CD2 3.76Å; F373-F377 HydrophobicContact CZ-CE2 4.34Å; F373-F377 HydrophobicContact CZ-CG 4.21Å; F373-F377 WeakPolarHBondContact O-CD2 3.48Å; F373-F377 PolarHBondContact O-N 3.41Å
374	T	93.9	Very high	93.3	Very high	7 Å²	7	64.4 Å²	64.4	4%	0.043	31%	0.308	C	S	.	.	H	α-helix	trans	-53.9	-58	174.7	-38.5	0	0	0	0	109.9	Y361 L370 E371 R376 F377 K378 I403	Y361-T374 PolarHBondContact OH-OG1 3.42Å; L370-T374 PolarHBondContact O-N 2.91Å; L370-T374 PolarHBondContact O-OG1 3.41Å; L370-T374 VanDerWaalsContact O-OG1 3.12Å; E371-T374 WeakPolarHBondContact O-CB 3.41Å; E371-T374 PolarHBondContact O-N 2.98Å; T374-R376 PolarHBondContact O-N 3.28Å; T374-F377 PolarHBondContact O-N 2.97Å; T374-K378 WeakPolarHBondContact O-CA 3.47Å; T374-K378 VanDerWaalsContact O-CB 3.29Å; T374-K378 WeakPolarHBondContact O-CB 3.39Å; T374-K378 PolarHBondContact O-N 3.3Å; T374-I403 HydrophobicContact CG2-CD1 4.12Å; T374-I403 HydrophobicContact CG2-CG1 4.31Å; T374-I403 HydrophobicContact CG2-CG2 3.88Å
375	N	91.9	Very high	94	Very high	100 Å²	100	56.7 Å²	56.7	54%	0.535	28%	0.28	S	S	.	.	H	α-helix	trans	-63.6	-17.3	-174.9	-62.9	-9.8	0	0	0	113.2	E371	E371-N375 WeakPolarHBondContact O-CB 3.17Å; E371-N375 VanDerWaalsContact O-CG 3.23Å; E371-N375 PolarHBondContact O-N 3.2Å; E371-N375 PolarHBondContact O-OD1 2.97Å
376	R	95.6	Very high	94.4	Very high	168 Å²	168	53.3 Å²	53.3	63%	0.634	27%	0.266	S	S	*	.	H	α-helix	trans	-93.3	-27.6	176.5	-178.1	173.7	-177.5	166.1	6.9	114.2	L372 F373 T374	L372-R376 VanDerWaalsContact O-CB 3.31Å; L372-R376 WeakPolarHBondContact O-CB 3.38Å; L372-R376 PolarHBondContact O-N 3.47Å; F373-R376 PolarHBondContact O-N 3.44Å; T374-R376 PolarHBondContact O-N 3.28Å
377	F	97.1	Very high	94.9	Very high	20 Å²	20	53.6 Å²	53.6	9%	0.088	27%	0.268	C	S	.	.	H	α-helix	trans	-121.7	0.7	-173.1	-68	-74.6	0	0	0	114.1	G339 L342 F373 T374 D379 R380 I381	G339-F377 WeakPolarHBondContact O-CE1 3.37Å; L342-F377 HydrophobicContact CD1-CB 4.4Å; F373-F377 HydrophobicContact CD1-CD2 4.31Å; F373-F377 AromaticContact CD2-CD2 3.55Å; F373-F377 HydrophobicContact CD2-CD2 3.55Å; F373-F377 AromaticContact CD2-CE2 3.75Å; F373-F377 HydrophobicContact CD2-CE2 3.75Å; F373-F377 HydrophobicContact CE1-CB 4.28Å; F373-F377 HydrophobicContact CE1-CD2 4.18Å; F373-F377 AromaticContact CE2-CD2 3.43Å; F373-F377 HydrophobicContact CE2-CD2 3.43Å; F373-F377 VanDerWaalsContact CE2-CD2 3.43Å; F373-F377 AromaticContact CE2-CE2 3.62Å; F373-F377 HydrophobicContact CE2-CE2 3.62Å; F373-F377 HydrophobicContact CE2-CG 4.29Å; F373-F377 HydrophobicContact CG-CD2 4.01Å; F373-F377 HydrophobicContact CZ-CB 4.37Å; F373-F377 AromaticContact CZ-CD2 3.76Å; F373-F377 HydrophobicContact CZ-CD2 3.76Å; F373-F377 HydrophobicContact CZ-CE2 4.34Å; F373-F377 HydrophobicContact CZ-CG 4.21Å; F373-F377 WeakPolarHBondContact O-CD2 3.48Å; F373-F377 PolarHBondContact O-N 3.41Å; T374-F377 PolarHBondContact O-N 2.97Å; F377-D379 PolarHBondContact O-N 2.63Å; F377-R380 PolarHBondContact O-N 3.31Å; F377-R380 VanDerWaalsContact O-N 3.08Å; F377-I381 HydrophobicContact CB-CD1 4.45Å; F377-I381 WeakPolarHBondContact O-CG1 3.44Å; F377-I381 PolarHBondContact O-N 3.22Å
378	K	95.6	Very high	95.2	Very high	39 Å²	39	59.3 Å²	59.3	17%	0.17	29%	0.293	C	S	.	.	H	α-helix	trans	-47.5	-56.3	177.3	-177.1	-149.5	60.9	130.6	0	111.6	T374 R380 I381 V382 A410 L411 D415	T374-K378 WeakPolarHBondContact O-CA 3.47Å; T374-K378 VanDerWaalsContact O-CB 3.29Å; T374-K378 WeakPolarHBondContact O-CB 3.39Å; T374-K378 PolarHBondContact O-N 3.3Å; K378-R380 PolarHBondContact O-N 3.09Å; K378-R380 VanDerWaalsContact O-N 3.17Å; K378-I381 CarbonylContact O-C 3.55Å; K378-I381 WeakPolarHBondContact O-CA 3.35Å; K378-I381 PolarHBondContact O-N 2.7Å; K378-V382 HydrophobicContact CG-CG2 4.26Å; K378-V382 WeakPolarHBondContact O-CG2 3.5Å; K378-V382 PolarHBondContact O-N 3.13Å; K378-A410 VanDerWaalsContact CD-O 3.29Å; K378-A410 WeakPolarHBondContact CD-O 3.28Å; K378-L411 HydrophobicContact CD-CD2 4.33Å; K378-L411 HydrophobicContact CG-CD2 4.11Å; K378-D415 WeakPolarHBondContact CD-OD2 3.46Å; K378-D415 IonicContact NZ-OD1 3.7Å; K378-D415 PolarHBondContact NZ-OD1 2.98Å; K378-D415 IonicContact NZ-OD2 3.56Å; K378-D415 PolarHBondContact NZ-OD2 2.98Å
379	D	96.4	Very high	95.6	Very high	111 Å²	111	58 Å²	58	59%	0.594	28%	0.278	S	S	*	.	H	α-helix	trans	-55.8	-38	-178.3	-46.6	-22.9	0	0	0	111.9	F377 S383	F377-D379 PolarHBondContact O-N 2.63Å; D379-S383 WeakPolarHBondContact O-CB 3.43Å; D379-S383 PolarHBondContact O-N 3Å; D379-S383 PolarHBondContact O-OG 3.49Å
380	R	97.7	Very high	95.9	Very high	56 Å²	56	57.7 Å²	57.7	21%	0.211	28%	0.275	C	S	.	.	H	α-helix	trans	-69	-44.3	175.2	178.1	61.6	-167.9	133.9	2.9	111.3	L342 F377 K378 S383 M384 D387	L342-R380 HydrophobicContact CB-CG 4.1Å; L342-R380 PolarHBondContact O-NE 3.41Å; L342-R380 PolarHBondContact O-NH2 3.33Å; F377-R380 PolarHBondContact O-N 3.31Å; F377-R380 VanDerWaalsContact O-N 3.08Å; K378-R380 PolarHBondContact O-N 3.09Å; K378-R380 VanDerWaalsContact O-N 3.17Å; R380-S383 WeakPolarHBondContact CA-OG 3.23Å; R380-S383 PolarHBondContact NH1-OG 3.16Å; R380-S383 PolarHBondContact O-N 2.99Å; R380-S383 PolarHBondContact O-OG 3.07Å; R380-M384 HydrophobicContact CG-SD 4.12Å; R380-M384 VanDerWaalsContact CZ-SD 3.56Å; R380-M384 VanDerWaalsContact NH1-CG 3.33Å; R380-M384 VanDerWaalsContact NH2-CG 3.33Å; R380-M384 VanDerWaalsContact O-CG 3.26Å; R380-M384 WeakPolarHBondContact O-CG 3.37Å; R380-M384 PolarHBondContact O-N 3.2Å; R380-M384 VanDerWaalsContact O-N 3.13Å; R380-D387 IonicContact NH2-OD2 2.75Å
381	I	98.1	Very high	96.1	Very high	0 Å²	0	63.1 Å²	63.1	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-63.3	-42.6	178.8	-65.4	165.4	0	0	0	110.7	L342 L357 F377 K378 M384 L399 V400 I403	L342-I381 HydrophobicContact CD1-CD1 4.49Å; L342-I381 HydrophobicContact CD1-CG1 4.04Å; L357-I381 HydrophobicContact CD1-CD1 4.43Å; F377-I381 HydrophobicContact CB-CD1 4.45Å; F377-I381 WeakPolarHBondContact O-CG1 3.44Å; F377-I381 PolarHBondContact O-N 3.22Å; K378-I381 CarbonylContact O-C 3.55Å; K378-I381 WeakPolarHBondContact O-CA 3.35Å; K378-I381 PolarHBondContact O-N 2.7Å; I381-M384 WeakPolarHBondContact O-CB 3.47Å; I381-M384 PolarHBondContact O-N 3.14Å; I381-M384 VanDerWaalsContact O-N 3.15Å; I381-L399 HydrophobicContact CD1-CD2 4.11Å; I381-L399 HydrophobicContact CG1-CD2 4.31Å; I381-L399 HydrophobicContact CG2-CD2 3.84Å; I381-L399 HydrophobicContact CG2-CG 4.12Å; I381-V400 HydrophobicContact CG2-CG2 3.8Å; I381-I403 HydrophobicContact CD1-CD1 4.45Å
382	V	96.9	Very high	96.5	Very high	13 Å²	13	57.6 Å²	57.6	8%	0.079	28%	0.278	C	S	.	.	H	α-helix	trans	-64.4	-44.6	174.3	176.9	0	0	0	0	110.4	K378 M384 T385 V400 L411 D415	K378-V382 HydrophobicContact CG-CG2 4.26Å; K378-V382 WeakPolarHBondContact O-CG2 3.5Å; K378-V382 PolarHBondContact O-N 3.13Å; V382-M384 PolarHBondContact O-N 2.83Å; V382-T385 WeakPolarHBondContact O-CG2 3.36Å; V382-T385 PolarHBondContact O-N 2.99Å; V382-T385 PolarHBondContact O-OG1 2.8Å; V382-V400 HydrophobicContact CG2-CG2 4.35Å; V382-L411 HydrophobicContact CG2-CD2 4.41Å; V382-D415 HydrophobicContact CG1-CB 4.45Å; V382-D415 HydrophobicContact CG2-CB 4.18Å
383	S	97.4	Very high	96.8	Very high	56 Å²	56	52.3 Å²	52.3	39%	0.392	25%	0.251	S	S	.	.	H	α-helix	trans	-60.2	-18	174.2	78.1	0	0	0	0	114.3	D379 R380	D379-S383 WeakPolarHBondContact O-CB 3.43Å; D379-S383 PolarHBondContact O-N 3Å; D379-S383 PolarHBondContact O-OG 3.49Å; R380-S383 WeakPolarHBondContact CA-OG 3.23Å; R380-S383 PolarHBondContact NH1-OG 3.16Å; R380-S383 PolarHBondContact O-N 2.99Å; R380-S383 PolarHBondContact O-OG 3.07Å
384	M	98.4	Very high	96.9	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-85.3	-7.2	177.9	-71.1	170.7	66.3	0	0	113.4	L342 R350 L354 R380 I381 V382 L386 D387 V392 A393 A396	L342-M384 HydrophobicContact CB-SD 4.15Å; L342-M384 HydrophobicContact CD2-CE 3.99Å; L342-M384 HydrophobicContact CD2-SD 3.89Å; R350-M384 HydrophobicContact CB-CE 3.82Å; R350-M384 HydrophobicContact CG-CE 4.39Å; L354-M384 HydrophobicContact CD1-CE 3.83Å; L354-M384 HydrophobicContact CD2-CE 3.98Å; L354-M384 HydrophobicContact CG-CE 3.89Å; R380-M384 HydrophobicContact CG-SD 4.12Å; R380-M384 VanDerWaalsContact CZ-SD 3.56Å; R380-M384 VanDerWaalsContact NH1-CG 3.33Å; R380-M384 VanDerWaalsContact NH2-CG 3.33Å; R380-M384 VanDerWaalsContact O-CG 3.26Å; R380-M384 WeakPolarHBondContact O-CG 3.37Å; R380-M384 PolarHBondContact O-N 3.2Å; R380-M384 VanDerWaalsContact O-N 3.13Å; I381-M384 WeakPolarHBondContact O-CB 3.47Å; I381-M384 PolarHBondContact O-N 3.14Å; I381-M384 VanDerWaalsContact O-N 3.15Å; V382-M384 PolarHBondContact O-N 2.83Å; M384-L386 PolarHBondContact O-N 3.42Å; M384-D387 HydrophobicContact CB-CB 4.49Å; M384-D387 VanDerWaalsContact O-CB 3.23Å; M384-D387 WeakPolarHBondContact O-CB 3.44Å; M384-D387 PolarHBondContact O-N 2.81Å; M384-D387 VanDerWaalsContact O-N 3.13Å; M384-V392 HydrophobicContact CE-CG1 3.56Å; M384-A393 VanDerWaalsContact O-CA 3.29Å; M384-A393 WeakPolarHBondContact O-CA 3.35Å; M384-A396 HydrophobicContact CB-CB 3.69Å; M384-A396 WeakPolarHBondContact O-CB 3.44Å
385	T	98.1	Very high	97.1	Very high	3 Å²	3	53 Å²	53	2%	0.018	25%	0.254	C	S	.	.	G	3₁₀ helix	trans	-69.5	-18.5	168.3	68.3	0	0	0	0	112	V382 A393 A396 I397 V400 V419	V382-T385 WeakPolarHBondContact O-CG2 3.36Å; V382-T385 PolarHBondContact O-N 2.99Å; V382-T385 PolarHBondContact O-OG1 2.8Å; T385-A393 WeakPolarHBondContact O-CB 3.33Å; T385-A396 HydrophobicContact CG2-CB 4.24Å; T385-I397 HydrophobicContact CG2-CB 4.45Å; T385-I397 HydrophobicContact CG2-CG1 3.59Å; T385-V400 HydrophobicContact CG2-CG2 4.38Å; T385-V419 HydrophobicContact CG2-CG2 4.09Å
386	L	96.9	Very high	97.5	Very high	90 Å²	90	48.2 Å²	48.2	47%	0.471	23%	0.228	S	C	.	.	G	3₁₀ helix	trans	-106.8	29.5	169	-70.5	170.4	0	0	0	112.2	M384 L422	M384-L386 PolarHBondContact O-N 3.42Å; L386-L422 HydrophobicContact CD2-CD2 3.65Å; L386-L422 HydrophobicContact CG-CD2 4.34Å
387	D	98.3	Very high	97.6	Very high	17 Å²	17	40.2 Å²	40.2	9%	0.091	20%	0.198	C	C	.	.			trans	-65.1	144	176	-161.2	-69.8	0	0	0	111.6	R350 R380 M384 E389 V392	R350-D387 IonicContact CZ-OD1 2.69Å; R350-D387 IonicContact CZ-OD2 2.67Å; R350-D387 IonicContact NE-OD1 2.92Å; R350-D387 IonicContact NE-OD2 3.58Å; R350-D387 PolarHBondContact NE-OD2 3.04Å; R350-D387 IonicContact NH2-OD1 2.71Å; R350-D387 PolarHBondContact NH2-OD1 3.3Å; R350-D387 IonicContact NH2-OD2 2.88Å; R350-D387 PolarHBondContact NH2-OD2 2.92Å; R380-D387 IonicContact NH2-OD2 2.75Å; M384-D387 HydrophobicContact CB-CB 4.49Å; M384-D387 VanDerWaalsContact O-CB 3.23Å; M384-D387 WeakPolarHBondContact O-CB 3.44Å; M384-D387 PolarHBondContact O-N 2.81Å; M384-D387 VanDerWaalsContact O-N 3.13Å; D387-E389 PolarHBondContact O-N 3.35Å; D387-E389 VanDerWaalsContact O-N 3.12Å; D387-E389 PolarHBondContact OD1-N 2.9Å; D387-V392 HydrophobicContact CB-CB 3.95Å; D387-V392 HydrophobicContact CB-CG1 3.88Å
388	K	95.9	Very high	97.6	Very high	150 Å²	150	44 Å²	44	65%	0.652	21%	0.212	S	C	*	.	S	Bend	trans	-61.5	-20.6	-177	-175.7	-175.7	172	-163.8	0	113.6
389	E	96.9	Very high	97.7	Very high	76 Å²	76	42.1 Å²	42.1	36%	0.355	20%	0.204	S	C	.	.	S	Bend	trans	-110.3	110.1	177.1	-69	165.4	-104.6	0	0	108.9	G347 R350 D387 D391 V392 A393	G347-E389 VanDerWaalsContact CA-CD 3.46Å; G347-E389 VanDerWaalsContact CA-OE1 3.24Å; G347-E389 WeakPolarHBondContact CA-OE1 3.37Å; G347-E389 WeakPolarHBondContact CA-OE2 3.24Å; G347-E389 PolarHBondContact N-OE1 2.99Å; G347-E389 PolarHBondContact N-OE2 3.04Å; R350-E389 IonicContact CZ-OE1 3.14Å; R350-E389 IonicContact NH1-OE1 3.91Å; R350-E389 IonicContact NH2-OE1 2.76Å; R350-E389 PolarHBondContact NH2-OE1 3.36Å; D387-E389 PolarHBondContact O-N 3.35Å; D387-E389 VanDerWaalsContact O-N 3.12Å; D387-E389 PolarHBondContact OD1-N 2.9Å; E389-D391 VanDerWaalsContact C-N 3.25Å; E389-D391 PolarHBondContact O-N 2.98Å; E389-D391 VanDerWaalsContact O-N 3.12Å; E389-V392 HydrophobicContact CB-CG2 4Å; E389-V392 WeakPolarHBondContact O-CA 2.91Å; E389-V392 VanDerWaalsContact O-CB 3.31Å; E389-V392 WeakPolarHBondContact O-CB 3.49Å; E389-V392 PolarHBondContact O-N 3.04Å; E389-A393 PolarHBondContact O-N 3.38Å
390	Y	97.1	Very high	97.7	Very high	68 Å²	68	36.9 Å²	36.9	27%	0.267	18%	0.176	S	C	.	.	H	α-helix	trans	-58.1	-31.3	-169.3	-63.9	-62	0	0	0	114.5	V392 A393 V394 H427 V430	Y390-V392 PolarHBondContact O-N 3.21Å; Y390-A393 WeakPolarHBondContact O-CB 3.44Å; Y390-A393 PolarHBondContact O-N 3.18Å; Y390-A393 VanDerWaalsContact O-N 3.1Å; Y390-V394 WeakPolarHBondContact O-CG2 3.42Å; Y390-V394 PolarHBondContact O-N 2.78Å; Y390-H427 WeakPolarHBondContact CB-CE1 3.19Å; Y390-H427 WeakPolarHBondContact CB-ND1 3.47Å; Y390-H427 HydrophobicContact CD1-CB 3.99Å; Y390-H427 AromaticContact CD1-CG 3.93Å; Y390-H427 HydrophobicContact CD2-CB 4.29Å; Y390-H427 AromaticContact CD2-CD2 3.56Å; Y390-H427 AromaticContact CD2-CG 3.75Å; Y390-H427 AromaticContact CD2-NE2 3.87Å; Y390-H427 HydrophobicContact CE1-CB 3.93Å; Y390-H427 HydrophobicContact CE2-CB 4.25Å; Y390-H427 HydrophobicContact CG-CB 4.18Å; Y390-H427 AromaticContact CG-CD2 3.88Å; Y390-H427 AromaticContact CG-CE1 3.87Å; Y390-H427 AromaticContact CG-CG 3.64Å; Y390-H427 AromaticContact CG-ND1 3.65Å; Y390-V430 HydrophobicContact CD1-CG2 4.14Å
391	D	97.8	Very high	97.6	Very high	114 Å²	114	34.3 Å²	34.3	61%	0.61	17%	0.166	S	C	*	.	H	α-helix	trans	-59.6	-34.7	173.5	-71.9	-31.8	0	0	0	112.4	L351 E389 E395	L351-D391 HydrophobicContact CD1-CB 4.17Å; L351-D391 VanDerWaalsContact CD1-O 3.28Å; L351-D391 WeakPolarHBondContact CD1-O 3.41Å; E389-D391 VanDerWaalsContact C-N 3.25Å; E389-D391 PolarHBondContact O-N 2.98Å; E389-D391 VanDerWaalsContact O-N 3.12Å; D391-E395 VanDerWaalsContact O-CG 3.29Å; D391-E395 WeakPolarHBondContact O-CG 3.39Å; D391-E395 PolarHBondContact O-N 2.75Å
392	V	98.6	Very high	97.4	Very high	2 Å²	2	35.8 Å²	35.8	1%	0.012	17%	0.174	C	C	.	.	H	α-helix	trans	-71.1	-40.6	175.1	-174.5	0	0	0	0	109.8	G347 R350 L351 L354 M384 D387 E389 Y390 E395 A396	G347-V392 WeakPolarHBondContact O-CG2 3.35Å; R350-V392 HydrophobicContact CB-CG1 3.89Å; R350-V392 HydrophobicContact CB-CG2 4.4Å; L351-V392 HydrophobicContact CB-CG2 4.35Å; L354-V392 HydrophobicContact CD1-CG1 3.65Å; L354-V392 WeakPolarHBondContact CD1-O 3.46Å; M384-V392 HydrophobicContact CE-CG1 3.56Å; D387-V392 HydrophobicContact CB-CB 3.95Å; D387-V392 HydrophobicContact CB-CG1 3.88Å; E389-V392 HydrophobicContact CB-CG2 4Å; E389-V392 WeakPolarHBondContact O-CA 2.91Å; E389-V392 VanDerWaalsContact O-CB 3.31Å; E389-V392 WeakPolarHBondContact O-CB 3.49Å; E389-V392 PolarHBondContact O-N 3.04Å; Y390-V392 PolarHBondContact O-N 3.21Å; V392-E395 PolarHBondContact O-N 2.98Å; V392-A396 VanDerWaalsContact O-CB 3.3Å; V392-A396 WeakPolarHBondContact O-CB 3.46Å; V392-A396 PolarHBondContact O-N 3.16Å
393	A	98.6	Very high	97.3	Very high	2 Å²	2	35.3 Å²	35.3	2%	0.017	17%	0.171	C	C	.	.	H	α-helix	trans	-61.4	-47	176.3	0	0	0	0	0	113.1	M384 T385 E389 Y390 E395 A396 I397 V430	M384-A393 VanDerWaalsContact O-CA 3.29Å; M384-A393 WeakPolarHBondContact O-CA 3.35Å; T385-A393 WeakPolarHBondContact O-CB 3.33Å; E389-A393 PolarHBondContact O-N 3.38Å; Y390-A393 WeakPolarHBondContact O-CB 3.44Å; Y390-A393 PolarHBondContact O-N 3.18Å; Y390-A393 VanDerWaalsContact O-N 3.1Å; A393-E395 VanDerWaalsContact C-N 3.33Å; A393-E395 PolarHBondContact O-N 2.86Å; A393-A396 PolarHBondContact O-N 3.05Å; A393-I397 VanDerWaalsContact O-CG1 3.31Å; A393-I397 WeakPolarHBondContact O-CG1 3.29Å; A393-I397 PolarHBondContact O-N 2.84Å; A393-V430 HydrophobicContact CB-CG2 3.91Å
394	V	98.6	Very high	96.9	Very high	7 Å²	7	33 Å²	33	4%	0.042	15%	0.154	C	C	.	.	H	α-helix	trans	-56.6	-46.8	176.3	172.6	0	0	0	0	111.4	Y390 A396 R398 P429 V430 A433	Y390-V394 WeakPolarHBondContact O-CG2 3.42Å; Y390-V394 PolarHBondContact O-N 2.78Å; V394-A396 VanDerWaalsContact C-N 3.34Å; V394-R398 VanDerWaalsContact CG1-CZ 3.49Å; V394-R398 WeakPolarHBondContact O-CG 3.39Å; V394-R398 PolarHBondContact O-N 3.28Å; V394-R398 VanDerWaalsContact O-N 3.07Å; V394-P429 HydrophobicContact CG2-CB 3.89Å; V394-P429 WeakPolarHBondContact CG2-O 3.47Å; V394-V430 HydrophobicContact CG2-CB 4.5Å; V394-V430 HydrophobicContact CG2-CG2 3.71Å; V394-A433 HydrophobicContact CG1-CB 4.33Å
395	E	98.4	Very high	96.3	Very high	20 Å²	20	36.9 Å²	36.9	9%	0.093	17%	0.172	C	C	.	.	H	α-helix	trans	-77	-22.5	-177.7	-56.6	-68.1	-164.6	0	0	112.7	L351 L354 K355 Q358 D391 V392 A393 R398 L399	L351-E395 HydrophobicContact CD1-CB 4.17Å; L351-E395 HydrophobicContact CD1-CG 3.65Å; L354-E395 HydrophobicContact CB-CB 4.17Å; L354-E395 HydrophobicContact CD1-CB 3.97Å; K355-E395 VanDerWaalsContact CE-CG 3.44Å; K355-E395 WeakPolarHBondContact CE-OE1 3.44Å; K355-E395 IonicContact NZ-OE1 2.82Å; K355-E395 PolarHBondContact NZ-OE1 3.26Å; Q358-E395 PolarHBondContact NE2-O 3.47Å; Q358-E395 PolarHBondContact NE2-OE2 3.39Å; D391-E395 VanDerWaalsContact O-CG 3.29Å; D391-E395 WeakPolarHBondContact O-CG 3.39Å; D391-E395 PolarHBondContact O-N 2.75Å; V392-E395 PolarHBondContact O-N 2.98Å; A393-E395 VanDerWaalsContact C-N 3.33Å; A393-E395 PolarHBondContact O-N 2.86Å; E395-R398 IonicContact OE1-NH1 2.62Å; E395-R398 PolarHBondContact OE1-NH1 3.47Å; E395-R398 WeakPolarHBondContact OE2-CD 3.31Å; E395-R398 IonicContact OE2-CZ 3.8Å; E395-R398 IonicContact OE2-NE 3.38Å; E395-R398 IonicContact OE2-NH1 2.75Å; E395-R398 PolarHBondContact OE2-NH1 3.09Å; E395-L399 WeakPolarHBondContact O-CB 3.46Å; E395-L399 PolarHBondContact O-N 3.05Å; E395-L399 VanDerWaalsContact O-N 3.09Å
396	A	98.6	Very high	95.5	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-70.6	-47.8	170.8	0	0	0	0	0	110.8	L354 M384 T385 V392 A393 V394 R398 L399 V400	L354-A396 HydrophobicContact CD1-CB 4.01Å; L354-A396 HydrophobicContact CD2-CB 4.19Å; M384-A396 HydrophobicContact CB-CB 3.69Å; M384-A396 WeakPolarHBondContact O-CB 3.44Å; T385-A396 HydrophobicContact CG2-CB 4.24Å; V392-A396 VanDerWaalsContact O-CB 3.3Å; V392-A396 WeakPolarHBondContact O-CB 3.46Å; V392-A396 PolarHBondContact O-N 3.16Å; A393-A396 PolarHBondContact O-N 3.05Å; V394-A396 VanDerWaalsContact C-N 3.34Å; A396-R398 PolarHBondContact O-N 3.37Å; A396-L399 WeakPolarHBondContact O-CB 3.45Å; A396-L399 PolarHBondContact O-N 3.29Å; A396-L399 VanDerWaalsContact O-N 3.07Å; A396-V400 WeakPolarHBondContact O-CG2 3.42Å; A396-V400 PolarHBondContact O-N 3.47Å
397	I	98.6	Very high	94.8	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-57.9	-50.9	175.6	-63.2	161.2	0	0	0	109.8	T385 A393 L399 V400 T401 V419 L422 V430 A433 F437	T385-I397 HydrophobicContact CG2-CB 4.45Å; T385-I397 HydrophobicContact CG2-CG1 3.59Å; A393-I397 VanDerWaalsContact O-CG1 3.31Å; A393-I397 WeakPolarHBondContact O-CG1 3.29Å; A393-I397 PolarHBondContact O-N 2.84Å; I397-L399 PolarHBondContact O-N 3.16Å; I397-V400 CarbonylContact O-C 3.59Å; I397-V400 WeakPolarHBondContact O-CA 3.28Å; I397-V400 WeakPolarHBondContact O-CB 3.18Å; I397-V400 PolarHBondContact O-N 3.47Å; I397-T401 PolarHBondContact O-N 3.33Å; I397-T401 PolarHBondContact O-OG1 2.86Å; I397-V419 HydrophobicContact CG2-CG1 3.93Å; I397-L422 HydrophobicContact CD1-CD1 3.77Å; I397-L422 HydrophobicContact CG1-CD1 4.13Å; I397-V430 HydrophobicContact CD1-CG1 3.84Å; I397-A433 HydrophobicContact CB-CB 4.16Å; I397-A433 HydrophobicContact CD1-CB 4.35Å; I397-A433 HydrophobicContact CG2-CB 3.97Å; I397-A433 VanDerWaalsContact CG2-O 3.31Å; I397-A433 WeakPolarHBondContact CG2-O 3.29Å; I397-F437 HydrophobicContact CG2-CB 4.34Å
398	R	97.7	Very high	93.5	Very high	100 Å²	100	40.4 Å²	40.4	38%	0.377	20%	0.201	S	C	.	.	H	α-helix	trans	-55.8	-34.8	175.2	-74	167.9	176	165.7	4.9	113.7	V394 E395 A396 T401 L402	V394-R398 VanDerWaalsContact CG1-CZ 3.49Å; V394-R398 WeakPolarHBondContact O-CG 3.39Å; V394-R398 PolarHBondContact O-N 3.28Å; V394-R398 VanDerWaalsContact O-N 3.07Å; E395-R398 IonicContact OE1-NH1 2.62Å; E395-R398 PolarHBondContact OE1-NH1 3.47Å; E395-R398 WeakPolarHBondContact OE2-CD 3.31Å; E395-R398 IonicContact OE2-CZ 3.8Å; E395-R398 IonicContact OE2-NE 3.38Å; E395-R398 IonicContact OE2-NH1 2.75Å; E395-R398 PolarHBondContact OE2-NH1 3.09Å; A396-R398 PolarHBondContact O-N 3.37Å; R398-T401 PolarHBondContact O-N 3.07Å; R398-L402 WeakPolarHBondContact O-CG 3.39Å; R398-L402 PolarHBondContact O-N 3.32Å
399	L	97.5	Very high	92.8	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-69.3	-43.2	175.2	178.8	59.3	0	0	0	111.5	L354 L357 Q358 Y361 I381 E395 A396 I397 T401 L402 I403	L354-L399 HydrophobicContact CD2-CD2 3.59Å; L357-L399 HydrophobicContact CB-CD1 3.88Å; L357-L399 HydrophobicContact CB-CD2 3.84Å; L357-L399 HydrophobicContact CD1-CD2 3.86Å; Q358-L399 HydrophobicContact CG-CB 4.1Å; Q358-L399 HydrophobicContact CG-CD1 4.19Å; Y361-L399 HydrophobicContact CD2-CD1 3.4Å; Y361-L399 HydrophobicContact CE2-CD1 3.77Å; Y361-L399 HydrophobicContact CG-CD1 4.32Å; I381-L399 HydrophobicContact CD1-CD2 4.11Å; I381-L399 HydrophobicContact CG1-CD2 4.31Å; I381-L399 HydrophobicContact CG2-CD2 3.84Å; I381-L399 HydrophobicContact CG2-CG 4.12Å; E395-L399 WeakPolarHBondContact O-CB 3.46Å; E395-L399 PolarHBondContact O-N 3.05Å; E395-L399 VanDerWaalsContact O-N 3.09Å; A396-L399 WeakPolarHBondContact O-CB 3.45Å; A396-L399 PolarHBondContact O-N 3.29Å; A396-L399 VanDerWaalsContact O-N 3.07Å; I397-L399 PolarHBondContact O-N 3.16Å; L399-T401 VanDerWaalsContact C-N 3.3Å; L399-T401 PolarHBondContact O-N 3.19Å; L399-L402 PolarHBondContact O-N 3.02Å; L399-I403 HydrophobicContact CD1-CD1 4.42Å; L399-I403 HydrophobicContact CG-CD1 4.15Å; L399-I403 WeakPolarHBondContact O-CG1 3.17Å; L399-I403 PolarHBondContact O-N 3.34Å
400	V	96.6	Very high	92.3	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-60.7	-40.5	172.9	178.4	0	0	0	0	110.7	I381 V382 T385 A396 I397 L402 I403 L404 L411 V419 F437	I381-V400 HydrophobicContact CG2-CG2 3.8Å; V382-V400 HydrophobicContact CG2-CG2 4.35Å; T385-V400 HydrophobicContact CG2-CG2 4.38Å; A396-V400 WeakPolarHBondContact O-CG2 3.42Å; A396-V400 PolarHBondContact O-N 3.47Å; I397-V400 CarbonylContact O-C 3.59Å; I397-V400 WeakPolarHBondContact O-CA 3.28Å; I397-V400 WeakPolarHBondContact O-CB 3.18Å; I397-V400 PolarHBondContact O-N 3.47Å; V400-L402 VanDerWaalsContact C-N 3.33Å; V400-L402 PolarHBondContact O-N 3.26Å; V400-I403 PolarHBondContact O-N 3.17Å; V400-L404 PolarHBondContact O-N 3.21Å; V400-L411 HydrophobicContact CG1-CD1 3.52Å; V400-L411 HydrophobicContact CG1-CD2 4Å; V400-L411 HydrophobicContact CG1-CG 4.44Å; V400-V419 HydrophobicContact CG1-CG2 4.46Å; V400-F437 HydrophobicContact CG1-CD2 4.26Å; V400-F437 HydrophobicContact CG1-CE2 3.7Å; V400-F437 HydrophobicContact CG1-CZ 4.26Å
401	T	95.1	Very high	92	Very high	2 Å²	2	35 Å²	35	1%	0.012	19%	0.188	C	C	.	.	H	α-helix	trans	-63.2	-32.1	174.2	-49.8	0	0	0	0	113.7	I397 R398 L399 Q405 E436 R440	I397-T401 PolarHBondContact O-N 3.33Å; I397-T401 PolarHBondContact O-OG1 2.86Å; R398-T401 PolarHBondContact O-N 3.07Å; L399-T401 VanDerWaalsContact C-N 3.3Å; L399-T401 PolarHBondContact O-N 3.19Å; T401-Q405 PolarHBondContact O-N 3.22Å; T401-E436 HydrophobicContact CG2-CG 4.48Å; T401-R440 VanDerWaalsContact CG2-CD 3.47Å
402	L	94.3	Very high	91.7	Very high	31 Å²	31	31.9 Å²	31.9	16%	0.162	18%	0.175	C	C	.	.	H	α-helix	trans	-77.6	-35.7	172.8	-73.8	172.3	0	0	0	112.6	Q358 R398 L399 V400 Q405	Q358-L402 HydrophobicContact CB-CD1 3.95Å; Q358-L402 HydrophobicContact CG-CD1 4.12Å; R398-L402 WeakPolarHBondContact O-CG 3.39Å; R398-L402 PolarHBondContact O-N 3.32Å; L399-L402 PolarHBondContact O-N 3.02Å; V400-L402 VanDerWaalsContact C-N 3.33Å; V400-L402 PolarHBondContact O-N 3.26Å; L402-Q405 PolarHBondContact O-N 2.67Å
403	I	93.6	Very high	91.3	Very high	4 Å²	4	35.3 Å²	35.3	2%	0.021	19%	0.193	C	C	.	.	H	α-helix	trans	-61.8	-51.8	174.7	-71.5	162.6	0	0	0	109.7	Y361 T374 I381 L399 V400 Q405 G406 S407 A410 L411	Y361-I403 HydrophobicContact CD1-CG1 4.21Å; Y361-I403 HydrophobicContact CE1-CG1 3.99Å; Y361-I403 HydrophobicContact CE2-CG1 4.34Å; Y361-I403 HydrophobicContact CG-CG1 4.48Å; T374-I403 HydrophobicContact CG2-CD1 4.12Å; T374-I403 HydrophobicContact CG2-CG1 4.31Å; T374-I403 HydrophobicContact CG2-CG2 3.88Å; I381-I403 HydrophobicContact CD1-CD1 4.45Å; L399-I403 HydrophobicContact CD1-CD1 4.42Å; L399-I403 HydrophobicContact CG-CD1 4.15Å; L399-I403 WeakPolarHBondContact O-CG1 3.17Å; L399-I403 PolarHBondContact O-N 3.34Å; V400-I403 PolarHBondContact O-N 3.17Å; I403-Q405 PolarHBondContact O-N 3.43Å; I403-Q405 VanDerWaalsContact O-N 3.17Å; I403-G406 PolarHBondContact O-N 3.45Å; I403-G406 VanDerWaalsContact O-N 3.07Å; I403-S407 PolarHBondContact O-N 2.85Å; I403-A410 HydrophobicContact CG2-CB 3.8Å; I403-L411 HydrophobicContact CG2-CD2 4.43Å; I403-L411 HydrophobicContact CG2-CG 4.41Å
404	L	90.3	Very high	91	Very high	7 Å²	7	41.6 Å²	41.6	4%	0.037	22%	0.222	C	C	.	.	H	α-helix	trans	-50.8	-40.7	176.1	179	67.9	0	0	0	112.5	V400 G406 S407 E408 L411 F437 K441	V400-L404 PolarHBondContact O-N 3.21Å; L404-G406 VanDerWaalsContact C-N 3.28Å; L404-G406 PolarHBondContact O-N 3.12Å; L404-S407 CarbonylContact O-C 3.5Å; L404-E408 HydrophobicContact CD1-CG 4.34Å; L404-L411 HydrophobicContact CB-CD1 3.97Å; L404-L411 HydrophobicContact CD1-CD1 4.34Å; L404-F437 HydrophobicContact CB-CE2 4.24Å; L404-F437 HydrophobicContact CD2-CD2 4.12Å; L404-F437 HydrophobicContact CD2-CE2 3.69Å; L404-F437 HydrophobicContact CD2-CZ 4.26Å; L404-F437 HydrophobicContact CG-CE2 4.48Å; L404-K441 HydrophobicContact CD1-CD 3.67Å; L404-K441 HydrophobicContact CD2-CB 3.92Å; L404-K441 HydrophobicContact CD2-CD 3.85Å; L404-K441 HydrophobicContact CD2-CG 4.41Å; L404-K441 HydrophobicContact CG-CD 4.42Å
405	Q	85.8	Confident	90.7	Very high	82 Å²	82	41.8 Å²	41.8	38%	0.383	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-11.9	-177.1	-93.8	-160.3	-25.5	0	0	115.9	R364 T401 L402 I403	R364-Q405 PolarHBondContact NH2-O 2.94Å; R364-Q405 VanDerWaalsContact NH2-O 3.08Å; T401-Q405 PolarHBondContact O-N 3.22Å; L402-Q405 PolarHBondContact O-N 2.67Å; I403-Q405 PolarHBondContact O-N 3.43Å; I403-Q405 VanDerWaalsContact O-N 3.17Å
406	G	81.1	Confident	90.5	Very high	37 Å²	37	40.9 Å²	40.9	38%	0.381	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-125	-10	177.7	0	0	0	0	0	114.7	F367 I403 L404	F367-G406 VanDerWaalsContact CE1-CA 3.41Å; I403-G406 PolarHBondContact O-N 3.45Å; I403-G406 VanDerWaalsContact O-N 3.07Å; L404-G406 VanDerWaalsContact C-N 3.28Å; L404-G406 PolarHBondContact O-N 3.12Å
407	S	82.4	Confident	90.1	Very high	50 Å²	50	45 Å²	45	35%	0.35	24%	0.238	S	C	.	.			trans	-153	108	162.7	-178.2	0	0	0	0	109.1	I403 L404 D409 A410	I403-S407 PolarHBondContact O-N 2.85Å; L404-S407 CarbonylContact O-C 3.5Å; S407-D409 VanDerWaalsContact C-N 3.27Å; S407-D409 PolarHBondContact O-N 3.18Å; S407-A410 WeakPolarHBondContact O-CB 3.35Å; S407-A410 PolarHBondContact O-N 3.32Å
408	E	70.8	Confident	89.7	Confident	97 Å²	97	47.6 Å²	47.6	45%	0.453	25%	0.252	S	S	.	.	G	3₁₀ helix	trans	-68.6	-28.7	178.4	-72.1	-169.5	-132.2	0	0	112.4	L404 A410 R445	L404-E408 HydrophobicContact CD1-CG 4.34Å; E408-A410 VanDerWaalsContact C-N 3.27Å; E408-A410 PolarHBondContact O-N 2.77Å; E408-R445 IonicContact OE2-CZ 3.86Å; E408-R445 VanDerWaalsContact OE2-CZ 3.24Å; E408-R445 IonicContact OE2-NE 3.46Å; E408-R445 PolarHBondContact OE2-NE 3.46Å; E408-R445 IonicContact OE2-NH2 3.11Å; E408-R445 PolarHBondContact OE2-NH2 2.82Å
409	D	81.1	Confident	89.6	Confident	157 Å²	157	42.9 Å²	42.9	84%	0.84	24%	0.235	S	C	*	.	G	3₁₀ helix	trans	-78	-6.6	179.2	-56.3	-48.4	0	0	0	113.5	S407 L411	S407-D409 VanDerWaalsContact C-N 3.27Å; S407-D409 PolarHBondContact O-N 3.18Å; D409-L411 PolarHBondContact O-N 3.15Å
410	A	85.3	Confident	89.5	Confident	14 Å²	14	44.5 Å²	44.5	12%	0.116	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-77.8	-5	-178.8	0	0	0	0	0	114.3	K378 I403 S407 E408	K378-A410 VanDerWaalsContact CD-O 3.29Å; K378-A410 WeakPolarHBondContact CD-O 3.28Å; I403-A410 HydrophobicContact CG2-CB 3.8Å; S407-A410 WeakPolarHBondContact O-CB 3.35Å; S407-A410 PolarHBondContact O-N 3.32Å; E408-A410 VanDerWaalsContact C-N 3.27Å; E408-A410 PolarHBondContact O-N 2.77Å
411	L	91.3	Very high	89.2	Confident	10 Å²	10	48.1 Å²	48.1	5%	0.052	26%	0.258	C	S	.	.	S	Bend	trans	-130.5	131.5	178.9	-59.1	173.2	0	0	0	109.4	K378 V382 V400 I403 L404 D409 D415 F437	K378-L411 HydrophobicContact CD-CD2 4.33Å; K378-L411 HydrophobicContact CG-CD2 4.11Å; V382-L411 HydrophobicContact CG2-CD2 4.41Å; V400-L411 HydrophobicContact CG1-CD1 3.52Å; V400-L411 HydrophobicContact CG1-CD2 4Å; V400-L411 HydrophobicContact CG1-CG 4.44Å; I403-L411 HydrophobicContact CG2-CD2 4.43Å; I403-L411 HydrophobicContact CG2-CG 4.41Å; L404-L411 HydrophobicContact CB-CD1 3.97Å; L404-L411 HydrophobicContact CD1-CD1 4.34Å; D409-L411 PolarHBondContact O-N 3.15Å; L411-D415 HydrophobicContact CB-CB 4.18Å; L411-D415 HydrophobicContact CD2-CB 4.29Å; L411-F437 HydrophobicContact CD1-CE2 4.01Å; L411-F437 HydrophobicContact CD1-CZ 4.21Å
412	S	91.9	Very high	89.3	Confident	48 Å²	48	48.8 Å²	48.8	34%	0.336	26%	0.261	S	S	.	.			trans	-72.5	171.2	170.3	75.5	0	0	0	0	111.3	E414 D415 C416	S412-E414 PolarHBondContact OG-N 3.3Å; S412-D415 PolarHBondContact N-OD2 3.26Å; S412-D415 PolarHBondContact O-N 2.88Å; S412-D415 VanDerWaalsContact OG-CG 3.3Å; S412-D415 PolarHBondContact OG-N 3.37Å; S412-D415 PolarHBondContact OG-OD2 3.42Å; S412-D415 VanDerWaalsContact OG-OD2 3.07Å; S412-C416 PolarHBondContact O-N 2.96Å; S412-C416 PolarHBondContact O-SG 3.3Å
413	N	90.1	Very high	89.4	Confident	73 Å²	73	47.3 Å²	47.3	39%	0.39	25%	0.253	S	S	.	.	H	α-helix	trans	-63.6	-43.5	171.6	-65.9	-5.6	0	0	0	110.7	D415 C416 E417	N413-D415 VanDerWaalsContact C-N 3.32Å; N413-D415 PolarHBondContact O-N 3.38Å; N413-C416 CarbonylContact O-C 3.55Å; N413-C416 WeakPolarHBondContact O-CA 3.49Å; N413-C416 WeakPolarHBondContact O-CB 3.38Å; N413-C416 PolarHBondContact O-N 2.82Å; N413-E417 WeakPolarHBondContact CB-OE1 3.32Å; N413-E417 WeakPolarHBondContact O-CG 3.29Å; N413-E417 PolarHBondContact O-N 2.77Å
414	E	91.6	Very high	89.5	Confident	134 Å²	134	47.9 Å²	47.9	63%	0.626	26%	0.255	S	S	*	.	H	α-helix	trans	-56.6	-40	173.9	-176.3	-174.9	-174.9	0	0	112.6	S412 C416 N418	S412-E414 PolarHBondContact OG-N 3.3Å; E414-C416 VanDerWaalsContact C-N 3.27Å; E414-C416 PolarHBondContact O-N 3.07Å; E414-N418 WeakPolarHBondContact O-CB 3.36Å; E414-N418 PolarHBondContact O-N 2.93Å; E414-N418 VanDerWaalsContact O-N 3.12Å; E414-N418 PolarHBondContact O-ND2 3.21Å
415	D	93.6	Very high	89.7	Confident	12 Å²	12	48.5 Å²	48.5	6%	0.064	26%	0.26	C	S	.	.	H	α-helix	trans	-62.8	-36.3	173.3	-64.7	-52.2	0	0	0	111.7	K378 V382 L411 S412 N413	K378-D415 WeakPolarHBondContact CD-OD2 3.46Å; K378-D415 IonicContact NZ-OD1 3.7Å; K378-D415 PolarHBondContact NZ-OD1 2.98Å; K378-D415 IonicContact NZ-OD2 3.56Å; K378-D415 PolarHBondContact NZ-OD2 2.98Å; V382-D415 HydrophobicContact CG1-CB 4.45Å; V382-D415 HydrophobicContact CG2-CB 4.18Å; L411-D415 HydrophobicContact CB-CB 4.18Å; L411-D415 HydrophobicContact CD2-CB 4.29Å; S412-D415 PolarHBondContact N-OD2 3.26Å; S412-D415 PolarHBondContact O-N 2.88Å; S412-D415 VanDerWaalsContact OG-CG 3.3Å; S412-D415 PolarHBondContact OG-N 3.37Å; S412-D415 PolarHBondContact OG-OD2 3.42Å; S412-D415 VanDerWaalsContact OG-OD2 3.07Å; N413-D415 VanDerWaalsContact C-N 3.32Å; N413-D415 PolarHBondContact O-N 3.38Å
416	C	92.9	Very high	89.9	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-75.3	-44.8	-180	-60.3	0	0	0	0	111.5	S412 N413 E414 N418 V419 Y420 F437 K441	S412-C416 PolarHBondContact O-N 2.96Å; S412-C416 PolarHBondContact O-SG 3.3Å; N413-C416 CarbonylContact O-C 3.55Å; N413-C416 WeakPolarHBondContact O-CA 3.49Å; N413-C416 WeakPolarHBondContact O-CB 3.38Å; N413-C416 PolarHBondContact O-N 2.82Å; E414-C416 VanDerWaalsContact C-N 3.27Å; E414-C416 PolarHBondContact O-N 3.07Å; C416-N418 VanDerWaalsContact C-N 3.33Å; C416-N418 PolarHBondContact O-N 2.97Å; C416-V419 CarbonylContact O-C 3.53Å; C416-V419 WeakPolarHBondContact O-CA 3.34Å; C416-V419 WeakPolarHBondContact O-CB 3.02Å; C416-V419 PolarHBondContact O-N 3.27Å; C416-Y420 HydrophobicContact CB-CE1 3.97Å; C416-Y420 HydrophobicContact CB-CE2 4.19Å; C416-Y420 VanDerWaalsContact O-CD1 3.23Å; C416-Y420 WeakPolarHBondContact O-CD1 3.38Å; C416-Y420 VanDerWaalsContact O-CG 3.24Å; C416-Y420 PolarHBondContact O-N 3.42Å; C416-F437 HydrophobicContact CB-CE1 4.05Å; C416-F437 HydrophobicContact CB-CZ 4.14Å; C416-K441 PolarHBondContact SG-NZ 2.88Å
417	E	90.3	Very high	90.6	Very high	86 Å²	86	46.6 Å²	46.6	40%	0.402	25%	0.245	S	C	.	.	H	α-helix	trans	-56.6	-44.4	176.7	-71.4	151.2	-152.3	0	0	111.3	N413 V419 Y420 H421	N413-E417 WeakPolarHBondContact CB-OE1 3.32Å; N413-E417 WeakPolarHBondContact O-CG 3.29Å; N413-E417 PolarHBondContact O-N 2.77Å; E417-V419 PolarHBondContact O-N 3.27Å; E417-V419 VanDerWaalsContact O-N 3.14Å; E417-Y420 HydrophobicContact CG-CD2 4.26Å; E417-Y420 HydrophobicContact CG-CE2 4.42Å; E417-Y420 WeakPolarHBondContact O-CB 3.2Å; E417-Y420 PolarHBondContact O-N 2.84Å; E417-Y420 VanDerWaalsContact O-N 3.1Å; E417-H421 PolarHBondContact O-N 2.84Å; E417-H421 VanDerWaalsContact O-N 3.12Å; E417-H421 PolarHBondContact O-ND1 3.01Å
418	N	90.6	Very high	91.2	Very high	56 Å²	56	46.4 Å²	46.4	30%	0.299	24%	0.237	S	C	.	.	H	α-helix	trans	-60.8	-21.1	173.9	-83.5	-75.4	0	0	0	114.3	E414 C416	E414-N418 WeakPolarHBondContact O-CB 3.36Å; E414-N418 PolarHBondContact O-N 2.93Å; E414-N418 VanDerWaalsContact O-N 3.12Å; E414-N418 PolarHBondContact O-ND2 3.21Å; C416-N418 VanDerWaalsContact C-N 3.33Å; C416-N418 PolarHBondContact O-N 2.97Å
419	V	95.6	Very high	92.5	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-93.1	-35.1	172	-177.8	0	0	0	0	111.5	T385 I397 V400 C416 E417 H421 L422 A434 F437	T385-V419 HydrophobicContact CG2-CG2 4.09Å; I397-V419 HydrophobicContact CG2-CG1 3.93Å; V400-V419 HydrophobicContact CG1-CG2 4.46Å; C416-V419 CarbonylContact O-C 3.53Å; C416-V419 WeakPolarHBondContact O-CA 3.34Å; C416-V419 WeakPolarHBondContact O-CB 3.02Å; C416-V419 PolarHBondContact O-N 3.27Å; E417-V419 PolarHBondContact O-N 3.27Å; E417-V419 VanDerWaalsContact O-N 3.14Å; V419-H421 VanDerWaalsContact C-N 3.35Å; V419-H421 PolarHBondContact O-N 3.08Å; V419-L422 VanDerWaalsContact O-CB 3.31Å; V419-L422 WeakPolarHBondContact O-CB 3.39Å; V419-L422 PolarHBondContact O-N 2.54Å; V419-L422 VanDerWaalsContact O-N 3.08Å; V419-A434 HydrophobicContact CG1-CB 4.35Å; V419-F437 HydrophobicContact CB-CD1 3.81Å; V419-F437 HydrophobicContact CB-CE1 3.84Å; V419-F437 HydrophobicContact CB-CG 4.46Å; V419-F437 HydrophobicContact CG1-CB 3.97Å; V419-F437 HydrophobicContact CG1-CD1 3.42Å; V419-F437 VanDerWaalsContact CG1-CD1 3.42Å; V419-F437 HydrophobicContact CG1-CD2 4.47Å; V419-F437 HydrophobicContact CG1-CE1 3.98Å; V419-F437 HydrophobicContact CG1-CG 3.7Å
420	Y	94.6	Very high	93.3	Very high	34 Å²	34	37.9 Å²	37.9	13%	0.133	20%	0.199	C	C	.	.	H	α-helix	trans	-56.3	-46.6	176.7	-64.5	-16	0	0	0	111.8	C416 E417 L422 V423 F437 L438 K441 F474	C416-Y420 HydrophobicContact CB-CE1 3.97Å; C416-Y420 HydrophobicContact CB-CE2 4.19Å; C416-Y420 VanDerWaalsContact O-CD1 3.23Å; C416-Y420 WeakPolarHBondContact O-CD1 3.38Å; C416-Y420 VanDerWaalsContact O-CG 3.24Å; C416-Y420 PolarHBondContact O-N 3.42Å; E417-Y420 HydrophobicContact CG-CD2 4.26Å; E417-Y420 HydrophobicContact CG-CE2 4.42Å; E417-Y420 WeakPolarHBondContact O-CB 3.2Å; E417-Y420 PolarHBondContact O-N 2.84Å; E417-Y420 VanDerWaalsContact O-N 3.1Å; Y420-L422 PolarHBondContact O-N 2.81Å; Y420-V423 WeakPolarHBondContact O-CG1 3.48Å; Y420-V423 VanDerWaalsContact O-CG2 3.23Å; Y420-V423 WeakPolarHBondContact O-CG2 3.35Å; Y420-V423 PolarHBondContact O-N 2.93Å; Y420-F437 HydrophobicContact CD1-CD1 4.12Å; Y420-F437 AromaticContact CD1-CE1 3.99Å; Y420-F437 HydrophobicContact CD1-CE1 3.99Å; Y420-F437 HydrophobicContact CE1-CD1 4.1Å; Y420-F437 AromaticContact CE1-CE1 3.7Å; Y420-F437 HydrophobicContact CE1-CE1 3.7Å; Y420-L438 HydrophobicContact CD1-CD1 3.63Å; Y420-L438 HydrophobicContact CE1-CD1 3.8Å; Y420-L438 HydrophobicContact CG-CD1 4.19Å; Y420-K441 HydrophobicContact CE1-CB 4.43Å; Y420-K441 HydrophobicContact CE1-CG 4.15Å; Y420-K441 WeakPolarHBondContact OH-CG 3.39Å; Y420-F474 HydrophobicContact CD1-CE2 4.48Å; Y420-F474 AromaticContact CD2-CE2 3.92Å; Y420-F474 HydrophobicContact CD2-CE2 3.92Å; Y420-F474 AromaticContact CG-CE2 3.83Å; Y420-F474 HydrophobicContact CG-CE2 3.83Å; Y420-F474 HydrophobicContact CG-CZ 4.41Å
421	H	92	Very high	93.9	Very high	77 Å²	77	37.2 Å²	37.2	36%	0.356	19%	0.193	S	C	.	.	G	3₁₀ helix	trans	-56.3	-23.1	178.3	-59	148.3	0	0	0	113.6	E417 V419 V423 Y424 L480	E417-H421 PolarHBondContact O-N 2.84Å; E417-H421 VanDerWaalsContact O-N 3.12Å; E417-H421 PolarHBondContact O-ND1 3.01Å; V419-H421 VanDerWaalsContact C-N 3.35Å; V419-H421 PolarHBondContact O-N 3.08Å; H421-V423 VanDerWaalsContact C-N 3.27Å; H421-V423 PolarHBondContact O-N 3.05Å; H421-Y424 PolarHBondContact O-N 3.01Å; H421-L480 HydrophobicContact CB-CD1 3.67Å; H421-L480 VanDerWaalsContact CD2-CD1 3.45Å; H421-L480 WeakPolarHBondContact CD2-CD1 3.4Å
422	L	96.6	Very high	94.2	Very high	15 Å²	15	37.9 Å²	37.9	8%	0.079	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-74.8	-13.2	-178.5	-52.8	178.9	0	0	0	113.4	L386 I397 V419 Y420 Y424 S425 V430 A431 A434	L386-L422 HydrophobicContact CD2-CD2 3.65Å; L386-L422 HydrophobicContact CG-CD2 4.34Å; I397-L422 HydrophobicContact CD1-CD1 3.77Å; I397-L422 HydrophobicContact CG1-CD1 4.13Å; V419-L422 VanDerWaalsContact O-CB 3.31Å; V419-L422 WeakPolarHBondContact O-CB 3.39Å; V419-L422 PolarHBondContact O-N 2.54Å; V419-L422 VanDerWaalsContact O-N 3.08Å; Y420-L422 PolarHBondContact O-N 2.81Å; L422-Y424 PolarHBondContact O-N 3.36Å; L422-Y424 VanDerWaalsContact O-N 3.17Å; L422-S425 VanDerWaalsContact O-CB 3.26Å; L422-S425 WeakPolarHBondContact O-CB 3.17Å; L422-S425 PolarHBondContact O-N 3.29Å; L422-V430 HydrophobicContact CB-CG1 4.15Å; L422-A431 VanDerWaalsContact O-CA 3.31Å; L422-A431 WeakPolarHBondContact O-CA 3.21Å; L422-A434 HydrophobicContact CB-CB 3.75Å
423	V	97.1	Very high	94.5	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.183	C	C	.	.	G	3₁₀ helix	trans	-63.5	-16.3	171.2	-54.5	0	0	0	0	112.7	Y420 H421 A434 L438 F474 L487 S490 R548	Y420-V423 WeakPolarHBondContact O-CG1 3.48Å; Y420-V423 VanDerWaalsContact O-CG2 3.23Å; Y420-V423 WeakPolarHBondContact O-CG2 3.35Å; Y420-V423 PolarHBondContact O-N 2.93Å; H421-V423 VanDerWaalsContact C-N 3.27Å; H421-V423 PolarHBondContact O-N 3.05Å; V423-A434 HydrophobicContact CG1-CB 3.78Å; V423-L438 HydrophobicContact CG1-CB 4.46Å; V423-L438 HydrophobicContact CG1-CD2 4.1Å; V423-F474 HydrophobicContact CG2-CE1 4.1Å; V423-F474 HydrophobicContact CG2-CZ 4.27Å; V423-L487 HydrophobicContact CB-CD1 4.38Å; V423-L487 HydrophobicContact CG2-CD1 3.8Å; V423-S490 PolarHBondContact O-OG 3.25Å; V423-R548 PolarHBondContact O-NH2 3.16Å
424	Y	95.2	Very high	94.9	Very high	17 Å²	17	32.3 Å²	32.3	7%	0.067	17%	0.165	C	C	.	.	G	3₁₀ helix	trans	-93.1	-8.3	175	-60.7	-70.9	0	0	0	113.5	H421 L422 A426 S478 L480 H481 L487	H421-Y424 PolarHBondContact O-N 3.01Å; L422-Y424 PolarHBondContact O-N 3.36Å; L422-Y424 VanDerWaalsContact O-N 3.17Å; Y424-A426 PolarHBondContact O-N 3Å; Y424-S478 WeakPolarHBondContact CE2-OG 3.46Å; Y424-S478 VanDerWaalsContact OH-CB 3.26Å; Y424-S478 WeakPolarHBondContact OH-CB 3.17Å; Y424-S478 PolarHBondContact OH-OG 2.9Å; Y424-L480 HydrophobicContact CD2-CB 4.12Å; Y424-L480 HydrophobicContact CD2-CD1 3.99Å; Y424-L480 HydrophobicContact CE2-CB 4.4Å; Y424-H481 HydrophobicContact CD1-CB 4Å; Y424-H481 AromaticContact CD1-CD2 3.32Å; Y424-H481 WeakPolarHBondContact CD1-CD2 3.45Å; Y424-H481 AromaticContact CD1-CG 3.78Å; Y424-H481 HydrophobicContact CE1-CB 4Å; Y424-H481 AromaticContact CG-CD2 3.56Å; Y424-L487 HydrophobicContact CE1-CB 3.96Å
425	S	94.4	Very high	95.2	Very high	20 Å²	20	26 Å²	26	14%	0.14	14%	0.135	C	C	.	.			trans	-55.1	138.6	-176.4	-172.6	0	0	0	0	113	L422 H427 R548	L422-S425 VanDerWaalsContact O-CB 3.26Å; L422-S425 WeakPolarHBondContact O-CB 3.17Å; L422-S425 PolarHBondContact O-N 3.29Å; S425-H427 PolarHBondContact O-N 3.45Å; S425-H427 PolarHBondContact OG-N 3.4Å; S425-R548 PolarHBondContact O-NE 3.2Å; S425-R548 PolarHBondContact O-NH2 3.27Å
426	A	90.6	Very high	95.3	Very high	25 Å²	25	28.5 Å²	28.5	21%	0.207	15%	0.146	C	C	.	.	S	Bend	trans	-59.5	-34.8	174.3	0	0	0	0	0	112.4	Y424 R428 E1234	Y424-A426 PolarHBondContact O-N 3Å; A426-R428 PolarHBondContact O-N 3.27Å; A426-E1234 HydrophobicContact CB-CG 4.03Å
427	H	94.6	Very high	95.4	Very high	53 Å²	53	28.5 Å²	28.5	25%	0.245	15%	0.146	C	C	.	.	S	Bend	trans	-78	89.1	-179	-174	-97.6	0	0	0	111.4	Y390 S425 P429 V430 A431	Y390-H427 WeakPolarHBondContact CB-CE1 3.19Å; Y390-H427 WeakPolarHBondContact CB-ND1 3.47Å; Y390-H427 HydrophobicContact CD1-CB 3.99Å; Y390-H427 AromaticContact CD1-CG 3.93Å; Y390-H427 HydrophobicContact CD2-CB 4.29Å; Y390-H427 AromaticContact CD2-CD2 3.56Å; Y390-H427 AromaticContact CD2-CG 3.75Å; Y390-H427 AromaticContact CD2-NE2 3.87Å; Y390-H427 HydrophobicContact CE1-CB 3.93Å; Y390-H427 HydrophobicContact CE2-CB 4.25Å; Y390-H427 HydrophobicContact CG-CB 4.18Å; Y390-H427 AromaticContact CG-CD2 3.88Å; Y390-H427 AromaticContact CG-CE1 3.87Å; Y390-H427 AromaticContact CG-CG 3.64Å; Y390-H427 AromaticContact CG-ND1 3.65Å; S425-H427 PolarHBondContact O-N 3.45Å; S425-H427 PolarHBondContact OG-N 3.4Å; H427-P429 VanDerWaalsContact C-CD 3.43Å; H427-P429 VanDerWaalsContact C-N 3.33Å; H427-P429 WeakPolarHBondContact O-CD 3.44Å; H427-V430 WeakPolarHBondContact O-CB 3.19Å; H427-V430 PolarHBondContact O-N 3.42Å; H427-A431 PolarHBondContact O-N 2.8Å
428	R	95.6	Very high	95.6	Very high	47 Å²	47	24.4 Å²	24.4	18%	0.177	13%	0.127	C	C	.	.	H	α-helix	trans	-41.2	-43.8	-173.7	-171.4	179.2	-167.9	-85.2	-8.4	116	A426 V430 A431 V432 D489 E493 R548	A426-R428 PolarHBondContact O-N 3.27Å; R428-V430 VanDerWaalsContact C-N 3.27Å; R428-V430 PolarHBondContact O-N 2.88Å; R428-A431 PolarHBondContact O-N 3.09Å; R428-A431 VanDerWaalsContact O-N 3.11Å; R428-V432 HydrophobicContact CG-CG2 3.92Å; R428-V432 WeakPolarHBondContact O-CG2 3.22Å; R428-V432 PolarHBondContact O-N 2.74Å; R428-D489 WeakPolarHBondContact CD-OD2 3.35Å; R428-D489 WeakPolarHBondContact CG-OD2 3.26Å; R428-D489 IonicContact CZ-OD1 2.68Å; R428-D489 VanDerWaalsContact CZ-OD1 3.24Å; R428-D489 IonicContact CZ-OD2 3.24Å; R428-D489 VanDerWaalsContact NE-CG 3.29Å; R428-D489 IonicContact NE-OD1 2.65Å; R428-D489 PolarHBondContact NE-OD1 3.22Å; R428-D489 IonicContact NE-OD2 3.46Å; R428-D489 PolarHBondContact NE-OD2 3.38Å; R428-D489 PolarHBondContact NH2-O 2.87Å; R428-D489 IonicContact NH2-OD1 2.82Å; R428-D489 PolarHBondContact NH2-OD1 3.47Å; R428-E493 IonicContact CZ-OE1 3.53Å; R428-E493 IonicContact NH1-OE1 2.68Å; R428-E493 PolarHBondContact NH1-OE1 3.21Å; R428-E493 IonicContact NH2-OE1 3.27Å; R428-E493 PolarHBondContact NH2-OE1 2.64Å; R428-R548 HydrophobicContact CB-CB 4.07Å; R428-R548 HydrophobicContact CB-CG 4.08Å; R428-R548 WeakPolarHBondContact CD-O 3.43Å; R428-R548 HydrophobicContact CG-CB 4.36Å
429	P	97.6	Very high	95.7	Very high	72 Å²	72	24 Å²	24	47%	0.468	12%	0.124	S	C	.	.	H	α-helix	trans	-59.5	-31.1	177	-26.4	35.3	0	0	0	115.2	V394 H427 A433	V394-P429 HydrophobicContact CG2-CB 3.89Å; V394-P429 WeakPolarHBondContact CG2-O 3.47Å; H427-P429 VanDerWaalsContact C-CD 3.43Å; H427-P429 VanDerWaalsContact C-N 3.33Å; H427-P429 WeakPolarHBondContact O-CD 3.44Å; P429-A433 WeakPolarHBondContact O-CB 3.25Å; P429-A433 PolarHBondContact O-N 3.26Å
430	V	98.2	Very high	95.5	Very high	3 Å²	3	26.9 Å²	26.9	2%	0.018	14%	0.135	C	C	.	.	H	α-helix	trans	-72.4	-45.7	172.9	162.3	0	0	0	0	109.7	Y390 A393 V394 I397 L422 H427 R428 V432 A433 A434	Y390-V430 HydrophobicContact CD1-CG2 4.14Å; A393-V430 HydrophobicContact CB-CG2 3.91Å; V394-V430 HydrophobicContact CG2-CB 4.5Å; V394-V430 HydrophobicContact CG2-CG2 3.71Å; I397-V430 HydrophobicContact CD1-CG1 3.84Å; L422-V430 HydrophobicContact CB-CG1 4.15Å; H427-V430 WeakPolarHBondContact O-CB 3.19Å; H427-V430 PolarHBondContact O-N 3.42Å; R428-V430 VanDerWaalsContact C-N 3.27Å; R428-V430 PolarHBondContact O-N 2.88Å; V430-V432 PolarHBondContact O-N 3.11Å; V430-A433 PolarHBondContact O-N 3.13Å; V430-A434 PolarHBondContact O-N 3.41Å
431	A	97.8	Very high	95.1	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-64.7	-41.2	-177.5	0	0	0	0	0	113.1	L422 H427 R428 A434 G435 S490 R548	L422-A431 VanDerWaalsContact O-CA 3.31Å; L422-A431 WeakPolarHBondContact O-CA 3.21Å; H427-A431 PolarHBondContact O-N 2.8Å; R428-A431 PolarHBondContact O-N 3.09Å; R428-A431 VanDerWaalsContact O-N 3.11Å; A431-A434 CarbonylContact O-C 3.58Å; A431-A434 PolarHBondContact O-N 3.4Å; A431-G435 PolarHBondContact O-N 3.17Å; A431-S490 VanDerWaalsContact CB-OG 3.28Å; A431-S490 WeakPolarHBondContact CB-OG 3.49Å; A431-S490 WeakPolarHBondContact O-CB 3.4Å; A431-S490 PolarHBondContact O-OG 2.85Å; A431-R548 VanDerWaalsContact CB-NH2 3.32Å
432	V	98	Very high	94.7	Very high	23 Å²	23	24 Å²	24	14%	0.139	12%	0.123	C	C	.	.	H	α-helix	trans	-68.6	-35.5	174	175	0	0	0	0	112	R428 V430 A434 G435 E436 E493	R428-V432 HydrophobicContact CG-CG2 3.92Å; R428-V432 WeakPolarHBondContact O-CG2 3.22Å; R428-V432 PolarHBondContact O-N 2.74Å; V430-V432 PolarHBondContact O-N 3.11Å; V432-A434 VanDerWaalsContact C-N 3.33Å; V432-G435 PolarHBondContact O-N 2.93Å; V432-E436 PolarHBondContact O-N 2.91Å; V432-E493 HydrophobicContact CG1-CB 4.23Å
433	A	98.3	Very high	93.9	Very high	5 Å²	5	23.9 Å²	23.9	4%	0.041	12%	0.122	C	C	.	.	H	α-helix	trans	-65.6	-37.3	173.1	0	0	0	0	0	111.9	V394 I397 P429 V430 E436 F437	V394-A433 HydrophobicContact CG1-CB 4.33Å; I397-A433 HydrophobicContact CB-CB 4.16Å; I397-A433 HydrophobicContact CD1-CB 4.35Å; I397-A433 HydrophobicContact CG2-CB 3.97Å; I397-A433 VanDerWaalsContact CG2-O 3.31Å; I397-A433 WeakPolarHBondContact CG2-O 3.29Å; P429-A433 WeakPolarHBondContact O-CB 3.25Å; P429-A433 PolarHBondContact O-N 3.26Å; V430-A433 PolarHBondContact O-N 3.13Å; A433-E436 PolarHBondContact O-N 3.31Å; A433-F437 PolarHBondContact O-N 2.89Å; A433-F437 VanDerWaalsContact O-N 3.16Å
434	A	98.1	Very high	92.6	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-69.5	-35.2	172.1	0	0	0	0	0	112.1	V419 L422 V423 V430 A431 V432 F437 L438	V419-A434 HydrophobicContact CG1-CB 4.35Å; L422-A434 HydrophobicContact CB-CB 3.75Å; V423-A434 HydrophobicContact CG1-CB 3.78Å; V430-A434 PolarHBondContact O-N 3.41Å; A431-A434 CarbonylContact O-C 3.58Å; A431-A434 PolarHBondContact O-N 3.4Å; V432-A434 VanDerWaalsContact C-N 3.33Å; A434-F437 WeakPolarHBondContact O-CB 3.28Å; A434-F437 PolarHBondContact O-N 2.96Å; A434-L438 WeakPolarHBondContact O-CB 3.49Å; A434-L438 PolarHBondContact O-N 3.03Å
435	G	96.9	Very high	91.2	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-62.3	-39.3	171.9	0	0	0	0	0	112.8	A431 V432 L438 H439 L491	A431-G435 PolarHBondContact O-N 3.17Å; V432-G435 PolarHBondContact O-N 2.93Å; G435-L438 PolarHBondContact O-N 3.46Å; G435-H439 VanDerWaalsContact O-CB 3.28Å; G435-H439 WeakPolarHBondContact O-CB 3.14Å; G435-H439 PolarHBondContact O-N 2.86Å; G435-L491 WeakPolarHBondContact O-CD2 3.43Å
436	E	96.3	Very high	90	Very high	65 Å²	65	34 Å²	34	30%	0.304	17%	0.171	S	C	.	.	H	α-helix	trans	-64.7	-39.6	171.6	-172.6	-179.7	-159.7	0	0	112.1	T401 V432 A433 R440	T401-E436 HydrophobicContact CG2-CG 4.48Å; V432-E436 PolarHBondContact O-N 2.91Å; A433-E436 PolarHBondContact O-N 3.31Å; E436-R440 WeakPolarHBondContact O-CG 3.49Å; E436-R440 PolarHBondContact O-N 3.45Å; E436-R440 VanDerWaalsContact O-N 3.15Å; E436-R440 IonicContact OE1-CZ 3.95Å; E436-R440 IonicContact OE1-NE 2.75Å; E436-R440 PolarHBondContact OE1-NE 3.09Å; E436-R440 IonicContact OE1-NH2 2.7Å; E436-R440 PolarHBondContact OE1-NH2 3.34Å
437	F	95.9	Very high	89.2	Confident	0 Å²	0	37 Å²	37	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-61.8	-49.8	173.4	179.4	-99.7	0	0	0	111.7	I397 V400 L404 L411 C416 V419 Y420 A433 A434 R440 K441	I397-F437 HydrophobicContact CG2-CB 4.34Å; V400-F437 HydrophobicContact CG1-CD2 4.26Å; V400-F437 HydrophobicContact CG1-CE2 3.7Å; V400-F437 HydrophobicContact CG1-CZ 4.26Å; L404-F437 HydrophobicContact CB-CE2 4.24Å; L404-F437 HydrophobicContact CD2-CD2 4.12Å; L404-F437 HydrophobicContact CD2-CE2 3.69Å; L404-F437 HydrophobicContact CD2-CZ 4.26Å; L404-F437 HydrophobicContact CG-CE2 4.48Å; L411-F437 HydrophobicContact CD1-CE2 4.01Å; L411-F437 HydrophobicContact CD1-CZ 4.21Å; C416-F437 HydrophobicContact CB-CE1 4.05Å; C416-F437 HydrophobicContact CB-CZ 4.14Å; V419-F437 HydrophobicContact CB-CD1 3.81Å; V419-F437 HydrophobicContact CB-CE1 3.84Å; V419-F437 HydrophobicContact CB-CG 4.46Å; V419-F437 HydrophobicContact CG1-CB 3.97Å; V419-F437 HydrophobicContact CG1-CD1 3.42Å; V419-F437 VanDerWaalsContact CG1-CD1 3.42Å; V419-F437 HydrophobicContact CG1-CD2 4.47Å; V419-F437 HydrophobicContact CG1-CE1 3.98Å; V419-F437 HydrophobicContact CG1-CG 3.7Å; Y420-F437 HydrophobicContact CD1-CD1 4.12Å; Y420-F437 AromaticContact CD1-CE1 3.99Å; Y420-F437 HydrophobicContact CD1-CE1 3.99Å; Y420-F437 HydrophobicContact CE1-CD1 4.1Å; Y420-F437 AromaticContact CE1-CE1 3.7Å; Y420-F437 HydrophobicContact CE1-CE1 3.7Å; A433-F437 PolarHBondContact O-N 2.89Å; A433-F437 VanDerWaalsContact O-N 3.16Å; A434-F437 WeakPolarHBondContact O-CB 3.28Å; A434-F437 PolarHBondContact O-N 2.96Å; F437-R440 PolarHBondContact O-N 2.86Å; F437-K441 WeakPolarHBondContact O-CB 3.11Å; F437-K441 PolarHBondContact O-N 3.01Å
438	L	94.3	Very high	88.4	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-59.6	-48.1	179.5	-175.3	66.4	0	0	0	111.5	Y420 V423 A434 G435 R440 K441 L442 F474 L487 L491	Y420-L438 HydrophobicContact CD1-CD1 3.63Å; Y420-L438 HydrophobicContact CE1-CD1 3.8Å; Y420-L438 HydrophobicContact CG-CD1 4.19Å; V423-L438 HydrophobicContact CG1-CB 4.46Å; V423-L438 HydrophobicContact CG1-CD2 4.1Å; A434-L438 WeakPolarHBondContact O-CB 3.49Å; A434-L438 PolarHBondContact O-N 3.03Å; G435-L438 PolarHBondContact O-N 3.46Å; L438-R440 VanDerWaalsContact C-N 3.31Å; L438-R440 PolarHBondContact O-N 2.95Å; L438-K441 PolarHBondContact O-N 3.35Å; L438-L442 HydrophobicContact CD1-CD1 3.55Å; L438-L442 HydrophobicContact CD1-CG 3.92Å; L438-L442 HydrophobicContact CG-CD1 4.09Å; L438-L442 PolarHBondContact O-N 2.94Å; L438-F474 HydrophobicContact CD1-CD2 3.77Å; L438-F474 HydrophobicContact CD1-CE1 4.39Å; L438-F474 HydrophobicContact CD1-CE2 3.46Å; L438-F474 VanDerWaalsContact CD1-CE2 3.46Å; L438-F474 HydrophobicContact CD1-CG 4.35Å; L438-F474 HydrophobicContact CD1-CZ 3.81Å; L438-F474 HydrophobicContact CD2-CD1 3.89Å; L438-F474 HydrophobicContact CD2-CD2 4.47Å; L438-F474 HydrophobicContact CD2-CE1 3.53Å; L438-F474 HydrophobicContact CD2-CE2 4.13Å; L438-F474 HydrophobicContact CD2-CG 4.35Å; L438-F474 HydrophobicContact CD2-CZ 3.66Å; L438-F474 HydrophobicContact CG-CE2 4.47Å; L438-F474 HydrophobicContact CG-CZ 4.42Å; L438-L487 HydrophobicContact CD2-CD1 4.11Å; L438-L491 HydrophobicContact CD2-CD1 4.41Å; L438-L491 HydrophobicContact CD2-CD2 4.34Å
439	H	92.5	Very high	87.7	Confident	49 Å²	49	44.1 Å²	44.1	23%	0.227	23%	0.227	C	C	.	.	H	α-helix	trans	-53.9	-47.1	175.3	173.8	109.8	0	0	0	111.7	G435 F443 S444 L491 S494 S495	G435-H439 VanDerWaalsContact O-CB 3.28Å; G435-H439 WeakPolarHBondContact O-CB 3.14Å; G435-H439 PolarHBondContact O-N 2.86Å; H439-F443 HydrophobicContact CB-CD2 4.12Å; H439-F443 AromaticContact ND1-CD2 3.81Å; H439-F443 WeakPolarHBondContact O-CB 3.22Å; H439-F443 PolarHBondContact O-N 2.93Å; H439-S444 PolarHBondContact O-N 3.46Å; H439-L491 HydrophobicContact CB-CD2 4.41Å; H439-S494 PolarHBondContact CE1-O 3.16Å; H439-S494 PolarHBondContact ND1-O 3.24Å; H439-S495 PolarHBondContact ND1-OG 2.82Å
440	R	90.1	Very high	87	Confident	60 Å²	60	42.6 Å²	42.6	23%	0.226	22%	0.221	C	C	.	.	H	α-helix	trans	-72.2	-28.8	-178.8	-69.5	-179.2	-169.8	-166.2	-0.2	113.4	T401 E436 F437 L438	T401-R440 VanDerWaalsContact CG2-CD 3.47Å; E436-R440 WeakPolarHBondContact O-CG 3.49Å; E436-R440 PolarHBondContact O-N 3.45Å; E436-R440 VanDerWaalsContact O-N 3.15Å; E436-R440 IonicContact OE1-CZ 3.95Å; E436-R440 IonicContact OE1-NE 2.75Å; E436-R440 PolarHBondContact OE1-NE 3.09Å; E436-R440 IonicContact OE1-NH2 2.7Å; E436-R440 PolarHBondContact OE1-NH2 3.34Å; F437-R440 PolarHBondContact O-N 2.86Å; L438-R440 VanDerWaalsContact C-N 3.31Å; L438-R440 PolarHBondContact O-N 2.95Å
441	K	87.9	Confident	86.2	Confident	11 Å²	11	43.5 Å²	43.5	5%	0.048	23%	0.225	C	C	.	.	H	α-helix	trans	-82.6	-36.3	-179.6	-173	65.7	174.9	-161.2	0	113	L404 C416 Y420 F437 L438 R445	L404-K441 HydrophobicContact CD1-CD 3.67Å; L404-K441 HydrophobicContact CD2-CB 3.92Å; L404-K441 HydrophobicContact CD2-CD 3.85Å; L404-K441 HydrophobicContact CD2-CG 4.41Å; L404-K441 HydrophobicContact CG-CD 4.42Å; C416-K441 PolarHBondContact SG-NZ 2.88Å; Y420-K441 HydrophobicContact CE1-CB 4.43Å; Y420-K441 HydrophobicContact CE1-CG 4.15Å; Y420-K441 WeakPolarHBondContact OH-CG 3.39Å; F437-K441 WeakPolarHBondContact O-CB 3.11Å; F437-K441 PolarHBondContact O-N 3.01Å; L438-K441 PolarHBondContact O-N 3.35Å; K441-R445 WeakPolarHBondContact O-CD 3.42Å
442	L	82.8	Confident	85.5	Confident	38 Å²	38	48.1 Å²	48.1	20%	0.199	25%	0.247	C	C	.	.	H	α-helix	trans	-93.8	-60.5	179.3	-60.9	-173.9	0	0	0	112.5	L438 F474	L438-L442 HydrophobicContact CD1-CD1 3.55Å; L438-L442 HydrophobicContact CD1-CG 3.92Å; L438-L442 HydrophobicContact CG-CD1 4.09Å; L438-L442 PolarHBondContact O-N 2.94Å; L442-F474 HydrophobicContact CD1-CB 4.26Å; L442-F474 HydrophobicContact CD1-CD2 4.15Å; L442-F474 HydrophobicContact CD1-CG 4.3Å
443	F	80.2	Confident	84.9	Confident	13 Å²	13	49 Å²	49	6%	0.057	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-82.6	-37.5	-165.6	-48.9	-44.5	0	0	0	113.4	H439 R445 H446 L467 M470 L471 L491 L498	H439-F443 HydrophobicContact CB-CD2 4.12Å; H439-F443 AromaticContact ND1-CD2 3.81Å; H439-F443 WeakPolarHBondContact O-CB 3.22Å; H439-F443 PolarHBondContact O-N 2.93Å; F443-R445 PolarHBondContact O-N 3.08Å; F443-H446 PolarHBondContact O-N 3.31Å; F443-L467 HydrophobicContact CB-CD2 4.37Å; F443-L467 HydrophobicContact CD1-CB 4.18Å; F443-L467 HydrophobicContact CD1-CD2 4.14Å; F443-M470 HydrophobicContact CD1-CE 4Å; F443-M470 HydrophobicContact CE1-CE 4.45Å; F443-L471 HydrophobicContact CZ-CB 4.25Å; F443-L471 HydrophobicContact CZ-CD1 4.38Å; F443-L491 HydrophobicContact CE2-CD2 4.47Å; F443-L498 HydrophobicContact CD1-CD2 4.26Å; F443-L498 HydrophobicContact CD2-CD2 4.07Å; F443-L498 HydrophobicContact CE1-CD2 3.99Å; F443-L498 HydrophobicContact CE2-CD2 3.8Å; F443-L498 HydrophobicContact CG-CD2 4.31Å; F443-L498 HydrophobicContact CZ-CD2 3.77Å
444	S	70.4	Confident	84	Confident	75 Å²	75	51.6 Å²	51.6	52%	0.524	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-69	1.3	-177.7	-54	0	0	0	0	115.6	H439	H439-S444 PolarHBondContact O-N 3.46Å
445	R	65.3	Low	83.4	Confident	118 Å²	118	52.1 Å²	52.1	45%	0.445	27%	0.273	S	S	.	.	G	3₁₀ helix	trans	-86.7	-11.9	174	-78.3	177.5	161.7	-176.8	-8	113.9	E408 K441 F443	E408-R445 IonicContact OE2-CZ 3.86Å; E408-R445 VanDerWaalsContact OE2-CZ 3.24Å; E408-R445 IonicContact OE2-NE 3.46Å; E408-R445 PolarHBondContact OE2-NE 3.46Å; E408-R445 IonicContact OE2-NH2 3.11Å; E408-R445 PolarHBondContact OE2-NH2 2.82Å; K441-R445 WeakPolarHBondContact O-CD 3.42Å; F443-R445 PolarHBondContact O-N 3.08Å
446	H	68.2	Low	82.8	Confident	56 Å²	56	58.8 Å²	58.8	26%	0.259	30%	0.303	S	S	.	.	S	Bend	trans	-85.3	135	-180	-70.8	-100.1	0	0	0	111.4	F443 P448 E451 L467 M470	F443-H446 PolarHBondContact O-N 3.31Å; H446-P448 WeakPolarHBondContact O-CD 3.46Å; H446-E451 HydrophobicContact CB-CG 4.01Å; H446-E451 IonicContact CE1-OE1 2.78Å; H446-E451 IonicContact CG-OE1 3.94Å; H446-E451 IonicContact ND1-OE1 3.33Å; H446-E451 PolarHBondContact ND1-OE1 3.46Å; H446-L467 HydrophobicContact CB-CD2 4.2Å; H446-M470 WeakPolarHBondContact NE2-CE 3.43Å
447	D	73.6	Confident	82.1	Confident	89 Å²	89	65.7 Å²	65.7	48%	0.476	33%	0.326	S	S	.	.			trans	-77.3	115.2	168.6	173.5	2.1	0	0	0	108.6	Q449 A450 E451	D447-Q449 PolarHBondContact O-N 2.7Å; D447-Q449 VanDerWaalsContact O-N 3.16Å; D447-Q449 WeakPolarHBondContact OD1-CB 3.21Å; D447-Q449 PolarHBondContact OD1-N 3.48Å; D447-A450 HydrophobicContact CB-CB 3.84Å; D447-A450 WeakPolarHBondContact O-CB 3.35Å; D447-A450 PolarHBondContact O-N 3.08Å; D447-E451 PolarHBondContact O-N 2.67Å
448	P	77.9	Confident	81.3	Confident	99 Å²	99	68.6 Å²	68.6	64%	0.643	34%	0.337	S	S	*	.	H	α-helix	trans	-59.4	-29.7	-178.3	-24	35.2	0	0	0	113.1	H446 E452	H446-P448 WeakPolarHBondContact O-CD 3.46Å; P448-E452 VanDerWaalsContact O-CB 3.27Å; P448-E452 WeakPolarHBondContact O-CB 3.24Å; P448-E452 PolarHBondContact O-N 2.99Å
449	Q	81.6	Confident	80.6	Confident	150 Å²	150	71.6 Å²	71.6	70%	0.701	37%	0.368	S	S	*	.	H	α-helix	trans	-73.4	-31.2	177.4	-57.1	-173.2	9.4	0	0	111.6	D447 A453	D447-Q449 PolarHBondContact O-N 2.7Å; D447-Q449 VanDerWaalsContact O-N 3.16Å; D447-Q449 WeakPolarHBondContact OD1-CB 3.21Å; D447-Q449 PolarHBondContact OD1-N 3.48Å; Q449-A453 WeakPolarHBondContact O-CB 3.22Å; Q449-A453 PolarHBondContact O-N 2.93Å; Q449-A453 VanDerWaalsContact O-N 3.08Å
450	A	81.8	Confident	80.1	Confident	40 Å²	40	70.3 Å²	70.3	33%	0.331	36%	0.361	S	S	.	.	H	α-helix	trans	-71.7	-45.3	174.4	0	0	0	0	0	111.2	D447 A453 L454	D447-A450 HydrophobicContact CB-CB 3.84Å; D447-A450 WeakPolarHBondContact O-CB 3.35Å; D447-A450 PolarHBondContact O-N 3.08Å; A450-A453 PolarHBondContact O-N 3.03Å; A450-L454 WeakPolarHBondContact O-CB 3.49Å; A450-L454 VanDerWaalsContact O-CG 3.25Å; A450-L454 WeakPolarHBondContact O-CG 3.24Å; A450-L454 PolarHBondContact O-N 3.14Å
451	E	82.2	Confident	79.6	Confident	23 Å²	23	70.5 Å²	70.5	11%	0.107	37%	0.372	C	S	.	.	H	α-helix	trans	-65.5	-43.1	177.1	-62.2	-54.9	149.6	0	0	112	H446 D447 A453 L454 A455 P463 N466	H446-E451 HydrophobicContact CB-CG 4.01Å; H446-E451 IonicContact CE1-OE1 2.78Å; H446-E451 IonicContact CG-OE1 3.94Å; H446-E451 IonicContact ND1-OE1 3.33Å; H446-E451 PolarHBondContact ND1-OE1 3.46Å; D447-E451 PolarHBondContact O-N 2.67Å; E451-A453 VanDerWaalsContact C-N 3.31Å; E451-A453 PolarHBondContact O-N 3.34Å; E451-L454 PolarHBondContact O-N 2.86Å; E451-L454 VanDerWaalsContact O-N 3.12Å; E451-A455 WeakPolarHBondContact O-CB 3.45Å; E451-A455 PolarHBondContact O-N 2.83Å; E451-P463 HydrophobicContact CB-CB 4Å; E451-N466 PolarHBondContact OE2-ND2 3.36Å
452	E	84.1	Confident	79.6	Confident	96 Å²	96	70.6 Å²	70.6	45%	0.449	37%	0.374	S	S	.	.	H	α-helix	trans	-62.4	-38	174.7	-166.8	-168.8	-172.3	0	0	111.8	P448 K456	P448-E452 VanDerWaalsContact O-CB 3.27Å; P448-E452 WeakPolarHBondContact O-CB 3.24Å; P448-E452 PolarHBondContact O-N 2.99Å; E452-K456 HydrophobicContact CG-CD 4.3Å; E452-K456 WeakPolarHBondContact O-CB 3.43Å; E452-K456 VanDerWaalsContact O-CG 3.28Å; E452-K456 WeakPolarHBondContact O-CG 3.33Å; E452-K456 PolarHBondContact O-N 3.24Å; E452-K456 VanDerWaalsContact O-N 3.11Å; E452-K456 WeakPolarHBondContact OE1-CE 3.5Å; E452-K456 IonicContact OE1-NZ 2.58Å; E452-K456 PolarHBondContact OE1-NZ 2.95Å; E452-K456 IonicContact OE2-NZ 2.78Å
453	A	83.8	Confident	79.8	Confident	42 Å²	42	71.2 Å²	71.2	35%	0.347	38%	0.38	S	S	.	.	H	α-helix	trans	-70.8	-30.4	173.9	0	0	0	0	0	113.1	Q449 A450 E451 R457	Q449-A453 WeakPolarHBondContact O-CB 3.22Å; Q449-A453 PolarHBondContact O-N 2.93Å; Q449-A453 VanDerWaalsContact O-N 3.08Å; A450-A453 PolarHBondContact O-N 3.03Å; E451-A453 VanDerWaalsContact C-N 3.31Å; E451-A453 PolarHBondContact O-N 3.34Å; A453-R457 WeakPolarHBondContact O-CB 3.45Å; A453-R457 WeakPolarHBondContact O-CD 3.41Å; A453-R457 WeakPolarHBondContact O-CG 3.38Å; A453-R457 PolarHBondContact O-N 3.39Å; A453-R457 VanDerWaalsContact O-N 3.15Å
454	L	81.2	Confident	80.2	Confident	59 Å²	59	72.1 Å²	72.1	31%	0.309	39%	0.385	S	S	.	.	H	α-helix	trans	-72.9	-46.4	175.1	-76.7	166.6	0	0	0	111.4	A450 E451 K456 R457 R458	A450-L454 WeakPolarHBondContact O-CB 3.49Å; A450-L454 VanDerWaalsContact O-CG 3.25Å; A450-L454 WeakPolarHBondContact O-CG 3.24Å; A450-L454 PolarHBondContact O-N 3.14Å; E451-L454 PolarHBondContact O-N 2.86Å; E451-L454 VanDerWaalsContact O-N 3.12Å; L454-K456 PolarHBondContact O-N 3.24Å; L454-R457 PolarHBondContact O-N 3.12Å; L454-R457 VanDerWaalsContact O-N 3.16Å; L454-R458 WeakPolarHBondContact O-CG 3.25Å; L454-R458 PolarHBondContact O-N 2.67Å
455	A	83.4	Confident	81.1	Confident	11 Å²	11	69 Å²	69	9%	0.091	37%	0.365	C	S	.	.	H	α-helix	trans	-56.5	-50.5	174.4	0	0	0	0	0	111.3	E451 R457 R458 G459 R460 S462	E451-A455 WeakPolarHBondContact O-CB 3.45Å; E451-A455 PolarHBondContact O-N 2.83Å; A455-R457 VanDerWaalsContact C-N 3.28Å; A455-R457 PolarHBondContact O-N 2.85Å; A455-R458 CarbonylContact O-C 3.52Å; A455-R458 PolarHBondContact O-N 2.96Å; A455-G459 PolarHBondContact O-N 3.17Å; A455-R460 HydrophobicContact CB-CB 4.36Å; A455-R460 PolarHBondContact O-N 2.84Å; A455-R460 VanDerWaalsContact O-N 3.14Å; A455-S462 VanDerWaalsContact CB-O 3.3Å; A455-S462 WeakPolarHBondContact CB-O 3.39Å
456	K	84.6	Confident	82.1	Confident	141 Å²	141	65.1 Å²	65.1	61%	0.613	35%	0.353	S	S	*	.	H	α-helix	trans	-62.9	-28.5	176.8	-71.1	172.1	-174	171.4	0	114.1	E452 L454	E452-K456 HydrophobicContact CG-CD 4.3Å; E452-K456 WeakPolarHBondContact O-CB 3.43Å; E452-K456 VanDerWaalsContact O-CG 3.28Å; E452-K456 WeakPolarHBondContact O-CG 3.33Å; E452-K456 PolarHBondContact O-N 3.24Å; E452-K456 VanDerWaalsContact O-N 3.11Å; E452-K456 WeakPolarHBondContact OE1-CE 3.5Å; E452-K456 IonicContact OE1-NZ 2.58Å; E452-K456 PolarHBondContact OE1-NZ 2.95Å; E452-K456 IonicContact OE2-NZ 2.78Å; L454-K456 PolarHBondContact O-N 3.24Å
457	R	81.6	Confident	83.2	Confident	209 Å²	209	63.6 Å²	63.6	79%	0.789	35%	0.347	S	S	*	.	H	α-helix	trans	-75.4	-32.5	172.1	-78.6	171.5	-174.3	-164.9	5.9	112.9	A453 L454 A455	A453-R457 WeakPolarHBondContact O-CB 3.45Å; A453-R457 WeakPolarHBondContact O-CD 3.41Å; A453-R457 WeakPolarHBondContact O-CG 3.38Å; A453-R457 PolarHBondContact O-N 3.39Å; A453-R457 VanDerWaalsContact O-N 3.15Å; L454-R457 PolarHBondContact O-N 3.12Å; L454-R457 VanDerWaalsContact O-N 3.16Å; A455-R457 VanDerWaalsContact C-N 3.28Å; A455-R457 PolarHBondContact O-N 2.85Å
458	R	79.9	Confident	84.1	Confident	61 Å²	61	59.6 Å²	59.6	23%	0.23	33%	0.325	C	S	.	.	H	α-helix	trans	-82.8	-19.5	176.5	-70.4	174.1	172.2	172.2	2.9	112.5	L454 A455 R460 N466 V514 G516 E517	L454-R458 WeakPolarHBondContact O-CG 3.25Å; L454-R458 PolarHBondContact O-N 2.67Å; A455-R458 CarbonylContact O-C 3.52Å; A455-R458 PolarHBondContact O-N 2.96Å; R458-R460 HydrophobicContact CB-CG 4.1Å; R458-N466 PolarHBondContact NH1-OD1 3.11Å; R458-V514 HydrophobicContact CB-CB 4.3Å; R458-V514 HydrophobicContact CB-CG1 4.29Å; R458-V514 HydrophobicContact CB-CG2 4.29Å; R458-V514 HydrophobicContact CG-CB 4.38Å; R458-V514 HydrophobicContact CG-CG1 4.41Å; R458-V514 WeakPolarHBondContact O-CG2 3.12Å; R458-G516 PolarHBondContact NH2-O 3.08Å; R458-E517 VanDerWaalsContact CD-OE1 3.29Å; R458-E517 WeakPolarHBondContact CD-OE1 3.12Å; R458-E517 IonicContact CZ-OE1 2.67Å; R458-E517 VanDerWaalsContact CZ-OE1 3.29Å; R458-E517 IonicContact NE-OE1 2.59Å; R458-E517 PolarHBondContact NE-OE1 2.84Å; R458-E517 IonicContact NH1-OE1 2.67Å; R458-E517 PolarHBondContact NH1-OE1 2.9Å
459	G	79.5	Confident	84.8	Confident	64 Å²	64	56.9 Å²	56.9	66%	0.66	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.8	7.7	-177.1	0	0	0	0	0	114.7	A455	A455-G459 PolarHBondContact O-N 3.17Å
460	R	82.2	Confident	85.3	Confident	21 Å²	21	52.2 Å²	52.2	8%	0.079	28%	0.281	C	S	.	.			trans	-72.1	151.4	176.7	-57.7	-60.7	-169.7	156.2	5.1	111	A455 R458 E507 E511 E517	A455-R460 HydrophobicContact CB-CB 4.36Å; A455-R460 PolarHBondContact O-N 2.84Å; A455-R460 VanDerWaalsContact O-N 3.14Å; R458-R460 HydrophobicContact CB-CG 4.1Å; R460-E507 WeakPolarHBondContact CB-OE2 3.33Å; R460-E507 PolarHBondContact NH1-O 2.81Å; R460-E511 IonicContact CZ-OE2 3.51Å; R460-E511 IonicContact NE-OE2 2.97Å; R460-E511 IonicContact NH1-OE2 3.29Å; R460-E511 PolarHBondContact NH1-OE2 2.81Å; R460-E517 IonicContact CZ-OE2 2.67Å; R460-E517 IonicContact NE-OE2 3.17Å; R460-E517 IonicContact NH2-OE2 3.19Å; R460-E517 PolarHBondContact NH2-OE2 2.89Å
461	S	80.1	Confident	85.9	Confident	65 Å²	65	50.6 Å²	50.6	46%	0.455	27%	0.267	S	S	.	.	S	Bend	trans	-69.9	-40.9	175.8	59	0	0	0	0	112.9	E507	S461-E507 WeakPolarHBondContact CB-OE1 3.49Å; S461-E507 PolarHBondContact N-OE1 3.16Å; S461-E507 PolarHBondContact N-OE2 3.22Å; S461-E507 PolarHBondContact OG-OE1 3.36Å; S461-E507 PolarHBondContact OG-OE2 2.92Å
462	S	86.4	Confident	86.5	Confident	13 Å²	13	49.6 Å²	49.6	9%	0.091	26%	0.263	C	S	.	.			trans	-112.2	144.3	-169	173.5	0	0	0	0	113.9	A455 N464 D501	A455-S462 VanDerWaalsContact CB-O 3.3Å; A455-S462 WeakPolarHBondContact CB-O 3.39Å; S462-N464 VanDerWaalsContact C-N 3.27Å; S462-N464 PolarHBondContact O-N 2.75Å; S462-N464 WeakPolarHBondContact OG-CB 3.48Å; S462-N464 PolarHBondContact OG-N 3.11Å; S462-D501 WeakPolarHBondContact CB-OD2 3.37Å; S462-D501 PolarHBondContact OG-OD2 3.34Å
463	P	87.3	Confident	87	Confident	50 Å²	50	48.1 Å²	48.1	33%	0.325	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-15.8	169.2	31.9	-36.7	0	0	0	114.1	E451 G465	E451-P463 HydrophobicContact CB-CB 4Å; P463-G465 VanDerWaalsContact C-N 3.31Å; P463-G465 PolarHBondContact O-N 2.93Å
464	N	89.6	Confident	87.5	Confident	32 Å²	32	47 Å²	47	17%	0.171	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-11.9	-166.5	-70.5	-36.3	0	0	0	114.8	S462 N466 L467 I468 L498 D501	S462-N464 VanDerWaalsContact C-N 3.27Å; S462-N464 PolarHBondContact O-N 2.75Å; S462-N464 WeakPolarHBondContact OG-CB 3.48Å; S462-N464 PolarHBondContact OG-N 3.11Å; N464-N466 VanDerWaalsContact C-N 3.26Å; N464-N466 PolarHBondContact O-N 3.46Å; N464-N466 VanDerWaalsContact O-N 3.09Å; N464-L467 WeakPolarHBondContact O-CA 3.39Å; N464-L467 WeakPolarHBondContact O-CB 3.47Å; N464-L467 PolarHBondContact O-N 3.47Å; N464-I468 HydrophobicContact CB-CD1 4.28Å; N464-I468 HydrophobicContact CB-CG1 4.45Å; N464-I468 PolarHBondContact O-N 3.11Å; N464-L498 HydrophobicContact CB-CD1 3.86Å; N464-D501 WeakPolarHBondContact CB-OD2 3.39Å; N464-D501 PolarHBondContact ND2-OD2 2.96Å
465	G	88.9	Confident	88.2	Confident	9 Å²	9	44.8 Å²	44.8	9%	0.093	23%	0.232	C	C	.	.	H	α-helix	trans	-58.1	-30.7	-169.6	0	0	0	0	0	115.5	P463 R469 C504	P463-G465 VanDerWaalsContact C-N 3.31Å; P463-G465 PolarHBondContact O-N 2.93Å; G465-R469 WeakPolarHBondContact O-CG 3.31Å; G465-R469 PolarHBondContact O-N 2.72Å; G465-C504 WeakPolarHBondContact CA-SG 3.36Å; G465-C504 PolarHBondContact N-SG 2.99Å; G465-C504 VanDerWaalsContact N-SG 3.41Å
466	N	86.8	Confident	88.7	Confident	37 Å²	37	45.5 Å²	45.5	20%	0.198	24%	0.235	C	C	.	.	H	α-helix	trans	-74.6	-34.7	173.7	-65.2	-33.8	0	0	0	112.1	E451 R458 N464 M470	E451-N466 PolarHBondContact OE2-ND2 3.36Å; R458-N466 PolarHBondContact NH1-OD1 3.11Å; N464-N466 VanDerWaalsContact C-N 3.26Å; N464-N466 PolarHBondContact O-N 3.46Å; N464-N466 VanDerWaalsContact O-N 3.09Å; N466-M470 PolarHBondContact O-N 2.79Å; N466-M470 VanDerWaalsContact O-N 3.14Å
467	L	90.8	Very high	89	Confident	24 Å²	24	45.9 Å²	45.9	13%	0.126	24%	0.239	C	C	.	.	H	α-helix	trans	-68.9	-39.7	175.5	-53.6	-179.8	0	0	0	111.5	F443 H446 N464 M470 L471 L498	F443-L467 HydrophobicContact CB-CD2 4.37Å; F443-L467 HydrophobicContact CD1-CB 4.18Å; F443-L467 HydrophobicContact CD1-CD2 4.14Å; H446-L467 HydrophobicContact CB-CD2 4.2Å; N464-L467 WeakPolarHBondContact O-CA 3.39Å; N464-L467 WeakPolarHBondContact O-CB 3.47Å; N464-L467 PolarHBondContact O-N 3.47Å; L467-M470 HydrophobicContact CD2-CE 3.8Å; L467-M470 PolarHBondContact O-N 3.37Å; L467-L471 PolarHBondContact O-N 2.86Å; L467-L498 HydrophobicContact CB-CD1 3.7Å; L467-L498 HydrophobicContact CB-CD2 4.12Å; L467-L498 HydrophobicContact CD1-CD1 4.42Å
468	I	92.9	Very high	89.2	Confident	5 Å²	5	36.6 Å²	36.6	3%	0.026	21%	0.206	C	C	.	.	H	α-helix	trans	-62.1	-47	174.9	-63	172.2	0	0	0	110.1	N464 M470 L471 V472 L498 C504 M505 L508 L528	N464-I468 HydrophobicContact CB-CD1 4.28Å; N464-I468 HydrophobicContact CB-CG1 4.45Å; N464-I468 PolarHBondContact O-N 3.11Å; I468-M470 VanDerWaalsContact C-N 3.29Å; I468-M470 PolarHBondContact O-N 3.21Å; I468-L471 PolarHBondContact O-N 3.4Å; I468-V472 WeakPolarHBondContact O-CG2 3.38Å; I468-V472 PolarHBondContact O-N 3.07Å; I468-L498 HydrophobicContact CD1-CD1 4.44Å; I468-L498 HydrophobicContact CG1-CD1 3.53Å; I468-C504 HydrophobicContact CD1-CB 3.83Å; I468-M505 HydrophobicContact CD1-CG 3.91Å; I468-M505 HydrophobicContact CG2-CG 4.37Å; I468-L508 HydrophobicContact CB-CD1 3.95Å; I468-L508 HydrophobicContact CD1-CD1 4.31Å; I468-L508 HydrophobicContact CG2-CD1 3.77Å; I468-L528 HydrophobicContact CG2-CD1 3.48Å; I468-L528 VanDerWaalsContact CG2-CD1 3.48Å
469	R	91.9	Very high	89.4	Confident	43 Å²	43	40.8 Å²	40.8	16%	0.162	23%	0.228	C	C	.	.	H	α-helix	trans	-57	-39.1	174.6	-76.4	173	174.3	133	-6.6	112.6	G465 V472 L473 L508 E517 L520	G465-R469 WeakPolarHBondContact O-CG 3.31Å; G465-R469 PolarHBondContact O-N 2.72Å; R469-V472 PolarHBondContact O-N 3.46Å; R469-L473 WeakPolarHBondContact O-CG 3.46Å; R469-L473 PolarHBondContact O-N 3.17Å; R469-L508 VanDerWaalsContact CZ-CD2 3.47Å; R469-E517 IonicContact CZ-OE1 3.74Å; R469-E517 IonicContact NH1-OE1 3.89Å; R469-E517 PolarHBondContact NH1-OE1 2.84Å; R469-E517 IonicContact NH2-OE1 2.71Å; R469-E517 PolarHBondContact NH2-OE1 2.94Å; R469-E517 IonicContact NH2-OE2 3.82Å; R469-E517 PolarHBondContact NH2-OE2 3.2Å; R469-L520 HydrophobicContact CG-CD2 4.15Å
470	M	91.7	Very high	89.5	Confident	51 Å²	51	42.1 Å²	42.1	25%	0.251	22%	0.219	S	C	.	.	H	α-helix	trans	-68.5	-34.9	174.1	-70.8	-164.1	-55.9	0	0	113.5	F443 H446 N466 L467 I468 L473 F474	F443-M470 HydrophobicContact CD1-CE 4Å; F443-M470 HydrophobicContact CE1-CE 4.45Å; H446-M470 WeakPolarHBondContact NE2-CE 3.43Å; N466-M470 PolarHBondContact O-N 2.79Å; N466-M470 VanDerWaalsContact O-N 3.14Å; L467-M470 HydrophobicContact CD2-CE 3.8Å; L467-M470 PolarHBondContact O-N 3.37Å; I468-M470 VanDerWaalsContact C-N 3.29Å; I468-M470 PolarHBondContact O-N 3.21Å; M470-L473 PolarHBondContact O-N 3.04Å; M470-F474 WeakPolarHBondContact O-CB 3.2Å; M470-F474 PolarHBondContact O-N 3.34Å
471	L	94.9	Very high	89.6	Confident	6 Å²	6	43.9 Å²	43.9	3%	0.031	23%	0.229	C	C	.	.	H	α-helix	trans	-67.7	-39.4	175.3	-179.4	59	0	0	0	111.6	F443 L467 I468 F474 F475 L487 L491 L499 L531	F443-L471 HydrophobicContact CZ-CB 4.25Å; F443-L471 HydrophobicContact CZ-CD1 4.38Å; L467-L471 PolarHBondContact O-N 2.86Å; I468-L471 PolarHBondContact O-N 3.4Å; L471-F474 PolarHBondContact O-N 3.33Å; L471-F475 WeakPolarHBondContact O-CB 3.46Å; L471-F475 PolarHBondContact O-N 3.16Å; L471-L487 HydrophobicContact CD1-CD1 4.33Å; L471-L487 HydrophobicContact CD1-CD2 3.89Å; L471-L487 HydrophobicContact CD1-CG 4.17Å; L471-L491 HydrophobicContact CD1-CD1 3.53Å; L471-L491 HydrophobicContact CD2-CD1 4.41Å; L471-L499 HydrophobicContact CD2-CD2 3.82Å; L471-L531 HydrophobicContact CD2-CD2 4.13Å; L471-L531 HydrophobicContact CG-CD1 4.18Å; L471-L531 HydrophobicContact CG-CD2 4.18Å
472	V	95.5	Very high	89.8	Confident	3 Å²	3	50 Å²	50	2%	0.018	25%	0.25	C	C	.	.	H	α-helix	trans	-60.9	-48.1	172.1	171.7	0	0	0	0	110.9	I468 R469 F475 L476 Q524 A527 L528 L531	I468-V472 WeakPolarHBondContact O-CG2 3.38Å; I468-V472 PolarHBondContact O-N 3.07Å; R469-V472 PolarHBondContact O-N 3.46Å; V472-F475 PolarHBondContact O-N 2.94Å; V472-L476 HydrophobicContact CG1-CD1 4.22Å; V472-L476 WeakPolarHBondContact O-CG 3.17Å; V472-L476 PolarHBondContact O-N 3.08Å; V472-L476 VanDerWaalsContact O-N 3.08Å; V472-Q524 HydrophobicContact CG1-CB 3.85Å; V472-Q524 HydrophobicContact CG1-CG 3.97Å; V472-A527 HydrophobicContact CG1-CB 3.9Å; V472-L528 HydrophobicContact CG2-CB 3.88Å; V472-L528 HydrophobicContact CG2-CD1 3.99Å; V472-L528 HydrophobicContact CG2-CG 4.44Å; V472-L531 HydrophobicContact CB-CD1 4.42Å; V472-L531 HydrophobicContact CG2-CD1 3.73Å
473	L	93.9	Very high	90	Very high	65 Å²	65	52.6 Å²	52.6	34%	0.34	26%	0.261	S	S	.	.	H	α-helix	trans	-60.4	-48.1	175.9	-76.6	168.9	0	0	0	111.8	R469 M470 F475 L476 E477	R469-L473 WeakPolarHBondContact O-CG 3.46Å; R469-L473 PolarHBondContact O-N 3.17Å; M470-L473 PolarHBondContact O-N 3.04Å; L473-F475 VanDerWaalsContact C-N 3.3Å; L473-F475 PolarHBondContact O-N 3.01Å; L473-L476 PolarHBondContact O-N 3.48Å; L473-L476 VanDerWaalsContact O-N 3.15Å; L473-E477 WeakPolarHBondContact O-CB 3.35Å; L473-E477 WeakPolarHBondContact O-CG 3.25Å; L473-E477 PolarHBondContact O-N 3.43Å
474	F	94.5	Very high	90.4	Very high	18 Å²	18	50.2 Å²	50.2	8%	0.079	25%	0.245	C	C	.	.	H	α-helix	trans	-57.5	-41.4	178.2	174.6	-91.4	0	0	0	112.8	Y420 V423 L438 L442 M470 L471 S478 L487	Y420-F474 HydrophobicContact CD1-CE2 4.48Å; Y420-F474 AromaticContact CD2-CE2 3.92Å; Y420-F474 HydrophobicContact CD2-CE2 3.92Å; Y420-F474 AromaticContact CG-CE2 3.83Å; Y420-F474 HydrophobicContact CG-CE2 3.83Å; Y420-F474 HydrophobicContact CG-CZ 4.41Å; V423-F474 HydrophobicContact CG2-CE1 4.1Å; V423-F474 HydrophobicContact CG2-CZ 4.27Å; L438-F474 HydrophobicContact CD1-CD2 3.77Å; L438-F474 HydrophobicContact CD1-CE1 4.39Å; L438-F474 HydrophobicContact CD1-CE2 3.46Å; L438-F474 VanDerWaalsContact CD1-CE2 3.46Å; L438-F474 HydrophobicContact CD1-CG 4.35Å; L438-F474 HydrophobicContact CD1-CZ 3.81Å; L438-F474 HydrophobicContact CD2-CD1 3.89Å; L438-F474 HydrophobicContact CD2-CD2 4.47Å; L438-F474 HydrophobicContact CD2-CE1 3.53Å; L438-F474 HydrophobicContact CD2-CE2 4.13Å; L438-F474 HydrophobicContact CD2-CG 4.35Å; L438-F474 HydrophobicContact CD2-CZ 3.66Å; L438-F474 HydrophobicContact CG-CE2 4.47Å; L438-F474 HydrophobicContact CG-CZ 4.42Å; L442-F474 HydrophobicContact CD1-CB 4.26Å; L442-F474 HydrophobicContact CD1-CD2 4.15Å; L442-F474 HydrophobicContact CD1-CG 4.3Å; M470-F474 WeakPolarHBondContact O-CB 3.2Å; M470-F474 PolarHBondContact O-N 3.34Å; L471-F474 PolarHBondContact O-N 3.33Å; F474-S478 WeakPolarHBondContact O-CB 3.07Å; F474-S478 PolarHBondContact O-N 2.84Å; F474-S478 VanDerWaalsContact O-N 3.08Å; F474-S478 PolarHBondContact O-OG 3.38Å; F474-L487 HydrophobicContact CD1-CD1 4.03Å; F474-L487 HydrophobicContact CD1-CD2 3.98Å; F474-L487 HydrophobicContact CE1-CD1 3.7Å; F474-L487 HydrophobicContact CE1-CD2 4.26Å
475	F	95.4	Very high	90.7	Very high	12 Å²	12	49.1 Å²	49.1	5%	0.053	24%	0.24	C	C	.	.	H	α-helix	trans	-62.6	-48.3	175.7	175.2	-124.3	0	0	0	111.3	L471 V472 L473 E477 S478 A484 L487 A527 E530	L471-F475 WeakPolarHBondContact O-CB 3.46Å; L471-F475 PolarHBondContact O-N 3.16Å; V472-F475 PolarHBondContact O-N 2.94Å; L473-F475 VanDerWaalsContact C-N 3.3Å; L473-F475 PolarHBondContact O-N 3.01Å; F475-E477 PolarHBondContact O-N 3.43Å; F475-S478 WeakPolarHBondContact O-CB 3.24Å; F475-S478 PolarHBondContact O-N 3.06Å; F475-A484 HydrophobicContact CD2-CB 4.41Å; F475-A484 HydrophobicContact CE1-CB 4.34Å; F475-A484 HydrophobicContact CE2-CB 4.12Å; F475-A484 HydrophobicContact CZ-CB 4.08Å; F475-L487 HydrophobicContact CB-CD2 3.74Å; F475-L487 HydrophobicContact CD2-CD2 4.03Å; F475-L487 HydrophobicContact CG-CD2 4.22Å; F475-A527 HydrophobicContact CD1-CB 3.82Å; F475-A527 HydrophobicContact CE1-CB 4.12Å; F475-E530 HydrophobicContact CE1-CG 4.38Å; F475-E530 HydrophobicContact CZ-CG 4.45Å
476	L	93.5	Very high	91.1	Very high	27 Å²	27	50.3 Å²	50.3	14%	0.141	24%	0.242	C	C	.	.	H	α-helix	trans	-66.9	-34.5	179.8	-68.6	-179.9	0	0	0	114.1	V472 L473 S478 E479 R523 Q524 A527	V472-L476 HydrophobicContact CG1-CD1 4.22Å; V472-L476 WeakPolarHBondContact O-CG 3.17Å; V472-L476 PolarHBondContact O-N 3.08Å; V472-L476 VanDerWaalsContact O-N 3.08Å; L473-L476 PolarHBondContact O-N 3.48Å; L473-L476 VanDerWaalsContact O-N 3.15Å; L476-S478 VanDerWaalsContact C-N 3.33Å; L476-E479 WeakPolarHBondContact O-CG 3.26Å; L476-R523 HydrophobicContact CD1-CG 4.07Å; L476-R523 HydrophobicContact CD2-CG 3.73Å; L476-R523 PolarHBondContact O-NH2 2.93Å; L476-Q524 HydrophobicContact CD1-CB 4.5Å; L476-Q524 HydrophobicContact CD1-CG 3.8Å; L476-A527 HydrophobicContact CD1-CB 4.17Å; L476-A527 HydrophobicContact CD2-CB 3.76Å; L476-A527 HydrophobicContact CG-CB 3.92Å
477	E	91	Very high	91.6	Very high	148 Å²	148	48.5 Å²	48.5	69%	0.692	23%	0.233	S	C	*	.	H	α-helix	trans	-81.2	-10.3	177	-69.3	175.7	175.3	0	0	113	L473 F475	L473-E477 WeakPolarHBondContact O-CB 3.35Å; L473-E477 WeakPolarHBondContact O-CG 3.25Å; L473-E477 PolarHBondContact O-N 3.43Å; F475-E477 PolarHBondContact O-N 3.43Å
478	S	86.3	Confident	91.9	Very high	14 Å²	14	47.4 Å²	47.4	10%	0.098	23%	0.227	C	C	.	.	H	α-helix	trans	-73	-35.8	179.6	-70.2	0	0	0	0	113.1	Y424 F474 F475 L476 L480	Y424-S478 WeakPolarHBondContact CE2-OG 3.46Å; Y424-S478 VanDerWaalsContact OH-CB 3.26Å; Y424-S478 WeakPolarHBondContact OH-CB 3.17Å; Y424-S478 PolarHBondContact OH-OG 2.9Å; F474-S478 WeakPolarHBondContact O-CB 3.07Å; F474-S478 PolarHBondContact O-N 2.84Å; F474-S478 VanDerWaalsContact O-N 3.08Å; F474-S478 PolarHBondContact O-OG 3.38Å; F475-S478 WeakPolarHBondContact O-CB 3.24Å; F475-S478 PolarHBondContact O-N 3.06Å; L476-S478 VanDerWaalsContact C-N 3.33Å; S478-L480 WeakPolarHBondContact O-CG 3.39Å; S478-L480 PolarHBondContact O-N 3.26Å
479	E	84.7	Confident	92.1	Very high	150 Å²	150	47.2 Å²	47.2	70%	0.701	23%	0.226	S	C	*	.			trans	47.1	21.3	-178.9	-54.3	-164.7	142.8	0	0	116.1	L476 R523	L476-E479 WeakPolarHBondContact O-CG 3.26Å; E479-R523 IonicContact OE1-NH1 3.12Å; E479-R523 IonicContact OE1-NH2 3.77Å
480	L	80.9	Confident	92.4	Very high	91 Å²	91	45.1 Å²	45.1	48%	0.476	22%	0.218	S	C	.	.	S	Bend	trans	-103.4	-16.9	179.8	-77	174.1	0	0	0	114.5	H421 Y424 S478	H421-L480 HydrophobicContact CB-CD1 3.67Å; H421-L480 VanDerWaalsContact CD2-CD1 3.45Å; H421-L480 WeakPolarHBondContact CD2-CD1 3.4Å; Y424-L480 HydrophobicContact CD2-CB 4.12Å; Y424-L480 HydrophobicContact CD2-CD1 3.99Å; Y424-L480 HydrophobicContact CE2-CB 4.4Å; S478-L480 WeakPolarHBondContact O-CG 3.39Å; S478-L480 PolarHBondContact O-N 3.26Å
481	H	84.4	Confident	92.7	Very high	59 Å²	59	42.7 Å²	42.7	27%	0.273	21%	0.206	S	C	.	.			trans	-150.1	141.6	179.7	-88.5	-96.1	0	0	0	110.2	Y424 H483 Y486	Y424-H481 HydrophobicContact CD1-CB 4Å; Y424-H481 AromaticContact CD1-CD2 3.32Å; Y424-H481 WeakPolarHBondContact CD1-CD2 3.45Å; Y424-H481 AromaticContact CD1-CG 3.78Å; Y424-H481 HydrophobicContact CE1-CB 4Å; Y424-H481 AromaticContact CG-CD2 3.56Å; H481-H483 AromaticContact ND1-CD2 3.88Å; H481-H483 AromaticContact ND1-NE2 3.41Å; H481-H483 PolarHBondContact ND1-NE2 3.08Å; H481-Y486 AromaticContact CE1-CD2 3.41Å; H481-Y486 VanDerWaalsContact CE1-CD2 3.41Å; H481-Y486 WeakPolarHBondContact CE1-CD2 2.86Å; H481-Y486 AromaticContact CE1-CE2 3.71Å; H481-Y486 AromaticContact ND1-CD2 3.67Å
482	E	84.7	Confident	92.7	Very high	192 Å²	192	43.8 Å²	43.8	90%	0.897	21%	0.21	S	C	*	.	S	Bend	trans	-83.4	-17.5	177.6	-61.5	170.5	158.8	0	0	112.8
483	H	90.6	Very high	92.6	Very high	69 Å²	69	49.4 Å²	49.4	32%	0.319	24%	0.236	S	C	.	.	S	Bend	trans	-127.4	148.1	-175.8	73.2	101.6	0	0	0	111.7	H481 Y486	H481-H483 AromaticContact ND1-CD2 3.88Å; H481-H483 AromaticContact ND1-NE2 3.41Å; H481-H483 PolarHBondContact ND1-NE2 3.08Å; H483-Y486 AromaticContact CE1-CD2 3.44Å; H483-Y486 VanDerWaalsContact CE1-CD2 3.44Å; H483-Y486 WeakPolarHBondContact CE1-CD2 2.55Å; H483-Y486 AromaticContact CE1-CE2 3.36Å; H483-Y486 WeakPolarHBondContact CE1-CE2 3.43Å; H483-Y486 AromaticContact NE2-CD2 3.69Å; H483-Y486 AromaticContact NE2-CE2 3.53Å
484	A	95.6	Very high	92.5	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	23%	0.232	C	C	.	.	S	Bend	trans	-88.8	-7.5	-167	0	0	0	0	0	114.7	F475 Y486 L487 V488 E530 L531	F475-A484 HydrophobicContact CD2-CB 4.41Å; F475-A484 HydrophobicContact CE1-CB 4.34Å; F475-A484 HydrophobicContact CE2-CB 4.12Å; F475-A484 HydrophobicContact CZ-CB 4.08Å; A484-Y486 VanDerWaalsContact C-N 3.29Å; A484-Y486 PolarHBondContact O-N 2.8Å; A484-Y486 VanDerWaalsContact O-N 3.12Å; A484-L487 WeakPolarHBondContact O-CB 3.38Å; A484-L487 PolarHBondContact O-N 3.36Å; A484-V488 HydrophobicContact CB-CG2 4.4Å; A484-V488 PolarHBondContact O-N 3.33Å; A484-E530 HydrophobicContact CB-CG 3.8Å; A484-E530 PolarHBondContact N-OE1 3.25Å; A484-L531 HydrophobicContact CB-CD2 3.72Å; A484-L531 HydrophobicContact CB-CG 3.89Å
485	A	95.9	Very high	92.4	Very high	9 Å²	9	47.6 Å²	47.6	7%	0.074	23%	0.231	C	C	.	.	H	α-helix	trans	-51.2	-41.9	-171.2	0	0	0	0	0	114.4	D489 C534 P545	A485-D489 PolarHBondContact O-N 3.32Å; A485-D489 VanDerWaalsContact O-N 3.11Å; A485-C534 WeakPolarHBondContact CA-SG 3.47Å; A485-C534 PolarHBondContact N-SG 3.09Å; A485-C534 VanDerWaalsContact N-SG 3.38Å; A485-P545 HydrophobicContact CB-CB 4.37Å
486	Y	96.5	Very high	92.2	Very high	33 Å²	33	50.9 Å²	50.9	13%	0.129	25%	0.246	C	C	.	.	H	α-helix	trans	-75.4	-30.4	179.7	-65.3	-58.5	0	0	0	113.5	H481 H483 A484 S490 P545 R548	H481-Y486 AromaticContact CE1-CD2 3.41Å; H481-Y486 VanDerWaalsContact CE1-CD2 3.41Å; H481-Y486 WeakPolarHBondContact CE1-CD2 2.86Å; H481-Y486 AromaticContact CE1-CE2 3.71Å; H481-Y486 AromaticContact ND1-CD2 3.67Å; H483-Y486 AromaticContact CE1-CD2 3.44Å; H483-Y486 VanDerWaalsContact CE1-CD2 3.44Å; H483-Y486 WeakPolarHBondContact CE1-CD2 2.55Å; H483-Y486 AromaticContact CE1-CE2 3.36Å; H483-Y486 WeakPolarHBondContact CE1-CE2 3.43Å; H483-Y486 AromaticContact NE2-CD2 3.69Å; H483-Y486 AromaticContact NE2-CE2 3.53Å; A484-Y486 VanDerWaalsContact C-N 3.29Å; A484-Y486 PolarHBondContact O-N 2.8Å; A484-Y486 VanDerWaalsContact O-N 3.12Å; Y486-S490 WeakPolarHBondContact O-CB 3.26Å; Y486-S490 PolarHBondContact O-N 3.09Å; Y486-S490 PolarHBondContact O-OG 3.18Å; Y486-P545 HydrophobicContact CD1-CB 4.43Å; Y486-P545 HydrophobicContact CD1-CG 3.78Å; Y486-P545 HydrophobicContact CE1-CB 4.14Å; Y486-P545 HydrophobicContact CE1-CG 3.89Å; Y486-R548 HydrophobicContact CD1-CG 4.33Å; Y486-R548 HydrophobicContact CE1-CG 4.32Å; Y486-R548 PolarHBondContact O-NH1 3.11Å; Y486-R548 PolarHBondContact O-NH2 2.94Å
487	L	97.4	Very high	92.1	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-70.1	-44.5	173	173.5	57.8	0	0	0	111	V423 Y424 L438 L471 F474 F475 A484 S490 L491	V423-L487 HydrophobicContact CB-CD1 4.38Å; V423-L487 HydrophobicContact CG2-CD1 3.8Å; Y424-L487 HydrophobicContact CE1-CB 3.96Å; L438-L487 HydrophobicContact CD2-CD1 4.11Å; L471-L487 HydrophobicContact CD1-CD1 4.33Å; L471-L487 HydrophobicContact CD1-CD2 3.89Å; L471-L487 HydrophobicContact CD1-CG 4.17Å; F474-L487 HydrophobicContact CD1-CD1 4.03Å; F474-L487 HydrophobicContact CD1-CD2 3.98Å; F474-L487 HydrophobicContact CE1-CD1 3.7Å; F474-L487 HydrophobicContact CE1-CD2 4.26Å; F475-L487 HydrophobicContact CB-CD2 3.74Å; F475-L487 HydrophobicContact CD2-CD2 4.03Å; F475-L487 HydrophobicContact CG-CD2 4.22Å; A484-L487 WeakPolarHBondContact O-CB 3.38Å; A484-L487 PolarHBondContact O-N 3.36Å; L487-S490 PolarHBondContact O-N 3.33Å; L487-L491 HydrophobicContact CD1-CD1 3.83Å; L487-L491 HydrophobicContact CD1-CG 4.42Å; L487-L491 HydrophobicContact CG-CD1 4.33Å; L487-L491 PolarHBondContact O-N 3.26Å
488	V	97.8	Very high	92.2	Very high	1 Å²	1	51.8 Å²	51.8	1%	0.006	25%	0.25	C	S	.	.	H	α-helix	trans	-59.7	-48.1	176.9	172.5	0	0	0	0	111	A484 S490 L491 W492 L531 C534 T535	A484-V488 HydrophobicContact CB-CG2 4.4Å; A484-V488 PolarHBondContact O-N 3.33Å; V488-S490 VanDerWaalsContact C-N 3.33Å; V488-S490 PolarHBondContact O-N 3.17Å; V488-L491 CarbonylContact O-C 3.56Å; V488-L491 PolarHBondContact O-N 3.47Å; V488-L491 VanDerWaalsContact O-N 3.16Å; V488-W492 HydrophobicContact CG1-CE3 3.82Å; V488-W492 HydrophobicContact CG1-CZ3 4.02Å; V488-W492 PolarHBondContact O-N 2.73Å; V488-L531 HydrophobicContact CG2-CD2 3.78Å; V488-C534 HydrophobicContact CB-CB 4.3Å; V488-C534 HydrophobicContact CG2-CB 3.82Å; V488-T535 HydrophobicContact CG1-CG2 3.64Å; V488-T535 HydrophobicContact CG2-CG2 4.01Å
489	D	97.8	Very high	92.6	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-62.5	-37.4	178.7	174.4	63	0	0	0	113.4	R428 A485 L491 W492 Q538 P545 R548	R428-D489 WeakPolarHBondContact CD-OD2 3.35Å; R428-D489 WeakPolarHBondContact CG-OD2 3.26Å; R428-D489 IonicContact CZ-OD1 2.68Å; R428-D489 VanDerWaalsContact CZ-OD1 3.24Å; R428-D489 IonicContact CZ-OD2 3.24Å; R428-D489 VanDerWaalsContact NE-CG 3.29Å; R428-D489 IonicContact NE-OD1 2.65Å; R428-D489 PolarHBondContact NE-OD1 3.22Å; R428-D489 IonicContact NE-OD2 3.46Å; R428-D489 PolarHBondContact NE-OD2 3.38Å; R428-D489 PolarHBondContact NH2-O 2.87Å; R428-D489 IonicContact NH2-OD1 2.82Å; R428-D489 PolarHBondContact NH2-OD1 3.47Å; A485-D489 PolarHBondContact O-N 3.32Å; A485-D489 VanDerWaalsContact O-N 3.11Å; D489-L491 VanDerWaalsContact C-N 3.27Å; D489-L491 PolarHBondContact O-N 2.68Å; D489-W492 VanDerWaalsContact O-CB 3.23Å; D489-W492 WeakPolarHBondContact O-CB 3.48Å; D489-W492 PolarHBondContact O-N 2.81Å; D489-Q538 VanDerWaalsContact CA-OE1 3.27Å; D489-Q538 PolarHBondContact OD1-NE2 3.48Å; D489-P545 HydrophobicContact CB-CG 4.09Å; D489-R548 WeakPolarHBondContact OD2-CD 3.25Å; D489-R548 IonicContact OD2-CZ 3.45Å; D489-R548 IonicContact OD2-NE 3.97Å; D489-R548 IonicContact OD2-NH1 3.89Å; D489-R548 PolarHBondContact OD2-NH1 3.11Å
490	S	97.9	Very high	93.2	Very high	0 Å²	0	46 Å²	46	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-64.3	-33.1	176.5	-67.4	0	0	0	0	112.8	V423 A431 Y486 L487 V488 R548	V423-S490 PolarHBondContact O-OG 3.25Å; A431-S490 VanDerWaalsContact CB-OG 3.28Å; A431-S490 WeakPolarHBondContact CB-OG 3.49Å; A431-S490 WeakPolarHBondContact O-CB 3.4Å; A431-S490 PolarHBondContact O-OG 2.85Å; Y486-S490 WeakPolarHBondContact O-CB 3.26Å; Y486-S490 PolarHBondContact O-N 3.09Å; Y486-S490 PolarHBondContact O-OG 3.18Å; L487-S490 PolarHBondContact O-N 3.33Å; V488-S490 VanDerWaalsContact C-N 3.33Å; V488-S490 PolarHBondContact O-N 3.17Å; S490-R548 PolarHBondContact OG-NH1 3.34Å
491	L	97.2	Very high	93.9	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-91.3	-5	176.9	-67.1	171	0	0	0	112.9	G435 L438 H439 F443 L471 L487 V488 D489 E493 S494 S495 L499	G435-L491 WeakPolarHBondContact O-CD2 3.43Å; L438-L491 HydrophobicContact CD2-CD1 4.41Å; L438-L491 HydrophobicContact CD2-CD2 4.34Å; H439-L491 HydrophobicContact CB-CD2 4.41Å; F443-L491 HydrophobicContact CE2-CD2 4.47Å; L471-L491 HydrophobicContact CD1-CD1 3.53Å; L471-L491 HydrophobicContact CD2-CD1 4.41Å; L487-L491 HydrophobicContact CD1-CD1 3.83Å; L487-L491 HydrophobicContact CD1-CG 4.42Å; L487-L491 HydrophobicContact CG-CD1 4.33Å; L487-L491 PolarHBondContact O-N 3.26Å; V488-L491 CarbonylContact O-C 3.56Å; V488-L491 PolarHBondContact O-N 3.47Å; V488-L491 VanDerWaalsContact O-N 3.16Å; D489-L491 VanDerWaalsContact C-N 3.27Å; D489-L491 PolarHBondContact O-N 2.68Å; L491-E493 PolarHBondContact O-N 3.2Å; L491-E493 VanDerWaalsContact O-N 3.13Å; L491-S494 PolarHBondContact O-N 3.49Å; L491-S494 PolarHBondContact O-OG 2.7Å; L491-S495 WeakPolarHBondContact O-CB 3.49Å; L491-S495 PolarHBondContact O-N 3.31Å; L491-L499 HydrophobicContact CB-CD1 3.84Å
492	W	96.2	Very high	94.5	Very high	29 Å²	29	40.4 Å²	40.4	11%	0.11	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-16.8	-171.7	-162.7	-109.6	0	0	0	115	V488 D489 Q496 L499 K500 T535 Q538 A539	V488-W492 HydrophobicContact CG1-CE3 3.82Å; V488-W492 HydrophobicContact CG1-CZ3 4.02Å; V488-W492 PolarHBondContact O-N 2.73Å; D489-W492 VanDerWaalsContact O-CB 3.23Å; D489-W492 WeakPolarHBondContact O-CB 3.48Å; D489-W492 PolarHBondContact O-N 2.81Å; W492-Q496 WeakPolarHBondContact O-CG 3.44Å; W492-Q496 PolarHBondContact O-NE2 2.75Å; W492-L499 HydrophobicContact CE3-CD1 3.91Å; W492-L499 HydrophobicContact CZ3-CB 4.34Å; W492-L499 HydrophobicContact CZ3-CD1 4.49Å; W492-K500 HydrophobicContact CH2-CG 4.47Å; W492-T535 WeakPolarHBondContact CH2-O 3.25Å; W492-T535 HydrophobicContact CZ3-CG2 4.38Å; W492-Q538 HydrophobicContact CD2-CB 4.42Å; W492-Q538 HydrophobicContact CD2-CG 3.85Å; W492-Q538 HydrophobicContact CE3-CB 4.29Å; W492-Q538 HydrophobicContact CE3-CG 4.2Å; W492-Q538 HydrophobicContact CG-CG 4.32Å; W492-Q538 HydrophobicContact CH2-CB 3.93Å; W492-Q538 HydrophobicContact CH2-CG 4.25Å; W492-Q538 HydrophobicContact CZ2-CB 4.05Å; W492-Q538 HydrophobicContact CZ2-CG 3.89Å; W492-Q538 WeakPolarHBondContact CZ2-O 3.46Å; W492-Q538 HydrophobicContact CZ3-CB 4.07Å; W492-Q538 HydrophobicContact CZ3-CG 4.39Å; W492-A539 HydrophobicContact CH2-CB 3.95Å; W492-A539 HydrophobicContact CZ2-CB 4.26Å
493	E	91.8	Very high	95	Very high	121 Å²	121	36.7 Å²	36.7	57%	0.565	18%	0.175	S	C	*	.	T	Hydrogen-bonded Turn	trans	-103.2	-26.8	175.2	-72.6	174.9	-138.1	0	0	112.9	R428 V432 L491	R428-E493 IonicContact CZ-OE1 3.53Å; R428-E493 IonicContact NH1-OE1 2.68Å; R428-E493 PolarHBondContact NH1-OE1 3.21Å; R428-E493 IonicContact NH2-OE1 3.27Å; R428-E493 PolarHBondContact NH2-OE1 2.64Å; V432-E493 HydrophobicContact CG1-CB 4.23Å; L491-E493 PolarHBondContact O-N 3.2Å; L491-E493 VanDerWaalsContact O-N 3.13Å
494	S	92.7	Very high	95.2	Very high	38 Å²	38	33.5 Å²	33.5	27%	0.266	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.6	-26.5	-178.9	59.3	0	0	0	0	114.2	H439 L491	H439-S494 PolarHBondContact CE1-O 3.16Å; H439-S494 PolarHBondContact ND1-O 3.24Å; L491-S494 PolarHBondContact O-N 3.49Å; L491-S494 PolarHBondContact O-OG 2.7Å
495	S	93.3	Very high	95.2	Very high	6 Å²	6	33.8 Å²	33.8	4%	0.042	16%	0.162	C	C	.	.			trans	-132.7	24.6	-159.3	-49.3	0	0	0	0	114	H439 L491 E497 L498 L499	H439-S495 PolarHBondContact ND1-OG 2.82Å; L491-S495 WeakPolarHBondContact O-CB 3.49Å; L491-S495 PolarHBondContact O-N 3.31Å; S495-E497 VanDerWaalsContact C-N 3.27Å; S495-E497 PolarHBondContact O-N 3.38Å; S495-L498 WeakPolarHBondContact O-CB 3.45Å; S495-L498 PolarHBondContact O-N 3.2Å; S495-L499 WeakPolarHBondContact O-CG 3.18Å; S495-L499 PolarHBondContact O-N 3.04Å
496	Q	90.8	Very high	95.2	Very high	82 Å²	82	33.8 Å²	33.8	38%	0.383	16%	0.162	S	C	.	.	H	α-helix	trans	-55.9	-36.3	-173.5	-67.3	-166.4	-1.4	0	0	114.5	W492 L498 L499 K500	W492-Q496 WeakPolarHBondContact O-CG 3.44Å; W492-Q496 PolarHBondContact O-NE2 2.75Å; Q496-L498 VanDerWaalsContact C-N 3.28Å; Q496-L498 PolarHBondContact O-N 3.2Å; Q496-L499 PolarHBondContact O-N 2.95Å; Q496-K500 WeakPolarHBondContact O-CB 3.39Å; Q496-K500 WeakPolarHBondContact O-CG 3.36Å; Q496-K500 PolarHBondContact O-N 2.99Å; Q496-K500 VanDerWaalsContact O-N 3.1Å
497	E	89.9	Confident	95.1	Very high	179 Å²	179	33.6 Å²	33.6	84%	0.836	16%	0.162	S	C	*	.	H	α-helix	trans	-68	-27.9	179.8	-62.5	179.3	172.5	0	0	112.5	S495	S495-E497 VanDerWaalsContact C-N 3.27Å; S495-E497 PolarHBondContact O-N 3.38Å
498	L	93	Very high	94.8	Very high	14 Å²	14	34.2 Å²	34.2	7%	0.073	17%	0.165	C	C	.	.	H	α-helix	trans	-82.9	-43.6	174.1	176.9	62.7	0	0	0	111.5	F443 N464 L467 I468 S495 Q496 K500 D501 M505	F443-L498 HydrophobicContact CD1-CD2 4.26Å; F443-L498 HydrophobicContact CD2-CD2 4.07Å; F443-L498 HydrophobicContact CE1-CD2 3.99Å; F443-L498 HydrophobicContact CE2-CD2 3.8Å; F443-L498 HydrophobicContact CG-CD2 4.31Å; F443-L498 HydrophobicContact CZ-CD2 3.77Å; N464-L498 HydrophobicContact CB-CD1 3.86Å; L467-L498 HydrophobicContact CB-CD1 3.7Å; L467-L498 HydrophobicContact CB-CD2 4.12Å; L467-L498 HydrophobicContact CD1-CD1 4.42Å; I468-L498 HydrophobicContact CD1-CD1 4.44Å; I468-L498 HydrophobicContact CG1-CD1 3.53Å; S495-L498 WeakPolarHBondContact O-CB 3.45Å; S495-L498 PolarHBondContact O-N 3.2Å; Q496-L498 VanDerWaalsContact C-N 3.28Å; Q496-L498 PolarHBondContact O-N 3.2Å; L498-K500 VanDerWaalsContact C-N 3.32Å; L498-K500 PolarHBondContact O-N 2.38Å; L498-D501 PolarHBondContact O-N 2.85Å; L498-M505 WeakPolarHBondContact O-CE 3.44Å
499	L	96.3	Very high	94.7	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-72.4	-22.8	-174.4	-67.4	174.2	0	0	0	113.7	L471 L491 W492 S495 Q496 M505 T535	L471-L499 HydrophobicContact CD2-CD2 3.82Å; L491-L499 HydrophobicContact CB-CD1 3.84Å; W492-L499 HydrophobicContact CE3-CD1 3.91Å; W492-L499 HydrophobicContact CZ3-CB 4.34Å; W492-L499 HydrophobicContact CZ3-CD1 4.49Å; S495-L499 WeakPolarHBondContact O-CG 3.18Å; S495-L499 PolarHBondContact O-N 3.04Å; Q496-L499 PolarHBondContact O-N 2.95Å; L499-M505 WeakPolarHBondContact O-CE 3.33Å; L499-T535 HydrophobicContact CB-CG2 3.84Å; L499-T535 HydrophobicContact CD2-CG2 3.91Å; L499-T535 HydrophobicContact CG-CG2 4.4Å; L499-T535 WeakPolarHBondContact O-CB 3.35Å; L499-T535 VanDerWaalsContact O-CG2 3.22Å; L499-T535 WeakPolarHBondContact O-CG2 3.33Å; L499-T535 PolarHBondContact O-OG1 3.05Å
500	K	96.6	Very high	94.5	Very high	42 Å²	42	36.7 Å²	36.7	18%	0.183	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.1	9.6	179.1	-62.9	180	177.8	-179.3	0	113.5	W492 Q496 L498 W502 D566	W492-K500 HydrophobicContact CH2-CG 4.47Å; Q496-K500 WeakPolarHBondContact O-CB 3.39Å; Q496-K500 WeakPolarHBondContact O-CG 3.36Å; Q496-K500 PolarHBondContact O-N 2.99Å; Q496-K500 VanDerWaalsContact O-N 3.1Å; L498-K500 VanDerWaalsContact C-N 3.32Å; L498-K500 PolarHBondContact O-N 2.38Å; K500-W502 HydrophobicContact CB-CZ2 4.44Å; K500-W502 HydrophobicContact CG-CH2 4.48Å; K500-W502 HydrophobicContact CG-CZ2 4.26Å; K500-W502 PolarHBondContact O-N 3.23Å; K500-D566 IonicContact NZ-OD2 3.11Å; K500-D566 PolarHBondContact NZ-OD2 3.48Å
501	D	96.4	Very high	93.9	Very high	23 Å²	23	41.5 Å²	41.5	12%	0.123	20%	0.2	C	C	.	.			trans	-81.8	61.7	176.2	-164	-14.1	0	0	0	111.5	S462 N464 L498 E503 C504 M505	S462-D501 WeakPolarHBondContact CB-OD2 3.37Å; S462-D501 PolarHBondContact OG-OD2 3.34Å; N464-D501 WeakPolarHBondContact CB-OD2 3.39Å; N464-D501 PolarHBondContact ND2-OD2 2.96Å; L498-D501 PolarHBondContact O-N 2.85Å; D501-E503 PolarHBondContact O-N 3.11Å; D501-C504 HydrophobicContact CB-CB 4.3Å; D501-C504 PolarHBondContact O-N 2.79Å; D501-C504 WeakPolarHBondContact OD1-CB 3.42Å; D501-C504 PolarHBondContact OD1-N 3.07Å; D501-C504 WeakPolarHBondContact OD2-CB 3.47Å; D501-M505 WeakPolarHBondContact O-CG 3.15Å; D501-M505 PolarHBondContact O-N 3.14Å
502	W	97.1	Very high	93	Very high	11 Å²	11	49.9 Å²	49.9	4%	0.042	24%	0.239	C	C	.	.	H	α-helix	trans	-64.9	-25.8	-178	-59.9	-51.1	0	0	0	113	K500 T506 T535 I536 A539 D566 K569 L570 H573 F574	K500-W502 HydrophobicContact CB-CZ2 4.44Å; K500-W502 HydrophobicContact CG-CH2 4.48Å; K500-W502 HydrophobicContact CG-CZ2 4.26Å; K500-W502 PolarHBondContact O-N 3.23Å; W502-T506 VanDerWaalsContact O-CB 3.27Å; W502-T506 WeakPolarHBondContact O-CB 3.17Å; W502-T506 PolarHBondContact O-N 3.11Å; W502-T506 PolarHBondContact O-OG1 2.88Å; W502-T535 PolarHBondContact NE1-OG1 3.37Å; W502-I536 HydrophobicContact CZ2-CG1 4.41Å; W502-A539 HydrophobicContact CH2-CB 3.79Å; W502-A539 HydrophobicContact CZ2-CB 3.72Å; W502-D566 HydrophobicContact CH2-CB 4.33Å; W502-K569 HydrophobicContact CZ3-CB 4.33Å; W502-L570 HydrophobicContact CD2-CB 4.41Å; W502-L570 HydrophobicContact CE3-CB 3.87Å; W502-L570 HydrophobicContact CH2-CB 3.93Å; W502-L570 HydrophobicContact CH2-CD2 4.08Å; W502-L570 HydrophobicContact CZ2-CB 4.46Å; W502-L570 HydrophobicContact CZ3-CB 3.62Å; W502-H573 PolarHBondContact O-NE2 3.12Å; W502-F574 HydrophobicContact CB-CE2 3.69Å; W502-F574 HydrophobicContact CB-CZ 3.87Å; W502-F574 HydrophobicContact CD2-CE2 4.4Å; W502-F574 AromaticContact CG-CE2 3.83Å; W502-F574 HydrophobicContact CG-CE2 3.83Å; W502-F574 HydrophobicContact CG-CZ 4.26Å
503	E	95.1	Very high	92	Very high	113 Å²	113	51.1 Å²	51.1	53%	0.528	25%	0.251	S	S	.	.	H	α-helix	trans	-64.7	-51.2	173	-170.2	169.3	-165.3	0	0	109.8	D501 M505 T506 E507	D501-E503 PolarHBondContact O-N 3.11Å; E503-M505 PolarHBondContact O-N 3.46Å; E503-T506 WeakPolarHBondContact O-CB 3.36Å; E503-T506 PolarHBondContact O-N 3.28Å; E503-T506 VanDerWaalsContact O-N 3.12Å; E503-E507 PolarHBondContact O-N 2.62Å
504	C	94.1	Very high	91.2	Very high	3 Å²	3	47.7 Å²	47.7	2%	0.02	24%	0.238	C	C	.	.	H	α-helix	trans	-65.2	-39.9	176.4	-164.4	0	0	0	0	113.2	G465 I468 D501 T506 E507 L508	G465-C504 WeakPolarHBondContact CA-SG 3.36Å; G465-C504 PolarHBondContact N-SG 2.99Å; G465-C504 VanDerWaalsContact N-SG 3.41Å; I468-C504 HydrophobicContact CD1-CB 3.83Å; D501-C504 HydrophobicContact CB-CB 4.3Å; D501-C504 PolarHBondContact O-N 2.79Å; D501-C504 WeakPolarHBondContact OD1-CB 3.42Å; D501-C504 PolarHBondContact OD1-N 3.07Å; D501-C504 WeakPolarHBondContact OD2-CB 3.47Å; C504-T506 PolarHBondContact O-N 2.69Å; C504-E507 PolarHBondContact O-N 3.47Å; C504-L508 VanDerWaalsContact O-CG 3.32Å; C504-L508 WeakPolarHBondContact O-CG 3.42Å; C504-L508 PolarHBondContact O-N 3.31Å
505	M	96.3	Very high	89.9	Confident	5 Å²	5	55.4 Å²	55.4	3%	0.025	27%	0.271	C	S	.	.	H	α-helix	trans	-57.8	-36.8	173	-66.1	172.3	-175.5	0	0	111.5	I468 L498 L499 D501 E503 L509 L528 T532	I468-M505 HydrophobicContact CD1-CG 3.91Å; I468-M505 HydrophobicContact CG2-CG 4.37Å; L498-M505 WeakPolarHBondContact O-CE 3.44Å; L499-M505 WeakPolarHBondContact O-CE 3.33Å; D501-M505 WeakPolarHBondContact O-CG 3.15Å; D501-M505 PolarHBondContact O-N 3.14Å; E503-M505 PolarHBondContact O-N 3.46Å; M505-L509 WeakPolarHBondContact O-CG 3.42Å; M505-L509 PolarHBondContact O-N 2.95Å; M505-L528 HydrophobicContact CB-CD1 4.31Å; M505-L528 HydrophobicContact CG-CD1 4.14Å; M505-T532 HydrophobicContact SD-CG2 4.23Å; M505-T532 PolarHBondContact SD-OG1 3.4Å
506	T	95.8	Very high	88.7	Confident	10 Å²	10	58.6 Å²	58.6	6%	0.061	30%	0.304	C	S	.	.	H	α-helix	trans	-76.2	-40.9	178.5	-59.9	0	0	0	0	112.5	W502 E503 C504 L508 L509 L510 H573 A577	W502-T506 VanDerWaalsContact O-CB 3.27Å; W502-T506 WeakPolarHBondContact O-CB 3.17Å; W502-T506 PolarHBondContact O-N 3.11Å; W502-T506 PolarHBondContact O-OG1 2.88Å; E503-T506 WeakPolarHBondContact O-CB 3.36Å; E503-T506 PolarHBondContact O-N 3.28Å; E503-T506 VanDerWaalsContact O-N 3.12Å; C504-T506 PolarHBondContact O-N 2.69Å; T506-L508 VanDerWaalsContact C-N 3.26Å; T506-L508 PolarHBondContact O-N 2.71Å; T506-L509 PolarHBondContact O-N 3.33Å; T506-L509 VanDerWaalsContact O-N 3.16Å; T506-L510 HydrophobicContact CG2-CD1 3.63Å; T506-L510 HydrophobicContact CG2-CG 4.21Å; T506-L510 WeakPolarHBondContact O-CB 3.46Å; T506-L510 PolarHBondContact O-N 3.14Å; T506-H573 WeakPolarHBondContact CB-NE2 3.27Å; T506-H573 PolarHBondContact OG1-NE2 3.14Å; T506-A577 HydrophobicContact CG2-CB 3.71Å
507	E	93.1	Very high	87.9	Confident	29 Å²	29	55.8 Å²	55.8	14%	0.136	29%	0.291	C	S	.	.	H	α-helix	trans	-58	-38.9	172.8	-78.5	-174.2	-175.7	0	0	112	R460 S461 E503 C504 L509 E511	R460-E507 WeakPolarHBondContact CB-OE2 3.33Å; R460-E507 PolarHBondContact NH1-O 2.81Å; S461-E507 WeakPolarHBondContact CB-OE1 3.49Å; S461-E507 PolarHBondContact N-OE1 3.16Å; S461-E507 PolarHBondContact N-OE2 3.22Å; S461-E507 PolarHBondContact OG-OE1 3.36Å; S461-E507 PolarHBondContact OG-OE2 2.92Å; E503-E507 PolarHBondContact O-N 2.62Å; C504-E507 PolarHBondContact O-N 3.47Å; E507-L509 VanDerWaalsContact C-N 3.35Å; E507-E511 WeakPolarHBondContact O-CB 3.39Å; E507-E511 PolarHBondContact O-N 3.11Å; E507-E511 VanDerWaalsContact O-N 3.09Å
508	L	92.6	Very high	87.4	Confident	12 Å²	12	55.5 Å²	55.5	6%	0.063	29%	0.29	C	S	.	.	H	α-helix	trans	-68.1	-30.9	176.8	-73.5	173.9	0	0	0	113.3	I468 R469 C504 T506 L520 L528	I468-L508 HydrophobicContact CB-CD1 3.95Å; I468-L508 HydrophobicContact CD1-CD1 4.31Å; I468-L508 HydrophobicContact CG2-CD1 3.77Å; R469-L508 VanDerWaalsContact CZ-CD2 3.47Å; C504-L508 VanDerWaalsContact O-CG 3.32Å; C504-L508 WeakPolarHBondContact O-CG 3.42Å; C504-L508 PolarHBondContact O-N 3.31Å; T506-L508 VanDerWaalsContact C-N 3.26Å; T506-L508 PolarHBondContact O-N 2.71Å; L508-L520 HydrophobicContact CB-CD1 4.44Å; L508-L520 WeakPolarHBondContact O-CD1 3.45Å; L508-L528 HydrophobicContact CB-CD2 3.81Å; L508-L528 HydrophobicContact CD1-CD2 4.27Å
509	L	95.3	Very high	87	Confident	3 Å²	3	61.7 Å²	61.7	2%	0.016	32%	0.32	C	S	.	.	H	α-helix	trans	-87.9	-26.8	179	-70.1	169.6	0	0	0	113.5	M505 T506 E507 E525 L528 I529 L581 K584 Y585	M505-L509 WeakPolarHBondContact O-CG 3.42Å; M505-L509 PolarHBondContact O-N 2.95Å; T506-L509 PolarHBondContact O-N 3.33Å; T506-L509 VanDerWaalsContact O-N 3.16Å; E507-L509 VanDerWaalsContact C-N 3.35Å; L509-E525 HydrophobicContact CD2-CB 4.24Å; L509-E525 HydrophobicContact CD2-CG 4.46Å; L509-L528 HydrophobicContact CD1-CD2 4.44Å; L509-L528 HydrophobicContact CD1-CG 4.24Å; L509-L528 HydrophobicContact CD2-CB 4.23Å; L509-L528 HydrophobicContact CD2-CD2 3.86Å; L509-L528 HydrophobicContact CD2-CG 4.09Å; L509-L528 HydrophobicContact CG-CD2 3.78Å; L509-L528 HydrophobicContact CG-CG 4.09Å; L509-I529 HydrophobicContact CD1-CG1 3.77Å; L509-I529 HydrophobicContact CD2-CD1 4.38Å; L509-I529 HydrophobicContact CD2-CG1 4.03Å; L509-L581 HydrophobicContact CB-CD2 3.68Å; L509-L581 HydrophobicContact CD1-CD2 3.99Å; L509-L581 HydrophobicContact CG-CD2 4.48Å; L509-K584 WeakPolarHBondContact O-CD 3.28Å; L509-K584 PolarHBondContact O-NZ 2.89Å; L509-Y585 HydrophobicContact CB-CE2 4.46Å; L509-Y585 HydrophobicContact CD2-CE2 4.42Å; L509-Y585 WeakPolarHBondContact CD2-OH 2.8Å; L509-Y585 PolarHBondContact O-OH 3.41Å; L509-Y585 VanDerWaalsContact O-OH 3.12Å
510	L	92.8	Very high	86.7	Confident	51 Å²	51	62.3 Å²	62.3	27%	0.267	32%	0.323	S	S	.	.	H	α-helix	trans	-106.3	-32.3	-173.3	-68.5	-177.8	0	0	0	115.6	T506 M580 L581	T506-L510 HydrophobicContact CG2-CD1 3.63Å; T506-L510 HydrophobicContact CG2-CG 4.21Å; T506-L510 WeakPolarHBondContact O-CB 3.46Å; T506-L510 PolarHBondContact O-N 3.14Å; L510-M580 HydrophobicContact CD1-CB 3.97Å; L510-M580 HydrophobicContact CD1-CE 4.26Å; L510-M580 HydrophobicContact CD2-CB 4.15Å; L510-L581 HydrophobicContact CD1-CD2 4.39Å; L510-L581 HydrophobicContact CD1-CG 4.35Å; L510-L581 HydrophobicContact CD2-CD2 3.69Å; L510-L581 HydrophobicContact CD2-CG 4.08Å; L510-L581 HydrophobicContact CG-CD2 3.81Å; L510-L581 HydrophobicContact CG-CG 4.28Å
511	E	85.6	Confident	86.6	Confident	101 Å²	101	63.1 Å²	63.1	47%	0.472	33%	0.334	S	S	.	.	S	Bend	trans	-95	147.7	-173.4	-51.6	-171.9	125.1	0	0	113	R460 E507	R460-E511 IonicContact CZ-OE2 3.51Å; R460-E511 IonicContact NE-OE2 2.97Å; R460-E511 IonicContact NH1-OE2 3.29Å; R460-E511 PolarHBondContact NH1-OE2 2.81Å; E507-E511 WeakPolarHBondContact O-CB 3.39Å; E507-E511 PolarHBondContact O-N 3.11Å; E507-E511 VanDerWaalsContact O-N 3.09Å
512	E	79	Confident	86.5	Confident	175 Å²	175	66.4 Å²	66.4	82%	0.818	35%	0.351	S	S	*	.	P	Polyproline II helix	trans	-63.1	145.5	175.3	-67	-174	171.4	0	0	112.1	V514	E512-V514 PolarHBondContact O-N 3.37Å
513	P	74.6	Confident	86.4	Confident	55 Å²	55	72.6 Å²	72.6	36%	0.357	38%	0.375	S	S	.	.	P	Polyproline II helix	trans	-64.1	127.3	178.1	26.9	-35	0	0	0	111.3	E517 M519	P513-E517 HydrophobicContact CB-CB 4.01Å; P513-M519 HydrophobicContact CG-CB 4.05Å; P513-M519 HydrophobicContact CG-CG 4.09Å
514	V	75.9	Confident	86.4	Confident	49 Å²	49	69.1 Å²	69.1	30%	0.297	36%	0.359	S	S	.	.	P	Polyproline II helix	trans	-71.4	156	-180	-171.7	0	0	0	0	109.9	R458 E512 G516 E517	R458-V514 HydrophobicContact CB-CB 4.3Å; R458-V514 HydrophobicContact CB-CG1 4.29Å; R458-V514 HydrophobicContact CB-CG2 4.29Å; R458-V514 HydrophobicContact CG-CB 4.38Å; R458-V514 HydrophobicContact CG-CG1 4.41Å; R458-V514 WeakPolarHBondContact O-CG2 3.12Å; E512-V514 PolarHBondContact O-N 3.37Å; V514-G516 PolarHBondContact O-N 3.41Å; V514-E517 HydrophobicContact CB-CG 4.29Å; V514-E517 WeakPolarHBondContact O-CB 3.42Å; V514-E517 PolarHBondContact O-N 3.4Å
515	Q	64.8	Low	86.6	Confident	201 Å²	201	70.2 Å²	70.2	94%	0.939	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.2	112	-177.5	-69.2	-173	-7.2	0	0	112.5
516	G	68.7	Low	86.6	Confident	72 Å²	72	70.3 Å²	70.3	74%	0.742	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.9	15.5	-174.4	0	0	0	0	0	114.9	R458 V514	R458-G516 PolarHBondContact NH2-O 3.08Å; V514-G516 PolarHBondContact O-N 3.41Å
517	E	74.2	Confident	86.7	Confident	24 Å²	24	70 Å²	70	11%	0.112	36%	0.363	C	S	.	.	P	Polyproline II helix	trans	-98.3	147	155.7	-59.6	-153.1	118.8	0	0	110.2	R458 R460 R469 P513 V514	R458-E517 VanDerWaalsContact CD-OE1 3.29Å; R458-E517 WeakPolarHBondContact CD-OE1 3.12Å; R458-E517 IonicContact CZ-OE1 2.67Å; R458-E517 VanDerWaalsContact CZ-OE1 3.29Å; R458-E517 IonicContact NE-OE1 2.59Å; R458-E517 PolarHBondContact NE-OE1 2.84Å; R458-E517 IonicContact NH1-OE1 2.67Å; R458-E517 PolarHBondContact NH1-OE1 2.9Å; R460-E517 IonicContact CZ-OE2 2.67Å; R460-E517 IonicContact NE-OE2 3.17Å; R460-E517 IonicContact NH2-OE2 3.19Å; R460-E517 PolarHBondContact NH2-OE2 2.89Å; R469-E517 IonicContact CZ-OE1 3.74Å; R469-E517 IonicContact NH1-OE1 3.89Å; R469-E517 PolarHBondContact NH1-OE1 2.84Å; R469-E517 IonicContact NH2-OE1 2.71Å; R469-E517 PolarHBondContact NH2-OE1 2.94Å; R469-E517 IonicContact NH2-OE2 3.82Å; R469-E517 PolarHBondContact NH2-OE2 3.2Å; P513-E517 HydrophobicContact CB-CB 4.01Å; V514-E517 HydrophobicContact CB-CG 4.29Å; V514-E517 WeakPolarHBondContact O-CB 3.42Å; V514-E517 PolarHBondContact O-N 3.4Å
518	E	78.1	Confident	86.9	Confident	173 Å²	173	68.7 Å²	68.7	81%	0.808	36%	0.357	S	S	*	.	P	Polyproline II helix	trans	-83.6	143.5	164.5	-65.6	179.8	166.2	0	0	109.1
519	M	84	Confident	87.2	Confident	144 Å²	144	68.2 Å²	68.2	71%	0.709	35%	0.354	S	S	*	.	P	Polyproline II helix	trans	-72.3	144	173.5	-160.3	179.3	86	0	0	109.2	P513	P513-M519 HydrophobicContact CG-CB 4.05Å; P513-M519 HydrophobicContact CG-CG 4.09Å
520	L	90.7	Very high	87.3	Confident	13 Å²	13	68.9 Å²	68.9	7%	0.068	36%	0.357	C	S	.	.	P	Polyproline II helix	trans	-61.8	140	169.6	-61.6	-178.8	0	0	0	109.7	R469 L508 Q524 E525 L528	R469-L520 HydrophobicContact CG-CD2 4.15Å; L508-L520 HydrophobicContact CB-CD1 4.44Å; L508-L520 WeakPolarHBondContact O-CD1 3.45Å; L520-Q524 HydrophobicContact CB-CB 4.26Å; L520-Q524 HydrophobicContact CD2-CB 4.32Å; L520-E525 HydrophobicContact CB-CG 3.74Å; L520-E525 HydrophobicContact CD1-CG 4.18Å; L520-L528 HydrophobicContact CD1-CD2 3.8Å
521	S	94.1	Very high	87.6	Confident	59 Å²	59	66.7 Å²	66.7	41%	0.413	35%	0.346	S	S	.	.	P	Polyproline II helix	trans	-79.2	158.6	165.8	71.2	0	0	0	0	110.5	R523 Q524 E525	S521-R523 VanDerWaalsContact C-N 3.31Å; S521-R523 PolarHBondContact O-N 3.24Å; S521-Q524 CarbonylContact O-C 3.59Å; S521-Q524 WeakPolarHBondContact O-CA 3.28Å; S521-Q524 VanDerWaalsContact O-CB 3.3Å; S521-Q524 WeakPolarHBondContact O-CB 3.49Å; S521-Q524 PolarHBondContact O-N 3.46Å; S521-Q524 WeakPolarHBondContact OG-CG 3.43Å; S521-E525 PolarHBondContact O-N 3.08Å
522	D	95	Very high	88.2	Confident	91 Å²	91	62.1 Å²	62.1	49%	0.487	33%	0.325	S	S	.	.	H	α-helix	trans	-55.7	-42.3	-177.6	-176.7	84.2	0	0	0	113.3	Q524 E525 S526 K591	D522-Q524 VanDerWaalsContact C-N 3.27Å; D522-Q524 PolarHBondContact O-N 3.4Å; D522-E525 WeakPolarHBondContact O-CB 3.44Å; D522-E525 PolarHBondContact O-N 3.33Å; D522-S526 PolarHBondContact O-N 3.37Å; D522-K591 WeakPolarHBondContact O-CE 3.4Å; D522-K591 WeakPolarHBondContact OD1-CE 3.45Å; D522-K591 IonicContact OD1-NZ 2.67Å; D522-K591 PolarHBondContact OD1-NZ 3.21Å; D522-K591 VanDerWaalsContact OD1-NZ 3.1Å; D522-K591 IonicContact OD2-NZ 3.94Å; D522-K591 PolarHBondContact OD2-NZ 3.03Å
523	R	94.9	Very high	89.1	Confident	142 Å²	142	53.9 Å²	53.9	54%	0.536	29%	0.286	S	S	.	.	H	α-helix	trans	-62.6	-30.3	173.4	-170.8	177	176.5	-158.8	-8.3	112.5	L476 E479 S521 A527	L476-R523 HydrophobicContact CD1-CG 4.07Å; L476-R523 HydrophobicContact CD2-CG 3.73Å; L476-R523 PolarHBondContact O-NH2 2.93Å; E479-R523 IonicContact OE1-NH1 3.12Å; E479-R523 IonicContact OE1-NH2 3.77Å; S521-R523 VanDerWaalsContact C-N 3.31Å; S521-R523 PolarHBondContact O-N 3.24Å; R523-A527 WeakPolarHBondContact O-CB 3.24Å; R523-A527 PolarHBondContact O-N 3.42Å; R523-A527 VanDerWaalsContact O-N 3.17Å
524	Q	95.8	Very high	90.2	Very high	40 Å²	40	51.4 Å²	51.4	19%	0.187	27%	0.27	C	S	.	.	H	α-helix	trans	-75.9	-31.3	172.1	-69.2	170.4	-19.8	0	0	112.4	V472 L476 L520 S521 D522 L528	V472-Q524 HydrophobicContact CG1-CB 3.85Å; V472-Q524 HydrophobicContact CG1-CG 3.97Å; L476-Q524 HydrophobicContact CD1-CB 4.5Å; L476-Q524 HydrophobicContact CD1-CG 3.8Å; L520-Q524 HydrophobicContact CB-CB 4.26Å; L520-Q524 HydrophobicContact CD2-CB 4.32Å; S521-Q524 CarbonylContact O-C 3.59Å; S521-Q524 WeakPolarHBondContact O-CA 3.28Å; S521-Q524 VanDerWaalsContact O-CB 3.3Å; S521-Q524 WeakPolarHBondContact O-CB 3.49Å; S521-Q524 PolarHBondContact O-N 3.46Å; S521-Q524 WeakPolarHBondContact OG-CG 3.43Å; D522-Q524 VanDerWaalsContact C-N 3.27Å; D522-Q524 PolarHBondContact O-N 3.4Å; Q524-L528 VanDerWaalsContact O-CB 3.24Å; Q524-L528 WeakPolarHBondContact O-CB 3.38Å; Q524-L528 PolarHBondContact O-N 3.25Å
525	E	96.9	Very high	91.2	Very high	26 Å²	26	49 Å²	49	12%	0.121	26%	0.256	C	S	.	.	H	α-helix	trans	-69.4	-44.4	174	-62.3	-167.7	109.8	0	0	111.3	L509 L520 S521 D522 L528 I529 K584 Y585	L509-E525 HydrophobicContact CD2-CB 4.24Å; L509-E525 HydrophobicContact CD2-CG 4.46Å; L520-E525 HydrophobicContact CB-CG 3.74Å; L520-E525 HydrophobicContact CD1-CG 4.18Å; S521-E525 PolarHBondContact O-N 3.08Å; D522-E525 WeakPolarHBondContact O-CB 3.44Å; D522-E525 PolarHBondContact O-N 3.33Å; E525-L528 PolarHBondContact O-N 3.17Å; E525-I529 WeakPolarHBondContact O-CG1 3.31Å; E525-I529 PolarHBondContact O-N 3.19Å; E525-K584 WeakPolarHBondContact OE1-CE 3.26Å; E525-K584 IonicContact OE1-NZ 2.71Å; E525-K584 PolarHBondContact OE1-NZ 3.41Å; E525-Y585 HydrophobicContact CB-CE1 4.18Å; E525-Y585 VanDerWaalsContact CD-OH 3.31Å; E525-Y585 PolarHBondContact OE1-OH 3.39Å
526	S	96.9	Very high	92.8	Very high	6 Å²	6	39.5 Å²	39.5	4%	0.042	21%	0.211	C	C	.	.	H	α-helix	trans	-55	-54.3	170.1	-77	0	0	0	0	111.7	D522 L528 I529 E530 E590 K591	D522-S526 PolarHBondContact O-N 3.37Å; S526-L528 VanDerWaalsContact C-N 3.31Å; S526-L528 PolarHBondContact O-N 3.16Å; S526-I529 WeakPolarHBondContact O-CB 3.47Å; S526-I529 PolarHBondContact O-N 3.45Å; S526-I529 VanDerWaalsContact O-N 3.1Å; S526-E530 PolarHBondContact O-N 3.02Å; S526-E590 WeakPolarHBondContact CB-OE1 3.34Å; S526-E590 VanDerWaalsContact CB-OE2 3.28Å; S526-E590 WeakPolarHBondContact CB-OE2 3.35Å; S526-E590 VanDerWaalsContact OG-CD 3.28Å; S526-E590 PolarHBondContact OG-OE2 3.46Å; S526-K591 VanDerWaalsContact OG-CE 3.24Å; S526-K591 WeakPolarHBondContact OG-CE 3.44Å; S526-K591 WeakPolarHBondContact OG-CG 3.41Å; S526-K591 PolarHBondContact OG-NZ 2.96Å
527	A	97.4	Very high	94.1	Very high	3 Å²	3	39.5 Å²	39.5	3%	0.025	19%	0.189	C	C	.	.	H	α-helix	trans	-60.8	-35.9	-179.5	0	0	0	0	0	113.8	V472 F475 L476 R523 L531	V472-A527 HydrophobicContact CG1-CB 3.9Å; F475-A527 HydrophobicContact CD1-CB 3.82Å; F475-A527 HydrophobicContact CE1-CB 4.12Å; L476-A527 HydrophobicContact CD1-CB 4.17Å; L476-A527 HydrophobicContact CD2-CB 3.76Å; L476-A527 HydrophobicContact CG-CB 3.92Å; R523-A527 WeakPolarHBondContact O-CB 3.24Å; R523-A527 PolarHBondContact O-N 3.42Å; R523-A527 VanDerWaalsContact O-N 3.17Å; A527-L531 VanDerWaalsContact O-CB 3.32Å; A527-L531 WeakPolarHBondContact O-CB 3.26Å; A527-L531 WeakPolarHBondContact O-CD1 3.26Å; A527-L531 WeakPolarHBondContact O-CG 3.39Å; A527-L531 PolarHBondContact O-N 2.97Å
528	L	98.2	Very high	95.2	Very high	2 Å²	2	38.9 Å²	38.9	1%	0.01	19%	0.186	C	C	.	.	H	α-helix	trans	-70.8	-36.4	175.4	-179.4	54	0	0	0	111.9	I468 V472 M505 L508 L509 L520 Q524 E525 S526 T532	I468-L528 HydrophobicContact CG2-CD1 3.48Å; I468-L528 VanDerWaalsContact CG2-CD1 3.48Å; V472-L528 HydrophobicContact CG2-CB 3.88Å; V472-L528 HydrophobicContact CG2-CD1 3.99Å; V472-L528 HydrophobicContact CG2-CG 4.44Å; M505-L528 HydrophobicContact CB-CD1 4.31Å; M505-L528 HydrophobicContact CG-CD1 4.14Å; L508-L528 HydrophobicContact CB-CD2 3.81Å; L508-L528 HydrophobicContact CD1-CD2 4.27Å; L509-L528 HydrophobicContact CD1-CD2 4.44Å; L509-L528 HydrophobicContact CD1-CG 4.24Å; L509-L528 HydrophobicContact CD2-CB 4.23Å; L509-L528 HydrophobicContact CD2-CD2 3.86Å; L509-L528 HydrophobicContact CD2-CG 4.09Å; L509-L528 HydrophobicContact CG-CD2 3.78Å; L509-L528 HydrophobicContact CG-CG 4.09Å; L520-L528 HydrophobicContact CD1-CD2 3.8Å; Q524-L528 VanDerWaalsContact O-CB 3.24Å; Q524-L528 WeakPolarHBondContact O-CB 3.38Å; Q524-L528 PolarHBondContact O-N 3.25Å; E525-L528 PolarHBondContact O-N 3.17Å; S526-L528 VanDerWaalsContact C-N 3.31Å; S526-L528 PolarHBondContact O-N 3.16Å; L528-T532 VanDerWaalsContact O-CB 3.29Å; L528-T532 WeakPolarHBondContact O-CB 3.42Å; L528-T532 PolarHBondContact O-N 3.23Å; L528-T532 PolarHBondContact O-OG1 3.18Å
529	I	98.4	Very high	96	Very high	2 Å²	2	30.8 Å²	30.8	1%	0.01	15%	0.149	C	C	.	.	H	α-helix	trans	-65.1	-48.7	173.4	-72.7	167	0	0	0	110.4	L509 E525 S526 L531 T532 V533 Y585 K591 N594 L595	L509-I529 HydrophobicContact CD1-CG1 3.77Å; L509-I529 HydrophobicContact CD2-CD1 4.38Å; L509-I529 HydrophobicContact CD2-CG1 4.03Å; E525-I529 WeakPolarHBondContact O-CG1 3.31Å; E525-I529 PolarHBondContact O-N 3.19Å; S526-I529 WeakPolarHBondContact O-CB 3.47Å; S526-I529 PolarHBondContact O-N 3.45Å; S526-I529 VanDerWaalsContact O-N 3.1Å; I529-L531 PolarHBondContact O-N 3.42Å; I529-T532 WeakPolarHBondContact O-CB 3.37Å; I529-T532 PolarHBondContact O-N 2.77Å; I529-T532 VanDerWaalsContact O-N 3.1Å; I529-V533 HydrophobicContact CG2-CG2 4.48Å; I529-V533 WeakPolarHBondContact O-CG2 3.38Å; I529-V533 PolarHBondContact O-N 2.93Å; I529-Y585 HydrophobicContact CD1-CD2 3.94Å; I529-Y585 HydrophobicContact CD1-CE2 3.92Å; I529-Y585 HydrophobicContact CD1-CG 4.32Å; I529-K591 HydrophobicContact CD1-CB 3.89Å; I529-K591 HydrophobicContact CD1-CD 4.33Å; I529-K591 HydrophobicContact CD1-CG 3.97Å; I529-N594 HydrophobicContact CG2-CB 3.83Å; I529-L595 HydrophobicContact CD1-CD1 4.2Å; I529-L595 HydrophobicContact CD1-CG 4.39Å; I529-L595 HydrophobicContact CG1-CD2 4.46Å; I529-L595 HydrophobicContact CG2-CD2 4.18Å; I529-L595 HydrophobicContact CG2-CG 3.95Å
530	E	97.7	Very high	96.6	Very high	17 Å²	17	24.5 Å²	24.5	8%	0.079	12%	0.12	C	C	.	.	H	α-helix	trans	-58.5	-46.6	176.2	167.7	50.8	-148.8	0	0	112.2	F475 A484 S526 T532 V533 C534 N594	F475-E530 HydrophobicContact CE1-CG 4.38Å; F475-E530 HydrophobicContact CZ-CG 4.45Å; A484-E530 HydrophobicContact CB-CG 3.8Å; A484-E530 PolarHBondContact N-OE1 3.25Å; S526-E530 PolarHBondContact O-N 3.02Å; E530-T532 VanDerWaalsContact C-N 3.32Å; E530-T532 PolarHBondContact O-N 3.34Å; E530-V533 PolarHBondContact O-N 3.31Å; E530-C534 WeakPolarHBondContact O-CB 3.43Å; E530-C534 PolarHBondContact O-N 3.29Å; E530-C534 PolarHBondContact OE1-SG 3.36Å; E530-N594 PolarHBondContact OE2-ND2 2.97Å
531	L	97.9	Very high	96.6	Very high	5 Å²	5	27.2 Å²	27.2	3%	0.026	13%	0.132	C	C	.	.	H	α-helix	trans	-57.5	-44.3	172.1	-83.3	162.5	0	0	0	111.9	L471 V472 A484 V488 A527 I529 C534 T535	L471-L531 HydrophobicContact CD2-CD2 4.13Å; L471-L531 HydrophobicContact CG-CD1 4.18Å; L471-L531 HydrophobicContact CG-CD2 4.18Å; V472-L531 HydrophobicContact CB-CD1 4.42Å; V472-L531 HydrophobicContact CG2-CD1 3.73Å; A484-L531 HydrophobicContact CB-CD2 3.72Å; A484-L531 HydrophobicContact CB-CG 3.89Å; V488-L531 HydrophobicContact CG2-CD2 3.78Å; A527-L531 VanDerWaalsContact O-CB 3.32Å; A527-L531 WeakPolarHBondContact O-CB 3.26Å; A527-L531 WeakPolarHBondContact O-CD1 3.26Å; A527-L531 WeakPolarHBondContact O-CG 3.39Å; A527-L531 PolarHBondContact O-N 2.97Å; I529-L531 PolarHBondContact O-N 3.42Å; L531-C534 PolarHBondContact O-N 3.33Å; L531-T535 WeakPolarHBondContact O-CG2 3.33Å; L531-T535 PolarHBondContact O-N 2.99Å
532	T	98.3	Very high	96.5	Very high	6 Å²	6	25.9 Å²	25.9	4%	0.037	13%	0.125	C	C	.	.	H	α-helix	trans	-64.5	-45.8	-179.6	-59.6	0	0	0	0	111.7	M505 L528 I529 E530 C534 T535 I536 F574	M505-T532 HydrophobicContact SD-CG2 4.23Å; M505-T532 PolarHBondContact SD-OG1 3.4Å; L528-T532 VanDerWaalsContact O-CB 3.29Å; L528-T532 WeakPolarHBondContact O-CB 3.42Å; L528-T532 PolarHBondContact O-N 3.23Å; L528-T532 PolarHBondContact O-OG1 3.18Å; I529-T532 WeakPolarHBondContact O-CB 3.37Å; I529-T532 PolarHBondContact O-N 2.77Å; I529-T532 VanDerWaalsContact O-N 3.1Å; E530-T532 VanDerWaalsContact C-N 3.32Å; E530-T532 PolarHBondContact O-N 3.34Å; T532-C534 VanDerWaalsContact C-N 3.34Å; T532-C534 PolarHBondContact O-N 3.42Å; T532-T535 PolarHBondContact O-N 3.09Å; T532-T535 PolarHBondContact O-OG1 3.5Å; T532-I536 HydrophobicContact CG2-CD1 3.85Å; T532-I536 WeakPolarHBondContact O-CB 3.45Å; T532-I536 WeakPolarHBondContact O-CD1 3.24Å; T532-I536 VanDerWaalsContact O-CG1 3.23Å; T532-I536 WeakPolarHBondContact O-CG1 3.29Å; T532-I536 PolarHBondContact O-N 3.4Å; T532-F574 HydrophobicContact CG2-CE1 4.44Å; T532-F574 HydrophobicContact CG2-CZ 3.79Å
533	V	97.9	Very high	96.3	Very high	1 Å²	1	26.3 Å²	26.3	1%	0.006	12%	0.124	C	C	.	.	H	α-helix	trans	-63.6	-41.8	177.2	174.7	0	0	0	0	110.6	I529 E530 T535 I536 R537 N594 Q597 I598	I529-V533 HydrophobicContact CG2-CG2 4.48Å; I529-V533 WeakPolarHBondContact O-CG2 3.38Å; I529-V533 PolarHBondContact O-N 2.93Å; E530-V533 PolarHBondContact O-N 3.31Å; V533-T535 PolarHBondContact O-N 2.81Å; V533-I536 PolarHBondContact O-N 3.37Å; V533-R537 WeakPolarHBondContact O-CB 3.38Å; V533-R537 PolarHBondContact O-N 3.47Å; V533-N594 HydrophobicContact CG2-CB 4.11Å; V533-N594 VanDerWaalsContact CG2-O 3.32Å; V533-N594 WeakPolarHBondContact CG2-O 3.37Å; V533-Q597 HydrophobicContact CG1-CB 4.21Å; V533-I598 HydrophobicContact CG2-CD1 4.15Å; V533-I598 HydrophobicContact CG2-CG1 4.02Å
534	C	98.1	Very high	96.1	Very high	3 Å²	3	21 Å²	21	2%	0.02	11%	0.108	C	C	.	.	H	α-helix	trans	-63.2	-38.5	175.5	-84.8	0	0	0	0	113.8	A485 V488 E530 L531 T532 R537 Q538	A485-C534 WeakPolarHBondContact CA-SG 3.47Å; A485-C534 PolarHBondContact N-SG 3.09Å; A485-C534 VanDerWaalsContact N-SG 3.38Å; V488-C534 HydrophobicContact CB-CB 4.3Å; V488-C534 HydrophobicContact CG2-CB 3.82Å; E530-C534 WeakPolarHBondContact O-CB 3.43Å; E530-C534 PolarHBondContact O-N 3.29Å; E530-C534 PolarHBondContact OE1-SG 3.36Å; L531-C534 PolarHBondContact O-N 3.33Å; T532-C534 VanDerWaalsContact C-N 3.34Å; T532-C534 PolarHBondContact O-N 3.42Å; C534-R537 PolarHBondContact SG-NH2 2.87Å; C534-Q538 PolarHBondContact O-N 3.11Å; C534-Q538 VanDerWaalsContact O-N 3.08Å
535	T	98.2	Very high	95.9	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-74.5	-33.1	176.6	67.1	0	0	0	0	112.8	V488 W492 L499 W502 L531 T532 V533 A539	V488-T535 HydrophobicContact CG1-CG2 3.64Å; V488-T535 HydrophobicContact CG2-CG2 4.01Å; W492-T535 WeakPolarHBondContact CH2-O 3.25Å; W492-T535 HydrophobicContact CZ3-CG2 4.38Å; L499-T535 HydrophobicContact CB-CG2 3.84Å; L499-T535 HydrophobicContact CD2-CG2 3.91Å; L499-T535 HydrophobicContact CG-CG2 4.4Å; L499-T535 WeakPolarHBondContact O-CB 3.35Å; L499-T535 VanDerWaalsContact O-CG2 3.22Å; L499-T535 WeakPolarHBondContact O-CG2 3.33Å; L499-T535 PolarHBondContact O-OG1 3.05Å; W502-T535 PolarHBondContact NE1-OG1 3.37Å; L531-T535 WeakPolarHBondContact O-CG2 3.33Å; L531-T535 PolarHBondContact O-N 2.99Å; T532-T535 PolarHBondContact O-N 3.09Å; T532-T535 PolarHBondContact O-OG1 3.5Å; V533-T535 PolarHBondContact O-N 2.81Å; T535-A539 VanDerWaalsContact O-CB 3.29Å; T535-A539 WeakPolarHBondContact O-CB 3.49Å; T535-A539 PolarHBondContact O-N 3.44Å
536	I	98.1	Very high	95.5	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-60.9	-53	170.7	-71.4	165	0	0	0	110.1	W502 T532 V533 Q538 A539 A540 L570 F574 I598 F601	W502-I536 HydrophobicContact CZ2-CG1 4.41Å; T532-I536 HydrophobicContact CG2-CD1 3.85Å; T532-I536 WeakPolarHBondContact O-CB 3.45Å; T532-I536 WeakPolarHBondContact O-CD1 3.24Å; T532-I536 VanDerWaalsContact O-CG1 3.23Å; T532-I536 WeakPolarHBondContact O-CG1 3.29Å; T532-I536 PolarHBondContact O-N 3.4Å; V533-I536 PolarHBondContact O-N 3.37Å; I536-Q538 PolarHBondContact O-N 3.11Å; I536-A539 PolarHBondContact O-N 2.81Å; I536-A540 WeakPolarHBondContact O-CB 3.27Å; I536-A540 PolarHBondContact O-N 3.36Å; I536-L570 HydrophobicContact CG2-CD1 4.19Å; I536-L570 HydrophobicContact CG2-CD2 4.21Å; I536-F574 HydrophobicContact CD1-CD2 3.92Å; I536-F574 HydrophobicContact CD1-CE1 4.48Å; I536-F574 HydrophobicContact CD1-CE2 3.38Å; I536-F574 HydrophobicContact CD1-CZ 3.71Å; I536-F574 HydrophobicContact CG1-CE2 3.93Å; I536-I598 HydrophobicContact CD1-CD1 3.78Å; I536-I598 HydrophobicContact CD1-CG1 3.81Å; I536-I598 HydrophobicContact CD1-CG2 4.12Å; I536-F601 HydrophobicContact CG2-CB 3.97Å; I536-F601 HydrophobicContact CG2-CD2 3.6Å; I536-F601 HydrophobicContact CG2-CE2 4.4Å; I536-F601 HydrophobicContact CG2-CG 3.94Å
537	R	96.4	Very high	95	Very high	72 Å²	72	26.3 Å²	26.3	27%	0.272	15%	0.154	S	C	.	.	H	α-helix	trans	-55.2	-54.2	179.6	178.6	167.4	54.2	-162.9	-9	111.3	V533 C534 A539 A540 E541 F601	V533-R537 WeakPolarHBondContact O-CB 3.38Å; V533-R537 PolarHBondContact O-N 3.47Å; C534-R537 PolarHBondContact SG-NH2 2.87Å; R537-A539 VanDerWaalsContact C-N 3.28Å; R537-A539 PolarHBondContact O-N 2.79Å; R537-A540 PolarHBondContact O-N 3.37Å; R537-A540 VanDerWaalsContact O-N 3.17Å; R537-E541 HydrophobicContact CG-CG 4.28Å; R537-E541 WeakPolarHBondContact CG-OE1 3.32Å; R537-E541 WeakPolarHBondContact CG-OE2 3.26Å; R537-E541 WeakPolarHBondContact O-CB 3.34Å; R537-E541 WeakPolarHBondContact O-CG 3.48Å; R537-E541 PolarHBondContact O-N 3.15Å; R537-F601 HydrophobicContact CB-CE1 4.11Å; R537-F601 HydrophobicContact CB-CE2 4.23Å; R537-F601 HydrophobicContact CB-CZ 3.74Å; R537-F601 HydrophobicContact CG-CE1 3.95Å; R537-F601 HydrophobicContact CG-CZ 3.78Å
538	Q	95.7	Very high	94.6	Very high	11 Å²	11	26.6 Å²	26.6	5%	0.051	15%	0.154	C	C	.	.	H	α-helix	trans	-67.4	-24.8	-178.5	-165.3	168	15.5	0	0	113.4	D489 W492 C534 I536 A542	D489-Q538 VanDerWaalsContact CA-OE1 3.27Å; D489-Q538 PolarHBondContact OD1-NE2 3.48Å; W492-Q538 HydrophobicContact CD2-CB 4.42Å; W492-Q538 HydrophobicContact CD2-CG 3.85Å; W492-Q538 HydrophobicContact CE3-CB 4.29Å; W492-Q538 HydrophobicContact CE3-CG 4.2Å; W492-Q538 HydrophobicContact CG-CG 4.32Å; W492-Q538 HydrophobicContact CH2-CB 3.93Å; W492-Q538 HydrophobicContact CH2-CG 4.25Å; W492-Q538 HydrophobicContact CZ2-CB 4.05Å; W492-Q538 HydrophobicContact CZ2-CG 3.89Å; W492-Q538 WeakPolarHBondContact CZ2-O 3.46Å; W492-Q538 HydrophobicContact CZ3-CB 4.07Å; W492-Q538 HydrophobicContact CZ3-CG 4.39Å; C534-Q538 PolarHBondContact O-N 3.11Å; C534-Q538 VanDerWaalsContact O-N 3.08Å; I536-Q538 PolarHBondContact O-N 3.11Å; Q538-A542 WeakPolarHBondContact O-CA 3.43Å; Q538-A542 PolarHBondContact O-N 2.94Å
539	A	96.3	Very high	93.9	Very high	4 Å²	4	28.5 Å²	28.5	3%	0.033	17%	0.174	C	C	.	.	H	α-helix	trans	-72.6	-43.9	170.6	0	0	0	0	0	112.8	W492 W502 T535 I536 R537 D566	W492-A539 HydrophobicContact CH2-CB 3.95Å; W492-A539 HydrophobicContact CZ2-CB 4.26Å; W502-A539 HydrophobicContact CH2-CB 3.79Å; W502-A539 HydrophobicContact CZ2-CB 3.72Å; T535-A539 VanDerWaalsContact O-CB 3.29Å; T535-A539 WeakPolarHBondContact O-CB 3.49Å; T535-A539 PolarHBondContact O-N 3.44Å; I536-A539 PolarHBondContact O-N 2.81Å; R537-A539 VanDerWaalsContact C-N 3.28Å; R537-A539 PolarHBondContact O-N 2.79Å; A539-D566 HydrophobicContact CB-CB 4.46Å
540	A	94.9	Very high	92.7	Very high	12 Å²	12	33.7 Å²	33.7	10%	0.099	21%	0.207	C	C	.	.	H	α-helix	trans	-75.2	-43.3	-175.4	0	0	0	0	0	112.7	I536 R537 Q563 L570 F601	I536-A540 WeakPolarHBondContact O-CB 3.27Å; I536-A540 PolarHBondContact O-N 3.36Å; R537-A540 PolarHBondContact O-N 3.37Å; R537-A540 VanDerWaalsContact O-N 3.17Å; A540-Q563 WeakPolarHBondContact O-CG 3.47Å; A540-Q563 PolarHBondContact O-NE2 2.91Å; A540-L570 HydrophobicContact CB-CD2 4.31Å; A540-F601 HydrophobicContact CB-CB 3.75Å; A540-F601 HydrophobicContact CB-CD1 3.64Å; A540-F601 HydrophobicContact CB-CG 3.99Å
541	E	92	Very high	91.4	Very high	69 Å²	69	36 Å²	36	32%	0.322	24%	0.235	S	C	.	.	H	α-helix	trans	-78.8	-31.9	179.9	-67.3	174.2	175.3	0	0	112.6	R537 H543 Q563 F601	R537-E541 HydrophobicContact CG-CG 4.28Å; R537-E541 WeakPolarHBondContact CG-OE1 3.32Å; R537-E541 WeakPolarHBondContact CG-OE2 3.26Å; R537-E541 WeakPolarHBondContact O-CB 3.34Å; R537-E541 WeakPolarHBondContact O-CG 3.48Å; R537-E541 PolarHBondContact O-N 3.15Å; E541-H543 PolarHBondContact O-N 3.5Å; E541-H543 IonicContact OE2-CE1 2.74Å; E541-H543 PolarHBondContact OE2-CE1 3Å; E541-H543 IonicContact OE2-ND1 2.63Å; E541-H543 IonicContact OE2-NE2 3.14Å; E541-Q563 PolarHBondContact O-NE2 2.74Å; E541-F601 HydrophobicContact CG-CE1 4.23Å
542	A	92.3	Very high	90.1	Very high	32 Å²	32	45.2 Å²	45.2	26%	0.264	28%	0.275	S	S	.	.			trans	58.9	22	-177.8	0	0	0	0	0	115.8	Q538 L555 Q563	Q538-A542 WeakPolarHBondContact O-CA 3.43Å; Q538-A542 PolarHBondContact O-N 2.94Å; A542-L555 HydrophobicContact CB-CD1 3.92Å; A542-L555 HydrophobicContact CB-CD2 4.14Å; A542-Q563 HydrophobicContact CB-CB 4.2Å; A542-Q563 HydrophobicContact CB-CG 3.99Å
543	H	89.9	Confident	89.3	Confident	100 Å²	100	51.9 Å²	51.9	46%	0.463	30%	0.299	S	S	.	.	S	Bend	trans	-119.2	158	165.9	55.7	65.5	0	0	0	112.1	E541	E541-H543 PolarHBondContact O-N 3.5Å; E541-H543 IonicContact OE2-CE1 2.74Å; E541-H543 PolarHBondContact OE2-CE1 3Å; E541-H543 IonicContact OE2-ND1 2.63Å; E541-H543 IonicContact OE2-NE2 3.14Å
544	P	91.8	Very high	88.6	Confident	29 Å²	29	57.6 Å²	57.6	19%	0.188	33%	0.334	C	S	.	.	P	Polyproline II helix	trans	-61	166	168	-21.2	34.5	0	0	0	112.4	R548	P544-R548 HydrophobicContact CB-CB 3.79Å
545	P	91.4	Very high	88.1	Confident	28 Å²	28	59.2 Å²	59.2	18%	0.182	34%	0.342	C	S	.	.	P	Polyproline II helix	trans	-62.8	171.1	167.9	27.9	-35.7	0	0	0	112.4	A485 Y486 D489 R548 G549	A485-P545 HydrophobicContact CB-CB 4.37Å; Y486-P545 HydrophobicContact CD1-CB 4.43Å; Y486-P545 HydrophobicContact CD1-CG 3.78Å; Y486-P545 HydrophobicContact CE1-CB 4.14Å; Y486-P545 HydrophobicContact CE1-CG 3.89Å; D489-P545 HydrophobicContact CB-CG 4.09Å; P545-R548 HydrophobicContact CG-CB 4.44Å; P545-R548 WeakPolarHBondContact O-CB 3.5Å; P545-R548 PolarHBondContact O-N 2.96Å; P545-R548 VanDerWaalsContact O-N 3.13Å; P545-G549 PolarHBondContact O-N 2.85Å
546	V	88.3	Confident	87.8	Confident	111 Å²	111	62.8 Å²	62.8	67%	0.673	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.4	149.2	175.6	69.3	0	0	0	0	112	R548	V546-R548 PolarHBondContact O-N 2.8Å
547	G	85.6	Confident	87.6	Confident	46 Å²	46	67.1 Å²	67.1	47%	0.474	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.5	-18.7	-173.4	0	0	0	0	0	115.3
548	R	89.1	Confident	87.5	Confident	8 Å²	8	71.7 Å²	71.7	3%	0.03	42%	0.421	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.2	-13.3	-177.9	-69.8	-159.8	177.2	176.9	6.8	115.3	V423 S425 R428 A431 Y486 D489 S490 P544 P545 V546	V423-R548 PolarHBondContact O-NH2 3.16Å; S425-R548 PolarHBondContact O-NE 3.2Å; S425-R548 PolarHBondContact O-NH2 3.27Å; R428-R548 HydrophobicContact CB-CB 4.07Å; R428-R548 HydrophobicContact CB-CG 4.08Å; R428-R548 WeakPolarHBondContact CD-O 3.43Å; R428-R548 HydrophobicContact CG-CB 4.36Å; A431-R548 VanDerWaalsContact CB-NH2 3.32Å; Y486-R548 HydrophobicContact CD1-CG 4.33Å; Y486-R548 HydrophobicContact CE1-CG 4.32Å; Y486-R548 PolarHBondContact O-NH1 3.11Å; Y486-R548 PolarHBondContact O-NH2 2.94Å; D489-R548 WeakPolarHBondContact OD2-CD 3.25Å; D489-R548 IonicContact OD2-CZ 3.45Å; D489-R548 IonicContact OD2-NE 3.97Å; D489-R548 IonicContact OD2-NH1 3.89Å; D489-R548 PolarHBondContact OD2-NH1 3.11Å; S490-R548 PolarHBondContact OG-NH1 3.34Å; P544-R548 HydrophobicContact CB-CB 3.79Å; P545-R548 HydrophobicContact CG-CB 4.44Å; P545-R548 WeakPolarHBondContact O-CB 3.5Å; P545-R548 PolarHBondContact O-N 2.96Å; P545-R548 VanDerWaalsContact O-N 3.13Å; V546-R548 PolarHBondContact O-N 2.8Å
549	G	83.7	Confident	87.3	Confident	42 Å²	42	74.1 Å²	74.1	43%	0.433	43%	0.433	S	S	.	.	S	Bend	trans	-69.8	143.3	175.3	0	0	0	0	0	113.5	P545 G551	P545-G549 PolarHBondContact O-N 2.85Å; G549-G551 VanDerWaalsContact C-N 3.28Å; G549-G551 PolarHBondContact O-N 3.15Å
550	T	73.8	Confident	87.2	Confident	112 Å²	112	80.2 Å²	80.2	69%	0.687	46%	0.455	S	S	*	.			trans	-91.7	54.9	176.3	39.6	0	0	0	0	111.8
551	G	69.1	Low	87.3	Confident	65 Å²	65	85.4 Å²	85.4	67%	0.67	48%	0.475	S	S	*	.	S	Bend	trans	62.2	-159.9	-173.7	0	0	0	0	0	113.2	G549 R553	G549-G551 VanDerWaalsContact C-N 3.28Å; G549-G551 PolarHBondContact O-N 3.15Å; G551-R553 PolarHBondContact O-N 3.1Å
552	K	71.5	Confident	87.4	Confident	199 Å²	199	84.5 Å²	84.5	87%	0.865	48%	0.475	S	S	*	.	S	Bend	trans	-75	62.2	179.5	-65.1	-176.2	178.9	177.8	0	111.7
553	R	80.9	Confident	87.5	Confident	146 Å²	146	84.9 Å²	84.9	55%	0.551	47%	0.471	S	S	*	.	P	Polyproline II helix	trans	-67.9	125.2	178.3	177.5	-177.2	166.1	-152.1	-14.6	110.8	G551 E559	G551-R553 PolarHBondContact O-N 3.1Å; R553-E559 IonicContact CZ-OE1 2.67Å; R553-E559 IonicContact NH1-OE1 2.8Å; R553-E559 VanDerWaalsContact NH2-CD 3.27Å; R553-E559 IonicContact NH2-OE1 3.17Å; R553-E559 PolarHBondContact NH2-OE1 3.03Å; R553-E559 IonicContact NH2-OE2 3.82Å; R553-E559 PolarHBondContact NH2-OE2 3.32Å; R553-E559 VanDerWaalsContact NH2-OE2 3.14Å
554	V	84.2	Confident	87.7	Confident	121 Å²	121	84.4 Å²	84.4	73%	0.733	47%	0.471	S	S	*	.	P	Polyproline II helix	trans	-76.3	126.4	174.3	-176.2	0	0	0	0	110.8
555	L	87.4	Confident	87.9	Confident	37 Å²	37	85.9 Å²	85.9	19%	0.194	48%	0.477	C	S	.	.	P	Polyproline II helix	trans	-64.6	136.5	174.2	-62.1	174.5	0	0	0	111.8	A542 E559	A542-L555 HydrophobicContact CB-CD1 3.92Å; A542-L555 HydrophobicContact CB-CD2 4.14Å; L555-E559 HydrophobicContact CB-CB 4.33Å; L555-E559 HydrophobicContact CD2-CB 4.29Å
556	T	91.4	Very high	88.1	Confident	74 Å²	74	85 Å²	85	45%	0.454	47%	0.471	S	S	.	.	P	Polyproline II helix	trans	-68.5	161.7	171.7	63.9	0	0	0	0	111.6	K558 E559 R560	T556-K558 PolarHBondContact O-N 3.24Å; T556-K558 VanDerWaalsContact O-N 3.16Å; T556-E559 VanDerWaalsContact CB-OE2 3.26Å; T556-E559 WeakPolarHBondContact CB-OE2 3.5Å; T556-E559 VanDerWaalsContact CG2-OE2 3.27Å; T556-E559 WeakPolarHBondContact CG2-OE2 3.4Å; T556-E559 PolarHBondContact N-OE2 3.03Å; T556-E559 PolarHBondContact O-N 3.39Å; T556-E559 VanDerWaalsContact O-N 3.13Å; T556-E559 VanDerWaalsContact OG1-CD 3.26Å; T556-E559 WeakPolarHBondContact OG1-CG 3.07Å; T556-E559 PolarHBondContact OG1-N 3.3Å; T556-E559 PolarHBondContact OG1-OE2 2.71Å; T556-R560 WeakPolarHBondContact O-CB 3.4Å; T556-R560 PolarHBondContact O-N 2.84Å
557	A	94.6	Very high	88.4	Confident	91 Å²	91	82.6 Å²	82.6	75%	0.752	45%	0.452	S	S	*	.	H	α-helix	trans	-59.8	-25.3	176.8	0	0	0	0	0	113.8	K561	A557-K561 PolarHBondContact O-N 3.33Å
558	K	94.1	Very high	88.9	Confident	168 Å²	168	83.1 Å²	83.1	73%	0.73	44%	0.444	S	S	*	.	H	α-helix	trans	-73.3	-51.2	172.3	-172.1	-166.3	173.6	-163.4	0	110.7	T556 R560 K561 T562	T556-K558 PolarHBondContact O-N 3.24Å; T556-K558 VanDerWaalsContact O-N 3.16Å; K558-R560 PolarHBondContact O-N 3.07Å; K558-K561 PolarHBondContact O-N 2.67Å; K558-K561 VanDerWaalsContact O-N 3.11Å; K558-T562 PolarHBondContact O-N 3.13Å; K558-T562 PolarHBondContact O-OG1 2.65Å
559	E	92.1	Very high	89.1	Confident	63 Å²	63	88 Å²	88	29%	0.294	47%	0.465	S	S	.	.	H	α-helix	trans	-60.8	-44.3	-178.9	-69.1	160.4	140.7	0	0	111.3	R553 L555 T556 K561 T562 Q563	R553-E559 IonicContact CZ-OE1 2.67Å; R553-E559 IonicContact NH1-OE1 2.8Å; R553-E559 VanDerWaalsContact NH2-CD 3.27Å; R553-E559 IonicContact NH2-OE1 3.17Å; R553-E559 PolarHBondContact NH2-OE1 3.03Å; R553-E559 IonicContact NH2-OE2 3.82Å; R553-E559 PolarHBondContact NH2-OE2 3.32Å; R553-E559 VanDerWaalsContact NH2-OE2 3.14Å; L555-E559 HydrophobicContact CB-CB 4.33Å; L555-E559 HydrophobicContact CD2-CB 4.29Å; T556-E559 VanDerWaalsContact CB-OE2 3.26Å; T556-E559 WeakPolarHBondContact CB-OE2 3.5Å; T556-E559 VanDerWaalsContact CG2-OE2 3.27Å; T556-E559 WeakPolarHBondContact CG2-OE2 3.4Å; T556-E559 PolarHBondContact N-OE2 3.03Å; T556-E559 PolarHBondContact O-N 3.39Å; T556-E559 VanDerWaalsContact O-N 3.13Å; T556-E559 VanDerWaalsContact OG1-CD 3.26Å; T556-E559 WeakPolarHBondContact OG1-CG 3.07Å; T556-E559 PolarHBondContact OG1-N 3.3Å; T556-E559 PolarHBondContact OG1-OE2 2.71Å; E559-K561 VanDerWaalsContact C-N 3.31Å; E559-K561 PolarHBondContact O-N 3.06Å; E559-T562 PolarHBondContact O-N 2.97Å; E559-T562 VanDerWaalsContact O-N 3.16Å; E559-Q563 WeakPolarHBondContact O-CB 3.4Å; E559-Q563 PolarHBondContact O-N 3.13Å
560	R	93.8	Very high	89.7	Confident	131 Å²	131	86 Å²	86	49%	0.494	44%	0.444	S	S	.	.	H	α-helix	trans	-60.7	-36.4	173.7	-174.3	-177.9	-65.3	-89.2	-0.8	112.8	T556 K558 I564	T556-R560 WeakPolarHBondContact O-CB 3.4Å; T556-R560 PolarHBondContact O-N 2.84Å; K558-R560 PolarHBondContact O-N 3.07Å; R560-I564 HydrophobicContact CG-CD1 4.25Å; R560-I564 WeakPolarHBondContact O-CD1 3.27Å; R560-I564 WeakPolarHBondContact O-CG1 3.14Å; R560-I564 PolarHBondContact O-N 2.91Å
561	K	95.6	Very high	90.8	Very high	121 Å²	121	80.6 Å²	80.6	53%	0.526	41%	0.411	S	S	.	.	H	α-helix	trans	-67	-45.7	173.6	-168.4	-176.8	-176.5	-75.8	0	110.8	A557 K558 E559 Q563 I564 D565	A557-K561 PolarHBondContact O-N 3.33Å; K558-K561 PolarHBondContact O-N 2.67Å; K558-K561 VanDerWaalsContact O-N 3.11Å; E559-K561 VanDerWaalsContact C-N 3.31Å; E559-K561 PolarHBondContact O-N 3.06Å; K561-Q563 VanDerWaalsContact C-N 3.33Å; K561-Q563 PolarHBondContact O-N 3.4Å; K561-I564 PolarHBondContact O-N 2.86Å; K561-D565 IonicContact NZ-OD1 2.84Å; K561-D565 PolarHBondContact NZ-OD1 2.89Å; K561-D565 IonicContact NZ-OD2 3.14Å; K561-D565 PolarHBondContact NZ-OD2 3.42Å; K561-D565 WeakPolarHBondContact O-CB 3.22Å; K561-D565 VanDerWaalsContact O-CG 3.24Å; K561-D565 PolarHBondContact O-N 2.75Å
562	T	94.3	Very high	92	Very high	51 Å²	51	83.5 Å²	83.5	31%	0.313	41%	0.407	S	S	.	.	H	α-helix	trans	-60	-42.1	177.3	-63.9	0	0	0	0	111.8	K558 E559 I564 D565 D566	K558-T562 PolarHBondContact O-N 3.13Å; K558-T562 PolarHBondContact O-OG1 2.65Å; E559-T562 PolarHBondContact O-N 2.97Å; E559-T562 VanDerWaalsContact O-N 3.16Å; T562-I564 PolarHBondContact O-N 3.01Å; T562-D565 PolarHBondContact O-N 3.4Å; T562-D566 WeakPolarHBondContact CG2-OD2 3.5Å; T562-D566 VanDerWaalsContact O-CB 3.28Å; T562-D566 WeakPolarHBondContact O-CB 3.36Å; T562-D566 PolarHBondContact O-N 3.25Å
563	Q	94.9	Very high	93.2	Very high	40 Å²	40	76.3 Å²	76.3	19%	0.187	38%	0.377	C	S	.	.	H	α-helix	trans	-55.2	-46.4	173.1	-177.6	-176.6	26.5	0	0	112.3	A540 E541 A542 E559 K561 K567	A540-Q563 WeakPolarHBondContact O-CG 3.47Å; A540-Q563 PolarHBondContact O-NE2 2.91Å; E541-Q563 PolarHBondContact O-NE2 2.74Å; A542-Q563 HydrophobicContact CB-CB 4.2Å; A542-Q563 HydrophobicContact CB-CG 3.99Å; E559-Q563 WeakPolarHBondContact O-CB 3.4Å; E559-Q563 PolarHBondContact O-N 3.13Å; K561-Q563 VanDerWaalsContact C-N 3.33Å; K561-Q563 PolarHBondContact O-N 3.4Å; Q563-K567 VanDerWaalsContact O-CB 3.22Å; Q563-K567 WeakPolarHBondContact O-CB 3.43Å; Q563-K567 PolarHBondContact O-N 3.13Å
564	I	95	Very high	94	Very high	89 Å²	89	69.4 Å²	69.4	46%	0.456	35%	0.351	S	S	.	.	H	α-helix	trans	-70	-46.6	177.7	-64.3	163.8	0	0	0	111.1	R560 K561 T562 D566 K567 N568	R560-I564 HydrophobicContact CG-CD1 4.25Å; R560-I564 WeakPolarHBondContact O-CD1 3.27Å; R560-I564 WeakPolarHBondContact O-CG1 3.14Å; R560-I564 PolarHBondContact O-N 2.91Å; K561-I564 PolarHBondContact O-N 2.86Å; T562-I564 PolarHBondContact O-N 3.01Å; I564-D566 PolarHBondContact O-N 3.41Å; I564-K567 PolarHBondContact O-N 3.03Å; I564-N568 WeakPolarHBondContact O-CB 3.47Å; I564-N568 VanDerWaalsContact O-CG 3.23Å; I564-N568 PolarHBondContact O-N 3.33Å; I564-N568 PolarHBondContact O-OD1 3.19Å
565	D	95.1	Very high	94.6	Very high	60 Å²	60	63.8 Å²	63.8	32%	0.321	32%	0.316	S	S	.	.	H	α-helix	trans	-58.6	-34.6	178.1	-68.9	-24.1	0	0	0	111.3	K561 T562 K569	K561-D565 IonicContact NZ-OD1 2.84Å; K561-D565 PolarHBondContact NZ-OD1 2.89Å; K561-D565 IonicContact NZ-OD2 3.14Å; K561-D565 PolarHBondContact NZ-OD2 3.42Å; K561-D565 WeakPolarHBondContact O-CB 3.22Å; K561-D565 VanDerWaalsContact O-CG 3.24Å; K561-D565 PolarHBondContact O-N 2.75Å; T562-D565 PolarHBondContact O-N 3.4Å; D565-K569 VanDerWaalsContact O-CE 3.29Å; D565-K569 WeakPolarHBondContact O-CE 3.26Å; D565-K569 VanDerWaalsContact O-CG 3.3Å; D565-K569 WeakPolarHBondContact O-CG 3.46Å
566	D	95.3	Very high	95	Very high	10 Å²	10	66.7 Å²	66.7	5%	0.053	33%	0.33	C	S	.	.	H	α-helix	trans	-84.1	-38	179.1	-67.6	-20.5	0	0	0	112.5	K500 W502 A539 T562 I564 N568 K569 L570	K500-D566 IonicContact NZ-OD2 3.11Å; K500-D566 PolarHBondContact NZ-OD2 3.48Å; W502-D566 HydrophobicContact CH2-CB 4.33Å; A539-D566 HydrophobicContact CB-CB 4.46Å; T562-D566 WeakPolarHBondContact CG2-OD2 3.5Å; T562-D566 VanDerWaalsContact O-CB 3.28Å; T562-D566 WeakPolarHBondContact O-CB 3.36Å; T562-D566 PolarHBondContact O-N 3.25Å; I564-D566 PolarHBondContact O-N 3.41Å; D566-N568 VanDerWaalsContact C-N 3.27Å; D566-N568 PolarHBondContact O-N 2.97Å; D566-K569 PolarHBondContact O-N 2.95Å; D566-K569 IonicContact OD1-NZ 3.13Å; D566-K569 PolarHBondContact OD1-NZ 3.31Å; D566-L570 PolarHBondContact O-N 2.86Å
567	K	95.6	Very high	95.2	Very high	61 Å²	61	63.4 Å²	63.4	27%	0.265	31%	0.311	S	S	.	.	H	α-helix	trans	-60.6	-35.7	171.9	175.9	166.5	168.8	122.2	0	112.1	Q563 I564 L570 T571 F601 F602	Q563-K567 VanDerWaalsContact O-CB 3.22Å; Q563-K567 WeakPolarHBondContact O-CB 3.43Å; Q563-K567 PolarHBondContact O-N 3.13Å; I564-K567 PolarHBondContact O-N 3.03Å; K567-L570 WeakPolarHBondContact O-CG 3.36Å; K567-T571 WeakPolarHBondContact O-CB 3.5Å; K567-T571 PolarHBondContact O-N 3.15Å; K567-T571 VanDerWaalsContact O-N 3.16Å; K567-T571 PolarHBondContact O-OG1 3.31Å; K567-F601 VanDerWaalsContact CE-O 3.28Å; K567-F601 WeakPolarHBondContact CE-O 3.49Å; K567-F601 PolarHBondContact NZ-O 3.34Å; K567-F602 VanDerWaalsContact CE-C 3.41Å; K567-F602 VanDerWaalsContact CE-O 3.22Å; K567-F602 WeakPolarHBondContact CE-O 3.22Å; K567-F602 VanDerWaalsContact NZ-C 3.3Å; K567-F602 PolarHBondContact NZ-O 3.49Å
568	N	94.4	Very high	95.4	Very high	57 Å²	57	59.1 Å²	59.1	31%	0.305	28%	0.275	S	S	.	.	H	α-helix	trans	-67.9	-46	176.1	-68.2	9.4	0	0	0	111.1	I564 D566 T571 E572	I564-N568 WeakPolarHBondContact O-CB 3.47Å; I564-N568 VanDerWaalsContact O-CG 3.23Å; I564-N568 PolarHBondContact O-N 3.33Å; I564-N568 PolarHBondContact O-OD1 3.19Å; D566-N568 VanDerWaalsContact C-N 3.27Å; D566-N568 PolarHBondContact O-N 2.97Å; N568-T571 PolarHBondContact O-N 3.27Å; N568-E572 WeakPolarHBondContact O-CG 3.24Å; N568-E572 PolarHBondContact O-N 3.15Å
569	K	94.8	Very high	95.6	Very high	109 Å²	109	51.7 Å²	51.7	47%	0.474	24%	0.244	S	C	.	.	H	α-helix	trans	-60.2	-48	177.3	-66.4	165.9	-157.5	159.6	0	113	W502 D565 D566 T571 E572 H573	W502-K569 HydrophobicContact CZ3-CB 4.33Å; D565-K569 VanDerWaalsContact O-CE 3.29Å; D565-K569 WeakPolarHBondContact O-CE 3.26Å; D565-K569 VanDerWaalsContact O-CG 3.3Å; D565-K569 WeakPolarHBondContact O-CG 3.46Å; D566-K569 PolarHBondContact O-N 2.95Å; D566-K569 IonicContact OD1-NZ 3.13Å; D566-K569 PolarHBondContact OD1-NZ 3.31Å; K569-T571 PolarHBondContact O-N 3.35Å; K569-E572 PolarHBondContact O-N 3.43Å; K569-H573 WeakPolarHBondContact O-CB 3.31Å; K569-H573 PolarHBondContact O-N 3.41Å
570	L	95.9	Very high	95.8	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-63.4	-35.5	-179.8	76.3	87.7	0	0	0	110.8	W502 I536 A540 D566 K567 F574 F601 F602	W502-L570 HydrophobicContact CD2-CB 4.41Å; W502-L570 HydrophobicContact CE3-CB 3.87Å; W502-L570 HydrophobicContact CH2-CB 3.93Å; W502-L570 HydrophobicContact CH2-CD2 4.08Å; W502-L570 HydrophobicContact CZ2-CB 4.46Å; W502-L570 HydrophobicContact CZ3-CB 3.62Å; I536-L570 HydrophobicContact CG2-CD1 4.19Å; I536-L570 HydrophobicContact CG2-CD2 4.21Å; A540-L570 HydrophobicContact CB-CD2 4.31Å; D566-L570 PolarHBondContact O-N 2.86Å; K567-L570 WeakPolarHBondContact O-CG 3.36Å; L570-F574 HydrophobicContact CB-CD2 4.3Å; L570-F574 WeakPolarHBondContact O-CB 3.49Å; L570-F574 WeakPolarHBondContact O-CD2 3.31Å; L570-F574 PolarHBondContact O-N 3.39Å; L570-F601 HydrophobicContact CD1-CB 4.2Å; L570-F602 HydrophobicContact CD1-CD1 3.84Å; L570-F602 HydrophobicContact CD1-CE1 4.17Å
571	T	96.1	Very high	96	Very high	0 Å²	0	48 Å²	48	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-67.1	-51.8	176.2	-56.5	0	0	0	0	111.3	K567 N568 K569 H573 I575 F602 D603 V606	K567-T571 WeakPolarHBondContact O-CB 3.5Å; K567-T571 PolarHBondContact O-N 3.15Å; K567-T571 VanDerWaalsContact O-N 3.16Å; K567-T571 PolarHBondContact O-OG1 3.31Å; N568-T571 PolarHBondContact O-N 3.27Å; K569-T571 PolarHBondContact O-N 3.35Å; T571-H573 VanDerWaalsContact C-N 3.27Å; T571-H573 PolarHBondContact O-N 2.95Å; T571-I575 HydrophobicContact CG2-CD1 3.58Å; T571-I575 HydrophobicContact CG2-CG1 4.18Å; T571-I575 VanDerWaalsContact O-CB 3.26Å; T571-I575 WeakPolarHBondContact O-CB 3.44Å; T571-I575 WeakPolarHBondContact O-CG1 3.41Å; T571-I575 PolarHBondContact O-N 2.95Å; T571-F602 HydrophobicContact CG2-CB 4.03Å; T571-F602 HydrophobicContact CG2-CD1 4.46Å; T571-F602 HydrophobicContact CG2-CG 4.12Å; T571-F602 WeakPolarHBondContact OG1-CA 3.49Å; T571-D603 HydrophobicContact CG2-CB 4.48Å; T571-D603 WeakPolarHBondContact CG2-O 3.21Å; T571-D603 PolarHBondContact OG1-N 3.22Å; T571-V606 HydrophobicContact CG2-CB 3.77Å; T571-V606 HydrophobicContact CG2-CG1 4.09Å; T571-V606 HydrophobicContact CG2-CG2 3.85Å
572	E	94.4	Very high	96.1	Very high	125 Å²	125	42.2 Å²	42.2	58%	0.584	21%	0.209	S	C	*	.	H	α-helix	trans	-57.2	-39.6	179.2	-73.7	179	166.6	0	0	112.3	N568 K569 V606	N568-E572 WeakPolarHBondContact O-CG 3.24Å; N568-E572 PolarHBondContact O-N 3.15Å; K569-E572 PolarHBondContact O-N 3.43Å; E572-V606 HydrophobicContact CG-CG1 4.32Å
573	H	96.3	Very high	96.3	Very high	49 Å²	49	42.2 Å²	42.2	23%	0.227	21%	0.211	C	C	.	.	H	α-helix	trans	-74	-58.3	177.6	-179.7	65.9	0	0	0	113.2	W502 T506 K569 T571 I575 M576 A577	W502-H573 PolarHBondContact O-NE2 3.12Å; T506-H573 WeakPolarHBondContact CB-NE2 3.27Å; T506-H573 PolarHBondContact OG1-NE2 3.14Å; K569-H573 WeakPolarHBondContact O-CB 3.31Å; K569-H573 PolarHBondContact O-N 3.41Å; T571-H573 VanDerWaalsContact C-N 3.27Å; T571-H573 PolarHBondContact O-N 2.95Å; H573-I575 VanDerWaalsContact C-N 3.33Å; H573-I575 PolarHBondContact O-N 2.93Å; H573-M576 PolarHBondContact O-N 2.76Å; H573-A577 PolarHBondContact O-N 2.88Å
574	F	97.9	Very high	96.4	Very high	1 Å²	1	45 Å²	45	0%	0.004	22%	0.223	C	C	.	.	H	α-helix	trans	-74.6	-18.9	-171.2	-74.8	-70.6	0	0	0	114.1	W502 T532 I536 L570 M576 A577 L578 L581 I598 F602	W502-F574 HydrophobicContact CB-CE2 3.69Å; W502-F574 HydrophobicContact CB-CZ 3.87Å; W502-F574 HydrophobicContact CD2-CE2 4.4Å; W502-F574 AromaticContact CG-CE2 3.83Å; W502-F574 HydrophobicContact CG-CE2 3.83Å; W502-F574 HydrophobicContact CG-CZ 4.26Å; T532-F574 HydrophobicContact CG2-CE1 4.44Å; T532-F574 HydrophobicContact CG2-CZ 3.79Å; I536-F574 HydrophobicContact CD1-CD2 3.92Å; I536-F574 HydrophobicContact CD1-CE1 4.48Å; I536-F574 HydrophobicContact CD1-CE2 3.38Å; I536-F574 HydrophobicContact CD1-CZ 3.71Å; I536-F574 HydrophobicContact CG1-CE2 3.93Å; L570-F574 HydrophobicContact CB-CD2 4.3Å; L570-F574 WeakPolarHBondContact O-CB 3.49Å; L570-F574 WeakPolarHBondContact O-CD2 3.31Å; L570-F574 PolarHBondContact O-N 3.39Å; F574-M576 PolarHBondContact O-N 2.8Å; F574-A577 HydrophobicContact CD1-CB 4.17Å; F574-A577 PolarHBondContact O-N 3.13Å; F574-L578 WeakPolarHBondContact O-CB 3.3Å; F574-L578 PolarHBondContact O-N 2.75Å; F574-L581 HydrophobicContact CD1-CD1 4.37Å; F574-L581 HydrophobicContact CE1-CD1 4.13Å; F574-I598 HydrophobicContact CB-CG2 3.81Å; F574-I598 HydrophobicContact CD1-CD1 4.39Å; F574-I598 HydrophobicContact CD1-CG2 4.31Å; F574-I598 HydrophobicContact CD2-CG2 4.21Å; F574-I598 HydrophobicContact CE1-CD1 4.36Å; F574-I598 HydrophobicContact CG-CG2 3.86Å; F574-F602 HydrophobicContact CB-CE1 3.68Å; F574-F602 HydrophobicContact CB-CZ 3.65Å
575	I	96.8	Very high	96.5	Very high	2 Å²	2	41.4 Å²	41.4	1%	0.01	20%	0.203	C	C	.	.	H	α-helix	trans	-53.9	-38.3	165	-80.4	177.4	0	0	0	110.9	T571 H573 F602 V606 Y607 M612 H615	T571-I575 HydrophobicContact CG2-CD1 3.58Å; T571-I575 HydrophobicContact CG2-CG1 4.18Å; T571-I575 VanDerWaalsContact O-CB 3.26Å; T571-I575 WeakPolarHBondContact O-CB 3.44Å; T571-I575 WeakPolarHBondContact O-CG1 3.41Å; T571-I575 PolarHBondContact O-N 2.95Å; H573-I575 VanDerWaalsContact C-N 3.33Å; H573-I575 PolarHBondContact O-N 2.93Å; I575-F602 HydrophobicContact CG1-CD2 4.09Å; I575-F602 HydrophobicContact CG1-CE2 3.79Å; I575-F602 HydrophobicContact CG1-CZ 4.39Å; I575-V606 HydrophobicContact CD1-CB 4.13Å; I575-V606 HydrophobicContact CD1-CG1 3.87Å; I575-Y607 HydrophobicContact CB-CE1 4.39Å; I575-Y607 HydrophobicContact CD1-CD1 4Å; I575-Y607 HydrophobicContact CD1-CD2 4.26Å; I575-Y607 HydrophobicContact CD1-CE1 3.94Å; I575-Y607 HydrophobicContact CD1-CE2 4.21Å; I575-Y607 HydrophobicContact CD1-CG 4.17Å; I575-Y607 HydrophobicContact CG1-CD1 4.37Å; I575-Y607 HydrophobicContact CG1-CE1 3.8Å; I575-Y607 HydrophobicContact CG1-CE2 4.26Å; I575-Y607 HydrophobicContact CG2-CD1 4.31Å; I575-Y607 HydrophobicContact CG2-CE1 3.86Å; I575-M612 HydrophobicContact CG2-CB 3.74Å; I575-M612 HydrophobicContact CG2-CG 4.1Å; I575-H615 HydrophobicContact CG2-CB 3.84Å; I575-H615 WeakPolarHBondContact O-CB 3.29Å
576	M	95.7	Very high	96.5	Very high	98 Å²	98	40.5 Å²	40.5	48%	0.483	20%	0.197	S	C	.	.	H	α-helix	trans	-86.2	-42.6	178.8	-65.4	-171.9	52.2	0	0	112.7	H573 F574	H573-M576 PolarHBondContact O-N 2.76Å; F574-M576 PolarHBondContact O-N 2.8Å
577	A	97	Very high	96.5	Very high	6 Å²	6	44.2 Å²	44.2	5%	0.05	23%	0.229	C	C	.	.	H	α-helix	trans	-79	-38.1	-173.1	0	0	0	0	0	114.9	T506 H573 F574 M580 L581	T506-A577 HydrophobicContact CG2-CB 3.71Å; H573-A577 PolarHBondContact O-N 2.88Å; F574-A577 HydrophobicContact CD1-CB 4.17Å; F574-A577 PolarHBondContact O-N 3.13Å; A577-M580 WeakPolarHBondContact O-CA 3.42Å; A577-M580 WeakPolarHBondContact O-CB 3.21Å; A577-M580 PolarHBondContact O-N 3.01Å; A577-L581 HydrophobicContact CB-CD1 4.41Å; A577-L581 PolarHBondContact O-N 3.36Å
578	L	97.8	Very high	96.6	Very high	1 Å²	1	43.3 Å²	43.3	1%	0.005	23%	0.227	C	C	.	.	H	α-helix	trans	-60.4	-41.3	-171	-179.6	63.6	0	0	0	114.1	F574 M580 L581 L582 L595 I598 P599 L619	F574-L578 WeakPolarHBondContact O-CB 3.3Å; F574-L578 PolarHBondContact O-N 2.75Å; L578-M580 PolarHBondContact O-N 2.98Å; L578-L581 PolarHBondContact O-N 3.46Å; L578-L582 HydrophobicContact CD1-CD1 4.15Å; L578-L582 HydrophobicContact CD1-CG 3.95Å; L578-L582 HydrophobicContact CG-CD1 4.01Å; L578-L582 HydrophobicContact CG-CG 4.28Å; L578-L582 WeakPolarHBondContact O-CG 3.32Å; L578-L582 PolarHBondContact O-N 3.46Å; L578-L595 HydrophobicContact CD1-CB 3.98Å; L578-L595 HydrophobicContact CD1-CD2 4.14Å; L578-L595 WeakPolarHBondContact CD1-O 3.38Å; L578-I598 HydrophobicContact CD1-CD1 4.4Å; L578-I598 HydrophobicContact CD2-CB 4.33Å; L578-I598 HydrophobicContact CD2-CG2 4.46Å; L578-P599 HydrophobicContact CD2-CG 3.38Å; L578-L619 HydrophobicContact CD2-CD1 3.81Å; L578-L619 HydrophobicContact CG-CD1 4.06Å
579	P	97.9	Very high	96.7	Very high	12 Å²	12	41.9 Å²	41.9	8%	0.078	22%	0.223	C	C	.	.	H	α-helix	trans	-62.6	-24.1	174.9	-23.1	35	0	0	0	113.7	S583 A618 L619	P579-S583 VanDerWaalsContact O-CB 3.28Å; P579-S583 WeakPolarHBondContact O-CB 3.27Å; P579-S583 PolarHBondContact O-N 2.84Å; P579-A618 HydrophobicContact CB-CB 3.93Å; P579-A618 HydrophobicContact CG-CB 4.24Å; P579-L619 HydrophobicContact CG-CB 4.12Å
580	M	97.6	Very high	96.7	Very high	114 Å²	114	41.8 Å²	41.8	56%	0.562	22%	0.224	S	C	*	.	H	α-helix	trans	-81	-43.6	175.2	-63	177.2	61.6	0	0	111.3	L510 A577 L578 S583 K584	L510-M580 HydrophobicContact CD1-CB 3.97Å; L510-M580 HydrophobicContact CD1-CE 4.26Å; L510-M580 HydrophobicContact CD2-CB 4.15Å; A577-M580 WeakPolarHBondContact O-CA 3.42Å; A577-M580 WeakPolarHBondContact O-CB 3.21Å; A577-M580 PolarHBondContact O-N 3.01Å; L578-M580 PolarHBondContact O-N 2.98Å; M580-S583 WeakPolarHBondContact O-CB 3.35Å; M580-S583 PolarHBondContact O-N 3.12Å; M580-S583 VanDerWaalsContact O-N 3.17Å; M580-K584 PolarHBondContact O-N 3.46Å
581	L	98	Very high	96.8	Very high	1 Å²	1	41.9 Å²	41.9	1%	0.005	23%	0.225	C	C	.	.	H	α-helix	trans	-59	-51.4	175.2	-70.6	164.8	0	0	0	111	L509 L510 F574 A577 L578 S583 K584 Y585 L595	L509-L581 HydrophobicContact CB-CD2 3.68Å; L509-L581 HydrophobicContact CD1-CD2 3.99Å; L509-L581 HydrophobicContact CG-CD2 4.48Å; L510-L581 HydrophobicContact CD1-CD2 4.39Å; L510-L581 HydrophobicContact CD1-CG 4.35Å; L510-L581 HydrophobicContact CD2-CD2 3.69Å; L510-L581 HydrophobicContact CD2-CG 4.08Å; L510-L581 HydrophobicContact CG-CD2 3.81Å; L510-L581 HydrophobicContact CG-CG 4.28Å; F574-L581 HydrophobicContact CD1-CD1 4.37Å; F574-L581 HydrophobicContact CE1-CD1 4.13Å; A577-L581 HydrophobicContact CB-CD1 4.41Å; A577-L581 PolarHBondContact O-N 3.36Å; L578-L581 PolarHBondContact O-N 3.46Å; L581-S583 VanDerWaalsContact C-N 3.3Å; L581-S583 PolarHBondContact O-N 2.76Å; L581-K584 PolarHBondContact O-N 2.71Å; L581-K584 VanDerWaalsContact O-N 3.07Å; L581-Y585 HydrophobicContact CD2-CE2 4.1Å; L581-Y585 VanDerWaalsContact O-CD2 3.23Å; L581-Y585 WeakPolarHBondContact O-CD2 3.37Å; L581-Y585 PolarHBondContact O-N 3.18Å; L581-L595 HydrophobicContact CB-CD1 3.98Å; L581-L595 HydrophobicContact CB-CD2 3.97Å; L581-L595 HydrophobicContact CD1-CD2 4Å; L581-L595 HydrophobicContact CG-CD2 4.49Å
582	L	98.1	Very high	96.8	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-57.3	-43.6	173.5	-68.6	172.9	0	0	0	111	L578 K584 Y585 Q586 V592 L595 L596 L619 Q622	L578-L582 HydrophobicContact CD1-CD1 4.15Å; L578-L582 HydrophobicContact CD1-CG 3.95Å; L578-L582 HydrophobicContact CG-CD1 4.01Å; L578-L582 HydrophobicContact CG-CG 4.28Å; L578-L582 WeakPolarHBondContact O-CG 3.32Å; L578-L582 PolarHBondContact O-N 3.46Å; L582-K584 PolarHBondContact O-N 3.31Å; L582-Y585 PolarHBondContact O-N 2.86Å; L582-Q586 WeakPolarHBondContact O-CA 3.45Å; L582-Q586 WeakPolarHBondContact O-CB 3.44Å; L582-Q586 WeakPolarHBondContact O-CG 3.49Å; L582-Q586 PolarHBondContact O-N 2.94Å; L582-V592 HydrophobicContact CD2-CB 4.35Å; L582-V592 HydrophobicContact CD2-CG1 4.34Å; L582-L595 HydrophobicContact CD2-CB 3.77Å; L582-L595 HydrophobicContact CD2-CD1 4.24Å; L582-L596 HydrophobicContact CD1-CD2 4.28Å; L582-L596 HydrophobicContact CD2-CD2 4.32Å; L582-L596 HydrophobicContact CD2-CG 4.22Å; L582-L619 HydrophobicContact CD1-CD1 3.69Å; L582-Q622 HydrophobicContact CB-CB 3.99Å; L582-Q622 HydrophobicContact CB-CG 4.45Å; L582-Q622 HydrophobicContact CD1-CB 4.22Å
583	S	97.3	Very high	97	Very high	51 Å²	51	36.5 Å²	36.5	36%	0.357	20%	0.202	S	C	.	.	H	α-helix	trans	-63.1	-22.9	178.1	-161.4	0	0	0	0	114.6	P579 M580 L581 Q586 Q622	P579-S583 VanDerWaalsContact O-CB 3.28Å; P579-S583 WeakPolarHBondContact O-CB 3.27Å; P579-S583 PolarHBondContact O-N 2.84Å; M580-S583 WeakPolarHBondContact O-CB 3.35Å; M580-S583 PolarHBondContact O-N 3.12Å; M580-S583 VanDerWaalsContact O-N 3.17Å; L581-S583 VanDerWaalsContact C-N 3.3Å; L581-S583 PolarHBondContact O-N 2.76Å; S583-Q586 PolarHBondContact O-NE2 2.58Å; S583-Q622 PolarHBondContact OG-NE2 3.35Å; S583-Q622 VanDerWaalsContact OG-NE2 3.14Å
584	K	96.9	Very high	97	Very high	100 Å²	100	35.2 Å²	35.2	44%	0.435	20%	0.197	S	C	.	.	H	α-helix	trans	-82.5	-48.7	172.8	-179.9	176.6	168.4	-173.6	0	111.1	L509 E525 M580 L581 L582	L509-K584 WeakPolarHBondContact O-CD 3.28Å; L509-K584 PolarHBondContact O-NZ 2.89Å; E525-K584 WeakPolarHBondContact OE1-CE 3.26Å; E525-K584 IonicContact OE1-NZ 2.71Å; E525-K584 PolarHBondContact OE1-NZ 3.41Å; M580-K584 PolarHBondContact O-N 3.46Å; L581-K584 PolarHBondContact O-N 2.71Å; L581-K584 VanDerWaalsContact O-N 3.07Å; L582-K584 PolarHBondContact O-N 3.31Å
585	Y	97	Very high	97	Very high	12 Å²	12	35.3 Å²	35.3	5%	0.047	20%	0.197	C	C	.	.	H	α-helix	trans	-97.5	4.2	-168.8	-57	-70.5	0	0	0	115.6	L509 E525 I529 L581 L582 A587 D588 K591 V592 L595	L509-Y585 HydrophobicContact CB-CE2 4.46Å; L509-Y585 HydrophobicContact CD2-CE2 4.42Å; L509-Y585 WeakPolarHBondContact CD2-OH 2.8Å; L509-Y585 PolarHBondContact O-OH 3.41Å; L509-Y585 VanDerWaalsContact O-OH 3.12Å; E525-Y585 HydrophobicContact CB-CE1 4.18Å; E525-Y585 VanDerWaalsContact CD-OH 3.31Å; E525-Y585 PolarHBondContact OE1-OH 3.39Å; I529-Y585 HydrophobicContact CD1-CD2 3.94Å; I529-Y585 HydrophobicContact CD1-CE2 3.92Å; I529-Y585 HydrophobicContact CD1-CG 4.32Å; L581-Y585 HydrophobicContact CD2-CE2 4.1Å; L581-Y585 VanDerWaalsContact O-CD2 3.23Å; L581-Y585 WeakPolarHBondContact O-CD2 3.37Å; L581-Y585 PolarHBondContact O-N 3.18Å; L582-Y585 PolarHBondContact O-N 2.86Å; Y585-A587 PolarHBondContact O-N 3.18Å; Y585-D588 PolarHBondContact O-N 3.22Å; Y585-K591 HydrophobicContact CD1-CD 3.66Å; Y585-K591 HydrophobicContact CE1-CD 4.18Å; Y585-K591 HydrophobicContact CG-CB 4.41Å; Y585-K591 HydrophobicContact CG-CD 4.24Å; Y585-V592 VanDerWaalsContact O-CG1 3.32Å; Y585-V592 WeakPolarHBondContact O-CG1 3.29Å; Y585-L595 HydrophobicContact CD2-CD1 3.97Å
586	Q	95.4	Very high	97.1	Very high	42 Å²	42	35.2 Å²	35.2	20%	0.196	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.7	28.4	175.2	55.9	162.1	-36.5	0	0	118	L582 S583 V626 K629	L582-Q586 WeakPolarHBondContact O-CA 3.45Å; L582-Q586 WeakPolarHBondContact O-CB 3.44Å; L582-Q586 WeakPolarHBondContact O-CG 3.49Å; L582-Q586 PolarHBondContact O-N 2.94Å; S583-Q586 PolarHBondContact O-NE2 2.58Å; Q586-V626 HydrophobicContact CB-CG2 4.3Å; Q586-K629 WeakPolarHBondContact O-CD 3.01Å; Q586-K629 PolarHBondContact O-NZ 3.42Å
587	A	95.6	Very high	97.1	Very high	88 Å²	88	32.9 Å²	32.9	73%	0.727	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	-137	-0.4	169.9	0	0	0	0	0	112	Y585	Y585-A587 PolarHBondContact O-N 3.18Å
588	D	97.4	Very high	97.1	Very high	42 Å²	42	32.7 Å²	32.7	23%	0.225	18%	0.183	C	C	.	.			trans	-119.6	116.7	-174.8	-176.8	-64.5	0	0	0	109.2	Y585 E590 K591 V592	Y585-D588 PolarHBondContact O-N 3.22Å; D588-E590 PolarHBondContact OD1-N 2.99Å; D588-K591 HydrophobicContact CB-CB 4.14Å; D588-K591 HydrophobicContact CB-CD 4.04Å; D588-K591 HydrophobicContact CB-CG 4.33Å; D588-K591 WeakPolarHBondContact OD1-CB 3.3Å; D588-K591 VanDerWaalsContact OD1-CG 3.26Å; D588-K591 WeakPolarHBondContact OD1-CG 3.47Å; D588-K591 PolarHBondContact OD1-N 3.36Å; D588-K591 IonicContact OD1-NZ 2.61Å; D588-K591 IonicContact OD2-NZ 2.7Å; D588-K591 PolarHBondContact OD2-NZ 2.78Å; D588-V592 WeakPolarHBondContact O-CG1 3.33Å; D588-V592 VanDerWaalsContact O-CG2 3.31Å; D588-V592 WeakPolarHBondContact O-CG2 3.29Å; D588-V592 PolarHBondContact O-N 3.45Å; D588-V592 VanDerWaalsContact O-N 3.11Å
589	A	96.4	Very high	97	Very high	27 Å²	27	32.7 Å²	32.7	22%	0.223	18%	0.183	C	C	.	.	H	α-helix	trans	-66.4	-44.5	-171.9	0	0	0	0	0	112.9	V592 A593 E632 V635	A589-V592 WeakPolarHBondContact O-CG2 3.33Å; A589-A593 VanDerWaalsContact O-CB 3.27Å; A589-A593 WeakPolarHBondContact O-CB 3.29Å; A589-A593 PolarHBondContact O-N 3.19Å; A589-E632 HydrophobicContact CB-CB 4.32Å; A589-E632 HydrophobicContact CB-CG 3.88Å; A589-V635 HydrophobicContact CB-CG2 3.74Å; A589-V635 WeakPolarHBondContact O-CG2 3.47Å
590	E	95.2	Very high	96.8	Very high	106 Å²	106	35 Å²	35	50%	0.495	19%	0.193	S	C	.	.	H	α-helix	trans	-61.2	-52.4	-180	-174.1	-152.3	168.9	0	0	110.4	S526 D588 V592 A593 N594	S526-E590 WeakPolarHBondContact CB-OE1 3.34Å; S526-E590 VanDerWaalsContact CB-OE2 3.28Å; S526-E590 WeakPolarHBondContact CB-OE2 3.35Å; S526-E590 VanDerWaalsContact OG-CD 3.28Å; S526-E590 PolarHBondContact OG-OE2 3.46Å; D588-E590 PolarHBondContact OD1-N 2.99Å; E590-V592 PolarHBondContact O-N 2.87Å; E590-A593 PolarHBondContact O-N 3Å; E590-N594 PolarHBondContact O-N 3.48Å
591	K	97.6	Very high	96.8	Very high	2 Å²	2	30.7 Å²	30.7	1%	0.009	17%	0.171	C	C	.	.	H	α-helix	trans	-63.8	-39.6	-177	-64.9	174.4	-172.3	61.5	0	111.4	D522 S526 I529 Y585 D588 L595	D522-K591 WeakPolarHBondContact O-CE 3.4Å; D522-K591 WeakPolarHBondContact OD1-CE 3.45Å; D522-K591 IonicContact OD1-NZ 2.67Å; D522-K591 PolarHBondContact OD1-NZ 3.21Å; D522-K591 VanDerWaalsContact OD1-NZ 3.1Å; D522-K591 IonicContact OD2-NZ 3.94Å; D522-K591 PolarHBondContact OD2-NZ 3.03Å; S526-K591 VanDerWaalsContact OG-CE 3.24Å; S526-K591 WeakPolarHBondContact OG-CE 3.44Å; S526-K591 WeakPolarHBondContact OG-CG 3.41Å; S526-K591 PolarHBondContact OG-NZ 2.96Å; I529-K591 HydrophobicContact CD1-CB 3.89Å; I529-K591 HydrophobicContact CD1-CD 4.33Å; I529-K591 HydrophobicContact CD1-CG 3.97Å; Y585-K591 HydrophobicContact CD1-CD 3.66Å; Y585-K591 HydrophobicContact CE1-CD 4.18Å; Y585-K591 HydrophobicContact CG-CB 4.41Å; Y585-K591 HydrophobicContact CG-CD 4.24Å; D588-K591 HydrophobicContact CB-CB 4.14Å; D588-K591 HydrophobicContact CB-CD 4.04Å; D588-K591 HydrophobicContact CB-CG 4.33Å; D588-K591 WeakPolarHBondContact OD1-CB 3.3Å; D588-K591 VanDerWaalsContact OD1-CG 3.26Å; D588-K591 WeakPolarHBondContact OD1-CG 3.47Å; D588-K591 PolarHBondContact OD1-N 3.36Å; D588-K591 IonicContact OD1-NZ 2.61Å; D588-K591 IonicContact OD2-NZ 2.7Å; D588-K591 PolarHBondContact OD2-NZ 2.78Å; K591-L595 WeakPolarHBondContact O-CB 3.49Å; K591-L595 WeakPolarHBondContact O-CD1 3.22Å; K591-L595 WeakPolarHBondContact O-CG 3.36Å; K591-L595 PolarHBondContact O-N 3.32Å; K591-L595 VanDerWaalsContact O-N 3.11Å
592	V	97.4	Very high	96.6	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-75.4	-38.8	177.2	-58.2	0	0	0	0	113.4	L582 Y585 D588 A589 E590 N594 L595 L596 V626 V635	L582-V592 HydrophobicContact CD2-CB 4.35Å; L582-V592 HydrophobicContact CD2-CG1 4.34Å; Y585-V592 VanDerWaalsContact O-CG1 3.32Å; Y585-V592 WeakPolarHBondContact O-CG1 3.29Å; D588-V592 WeakPolarHBondContact O-CG1 3.33Å; D588-V592 VanDerWaalsContact O-CG2 3.31Å; D588-V592 WeakPolarHBondContact O-CG2 3.29Å; D588-V592 PolarHBondContact O-N 3.45Å; D588-V592 VanDerWaalsContact O-N 3.11Å; A589-V592 WeakPolarHBondContact O-CG2 3.33Å; E590-V592 PolarHBondContact O-N 2.87Å; V592-N594 VanDerWaalsContact C-N 3.27Å; V592-N594 PolarHBondContact O-N 3.47Å; V592-L595 PolarHBondContact O-N 2.87Å; V592-L596 HydrophobicContact CB-CD1 4.46Å; V592-L596 VanDerWaalsContact O-CB 3.27Å; V592-L596 WeakPolarHBondContact O-CB 3.28Å; V592-L596 WeakPolarHBondContact O-CD1 3.31Å; V592-L596 WeakPolarHBondContact O-CG 3.48Å; V592-L596 PolarHBondContact O-N 2.96Å; V592-V626 HydrophobicContact CB-CG1 4.37Å; V592-V626 HydrophobicContact CG1-CG2 4.31Å; V592-V626 HydrophobicContact CG2-CG1 3.91Å; V592-V635 HydrophobicContact CG2-CB 4.41Å; V592-V635 HydrophobicContact CG2-CG1 3.69Å; V592-V635 HydrophobicContact CG2-CG2 3.84Å
593	A	96.9	Very high	96.4	Very high	13 Å²	13	33.1 Å²	33.1	11%	0.107	18%	0.184	C	C	.	.	H	α-helix	trans	-58.3	-42.4	178.1	0	0	0	0	0	111.1	A589 E590 D634 V635	A589-A593 VanDerWaalsContact O-CB 3.27Å; A589-A593 WeakPolarHBondContact O-CB 3.29Å; A589-A593 PolarHBondContact O-N 3.19Å; E590-A593 PolarHBondContact O-N 3Å; A593-D634 HydrophobicContact CB-CB 4.36Å; A593-V635 HydrophobicContact CB-CG2 4.12Å
594	N	97.3	Very high	96.3	Very high	21 Å²	21	30.9 Å²	30.9	11%	0.112	17%	0.168	C	C	.	.	H	α-helix	trans	-68.4	-48.9	174.4	-105.1	-18.9	0	0	0	112.7	I529 E530 V533 E590 V592 L596 Q597	I529-N594 HydrophobicContact CG2-CB 3.83Å; E530-N594 PolarHBondContact OE2-ND2 2.97Å; V533-N594 HydrophobicContact CG2-CB 4.11Å; V533-N594 VanDerWaalsContact CG2-O 3.32Å; V533-N594 WeakPolarHBondContact CG2-O 3.37Å; E590-N594 PolarHBondContact O-N 3.48Å; V592-N594 VanDerWaalsContact C-N 3.27Å; V592-N594 PolarHBondContact O-N 3.47Å; N594-L596 PolarHBondContact O-N 2.83Å; N594-Q597 WeakPolarHBondContact O-CB 3.36Å; N594-Q597 PolarHBondContact O-N 2.89Å; N594-Q597 VanDerWaalsContact O-N 3.08Å; N594-Q597 PolarHBondContact OD1-NE2 3.38Å
595	L	98.2	Very high	96.1	Very high	4 Å²	4	30.1 Å²	30.1	2%	0.021	17%	0.168	C	C	.	.	H	α-helix	trans	-58	-33.5	177.1	-75.6	170.6	0	0	0	113	I529 L578 L581 L582 Y585 K591 V592 Q597 I598	I529-L595 HydrophobicContact CD1-CD1 4.2Å; I529-L595 HydrophobicContact CD1-CG 4.39Å; I529-L595 HydrophobicContact CG1-CD2 4.46Å; I529-L595 HydrophobicContact CG2-CD2 4.18Å; I529-L595 HydrophobicContact CG2-CG 3.95Å; L578-L595 HydrophobicContact CD1-CB 3.98Å; L578-L595 HydrophobicContact CD1-CD2 4.14Å; L578-L595 WeakPolarHBondContact CD1-O 3.38Å; L581-L595 HydrophobicContact CB-CD1 3.98Å; L581-L595 HydrophobicContact CB-CD2 3.97Å; L581-L595 HydrophobicContact CD1-CD2 4Å; L581-L595 HydrophobicContact CG-CD2 4.49Å; L582-L595 HydrophobicContact CD2-CB 3.77Å; L582-L595 HydrophobicContact CD2-CD1 4.24Å; Y585-L595 HydrophobicContact CD2-CD1 3.97Å; K591-L595 WeakPolarHBondContact O-CB 3.49Å; K591-L595 WeakPolarHBondContact O-CD1 3.22Å; K591-L595 WeakPolarHBondContact O-CG 3.36Å; K591-L595 PolarHBondContact O-N 3.32Å; K591-L595 VanDerWaalsContact O-N 3.11Å; V592-L595 PolarHBondContact O-N 2.87Å; L595-Q597 VanDerWaalsContact C-N 3.26Å; L595-Q597 PolarHBondContact O-N 3.49Å; L595-I598 HydrophobicContact CD2-CD1 4Å; L595-I598 WeakPolarHBondContact O-CB 3.45Å; L595-I598 PolarHBondContact O-N 2.83Å
596	L	97.7	Very high	95.9	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-13.9	179	-75.2	166.5	0	0	0	114.2	L582 V592 N594 P599 I623 V626 V635 A638 C639 T642	L582-L596 HydrophobicContact CD1-CD2 4.28Å; L582-L596 HydrophobicContact CD2-CD2 4.32Å; L582-L596 HydrophobicContact CD2-CG 4.22Å; V592-L596 HydrophobicContact CB-CD1 4.46Å; V592-L596 VanDerWaalsContact O-CB 3.27Å; V592-L596 WeakPolarHBondContact O-CB 3.28Å; V592-L596 WeakPolarHBondContact O-CD1 3.31Å; V592-L596 WeakPolarHBondContact O-CG 3.48Å; V592-L596 PolarHBondContact O-N 2.96Å; N594-L596 PolarHBondContact O-N 2.83Å; L596-P599 WeakPolarHBondContact O-CD 3.41Å; L596-I623 HydrophobicContact CD2-CD1 4.42Å; L596-I623 HydrophobicContact CD2-CG1 3.81Å; L596-I623 HydrophobicContact CD2-CG2 4.34Å; L596-V626 HydrophobicContact CD1-CG1 4.21Å; L596-V635 HydrophobicContact CD1-CG1 4.48Å; L596-A638 HydrophobicContact CB-CB 3.68Å; L596-A638 HydrophobicContact CD1-CB 4.17Å; L596-C639 WeakPolarHBondContact CD1-SG 3.12Å; L596-T642 PolarHBondContact O-OG1 3.32Å
597	Q	96.5	Very high	95.8	Very high	49 Å²	49	28.7 Å²	28.7	23%	0.229	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-26	172.1	-65.3	170.5	43.6	0	0	112.4	V533 N594 L595 Q600 F601	V533-Q597 HydrophobicContact CG1-CB 4.21Å; N594-Q597 WeakPolarHBondContact O-CB 3.36Å; N594-Q597 PolarHBondContact O-N 2.89Å; N594-Q597 VanDerWaalsContact O-N 3.08Å; N594-Q597 PolarHBondContact OD1-NE2 3.38Å; L595-Q597 VanDerWaalsContact C-N 3.26Å; L595-Q597 PolarHBondContact O-N 3.49Å; Q597-Q600 VanDerWaalsContact O-CB 3.29Å; Q597-Q600 WeakPolarHBondContact O-CB 3.26Å; Q597-Q600 WeakPolarHBondContact O-CG 3.49Å; Q597-Q600 PolarHBondContact O-N 3.18Å; Q597-F601 HydrophobicContact CB-CE2 4.41Å; Q597-F601 WeakPolarHBondContact O-CD2 3.18Å
598	I	97.6	Very high	95.6	Very high	1 Å²	1	26.4 Å²	26.4	1%	0.005	14%	0.143	C	C	.	.	G	3₁₀ helix	trans	-56	-42.9	-171.1	-65	177.6	0	0	0	114.1	V533 I536 F574 L578 L595 Q600 F601 F602	V533-I598 HydrophobicContact CG2-CD1 4.15Å; V533-I598 HydrophobicContact CG2-CG1 4.02Å; I536-I598 HydrophobicContact CD1-CD1 3.78Å; I536-I598 HydrophobicContact CD1-CG1 3.81Å; I536-I598 HydrophobicContact CD1-CG2 4.12Å; F574-I598 HydrophobicContact CB-CG2 3.81Å; F574-I598 HydrophobicContact CD1-CD1 4.39Å; F574-I598 HydrophobicContact CD1-CG2 4.31Å; F574-I598 HydrophobicContact CD2-CG2 4.21Å; F574-I598 HydrophobicContact CE1-CD1 4.36Å; F574-I598 HydrophobicContact CG-CG2 3.86Å; L578-I598 HydrophobicContact CD1-CD1 4.4Å; L578-I598 HydrophobicContact CD2-CB 4.33Å; L578-I598 HydrophobicContact CD2-CG2 4.46Å; L595-I598 HydrophobicContact CD2-CD1 4Å; L595-I598 WeakPolarHBondContact O-CB 3.45Å; L595-I598 PolarHBondContact O-N 2.83Å; I598-Q600 PolarHBondContact O-N 3.27Å; I598-F601 PolarHBondContact O-N 2.91Å; I598-F602 HydrophobicContact CG2-CE1 3.63Å; I598-F602 HydrophobicContact CG2-CZ 4.03Å
599	P	96	Very high	95.2	Very high	2 Å²	2	28.6 Å²	28.6	1%	0.013	17%	0.166	C	C	.	.	G	3₁₀ helix	trans	-62.5	-22.9	178.7	-26.2	37.9	0	0	0	114.9	L578 L596 F601 F602 L619 T642	L578-P599 HydrophobicContact CD2-CG 3.38Å; L596-P599 WeakPolarHBondContact O-CD 3.41Å; P599-F601 PolarHBondContact O-N 3.21Å; P599-F602 HydrophobicContact CB-CD2 4.2Å; P599-F602 HydrophobicContact CB-CE2 4.21Å; P599-F602 HydrophobicContact CG-CE2 4.42Å; P599-F602 WeakPolarHBondContact O-CB 3.44Å; P599-F602 PolarHBondContact O-N 2.75Å; P599-F602 VanDerWaalsContact O-N 3.12Å; P599-L619 HydrophobicContact CG-CD2 4.17Å; P599-T642 HydrophobicContact CB-CG2 3.87Å; P599-T642 HydrophobicContact CG-CG2 3.86Å
600	Q	93.8	Very high	94.9	Very high	61 Å²	61	29.1 Å²	29.1	29%	0.285	18%	0.175	S	C	.	.	G	3₁₀ helix	trans	-65.8	-21.8	-179.2	-51.3	-172.5	21.2	0	0	111.4	Q597 I598 T642 I645	Q597-Q600 VanDerWaalsContact O-CB 3.29Å; Q597-Q600 WeakPolarHBondContact O-CB 3.26Å; Q597-Q600 WeakPolarHBondContact O-CG 3.49Å; Q597-Q600 PolarHBondContact O-N 3.18Å; I598-Q600 PolarHBondContact O-N 3.27Å; Q600-T642 WeakPolarHBondContact CG-OG1 3.28Å; Q600-T642 PolarHBondContact NE2-OG1 3.24Å; Q600-I645 HydrophobicContact CB-CD1 3.72Å; Q600-I645 HydrophobicContact CG-CD1 3.61Å
601	F	95.9	Very high	94.7	Very high	22 Å²	22	33.6 Å²	33.6	10%	0.096	19%	0.187	C	C	.	.	G	3₁₀ helix	trans	-91.8	-6.4	177.9	-55.8	-67.8	0	0	0	113.9	I536 R537 A540 E541 K567 L570 Q597 I598 P599	I536-F601 HydrophobicContact CG2-CB 3.97Å; I536-F601 HydrophobicContact CG2-CD2 3.6Å; I536-F601 HydrophobicContact CG2-CE2 4.4Å; I536-F601 HydrophobicContact CG2-CG 3.94Å; R537-F601 HydrophobicContact CB-CE1 4.11Å; R537-F601 HydrophobicContact CB-CE2 4.23Å; R537-F601 HydrophobicContact CB-CZ 3.74Å; R537-F601 HydrophobicContact CG-CE1 3.95Å; R537-F601 HydrophobicContact CG-CZ 3.78Å; A540-F601 HydrophobicContact CB-CB 3.75Å; A540-F601 HydrophobicContact CB-CD1 3.64Å; A540-F601 HydrophobicContact CB-CG 3.99Å; E541-F601 HydrophobicContact CG-CE1 4.23Å; K567-F601 VanDerWaalsContact CE-O 3.28Å; K567-F601 WeakPolarHBondContact CE-O 3.49Å; K567-F601 PolarHBondContact NZ-O 3.34Å; L570-F601 HydrophobicContact CD1-CB 4.2Å; Q597-F601 HydrophobicContact CB-CE2 4.41Å; Q597-F601 WeakPolarHBondContact O-CD2 3.18Å; I598-F601 PolarHBondContact O-N 2.91Å; P599-F601 PolarHBondContact O-N 3.21Å
602	F	95.3	Very high	94.5	Very high	6 Å²	6	35.9 Å²	35.9	3%	0.026	20%	0.198	C	C	.	.	S	Bend	trans	-69.4	155.1	-174	-73.2	-0.3	0	0	0	114.7	K567 L570 T571 F574 I575 I598 P599 L604 Y607	K567-F602 VanDerWaalsContact CE-C 3.41Å; K567-F602 VanDerWaalsContact CE-O 3.22Å; K567-F602 WeakPolarHBondContact CE-O 3.22Å; K567-F602 VanDerWaalsContact NZ-C 3.3Å; K567-F602 PolarHBondContact NZ-O 3.49Å; L570-F602 HydrophobicContact CD1-CD1 3.84Å; L570-F602 HydrophobicContact CD1-CE1 4.17Å; T571-F602 HydrophobicContact CG2-CB 4.03Å; T571-F602 HydrophobicContact CG2-CD1 4.46Å; T571-F602 HydrophobicContact CG2-CG 4.12Å; T571-F602 WeakPolarHBondContact OG1-CA 3.49Å; F574-F602 HydrophobicContact CB-CE1 3.68Å; F574-F602 HydrophobicContact CB-CZ 3.65Å; I575-F602 HydrophobicContact CG1-CD2 4.09Å; I575-F602 HydrophobicContact CG1-CE2 3.79Å; I575-F602 HydrophobicContact CG1-CZ 4.39Å; I598-F602 HydrophobicContact CG2-CE1 3.63Å; I598-F602 HydrophobicContact CG2-CZ 4.03Å; P599-F602 HydrophobicContact CB-CD2 4.2Å; P599-F602 HydrophobicContact CB-CE2 4.21Å; P599-F602 HydrophobicContact CG-CE2 4.42Å; P599-F602 WeakPolarHBondContact O-CB 3.44Å; P599-F602 PolarHBondContact O-N 2.75Å; P599-F602 VanDerWaalsContact O-N 3.12Å; F602-L604 HydrophobicContact CB-CD2 3.85Å; F602-L604 HydrophobicContact CD2-CD2 4.37Å; F602-Y607 HydrophobicContact CD2-CE2 4.17Å
603	D	93.6	Very high	94.3	Very high	46 Å²	46	38.8 Å²	38.8	25%	0.246	21%	0.212	C	C	.	.			trans	-88.4	100.4	157.2	-175.9	1.5	0	0	0	109.4	T571 D605 V606	T571-D603 HydrophobicContact CG2-CB 4.48Å; T571-D603 WeakPolarHBondContact CG2-O 3.21Å; T571-D603 PolarHBondContact OG1-N 3.22Å; D603-D605 PolarHBondContact O-N 2.97Å; D603-D605 PolarHBondContact OD1-N 3.07Å; D603-V606 HydrophobicContact CB-CG2 4.04Å; D603-V606 WeakPolarHBondContact O-CB 3.35Å; D603-V606 WeakPolarHBondContact O-CG2 3.47Å; D603-V606 PolarHBondContact O-N 3.2Å; D603-V606 VanDerWaalsContact O-N 3.12Å
604	L	94.1	Very high	94.2	Very high	4 Å²	4	44.7 Å²	44.7	2%	0.021	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-16.7	-170.4	-62	-179	0	0	0	113.9	F602 V606 Y607 I645 L646 Y651 I653	F602-L604 HydrophobicContact CB-CD2 3.85Å; F602-L604 HydrophobicContact CD2-CD2 4.37Å; L604-V606 PolarHBondContact O-N 3.12Å; L604-Y607 HydrophobicContact CD2-CD2 4.08Å; L604-Y607 HydrophobicContact CD2-CE2 3.88Å; L604-Y607 PolarHBondContact O-N 2.8Å; L604-I645 HydrophobicContact CD1-CG2 4.04Å; L604-I645 WeakPolarHBondContact CD1-O 3.49Å; L604-L646 HydrophobicContact CD1-CD2 4.3Å; L604-L646 HydrophobicContact CD2-CD2 3.7Å; L604-Y651 HydrophobicContact CB-CD1 3.76Å; L604-Y651 HydrophobicContact CB-CD2 3.94Å; L604-Y651 HydrophobicContact CB-CE1 3.85Å; L604-Y651 HydrophobicContact CB-CE2 4.02Å; L604-Y651 HydrophobicContact CB-CG 3.8Å; L604-Y651 HydrophobicContact CD1-CD2 3.72Å; L604-Y651 HydrophobicContact CD1-CE2 3.8Å; L604-Y651 HydrophobicContact CD1-CG 4.35Å; L604-Y651 HydrophobicContact CG-CD2 4.4Å; L604-Y651 HydrophobicContact CG-CE2 4.29Å; L604-I653 HydrophobicContact CB-CD1 4.31Å; L604-I653 HydrophobicContact CD1-CD1 4.4Å; L604-I653 HydrophobicContact CD2-CD1 4.47Å
605	D	92.4	Very high	94.2	Very high	84 Å²	84	45.1 Å²	45.1	45%	0.449	24%	0.236	S	C	.	.	H	α-helix	trans	-64	-24.9	172.5	-89.1	-27	0	0	0	112.4	D603 Y607 S608 A609	D603-D605 PolarHBondContact O-N 2.97Å; D603-D605 PolarHBondContact OD1-N 3.07Å; D605-Y607 PolarHBondContact O-N 2.9Å; D605-S608 PolarHBondContact O-N 3.12Å; D605-S608 VanDerWaalsContact O-N 3.16Å; D605-A609 VanDerWaalsContact O-CB 3.31Å; D605-A609 WeakPolarHBondContact O-CB 3.34Å; D605-A609 PolarHBondContact O-N 2.85Å
606	V	93.5	Very high	94.1	Very high	24 Å²	24	44.9 Å²	44.9	15%	0.145	24%	0.235	C	C	.	.	H	α-helix	trans	-60.1	-29.9	176.8	179.8	0	0	0	0	111.8	T571 E572 I575 D603 L604 S608 G610	T571-V606 HydrophobicContact CG2-CB 3.77Å; T571-V606 HydrophobicContact CG2-CG1 4.09Å; T571-V606 HydrophobicContact CG2-CG2 3.85Å; E572-V606 HydrophobicContact CG-CG1 4.32Å; I575-V606 HydrophobicContact CD1-CB 4.13Å; I575-V606 HydrophobicContact CD1-CG1 3.87Å; D603-V606 HydrophobicContact CB-CG2 4.04Å; D603-V606 WeakPolarHBondContact O-CB 3.35Å; D603-V606 WeakPolarHBondContact O-CG2 3.47Å; D603-V606 PolarHBondContact O-N 3.2Å; D603-V606 VanDerWaalsContact O-N 3.12Å; L604-V606 PolarHBondContact O-N 3.12Å; V606-S608 PolarHBondContact O-N 3.34Å; V606-G610 WeakPolarHBondContact O-CA 3.45Å; V606-G610 PolarHBondContact O-N 2.88Å
607	Y	93.8	Very high	94	Very high	1 Å²	1	48.3 Å²	48.3	0%	0.004	25%	0.253	C	S	.	.	H	α-helix	trans	-60.3	-45.9	175.6	-82.8	-65.6	0	0	0	112.4	I575 F602 L604 D605 R611 M612 L616 L619 L646 I653	I575-Y607 HydrophobicContact CB-CE1 4.39Å; I575-Y607 HydrophobicContact CD1-CD1 4Å; I575-Y607 HydrophobicContact CD1-CD2 4.26Å; I575-Y607 HydrophobicContact CD1-CE1 3.94Å; I575-Y607 HydrophobicContact CD1-CE2 4.21Å; I575-Y607 HydrophobicContact CD1-CG 4.17Å; I575-Y607 HydrophobicContact CG1-CD1 4.37Å; I575-Y607 HydrophobicContact CG1-CE1 3.8Å; I575-Y607 HydrophobicContact CG1-CE2 4.26Å; I575-Y607 HydrophobicContact CG2-CD1 4.31Å; I575-Y607 HydrophobicContact CG2-CE1 3.86Å; F602-Y607 HydrophobicContact CD2-CE2 4.17Å; L604-Y607 HydrophobicContact CD2-CD2 4.08Å; L604-Y607 HydrophobicContact CD2-CE2 3.88Å; L604-Y607 PolarHBondContact O-N 2.8Å; D605-Y607 PolarHBondContact O-N 2.9Å; Y607-R611 PolarHBondContact O-N 3.46Å; Y607-M612 HydrophobicContact CD1-CB 4.13Å; Y607-M612 PolarHBondContact O-N 2.67Å; Y607-L616 HydrophobicContact CD1-CB 3.86Å; Y607-L616 HydrophobicContact CE1-CB 3.72Å; Y607-L616 HydrophobicContact CE1-CD1 4.37Å; Y607-L616 HydrophobicContact CE2-CD1 4.28Å; Y607-L619 WeakPolarHBondContact OH-CD2 3.38Å; Y607-L646 HydrophobicContact CE2-CD2 4.32Å; Y607-I653 HydrophobicContact CD2-CD1 4.08Å
608	S	90.4	Very high	94.1	Very high	40 Å²	40	47.7 Å²	47.7	28%	0.28	26%	0.257	S	S	.	.	H	α-helix	trans	-86	-41	-177.4	-65.5	0	0	0	0	112.4	D605 V606 R611 T652	D605-S608 PolarHBondContact O-N 3.12Å; D605-S608 VanDerWaalsContact O-N 3.16Å; V606-S608 PolarHBondContact O-N 3.34Å; S608-R611 PolarHBondContact O-N 3.41Å; S608-T652 WeakPolarHBondContact CB-OG1 3.32Å; S608-T652 PolarHBondContact OG-OG1 3.46Å
609	A	90.5	Very high	94.1	Very high	87 Å²	87	47.7 Å²	47.7	72%	0.719	26%	0.257	S	S	*	.	H	α-helix	trans	-67	-40.4	177.9	0	0	0	0	0	112.1	D605	D605-A609 VanDerWaalsContact O-CB 3.31Å; D605-A609 WeakPolarHBondContact O-CB 3.34Å; D605-A609 PolarHBondContact O-N 2.85Å
610	G	88.8	Confident	94.2	Very high	39 Å²	39	48 Å²	48	40%	0.402	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-7.6	178.9	0	0	0	0	0	115.2	V606	V606-G610 WeakPolarHBondContact O-CA 3.45Å; V606-G610 PolarHBondContact O-N 2.88Å
611	R	91.4	Very high	94.4	Very high	199 Å²	199	51.9 Å²	51.9	75%	0.751	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.6	47	-172.4	-53.1	179.2	-174.9	168.7	1.7	112.8	Y607 S608 E613	Y607-R611 PolarHBondContact O-N 3.46Å; S608-R611 PolarHBondContact O-N 3.41Å; R611-E613 WeakPolarHBondContact CA-OE2 3.4Å
612	M	93.1	Very high	94.5	Very high	51 Å²	51	52 Å²	52	25%	0.251	28%	0.275	S	S	.	.			trans	-101.4	16.7	-177.7	-59.5	-60.5	-171.6	0	0	112.6	I575 Y607 K614 H615 L616	I575-M612 HydrophobicContact CG2-CB 3.74Å; I575-M612 HydrophobicContact CG2-CG 4.1Å; Y607-M612 HydrophobicContact CD1-CB 4.13Å; Y607-M612 PolarHBondContact O-N 2.67Å; M612-K614 PolarHBondContact O-N 2.9Å; M612-K614 VanDerWaalsContact O-N 3.1Å; M612-H615 WeakPolarHBondContact O-CA 3.26Å; M612-H615 WeakPolarHBondContact O-CB 3.42Å; M612-H615 PolarHBondContact O-N 3.44Å; M612-L616 PolarHBondContact O-N 2.95Å
613	E	93.1	Very high	94.6	Very high	61 Å²	61	51.7 Å²	51.7	29%	0.285	27%	0.274	S	S	.	.	H	α-helix	trans	-62.8	-24.2	-175.2	-42.2	93.4	132.9	0	0	112.5	R611 H615 L616 D617	R611-E613 WeakPolarHBondContact CA-OE2 3.4Å; E613-H615 PolarHBondContact O-N 3.42Å; E613-L616 WeakPolarHBondContact O-CB 3.34Å; E613-L616 PolarHBondContact O-N 3.31Å; E613-D617 PolarHBondContact O-N 3.27Å
614	K	95.8	Very high	94.7	Very high	137 Å²	137	52.4 Å²	52.4	60%	0.596	27%	0.273	S	S	*	.	H	α-helix	trans	-61.1	-29.7	169.8	75.6	-170.9	-173.4	-170.5	0	113.2	M612 A618	M612-K614 PolarHBondContact O-N 2.9Å; M612-K614 VanDerWaalsContact O-N 3.1Å; K614-A618 PolarHBondContact O-N 3.29Å
615	H	96.4	Very high	94.9	Very high	29 Å²	29	54.7 Å²	54.7	13%	0.134	29%	0.285	C	S	.	.	H	α-helix	trans	-83.9	-30.4	176	-69.6	-79.4	0	0	0	111.2	I575 M612 E613 A618 L619	I575-H615 HydrophobicContact CG2-CB 3.84Å; I575-H615 WeakPolarHBondContact O-CB 3.29Å; M612-H615 WeakPolarHBondContact O-CA 3.26Å; M612-H615 WeakPolarHBondContact O-CB 3.42Å; M612-H615 PolarHBondContact O-N 3.44Å; E613-H615 PolarHBondContact O-N 3.42Å; H615-A618 PolarHBondContact O-N 3.43Å; H615-L619 WeakPolarHBondContact O-CB 3.44Å; H615-L619 PolarHBondContact O-N 2.83Å
616	L	96.4	Very high	95.1	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-62.6	-46.5	168.4	-177.5	60.2	0	0	0	110.9	Y607 M612 E613 A618 L619 L620 L646 I653 V657	Y607-L616 HydrophobicContact CD1-CB 3.86Å; Y607-L616 HydrophobicContact CE1-CB 3.72Å; Y607-L616 HydrophobicContact CE1-CD1 4.37Å; Y607-L616 HydrophobicContact CE2-CD1 4.28Å; M612-L616 PolarHBondContact O-N 2.95Å; E613-L616 WeakPolarHBondContact O-CB 3.34Å; E613-L616 PolarHBondContact O-N 3.31Å; L616-A618 VanDerWaalsContact C-N 3.26Å; L616-A618 PolarHBondContact O-N 3.5Å; L616-L619 PolarHBondContact O-N 3.09Å; L616-L619 VanDerWaalsContact O-N 3.15Å; L616-L620 HydrophobicContact CD1-CD1 4.24Å; L616-L620 HydrophobicContact CD1-CD2 4.42Å; L616-L620 HydrophobicContact CD1-CG 4.11Å; L616-L620 HydrophobicContact CG-CD1 4.02Å; L616-L620 HydrophobicContact CG-CG 4.33Å; L616-L620 VanDerWaalsContact O-CG 3.28Å; L616-L620 WeakPolarHBondContact O-CG 3.48Å; L616-L620 PolarHBondContact O-N 2.66Å; L616-L646 HydrophobicContact CD1-CD1 4.43Å; L616-L646 HydrophobicContact CD1-CD2 4.23Å; L616-I653 HydrophobicContact CD2-CB 3.72Å; L616-I653 HydrophobicContact CD2-CD1 4.06Å; L616-I653 HydrophobicContact CD2-CG1 4.43Å; L616-I653 HydrophobicContact CD2-CG2 3.87Å; L616-V657 HydrophobicContact CD1-CG2 4.31Å; L616-V657 HydrophobicContact CD2-CG2 4.04Å
617	D	96.6	Very high	95.3	Very high	71 Å²	71	49.6 Å²	49.6	38%	0.38	26%	0.257	S	S	.	.	H	α-helix	trans	-55.5	-42	173.2	-69.5	-23.7	0	0	0	112	E613 K621 R656	E613-D617 PolarHBondContact O-N 3.27Å; D617-K621 WeakPolarHBondContact O-CB 3.38Å; D617-K621 PolarHBondContact O-N 3.27Å; D617-K621 VanDerWaalsContact O-N 3.08Å; D617-R656 VanDerWaalsContact CG-NH2 3.31Å; D617-R656 IonicContact OD1-CZ 2.84Å; D617-R656 IonicContact OD1-NE 3.37Å; D617-R656 PolarHBondContact OD1-NE 2.89Å; D617-R656 IonicContact OD1-NH2 3.47Å; D617-R656 PolarHBondContact OD1-NH2 2.89Å; D617-R656 IonicContact OD2-CZ 3.26Å; D617-R656 IonicContact OD2-NE 2.7Å; D617-R656 IonicContact OD2-NH2 2.73Å; D617-R656 PolarHBondContact OD2-NH2 3.11Å
618	A	97.9	Very high	95.3	Very high	36 Å²	36	52.5 Å²	52.5	30%	0.298	27%	0.27	S	S	.	.	H	α-helix	trans	-66.4	-42.5	177.4	0	0	0	0	0	112	P579 K614 H615 L616 K621 Q622	P579-A618 HydrophobicContact CB-CB 3.93Å; P579-A618 HydrophobicContact CG-CB 4.24Å; K614-A618 PolarHBondContact O-N 3.29Å; H615-A618 PolarHBondContact O-N 3.43Å; L616-A618 VanDerWaalsContact C-N 3.26Å; L616-A618 PolarHBondContact O-N 3.5Å; A618-K621 PolarHBondContact O-N 3.27Å; A618-Q622 WeakPolarHBondContact O-CG 3.49Å; A618-Q622 PolarHBondContact O-N 2.82Å; A618-Q622 VanDerWaalsContact O-N 3.11Å
619	L	97.8	Very high	95.5	Very high	1 Å²	1	55.3 Å²	55.3	1%	0.005	28%	0.277	C	S	.	.	H	α-helix	trans	-61.6	-54	176	180	58.2	0	0	0	111	L578 P579 L582 P599 Y607 H615 L616 K621 Q622 I623 L646	L578-L619 HydrophobicContact CD2-CD1 3.81Å; L578-L619 HydrophobicContact CG-CD1 4.06Å; P579-L619 HydrophobicContact CG-CB 4.12Å; L582-L619 HydrophobicContact CD1-CD1 3.69Å; P599-L619 HydrophobicContact CG-CD2 4.17Å; Y607-L619 WeakPolarHBondContact OH-CD2 3.38Å; H615-L619 WeakPolarHBondContact O-CB 3.44Å; H615-L619 PolarHBondContact O-N 2.83Å; L616-L619 PolarHBondContact O-N 3.09Å; L616-L619 VanDerWaalsContact O-N 3.15Å; L619-K621 PolarHBondContact O-N 2.87Å; L619-Q622 PolarHBondContact O-N 2.99Å; L619-I623 HydrophobicContact CD1-CD1 3.99Å; L619-I623 HydrophobicContact CD1-CG1 4.07Å; L619-I623 HydrophobicContact CD2-CD1 4.5Å; L619-I623 HydrophobicContact CG-CD1 3.83Å; L619-I623 HydrophobicContact CG-CG1 4.32Å; L619-I623 WeakPolarHBondContact O-CG1 3.2Å; L619-I623 PolarHBondContact O-N 3.48Å; L619-L646 HydrophobicContact CD2-CD1 4.25Å
620	L	97.8	Very high	95.8	Very high	9 Å²	9	51.7 Å²	51.7	5%	0.047	25%	0.246	C	C	.	.	H	α-helix	trans	-57.1	-39.4	180	-64.2	172.2	0	0	0	111.8	L616 R624 Y643 L646 V657 A660	L616-L620 HydrophobicContact CD1-CD1 4.24Å; L616-L620 HydrophobicContact CD1-CD2 4.42Å; L616-L620 HydrophobicContact CD1-CG 4.11Å; L616-L620 HydrophobicContact CG-CD1 4.02Å; L616-L620 HydrophobicContact CG-CG 4.33Å; L616-L620 VanDerWaalsContact O-CG 3.28Å; L616-L620 WeakPolarHBondContact O-CG 3.48Å; L616-L620 PolarHBondContact O-N 2.66Å; L620-R624 WeakPolarHBondContact O-CB 3.29Å; L620-R624 PolarHBondContact O-N 3.08Å; L620-Y643 HydrophobicContact CD2-CD1 4.45Å; L620-Y643 HydrophobicContact CD2-CE1 3.8Å; L620-L646 HydrophobicContact CD2-CD1 4.32Å; L620-V657 HydrophobicContact CD1-CG2 4.22Å; L620-V657 HydrophobicContact CD2-CG1 3.89Å; L620-V657 HydrophobicContact CD2-CG2 4.4Å; L620-A660 HydrophobicContact CB-CB 4.46Å; L620-A660 HydrophobicContact CD1-CB 4.13Å
621	K	97.5	Very high	96.1	Very high	142 Å²	142	51.8 Å²	51.8	62%	0.617	24%	0.236	S	C	*	.	H	α-helix	trans	-62.7	-41.6	174	-175.2	-178.4	176.9	-173.5	0	112.6	D617 A618 L619 L625	D617-K621 WeakPolarHBondContact O-CB 3.38Å; D617-K621 PolarHBondContact O-N 3.27Å; D617-K621 VanDerWaalsContact O-N 3.08Å; A618-K621 PolarHBondContact O-N 3.27Å; L619-K621 PolarHBondContact O-N 2.87Å; K621-L625 HydrophobicContact CG-CD1 4.48Å; K621-L625 WeakPolarHBondContact O-CG 3.28Å; K621-L625 PolarHBondContact O-N 3.49Å; K621-L625 VanDerWaalsContact O-N 3.12Å
622	Q	97.9	Very high	96.4	Very high	25 Å²	25	46 Å²	46	12%	0.117	22%	0.218	C	C	.	.	H	α-helix	trans	-70.8	-42.3	178	-64.9	-65.7	-4.8	0	0	111.8	L582 S583 A618 L619 R624 L625 V626	L582-Q622 HydrophobicContact CB-CB 3.99Å; L582-Q622 HydrophobicContact CB-CG 4.45Å; L582-Q622 HydrophobicContact CD1-CB 4.22Å; S583-Q622 PolarHBondContact OG-NE2 3.35Å; S583-Q622 VanDerWaalsContact OG-NE2 3.14Å; A618-Q622 WeakPolarHBondContact O-CG 3.49Å; A618-Q622 PolarHBondContact O-N 2.82Å; A618-Q622 VanDerWaalsContact O-N 3.11Å; L619-Q622 PolarHBondContact O-N 2.99Å; Q622-R624 VanDerWaalsContact C-N 3.3Å; Q622-R624 PolarHBondContact O-N 2.97Å; Q622-L625 PolarHBondContact O-N 3.08Å; Q622-L625 VanDerWaalsContact O-N 3.14Å; Q622-V626 WeakPolarHBondContact O-CG2 3.38Å; Q622-V626 PolarHBondContact O-N 2.98Å
623	I	97.4	Very high	96.4	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-58.6	-45	175.4	-57.9	171.2	0	0	0	109.8	L596 L619 L625 V626 V627 C639 T642 Y643 L646	L596-I623 HydrophobicContact CD2-CD1 4.42Å; L596-I623 HydrophobicContact CD2-CG1 3.81Å; L596-I623 HydrophobicContact CD2-CG2 4.34Å; L619-I623 HydrophobicContact CD1-CD1 3.99Å; L619-I623 HydrophobicContact CD1-CG1 4.07Å; L619-I623 HydrophobicContact CD2-CD1 4.5Å; L619-I623 HydrophobicContact CG-CD1 3.83Å; L619-I623 HydrophobicContact CG-CG1 4.32Å; L619-I623 WeakPolarHBondContact O-CG1 3.2Å; L619-I623 PolarHBondContact O-N 3.48Å; I623-L625 PolarHBondContact O-N 3.08Å; I623-V626 WeakPolarHBondContact O-CB 3.41Å; I623-V626 PolarHBondContact O-N 2.89Å; I623-V626 VanDerWaalsContact O-N 3.15Å; I623-V627 HydrophobicContact CG2-CG2 4.49Å; I623-V627 WeakPolarHBondContact O-CG2 3.5Å; I623-V627 PolarHBondContact O-N 3.2Å; I623-C639 HydrophobicContact CG2-CB 4.03Å; I623-T642 HydrophobicContact CD1-CG2 3.92Å; I623-Y643 HydrophobicContact CB-CE2 4.11Å; I623-Y643 HydrophobicContact CG2-CD2 3.78Å; I623-Y643 HydrophobicContact CG2-CE2 3.53Å; I623-L646 HydrophobicContact CD1-CD1 4.45Å
624	R	97.3	Very high	96.4	Very high	61 Å²	61	49.9 Å²	49.9	23%	0.23	25%	0.245	C	C	.	.	H	α-helix	trans	-57.1	-45.7	174.3	171.7	168.9	169.3	149.5	7.9	112.7	L620 Q622 V626 V627 E628 L664 E667	L620-R624 WeakPolarHBondContact O-CB 3.29Å; L620-R624 PolarHBondContact O-N 3.08Å; Q622-R624 VanDerWaalsContact C-N 3.3Å; Q622-R624 PolarHBondContact O-N 2.97Å; R624-V626 VanDerWaalsContact C-N 3.28Å; R624-V626 PolarHBondContact O-N 3.37Å; R624-V627 PolarHBondContact O-N 3.36Å; R624-E628 HydrophobicContact CG-CG 4.45Å; R624-E628 IonicContact CZ-OE1 2.99Å; R624-E628 IonicContact NE-OE1 3.75Å; R624-E628 PolarHBondContact NE-OE1 3.25Å; R624-E628 IonicContact NH2-OE1 3.9Å; R624-E628 PolarHBondContact NH2-OE1 2.98Å; R624-E628 WeakPolarHBondContact O-CB 3.5Å; R624-E628 WeakPolarHBondContact O-CG 3.46Å; R624-E628 PolarHBondContact O-N 3.14Å; R624-L664 HydrophobicContact CG-CD1 4.28Å; R624-E667 IonicContact CZ-OE1 2.7Å; R624-E667 IonicContact CZ-OE2 3.39Å; R624-E667 IonicContact NH1-OE1 2.72Å; R624-E667 PolarHBondContact NH1-OE1 3.12Å; R624-E667 IonicContact NH1-OE2 3.63Å; R624-E667 VanDerWaalsContact NH2-CD 3.28Å; R624-E667 IonicContact NH2-OE1 3.76Å; R624-E667 PolarHBondContact NH2-OE1 2.87Å; R624-E667 VanDerWaalsContact NH2-OE1 3.14Å; R624-E667 IonicContact NH2-OE2 3.21Å; R624-E667 PolarHBondContact NH2-OE2 3.17Å
625	L	97.1	Very high	96.5	Very high	52 Å²	52	43.4 Å²	43.4	27%	0.272	22%	0.217	S	C	.	.	H	α-helix	trans	-64.3	-31.5	177.1	-72.5	170	0	0	0	112.9	K621 Q622 I623 K629	K621-L625 HydrophobicContact CG-CD1 4.48Å; K621-L625 WeakPolarHBondContact O-CG 3.28Å; K621-L625 PolarHBondContact O-N 3.49Å; K621-L625 VanDerWaalsContact O-N 3.12Å; Q622-L625 PolarHBondContact O-N 3.08Å; Q622-L625 VanDerWaalsContact O-N 3.14Å; I623-L625 PolarHBondContact O-N 3.08Å; L625-K629 WeakPolarHBondContact O-CD 3.48Å; L625-K629 VanDerWaalsContact O-CG 3.3Å; L625-K629 WeakPolarHBondContact O-CG 3.39Å; L625-K629 PolarHBondContact O-N 3.11Å
626	V	97.4	Very high	96.5	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-68.9	-49.2	173.1	171.5	0	0	0	0	110.4	Q586 V592 L596 Q622 I623 R624 E628 K629 H630 V635	Q586-V626 HydrophobicContact CB-CG2 4.3Å; V592-V626 HydrophobicContact CB-CG1 4.37Å; V592-V626 HydrophobicContact CG1-CG2 4.31Å; V592-V626 HydrophobicContact CG2-CG1 3.91Å; L596-V626 HydrophobicContact CD1-CG1 4.21Å; Q622-V626 WeakPolarHBondContact O-CG2 3.38Å; Q622-V626 PolarHBondContact O-N 2.98Å; I623-V626 WeakPolarHBondContact O-CB 3.41Å; I623-V626 PolarHBondContact O-N 2.89Å; I623-V626 VanDerWaalsContact O-N 3.15Å; R624-V626 VanDerWaalsContact C-N 3.28Å; R624-V626 PolarHBondContact O-N 3.37Å; V626-E628 VanDerWaalsContact C-N 3.3Å; V626-E628 PolarHBondContact O-N 2.74Å; V626-K629 PolarHBondContact O-N 3.46Å; V626-K629 VanDerWaalsContact O-N 3.08Å; V626-H630 WeakPolarHBondContact O-CB 3.39Å; V626-H630 PolarHBondContact O-CD2 3.14Å; V626-H630 PolarHBondContact O-N 2.86Å; V626-V635 HydrophobicContact CG1-CG1 3.42Å; V626-V635 VanDerWaalsContact CG1-CG1 3.42Å
627	V	96.8	Very high	96.5	Very high	1 Å²	1	44.8 Å²	44.8	1%	0.006	22%	0.223	C	C	.	.	H	α-helix	trans	-59.3	-38.9	177	179.1	0	0	0	0	112	I623 R624 K629 L636 C639 L664 M668 R700 F704	I623-V627 HydrophobicContact CG2-CG2 4.49Å; I623-V627 WeakPolarHBondContact O-CG2 3.5Å; I623-V627 PolarHBondContact O-N 3.2Å; R624-V627 PolarHBondContact O-N 3.36Å; V627-K629 VanDerWaalsContact C-N 3.26Å; V627-K629 PolarHBondContact O-N 3.28Å; V627-L636 HydrophobicContact CG1-CD2 4.17Å; V627-C639 HydrophobicContact CG2-CB 3.61Å; V627-C639 WeakPolarHBondContact CG2-SG 3.49Å; V627-L664 HydrophobicContact CB-CD2 4.47Å; V627-L664 HydrophobicContact CG1-CD1 4.38Å; V627-L664 HydrophobicContact CG1-CD2 4.34Å; V627-L664 HydrophobicContact CG2-CD2 4.42Å; V627-M668 HydrophobicContact CG1-CE 4.09Å; V627-R700 HydrophobicContact CG1-CB 4.38Å; V627-R700 HydrophobicContact CG1-CG 4.1Å; V627-R700 WeakPolarHBondContact O-CD 3.26Å; V627-R700 PolarHBondContact O-NE 2.72Å; V627-F704 HydrophobicContact CG1-CE2 4.11Å; V627-F704 HydrophobicContact CG2-CE2 3.8Å; V627-F704 HydrophobicContact CG2-CZ 3.93Å
628	E	94.1	Very high	96.5	Very high	62 Å²	62	41.9 Å²	41.9	29%	0.29	21%	0.21	S	C	.	.	H	α-helix	trans	-66.2	-24.6	177.7	-76.6	172.9	174.9	0	0	113.8	R624 V626 M668 R700	R624-E628 HydrophobicContact CG-CG 4.45Å; R624-E628 IonicContact CZ-OE1 2.99Å; R624-E628 IonicContact NE-OE1 3.75Å; R624-E628 PolarHBondContact NE-OE1 3.25Å; R624-E628 IonicContact NH2-OE1 3.9Å; R624-E628 PolarHBondContact NH2-OE1 2.98Å; R624-E628 WeakPolarHBondContact O-CB 3.5Å; R624-E628 WeakPolarHBondContact O-CG 3.46Å; R624-E628 PolarHBondContact O-N 3.14Å; V626-E628 VanDerWaalsContact C-N 3.3Å; V626-E628 PolarHBondContact O-N 2.74Å; E628-M668 HydrophobicContact CG-CE 4.1Å; E628-R700 PolarHBondContact O-NH2 3.45Å
629	K	95	Very high	96.5	Very high	98 Å²	98	40.2 Å²	40.2	43%	0.426	20%	0.195	S	C	.	.	H	α-helix	trans	-94.6	-47.2	-179.2	-74.4	171.5	169	-177.9	0	113.5	Q586 L625 V626 V627	Q586-K629 WeakPolarHBondContact O-CD 3.01Å; Q586-K629 PolarHBondContact O-NZ 3.42Å; L625-K629 WeakPolarHBondContact O-CD 3.48Å; L625-K629 VanDerWaalsContact O-CG 3.3Å; L625-K629 WeakPolarHBondContact O-CG 3.39Å; L625-K629 PolarHBondContact O-N 3.11Å; V626-K629 PolarHBondContact O-N 3.46Å; V626-K629 VanDerWaalsContact O-N 3.08Å; V627-K629 VanDerWaalsContact C-N 3.26Å; V627-K629 PolarHBondContact O-N 3.28Å
630	H	96.6	Very high	96.4	Very high	11 Å²	11	40.2 Å²	40.2	5%	0.051	20%	0.195	C	C	.	.			trans	-84.6	159	-167.4	-76.5	-79.9	0	0	0	113	V626 E632 V635 R700	V626-H630 WeakPolarHBondContact O-CB 3.39Å; V626-H630 PolarHBondContact O-CD2 3.14Å; V626-H630 PolarHBondContact O-N 2.86Å; H630-E632 WeakPolarHBondContact CA-OE2 3.39Å; H630-E632 WeakPolarHBondContact CB-OE2 3.32Å; H630-E632 IonicContact CG-OE2 2.67Å; H630-E632 IonicContact ND1-OE1 3.97Å; H630-E632 IonicContact ND1-OE2 2.72Å; H630-E632 PolarHBondContact ND1-OE2 3.27Å; H630-V635 HydrophobicContact CB-CB 4.19Å; H630-V635 HydrophobicContact CB-CG1 3.63Å; H630-R700 PolarHBondContact O-NE 2.98Å; H630-R700 PolarHBondContact O-NH2 3.14Å
631	I	95.5	Very high	96.3	Very high	41 Å²	41	42.5 Å²	42.5	21%	0.21	21%	0.205	C	C	.	.			trans	-138.5	-0.5	176.1	63.1	165.4	0	0	0	112.7	Y692 K699	I631-Y692 HydrophobicContact CD1-CE2 3.87Å; I631-K699 WeakPolarHBondContact O-CD 3.44Å
632	E	96.2	Very high	96.2	Very high	77 Å²	77	35.8 Å²	35.8	36%	0.36	18%	0.176	S	C	.	.			trans	-73.8	135.4	178.2	-58.8	83	172.4	0	0	109.8	A589 H630 D634 V635 L636	A589-E632 HydrophobicContact CB-CB 4.32Å; A589-E632 HydrophobicContact CB-CG 3.88Å; H630-E632 WeakPolarHBondContact CA-OE2 3.39Å; H630-E632 WeakPolarHBondContact CB-OE2 3.32Å; H630-E632 IonicContact CG-OE2 2.67Å; H630-E632 IonicContact ND1-OE1 3.97Å; H630-E632 IonicContact ND1-OE2 2.72Å; H630-E632 PolarHBondContact ND1-OE2 3.27Å; E632-D634 PolarHBondContact O-N 3.35Å; E632-V635 HydrophobicContact CB-CB 4.42Å; E632-V635 HydrophobicContact CB-CG2 4.07Å; E632-V635 PolarHBondContact O-N 2.91Å; E632-L636 WeakPolarHBondContact O-CG 3.35Å; E632-L636 PolarHBondContact O-N 3.32Å; E632-L636 VanDerWaalsContact O-N 3.16Å
633	T	93.4	Very high	96.1	Very high	82 Å²	82	34.7 Å²	34.7	50%	0.503	17%	0.171	S	C	.	.	H	α-helix	trans	-56.8	-52.6	-171.6	-49.2	0	0	0	0	111.5	V635 L636 E637	T633-V635 VanDerWaalsContact C-N 3.3Å; T633-V635 PolarHBondContact O-N 3.36Å; T633-L636 PolarHBondContact O-N 3.27Å; T633-L636 VanDerWaalsContact O-N 3.11Å; T633-E637 WeakPolarHBondContact O-CB 3.31Å; T633-E637 PolarHBondContact O-N 2.85Å
634	D	94.3	Very high	96	Very high	112 Å²	112	36.7 Å²	36.7	60%	0.599	19%	0.185	S	C	*	.	H	α-helix	trans	-64.4	-35.3	-171.9	-27.4	-36.7	0	0	0	111.6	A593 E632 A638	A593-D634 HydrophobicContact CB-CB 4.36Å; E632-D634 PolarHBondContact O-N 3.35Å; D634-A638 WeakPolarHBondContact O-CB 3.38Å; D634-A638 PolarHBondContact O-N 3.12Å
635	V	97.4	Very high	95.8	Very high	1 Å²	1	36.9 Å²	36.9	1%	0.006	19%	0.19	C	C	.	.	H	α-helix	trans	-66.1	-48.9	174.3	178.4	0	0	0	0	110.7	A589 V592 A593 L596 V626 H630 E632 T633 E637 A638 C639	A589-V635 HydrophobicContact CB-CG2 3.74Å; A589-V635 WeakPolarHBondContact O-CG2 3.47Å; V592-V635 HydrophobicContact CG2-CB 4.41Å; V592-V635 HydrophobicContact CG2-CG1 3.69Å; V592-V635 HydrophobicContact CG2-CG2 3.84Å; A593-V635 HydrophobicContact CB-CG2 4.12Å; L596-V635 HydrophobicContact CD1-CG1 4.48Å; V626-V635 HydrophobicContact CG1-CG1 3.42Å; V626-V635 VanDerWaalsContact CG1-CG1 3.42Å; H630-V635 HydrophobicContact CB-CB 4.19Å; H630-V635 HydrophobicContact CB-CG1 3.63Å; E632-V635 HydrophobicContact CB-CB 4.42Å; E632-V635 HydrophobicContact CB-CG2 4.07Å; E632-V635 PolarHBondContact O-N 2.91Å; T633-V635 VanDerWaalsContact C-N 3.3Å; T633-V635 PolarHBondContact O-N 3.36Å; V635-E637 VanDerWaalsContact C-N 3.34Å; V635-A638 PolarHBondContact O-N 3.11Å; V635-C639 WeakPolarHBondContact O-CB 3.39Å; V635-C639 PolarHBondContact O-N 3.35Å; V635-C639 PolarHBondContact O-SG 3.1Å
636	L	97.4	Very high	95.6	Very high	2 Å²	2	34.4 Å²	34.4	1%	0.01	18%	0.177	C	C	.	.	H	α-helix	trans	-68.2	-35.5	-178.6	-65.9	177.2	0	0	0	112	V627 E632 T633 C639 S640 K699 R700 A703	V627-L636 HydrophobicContact CG1-CD2 4.17Å; E632-L636 WeakPolarHBondContact O-CG 3.35Å; E632-L636 PolarHBondContact O-N 3.32Å; E632-L636 VanDerWaalsContact O-N 3.16Å; T633-L636 PolarHBondContact O-N 3.27Å; T633-L636 VanDerWaalsContact O-N 3.11Å; L636-C639 WeakPolarHBondContact O-CB 3.37Å; L636-S640 PolarHBondContact O-N 2.91Å; L636-K699 HydrophobicContact CD1-CB 3.9Å; L636-R700 HydrophobicContact CD1-CG 4.09Å; L636-R700 HydrophobicContact CD2-CG 3.75Å; L636-A703 HydrophobicContact CB-CB 3.7Å
637	E	95.8	Very high	95.4	Very high	56 Å²	56	35.1 Å²	35.1	26%	0.262	18%	0.182	S	C	.	.	H	α-helix	trans	-70.3	-45.7	175.1	-166.8	-174.8	109.3	0	0	111.6	T633 V635 C639 S640 K641	T633-E637 WeakPolarHBondContact O-CB 3.31Å; T633-E637 PolarHBondContact O-N 2.85Å; V635-E637 VanDerWaalsContact C-N 3.34Å; E637-C639 VanDerWaalsContact C-N 3.3Å; E637-C639 PolarHBondContact O-N 2.87Å; E637-S640 PolarHBondContact O-N 2.91Å; E637-K641 HydrophobicContact CG-CD 4.02Å; E637-K641 HydrophobicContact CG-CG 4.32Å; E637-K641 WeakPolarHBondContact O-CB 3.45Å; E637-K641 PolarHBondContact O-N 3.07Å; E637-K641 VanDerWaalsContact OE1-CE 3.25Å; E637-K641 WeakPolarHBondContact OE1-CE 3.45Å; E637-K641 IonicContact OE1-NZ 2.75Å; E637-K641 PolarHBondContact OE1-NZ 3.38Å
638	A	96.1	Very high	95.1	Very high	11 Å²	11	36.8 Å²	36.8	9%	0.091	19%	0.193	C	C	.	.	H	α-helix	trans	-61.6	-38.7	174.4	0	0	0	0	0	111.6	L596 D634 V635 T642	L596-A638 HydrophobicContact CB-CB 3.68Å; L596-A638 HydrophobicContact CD1-CB 4.17Å; D634-A638 WeakPolarHBondContact O-CB 3.38Å; D634-A638 PolarHBondContact O-N 3.12Å; V635-A638 PolarHBondContact O-N 3.11Å; A638-T642 VanDerWaalsContact O-CB 3.25Å; A638-T642 WeakPolarHBondContact O-CB 3.48Å; A638-T642 PolarHBondContact O-N 3.49Å; A638-T642 VanDerWaalsContact O-N 3.13Å; A638-T642 PolarHBondContact O-OG1 2.97Å
639	C	97.4	Very high	94.8	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-56.8	-48.5	169.1	-76.9	0	0	0	0	112	L596 I623 V627 V635 L636 E637 Y643 F704	L596-C639 WeakPolarHBondContact CD1-SG 3.12Å; I623-C639 HydrophobicContact CG2-CB 4.03Å; V627-C639 HydrophobicContact CG2-CB 3.61Å; V627-C639 WeakPolarHBondContact CG2-SG 3.49Å; V635-C639 WeakPolarHBondContact O-CB 3.39Å; V635-C639 PolarHBondContact O-N 3.35Å; V635-C639 PolarHBondContact O-SG 3.1Å; L636-C639 WeakPolarHBondContact O-CB 3.37Å; E637-C639 VanDerWaalsContact C-N 3.3Å; E637-C639 PolarHBondContact O-N 2.87Å; C639-Y643 WeakPolarHBondContact O-CB 3.3Å; C639-Y643 WeakPolarHBondContact O-CD2 3.28Å; C639-Y643 PolarHBondContact O-N 3.4Å; C639-F704 HydrophobicContact CB-CE2 4.19Å; C639-F704 HydrophobicContact CB-CZ 4.26Å
640	S	96.9	Very high	94.5	Very high	1 Å²	1	45.3 Å²	45.3	1%	0.007	23%	0.234	C	C	.	.	H	α-helix	trans	-72.6	-46.1	-176.5	-177.6	0	0	0	0	113.4	L636 E637 T642 Y643 S644 A703 F704 A707 H708	L636-S640 PolarHBondContact O-N 2.91Å; E637-S640 PolarHBondContact O-N 2.91Å; S640-T642 VanDerWaalsContact C-N 3.28Å; S640-T642 PolarHBondContact O-N 2.86Å; S640-Y643 CarbonylContact O-C 3.48Å; S640-Y643 PolarHBondContact O-N 3.19Å; S640-Y643 VanDerWaalsContact O-N 3.14Å; S640-S644 WeakPolarHBondContact O-CB 3.18Å; S640-S644 PolarHBondContact O-N 3.11Å; S640-A703 PolarHBondContact OG-O 3.42Å; S640-F704 WeakPolarHBondContact OG-CA 3.43Å; S640-A707 WeakPolarHBondContact OG-CB 3.22Å; S640-H708 PolarHBondContact O-NE2 3.23Å
641	K	95.6	Very high	94.2	Very high	58 Å²	58	47.6 Å²	47.6	25%	0.252	24%	0.243	S	C	.	.	H	α-helix	trans	-56.4	-43.4	175.3	-75.4	179.4	172.6	170.7	0	110.8	E637 S644 I645 E1252	E637-K641 HydrophobicContact CG-CD 4.02Å; E637-K641 HydrophobicContact CG-CG 4.32Å; E637-K641 WeakPolarHBondContact O-CB 3.45Å; E637-K641 PolarHBondContact O-N 3.07Å; E637-K641 VanDerWaalsContact OE1-CE 3.25Å; E637-K641 WeakPolarHBondContact OE1-CE 3.45Å; E637-K641 IonicContact OE1-NZ 2.75Å; E637-K641 PolarHBondContact OE1-NZ 3.38Å; K641-S644 WeakPolarHBondContact O-CB 3.28Å; K641-S644 PolarHBondContact O-N 3.47Å; K641-S644 VanDerWaalsContact O-N 3.16Å; K641-I645 PolarHBondContact O-N 2.68Å; K641-I645 VanDerWaalsContact O-N 3.11Å; K641-E1252 PolarHBondContact NZ-O 3.35Å
642	T	95.4	Very high	94	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-70.3	-37.9	175.5	-75.6	0	0	0	0	113.4	L596 P599 Q600 I623 A638 S640 S644 L646	L596-T642 PolarHBondContact O-OG1 3.32Å; P599-T642 HydrophobicContact CB-CG2 3.87Å; P599-T642 HydrophobicContact CG-CG2 3.86Å; Q600-T642 WeakPolarHBondContact CG-OG1 3.28Å; Q600-T642 PolarHBondContact NE2-OG1 3.24Å; I623-T642 HydrophobicContact CD1-CG2 3.92Å; A638-T642 VanDerWaalsContact O-CB 3.25Å; A638-T642 WeakPolarHBondContact O-CB 3.48Å; A638-T642 PolarHBondContact O-N 3.49Å; A638-T642 VanDerWaalsContact O-N 3.13Å; A638-T642 PolarHBondContact O-OG1 2.97Å; S640-T642 VanDerWaalsContact C-N 3.28Å; S640-T642 PolarHBondContact O-N 2.86Å; T642-S644 PolarHBondContact O-N 3.11Å; T642-L646 HydrophobicContact CG2-CD1 3.92Å; T642-L646 WeakPolarHBondContact O-CB 3.35Å; T642-L646 VanDerWaalsContact O-CG 3.24Å; T642-L646 WeakPolarHBondContact O-CG 3.29Å; T642-L646 PolarHBondContact O-N 3.37Å; T642-L646 VanDerWaalsContact O-N 3.09Å
643	Y	95.8	Very high	93.9	Very high	2 Å²	2	47.1 Å²	47.1	1%	0.008	25%	0.247	C	C	.	.	H	α-helix	trans	-61.6	-30.2	169	-104.6	-73.8	0	0	0	112.4	L620 I623 C639 S640 C647 V657 R661 L664 F704 H708	L620-Y643 HydrophobicContact CD2-CD1 4.45Å; L620-Y643 HydrophobicContact CD2-CE1 3.8Å; I623-Y643 HydrophobicContact CB-CE2 4.11Å; I623-Y643 HydrophobicContact CG2-CD2 3.78Å; I623-Y643 HydrophobicContact CG2-CE2 3.53Å; C639-Y643 WeakPolarHBondContact O-CB 3.3Å; C639-Y643 WeakPolarHBondContact O-CD2 3.28Å; C639-Y643 PolarHBondContact O-N 3.4Å; S640-Y643 CarbonylContact O-C 3.48Å; S640-Y643 PolarHBondContact O-N 3.19Å; S640-Y643 VanDerWaalsContact O-N 3.14Å; Y643-C647 VanDerWaalsContact O-CB 3.24Å; Y643-C647 WeakPolarHBondContact O-CB 3.2Å; Y643-C647 PolarHBondContact O-N 2.73Å; Y643-C647 PolarHBondContact O-SG 2.91Å; Y643-V657 HydrophobicContact CD1-CG1 3.83Å; Y643-V657 HydrophobicContact CE1-CG1 4.05Å; Y643-R661 HydrophobicContact CD1-CB 4.01Å; Y643-R661 HydrophobicContact CD1-CG 4.48Å; Y643-R661 HydrophobicContact CE1-CB 3.96Å; Y643-L664 HydrophobicContact CE2-CD2 4.18Å; Y643-F704 AromaticContact CD2-CE1 3.64Å; Y643-F704 HydrophobicContact CD2-CE1 3.64Å; Y643-F704 AromaticContact CD2-CZ 3.7Å; Y643-F704 HydrophobicContact CD2-CZ 3.7Å; Y643-F704 HydrophobicContact CE2-CE1 4.22Å; Y643-F704 HydrophobicContact CE2-CZ 4.17Å; Y643-F704 AromaticContact CG-CE1 3.97Å; Y643-F704 HydrophobicContact CG-CE1 3.97Å; Y643-F704 HydrophobicContact CG-CZ 4.45Å; Y643-H708 WeakPolarHBondContact CB-NE2 3.33Å; Y643-H708 PolarHBondContact O-NE2 3.28Å
644	S	94.4	Very high	93.9	Very high	42 Å²	42	45.2 Å²	45.2	29%	0.294	23%	0.233	S	C	.	.	H	α-helix	trans	-73.8	-48.1	-177.1	-160.3	0	0	0	0	110.9	S640 K641 T642 L646 C647 S648 A707 H708	S640-S644 WeakPolarHBondContact O-CB 3.18Å; S640-S644 PolarHBondContact O-N 3.11Å; K641-S644 WeakPolarHBondContact O-CB 3.28Å; K641-S644 PolarHBondContact O-N 3.47Å; K641-S644 VanDerWaalsContact O-N 3.16Å; T642-S644 PolarHBondContact O-N 3.11Å; S644-L646 VanDerWaalsContact C-N 3.34Å; S644-L646 PolarHBondContact O-N 3.17Å; S644-C647 CarbonylContact O-C 3.51Å; S644-C647 WeakPolarHBondContact O-CA 3.31Å; S644-C647 PolarHBondContact O-N 3.21Å; S644-S648 PolarHBondContact O-N 3.4Å; S644-A707 PolarHBondContact OG-O 3.36Å; S644-H708 WeakPolarHBondContact CA-NE2 3.33Å; S644-H708 WeakPolarHBondContact CB-NE2 3.42Å; S644-H708 PolarHBondContact N-NE2 3.21Å; S644-H708 PolarHBondContact OG-CE1 3.1Å; S644-H708 VanDerWaalsContact OG-CE1 3.24Å; S644-H708 PolarHBondContact OG-NE2 2.99Å
645	I	92.6	Very high	93.9	Very high	65 Å²	65	45.1 Å²	45.1	33%	0.333	23%	0.233	S	C	.	.	H	α-helix	trans	-61.2	-41.4	175.1	-72.4	161	0	0	0	111.6	Q600 L604 K641 C647 S648	Q600-I645 HydrophobicContact CB-CD1 3.72Å; Q600-I645 HydrophobicContact CG-CD1 3.61Å; L604-I645 HydrophobicContact CD1-CG2 4.04Å; L604-I645 WeakPolarHBondContact CD1-O 3.49Å; K641-I645 PolarHBondContact O-N 2.68Å; K641-I645 VanDerWaalsContact O-N 3.11Å; I645-C647 PolarHBondContact O-N 2.78Å; I645-S648 PolarHBondContact O-N 3.03Å
646	L	93.8	Very high	93.7	Very high	1 Å²	1	49.9 Å²	49.9	1%	0.005	25%	0.251	C	S	.	.	H	α-helix	trans	-69.2	-19.4	174.3	-67.6	173.4	0	0	0	113.5	L604 Y607 L616 L619 L620 I623 T642 S644 I653 V657	L604-L646 HydrophobicContact CD1-CD2 4.3Å; L604-L646 HydrophobicContact CD2-CD2 3.7Å; Y607-L646 HydrophobicContact CE2-CD2 4.32Å; L616-L646 HydrophobicContact CD1-CD1 4.43Å; L616-L646 HydrophobicContact CD1-CD2 4.23Å; L619-L646 HydrophobicContact CD2-CD1 4.25Å; L620-L646 HydrophobicContact CD2-CD1 4.32Å; I623-L646 HydrophobicContact CD1-CD1 4.45Å; T642-L646 HydrophobicContact CG2-CD1 3.92Å; T642-L646 WeakPolarHBondContact O-CB 3.35Å; T642-L646 VanDerWaalsContact O-CG 3.24Å; T642-L646 WeakPolarHBondContact O-CG 3.29Å; T642-L646 PolarHBondContact O-N 3.37Å; T642-L646 VanDerWaalsContact O-N 3.09Å; S644-L646 VanDerWaalsContact C-N 3.34Å; S644-L646 PolarHBondContact O-N 3.17Å; L646-I653 HydrophobicContact CD2-CD1 4.05Å; L646-V657 HydrophobicContact CB-CG1 3.76Å; L646-V657 HydrophobicContact CB-CG2 4.1Å; L646-V657 WeakPolarHBondContact O-CG2 3.44Å
647	C	93.1	Very high	93.7	Very high	15 Å²	15	49.8 Å²	49.8	10%	0.101	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.7	8.8	174.6	-74.9	0	0	0	0	114.1	Y643 S644 I645 E649 M654 V657	Y643-C647 VanDerWaalsContact O-CB 3.24Å; Y643-C647 WeakPolarHBondContact O-CB 3.2Å; Y643-C647 PolarHBondContact O-N 2.73Å; Y643-C647 PolarHBondContact O-SG 2.91Å; S644-C647 CarbonylContact O-C 3.51Å; S644-C647 WeakPolarHBondContact O-CA 3.31Å; S644-C647 PolarHBondContact O-N 3.21Å; I645-C647 PolarHBondContact O-N 2.78Å; C647-E649 PolarHBondContact O-N 3.48Å; C647-M654 WeakPolarHBondContact O-CG 3.14Å; C647-V657 WeakPolarHBondContact SG-CG1 3.45Å
648	S	90.9	Very high	93.6	Very high	36 Å²	36	49.3 Å²	49.3	25%	0.252	25%	0.249	S	C	.	.			trans	-62.1	131.9	178.3	172.8	0	0	0	0	112.1	S644 I645 E650 Y651	S644-S648 PolarHBondContact O-N 3.4Å; I645-S648 PolarHBondContact O-N 3.03Å; S648-E650 PolarHBondContact O-N 2.92Å; S648-E650 VanDerWaalsContact O-N 3.16Å; S648-E650 PolarHBondContact OG-N 2.63Å; S648-Y651 PolarHBondContact O-N 3.17Å
649	E	87.4	Confident	93.6	Very high	174 Å²	174	53.5 Å²	53.5	81%	0.813	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-18	178.9	-57.7	-162.1	154.1	0	0	113.5	C647 Y651 M654	C647-E649 PolarHBondContact O-N 3.48Å; E649-Y651 PolarHBondContact O-N 2.82Å; E649-M654 HydrophobicContact CB-SD 4.26Å; E649-M654 HydrophobicContact CG-SD 3.97Å
650	E	89	Confident	93.6	Very high	164 Å²	164	54.5 Å²	54.5	77%	0.766	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-25.3	178.4	-60.5	-173.5	137.9	0	0	112.6	S648	S648-E650 PolarHBondContact O-N 2.92Å; S648-E650 VanDerWaalsContact O-N 3.16Å; S648-E650 PolarHBondContact OG-N 2.63Å
651	Y	90.3	Very high	93.5	Very high	59 Å²	59	57 Å²	57	23%	0.231	29%	0.287	C	S	.	.	S	Bend	trans	-109.5	137.7	-171.3	-61.9	-71.6	0	0	0	113.9	L604 S648 E649 I653 M654	L604-Y651 HydrophobicContact CB-CD1 3.76Å; L604-Y651 HydrophobicContact CB-CD2 3.94Å; L604-Y651 HydrophobicContact CB-CE1 3.85Å; L604-Y651 HydrophobicContact CB-CE2 4.02Å; L604-Y651 HydrophobicContact CB-CG 3.8Å; L604-Y651 HydrophobicContact CD1-CD2 3.72Å; L604-Y651 HydrophobicContact CD1-CE2 3.8Å; L604-Y651 HydrophobicContact CD1-CG 4.35Å; L604-Y651 HydrophobicContact CG-CD2 4.4Å; L604-Y651 HydrophobicContact CG-CE2 4.29Å; S648-Y651 PolarHBondContact O-N 3.17Å; E649-Y651 PolarHBondContact O-N 2.82Å; Y651-I653 PolarHBondContact O-N 3.33Å; Y651-M654 WeakPolarHBondContact O-CB 3.42Å; Y651-M654 PolarHBondContact O-N 2.94Å
652	T	91.4	Very high	93.6	Very high	103 Å²	103	55 Å²	55	63%	0.632	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-15	179.5	50.9	0	0	0	0	115	S608	S608-T652 WeakPolarHBondContact CB-OG1 3.32Å; S608-T652 PolarHBondContact OG-OG1 3.46Å
653	I	93.2	Very high	93.6	Very high	6 Å²	6	60 Å²	60	3%	0.031	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-19.3	175.8	65.2	173.2	0	0	0	114	L604 Y607 L616 L646 Y651 N655 R656 V657	L604-I653 HydrophobicContact CB-CD1 4.31Å; L604-I653 HydrophobicContact CD1-CD1 4.4Å; L604-I653 HydrophobicContact CD2-CD1 4.47Å; Y607-I653 HydrophobicContact CD2-CD1 4.08Å; L616-I653 HydrophobicContact CD2-CB 3.72Å; L616-I653 HydrophobicContact CD2-CD1 4.06Å; L616-I653 HydrophobicContact CD2-CG1 4.43Å; L616-I653 HydrophobicContact CD2-CG2 3.87Å; L646-I653 HydrophobicContact CD2-CD1 4.05Å; Y651-I653 PolarHBondContact O-N 3.33Å; I653-N655 PolarHBondContact O-N 3.41Å; I653-R656 VanDerWaalsContact O-CB 3.29Å; I653-R656 WeakPolarHBondContact O-CB 3.43Å; I653-R656 PolarHBondContact O-N 2.97Å; I653-V657 HydrophobicContact CD1-CG2 4.46Å; I653-V657 HydrophobicContact CG1-CG2 4.44Å; I653-V657 PolarHBondContact O-N 3.12Å
654	M	94.1	Very high	93.7	Very high	41 Å²	41	59.9 Å²	59.9	20%	0.202	30%	0.303	C	S	.	.	H	α-helix	trans	-44.1	-54	-171.1	-174.1	-142.6	83.7	0	0	113.6	C647 E649 Y651 R656 V657 D658	C647-M654 WeakPolarHBondContact O-CG 3.14Å; E649-M654 HydrophobicContact CB-SD 4.26Å; E649-M654 HydrophobicContact CG-SD 3.97Å; Y651-M654 WeakPolarHBondContact O-CB 3.42Å; Y651-M654 PolarHBondContact O-N 2.94Å; M654-R656 PolarHBondContact O-N 2.76Å; M654-R656 VanDerWaalsContact O-N 3.11Å; M654-V657 PolarHBondContact O-N 2.8Å; M654-V657 VanDerWaalsContact O-N 3.11Å; M654-D658 WeakPolarHBondContact O-CB 3.26Å; M654-D658 PolarHBondContact O-N 2.77Å
655	N	93.1	Very high	93.8	Very high	110 Å²	110	58 Å²	58	59%	0.588	29%	0.29	S	S	*	.	H	α-helix	trans	-58	-28.7	-178.3	-67.6	-81.6	0	0	0	113.7	I653 I659	I653-N655 PolarHBondContact O-N 3.41Å; N655-I659 VanDerWaalsContact O-CD1 3.31Å; N655-I659 WeakPolarHBondContact O-CD1 3.34Å; N655-I659 VanDerWaalsContact O-CG1 3.26Å; N655-I659 WeakPolarHBondContact O-CG1 3.49Å; N655-I659 PolarHBondContact O-N 2.86Å
656	R	94.4	Very high	94	Very high	102 Å²	102	57.5 Å²	57.5	39%	0.385	29%	0.288	S	S	.	.	H	α-helix	trans	-79.1	-40.1	179.8	-164.5	-174.8	-163.6	119.4	-2.3	111.2	D617 I653 M654	D617-R656 VanDerWaalsContact CG-NH2 3.31Å; D617-R656 IonicContact OD1-CZ 2.84Å; D617-R656 IonicContact OD1-NE 3.37Å; D617-R656 PolarHBondContact OD1-NE 2.89Å; D617-R656 IonicContact OD1-NH2 3.47Å; D617-R656 PolarHBondContact OD1-NH2 2.89Å; D617-R656 IonicContact OD2-CZ 3.26Å; D617-R656 IonicContact OD2-NE 2.7Å; D617-R656 IonicContact OD2-NH2 2.73Å; D617-R656 PolarHBondContact OD2-NH2 3.11Å; I653-R656 VanDerWaalsContact O-CB 3.29Å; I653-R656 WeakPolarHBondContact O-CB 3.43Å; I653-R656 PolarHBondContact O-N 2.97Å; M654-R656 PolarHBondContact O-N 2.76Å; M654-R656 VanDerWaalsContact O-N 3.11Å
657	V	96.1	Very high	94.1	Very high	0 Å²	0	61.1 Å²	61.1	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-71	-42.8	178.4	-176	0	0	0	0	110.3	L616 L620 Y643 L646 C647 I653 M654 I659 A660 R661	L616-V657 HydrophobicContact CD1-CG2 4.31Å; L616-V657 HydrophobicContact CD2-CG2 4.04Å; L620-V657 HydrophobicContact CD1-CG2 4.22Å; L620-V657 HydrophobicContact CD2-CG1 3.89Å; L620-V657 HydrophobicContact CD2-CG2 4.4Å; Y643-V657 HydrophobicContact CD1-CG1 3.83Å; Y643-V657 HydrophobicContact CE1-CG1 4.05Å; L646-V657 HydrophobicContact CB-CG1 3.76Å; L646-V657 HydrophobicContact CB-CG2 4.1Å; L646-V657 WeakPolarHBondContact O-CG2 3.44Å; C647-V657 WeakPolarHBondContact SG-CG1 3.45Å; I653-V657 HydrophobicContact CD1-CG2 4.46Å; I653-V657 HydrophobicContact CG1-CG2 4.44Å; I653-V657 PolarHBondContact O-N 3.12Å; M654-V657 PolarHBondContact O-N 2.8Å; M654-V657 VanDerWaalsContact O-N 3.11Å; V657-I659 VanDerWaalsContact C-N 3.35Å; V657-I659 PolarHBondContact O-N 2.86Å; V657-A660 WeakPolarHBondContact O-CB 3.42Å; V657-A660 PolarHBondContact O-N 3.02Å; V657-A660 VanDerWaalsContact O-N 3.1Å; V657-R661 PolarHBondContact O-N 3.12Å
658	D	95.1	Very high	94.3	Very high	45 Å²	45	60.6 Å²	60.6	24%	0.241	30%	0.301	C	S	.	.	H	α-helix	trans	-62.8	-36.9	179.4	-179.9	52.1	0	0	0	113.3	M654 A660 R661 S662	M654-D658 WeakPolarHBondContact O-CB 3.26Å; M654-D658 PolarHBondContact O-N 2.77Å; D658-A660 VanDerWaalsContact C-N 3.33Å; D658-A660 PolarHBondContact O-N 2.88Å; D658-R661 PolarHBondContact O-N 3.26Å; D658-R661 IonicContact OD1-CZ 3.82Å; D658-R661 IonicContact OD1-NE 3.01Å; D658-R661 PolarHBondContact OD1-NE 3.37Å; D658-R661 IonicContact OD1-NH2 2.69Å; D658-R661 PolarHBondContact OD1-NH2 3.01Å; D658-S662 VanDerWaalsContact O-CB 3.26Å; D658-S662 WeakPolarHBondContact O-CB 3.42Å; D658-S662 PolarHBondContact O-N 3.18Å; D658-S662 PolarHBondContact O-OG 3.36Å; D658-S662 VanDerWaalsContact O-OG 3.04Å
659	I	96.1	Very high	94.6	Very high	99 Å²	99	59.6 Å²	59.6	51%	0.508	29%	0.293	S	S	.	.	H	α-helix	trans	-61.4	-43.6	173.1	-70.9	167.1	0	0	0	110.6	N655 V657 Q663	N655-I659 VanDerWaalsContact O-CD1 3.31Å; N655-I659 WeakPolarHBondContact O-CD1 3.34Å; N655-I659 VanDerWaalsContact O-CG1 3.26Å; N655-I659 WeakPolarHBondContact O-CG1 3.49Å; N655-I659 PolarHBondContact O-N 2.86Å; V657-I659 VanDerWaalsContact C-N 3.35Å; V657-I659 PolarHBondContact O-N 2.86Å; I659-Q663 VanDerWaalsContact O-CG 3.27Å; I659-Q663 WeakPolarHBondContact O-CG 3.48Å; I659-Q663 PolarHBondContact O-N 3.07Å; I659-Q663 VanDerWaalsContact O-N 3.11Å
660	A	96.3	Very high	95	Very high	22 Å²	22	57 Å²	57	18%	0.182	29%	0.285	C	S	.	.	H	α-helix	trans	-68.8	-39.3	178	0	0	0	0	0	112.3	L620 V657 D658 L664	L620-A660 HydrophobicContact CB-CB 4.46Å; L620-A660 HydrophobicContact CD1-CB 4.13Å; V657-A660 WeakPolarHBondContact O-CB 3.42Å; V657-A660 PolarHBondContact O-N 3.02Å; V657-A660 VanDerWaalsContact O-N 3.1Å; D658-A660 VanDerWaalsContact C-N 3.33Å; D658-A660 PolarHBondContact O-N 2.88Å; A660-L664 PolarHBondContact O-N 3.06Å; A660-L664 VanDerWaalsContact O-N 3.15Å
661	R	96.3	Very high	95.3	Very high	52 Å²	52	53.5 Å²	53.5	20%	0.196	27%	0.265	C	S	.	.	H	α-helix	trans	-61	-52.1	173.2	179.2	-179.7	66.6	166.7	-1.8	111	Y643 V657 D658 Q663 L664 I665 H708	Y643-R661 HydrophobicContact CD1-CB 4.01Å; Y643-R661 HydrophobicContact CD1-CG 4.48Å; Y643-R661 HydrophobicContact CE1-CB 3.96Å; V657-R661 PolarHBondContact O-N 3.12Å; D658-R661 PolarHBondContact O-N 3.26Å; D658-R661 IonicContact OD1-CZ 3.82Å; D658-R661 IonicContact OD1-NE 3.01Å; D658-R661 PolarHBondContact OD1-NE 3.37Å; D658-R661 IonicContact OD1-NH2 2.69Å; D658-R661 PolarHBondContact OD1-NH2 3.01Å; R661-Q663 VanDerWaalsContact C-N 3.33Å; R661-Q663 PolarHBondContact O-N 3.02Å; R661-L664 WeakPolarHBondContact O-CB 3.23Å; R661-L664 PolarHBondContact O-N 2.93Å; R661-L664 VanDerWaalsContact O-N 3.11Å; R661-I665 HydrophobicContact CG-CG1 4.48Å; R661-I665 WeakPolarHBondContact O-CG1 3.24Å; R661-I665 PolarHBondContact O-N 3.13Å; R661-H708 PolarHBondContact NH1-CE1 3.15Å; R661-H708 PolarHBondContact NH1-ND1 3.01Å
662	S	96.4	Very high	95.6	Very high	18 Å²	18	50.7 Å²	50.7	13%	0.126	25%	0.254	C	S	.	.	H	α-helix	trans	-57.7	-44.6	-179.4	-71.4	0	0	0	0	111.7	D658 L664 I665 D666	D658-S662 VanDerWaalsContact O-CB 3.26Å; D658-S662 WeakPolarHBondContact O-CB 3.42Å; D658-S662 PolarHBondContact O-N 3.18Å; D658-S662 PolarHBondContact O-OG 3.36Å; D658-S662 VanDerWaalsContact O-OG 3.04Å; S662-L664 PolarHBondContact O-N 3.13Å; S662-I665 PolarHBondContact O-N 2.91Å; S662-D666 WeakPolarHBondContact O-CB 3.47Å; S662-D666 PolarHBondContact O-N 3.08Å
663	Q	96.5	Very high	95.8	Very high	103 Å²	103	47.2 Å²	47.2	48%	0.481	24%	0.236	S	C	.	.	H	α-helix	trans	-61.6	-40.5	176	-73.1	170.2	3	0	0	112.7	I659 R661 E667	I659-Q663 VanDerWaalsContact O-CG 3.27Å; I659-Q663 WeakPolarHBondContact O-CG 3.48Å; I659-Q663 PolarHBondContact O-N 3.07Å; I659-Q663 VanDerWaalsContact O-N 3.11Å; R661-Q663 VanDerWaalsContact C-N 3.33Å; R661-Q663 PolarHBondContact O-N 3.02Å; Q663-E667 WeakPolarHBondContact O-CG 3.31Å; Q663-E667 PolarHBondContact O-N 2.99Å
664	L	96.8	Very high	95.8	Very high	1 Å²	1	52.5 Å²	52.5	1%	0.005	26%	0.26	C	S	.	.	H	α-helix	trans	-64.2	-43.1	175.5	178.4	58.9	0	0	0	111.8	R624 V627 Y643 A660 R661 S662 M668 F704	R624-L664 HydrophobicContact CG-CD1 4.28Å; V627-L664 HydrophobicContact CB-CD2 4.47Å; V627-L664 HydrophobicContact CG1-CD1 4.38Å; V627-L664 HydrophobicContact CG1-CD2 4.34Å; V627-L664 HydrophobicContact CG2-CD2 4.42Å; Y643-L664 HydrophobicContact CE2-CD2 4.18Å; A660-L664 PolarHBondContact O-N 3.06Å; A660-L664 VanDerWaalsContact O-N 3.15Å; R661-L664 WeakPolarHBondContact O-CB 3.23Å; R661-L664 PolarHBondContact O-N 2.93Å; R661-L664 VanDerWaalsContact O-N 3.11Å; S662-L664 PolarHBondContact O-N 3.13Å; L664-M668 HydrophobicContact CD1-CE 3.72Å; L664-M668 HydrophobicContact CD1-CG 4.18Å; L664-M668 WeakPolarHBondContact O-CB 3.19Å; L664-M668 WeakPolarHBondContact O-CG 3.26Å; L664-M668 PolarHBondContact O-N 3.31Å; L664-M668 VanDerWaalsContact O-N 3.07Å; L664-F704 HydrophobicContact CD2-CE1 4.03Å; L664-F704 HydrophobicContact CD2-CZ 3.86Å
665	I	97.5	Very high	95.9	Very high	3 Å²	3	51.3 Å²	51.3	2%	0.015	26%	0.256	C	S	.	.	H	α-helix	trans	-73.2	-39.8	179.8	-58.8	-56.5	0	0	0	112.5	R661 S662 E667 M668 T669 L701 F704 L710 W713	R661-I665 HydrophobicContact CG-CG1 4.48Å; R661-I665 WeakPolarHBondContact O-CG1 3.24Å; R661-I665 PolarHBondContact O-N 3.13Å; S662-I665 PolarHBondContact O-N 2.91Å; I665-E667 VanDerWaalsContact C-N 3.34Å; I665-E667 PolarHBondContact O-N 3.42Å; I665-M668 PolarHBondContact O-N 2.8Å; I665-T669 VanDerWaalsContact O-CB 3.28Å; I665-T669 WeakPolarHBondContact O-CB 3.46Å; I665-T669 PolarHBondContact O-N 3.1Å; I665-T669 PolarHBondContact O-OG1 3.15Å; I665-L701 HydrophobicContact CG2-CD2 4.45Å; I665-F704 HydrophobicContact CD1-CB 3.74Å; I665-F704 HydrophobicContact CD1-CD1 3.84Å; I665-F704 HydrophobicContact CD1-CG 3.93Å; I665-L710 HydrophobicContact CD1-CD1 4.08Å; I665-L710 HydrophobicContact CD1-CD2 4.36Å; I665-L710 HydrophobicContact CG1-CD1 4.49Å; I665-L710 HydrophobicContact CG1-CD2 4.01Å; I665-L710 HydrophobicContact CG2-CD1 4.06Å; I665-L710 HydrophobicContact CG2-CD2 4.08Å; I665-W713 HydrophobicContact CB-CZ2 4.21Å; I665-W713 HydrophobicContact CG2-CD2 3.65Å; I665-W713 HydrophobicContact CG2-CE3 3.98Å; I665-W713 HydrophobicContact CG2-CG 4.01Å; I665-W713 HydrophobicContact CG2-CH2 4.39Å; I665-W713 HydrophobicContact CG2-CZ2 4.09Å; I665-W713 HydrophobicContact CG2-CZ3 4.34Å
666	D	96.9	Very high	95.9	Very high	53 Å²	53	46.1 Å²	46.1	28%	0.283	23%	0.228	S	C	.	.	H	α-helix	trans	-53.7	-52.7	172.8	-77.5	-40.5	0	0	0	109.4	S662 M668 T669 D670 R712 W713	S662-D666 WeakPolarHBondContact O-CB 3.47Å; S662-D666 PolarHBondContact O-N 3.08Å; D666-M668 PolarHBondContact O-N 2.78Å; D666-T669 PolarHBondContact O-N 2.7Å; D666-D670 PolarHBondContact O-N 2.93Å; D666-D670 VanDerWaalsContact O-N 3.09Å; D666-R712 IonicContact OD1-CZ 2.74Å; D666-R712 IonicContact OD1-NH2 3.74Å; D666-R712 PolarHBondContact OD1-NH2 3.29Å; D666-R712 IonicContact OD2-NH2 2.73Å; D666-R712 PolarHBondContact OD2-NH2 2.94Å; D666-W713 PolarHBondContact OD1-NE1 3.32Å
667	E	96.1	Very high	95.8	Very high	78 Å²	78	46 Å²	46	36%	0.364	23%	0.232	S	C	.	.	H	α-helix	trans	-68.4	-27.9	-179.2	-71.5	-179.5	-133.8	0	0	115.3	R624 Q663 I665 R671	R624-E667 IonicContact CZ-OE1 2.7Å; R624-E667 IonicContact CZ-OE2 3.39Å; R624-E667 IonicContact NH1-OE1 2.72Å; R624-E667 PolarHBondContact NH1-OE1 3.12Å; R624-E667 IonicContact NH1-OE2 3.63Å; R624-E667 VanDerWaalsContact NH2-CD 3.28Å; R624-E667 IonicContact NH2-OE1 3.76Å; R624-E667 PolarHBondContact NH2-OE1 2.87Å; R624-E667 VanDerWaalsContact NH2-OE1 3.14Å; R624-E667 IonicContact NH2-OE2 3.21Å; R624-E667 PolarHBondContact NH2-OE2 3.17Å; Q663-E667 WeakPolarHBondContact O-CG 3.31Å; Q663-E667 PolarHBondContact O-N 2.99Å; I665-E667 VanDerWaalsContact C-N 3.34Å; I665-E667 PolarHBondContact O-N 3.42Å; E667-R671 PolarHBondContact O-NE 3.31Å
668	M	95.8	Very high	95.5	Very high	3 Å²	3	49.9 Å²	49.9	2%	0.015	25%	0.25	C	S	.	.	H	α-helix	trans	-80.6	-35	175.4	-68.8	-69.4	177.3	0	0	111.4	V627 E628 L664 I665 D666 R671 F672 T697 R700 L701	V627-M668 HydrophobicContact CG1-CE 4.09Å; E628-M668 HydrophobicContact CG-CE 4.1Å; L664-M668 HydrophobicContact CD1-CE 3.72Å; L664-M668 HydrophobicContact CD1-CG 4.18Å; L664-M668 WeakPolarHBondContact O-CB 3.19Å; L664-M668 WeakPolarHBondContact O-CG 3.26Å; L664-M668 PolarHBondContact O-N 3.31Å; L664-M668 VanDerWaalsContact O-N 3.07Å; I665-M668 PolarHBondContact O-N 2.8Å; D666-M668 PolarHBondContact O-N 2.78Å; M668-R671 VanDerWaalsContact SD-CZ 3.57Å; M668-F672 WeakPolarHBondContact O-CB 3.37Å; M668-F672 PolarHBondContact O-N 2.9Å; M668-T697 HydrophobicContact CB-CG2 4.41Å; M668-T697 VanDerWaalsContact O-CG2 3.25Å; M668-T697 WeakPolarHBondContact O-CG2 3.43Å; M668-T697 HydrophobicContact SD-CG2 4.22Å; M668-R700 HydrophobicContact SD-CB 4.47Å; M668-L701 HydrophobicContact CB-CD2 3.75Å; M668-L701 HydrophobicContact CB-CG 4.12Å
669	T	96.9	Very high	95.3	Very high	15 Å²	15	48.9 Å²	48.9	9%	0.092	25%	0.245	C	C	.	.	H	α-helix	trans	-66.4	-47.2	177.5	-58.2	0	0	0	0	111.2	I665 D666 R671 F672 A673 W713 L715	I665-T669 VanDerWaalsContact O-CB 3.28Å; I665-T669 WeakPolarHBondContact O-CB 3.46Å; I665-T669 PolarHBondContact O-N 3.1Å; I665-T669 PolarHBondContact O-OG1 3.15Å; D666-T669 PolarHBondContact O-N 2.7Å; T669-R671 VanDerWaalsContact C-N 3.3Å; T669-R671 PolarHBondContact O-N 2.72Å; T669-F672 PolarHBondContact O-N 3.16Å; T669-A673 WeakPolarHBondContact O-CB 3.48Å; T669-A673 PolarHBondContact O-N 3.4Å; T669-W713 HydrophobicContact CG2-CB 4.08Å; T669-W713 HydrophobicContact CG2-CG 4.42Å; T669-L715 HydrophobicContact CG2-CD2 3.84Å
670	D	95.9	Very high	94.9	Very high	121 Å²	121	46.1 Å²	46.1	65%	0.647	23%	0.231	S	C	*	.	H	α-helix	trans	-60.1	-40.6	178.6	-78.2	-10.6	0	0	0	111.6	D666 H674	D666-D670 PolarHBondContact O-N 2.93Å; D666-D670 VanDerWaalsContact O-N 3.09Å; D670-H674 PolarHBondContact O-N 2.66Å; D670-H674 VanDerWaalsContact O-N 3.09Å
671	R	95.6	Very high	94.4	Very high	89 Å²	89	50.7 Å²	50.7	34%	0.336	25%	0.248	S	C	.	.	H	α-helix	trans	-64.3	-49.5	174.1	-84	-179.9	-80.4	178.9	-14.8	112.5	E667 M668 T669 A673 H674 S675 T697	E667-R671 PolarHBondContact O-NE 3.31Å; M668-R671 VanDerWaalsContact SD-CZ 3.57Å; T669-R671 VanDerWaalsContact C-N 3.3Å; T669-R671 PolarHBondContact O-N 2.72Å; R671-A673 VanDerWaalsContact C-N 3.3Å; R671-A673 PolarHBondContact O-N 3.26Å; R671-H674 PolarHBondContact O-N 2.68Å; R671-H674 VanDerWaalsContact O-N 3.17Å; R671-S675 PolarHBondContact O-N 3.47Å; R671-T697 HydrophobicContact CB-CG2 4.03Å
672	F	96.7	Very high	93.2	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-61.2	-40.5	179.2	174.4	-122.1	0	0	0	111.7	M668 T669 V676 V694 T697 L698 L701 L715 N718 L722	M668-F672 WeakPolarHBondContact O-CB 3.37Å; M668-F672 PolarHBondContact O-N 2.9Å; T669-F672 PolarHBondContact O-N 3.16Å; F672-V676 HydrophobicContact CD2-CG2 3.8Å; F672-V676 HydrophobicContact CE2-CG2 3.44Å; F672-V676 VanDerWaalsContact CE2-CG2 3.44Å; F672-V676 HydrophobicContact CG-CG2 4.47Å; F672-V676 HydrophobicContact CZ-CG2 3.85Å; F672-V676 WeakPolarHBondContact O-CB 3.49Å; F672-V676 WeakPolarHBondContact O-CG2 3.45Å; F672-V676 PolarHBondContact O-N 3.26Å; F672-V694 HydrophobicContact CE2-CG1 4.21Å; F672-T697 HydrophobicContact CB-CG2 3.83Å; F672-L698 HydrophobicContact CD2-CB 4.18Å; F672-L698 HydrophobicContact CE1-CD1 4.39Å; F672-L698 HydrophobicContact CE2-CB 3.86Å; F672-L698 HydrophobicContact CE2-CD1 3.9Å; F672-L698 HydrophobicContact CE2-CD2 4.25Å; F672-L698 HydrophobicContact CE2-CG 4.2Å; F672-L698 HydrophobicContact CZ-CD1 3.76Å; F672-L701 HydrophobicContact CB-CD1 3.45Å; F672-L701 VanDerWaalsContact CB-CD1 3.45Å; F672-L701 HydrophobicContact CD1-CD1 3.65Å; F672-L701 HydrophobicContact CG-CD1 3.66Å; F672-L715 HydrophobicContact CD1-CD2 4.42Å; F672-N718 HydrophobicContact CD1-CB 4.33Å; F672-N718 HydrophobicContact CE1-CB 3.59Å; F672-N718 HydrophobicContact CZ-CB 4.02Å; F672-L722 HydrophobicContact CE2-CD1 3.95Å; F672-L722 HydrophobicContact CZ-CD1 3.98Å
673	A	95.6	Very high	91.7	Very high	31 Å²	31	60.8 Å²	60.8	26%	0.256	32%	0.317	S	S	.	.	H	α-helix	trans	-61.2	-44.2	174.5	0	0	0	0	0	112	T669 R671 V676 E677	T669-A673 WeakPolarHBondContact O-CB 3.48Å; T669-A673 PolarHBondContact O-N 3.4Å; R671-A673 VanDerWaalsContact C-N 3.3Å; R671-A673 PolarHBondContact O-N 3.26Å; A673-V676 PolarHBondContact O-N 2.8Å; A673-E677 PolarHBondContact O-N 3.18Å
674	H	94.4	Very high	90.5	Very high	117 Å²	117	62.8 Å²	62.8	54%	0.542	33%	0.326	S	S	.	.	H	α-helix	trans	-62.2	-51.7	179.1	-164.3	-19.7	0	0	0	112.1	D670 R671 V676 E677 E678	D670-H674 PolarHBondContact O-N 2.66Å; D670-H674 VanDerWaalsContact O-N 3.09Å; R671-H674 PolarHBondContact O-N 2.68Å; R671-H674 VanDerWaalsContact O-N 3.17Å; H674-V676 VanDerWaalsContact C-N 3.26Å; H674-V676 PolarHBondContact O-N 3.24Å; H674-E677 PolarHBondContact O-N 3.2Å; H674-E677 VanDerWaalsContact O-N 3.09Å; H674-E678 IonicContact CE1-OE1 3.64Å; H674-E678 PolarHBondContact CE1-OE1 3.02Å; H674-E678 IonicContact CE1-OE2 3.1Å; H674-E678 IonicContact ND1-OE1 2.67Å; H674-E678 PolarHBondContact ND1-OE1 3.08Å; H674-E678 IonicContact ND1-OE2 2.67Å; H674-E678 PolarHBondContact ND1-OE2 3.48Å; H674-E678 IonicContact NE2-OE1 2.7Å; H674-E678 PolarHBondContact O-N 3.25Å; H674-E678 VanDerWaalsContact O-N 3.16Å
675	S	94.4	Very high	89.4	Confident	16 Å²	16	72.1 Å²	72.1	11%	0.112	37%	0.37	C	S	.	.	H	α-helix	trans	-71	-20.4	-177.6	-55.6	0	0	0	0	113.6	R671 E678 L679 V694	R671-S675 PolarHBondContact O-N 3.47Å; S675-E678 WeakPolarHBondContact CA-OE2 3.33Å; S675-E678 PolarHBondContact OG-OE2 3.42Å; S675-L679 VanDerWaalsContact O-CB 3.29Å; S675-L679 WeakPolarHBondContact O-CB 3.35Å; S675-L679 PolarHBondContact O-N 3.44Å; S675-V694 VanDerWaalsContact C-CG2 3.49Å; S675-V694 WeakPolarHBondContact O-CG2 3.48Å
676	V	93.7	Very high	88.6	Confident	0 Å²	0	74.2 Å²	74.2	0%	0	39%	0.388	C	S	.	.	H	α-helix	trans	-74.5	-28.7	170.2	168.7	0	0	0	0	112.5	F672 A673 H674 L680 V694 N718 L722	F672-V676 HydrophobicContact CD2-CG2 3.8Å; F672-V676 HydrophobicContact CE2-CG2 3.44Å; F672-V676 VanDerWaalsContact CE2-CG2 3.44Å; F672-V676 HydrophobicContact CG-CG2 4.47Å; F672-V676 HydrophobicContact CZ-CG2 3.85Å; F672-V676 WeakPolarHBondContact O-CB 3.49Å; F672-V676 WeakPolarHBondContact O-CG2 3.45Å; F672-V676 PolarHBondContact O-N 3.26Å; A673-V676 PolarHBondContact O-N 2.8Å; H674-V676 VanDerWaalsContact C-N 3.26Å; H674-V676 PolarHBondContact O-N 3.24Å; V676-L680 HydrophobicContact CG1-CD1 3.87Å; V676-L680 VanDerWaalsContact O-CB 3.31Å; V676-L680 WeakPolarHBondContact O-CB 3.4Å; V676-L680 WeakPolarHBondContact O-CD1 3.49Å; V676-L680 VanDerWaalsContact O-CG 3.23Å; V676-L680 WeakPolarHBondContact O-CG 3.45Å; V676-L680 PolarHBondContact O-N 3.19Å; V676-V694 HydrophobicContact CG2-CG1 4.27Å; V676-V694 HydrophobicContact CG2-CG2 4.35Å; V676-N718 HydrophobicContact CG1-CB 4.2Å; V676-L722 HydrophobicContact CG1-CD2 4.34Å; V676-L722 HydrophobicContact CG1-CG 4.34Å; V676-L722 HydrophobicContact CG2-CD1 3.9Å; V676-L722 HydrophobicContact CG2-CD2 4.19Å; V676-L722 HydrophobicContact CG2-CG 4.16Å
677	E	92.4	Very high	88	Confident	100 Å²	100	75.7 Å²	75.7	47%	0.467	40%	0.395	S	S	.	.	H	α-helix	trans	-73.2	-36.9	169.3	-57	-57.1	164.6	0	0	111.5	A673 H674 L680 Q681 R721	A673-E677 PolarHBondContact O-N 3.18Å; H674-E677 PolarHBondContact O-N 3.2Å; H674-E677 VanDerWaalsContact O-N 3.09Å; E677-L680 PolarHBondContact O-N 2.92Å; E677-Q681 PolarHBondContact O-N 3.28Å; E677-R721 IonicContact OE1-CZ 2.67Å; E677-R721 VanDerWaalsContact OE1-CZ 3.29Å; E677-R721 IonicContact OE1-NH1 3.72Å; E677-R721 PolarHBondContact OE1-NH1 3.07Å; E677-R721 IonicContact OE1-NH2 2.72Å; E677-R721 PolarHBondContact OE1-NH2 2.94Å; E677-R721 IonicContact OE2-CZ 2.78Å; E677-R721 IonicContact OE2-NH1 2.73Å; E677-R721 PolarHBondContact OE2-NH1 3.39Å; E677-R721 IonicContact OE2-NH2 3.59Å
678	E	90.4	Very high	87.7	Confident	82 Å²	82	78.6 Å²	78.6	38%	0.383	41%	0.413	S	S	.	.	H	α-helix	trans	-64.5	-53.9	177.6	-66.7	169.2	140.9	0	0	110.8	H674 S675 L680 Q681	H674-E678 IonicContact CE1-OE1 3.64Å; H674-E678 PolarHBondContact CE1-OE1 3.02Å; H674-E678 IonicContact CE1-OE2 3.1Å; H674-E678 IonicContact ND1-OE1 2.67Å; H674-E678 PolarHBondContact ND1-OE1 3.08Å; H674-E678 IonicContact ND1-OE2 2.67Å; H674-E678 PolarHBondContact ND1-OE2 3.48Å; H674-E678 IonicContact NE2-OE1 2.7Å; H674-E678 PolarHBondContact O-N 3.25Å; H674-E678 VanDerWaalsContact O-N 3.16Å; S675-E678 WeakPolarHBondContact CA-OE2 3.33Å; S675-E678 PolarHBondContact OG-OE2 3.42Å; E678-L680 PolarHBondContact O-N 2.82Å; E678-L680 VanDerWaalsContact O-N 3.11Å; E678-Q681 WeakPolarHBondContact O-CB 3.27Å; E678-Q681 PolarHBondContact O-N 3.44Å; E678-Q681 VanDerWaalsContact O-N 3.15Å
679	L	89.7	Confident	87.4	Confident	24 Å²	24	83.8 Å²	83.8	13%	0.126	44%	0.441	C	S	.	.	H	α-helix	trans	-60.9	-22.9	178.8	-167.3	78.2	0	0	0	113.8	S675 A686 D690 I691 V694 L722 M732 I736	S675-L679 VanDerWaalsContact O-CB 3.29Å; S675-L679 WeakPolarHBondContact O-CB 3.35Å; S675-L679 PolarHBondContact O-N 3.44Å; L679-A686 HydrophobicContact CD1-CB 3.62Å; L679-D690 HydrophobicContact CD1-CB 3.86Å; L679-I691 HydrophobicContact CD1-CG1 3.86Å; L679-V694 HydrophobicContact CB-CG2 3.95Å; L679-V694 HydrophobicContact CD2-CB 4.19Å; L679-V694 HydrophobicContact CD2-CG1 4.15Å; L679-V694 HydrophobicContact CD2-CG2 3.92Å; L679-V694 HydrophobicContact CG-CG2 4.4Å; L679-L722 HydrophobicContact CD2-CD2 3.8Å; L679-M732 HydrophobicContact CD2-CE 4.29Å; L679-M732 HydrophobicContact CD2-SD 4.49Å; L679-I736 HydrophobicContact CD2-CD1 4.38Å
680	L	88.4	Confident	87.1	Confident	41 Å²	41	85 Å²	85	22%	0.215	45%	0.447	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106	12.7	-178.3	-60.7	179.3	0	0	0	113.5	V676 E677 E678 E682 R721 L722 A725	V676-L680 HydrophobicContact CG1-CD1 3.87Å; V676-L680 VanDerWaalsContact O-CB 3.31Å; V676-L680 WeakPolarHBondContact O-CB 3.4Å; V676-L680 WeakPolarHBondContact O-CD1 3.49Å; V676-L680 VanDerWaalsContact O-CG 3.23Å; V676-L680 WeakPolarHBondContact O-CG 3.45Å; V676-L680 PolarHBondContact O-N 3.19Å; E677-L680 PolarHBondContact O-N 2.92Å; E678-L680 PolarHBondContact O-N 2.82Å; E678-L680 VanDerWaalsContact O-N 3.11Å; L680-E682 PolarHBondContact O-N 2.81Å; L680-R721 HydrophobicContact CD1-CB 3.95Å; L680-L722 HydrophobicContact CD1-CD2 4.41Å; L680-L722 HydrophobicContact CD2-CD2 4.44Å; L680-L722 HydrophobicContact CG-CD2 4.47Å; L680-A725 HydrophobicContact CD2-CB 3.65Å
681	Q	85.7	Confident	86.9	Confident	117 Å²	117	81.3 Å²	81.3	55%	0.547	43%	0.427	S	S	.	.			trans	-67.9	120.7	-178.9	-174.8	158.4	-89.3	0	0	112.2	E677 E678 G683 E684	E677-Q681 PolarHBondContact O-N 3.28Å; E678-Q681 WeakPolarHBondContact O-CB 3.27Å; E678-Q681 PolarHBondContact O-N 3.44Å; E678-Q681 VanDerWaalsContact O-N 3.15Å; Q681-G683 PolarHBondContact O-N 3.41Å; Q681-E684 PolarHBondContact NE2-OE2 2.87Å
682	E	71.3	Confident	86.8	Confident	203 Å²	203	82.4 Å²	82.4	95%	0.949	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	101.3	-177.4	-69.9	-171.7	169.8	0	0	112.8	L680	L680-E682 PolarHBondContact O-N 2.81Å
683	G	64.8	Low	86.7	Confident	79 Å²	79	85.7 Å²	85.7	81%	0.814	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	133	-4.4	163.7	0	0	0	0	0	116.4	Q681	Q681-G683 PolarHBondContact O-N 3.41Å
684	E	70.4	Confident	86.6	Confident	146 Å²	146	84.2 Å²	84.2	68%	0.682	44%	0.437	S	S	*	.	S	Bend	trans	-115.1	148.6	174.9	-71.6	165.8	142	0	0	109.2	Q681	Q681-E684 PolarHBondContact NE2-OE2 2.87Å
685	E	74.1	Confident	86.7	Confident	197 Å²	197	79.8 Å²	79.8	92%	0.921	42%	0.417	S	S	*	.			trans	-85.7	118.8	172.7	-70.4	-178.9	153.4	0	0	107.6
686	A	80.6	Confident	86.8	Confident	47 Å²	47	79.2 Å²	79.2	39%	0.388	41%	0.414	S	S	.	.			trans	-57.3	137.6	177.8	0	0	0	0	0	111.6	L679 D690	L679-A686 HydrophobicContact CD1-CB 3.62Å; A686-D690 HydrophobicContact CB-CB 4.37Å
687	D	85.9	Confident	86.9	Confident	84 Å²	84	79.6 Å²	79.6	45%	0.449	42%	0.416	S	S	.	.			trans	-95.7	176.8	179.1	76.8	23.6	0	0	0	113.5	D689 D690 I691	D687-D689 PolarHBondContact O-N 3.21Å; D687-D689 WeakPolarHBondContact OD1-CA 3.34Å; D687-D689 WeakPolarHBondContact OD1-CB 3.16Å; D687-D689 PolarHBondContact OD1-N 3.32Å; D687-D690 PolarHBondContact N-OD2 2.87Å; D687-D690 PolarHBondContact O-N 2.96Å; D687-D690 PolarHBondContact OD1-N 3.16Å; D687-I691 WeakPolarHBondContact O-CG1 3.49Å; D687-I691 PolarHBondContact O-N 3.41Å; D687-I691 VanDerWaalsContact O-N 3.12Å
688	D	88.1	Confident	87.2	Confident	138 Å²	138	74.8 Å²	74.8	74%	0.738	39%	0.393	S	S	*	.	H	α-helix	trans	-64.9	-27.6	-179	-68.4	-46	0	0	0	112.5	Y692	D688-Y692 VanDerWaalsContact O-CB 3.24Å; D688-Y692 WeakPolarHBondContact O-CB 3.46Å; D688-Y692 PolarHBondContact O-N 2.73Å
689	D	89.9	Confident	87.5	Confident	113 Å²	113	72.4 Å²	72.4	60%	0.604	38%	0.382	S	S	*	.	H	α-helix	trans	-75.9	-42.3	177.3	-78.1	-24.1	0	0	0	110.3	D687 I691 Y692 N693	D687-D689 PolarHBondContact O-N 3.21Å; D687-D689 WeakPolarHBondContact OD1-CA 3.34Å; D687-D689 WeakPolarHBondContact OD1-CB 3.16Å; D687-D689 PolarHBondContact OD1-N 3.32Å; D689-I691 VanDerWaalsContact C-N 3.34Å; D689-I691 PolarHBondContact O-N 3.21Å; D689-Y692 PolarHBondContact O-N 2.79Å; D689-N693 WeakPolarHBondContact O-CB 3.27Å; D689-N693 PolarHBondContact O-N 3.39Å; D689-N693 PolarHBondContact O-ND2 3.15Å
690	D	90.6	Very high	87.9	Confident	41 Å²	41	72 Å²	72	22%	0.219	38%	0.379	C	S	.	.	H	α-helix	trans	-55.3	-49.6	171.9	-69.5	-38.9	0	0	0	111.3	L679 A686 D687 Y692 N693 V694	L679-D690 HydrophobicContact CD1-CB 3.86Å; A686-D690 HydrophobicContact CB-CB 4.37Å; D687-D690 PolarHBondContact N-OD2 2.87Å; D687-D690 PolarHBondContact O-N 2.96Å; D687-D690 PolarHBondContact OD1-N 3.16Å; D690-Y692 VanDerWaalsContact C-N 3.34Å; D690-Y692 PolarHBondContact O-N 3.13Å; D690-N693 PolarHBondContact O-N 2.89Å; D690-V694 PolarHBondContact O-N 3.1Å; D690-V694 VanDerWaalsContact O-N 3.08Å
691	I	91.8	Very high	88.3	Confident	42 Å²	42	70.1 Å²	70.1	22%	0.215	37%	0.368	C	S	.	.	H	α-helix	trans	-59.5	-45	177.9	-72.9	168.5	0	0	0	110.5	L679 D687 D689 L695 P733 I736	L679-I691 HydrophobicContact CD1-CG1 3.86Å; D687-I691 WeakPolarHBondContact O-CG1 3.49Å; D687-I691 PolarHBondContact O-N 3.41Å; D687-I691 VanDerWaalsContact O-N 3.12Å; D689-I691 VanDerWaalsContact C-N 3.34Å; D689-I691 PolarHBondContact O-N 3.21Å; I691-L695 WeakPolarHBondContact O-CB 3.26Å; I691-L695 PolarHBondContact O-N 3.04Å; I691-P733 HydrophobicContact CD1-CG 4.08Å; I691-P733 HydrophobicContact CG1-CG 4.29Å; I691-P733 HydrophobicContact CG2-CB 4.47Å; I691-P733 HydrophobicContact CG2-CG 3.88Å; I691-I736 HydrophobicContact CG2-CD1 4.14Å
692	Y	93.4	Very high	88.9	Confident	112 Å²	112	64.6 Å²	64.6	44%	0.439	34%	0.343	S	S	.	.	H	α-helix	trans	-67.6	-38.1	178.8	-177.3	-94.8	0	0	0	113	I631 D688 D689 D690 L695 S696	I631-Y692 HydrophobicContact CD1-CE2 3.87Å; D688-Y692 VanDerWaalsContact O-CB 3.24Å; D688-Y692 WeakPolarHBondContact O-CB 3.46Å; D688-Y692 PolarHBondContact O-N 2.73Å; D689-Y692 PolarHBondContact O-N 2.79Å; D690-Y692 VanDerWaalsContact C-N 3.34Å; D690-Y692 PolarHBondContact O-N 3.13Å; Y692-L695 PolarHBondContact O-N 2.93Å; Y692-S696 WeakPolarHBondContact O-CB 3.33Å; Y692-S696 PolarHBondContact O-N 2.92Å; Y692-S696 PolarHBondContact O-OG 2.96Å
693	N	93.9	Very high	90.1	Very high	69 Å²	69	55.9 Å²	55.9	37%	0.369	31%	0.306	S	S	.	.	H	α-helix	trans	-64.6	-45.5	178.3	-75	-40	0	0	0	111.6	D689 D690 T697	D689-N693 WeakPolarHBondContact O-CB 3.27Å; D689-N693 PolarHBondContact O-N 3.39Å; D689-N693 PolarHBondContact O-ND2 3.15Å; D690-N693 PolarHBondContact O-N 2.89Å; N693-T697 WeakPolarHBondContact O-CB 3.38Å; N693-T697 PolarHBondContact O-N 3.5Å; N693-T697 PolarHBondContact O-OG1 2.86Å
694	V	95.4	Very high	91.6	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-63.9	-51	172.9	173.4	0	0	0	0	110.9	F672 S675 V676 L679 D690 L698 L722 I736	F672-V694 HydrophobicContact CE2-CG1 4.21Å; S675-V694 VanDerWaalsContact C-CG2 3.49Å; S675-V694 WeakPolarHBondContact O-CG2 3.48Å; V676-V694 HydrophobicContact CG2-CG1 4.27Å; V676-V694 HydrophobicContact CG2-CG2 4.35Å; L679-V694 HydrophobicContact CB-CG2 3.95Å; L679-V694 HydrophobicContact CD2-CB 4.19Å; L679-V694 HydrophobicContact CD2-CG1 4.15Å; L679-V694 HydrophobicContact CD2-CG2 3.92Å; L679-V694 HydrophobicContact CG-CG2 4.4Å; D690-V694 PolarHBondContact O-N 3.1Å; D690-V694 VanDerWaalsContact O-N 3.08Å; V694-L698 WeakPolarHBondContact O-CB 3.47Å; V694-L698 PolarHBondContact O-N 3.12Å; V694-L722 HydrophobicContact CG1-CD1 3.97Å; V694-L722 HydrophobicContact CG1-CD2 4.38Å; V694-I736 HydrophobicContact CB-CD1 4.39Å; V694-I736 HydrophobicContact CG1-CD1 4.15Å; V694-I736 HydrophobicContact CG1-CG2 4.22Å
695	L	95.5	Very high	92.8	Very high	24 Å²	24	45.3 Å²	45.3	13%	0.126	24%	0.235	C	C	.	.	H	α-helix	trans	-62.2	-47.8	-175.7	179.7	58.1	0	0	0	112.8	I691 Y692 L698 K699 Q735 I736 Q739	I691-L695 WeakPolarHBondContact O-CB 3.26Å; I691-L695 PolarHBondContact O-N 3.04Å; Y692-L695 PolarHBondContact O-N 2.93Å; L695-L698 PolarHBondContact O-N 3.16Å; L695-K699 HydrophobicContact CD1-CD 4.49Å; L695-K699 HydrophobicContact CD1-CG 4.22Å; L695-K699 WeakPolarHBondContact O-CG 3.48Å; L695-K699 PolarHBondContact O-N 3.49Å; L695-Q735 HydrophobicContact CD1-CB 3.67Å; L695-Q735 HydrophobicContact CD2-CB 3.97Å; L695-Q735 HydrophobicContact CG-CB 4.5Å; L695-I736 HydrophobicContact CB-CD1 4.3Å; L695-I736 HydrophobicContact CB-CG1 3.87Å; L695-I736 HydrophobicContact CD1-CG1 3.91Å; L695-I736 HydrophobicContact CG-CG1 4.38Å; L695-Q739 HydrophobicContact CD1-CG 4.49Å
696	S	96.3	Very high	93.8	Very high	5 Å²	5	36.6 Å²	36.6	4%	0.035	20%	0.195	C	C	.	.	H	α-helix	trans	-67.5	-37	-176.5	65.8	0	0	0	0	112.4	Y692 R700	Y692-S696 WeakPolarHBondContact O-CB 3.33Å; Y692-S696 PolarHBondContact O-N 2.92Å; Y692-S696 PolarHBondContact O-OG 2.96Å; S696-R700 WeakPolarHBondContact O-CD 3.42Å; S696-R700 VanDerWaalsContact O-CG 3.31Å; S696-R700 WeakPolarHBondContact O-CG 3.44Å; S696-R700 PolarHBondContact O-N 3.24Å; S696-R700 PolarHBondContact O-NH1 3.45Å; S696-R700 PolarHBondContact OG-NH1 2.87Å
697	T	96.9	Very high	94.4	Very high	7 Å²	7	35.3 Å²	35.3	4%	0.043	18%	0.184	C	C	.	.	H	α-helix	trans	-75.6	-37.4	176.6	-44.8	0	0	0	0	111.4	M668 R671 F672 N693 R700 L701	M668-T697 HydrophobicContact CB-CG2 4.41Å; M668-T697 VanDerWaalsContact O-CG2 3.25Å; M668-T697 WeakPolarHBondContact O-CG2 3.43Å; M668-T697 HydrophobicContact SD-CG2 4.22Å; R671-T697 HydrophobicContact CB-CG2 4.03Å; F672-T697 HydrophobicContact CB-CG2 3.83Å; N693-T697 WeakPolarHBondContact O-CB 3.38Å; N693-T697 PolarHBondContact O-N 3.5Å; N693-T697 PolarHBondContact O-OG1 2.86Å; T697-R700 PolarHBondContact O-N 3.05Å; T697-L701 WeakPolarHBondContact O-CG 3.3Å; T697-L701 PolarHBondContact O-N 2.89Å; T697-L701 VanDerWaalsContact O-N 3.08Å
698	L	97.4	Very high	94.8	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-64.7	-45.2	175.2	-179.3	55.4	0	0	0	111.9	F672 V694 L695 R700 L701 T702 L722 I736 Q739 A740 C743	F672-L698 HydrophobicContact CD2-CB 4.18Å; F672-L698 HydrophobicContact CE1-CD1 4.39Å; F672-L698 HydrophobicContact CE2-CB 3.86Å; F672-L698 HydrophobicContact CE2-CD1 3.9Å; F672-L698 HydrophobicContact CE2-CD2 4.25Å; F672-L698 HydrophobicContact CE2-CG 4.2Å; F672-L698 HydrophobicContact CZ-CD1 3.76Å; V694-L698 WeakPolarHBondContact O-CB 3.47Å; V694-L698 PolarHBondContact O-N 3.12Å; L695-L698 PolarHBondContact O-N 3.16Å; L698-R700 VanDerWaalsContact C-N 3.3Å; L698-R700 PolarHBondContact O-N 3.35Å; L698-L701 PolarHBondContact O-N 3.31Å; L698-L701 VanDerWaalsContact O-N 3.13Å; L698-T702 WeakPolarHBondContact O-CB 3.45Å; L698-T702 PolarHBondContact O-N 2.81Å; L698-T702 PolarHBondContact O-OG1 3.32Å; L698-L722 HydrophobicContact CD2-CD1 4.3Å; L698-I736 HydrophobicContact CD2-CG2 4.15Å; L698-Q739 HydrophobicContact CD2-CB 3.86Å; L698-Q739 HydrophobicContact CG-CB 3.85Å; L698-A740 HydrophobicContact CD2-CB 4.07Å; L698-C743 HydrophobicContact CD1-CB 4.15Å
699	K	97.4	Very high	95.1	Very high	31 Å²	31	27.9 Å²	27.9	14%	0.135	14%	0.144	C	C	.	.	H	α-helix	trans	-54.1	-45.4	175.1	-77.8	-171	-176.9	-173.9	0	112.5	I631 L636 L695 T702 A703 Q739	I631-K699 WeakPolarHBondContact O-CD 3.44Å; L636-K699 HydrophobicContact CD1-CB 3.9Å; L695-K699 HydrophobicContact CD1-CD 4.49Å; L695-K699 HydrophobicContact CD1-CG 4.22Å; L695-K699 WeakPolarHBondContact O-CG 3.48Å; L695-K699 PolarHBondContact O-N 3.49Å; K699-T702 PolarHBondContact O-N 3.14Å; K699-A703 PolarHBondContact O-N 2.9Å; K699-Q739 HydrophobicContact CG-CG 3.87Å
700	R	97.5	Very high	95.3	Very high	17 Å²	17	22.6 Å²	22.6	6%	0.064	12%	0.116	C	C	.	.	H	α-helix	trans	-59.9	-47.3	176.6	-67.3	164.4	-177.4	125.8	6.2	111.5	V627 E628 H630 L636 M668 S696 T697 L698 F704	V627-R700 HydrophobicContact CG1-CB 4.38Å; V627-R700 HydrophobicContact CG1-CG 4.1Å; V627-R700 WeakPolarHBondContact O-CD 3.26Å; V627-R700 PolarHBondContact O-NE 2.72Å; E628-R700 PolarHBondContact O-NH2 3.45Å; H630-R700 PolarHBondContact O-NE 2.98Å; H630-R700 PolarHBondContact O-NH2 3.14Å; L636-R700 HydrophobicContact CD1-CG 4.09Å; L636-R700 HydrophobicContact CD2-CG 3.75Å; M668-R700 HydrophobicContact SD-CB 4.47Å; S696-R700 WeakPolarHBondContact O-CD 3.42Å; S696-R700 VanDerWaalsContact O-CG 3.31Å; S696-R700 WeakPolarHBondContact O-CG 3.44Å; S696-R700 PolarHBondContact O-N 3.24Å; S696-R700 PolarHBondContact O-NH1 3.45Å; S696-R700 PolarHBondContact OG-NH1 2.87Å; T697-R700 PolarHBondContact O-N 3.05Å; L698-R700 VanDerWaalsContact C-N 3.3Å; L698-R700 PolarHBondContact O-N 3.35Å; R700-F704 WeakPolarHBondContact O-CD2 3.42Å; R700-F704 PolarHBondContact O-N 3.14Å
701	L	97.7	Very high	95.4	Very high	0 Å²	0	22 Å²	22	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-66.1	-42.2	178	-72.9	171	0	0	0	112.3	I665 M668 F672 T697 L698 F704 H705 L715	I665-L701 HydrophobicContact CG2-CD2 4.45Å; M668-L701 HydrophobicContact CB-CD2 3.75Å; M668-L701 HydrophobicContact CB-CG 4.12Å; F672-L701 HydrophobicContact CB-CD1 3.45Å; F672-L701 VanDerWaalsContact CB-CD1 3.45Å; F672-L701 HydrophobicContact CD1-CD1 3.65Å; F672-L701 HydrophobicContact CG-CD1 3.66Å; T697-L701 WeakPolarHBondContact O-CG 3.3Å; T697-L701 PolarHBondContact O-N 2.89Å; T697-L701 VanDerWaalsContact O-N 3.08Å; L698-L701 PolarHBondContact O-N 3.31Å; L698-L701 VanDerWaalsContact O-N 3.13Å; L701-F704 PolarHBondContact O-N 2.66Å; L701-H705 VanDerWaalsContact O-CB 3.25Å; L701-H705 WeakPolarHBondContact O-CB 3.47Å; L701-H705 PolarHBondContact O-N 3.47Å; L701-L715 HydrophobicContact CB-CD1 4.35Å; L701-L715 HydrophobicContact CD1-CD2 4.14Å; L701-L715 HydrophobicContact CD2-CD1 4.27Å
702	T	97.3	Very high	95.4	Very high	2 Å²	2	27.7 Å²	27.7	1%	0.012	13%	0.133	C	C	.	.	H	α-helix	trans	-60.1	-48.2	178	-56.2	0	0	0	0	111.7	L698 K699 F704 H705 N706 Q739 Q742 C743 Y746	L698-T702 WeakPolarHBondContact O-CB 3.45Å; L698-T702 PolarHBondContact O-N 2.81Å; L698-T702 PolarHBondContact O-OG1 3.32Å; K699-T702 PolarHBondContact O-N 3.14Å; T702-F704 PolarHBondContact O-N 3.31Å; T702-H705 PolarHBondContact O-N 3.21Å; T702-N706 PolarHBondContact O-N 2.81Å; T702-N706 VanDerWaalsContact O-N 3.11Å; T702-Q739 PolarHBondContact OG1-O 2.85Å; T702-Q739 PolarHBondContact OG1-OE1 3.33Å; T702-Q739 VanDerWaalsContact OG1-OE1 3.11Å; T702-Q742 HydrophobicContact CG2-CB 3.57Å; T702-C743 HydrophobicContact CG2-CB 4.37Å; T702-Y746 HydrophobicContact CG2-CD2 4.28Å; T702-Y746 HydrophobicContact CG2-CE2 3.8Å
703	A	96.3	Very high	95.5	Very high	20 Å²	20	24.5 Å²	24.5	17%	0.165	12%	0.12	C	C	.	.	H	α-helix	trans	-60.4	-44	178.6	0	0	0	0	0	111.8	L636 S640 K699 N706	L636-A703 HydrophobicContact CB-CB 3.7Å; S640-A703 PolarHBondContact OG-O 3.42Å; K699-A703 PolarHBondContact O-N 2.9Å; A703-N706 WeakPolarHBondContact O-CB 3.28Å; A703-N706 PolarHBondContact O-N 3.34Å
704	F	96.9	Very high	95.4	Very high	2 Å²	2	26.1 Å²	26.1	1%	0.009	13%	0.129	C	C	.	.	H	α-helix	trans	-71.1	-34	176.2	-85.8	-105.4	0	0	0	113.5	V627 C639 S640 Y643 L664 I665 R700 L701 T702 N706 A707 H708 L710	V627-F704 HydrophobicContact CG1-CE2 4.11Å; V627-F704 HydrophobicContact CG2-CE2 3.8Å; V627-F704 HydrophobicContact CG2-CZ 3.93Å; C639-F704 HydrophobicContact CB-CE2 4.19Å; C639-F704 HydrophobicContact CB-CZ 4.26Å; S640-F704 WeakPolarHBondContact OG-CA 3.43Å; Y643-F704 AromaticContact CD2-CE1 3.64Å; Y643-F704 HydrophobicContact CD2-CE1 3.64Å; Y643-F704 AromaticContact CD2-CZ 3.7Å; Y643-F704 HydrophobicContact CD2-CZ 3.7Å; Y643-F704 HydrophobicContact CE2-CE1 4.22Å; Y643-F704 HydrophobicContact CE2-CZ 4.17Å; Y643-F704 AromaticContact CG-CE1 3.97Å; Y643-F704 HydrophobicContact CG-CE1 3.97Å; Y643-F704 HydrophobicContact CG-CZ 4.45Å; L664-F704 HydrophobicContact CD2-CE1 4.03Å; L664-F704 HydrophobicContact CD2-CZ 3.86Å; I665-F704 HydrophobicContact CD1-CB 3.74Å; I665-F704 HydrophobicContact CD1-CD1 3.84Å; I665-F704 HydrophobicContact CD1-CG 3.93Å; R700-F704 WeakPolarHBondContact O-CD2 3.42Å; R700-F704 PolarHBondContact O-N 3.14Å; L701-F704 PolarHBondContact O-N 2.66Å; T702-F704 PolarHBondContact O-N 3.31Å; F704-N706 PolarHBondContact O-N 2.82Å; F704-A707 PolarHBondContact O-N 3.12Å; F704-H708 AromaticContact CD1-CD2 3.48Å; F704-H708 VanDerWaalsContact CD1-CD2 3.48Å; F704-H708 WeakPolarHBondContact CD1-CD2 3.42Å; F704-H708 WeakPolarHBondContact O-CB 3.34Å; F704-H708 PolarHBondContact O-CD2 2.64Å; F704-H708 PolarHBondContact O-N 2.99Å; F704-H708 VanDerWaalsContact O-N 3.11Å; F704-L710 HydrophobicContact CB-CD1 4.38Å
705	H	96.8	Very high	95.4	Very high	1 Å²	1	26.3 Å²	26.3	1%	0.005	13%	0.13	C	C	.	.	H	α-helix	trans	-69.8	-22.4	178.2	-156	170.7	0	0	0	112.4	L701 T702 L710 Y746 S747 W750	L701-H705 VanDerWaalsContact O-CB 3.25Å; L701-H705 WeakPolarHBondContact O-CB 3.47Å; L701-H705 PolarHBondContact O-N 3.47Å; T702-H705 PolarHBondContact O-N 3.21Å; H705-L710 HydrophobicContact CB-CD1 3.83Å; H705-L710 HydrophobicContact CB-CG 4.24Å; H705-Y746 HydrophobicContact CB-CD2 4.26Å; H705-S747 VanDerWaalsContact CE1-CA 3.46Å; H705-S747 WeakPolarHBondContact CE1-CA 3.45Å; H705-S747 PolarHBondContact CE1-N 3.32Å; H705-S747 PolarHBondContact CE1-OG 3.42Å; H705-W750 AromaticContact CD2-CD1 3.5Å; H705-W750 VanDerWaalsContact CD2-CD1 3.5Å; H705-W750 AromaticContact CD2-NE1 3.96Å; H705-W750 AromaticContact NE2-CD1 3.75Å; H705-W750 PolarHBondContact O-NE1 2.93Å
706	N	94.9	Very high	95.4	Very high	13 Å²	13	26 Å²	26	7%	0.07	13%	0.127	C	C	.	.	H	α-helix	trans	-62.3	-56.3	173.1	-165.3	13.5	0	0	0	111.1	T702 A703 F704 Y746 S1253 F1255	T702-N706 PolarHBondContact O-N 2.81Å; T702-N706 VanDerWaalsContact O-N 3.11Å; A703-N706 WeakPolarHBondContact O-CB 3.28Å; A703-N706 PolarHBondContact O-N 3.34Å; F704-N706 PolarHBondContact O-N 2.82Å; N706-Y746 HydrophobicContact CB-CD2 4.1Å; N706-Y746 HydrophobicContact CB-CE1 4.24Å; N706-Y746 HydrophobicContact CB-CE2 3.7Å; N706-Y746 VanDerWaalsContact OD1-CE1 3.26Å; N706-Y746 WeakPolarHBondContact OD1-CE1 3.22Å; N706-S1253 VanDerWaalsContact CG-O 3.27Å; N706-S1253 PolarHBondContact ND2-O 3.39Å; N706-S1253 PolarHBondContact OD1-O 2.72Å; N706-F1255 VanDerWaalsContact O-CD2 3.22Å; N706-F1255 WeakPolarHBondContact O-CD2 3.29Å; N706-F1255 WeakPolarHBondContact O-CE2 3.29Å
707	A	93.5	Very high	95.3	Very high	21 Å²	21	27.2 Å²	27.2	17%	0.174	14%	0.14	C	C	.	.	H	α-helix	trans	-93.9	5.7	-175.1	0	0	0	0	0	115.7	S640 S644 F704	S640-A707 WeakPolarHBondContact OG-CB 3.22Å; S644-A707 PolarHBondContact OG-O 3.36Å; F704-A707 PolarHBondContact O-N 3.12Å
708	H	93.9	Very high	95.2	Very high	6 Å²	6	28.1 Å²	28.1	3%	0.028	15%	0.145	C	C	.	.	S	Bend	trans	-144.5	140.6	-178.2	-49.1	-54	0	0	0	114.1	S640 Y643 S644 R661 F704 L710 W750	S640-H708 PolarHBondContact O-NE2 3.23Å; Y643-H708 WeakPolarHBondContact CB-NE2 3.33Å; Y643-H708 PolarHBondContact O-NE2 3.28Å; S644-H708 WeakPolarHBondContact CA-NE2 3.33Å; S644-H708 WeakPolarHBondContact CB-NE2 3.42Å; S644-H708 PolarHBondContact N-NE2 3.21Å; S644-H708 PolarHBondContact OG-CE1 3.1Å; S644-H708 VanDerWaalsContact OG-CE1 3.24Å; S644-H708 PolarHBondContact OG-NE2 2.99Å; R661-H708 PolarHBondContact NH1-CE1 3.15Å; R661-H708 PolarHBondContact NH1-ND1 3.01Å; F704-H708 AromaticContact CD1-CD2 3.48Å; F704-H708 VanDerWaalsContact CD1-CD2 3.48Å; F704-H708 WeakPolarHBondContact CD1-CD2 3.42Å; F704-H708 WeakPolarHBondContact O-CB 3.34Å; F704-H708 PolarHBondContact O-CD2 2.64Å; F704-H708 PolarHBondContact O-N 2.99Å; F704-H708 VanDerWaalsContact O-N 3.11Å; H708-L710 HydrophobicContact CB-CD2 3.91Å; H708-L710 PolarHBondContact O-N 3.22Å; H708-W750 VanDerWaalsContact C-CZ2 3.49Å; H708-W750 PolarHBondContact O-NE1 3.33Å; H708-W750 VanDerWaalsContact O-NE1 3.08Å
709	D	93.5	Very high	95.2	Very high	60 Å²	60	28.1 Å²	28.1	32%	0.321	15%	0.145	S	C	.	.			trans	-63.2	102.5	168.1	179.1	8.3	0	0	0	110.9	T711 W750 K754	D709-T711 WeakPolarHBondContact OD1-CB 3.49Å; D709-T711 WeakPolarHBondContact OD1-CG2 3.43Å; D709-T711 PolarHBondContact OD1-N 2.7Å; D709-T711 PolarHBondContact OD1-OG1 2.72Å; D709-T711 PolarHBondContact OD2-OG1 3.17Å; D709-W750 HydrophobicContact CB-CD2 3.92Å; D709-W750 HydrophobicContact CB-CE3 3.71Å; D709-W750 HydrophobicContact CB-CG 4.36Å; D709-W750 HydrophobicContact CB-CZ3 4.15Å; D709-K754 IonicContact OD1-NZ 2.62Å; D709-K754 IonicContact OD2-NZ 2.78Å; D709-K754 PolarHBondContact OD2-NZ 2.85Å
710	L	95.6	Very high	95.1	Very high	2 Å²	2	30 Å²	30	1%	0.01	15%	0.151	C	C	.	.			trans	-102.3	17.8	172.3	-49.1	-170.2	0	0	0	113	I665 F704 H705 H708 R712 W713 L715	I665-L710 HydrophobicContact CD1-CD1 4.08Å; I665-L710 HydrophobicContact CD1-CD2 4.36Å; I665-L710 HydrophobicContact CG1-CD1 4.49Å; I665-L710 HydrophobicContact CG1-CD2 4.01Å; I665-L710 HydrophobicContact CG2-CD1 4.06Å; I665-L710 HydrophobicContact CG2-CD2 4.08Å; F704-L710 HydrophobicContact CB-CD1 4.38Å; H705-L710 HydrophobicContact CB-CD1 3.83Å; H705-L710 HydrophobicContact CB-CG 4.24Å; H708-L710 HydrophobicContact CB-CD2 3.91Å; H708-L710 PolarHBondContact O-N 3.22Å; L710-R712 PolarHBondContact O-N 3.13Å; L710-W713 HydrophobicContact CB-CE3 4.04Å; L710-W713 HydrophobicContact CD2-CE3 4.27Å; L710-W713 HydrophobicContact CD2-CZ3 4.12Å; L710-W713 PolarHBondContact O-N 3.17Å; L710-L715 HydrophobicContact CB-CD1 4.19Å; L710-L715 HydrophobicContact CD1-CD1 3.93Å
711	T	91.7	Very high	94.9	Very high	29 Å²	29	33.1 Å²	33.1	18%	0.178	16%	0.163	C	C	.	.	G	3₁₀ helix	trans	-62.6	-16.8	-177.6	57.8	0	0	0	0	114.5	D709 W713 W750 Q751 K754	D709-T711 WeakPolarHBondContact OD1-CB 3.49Å; D709-T711 WeakPolarHBondContact OD1-CG2 3.43Å; D709-T711 PolarHBondContact OD1-N 2.7Å; D709-T711 PolarHBondContact OD1-OG1 2.72Å; D709-T711 PolarHBondContact OD2-OG1 3.17Å; T711-W713 PolarHBondContact O-N 2.67Å; T711-W750 HydrophobicContact CG2-CB 3.59Å; T711-Q751 HydrophobicContact CG2-CG 3.86Å; T711-K754 PolarHBondContact OG1-NZ 2.99Å
712	R	92.6	Very high	94.7	Very high	161 Å²	161	33.1 Å²	33.1	61%	0.608	16%	0.163	S	C	*	.	G	3₁₀ helix	trans	-62.9	-24.7	170	165.4	179.7	159.4	-154.4	-18.7	112.9	D666 L710	D666-R712 IonicContact OD1-CZ 2.74Å; D666-R712 IonicContact OD1-NH2 3.74Å; D666-R712 PolarHBondContact OD1-NH2 3.29Å; D666-R712 IonicContact OD2-NH2 2.73Å; D666-R712 PolarHBondContact OD2-NH2 2.94Å; L710-R712 PolarHBondContact O-N 3.13Å
713	W	94.7	Very high	94.6	Very high	44 Å²	44	33.3 Å²	33.3	17%	0.167	16%	0.164	C	C	.	.	G	3₁₀ helix	trans	-103.3	-0.2	-170	-70.4	-88	0	0	0	114.8	I665 D666 T669 L710 T711 L715	I665-W713 HydrophobicContact CB-CZ2 4.21Å; I665-W713 HydrophobicContact CG2-CD2 3.65Å; I665-W713 HydrophobicContact CG2-CE3 3.98Å; I665-W713 HydrophobicContact CG2-CG 4.01Å; I665-W713 HydrophobicContact CG2-CH2 4.39Å; I665-W713 HydrophobicContact CG2-CZ2 4.09Å; I665-W713 HydrophobicContact CG2-CZ3 4.34Å; D666-W713 PolarHBondContact OD1-NE1 3.32Å; T669-W713 HydrophobicContact CG2-CB 4.08Å; T669-W713 HydrophobicContact CG2-CG 4.42Å; L710-W713 HydrophobicContact CB-CE3 4.04Å; L710-W713 HydrophobicContact CD2-CE3 4.27Å; L710-W713 HydrophobicContact CD2-CZ3 4.12Å; L710-W713 PolarHBondContact O-N 3.17Å; T711-W713 PolarHBondContact O-N 2.67Å; W713-L715 VanDerWaalsContact C-N 3.3Å; W713-L715 HydrophobicContact CB-CD2 4.3Å; W713-L715 HydrophobicContact CB-CG 4.33Å; W713-L715 PolarHBondContact O-N 3.21Å; W713-L715 VanDerWaalsContact O-N 3.16Å
714	D	91.9	Very high	94.4	Very high	104 Å²	104	36.3 Å²	36.3	56%	0.556	17%	0.174	S	C	*	.			trans	44.9	43.5	176	-161.7	19.7	0	0	0	116	F716 G717	D714-F716 PolarHBondContact O-N 2.96Å; D714-F716 VanDerWaalsContact O-N 3.07Å; D714-G717 PolarHBondContact O-N 3.15Å
715	L	95.2	Very high	94.1	Very high	3 Å²	3	36.7 Å²	36.7	2%	0.016	18%	0.177	C	C	.	.	H	α-helix	trans	-59	-23.5	-177.6	-59.8	179.7	0	0	0	113.8	T669 F672 L701 L710 W713 G717 N718 C719	T669-L715 HydrophobicContact CG2-CD2 3.84Å; F672-L715 HydrophobicContact CD1-CD2 4.42Å; L701-L715 HydrophobicContact CB-CD1 4.35Å; L701-L715 HydrophobicContact CD1-CD2 4.14Å; L701-L715 HydrophobicContact CD2-CD1 4.27Å; L710-L715 HydrophobicContact CB-CD1 4.19Å; L710-L715 HydrophobicContact CD1-CD1 3.93Å; W713-L715 VanDerWaalsContact C-N 3.3Å; W713-L715 HydrophobicContact CB-CD2 4.3Å; W713-L715 HydrophobicContact CB-CG 4.33Å; W713-L715 PolarHBondContact O-N 3.21Å; W713-L715 VanDerWaalsContact O-N 3.16Å; L715-G717 VanDerWaalsContact C-N 3.31Å; L715-G717 PolarHBondContact O-N 2.89Å; L715-N718 PolarHBondContact O-N 3.37Å; L715-C719 PolarHBondContact O-N 3.3Å; L715-C719 PolarHBondContact O-SG 2.92Å
716	F	95.3	Very high	93.7	Very high	19 Å²	19	37.2 Å²	37.2	8%	0.083	18%	0.183	C	C	.	.	H	α-helix	trans	-57.8	-40.4	178.2	-176.5	-89	0	0	0	112.4	D714 N718 C719 Y720 I748 V771 F775	D714-F716 PolarHBondContact O-N 2.96Å; D714-F716 VanDerWaalsContact O-N 3.07Å; F716-N718 VanDerWaalsContact C-N 3.32Å; F716-N718 PolarHBondContact O-N 2.96Å; F716-C719 PolarHBondContact O-N 3.3Å; F716-Y720 AromaticContact CE1-CD2 3.98Å; F716-Y720 HydrophobicContact CE1-CD2 3.98Å; F716-Y720 AromaticContact CE1-CG 3.91Å; F716-Y720 HydrophobicContact CE1-CG 3.91Å; F716-Y720 AromaticContact CZ-CD2 3.75Å; F716-Y720 HydrophobicContact CZ-CD2 3.75Å; F716-Y720 HydrophobicContact CZ-CG 4.13Å; F716-Y720 WeakPolarHBondContact O-CB 3.45Å; F716-Y720 PolarHBondContact O-N 3.23Å; F716-I748 HydrophobicContact CE2-CD1 4.14Å; F716-I748 HydrophobicContact CE2-CG1 4.48Å; F716-V771 HydrophobicContact CD1-CG1 4.07Å; F716-V771 HydrophobicContact CD2-CG1 3.86Å; F716-V771 HydrophobicContact CE1-CG1 3.84Å; F716-V771 HydrophobicContact CE2-CG1 3.6Å; F716-V771 HydrophobicContact CG-CG1 4.1Å; F716-V771 HydrophobicContact CZ-CG1 3.61Å; F716-F775 HydrophobicContact CE2-CB 4.05Å; F716-F775 HydrophobicContact CE2-CD2 4.11Å; F716-F775 HydrophobicContact CE2-CG 4.22Å; F716-F775 HydrophobicContact CZ-CB 4.19Å
717	G	94.3	Very high	93.4	Very high	29 Å²	29	39.7 Å²	39.7	30%	0.299	20%	0.195	S	C	.	.	H	α-helix	trans	-58.7	-41.9	-176.5	0	0	0	0	0	113.1	D714 L715 R721	D714-G717 PolarHBondContact O-N 3.15Å; L715-G717 VanDerWaalsContact C-N 3.31Å; L715-G717 PolarHBondContact O-N 2.89Å; G717-R721 WeakPolarHBondContact O-CG 3.39Å; G717-R721 PolarHBondContact O-N 3.1Å
718	N	95.6	Very high	93	Very high	26 Å²	26	44.9 Å²	44.9	14%	0.139	22%	0.216	C	C	.	.	H	α-helix	trans	-77.2	-42.6	178.8	-71.2	-11.5	0	0	0	112	F672 V676 L715 F716 Y720 R721 L722	F672-N718 HydrophobicContact CD1-CB 4.33Å; F672-N718 HydrophobicContact CE1-CB 3.59Å; F672-N718 HydrophobicContact CZ-CB 4.02Å; V676-N718 HydrophobicContact CG1-CB 4.2Å; L715-N718 PolarHBondContact O-N 3.37Å; F716-N718 VanDerWaalsContact C-N 3.32Å; F716-N718 PolarHBondContact O-N 2.96Å; N718-Y720 VanDerWaalsContact C-N 3.33Å; N718-Y720 PolarHBondContact O-N 3.38Å; N718-R721 PolarHBondContact O-N 3.4Å; N718-R721 PolarHBondContact OD1-NH2 3.43Å; N718-L722 PolarHBondContact O-N 2.9Å; N718-L722 VanDerWaalsContact O-N 3.09Å
719	C	96.7	Very high	92.4	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-61.8	-40.9	176.9	-60.5	0	0	0	0	111.9	L715 F716 R721 L722 L723 A740 S744	L715-C719 PolarHBondContact O-N 3.3Å; L715-C719 PolarHBondContact O-SG 2.92Å; F716-C719 PolarHBondContact O-N 3.3Å; C719-R721 PolarHBondContact O-N 2.93Å; C719-L722 PolarHBondContact O-N 3.25Å; C719-L723 VanDerWaalsContact O-CG 3.32Å; C719-L723 WeakPolarHBondContact O-CG 3.31Å; C719-L723 PolarHBondContact O-N 2.72Å; C719-A740 HydrophobicContact CB-CB 4.14Å; C719-S744 WeakPolarHBondContact CB-OG 3.43Å
720	Y	95.1	Very high	91.6	Very high	70 Å²	70	51.2 Å²	51.2	28%	0.275	26%	0.262	S	S	.	.	H	α-helix	trans	-65.8	-34.8	176	-176	-97	0	0	0	112.8	F716 N718 K724 V778	F716-Y720 AromaticContact CE1-CD2 3.98Å; F716-Y720 HydrophobicContact CE1-CD2 3.98Å; F716-Y720 AromaticContact CE1-CG 3.91Å; F716-Y720 HydrophobicContact CE1-CG 3.91Å; F716-Y720 AromaticContact CZ-CD2 3.75Å; F716-Y720 HydrophobicContact CZ-CD2 3.75Å; F716-Y720 HydrophobicContact CZ-CG 4.13Å; F716-Y720 WeakPolarHBondContact O-CB 3.45Å; F716-Y720 PolarHBondContact O-N 3.23Å; N718-Y720 VanDerWaalsContact C-N 3.33Å; N718-Y720 PolarHBondContact O-N 3.38Å; Y720-K724 HydrophobicContact CE1-CD 4.43Å; Y720-K724 VanDerWaalsContact O-CB 3.28Å; Y720-K724 WeakPolarHBondContact O-CB 3.43Å; Y720-K724 PolarHBondContact O-N 3.11Å; Y720-V778 HydrophobicContact CD2-CG2 4.31Å; Y720-V778 HydrophobicContact CE2-CG2 3.76Å
721	R	93.8	Very high	90.5	Very high	83 Å²	83	55 Å²	55	31%	0.313	29%	0.289	S	S	.	.	H	α-helix	trans	-62.5	-49.4	171.8	-78.9	-164.7	-68.5	166.5	-10.2	111.8	E677 L680 G717 N718 C719 L723 K724 A725	E677-R721 IonicContact OE1-CZ 2.67Å; E677-R721 VanDerWaalsContact OE1-CZ 3.29Å; E677-R721 IonicContact OE1-NH1 3.72Å; E677-R721 PolarHBondContact OE1-NH1 3.07Å; E677-R721 IonicContact OE1-NH2 2.72Å; E677-R721 PolarHBondContact OE1-NH2 2.94Å; E677-R721 IonicContact OE2-CZ 2.78Å; E677-R721 IonicContact OE2-NH1 2.73Å; E677-R721 PolarHBondContact OE2-NH1 3.39Å; E677-R721 IonicContact OE2-NH2 3.59Å; L680-R721 HydrophobicContact CD1-CB 3.95Å; G717-R721 WeakPolarHBondContact O-CG 3.39Å; G717-R721 PolarHBondContact O-N 3.1Å; N718-R721 PolarHBondContact O-N 3.4Å; N718-R721 PolarHBondContact OD1-NH2 3.43Å; C719-R721 PolarHBondContact O-N 2.93Å; R721-L723 PolarHBondContact O-N 3.41Å; R721-K724 PolarHBondContact O-N 3.22Å; R721-A725 WeakPolarHBondContact O-CB 3.46Å; R721-A725 PolarHBondContact O-N 2.99Å
722	L	94.2	Very high	90.3	Very high	1 Å²	1	54.9 Å²	54.9	1%	0.005	29%	0.287	C	S	.	.	H	α-helix	trans	-57.4	-49.4	177.8	-70	172.9	0	0	0	112	F672 V676 L679 L680 V694 L698 N718 C719 K724 A725 G726 M732 I736	F672-L722 HydrophobicContact CE2-CD1 3.95Å; F672-L722 HydrophobicContact CZ-CD1 3.98Å; V676-L722 HydrophobicContact CG1-CD2 4.34Å; V676-L722 HydrophobicContact CG1-CG 4.34Å; V676-L722 HydrophobicContact CG2-CD1 3.9Å; V676-L722 HydrophobicContact CG2-CD2 4.19Å; V676-L722 HydrophobicContact CG2-CG 4.16Å; L679-L722 HydrophobicContact CD2-CD2 3.8Å; L680-L722 HydrophobicContact CD1-CD2 4.41Å; L680-L722 HydrophobicContact CD2-CD2 4.44Å; L680-L722 HydrophobicContact CG-CD2 4.47Å; V694-L722 HydrophobicContact CG1-CD1 3.97Å; V694-L722 HydrophobicContact CG1-CD2 4.38Å; L698-L722 HydrophobicContact CD2-CD1 4.3Å; N718-L722 PolarHBondContact O-N 2.9Å; N718-L722 VanDerWaalsContact O-N 3.09Å; C719-L722 PolarHBondContact O-N 3.25Å; L722-K724 PolarHBondContact O-N 3.49Å; L722-A725 PolarHBondContact O-N 3.37Å; L722-G726 PolarHBondContact O-N 2.83Å; L722-M732 HydrophobicContact CB-CE 4.47Å; L722-M732 HydrophobicContact CD2-CE 4.02Å; L722-I736 HydrophobicContact CD1-CG2 4.01Å
723	L	94.5	Very high	90.2	Very high	5 Å²	5	49.3 Å²	49.3	3%	0.026	27%	0.271	C	S	.	.	H	α-helix	trans	-62.2	-43.1	-180	-68.5	169.9	0	0	0	112.2	C719 R721 G726 I727 A737 A740 L741 F775 V778	C719-L723 VanDerWaalsContact O-CG 3.32Å; C719-L723 WeakPolarHBondContact O-CG 3.31Å; C719-L723 PolarHBondContact O-N 2.72Å; R721-L723 PolarHBondContact O-N 3.41Å; L723-G726 PolarHBondContact O-N 2.67Å; L723-I727 WeakPolarHBondContact O-CG1 3.49Å; L723-I727 PolarHBondContact O-N 2.69Å; L723-I727 VanDerWaalsContact O-N 3.09Å; L723-A737 HydrophobicContact CD2-CB 4.44Å; L723-A740 HydrophobicContact CD1-CB 4.2Å; L723-A740 HydrophobicContact CD2-CB 3.9Å; L723-A740 HydrophobicContact CG-CB 3.81Å; L723-L741 HydrophobicContact CD1-CD2 4.04Å; L723-L741 HydrophobicContact CD1-CG 4.35Å; L723-L741 HydrophobicContact CD2-CD2 4.12Å; L723-L741 HydrophobicContact CD2-CG 3.84Å; L723-F775 HydrophobicContact CD1-CE2 3.93Å; L723-V778 HydrophobicContact CB-CG1 3.84Å; L723-V778 HydrophobicContact CD1-CG1 4.01Å; L723-V778 HydrophobicContact CG-CG1 4.41Å
724	K	92.3	Very high	90	Very high	84 Å²	84	50.7 Å²	50.7	37%	0.365	28%	0.279	S	S	.	.	H	α-helix	trans	-65.7	-43.6	177.7	-176.1	175.6	177.1	-70.3	0	112	Y720 R721 L722 G726 I727 E728	Y720-K724 HydrophobicContact CE1-CD 4.43Å; Y720-K724 VanDerWaalsContact O-CB 3.28Å; Y720-K724 WeakPolarHBondContact O-CB 3.43Å; Y720-K724 PolarHBondContact O-N 3.11Å; R721-K724 PolarHBondContact O-N 3.22Å; L722-K724 PolarHBondContact O-N 3.49Å; K724-G726 VanDerWaalsContact C-N 3.34Å; K724-G726 PolarHBondContact O-N 3.19Å; K724-I727 PolarHBondContact O-N 3.06Å; K724-E728 WeakPolarHBondContact CE-OE1 3.26Å; K724-E728 IonicContact NZ-OE1 2.71Å; K724-E728 PolarHBondContact NZ-OE1 2.75Å; K724-E728 IonicContact NZ-OE2 3.53Å; K724-E728 PolarHBondContact NZ-OE2 2.89Å; K724-E728 WeakPolarHBondContact O-CG 3.31Å; K724-E728 PolarHBondContact O-N 2.9Å
725	A	89.9	Confident	90.1	Very high	10 Å²	10	50 Å²	50	8%	0.083	27%	0.273	C	S	.	.	H	α-helix	trans	-59.9	-44.4	175	0	0	0	0	0	111.2	L680 R721 L722 I727 E728 Q729	L680-A725 HydrophobicContact CD2-CB 3.65Å; R721-A725 WeakPolarHBondContact O-CB 3.46Å; R721-A725 PolarHBondContact O-N 2.99Å; L722-A725 PolarHBondContact O-N 3.37Å; A725-I727 VanDerWaalsContact C-N 3.31Å; A725-I727 PolarHBondContact O-N 3.32Å; A725-E728 PolarHBondContact O-N 3.11Å; A725-Q729 VanDerWaalsContact O-CB 3.27Å; A725-Q729 WeakPolarHBondContact O-CB 3.31Å; A725-Q729 WeakPolarHBondContact O-CG 3.23Å; A725-Q729 PolarHBondContact O-N 3.2Å
726	G	88.5	Confident	90.1	Very high	12 Å²	12	49.9 Å²	49.9	12%	0.124	27%	0.272	C	S	.	.	H	α-helix	trans	-61.1	-34.8	176.6	0	0	0	0	0	114.6	L722 L723 K724 G730 M732	L722-G726 PolarHBondContact O-N 2.83Å; L723-G726 PolarHBondContact O-N 2.67Å; K724-G726 VanDerWaalsContact C-N 3.34Å; K724-G726 PolarHBondContact O-N 3.19Å; G726-G730 VanDerWaalsContact O-CA 3.3Å; G726-G730 WeakPolarHBondContact O-CA 3.21Å; G726-G730 PolarHBondContact O-N 2.85Å; G726-M732 VanDerWaalsContact CA-CB 3.43Å
727	I	88.2	Confident	90.1	Very high	64 Å²	64	49.6 Å²	49.6	33%	0.328	27%	0.273	S	S	.	.	H	α-helix	trans	-74	-37.8	174.6	-68.4	165.3	0	0	0	111.7	L723 K724 A725 V778 Q781	L723-I727 WeakPolarHBondContact O-CG1 3.49Å; L723-I727 PolarHBondContact O-N 2.69Å; L723-I727 VanDerWaalsContact O-N 3.09Å; K724-I727 PolarHBondContact O-N 3.06Å; A725-I727 VanDerWaalsContact C-N 3.31Å; A725-I727 PolarHBondContact O-N 3.32Å; I727-V778 HydrophobicContact CD1-CB 4.5Å; I727-V778 HydrophobicContact CD1-CG1 3.99Å; I727-V778 HydrophobicContact CD1-CG2 4.48Å; I727-Q781 HydrophobicContact CD1-CB 4.06Å
728	E	86.6	Confident	90.2	Very high	131 Å²	131	49.3 Å²	49.3	61%	0.612	27%	0.266	S	S	*	.	H	α-helix	trans	-79.9	-26.8	-178.3	-72.4	177	150.6	0	0	113.7	K724 A725	K724-E728 WeakPolarHBondContact CE-OE1 3.26Å; K724-E728 IonicContact NZ-OE1 2.71Å; K724-E728 PolarHBondContact NZ-OE1 2.75Å; K724-E728 IonicContact NZ-OE2 3.53Å; K724-E728 PolarHBondContact NZ-OE2 2.89Å; K724-E728 WeakPolarHBondContact O-CG 3.31Å; K724-E728 PolarHBondContact O-N 2.9Å; A725-E728 PolarHBondContact O-N 3.11Å
729	Q	81.2	Confident	90.3	Very high	129 Å²	129	49.1 Å²	49.1	60%	0.603	26%	0.264	S	S	*	.	H	α-helix	trans	-105	-27.4	-177.2	-60.5	172.4	-5.9	0	0	113.3	A725 S731	A725-Q729 VanDerWaalsContact O-CB 3.27Å; A725-Q729 WeakPolarHBondContact O-CB 3.31Å; A725-Q729 WeakPolarHBondContact O-CG 3.23Å; A725-Q729 PolarHBondContact O-N 3.2Å; Q729-S731 PolarHBondContact O-N 3.21Å
730	G	75.2	Confident	90.3	Very high	69 Å²	69	49.1 Å²	49.1	71%	0.711	26%	0.264	S	S	*	.	S	Bend	trans	75.3	2.9	-179.4	0	0	0	0	0	115.8	G726	G726-G730 VanDerWaalsContact O-CA 3.3Å; G726-G730 WeakPolarHBondContact O-CA 3.21Å; G726-G730 PolarHBondContact O-N 2.85Å
731	S	73	Confident	90.4	Very high	83 Å²	83	45.8 Å²	45.8	58%	0.58	25%	0.251	S	S	*	.			trans	-106	-4.4	-170	50.5	0	0	0	0	115.5	Q729 P733	Q729-S731 PolarHBondContact O-N 3.21Å; S731-P733 WeakPolarHBondContact O-CD 3.49Å
732	M	86.9	Confident	90.5	Very high	26 Å²	26	43.6 Å²	43.6	13%	0.128	24%	0.244	C	C	.	.			trans	-67.5	126.1	-173.5	-177	61.7	60.2	0	0	112.2	L679 L722 G726 E734 I736	L679-M732 HydrophobicContact CD2-CE 4.29Å; L679-M732 HydrophobicContact CD2-SD 4.49Å; L722-M732 HydrophobicContact CB-CE 4.47Å; L722-M732 HydrophobicContact CD2-CE 4.02Å; G726-M732 VanDerWaalsContact CA-CB 3.43Å; M732-E734 PolarHBondContact O-N 2.93Å; M732-I736 HydrophobicContact CG-CB 4.44Å; M732-I736 HydrophobicContact CG-CG2 4.42Å; M732-I736 HydrophobicContact SD-CB 3.88Å; M732-I736 HydrophobicContact SD-CD1 4.21Å; M732-I736 HydrophobicContact SD-CG2 3.58Å; M732-I736 VanDerWaalsContact SD-CG2 3.58Å
733	P	90.6	Very high	90.7	Very high	44 Å²	44	43.6 Å²	43.6	29%	0.286	24%	0.244	S	C	.	.			trans	-55.7	135.8	176.4	-28.8	36.7	0	0	0	113.2	I691 S731 Q735 I736 A737	I691-P733 HydrophobicContact CD1-CG 4.08Å; I691-P733 HydrophobicContact CG1-CG 4.29Å; I691-P733 HydrophobicContact CG2-CB 4.47Å; I691-P733 HydrophobicContact CG2-CG 3.88Å; S731-P733 WeakPolarHBondContact O-CD 3.49Å; P733-Q735 VanDerWaalsContact C-N 3.3Å; P733-Q735 PolarHBondContact O-N 3.24Å; P733-I736 HydrophobicContact CB-CD1 4.4Å; P733-I736 HydrophobicContact CB-CG1 4.44Å; P733-I736 HydrophobicContact CG-CD1 4.31Å; P733-I736 PolarHBondContact O-N 3.41Å; P733-A737 PolarHBondContact O-N 3.41Å; P733-A737 VanDerWaalsContact O-N 3.14Å
734	E	92.1	Very high	90.8	Very high	72 Å²	72	43.3 Å²	43.3	34%	0.336	24%	0.243	S	C	.	.	H	α-helix	trans	-59.2	-36.5	-171.9	52.7	162	-151.6	0	0	113.8	M732 I736 A737 V738 N787 V790	M732-E734 PolarHBondContact O-N 2.93Å; E734-I736 VanDerWaalsContact C-N 3.33Å; E734-I736 PolarHBondContact O-N 3.39Å; E734-A737 PolarHBondContact O-N 3.48Å; E734-V738 WeakPolarHBondContact O-CG2 3.44Å; E734-V738 PolarHBondContact O-N 3.45Å; E734-N787 HydrophobicContact CB-CB 4.22Å; E734-V790 HydrophobicContact CB-CG2 3.73Å
735	Q	93.4	Very high	91	Very high	91 Å²	91	39.9 Å²	39.9	43%	0.425	23%	0.228	S	C	.	.	H	α-helix	trans	-67.3	-33.1	178.3	-60	-165.1	20.9	0	0	112.2	L695 P733 Q739	L695-Q735 HydrophobicContact CD1-CB 3.67Å; L695-Q735 HydrophobicContact CD2-CB 3.97Å; L695-Q735 HydrophobicContact CG-CB 4.5Å; P733-Q735 VanDerWaalsContact C-N 3.3Å; P733-Q735 PolarHBondContact O-N 3.24Å; Q735-Q739 VanDerWaalsContact O-CB 3.28Å; Q735-Q739 WeakPolarHBondContact O-CB 3.29Å; Q735-Q739 WeakPolarHBondContact O-CG 3.44Å; Q735-Q739 PolarHBondContact O-N 2.87Å
736	I	95.2	Very high	91.4	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-68.8	-42.4	173.6	-62.1	178.1	0	0	0	109.5	L679 I691 V694 L695 L698 L722 M732 P733 E734 Q739 A740	L679-I736 HydrophobicContact CD2-CD1 4.38Å; I691-I736 HydrophobicContact CG2-CD1 4.14Å; V694-I736 HydrophobicContact CB-CD1 4.39Å; V694-I736 HydrophobicContact CG1-CD1 4.15Å; V694-I736 HydrophobicContact CG1-CG2 4.22Å; L695-I736 HydrophobicContact CB-CD1 4.3Å; L695-I736 HydrophobicContact CB-CG1 3.87Å; L695-I736 HydrophobicContact CD1-CG1 3.91Å; L695-I736 HydrophobicContact CG-CG1 4.38Å; L698-I736 HydrophobicContact CD2-CG2 4.15Å; L722-I736 HydrophobicContact CD1-CG2 4.01Å; M732-I736 HydrophobicContact CG-CB 4.44Å; M732-I736 HydrophobicContact CG-CG2 4.42Å; M732-I736 HydrophobicContact SD-CB 3.88Å; M732-I736 HydrophobicContact SD-CD1 4.21Å; M732-I736 HydrophobicContact SD-CG2 3.58Å; M732-I736 VanDerWaalsContact SD-CG2 3.58Å; P733-I736 HydrophobicContact CB-CD1 4.4Å; P733-I736 HydrophobicContact CB-CG1 4.44Å; P733-I736 HydrophobicContact CG-CD1 4.31Å; P733-I736 PolarHBondContact O-N 3.41Å; E734-I736 VanDerWaalsContact C-N 3.33Å; E734-I736 PolarHBondContact O-N 3.39Å; I736-Q739 PolarHBondContact O-N 3.03Å; I736-A740 WeakPolarHBondContact O-CB 3.23Å; I736-A740 PolarHBondContact O-N 3.23Å
737	A	95.1	Very high	91.7	Very high	12 Å²	12	40.4 Å²	40.4	10%	0.099	23%	0.225	C	C	.	.	H	α-helix	trans	-62.2	-48.3	176.8	0	0	0	0	0	112.4	L723 P733 E734 Q739 A740 L741 V790	L723-A737 HydrophobicContact CD2-CB 4.44Å; P733-A737 PolarHBondContact O-N 3.41Å; P733-A737 VanDerWaalsContact O-N 3.14Å; E734-A737 PolarHBondContact O-N 3.48Å; A737-Q739 PolarHBondContact O-N 3.15Å; A737-A740 PolarHBondContact O-N 2.68Å; A737-L741 WeakPolarHBondContact O-CB 3.5Å; A737-L741 VanDerWaalsContact O-CG 3.26Å; A737-L741 WeakPolarHBondContact O-CG 3.12Å; A737-L741 PolarHBondContact O-N 2.98Å; A737-V790 HydrophobicContact CB-CG1 4.35Å; A737-V790 HydrophobicContact CB-CG2 4.11Å
738	V	95.9	Very high	92.1	Very high	23 Å²	23	37.4 Å²	37.4	14%	0.139	21%	0.21	C	C	.	.	H	α-helix	trans	-58.2	-47.8	176.5	166.6	0	0	0	0	111.2	E734 L741 Q742 P789 V790 Q793	E734-V738 WeakPolarHBondContact O-CG2 3.44Å; E734-V738 PolarHBondContact O-N 3.45Å; V738-L741 WeakPolarHBondContact O-CB 3.43Å; V738-L741 PolarHBondContact O-N 2.95Å; V738-Q742 WeakPolarHBondContact O-CG 3.35Å; V738-Q742 PolarHBondContact O-N 3.5Å; V738-P789 HydrophobicContact CG2-CB 4.36Å; V738-V790 HydrophobicContact CG2-CG2 4.27Å; V738-Q793 HydrophobicContact CG1-CB 4.42Å; V738-Q793 HydrophobicContact CG1-CG 4.1Å; V738-Q793 HydrophobicContact CG2-CB 4.23Å
739	Q	97.1	Very high	92.5	Very high	22 Å²	22	31.5 Å²	31.5	10%	0.103	18%	0.182	C	C	.	.	H	α-helix	trans	-70.2	-37.2	-178.8	-68.8	-68.2	-52.2	0	0	112.7	L695 L698 K699 T702 Q735 I736 A737 Q742 C743	L695-Q739 HydrophobicContact CD1-CG 4.49Å; L698-Q739 HydrophobicContact CD2-CB 3.86Å; L698-Q739 HydrophobicContact CG-CB 3.85Å; K699-Q739 HydrophobicContact CG-CG 3.87Å; T702-Q739 PolarHBondContact OG1-O 2.85Å; T702-Q739 PolarHBondContact OG1-OE1 3.33Å; T702-Q739 VanDerWaalsContact OG1-OE1 3.11Å; Q735-Q739 VanDerWaalsContact O-CB 3.28Å; Q735-Q739 WeakPolarHBondContact O-CB 3.29Å; Q735-Q739 WeakPolarHBondContact O-CG 3.44Å; Q735-Q739 PolarHBondContact O-N 2.87Å; I736-Q739 PolarHBondContact O-N 3.03Å; A737-Q739 PolarHBondContact O-N 3.15Å; Q739-Q742 PolarHBondContact O-N 3.19Å; Q739-C743 WeakPolarHBondContact O-CB 3.28Å; Q739-C743 PolarHBondContact O-N 3.4Å
740	A	97.4	Very high	93.2	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-68.8	-34	175.5	0	0	0	0	0	111.9	L698 C719 L723 I736 A737 S744	L698-A740 HydrophobicContact CD2-CB 4.07Å; C719-A740 HydrophobicContact CB-CB 4.14Å; L723-A740 HydrophobicContact CD1-CB 4.2Å; L723-A740 HydrophobicContact CD2-CB 3.9Å; L723-A740 HydrophobicContact CG-CB 3.81Å; I736-A740 WeakPolarHBondContact O-CB 3.23Å; I736-A740 PolarHBondContact O-N 3.23Å; A737-A740 PolarHBondContact O-N 2.68Å; A740-S744 WeakPolarHBondContact O-CB 3.3Å; A740-S744 PolarHBondContact O-N 3.18Å; A740-S744 PolarHBondContact O-OG 3.16Å
741	L	97.4	Very high	94	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-61.7	-52.6	170	-76.9	170.5	0	0	0	110.7	L723 A737 V738 S744 H745 F775 V778 V790 Q793 A794 L797	L723-L741 HydrophobicContact CD1-CD2 4.04Å; L723-L741 HydrophobicContact CD1-CG 4.35Å; L723-L741 HydrophobicContact CD2-CD2 4.12Å; L723-L741 HydrophobicContact CD2-CG 3.84Å; A737-L741 WeakPolarHBondContact O-CB 3.5Å; A737-L741 VanDerWaalsContact O-CG 3.26Å; A737-L741 WeakPolarHBondContact O-CG 3.12Å; A737-L741 PolarHBondContact O-N 2.98Å; V738-L741 WeakPolarHBondContact O-CB 3.43Å; V738-L741 PolarHBondContact O-N 2.95Å; L741-S744 PolarHBondContact O-N 3.25Å; L741-H745 PolarHBondContact O-N 3.23Å; L741-F775 HydrophobicContact CD2-CE2 3.89Å; L741-F775 HydrophobicContact CD2-CZ 3.91Å; L741-F775 VanDerWaalsContact O-CZ 3.28Å; L741-F775 WeakPolarHBondContact O-CZ 3.23Å; L741-V778 HydrophobicContact CD2-CG1 4.49Å; L741-V790 HydrophobicContact CD1-CG1 4.46Å; L741-Q793 HydrophobicContact CB-CG 4.24Å; L741-Q793 HydrophobicContact CD1-CB 4.4Å; L741-Q793 HydrophobicContact CD1-CG 4.21Å; L741-A794 HydrophobicContact CD1-CB 4.17Å; L741-L797 HydrophobicContact CB-CD1 3.79Å
742	Q	96.9	Very high	94.9	Very high	37 Å²	37	22.6 Å²	22.6	17%	0.173	11%	0.111	C	C	.	.	H	α-helix	trans	-58.1	-51.7	178.4	-71.3	176.6	-8.5	0	0	112.2	T702 V738 Q739 S744 H745 Y746 Q793	T702-Q742 HydrophobicContact CG2-CB 3.57Å; V738-Q742 WeakPolarHBondContact O-CG 3.35Å; V738-Q742 PolarHBondContact O-N 3.5Å; Q739-Q742 PolarHBondContact O-N 3.19Å; Q742-S744 VanDerWaalsContact C-N 3.32Å; Q742-S744 PolarHBondContact O-N 2.93Å; Q742-H745 WeakPolarHBondContact O-CB 3.39Å; Q742-H745 PolarHBondContact O-N 3.33Å; Q742-H745 VanDerWaalsContact O-N 3.09Å; Q742-Y746 HydrophobicContact CB-CE2 4.1Å; Q742-Y746 VanDerWaalsContact O-CD2 3.29Å; Q742-Y746 WeakPolarHBondContact O-CD2 3.44Å; Q742-Y746 PolarHBondContact O-N 3.15Å; Q742-Q793 HydrophobicContact CG-CG 4.33Å
743	C	97.4	Very high	95.2	Very high	1 Å²	1	22.4 Å²	22.4	1%	0.007	11%	0.111	C	C	.	.	H	α-helix	trans	-64	-34.9	-179.4	-169.6	0	0	0	0	112.8	L698 T702 Q739 S747	L698-C743 HydrophobicContact CD1-CB 4.15Å; T702-C743 HydrophobicContact CG2-CB 4.37Å; Q739-C743 WeakPolarHBondContact O-CB 3.28Å; Q739-C743 PolarHBondContact O-N 3.4Å; C743-S747 WeakPolarHBondContact O-CB 3.38Å; C743-S747 PolarHBondContact O-N 2.87Å; C743-S747 PolarHBondContact O-OG 2.92Å
744	S	97.6	Very high	95	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-66.8	-36.2	172.9	-61.9	0	0	0	0	112.5	C719 A740 L741 Q742 S747 I748	C719-S744 WeakPolarHBondContact CB-OG 3.43Å; A740-S744 WeakPolarHBondContact O-CB 3.3Å; A740-S744 PolarHBondContact O-N 3.18Å; A740-S744 PolarHBondContact O-OG 3.16Å; L741-S744 PolarHBondContact O-N 3.25Å; Q742-S744 VanDerWaalsContact C-N 3.32Å; Q742-S744 PolarHBondContact O-N 2.93Å; S744-S747 WeakPolarHBondContact O-CB 2.92Å; S744-I748 WeakPolarHBondContact O-CG1 3.13Å; S744-I748 PolarHBondContact O-N 3.26Å
745	H	96.6	Very high	94.9	Very high	12 Å²	12	22.9 Å²	22.9	6%	0.056	11%	0.108	C	C	.	.	H	α-helix	trans	-67	-48.8	174.8	174.2	95.9	0	0	0	111.6	L741 Q742 S747 I748 L749 F775 L797 L801	L741-H745 PolarHBondContact O-N 3.23Å; Q742-H745 WeakPolarHBondContact O-CB 3.39Å; Q742-H745 PolarHBondContact O-N 3.33Å; Q742-H745 VanDerWaalsContact O-N 3.09Å; H745-S747 VanDerWaalsContact C-N 3.27Å; H745-S747 PolarHBondContact O-N 3.38Å; H745-I748 WeakPolarHBondContact O-CA 3.35Å; H745-I748 WeakPolarHBondContact O-CB 3.47Å; H745-I748 PolarHBondContact O-N 3.01Å; H745-L749 WeakPolarHBondContact NE2-CD1 3.41Å; H745-L749 PolarHBondContact O-N 3.21Å; H745-F775 HydrophobicContact CB-CE1 4.14Å; H745-F775 HydrophobicContact CB-CZ 4.45Å; H745-L797 HydrophobicContact CB-CD1 4.19Å; H745-L797 HydrophobicContact CB-CD2 3.95Å; H745-L801 WeakPolarHBondContact ND1-CG 3.31Å
746	Y	96.7	Very high	94.5	Very high	29 Å²	29	20.5 Å²	20.5	11%	0.114	10%	0.1	C	C	.	.	H	α-helix	trans	-59.5	-38.1	175.4	-55.9	-41.2	0	0	0	112.1	T702 H705 N706 Q742 I748 L749 W750 F1255	T702-Y746 HydrophobicContact CG2-CD2 4.28Å; T702-Y746 HydrophobicContact CG2-CE2 3.8Å; H705-Y746 HydrophobicContact CB-CD2 4.26Å; N706-Y746 HydrophobicContact CB-CD2 4.1Å; N706-Y746 HydrophobicContact CB-CE1 4.24Å; N706-Y746 HydrophobicContact CB-CE2 3.7Å; N706-Y746 VanDerWaalsContact OD1-CE1 3.26Å; N706-Y746 WeakPolarHBondContact OD1-CE1 3.22Å; Q742-Y746 HydrophobicContact CB-CE2 4.1Å; Q742-Y746 VanDerWaalsContact O-CD2 3.29Å; Q742-Y746 WeakPolarHBondContact O-CD2 3.44Å; Q742-Y746 PolarHBondContact O-N 3.15Å; Y746-I748 VanDerWaalsContact C-N 3.26Å; Y746-I748 PolarHBondContact O-N 3Å; Y746-L749 PolarHBondContact O-N 2.97Å; Y746-W750 VanDerWaalsContact O-CD1 3.29Å; Y746-W750 PolarHBondContact O-N 3.14Å; Y746-F1255 HydrophobicContact CD1-CD2 4.01Å; Y746-F1255 HydrophobicContact CD1-CE2 4.19Å; Y746-F1255 HydrophobicContact CE1-CD2 4.4Å
747	S	95.7	Very high	93.9	Very high	4 Å²	4	28.1 Å²	28.1	3%	0.028	14%	0.136	C	C	.	.	H	α-helix	trans	-55.4	-40.2	172.1	-55.5	0	0	0	0	112.7	H705 C743 S744 H745 Q751	H705-S747 VanDerWaalsContact CE1-CA 3.46Å; H705-S747 WeakPolarHBondContact CE1-CA 3.45Å; H705-S747 PolarHBondContact CE1-N 3.32Å; H705-S747 PolarHBondContact CE1-OG 3.42Å; C743-S747 WeakPolarHBondContact O-CB 3.38Å; C743-S747 PolarHBondContact O-N 2.87Å; C743-S747 PolarHBondContact O-OG 2.92Å; S744-S747 WeakPolarHBondContact O-CB 2.92Å; H745-S747 VanDerWaalsContact C-N 3.27Å; H745-S747 PolarHBondContact O-N 3.38Å; S747-Q751 WeakPolarHBondContact O-CB 3.36Å; S747-Q751 WeakPolarHBondContact O-CG 3.22Å; S747-Q751 PolarHBondContact O-N 3.16Å
748	I	95.9	Very high	93.1	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-72.8	-41.3	178.4	-74.7	165.3	0	0	0	111.2	F716 S744 H745 Y746 Q751 L752 L768 V771 V772 F775 L801 F805	F716-I748 HydrophobicContact CE2-CD1 4.14Å; F716-I748 HydrophobicContact CE2-CG1 4.48Å; S744-I748 WeakPolarHBondContact O-CG1 3.13Å; S744-I748 PolarHBondContact O-N 3.26Å; H745-I748 WeakPolarHBondContact O-CA 3.35Å; H745-I748 WeakPolarHBondContact O-CB 3.47Å; H745-I748 PolarHBondContact O-N 3.01Å; Y746-I748 VanDerWaalsContact C-N 3.26Å; Y746-I748 PolarHBondContact O-N 3Å; I748-Q751 PolarHBondContact O-N 3.02Å; I748-L752 PolarHBondContact O-N 2.86Å; I748-L768 HydrophobicContact CG2-CD1 4.32Å; I748-V771 HydrophobicContact CD1-CG1 4.07Å; I748-V771 HydrophobicContact CG1-CG1 3.67Å; I748-V772 HydrophobicContact CG2-CG2 3.72Å; I748-F775 HydrophobicContact CD1-CB 3.66Å; I748-F775 HydrophobicContact CD1-CD1 3.49Å; I748-F775 VanDerWaalsContact CD1-CD1 3.49Å; I748-F775 HydrophobicContact CD1-CE1 4.38Å; I748-F775 HydrophobicContact CD1-CG 3.72Å; I748-L801 HydrophobicContact CG2-CD2 3.89Å; I748-F805 HydrophobicContact CG2-CE2 3.65Å; I748-F805 HydrophobicContact CG2-CZ 3.71Å
749	L	95.8	Very high	92.1	Very high	7 Å²	7	35.5 Å²	35.5	4%	0.037	19%	0.187	C	C	.	.	H	α-helix	trans	-65.9	-47.3	180	-63.1	-161.7	0	0	0	112	H745 Y746 Q751 L752 V753 L801 I804 F1255	H745-L749 WeakPolarHBondContact NE2-CD1 3.41Å; H745-L749 PolarHBondContact O-N 3.21Å; Y746-L749 PolarHBondContact O-N 2.97Å; L749-Q751 VanDerWaalsContact C-N 3.33Å; L749-Q751 PolarHBondContact O-N 3.23Å; L749-L752 WeakPolarHBondContact O-CA 3.1Å; L749-L752 WeakPolarHBondContact O-CB 3.42Å; L749-L752 PolarHBondContact O-N 3.06Å; L749-V753 WeakPolarHBondContact O-CG2 3.29Å; L749-V753 PolarHBondContact O-N 2.95Å; L749-L801 HydrophobicContact CD2-CD2 4.28Å; L749-I804 HydrophobicContact CD1-CD1 4.49Å; L749-I804 HydrophobicContact CD2-CD1 3.7Å; L749-I804 HydrophobicContact CD2-CG2 4.44Å; L749-F1255 HydrophobicContact CB-CE1 3.74Å; L749-F1255 HydrophobicContact CB-CE2 4.16Å; L749-F1255 HydrophobicContact CB-CZ 3.47Å; L749-F1255 VanDerWaalsContact CB-CZ 3.47Å; L749-F1255 HydrophobicContact CD1-CD1 3.68Å; L749-F1255 HydrophobicContact CD1-CD2 4.24Å; L749-F1255 HydrophobicContact CD1-CE1 3.64Å; L749-F1255 HydrophobicContact CD1-CE2 4.19Å; L749-F1255 HydrophobicContact CD1-CG 4.01Å; L749-F1255 HydrophobicContact CD1-CZ 3.91Å; L749-F1255 HydrophobicContact CG-CE1 4.37Å; L749-F1255 HydrophobicContact CG-CZ 4.35Å
750	W	94.8	Very high	91.1	Very high	52 Å²	52	36.6 Å²	36.6	20%	0.197	20%	0.196	C	C	.	.	H	α-helix	trans	-65.7	-34.4	177.3	-72.7	113.5	0	0	0	112.9	H705 H708 D709 T711 Y746 L752 V753 K754 F1255	H705-W750 AromaticContact CD2-CD1 3.5Å; H705-W750 VanDerWaalsContact CD2-CD1 3.5Å; H705-W750 AromaticContact CD2-NE1 3.96Å; H705-W750 AromaticContact NE2-CD1 3.75Å; H705-W750 PolarHBondContact O-NE1 2.93Å; H708-W750 VanDerWaalsContact C-CZ2 3.49Å; H708-W750 PolarHBondContact O-NE1 3.33Å; H708-W750 VanDerWaalsContact O-NE1 3.08Å; D709-W750 HydrophobicContact CB-CD2 3.92Å; D709-W750 HydrophobicContact CB-CE3 3.71Å; D709-W750 HydrophobicContact CB-CG 4.36Å; D709-W750 HydrophobicContact CB-CZ3 4.15Å; T711-W750 HydrophobicContact CG2-CB 3.59Å; Y746-W750 VanDerWaalsContact O-CD1 3.29Å; Y746-W750 PolarHBondContact O-N 3.14Å; W750-L752 VanDerWaalsContact C-N 3.28Å; W750-L752 PolarHBondContact O-N 3.04Å; W750-V753 HydrophobicContact CE3-CB 4.29Å; W750-V753 HydrophobicContact CE3-CG1 4.42Å; W750-V753 HydrophobicContact CE3-CG2 4.2Å; W750-V753 HydrophobicContact CZ3-CG1 4.5Å; W750-V753 PolarHBondContact O-N 2.96Å; W750-K754 WeakPolarHBondContact O-CB 3.28Å; W750-K754 PolarHBondContact O-N 3.31Å; W750-F1255 AromaticContact CD1-CE2 4Å; W750-F1255 HydrophobicContact CD2-CE2 4.43Å; W750-F1255 HydrophobicContact CD2-CZ 4.02Å; W750-F1255 AromaticContact CE2-CE2 3.72Å; W750-F1255 AromaticContact CE2-CZ 3.7Å; W750-F1255 HydrophobicContact CG-CZ 4.26Å; W750-F1255 HydrophobicContact CZ2-CE2 4.07Å; W750-F1255 HydrophobicContact CZ2-CZ 4.09Å; W750-F1255 AromaticContact NE1-CE2 3.43Å; W750-F1255 AromaticContact NE1-CZ 3.77Å
751	Q	92.6	Very high	90.5	Very high	42 Å²	42	38.8 Å²	38.8	20%	0.196	21%	0.212	C	C	.	.	H	α-helix	trans	-62.5	-35.5	169.9	-75.5	176.9	25.8	0	0	112	T711 S747 I748 L749 I755 L768	T711-Q751 HydrophobicContact CG2-CG 3.86Å; S747-Q751 WeakPolarHBondContact O-CB 3.36Å; S747-Q751 WeakPolarHBondContact O-CG 3.22Å; S747-Q751 PolarHBondContact O-N 3.16Å; I748-Q751 PolarHBondContact O-N 3.02Å; L749-Q751 VanDerWaalsContact C-N 3.33Å; L749-Q751 PolarHBondContact O-N 3.23Å; Q751-I755 WeakPolarHBondContact O-CB 3.42Å; Q751-I755 WeakPolarHBondContact O-CG1 3.4Å; Q751-I755 PolarHBondContact O-N 3.01Å; Q751-I755 VanDerWaalsContact O-N 3.16Å; Q751-L768 HydrophobicContact CB-CD1 3.89Å
752	L	93.1	Very high	89.9	Confident	1 Å²	1	47 Å²	47	1%	0.005	25%	0.247	C	C	.	.	H	α-helix	trans	-69.1	-47	174.3	-177.5	61.5	0	0	0	111.9	I748 L749 W750 K754 I755 T756 L768 I804 F805 L809 L820 M1257	I748-L752 PolarHBondContact O-N 2.86Å; L749-L752 WeakPolarHBondContact O-CA 3.1Å; L749-L752 WeakPolarHBondContact O-CB 3.42Å; L749-L752 PolarHBondContact O-N 3.06Å; W750-L752 VanDerWaalsContact C-N 3.28Å; W750-L752 PolarHBondContact O-N 3.04Å; L752-K754 VanDerWaalsContact C-N 3.33Å; L752-K754 PolarHBondContact O-N 3.31Å; L752-I755 PolarHBondContact O-N 3.47Å; L752-I755 VanDerWaalsContact O-N 3.11Å; L752-T756 HydrophobicContact CD1-CG2 3.98Å; L752-T756 HydrophobicContact CG-CG2 4.22Å; L752-T756 VanDerWaalsContact O-CG2 3.23Å; L752-T756 WeakPolarHBondContact O-CG2 3.35Å; L752-T756 PolarHBondContact O-N 3.05Å; L752-T756 PolarHBondContact O-OG1 3.46Å; L752-L768 HydrophobicContact CB-CD2 4.22Å; L752-L768 HydrophobicContact CD1-CD2 4.24Å; L752-I804 HydrophobicContact CD2-CG2 3.48Å; L752-I804 VanDerWaalsContact CD2-CG2 3.48Å; L752-F805 HydrophobicContact CB-CZ 4.36Å; L752-F805 HydrophobicContact CD1-CE1 4.25Å; L752-F805 HydrophobicContact CD2-CE1 4.19Å; L752-F805 HydrophobicContact CD2-CE2 4.35Å; L752-F805 HydrophobicContact CD2-CZ 3.86Å; L752-F805 HydrophobicContact CG-CZ 4.48Å; L752-L809 HydrophobicContact CD1-CD1 4.44Å; L752-L809 HydrophobicContact CD2-CD1 4.34Å; L752-L820 HydrophobicContact CD1-CD1 3.89Å; L752-M1257 HydrophobicContact CD2-CE 4.23Å; L752-M1257 HydrophobicContact CG-CE 4.34Å
753	V	91.6	Very high	89.5	Confident	21 Å²	21	50.8 Å²	50.8	13%	0.127	27%	0.269	C	S	.	.	H	α-helix	trans	-50	-55.5	174.8	174.5	0	0	0	0	110	L749 W750 I755 T756 E757 M1257	L749-V753 WeakPolarHBondContact O-CG2 3.29Å; L749-V753 PolarHBondContact O-N 2.95Å; W750-V753 HydrophobicContact CE3-CB 4.29Å; W750-V753 HydrophobicContact CE3-CG1 4.42Å; W750-V753 HydrophobicContact CE3-CG2 4.2Å; W750-V753 HydrophobicContact CZ3-CG1 4.5Å; W750-V753 PolarHBondContact O-N 2.96Å; V753-I755 VanDerWaalsContact C-N 3.27Å; V753-I755 PolarHBondContact O-N 3.18Å; V753-T756 WeakPolarHBondContact CA-OG1 3.26Å; V753-T756 WeakPolarHBondContact O-CA 3.37Å; V753-T756 PolarHBondContact O-N 2.89Å; V753-T756 PolarHBondContact O-OG1 2.94Å; V753-E757 HydrophobicContact CG1-CG 4.32Å; V753-E757 PolarHBondContact O-N 3.21Å; V753-M1257 HydrophobicContact CG2-CE 3.53Å
754	K	88	Confident	89	Confident	108 Å²	108	54.4 Å²	54.4	47%	0.47	29%	0.288	S	S	.	.	H	α-helix	trans	-58.3	-34.9	-179.5	-159.8	-179.7	-145.2	105.7	0	113.6	D709 T711 W750 L752 G758	D709-K754 IonicContact OD1-NZ 2.62Å; D709-K754 IonicContact OD2-NZ 2.78Å; D709-K754 PolarHBondContact OD2-NZ 2.85Å; T711-K754 PolarHBondContact OG1-NZ 2.99Å; W750-K754 WeakPolarHBondContact O-CB 3.28Å; W750-K754 PolarHBondContact O-N 3.31Å; L752-K754 VanDerWaalsContact C-N 3.33Å; L752-K754 PolarHBondContact O-N 3.31Å; K754-G758 PolarHBondContact O-N 3.15Å
755	I	88.6	Confident	88.7	Confident	19 Å²	19	55.2 Å²	55.2	10%	0.097	29%	0.292	C	S	.	.	H	α-helix	trans	-75.1	-28.2	174.8	-84.9	172.5	0	0	0	112.4	Q751 L752 V753 P760 D764 L765 L768 L817 L820	Q751-I755 WeakPolarHBondContact O-CB 3.42Å; Q751-I755 WeakPolarHBondContact O-CG1 3.4Å; Q751-I755 PolarHBondContact O-N 3.01Å; Q751-I755 VanDerWaalsContact O-N 3.16Å; L752-I755 PolarHBondContact O-N 3.47Å; L752-I755 VanDerWaalsContact O-N 3.11Å; V753-I755 VanDerWaalsContact C-N 3.27Å; V753-I755 PolarHBondContact O-N 3.18Å; I755-P760 HydrophobicContact CB-CB 4.36Å; I755-P760 HydrophobicContact CG1-CB 4.17Å; I755-P760 HydrophobicContact CG2-CB 3.95Å; I755-P760 HydrophobicContact CG2-CG 4.2Å; I755-P760 WeakPolarHBondContact O-CD 3.36Å; I755-P760 WeakPolarHBondContact O-CG 3.43Å; I755-D764 HydrophobicContact CD1-CB 4.16Å; I755-D764 HydrophobicContact CG1-CB 4.42Å; I755-L765 HydrophobicContact CG2-CD2 3.77Å; I755-L768 HydrophobicContact CD1-CB 3.94Å; I755-L768 HydrophobicContact CD1-CD2 3.77Å; I755-L768 HydrophobicContact CD1-CG 4.5Å; I755-L817 HydrophobicContact CG2-CD2 3.82Å; I755-L820 HydrophobicContact CG2-CD1 4.3Å
756	T	85.4	Confident	88.4	Confident	41 Å²	41	58.9 Å²	58.9	25%	0.252	31%	0.312	S	S	.	.	H	α-helix	trans	-85.5	-31.4	-179.2	58.9	0	0	0	0	113.9	L752 V753 L817 M1259	L752-T756 HydrophobicContact CD1-CG2 3.98Å; L752-T756 HydrophobicContact CG-CG2 4.22Å; L752-T756 VanDerWaalsContact O-CG2 3.23Å; L752-T756 WeakPolarHBondContact O-CG2 3.35Å; L752-T756 PolarHBondContact O-N 3.05Å; L752-T756 PolarHBondContact O-OG1 3.46Å; V753-T756 WeakPolarHBondContact CA-OG1 3.26Å; V753-T756 WeakPolarHBondContact O-CA 3.37Å; V753-T756 PolarHBondContact O-N 2.89Å; V753-T756 PolarHBondContact O-OG1 2.94Å; T756-L817 HydrophobicContact CG2-CD1 3.77Å; T756-L817 HydrophobicContact CG2-CD2 4.45Å; T756-M1259 HydrophobicContact CG2-CE 3.45Å; T756-M1259 VanDerWaalsContact CG2-CE 3.45Å; T756-M1259 WeakPolarHBondContact OG1-CE 3.49Å
757	E	83.4	Confident	88.1	Confident	160 Å²	160	59.2 Å²	59.2	75%	0.748	32%	0.321	S	S	*	.	H	α-helix	trans	-82.3	-32.1	175.1	-64.5	176	155.9	0	0	112.4	V753	V753-E757 HydrophobicContact CG1-CG 4.32Å; V753-E757 PolarHBondContact O-N 3.21Å
758	G	76.4	Confident	88	Confident	41 Å²	41	59.1 Å²	59.1	42%	0.423	32%	0.32	S	S	.	.	S	Bend	trans	-81.3	-173.3	-179.9	0	0	0	0	0	114.6	K754 P760	K754-G758 PolarHBondContact O-N 3.15Å; G758-P760 WeakPolarHBondContact O-CD 3.37Å
759	V	76.1	Confident	88	Confident	148 Å²	148	65 Å²	65	90%	0.897	34%	0.342	S	S	*	.			trans	-104.3	92.5	162.7	-179.3	0	0	0	0	106.8
760	P	76.3	Confident	87.9	Confident	45 Å²	45	72.5 Å²	72.5	29%	0.292	37%	0.37	S	S	.	.			trans	-69.1	136.8	-169.3	28	-35.9	0	0	0	111.3	I755 G758 L765	I755-P760 HydrophobicContact CB-CB 4.36Å; I755-P760 HydrophobicContact CG1-CB 4.17Å; I755-P760 HydrophobicContact CG2-CB 3.95Å; I755-P760 HydrophobicContact CG2-CG 4.2Å; I755-P760 WeakPolarHBondContact O-CD 3.36Å; I755-P760 WeakPolarHBondContact O-CG 3.43Å; G758-P760 WeakPolarHBondContact O-CD 3.37Å; P760-L765 HydrophobicContact CB-CD2 4.2Å; P760-L765 HydrophobicContact CB-CG 4.16Å; P760-L765 HydrophobicContact CG-CD1 4.5Å; P760-L765 HydrophobicContact CG-CD2 4.37Å
761	S	84	Confident	87.9	Confident	47 Å²	47	71.4 Å²	71.4	33%	0.329	37%	0.369	S	S	.	.			trans	-74.7	164	170.9	83.5	0	0	0	0	110.6	D763 D764 L765	S761-D763 PolarHBondContact O-N 3.07Å; S761-D763 PolarHBondContact OG-N 2.82Å; S761-D764 WeakPolarHBondContact CA-OD2 3.31Å; S761-D764 WeakPolarHBondContact CB-OD2 3.31Å; S761-D764 PolarHBondContact N-OD2 3.09Å; S761-D764 PolarHBondContact O-N 2.89Å; S761-D764 PolarHBondContact OG-N 3.2Å; S761-D764 VanDerWaalsContact OG-N 3.17Å; S761-D764 PolarHBondContact OG-OD2 2.83Å; S761-L765 WeakPolarHBondContact O-CG 3.47Å; S761-L765 PolarHBondContact O-N 3.3Å
762	K	85.2	Confident	88	Confident	171 Å²	171	69.6 Å²	69.6	74%	0.743	36%	0.361	S	S	*	.	H	α-helix	trans	-63.7	-29.1	173.9	-69.1	-173.6	176.6	-177	0	112.2	L766	K762-L766 WeakPolarHBondContact O-CB 3.4Å; K762-L766 WeakPolarHBondContact O-CD1 3.32Å; K762-L766 WeakPolarHBondContact O-CG 3.32Å; K762-L766 PolarHBondContact O-N 3.39Å
763	D	87.8	Confident	88.1	Confident	117 Å²	117	76.3 Å²	76.3	63%	0.626	39%	0.39	S	S	*	.	H	α-helix	trans	-78.4	-33.1	-177.6	-60.7	-41.8	0	0	0	111.1	S761 L766 A767	S761-D763 PolarHBondContact O-N 3.07Å; S761-D763 PolarHBondContact OG-N 2.82Å; D763-L766 CarbonylContact O-C 3.59Å; D763-L766 PolarHBondContact O-N 2.94Å; D763-A767 WeakPolarHBondContact O-CB 3.38Å; D763-A767 PolarHBondContact O-N 3.47Å
764	D	87.7	Confident	88.3	Confident	77 Å²	77	77.4 Å²	77.4	41%	0.412	40%	0.398	S	S	.	.	H	α-helix	trans	-64.5	-47.8	171.8	-51.3	-48.1	0	0	0	111.1	I755 S761 L766 A767 L768	I755-D764 HydrophobicContact CD1-CB 4.16Å; I755-D764 HydrophobicContact CG1-CB 4.42Å; S761-D764 WeakPolarHBondContact CA-OD2 3.31Å; S761-D764 WeakPolarHBondContact CB-OD2 3.31Å; S761-D764 PolarHBondContact N-OD2 3.09Å; S761-D764 PolarHBondContact O-N 2.89Å; S761-D764 PolarHBondContact OG-N 3.2Å; S761-D764 VanDerWaalsContact OG-N 3.17Å; S761-D764 PolarHBondContact OG-OD2 2.83Å; D764-L766 VanDerWaalsContact C-N 3.28Å; D764-L766 PolarHBondContact O-N 3.16Å; D764-A767 WeakPolarHBondContact O-CB 3.4Å; D764-A767 PolarHBondContact O-N 2.66Å; D764-L768 PolarHBondContact O-N 3.1Å
765	L	90.4	Very high	88.7	Confident	17 Å²	17	72.2 Å²	72.2	9%	0.089	38%	0.376	C	S	.	.	H	α-helix	trans	-61	-37.3	175.6	-66	171.7	0	0	0	111.7	I755 P760 S761 R769 L817 L820	I755-L765 HydrophobicContact CG2-CD2 3.77Å; P760-L765 HydrophobicContact CB-CD2 4.2Å; P760-L765 HydrophobicContact CB-CG 4.16Å; P760-L765 HydrophobicContact CG-CD1 4.5Å; P760-L765 HydrophobicContact CG-CD2 4.37Å; S761-L765 WeakPolarHBondContact O-CG 3.47Å; S761-L765 PolarHBondContact O-N 3.3Å; L765-R769 VanDerWaalsContact O-CB 3.24Å; L765-R769 WeakPolarHBondContact O-CB 3.23Å; L765-R769 PolarHBondContact O-N 2.95Å; L765-R769 VanDerWaalsContact O-N 3.07Å; L765-L817 HydrophobicContact CD2-CD2 4.35Å; L765-L820 HydrophobicContact CD2-CD1 3.87Å; L765-L820 HydrophobicContact CD2-CD2 4.26Å; L765-L820 HydrophobicContact CD2-CG 3.99Å; L765-L820 WeakPolarHBondContact O-CD2 3.06Å
766	L	90.8	Very high	89.1	Confident	89 Å²	89	71.5 Å²	71.5	47%	0.466	37%	0.372	S	S	.	.	H	α-helix	trans	-76	-22.1	175	-72.4	171.4	0	0	0	113.2	K762 D763 D764 R770	K762-L766 WeakPolarHBondContact O-CB 3.4Å; K762-L766 WeakPolarHBondContact O-CD1 3.32Å; K762-L766 WeakPolarHBondContact O-CG 3.32Å; K762-L766 PolarHBondContact O-N 3.39Å; D763-L766 CarbonylContact O-C 3.59Å; D763-L766 PolarHBondContact O-N 2.94Å; D764-L766 VanDerWaalsContact C-N 3.28Å; D764-L766 PolarHBondContact O-N 3.16Å; L766-R770 WeakPolarHBondContact O-CG 3.36Å; L766-R770 PolarHBondContact O-NE 3.02Å
767	A	91.4	Very high	89.5	Confident	37 Å²	37	71.4 Å²	71.4	31%	0.306	38%	0.376	S	S	.	.	H	α-helix	trans	-73.2	-59.5	169.9	0	0	0	0	0	110.4	D763 D764 R769 R770 V771	D763-A767 WeakPolarHBondContact O-CB 3.38Å; D763-A767 PolarHBondContact O-N 3.47Å; D764-A767 WeakPolarHBondContact O-CB 3.4Å; D764-A767 PolarHBondContact O-N 2.66Å; A767-R769 VanDerWaalsContact C-N 3.29Å; A767-R769 PolarHBondContact O-N 3.48Å; A767-R770 WeakPolarHBondContact O-CA 3.37Å; A767-R770 WeakPolarHBondContact O-CB 3.29Å; A767-R770 PolarHBondContact O-N 2.99Å; A767-V771 PolarHBondContact O-N 3.17Å
768	L	93.2	Very high	90.1	Very high	2 Å²	2	64.1 Å²	64.1	1%	0.01	34%	0.342	C	S	.	.	H	α-helix	trans	-56.8	-41.6	-179.5	-179.4	59.7	0	0	0	111.7	I748 Q751 L752 I755 D764 R770 V771 V772 F805 L820	I748-L768 HydrophobicContact CG2-CD1 4.32Å; Q751-L768 HydrophobicContact CB-CD1 3.89Å; L752-L768 HydrophobicContact CB-CD2 4.22Å; L752-L768 HydrophobicContact CD1-CD2 4.24Å; I755-L768 HydrophobicContact CD1-CB 3.94Å; I755-L768 HydrophobicContact CD1-CD2 3.77Å; I755-L768 HydrophobicContact CD1-CG 4.5Å; D764-L768 PolarHBondContact O-N 3.1Å; L768-R770 VanDerWaalsContact C-N 3.26Å; L768-R770 PolarHBondContact O-N 2.99Å; L768-V771 PolarHBondContact O-N 2.82Å; L768-V771 VanDerWaalsContact O-N 3.15Å; L768-V772 HydrophobicContact CD1-CG2 3.77Å; L768-V772 HydrophobicContact CG-CG2 4.03Å; L768-V772 WeakPolarHBondContact O-CB 3.39Å; L768-V772 VanDerWaalsContact O-CG2 3.32Å; L768-V772 WeakPolarHBondContact O-CG2 3.5Å; L768-V772 PolarHBondContact O-N 2.64Å; L768-F805 HydrophobicContact CD2-CE1 4.29Å; L768-F805 HydrophobicContact CD2-CZ 4.45Å; L768-L820 HydrophobicContact CB-CD2 4.06Å; L768-L820 HydrophobicContact CD2-CD1 3.96Å; L768-L820 HydrophobicContact CD2-CD2 4.12Å; L768-L820 HydrophobicContact CG-CD2 4.09Å
769	R	94.6	Very high	91.1	Very high	123 Å²	123	62.2 Å²	62.2	46%	0.464	32%	0.322	S	S	.	.	H	α-helix	trans	-58	-36.3	175.7	-164.9	-169.9	-170	150	12.3	113.3	L765 A767 K773 P819 L820	L765-R769 VanDerWaalsContact O-CB 3.24Å; L765-R769 WeakPolarHBondContact O-CB 3.23Å; L765-R769 PolarHBondContact O-N 2.95Å; L765-R769 VanDerWaalsContact O-N 3.07Å; A767-R769 VanDerWaalsContact C-N 3.29Å; A767-R769 PolarHBondContact O-N 3.48Å; R769-K773 VanDerWaalsContact O-CB 3.32Å; R769-K773 WeakPolarHBondContact O-CB 3.49Å; R769-K773 PolarHBondContact O-N 3Å; R769-K773 VanDerWaalsContact O-N 3.09Å; R769-P819 WeakPolarHBondContact CD-O 3.46Å; R769-P819 PolarHBondContact NE-O 2.95Å; R769-P819 PolarHBondContact NH1-O 3.1Å; R769-P819 VanDerWaalsContact NH1-O 3.07Å; R769-L820 HydrophobicContact CB-CD2 4.16Å
770	R	94.1	Very high	92	Very high	165 Å²	165	57.6 Å²	57.6	62%	0.623	29%	0.291	S	S	*	.	H	α-helix	trans	-72.8	-40.8	177.1	-77.1	178.2	-71.6	152.6	-0.5	111.4	L766 A767 L768 S774	L766-R770 WeakPolarHBondContact O-CG 3.36Å; L766-R770 PolarHBondContact O-NE 3.02Å; A767-R770 WeakPolarHBondContact O-CA 3.37Å; A767-R770 WeakPolarHBondContact O-CB 3.29Å; A767-R770 PolarHBondContact O-N 2.99Å; L768-R770 VanDerWaalsContact C-N 3.26Å; L768-R770 PolarHBondContact O-N 2.99Å; R770-S774 WeakPolarHBondContact O-CB 3.41Å; R770-S774 PolarHBondContact O-N 3.07Å; R770-S774 PolarHBondContact O-OG 3.35Å
771	V	94.6	Very high	92.9	Very high	28 Å²	28	60.2 Å²	60.2	17%	0.17	30%	0.299	C	S	.	.	H	α-helix	trans	-59.5	-58	174.6	176.5	0	0	0	0	109.9	F716 I748 A767 L768 K773 S774 F775	F716-V771 HydrophobicContact CD1-CG1 4.07Å; F716-V771 HydrophobicContact CD2-CG1 3.86Å; F716-V771 HydrophobicContact CE1-CG1 3.84Å; F716-V771 HydrophobicContact CE2-CG1 3.6Å; F716-V771 HydrophobicContact CG-CG1 4.1Å; F716-V771 HydrophobicContact CZ-CG1 3.61Å; I748-V771 HydrophobicContact CD1-CG1 4.07Å; I748-V771 HydrophobicContact CG1-CG1 3.67Å; A767-V771 PolarHBondContact O-N 3.17Å; L768-V771 PolarHBondContact O-N 2.82Å; L768-V771 VanDerWaalsContact O-N 3.15Å; V771-K773 PolarHBondContact O-N 3.39Å; V771-S774 PolarHBondContact O-N 2.94Å; V771-S774 VanDerWaalsContact O-N 3.11Å; V771-F775 WeakPolarHBondContact O-CB 3.48Å; V771-F775 PolarHBondContact O-N 3.32Å
772	V	95.4	Very high	93.4	Very high	5 Å²	5	58.3 Å²	58.3	3%	0.03	29%	0.286	C	S	.	.	H	α-helix	trans	-53.4	-51.8	178.8	172.1	0	0	0	0	111.7	I748 L768 S774 F775 L776 F805	I748-V772 HydrophobicContact CG2-CG2 3.72Å; L768-V772 HydrophobicContact CD1-CG2 3.77Å; L768-V772 HydrophobicContact CG-CG2 4.03Å; L768-V772 WeakPolarHBondContact O-CB 3.39Å; L768-V772 VanDerWaalsContact O-CG2 3.32Å; L768-V772 WeakPolarHBondContact O-CG2 3.5Å; L768-V772 PolarHBondContact O-N 2.64Å; V772-S774 VanDerWaalsContact C-N 3.3Å; V772-S774 PolarHBondContact O-N 3.2Å; V772-F775 PolarHBondContact O-N 3.04Å; V772-L776 HydrophobicContact CG1-CD1 3.74Å; V772-L776 HydrophobicContact CG1-CG 4.29Å; V772-L776 WeakPolarHBondContact O-CB 3.46Å; V772-L776 VanDerWaalsContact O-CG 3.3Å; V772-L776 WeakPolarHBondContact O-CG 3.33Å; V772-L776 PolarHBondContact O-N 3.38Å; V772-F805 HydrophobicContact CG1-CD1 4.36Å; V772-F805 HydrophobicContact CG1-CD2 4.27Å; V772-F805 HydrophobicContact CG1-CE2 4.49Å; V772-F805 HydrophobicContact CG1-CG 4.2Å; V772-F805 HydrophobicContact CG2-CD1 4.35Å; V772-F805 HydrophobicContact CG2-CE1 3.77Å; V772-F805 HydrophobicContact CG2-CE2 4.01Å; V772-F805 HydrophobicContact CG2-CZ 3.58Å
773	K	94.9	Very high	93.8	Very high	141 Å²	141	51 Å²	51	61%	0.613	26%	0.255	S	S	*	.	H	α-helix	trans	-62.5	-36.6	-179.5	-176.2	175.2	179.8	-177.7	0	112.7	R769 V771 A777	R769-K773 VanDerWaalsContact O-CB 3.32Å; R769-K773 WeakPolarHBondContact O-CB 3.49Å; R769-K773 PolarHBondContact O-N 3Å; R769-K773 VanDerWaalsContact O-N 3.09Å; V771-K773 PolarHBondContact O-N 3.39Å; K773-A777 PolarHBondContact O-N 3.43Å
774	S	95.1	Very high	93.9	Very high	44 Å²	44	50.3 Å²	50.3	31%	0.308	26%	0.259	S	S	.	.	H	α-helix	trans	-72.7	-38.6	179.8	-52.1	0	0	0	0	111.3	R770 V771 V772 A777 V778	R770-S774 WeakPolarHBondContact O-CB 3.41Å; R770-S774 PolarHBondContact O-N 3.07Å; R770-S774 PolarHBondContact O-OG 3.35Å; V771-S774 PolarHBondContact O-N 2.94Å; V771-S774 VanDerWaalsContact O-N 3.11Å; V772-S774 VanDerWaalsContact C-N 3.3Å; V772-S774 PolarHBondContact O-N 3.2Å; S774-A777 PolarHBondContact O-N 3.1Å; S774-V778 PolarHBondContact O-N 2.83Å
775	F	96.9	Very high	93.9	Very high	0 Å²	0	49 Å²	49	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-71	-40.9	177.9	-173	-113.1	0	0	0	113.1	F716 L723 L741 H745 I748 V771 V772 A777 V778 C779 L801	F716-F775 HydrophobicContact CE2-CB 4.05Å; F716-F775 HydrophobicContact CE2-CD2 4.11Å; F716-F775 HydrophobicContact CE2-CG 4.22Å; F716-F775 HydrophobicContact CZ-CB 4.19Å; L723-F775 HydrophobicContact CD1-CE2 3.93Å; L741-F775 HydrophobicContact CD2-CE2 3.89Å; L741-F775 HydrophobicContact CD2-CZ 3.91Å; L741-F775 VanDerWaalsContact O-CZ 3.28Å; L741-F775 WeakPolarHBondContact O-CZ 3.23Å; H745-F775 HydrophobicContact CB-CE1 4.14Å; H745-F775 HydrophobicContact CB-CZ 4.45Å; I748-F775 HydrophobicContact CD1-CB 3.66Å; I748-F775 HydrophobicContact CD1-CD1 3.49Å; I748-F775 VanDerWaalsContact CD1-CD1 3.49Å; I748-F775 HydrophobicContact CD1-CE1 4.38Å; I748-F775 HydrophobicContact CD1-CG 3.72Å; V771-F775 WeakPolarHBondContact O-CB 3.48Å; V771-F775 PolarHBondContact O-N 3.32Å; V772-F775 PolarHBondContact O-N 3.04Å; F775-A777 VanDerWaalsContact C-N 3.27Å; F775-A777 PolarHBondContact O-N 3.01Å; F775-V778 WeakPolarHBondContact O-CB 3.43Å; F775-V778 PolarHBondContact O-N 2.95Å; F775-V778 VanDerWaalsContact O-N 3.11Å; F775-C779 WeakPolarHBondContact CE1-SG 3.34Å; F775-C779 WeakPolarHBondContact CZ-SG 3.49Å; F775-C779 PolarHBondContact O-N 3.38Å; F775-C779 PolarHBondContact O-SG 2.93Å; F775-L801 HydrophobicContact CD1-CD1 3.58Å; F775-L801 HydrophobicContact CE1-CD1 3.68Å
776	L	96.5	Very high	93.8	Very high	4 Å²	4	54.3 Å²	54.3	2%	0.021	29%	0.285	C	S	.	.	H	α-helix	trans	-57.8	-40.1	173.1	-72.9	170.7	0	0	0	111.7	V772 C779 Q780 L798 L801 F822	V772-L776 HydrophobicContact CG1-CD1 3.74Å; V772-L776 HydrophobicContact CG1-CG 4.29Å; V772-L776 WeakPolarHBondContact O-CB 3.46Å; V772-L776 VanDerWaalsContact O-CG 3.3Å; V772-L776 WeakPolarHBondContact O-CG 3.33Å; V772-L776 PolarHBondContact O-N 3.38Å; L776-C779 PolarHBondContact O-N 2.96Å; L776-Q780 WeakPolarHBondContact O-CB 3.33Å; L776-Q780 PolarHBondContact O-N 2.6Å; L776-L798 HydrophobicContact CD2-CD2 3.81Å; L776-L801 HydrophobicContact CD2-CB 3.82Å; L776-L801 HydrophobicContact CD2-CD1 4.13Å; L776-F822 HydrophobicContact CD1-CB 4.43Å; L776-F822 HydrophobicContact CD1-CD1 3.79Å; L776-F822 HydrophobicContact CD1-CD2 3.68Å; L776-F822 HydrophobicContact CD1-CE1 3.88Å; L776-F822 HydrophobicContact CD1-CE2 3.76Å; L776-F822 HydrophobicContact CD1-CG 3.7Å; L776-F822 HydrophobicContact CD1-CZ 3.86Å
777	A	95.4	Very high	93.8	Very high	39 Å²	39	52.9 Å²	52.9	32%	0.322	28%	0.277	S	S	.	.	H	α-helix	trans	-67.7	-34.2	176.3	0	0	0	0	0	113.1	K773 S774 F775 Q781	K773-A777 PolarHBondContact O-N 3.43Å; S774-A777 PolarHBondContact O-N 3.1Å; F775-A777 VanDerWaalsContact C-N 3.27Å; F775-A777 PolarHBondContact O-N 3.01Å; A777-Q781 VanDerWaalsContact O-CG 3.29Å; A777-Q781 WeakPolarHBondContact O-CG 3.48Å; A777-Q781 PolarHBondContact O-N 3.47Å; A777-Q781 VanDerWaalsContact O-N 3.14Å
778	V	95.8	Very high	93.8	Very high	7 Å²	7	54 Å²	54	4%	0.042	28%	0.28	C	S	.	.	H	α-helix	trans	-66.3	-48.1	172.1	164.6	0	0	0	0	110.7	Y720 L723 I727 L741 S774 F775 Q780 Q781 C782	Y720-V778 HydrophobicContact CD2-CG2 4.31Å; Y720-V778 HydrophobicContact CE2-CG2 3.76Å; L723-V778 HydrophobicContact CB-CG1 3.84Å; L723-V778 HydrophobicContact CD1-CG1 4.01Å; L723-V778 HydrophobicContact CG-CG1 4.41Å; I727-V778 HydrophobicContact CD1-CB 4.5Å; I727-V778 HydrophobicContact CD1-CG1 3.99Å; I727-V778 HydrophobicContact CD1-CG2 4.48Å; L741-V778 HydrophobicContact CD2-CG1 4.49Å; S774-V778 PolarHBondContact O-N 2.83Å; F775-V778 WeakPolarHBondContact O-CB 3.43Å; F775-V778 PolarHBondContact O-N 2.95Å; F775-V778 VanDerWaalsContact O-N 3.11Å; V778-Q780 VanDerWaalsContact C-N 3.33Å; V778-Q780 PolarHBondContact O-N 3.12Å; V778-Q781 PolarHBondContact O-N 2.94Å; V778-Q781 VanDerWaalsContact O-N 3.15Å; V778-C782 PolarHBondContact O-N 3.22Å; V778-C782 PolarHBondContact O-SG 3.42Å; V778-C782 VanDerWaalsContact O-SG 3.34Å
779	C	96.4	Very high	93.7	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-61.9	-40.2	177.9	-59	0	0	0	0	112	F775 L776 Q781 C782 L783 A794 L798	F775-C779 WeakPolarHBondContact CE1-SG 3.34Å; F775-C779 WeakPolarHBondContact CZ-SG 3.49Å; F775-C779 PolarHBondContact O-N 3.38Å; F775-C779 PolarHBondContact O-SG 2.93Å; L776-C779 PolarHBondContact O-N 2.96Å; C779-Q781 VanDerWaalsContact C-N 3.33Å; C779-Q781 PolarHBondContact O-N 3.08Å; C779-C782 WeakPolarHBondContact O-CB 3.24Å; C779-C782 PolarHBondContact O-N 3.04Å; C779-C782 VanDerWaalsContact O-N 3.12Å; C779-L783 PolarHBondContact O-N 2.9Å; C779-L783 VanDerWaalsContact O-N 3.16Å; C779-A794 HydrophobicContact CB-CB 4.31Å; C779-L798 HydrophobicContact CB-CD1 4Å; C779-L798 HydrophobicContact CB-CD2 3.86Å; C779-L798 HydrophobicContact CB-CG 3.63Å
780	Q	96.1	Very high	93.7	Very high	52 Å²	52	50.5 Å²	50.5	24%	0.243	27%	0.274	C	S	.	.	H	α-helix	trans	-60.2	-41.8	174.9	-175.2	175.2	11.2	0	0	111.7	L776 V778 C782 L783 L828 E831	L776-Q780 WeakPolarHBondContact O-CB 3.33Å; L776-Q780 PolarHBondContact O-N 2.6Å; V778-Q780 VanDerWaalsContact C-N 3.33Å; V778-Q780 PolarHBondContact O-N 3.12Å; Q780-C782 VanDerWaalsContact C-N 3.34Å; Q780-C782 PolarHBondContact O-N 2.91Å; Q780-L783 WeakPolarHBondContact O-CB 3.46Å; Q780-L783 PolarHBondContact O-N 2.97Å; Q780-L828 HydrophobicContact CB-CD1 4.33Å; Q780-L828 HydrophobicContact CG-CD1 3.95Å; Q780-E831 VanDerWaalsContact CG-OE2 3.27Å; Q780-E831 WeakPolarHBondContact CG-OE2 3.47Å; Q780-E831 PolarHBondContact NE2-OE2 3.27Å
781	Q	94.4	Very high	93.7	Very high	100 Å²	100	44.8 Å²	44.8	47%	0.467	25%	0.254	S	S	.	.	H	α-helix	trans	-65	-37.9	174	-71	165.3	14.8	0	0	111.5	I727 A777 V778 C779 L783 S784	I727-Q781 HydrophobicContact CD1-CB 4.06Å; A777-Q781 VanDerWaalsContact O-CG 3.29Å; A777-Q781 WeakPolarHBondContact O-CG 3.48Å; A777-Q781 PolarHBondContact O-N 3.47Å; A777-Q781 VanDerWaalsContact O-N 3.14Å; V778-Q781 PolarHBondContact O-N 2.94Å; V778-Q781 VanDerWaalsContact O-N 3.15Å; C779-Q781 VanDerWaalsContact C-N 3.33Å; C779-Q781 PolarHBondContact O-N 3.08Å; Q781-L783 VanDerWaalsContact C-N 3.28Å; Q781-L783 PolarHBondContact O-N 3.17Å; Q781-S784 PolarHBondContact O-N 3.39Å; Q781-S784 VanDerWaalsContact O-N 3.09Å; Q781-S784 PolarHBondContact O-OG 2.82Å
782	C	94.3	Very high	93.7	Very high	6 Å²	6	44.8 Å²	44.8	4%	0.041	25%	0.252	C	S	.	.	H	α-helix	trans	-64.4	-22.3	175.9	-69.3	0	0	0	0	114.8	V778 C779 Q780 S784 N785 V790 A794	V778-C782 PolarHBondContact O-N 3.22Å; V778-C782 PolarHBondContact O-SG 3.42Å; V778-C782 VanDerWaalsContact O-SG 3.34Å; C779-C782 WeakPolarHBondContact O-CB 3.24Å; C779-C782 PolarHBondContact O-N 3.04Å; C779-C782 VanDerWaalsContact O-N 3.12Å; Q780-C782 VanDerWaalsContact C-N 3.34Å; Q780-C782 PolarHBondContact O-N 2.91Å; C782-S784 PolarHBondContact O-N 3.14Å; C782-N785 WeakPolarHBondContact O-CB 3.34Å; C782-N785 PolarHBondContact O-N 2.94Å; C782-N785 VanDerWaalsContact O-N 3.09Å; C782-V790 HydrophobicContact CB-CG1 4.12Å; C782-A794 HydrophobicContact CB-CB 3.52Å
783	L	93.2	Very high	93.8	Very high	19 Å²	19	46.2 Å²	46.2	10%	0.099	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-27.6	170.6	-64.9	-179.7	0	0	0	112.7	C779 Q780 Q781 K791 A794 F795 L798 E831 L832	C779-L783 PolarHBondContact O-N 2.9Å; C779-L783 VanDerWaalsContact O-N 3.16Å; Q780-L783 WeakPolarHBondContact O-CB 3.46Å; Q780-L783 PolarHBondContact O-N 2.97Å; Q781-L783 VanDerWaalsContact C-N 3.28Å; Q781-L783 PolarHBondContact O-N 3.17Å; L783-K791 WeakPolarHBondContact O-CD 3.47Å; L783-K791 WeakPolarHBondContact O-CG 3.44Å; L783-A794 HydrophobicContact CD2-CB 4.46Å; L783-F795 HydrophobicContact CD2-CB 3.74Å; L783-F795 HydrophobicContact CD2-CD2 4.45Å; L783-L798 HydrophobicContact CD1-CD1 3.71Å; L783-L798 HydrophobicContact CD2-CD1 4.04Å; L783-L798 HydrophobicContact CG-CD1 3.84Å; L783-E831 HydrophobicContact CD1-CB 4.19Å; L783-L832 HydrophobicContact CD1-CD2 4.14Å
784	S	89.9	Confident	93.9	Very high	101 Å²	101	39.5 Å²	39.5	71%	0.706	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89	3.1	178.1	72.6	0	0	0	0	114.3	Q781 C782	Q781-S784 PolarHBondContact O-N 3.39Å; Q781-S784 VanDerWaalsContact O-N 3.09Å; Q781-S784 PolarHBondContact O-OG 2.82Å; C782-S784 PolarHBondContact O-N 3.14Å
785	N	89.1	Confident	94	Very high	49 Å²	49	37.4 Å²	37.4	26%	0.262	21%	0.214	S	C	.	.			trans	-66	154.1	-179.7	-163.4	-78.1	0	0	0	111.8	C782 N787 V790 K791	C782-N785 WeakPolarHBondContact O-CB 3.34Å; C782-N785 PolarHBondContact O-N 2.94Å; C782-N785 VanDerWaalsContact O-N 3.09Å; N785-N787 WeakPolarHBondContact OD1-CB 3.46Å; N785-N787 PolarHBondContact OD1-N 3.42Å; N785-V790 HydrophobicContact CB-CB 4.33Å; N785-V790 HydrophobicContact CB-CG1 4.05Å; N785-K791 WeakPolarHBondContact O-CE 3.37Å
786	V	87.9	Confident	94	Very high	129 Å²	129	39 Å²	39	78%	0.782	22%	0.222	S	C	*	.	S	Bend	trans	-73.2	-27	177.5	-65.4	0	0	0	0	113
787	N	89.8	Confident	94	Very high	59 Å²	59	39.2 Å²	39.2	32%	0.316	22%	0.223	S	C	.	.	S	Bend	trans	-89.7	116.5	-175.8	-60.5	-34.2	0	0	0	110.9	E734 N785 V790 K791	E734-N787 HydrophobicContact CB-CB 4.22Å; N785-N787 WeakPolarHBondContact OD1-CB 3.46Å; N785-N787 PolarHBondContact OD1-N 3.42Å; N787-V790 HydrophobicContact CB-CB 4.35Å; N787-V790 HydrophobicContact CB-CG2 3.93Å; N787-V790 WeakPolarHBondContact O-CB 3.23Å; N787-V790 PolarHBondContact O-N 3.12Å; N787-V790 VanDerWaalsContact O-N 3.11Å; N787-K791 PolarHBondContact O-N 2.83Å
788	T	91.4	Very high	94.1	Very high	60 Å²	60	37.4 Å²	37.4	37%	0.368	21%	0.208	S	C	.	.	H	α-helix	trans	-53.7	-43.9	-179.4	-57.4	0	0	0	0	114	V790 K791 E792	T788-V790 VanDerWaalsContact C-N 3.26Å; T788-V790 PolarHBondContact O-N 2.81Å; T788-K791 WeakPolarHBondContact O-CB 3.47Å; T788-K791 PolarHBondContact O-N 3.15Å; T788-K791 VanDerWaalsContact O-N 3.09Å; T788-E792 HydrophobicContact CG2-CG 4.03Å; T788-E792 WeakPolarHBondContact O-CG 3.37Å; T788-E792 PolarHBondContact O-N 3.08Å
789	P	92.6	Very high	94.2	Very high	52 Å²	52	37.1 Å²	37.1	34%	0.338	21%	0.207	S	C	.	.	H	α-helix	trans	-59.9	-34.6	178.1	-25.4	36.2	0	0	0	113.6	V738 Q793	V738-P789 HydrophobicContact CG2-CB 4.36Å; P789-Q793 VanDerWaalsContact O-CB 3.29Å; P789-Q793 WeakPolarHBondContact O-CB 3.37Å; P789-Q793 PolarHBondContact O-N 2.66Å
790	V	94.4	Very high	94.1	Very high	1 Å²	1	39.5 Å²	39.5	1%	0.006	22%	0.219	C	C	.	.	H	α-helix	trans	-69.2	-40.5	176.7	-178.5	0	0	0	0	110.7	E734 A737 V738 L741 C782 N785 N787 T788 A794	E734-V790 HydrophobicContact CB-CG2 3.73Å; A737-V790 HydrophobicContact CB-CG1 4.35Å; A737-V790 HydrophobicContact CB-CG2 4.11Å; V738-V790 HydrophobicContact CG2-CG2 4.27Å; L741-V790 HydrophobicContact CD1-CG1 4.46Å; C782-V790 HydrophobicContact CB-CG1 4.12Å; N785-V790 HydrophobicContact CB-CB 4.33Å; N785-V790 HydrophobicContact CB-CG1 4.05Å; N787-V790 HydrophobicContact CB-CB 4.35Å; N787-V790 HydrophobicContact CB-CG2 3.93Å; N787-V790 WeakPolarHBondContact O-CB 3.23Å; N787-V790 PolarHBondContact O-N 3.12Å; N787-V790 VanDerWaalsContact O-N 3.11Å; T788-V790 VanDerWaalsContact C-N 3.26Å; T788-V790 PolarHBondContact O-N 2.81Å; V790-A794 VanDerWaalsContact O-CB 3.24Å; V790-A794 WeakPolarHBondContact O-CB 3.36Å; V790-A794 PolarHBondContact O-N 3.01Å
791	K	94.5	Very high	94.1	Very high	44 Å²	44	37 Å²	37	19%	0.191	21%	0.208	C	C	.	.	H	α-helix	trans	-63.5	-50.6	174.3	-59.6	-171.2	-177.7	-176.7	0	111.8	L783 N785 N787 T788 Q793 A794 F795 F835 H839	L783-K791 WeakPolarHBondContact O-CD 3.47Å; L783-K791 WeakPolarHBondContact O-CG 3.44Å; N785-K791 WeakPolarHBondContact O-CE 3.37Å; N787-K791 PolarHBondContact O-N 2.83Å; T788-K791 WeakPolarHBondContact O-CB 3.47Å; T788-K791 PolarHBondContact O-N 3.15Å; T788-K791 VanDerWaalsContact O-N 3.09Å; K791-Q793 VanDerWaalsContact C-N 3.34Å; K791-Q793 PolarHBondContact O-N 2.74Å; K791-A794 PolarHBondContact O-N 3.38Å; K791-F795 VanDerWaalsContact O-CB 3.28Å; K791-F795 WeakPolarHBondContact O-CB 3.3Å; K791-F795 PolarHBondContact O-N 3.33Å; K791-F835 HydrophobicContact CB-CD2 4.36Å; K791-F835 HydrophobicContact CB-CE2 3.76Å; K791-F835 HydrophobicContact CD-CE2 4.34Å; K791-H839 PolarHBondContact NZ-NE2 3.18Å
792	E	94.7	Very high	94.2	Very high	28 Å²	28	32.2 Å²	32.2	13%	0.131	19%	0.185	C	C	.	.	H	α-helix	trans	-59.8	-45.2	-177.8	-70.2	170.3	131.7	0	0	111	T788 F795 M796 F835 K867 L871	T788-E792 HydrophobicContact CG2-CG 4.03Å; T788-E792 WeakPolarHBondContact O-CG 3.37Å; T788-E792 PolarHBondContact O-N 3.08Å; E792-F795 PolarHBondContact O-N 3.33Å; E792-M796 PolarHBondContact O-N 2.93Å; E792-F835 HydrophobicContact CB-CZ 4.49Å; E792-F835 HydrophobicContact CG-CZ 3.94Å; E792-K867 WeakPolarHBondContact OE1-CE 3.35Å; E792-K867 IonicContact OE1-NZ 2.82Å; E792-K867 PolarHBondContact OE1-NZ 2.86Å; E792-K867 WeakPolarHBondContact OE2-CE 3.39Å; E792-K867 IonicContact OE2-NZ 2.94Å; E792-K867 PolarHBondContact OE2-NZ 2.87Å; E792-L871 HydrophobicContact CG-CD1 4.49Å
793	Q	96	Very high	94.3	Very high	36 Å²	36	33.3 Å²	33.3	17%	0.168	19%	0.19	C	C	.	.	H	α-helix	trans	-63.9	-44.9	176.7	-174.1	62.4	84	0	0	111.7	V738 L741 Q742 P789 K791 F795 L797	V738-Q793 HydrophobicContact CG1-CB 4.42Å; V738-Q793 HydrophobicContact CG1-CG 4.1Å; V738-Q793 HydrophobicContact CG2-CB 4.23Å; L741-Q793 HydrophobicContact CB-CG 4.24Å; L741-Q793 HydrophobicContact CD1-CB 4.4Å; L741-Q793 HydrophobicContact CD1-CG 4.21Å; Q742-Q793 HydrophobicContact CG-CG 4.33Å; P789-Q793 VanDerWaalsContact O-CB 3.29Å; P789-Q793 WeakPolarHBondContact O-CB 3.37Å; P789-Q793 PolarHBondContact O-N 2.66Å; K791-Q793 VanDerWaalsContact C-N 3.34Å; K791-Q793 PolarHBondContact O-N 2.74Å; Q793-F795 VanDerWaalsContact C-N 3.33Å; Q793-F795 PolarHBondContact O-N 3.39Å; Q793-L797 HydrophobicContact CG-CD1 4.02Å; Q793-L797 VanDerWaalsContact O-CG 3.25Å; Q793-L797 WeakPolarHBondContact O-CG 3.35Å; Q793-L797 PolarHBondContact O-N 3.5Å; Q793-L797 VanDerWaalsContact O-N 3.14Å
794	A	97	Very high	94.3	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-64.5	-37.8	178	0	0	0	0	0	112.3	L741 C779 C782 L783 V790 K791 L798	L741-A794 HydrophobicContact CD1-CB 4.17Å; C779-A794 HydrophobicContact CB-CB 4.31Å; C782-A794 HydrophobicContact CB-CB 3.52Å; L783-A794 HydrophobicContact CD2-CB 4.46Å; V790-A794 VanDerWaalsContact O-CB 3.24Å; V790-A794 WeakPolarHBondContact O-CB 3.36Å; V790-A794 PolarHBondContact O-N 3.01Å; K791-A794 PolarHBondContact O-N 3.38Å; A794-L798 WeakPolarHBondContact O-CB 3.38Å; A794-L798 WeakPolarHBondContact O-CD1 3.35Å; A794-L798 WeakPolarHBondContact O-CG 3.43Å; A794-L798 PolarHBondContact O-N 3.46Å
795	F	97.9	Very high	94.6	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-64	-47.3	176.5	172.8	-91.1	0	0	0	112.6	L783 K791 E792 Q793 L798 C799 L832 F835 V836 L871 A874 F875	L783-F795 HydrophobicContact CD2-CB 3.74Å; L783-F795 HydrophobicContact CD2-CD2 4.45Å; K791-F795 VanDerWaalsContact O-CB 3.28Å; K791-F795 WeakPolarHBondContact O-CB 3.3Å; K791-F795 PolarHBondContact O-N 3.33Å; E792-F795 PolarHBondContact O-N 3.33Å; Q793-F795 VanDerWaalsContact C-N 3.33Å; Q793-F795 PolarHBondContact O-N 3.39Å; F795-L798 WeakPolarHBondContact O-CB 3.35Å; F795-L798 PolarHBondContact O-N 3.39Å; F795-C799 PolarHBondContact O-N 3.45Å; F795-C799 PolarHBondContact O-SG 3.07Å; F795-L832 HydrophobicContact CD2-CD2 3.52Å; F795-L832 HydrophobicContact CE2-CB 4.28Å; F795-L832 HydrophobicContact CE2-CD2 3.8Å; F795-L832 HydrophobicContact CG-CD2 4.5Å; F795-F835 HydrophobicContact CB-CD1 4.08Å; F795-F835 HydrophobicContact CB-CD2 4.49Å; F795-F835 HydrophobicContact CB-CE1 3.91Å; F795-F835 HydrophobicContact CB-CE2 4.35Å; F795-F835 HydrophobicContact CB-CG 4.37Å; F795-F835 HydrophobicContact CB-CZ 4.06Å; F795-F835 AromaticContact CD1-CD1 3.87Å; F795-F835 HydrophobicContact CD1-CD1 3.87Å; F795-F835 AromaticContact CD1-CE1 3.59Å; F795-F835 HydrophobicContact CD1-CE1 3.59Å; F795-F835 HydrophobicContact CD1-CZ 4.41Å; F795-F835 HydrophobicContact CD2-CB 3.95Å; F795-F835 AromaticContact CD2-CD1 3.14Å; F795-F835 HydrophobicContact CD2-CD1 3.14Å; F795-F835 HydrophobicContact CD2-CD2 4.46Å; F795-F835 AromaticContact CD2-CE1 3.74Å; F795-F835 HydrophobicContact CD2-CE1 3.74Å; F795-F835 AromaticContact CD2-CG 3.59Å; F795-F835 HydrophobicContact CD2-CG 3.59Å; F795-F835 HydrophobicContact CE1-CD1 4.04Å; F795-F835 AromaticContact CE1-CE1 3.96Å; F795-F835 HydrophobicContact CE1-CE1 3.96Å; F795-F835 HydrophobicContact CE2-CB 4.17Å; F795-F835 AromaticContact CE2-CD1 3.36Å; F795-F835 HydrophobicContact CE2-CD1 3.36Å; F795-F835 HydrophobicContact CE2-CE1 4.1Å; F795-F835 HydrophobicContact CE2-CG 4.05Å; F795-F835 AromaticContact CG-CD1 3.41Å; F795-F835 HydrophobicContact CG-CD1 3.41Å; F795-F835 VanDerWaalsContact CG-CD1 3.41Å; F795-F835 AromaticContact CG-CE1 3.45Å; F795-F835 HydrophobicContact CG-CE1 3.45Å; F795-F835 VanDerWaalsContact CG-CE1 3.45Å; F795-F835 HydrophobicContact CG-CG 4.05Å; F795-F835 HydrophobicContact CG-CZ 4.11Å; F795-F835 AromaticContact CZ-CD1 3.79Å; F795-F835 HydrophobicContact CZ-CD1 3.79Å; F795-F835 HydrophobicContact CZ-CE1 4.18Å; F795-V836 HydrophobicContact CE2-CG2 3.91Å; F795-V836 HydrophobicContact CZ-CG2 3.57Å; F795-L871 HydrophobicContact CD1-CD2 3.64Å; F795-L871 HydrophobicContact CE1-CB 4.11Å; F795-L871 HydrophobicContact CE1-CD2 3.93Å; F795-L871 WeakPolarHBondContact CE1-O 3.37Å; F795-A874 HydrophobicContact CE1-CB 4.47Å; F795-F875 HydrophobicContact CZ-CB 4.06Å
796	M	97	Very high	94.9	Very high	33 Å²	33	26.4 Å²	26.4	16%	0.163	15%	0.145	C	C	.	.	H	α-helix	trans	-60.9	-51.1	177	-73.9	-61.6	-64.6	0	0	110.9	E792 L798 C799 D800 L871 A874	E792-M796 PolarHBondContact O-N 2.93Å; M796-L798 VanDerWaalsContact C-N 3.26Å; M796-L798 PolarHBondContact O-N 3.48Å; M796-C799 WeakPolarHBondContact O-CA 3.38Å; M796-C799 WeakPolarHBondContact O-CB 3.48Å; M796-C799 PolarHBondContact O-N 3.19Å; M796-D800 PolarHBondContact O-N 2.77Å; M796-L871 HydrophobicContact CG-CD2 3.92Å; M796-L871 HydrophobicContact SD-CD2 3.84Å; M796-A874 HydrophobicContact CE-CB 4.09Å; M796-A874 HydrophobicContact SD-CB 3.73Å
797	L	96.4	Very high	95.1	Very high	9 Å²	9	23.3 Å²	23.3	5%	0.047	12%	0.122	C	C	.	.	H	α-helix	trans	-65.1	-28.3	-179.7	-58.8	174.6	0	0	0	112.8	L741 H745 Q793 L801	L741-L797 HydrophobicContact CB-CD1 3.79Å; H745-L797 HydrophobicContact CB-CD1 4.19Å; H745-L797 HydrophobicContact CB-CD2 3.95Å; Q793-L797 HydrophobicContact CG-CD1 4.02Å; Q793-L797 VanDerWaalsContact O-CG 3.25Å; Q793-L797 WeakPolarHBondContact O-CG 3.35Å; Q793-L797 PolarHBondContact O-N 3.5Å; Q793-L797 VanDerWaalsContact O-N 3.14Å; L797-L801 WeakPolarHBondContact O-CB 3.34Å; L797-L801 WeakPolarHBondContact O-CD1 3.15Å; L797-L801 WeakPolarHBondContact O-CG 3.32Å; L797-L801 PolarHBondContact O-N 3.17Å
798	L	97.6	Very high	95.1	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-65.5	-48.7	168.1	-81.3	165.6	0	0	0	111.2	L776 C779 L783 A794 F795 M796 D800 L801 L802 L828 L832	L776-L798 HydrophobicContact CD2-CD2 3.81Å; C779-L798 HydrophobicContact CB-CD1 4Å; C779-L798 HydrophobicContact CB-CD2 3.86Å; C779-L798 HydrophobicContact CB-CG 3.63Å; L783-L798 HydrophobicContact CD1-CD1 3.71Å; L783-L798 HydrophobicContact CD2-CD1 4.04Å; L783-L798 HydrophobicContact CG-CD1 3.84Å; A794-L798 WeakPolarHBondContact O-CB 3.38Å; A794-L798 WeakPolarHBondContact O-CD1 3.35Å; A794-L798 WeakPolarHBondContact O-CG 3.43Å; A794-L798 PolarHBondContact O-N 3.46Å; F795-L798 WeakPolarHBondContact O-CB 3.35Å; F795-L798 PolarHBondContact O-N 3.39Å; M796-L798 VanDerWaalsContact C-N 3.26Å; M796-L798 PolarHBondContact O-N 3.48Å; L798-D800 VanDerWaalsContact C-N 3.34Å; L798-D800 PolarHBondContact O-N 2.81Å; L798-L801 PolarHBondContact O-N 3.41Å; L798-L802 WeakPolarHBondContact O-CB 3.46Å; L798-L802 WeakPolarHBondContact O-CG 3.33Å; L798-L802 PolarHBondContact O-N 2.9Å; L798-L828 HydrophobicContact CD1-CD1 4.23Å; L798-L828 HydrophobicContact CD2-CD1 4.31Å; L798-L832 HydrophobicContact CB-CD2 4.12Å; L798-L832 HydrophobicContact CD1-CD2 4.12Å
799	C	97.3	Very high	95	Very high	2 Å²	2	20.1 Å²	20.1	1%	0.014	10%	0.101	C	C	.	.	H	α-helix	trans	-59.5	-45.8	178.5	-64.9	0	0	0	0	111.5	F795 M796 L802 M803 A874 L878	F795-C799 PolarHBondContact O-N 3.45Å; F795-C799 PolarHBondContact O-SG 3.07Å; M796-C799 WeakPolarHBondContact O-CA 3.38Å; M796-C799 WeakPolarHBondContact O-CB 3.48Å; M796-C799 PolarHBondContact O-N 3.19Å; C799-L802 PolarHBondContact O-N 3.02Å; C799-M803 WeakPolarHBondContact O-CB 3.22Å; C799-M803 PolarHBondContact O-N 3.31Å; C799-A874 HydrophobicContact CB-CB 3.87Å; C799-L878 HydrophobicContact CB-CD1 4.45Å; C799-L878 HydrophobicContact CB-CD2 4.45Å; C799-L878 WeakPolarHBondContact O-CD2 3.35Å
800	D	95.4	Very high	94.9	Very high	49 Å²	49	19.7 Å²	19.7	26%	0.262	10%	0.096	S	C	.	.	H	α-helix	trans	-68.6	-43.9	-178.6	-60.5	-36.8	0	0	0	111.9	M796 L798 M803 I804	M796-D800 PolarHBondContact O-N 2.77Å; L798-D800 VanDerWaalsContact C-N 3.34Å; L798-D800 PolarHBondContact O-N 2.81Å; D800-M803 WeakPolarHBondContact O-CB 3.49Å; D800-M803 PolarHBondContact O-N 3.38Å; D800-I804 WeakPolarHBondContact O-CB 3.38Å; D800-I804 WeakPolarHBondContact O-CD1 3.34Å; D800-I804 VanDerWaalsContact O-CG1 3.24Å; D800-I804 WeakPolarHBondContact O-CG1 3.49Å; D800-I804 PolarHBondContact O-N 3.23Å
801	L	96.3	Very high	94.5	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-68.8	-35.3	176.1	-70.5	172.1	0	0	0	112.7	H745 I748 L749 F775 L776 L797 L798 M803 F805	H745-L801 WeakPolarHBondContact ND1-CG 3.31Å; I748-L801 HydrophobicContact CG2-CD2 3.89Å; L749-L801 HydrophobicContact CD2-CD2 4.28Å; F775-L801 HydrophobicContact CD1-CD1 3.58Å; F775-L801 HydrophobicContact CE1-CD1 3.68Å; L776-L801 HydrophobicContact CD2-CB 3.82Å; L776-L801 HydrophobicContact CD2-CD1 4.13Å; L797-L801 WeakPolarHBondContact O-CB 3.34Å; L797-L801 WeakPolarHBondContact O-CD1 3.15Å; L797-L801 WeakPolarHBondContact O-CG 3.32Å; L797-L801 PolarHBondContact O-N 3.17Å; L798-L801 PolarHBondContact O-N 3.41Å; L801-M803 VanDerWaalsContact C-N 3.29Å; L801-F805 HydrophobicContact CD2-CD2 4.01Å; L801-F805 HydrophobicContact CD2-CE2 3.75Å; L801-F805 WeakPolarHBondContact O-CB 3.28Å; L801-F805 WeakPolarHBondContact O-CD2 3.44Å; L801-F805 PolarHBondContact O-N 3.16Å
802	L	96.4	Very high	93.9	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-67.1	-31.4	173.4	-71.5	174.8	0	0	0	111.7	L798 C799 S806 F822 P824 L828 L832 L878 I883	L798-L802 WeakPolarHBondContact O-CB 3.46Å; L798-L802 WeakPolarHBondContact O-CG 3.33Å; L798-L802 PolarHBondContact O-N 2.9Å; C799-L802 PolarHBondContact O-N 3.02Å; L802-S806 VanDerWaalsContact O-CB 3.27Å; L802-S806 WeakPolarHBondContact O-CB 3.49Å; L802-S806 PolarHBondContact O-N 2.86Å; L802-F822 HydrophobicContact CD2-CD1 3.57Å; L802-F822 HydrophobicContact CD2-CE1 3.7Å; L802-P824 HydrophobicContact CD1-CB 4.12Å; L802-P824 HydrophobicContact CD1-CG 4.39Å; L802-P824 HydrophobicContact CD2-CB 3.95Å; L802-P824 HydrophobicContact CD2-CG 4.24Å; L802-L828 HydrophobicContact CD1-CD2 4.21Å; L802-L828 HydrophobicContact CD2-CD2 4.37Å; L802-L832 HydrophobicContact CD1-CD1 3.64Å; L802-L878 HydrophobicContact CB-CD2 4.11Å; L802-L878 HydrophobicContact CD1-CD1 4.32Å; L802-I883 HydrophobicContact CB-CG2 4.18Å
803	M	95.3	Very high	93.2	Very high	28 Å²	28	26.2 Å²	26.2	14%	0.138	17%	0.172	C	C	.	.	H	α-helix	trans	-69.2	-53.3	171.3	-170.2	57.4	48.8	0	0	111.8	C799 D800 L801 F805 S806 K877 L878 Y881 I883	C799-M803 WeakPolarHBondContact O-CB 3.22Å; C799-M803 PolarHBondContact O-N 3.31Å; D800-M803 WeakPolarHBondContact O-CB 3.49Å; D800-M803 PolarHBondContact O-N 3.38Å; L801-M803 VanDerWaalsContact C-N 3.29Å; M803-F805 PolarHBondContact O-N 3.11Å; M803-S806 WeakPolarHBondContact O-CB 3.34Å; M803-S806 PolarHBondContact O-N 3.47Å; M803-S806 PolarHBondContact O-OG 2.92Å; M803-K877 HydrophobicContact CE-CB 3.9Å; M803-L878 HydrophobicContact CE-CD2 3.79Å; M803-Y881 HydrophobicContact CE-CD2 3.76Å; M803-Y881 HydrophobicContact CE-CG 4.32Å; M803-Y881 HydrophobicContact SD-CD2 3.64Å; M803-Y881 HydrophobicContact SD-CE2 4.37Å; M803-Y881 HydrophobicContact SD-CG 3.98Å; M803-I883 HydrophobicContact CE-CD1 3.4Å; M803-I883 HydrophobicContact SD-CD1 3.65Å
804	I	94.5	Very high	92.7	Very high	24 Å²	24	27.3 Å²	27.3	12%	0.123	17%	0.174	C	C	.	.	H	α-helix	trans	-66.1	-40.5	-174.4	-68.4	165.8	0	0	0	111.8	L749 L752 D800 F1260	L749-I804 HydrophobicContact CD1-CD1 4.49Å; L749-I804 HydrophobicContact CD2-CD1 3.7Å; L749-I804 HydrophobicContact CD2-CG2 4.44Å; L752-I804 HydrophobicContact CD2-CG2 3.48Å; L752-I804 VanDerWaalsContact CD2-CG2 3.48Å; D800-I804 WeakPolarHBondContact O-CB 3.38Å; D800-I804 WeakPolarHBondContact O-CD1 3.34Å; D800-I804 VanDerWaalsContact O-CG1 3.24Å; D800-I804 WeakPolarHBondContact O-CG1 3.49Å; D800-I804 PolarHBondContact O-N 3.23Å; I804-F1260 HydrophobicContact CG1-CE2 4.44Å
805	F	95.5	Very high	92.2	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.2	14.6	178.2	-67.8	-87.5	0	0	0	113.7	I748 L752 L768 V772 L801 M803 L809 L820 V821 F822	I748-F805 HydrophobicContact CG2-CE2 3.65Å; I748-F805 HydrophobicContact CG2-CZ 3.71Å; L752-F805 HydrophobicContact CB-CZ 4.36Å; L752-F805 HydrophobicContact CD1-CE1 4.25Å; L752-F805 HydrophobicContact CD2-CE1 4.19Å; L752-F805 HydrophobicContact CD2-CE2 4.35Å; L752-F805 HydrophobicContact CD2-CZ 3.86Å; L752-F805 HydrophobicContact CG-CZ 4.48Å; L768-F805 HydrophobicContact CD2-CE1 4.29Å; L768-F805 HydrophobicContact CD2-CZ 4.45Å; V772-F805 HydrophobicContact CG1-CD1 4.36Å; V772-F805 HydrophobicContact CG1-CD2 4.27Å; V772-F805 HydrophobicContact CG1-CE2 4.49Å; V772-F805 HydrophobicContact CG1-CG 4.2Å; V772-F805 HydrophobicContact CG2-CD1 4.35Å; V772-F805 HydrophobicContact CG2-CE1 3.77Å; V772-F805 HydrophobicContact CG2-CE2 4.01Å; V772-F805 HydrophobicContact CG2-CZ 3.58Å; L801-F805 HydrophobicContact CD2-CD2 4.01Å; L801-F805 HydrophobicContact CD2-CE2 3.75Å; L801-F805 WeakPolarHBondContact O-CB 3.28Å; L801-F805 WeakPolarHBondContact O-CD2 3.44Å; L801-F805 PolarHBondContact O-N 3.16Å; M803-F805 PolarHBondContact O-N 3.11Å; F805-L809 HydrophobicContact CD1-CD2 4.15Å; F805-L820 HydrophobicContact CD1-CB 4.07Å; F805-L820 HydrophobicContact CE1-CB 4.27Å; F805-L820 HydrophobicContact CE1-CD1 4.46Å; F805-V821 CarbonylContact O-C 3.48Å; F805-V821 WeakPolarHBondContact O-CA 3.29Å; F805-F822 HydrophobicContact CB-CB 4.38Å; F805-F822 PolarHBondContact O-N 3.44Å
806	S	94.6	Very high	91.7	Very high	1 Å²	1	37.5 Å²	37.5	1%	0.007	24%	0.237	C	C	.	.	S	Bend	trans	-66.9	179.6	175.2	68.2	0	0	0	0	113.5	L802 M803 Q808 L809 I883	L802-S806 VanDerWaalsContact O-CB 3.27Å; L802-S806 WeakPolarHBondContact O-CB 3.49Å; L802-S806 PolarHBondContact O-N 2.86Å; M803-S806 WeakPolarHBondContact O-CB 3.34Å; M803-S806 PolarHBondContact O-N 3.47Å; M803-S806 PolarHBondContact O-OG 2.92Å; S806-Q808 PolarHBondContact O-N 2.81Å; S806-Q808 VanDerWaalsContact O-N 3.14Å; S806-Q808 VanDerWaalsContact OG-CB 3.26Å; S806-Q808 WeakPolarHBondContact OG-CB 3.42Å; S806-Q808 WeakPolarHBondContact OG-CG 3.42Å; S806-Q808 PolarHBondContact OG-N 3.12Å; S806-L809 VanDerWaalsContact O-CB 3.31Å; S806-L809 WeakPolarHBondContact O-CB 3.2Å; S806-L809 PolarHBondContact O-N 2.76Å; S806-L809 VanDerWaalsContact O-N 3.13Å; S806-I883 VanDerWaalsContact CB-CD1 3.49Å
807	H	92	Very high	91.3	Very high	64 Å²	64	36.4 Å²	36.4	30%	0.296	23%	0.232	S	C	.	.	G	3₁₀ helix	trans	-61.4	-12.4	166.3	72.3	-100.6	0	0	0	113.7	L809 I810 Y881 D882	H807-L809 VanDerWaalsContact C-N 3.29Å; H807-I810 WeakPolarHBondContact O-CG1 3.34Å; H807-Y881 PolarHBondContact CE1-O 3.47Å; H807-D882 PolarHBondContact CE1-O 3.47Å; H807-D882 VanDerWaalsContact CE1-O 3.27Å
808	Q	89.9	Confident	91.1	Very high	47 Å²	47	40.9 Å²	40.9	22%	0.22	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-71.6	-23.8	173.6	-55.8	-65.5	-13.7	0	0	112	S806 I810 T811 F1260	S806-Q808 PolarHBondContact O-N 2.81Å; S806-Q808 VanDerWaalsContact O-N 3.14Å; S806-Q808 VanDerWaalsContact OG-CB 3.26Å; S806-Q808 WeakPolarHBondContact OG-CB 3.42Å; S806-Q808 WeakPolarHBondContact OG-CG 3.42Å; S806-Q808 PolarHBondContact OG-N 3.12Å; Q808-I810 PolarHBondContact O-N 3.39Å; Q808-T811 WeakPolarHBondContact O-CB 3.33Å; Q808-T811 WeakPolarHBondContact O-CG2 3.17Å; Q808-T811 PolarHBondContact O-N 2.87Å; Q808-T811 PolarHBondContact O-OG1 2.85Å; Q808-F1260 HydrophobicContact CB-CE1 3.77Å
809	L	90.3	Very high	90.8	Very high	4 Å²	4	43.2 Å²	43.2	2%	0.021	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-57.2	-33.6	-178.8	-177.7	59.2	0	0	0	113.7	L752 F805 S806 H807 R814 L817 L820	L752-L809 HydrophobicContact CD1-CD1 4.44Å; L752-L809 HydrophobicContact CD2-CD1 4.34Å; F805-L809 HydrophobicContact CD1-CD2 4.15Å; S806-L809 VanDerWaalsContact O-CB 3.31Å; S806-L809 WeakPolarHBondContact O-CB 3.2Å; S806-L809 PolarHBondContact O-N 2.76Å; S806-L809 VanDerWaalsContact O-N 3.13Å; H807-L809 VanDerWaalsContact C-N 3.29Å; L809-R814 WeakPolarHBondContact O-CB 3.26Å; L809-R814 PolarHBondContact O-NE 3.14Å; L809-L817 HydrophobicContact CD1-CD1 3.85Å; L809-L817 HydrophobicContact CD2-CB 4.16Å; L809-L817 HydrophobicContact CG-CB 4.08Å; L809-L817 HydrophobicContact CG-CD1 4.01Å; L809-L820 HydrophobicContact CD2-CB 4.04Å
810	I	89.4	Confident	90.7	Very high	44 Å²	44	43.3 Å²	43.3	23%	0.226	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-84.7	-7.3	-179.5	55	169.2	0	0	0	113.8	H807 Q808 R814 Q818 V821	H807-I810 WeakPolarHBondContact O-CG1 3.34Å; Q808-I810 PolarHBondContact O-N 3.39Å; I810-R814 PolarHBondContact O-N 3.38Å; I810-R814 VanDerWaalsContact O-N 3.16Å; I810-Q818 HydrophobicContact CG2-CB 4.06Å; I810-V821 HydrophobicContact CG2-CG2 4Å
811	T	86.4	Confident	90.6	Very high	58 Å²	58	42 Å²	42	36%	0.356	26%	0.261	S	S	.	.	G	3₁₀ helix	trans	-65.8	163.8	175.9	67.1	0	0	0	0	111.5	Q808 G813 R814	Q808-T811 WeakPolarHBondContact O-CB 3.33Å; Q808-T811 WeakPolarHBondContact O-CG2 3.17Å; Q808-T811 PolarHBondContact O-N 2.87Å; Q808-T811 PolarHBondContact O-OG1 2.85Å; T811-G813 PolarHBondContact O-N 3.12Å; T811-R814 PolarHBondContact O-NE 3.26Å
812	G	82.6	Confident	90.6	Very high	85 Å²	85	44.3 Å²	44.3	88%	0.876	27%	0.272	S	S	*	.	G	3₁₀ helix	trans	72.5	10.4	-174.6	0	0	0	0	0	114.7
813	G	79.9	Confident	90.4	Very high	67 Å²	67	49.7 Å²	49.7	69%	0.691	30%	0.301	S	S	*	.	G	3₁₀ helix	trans	92.5	13.1	-178.9	0	0	0	0	0	114.5	T811 E815	T811-G813 PolarHBondContact O-N 3.12Å; G813-E815 PolarHBondContact O-N 2.85Å
814	R	85.9	Confident	90.4	Very high	58 Å²	58	48.8 Å²	48.8	22%	0.219	30%	0.297	C	S	.	.			trans	-81.6	34.9	-177.2	-66	179.9	-74.5	-162.4	2.9	113.4	L809 I810 T811 G816 L817 M1259	L809-R814 WeakPolarHBondContact O-CB 3.26Å; L809-R814 PolarHBondContact O-NE 3.14Å; I810-R814 PolarHBondContact O-N 3.38Å; I810-R814 VanDerWaalsContact O-N 3.16Å; T811-R814 PolarHBondContact O-NE 3.26Å; R814-G816 PolarHBondContact O-N 3.42Å; R814-L817 HydrophobicContact CB-CD1 3.94Å; R814-L817 HydrophobicContact CB-CG 4.35Å; R814-L817 HydrophobicContact CG-CD1 4.46Å; R814-L817 WeakPolarHBondContact O-CB 3.41Å; R814-L817 PolarHBondContact O-N 3.34Å; R814-M1259 PolarHBondContact NH1-O 3.38Å; R814-M1259 PolarHBondContact NH1-SD 3.16Å; R814-M1259 PolarHBondContact NH2-O 2.97Å
815	E	85.9	Confident	90.4	Very high	158 Å²	158	51.9 Å²	51.9	74%	0.738	31%	0.314	S	S	*	.	G	3₁₀ helix	trans	-54.6	-29.5	-174.4	-66.1	-175.1	-176.8	0	0	114	G813 L817 Q818	G813-E815 PolarHBondContact O-N 2.85Å; E815-L817 PolarHBondContact O-N 3.34Å; E815-L817 VanDerWaalsContact O-N 3.16Å; E815-Q818 WeakPolarHBondContact O-CB 3.42Å; E815-Q818 PolarHBondContact O-N 2.81Å; E815-Q818 VanDerWaalsContact O-N 3.1Å
816	G	86.1	Confident	90.3	Very high	56 Å²	56	54.2 Å²	54.2	58%	0.577	34%	0.337	S	S	*	.	G	3₁₀ helix	trans	-60	-22.2	176.4	0	0	0	0	0	114.5	R814 Q818 P819	R814-G816 PolarHBondContact O-N 3.42Å; G816-Q818 VanDerWaalsContact C-N 3.33Å; G816-P819 VanDerWaalsContact O-CD 3.24Å; G816-P819 WeakPolarHBondContact O-CD 3.35Å
817	L	90.5	Very high	90.4	Very high	11 Å²	11	57.9 Å²	57.9	6%	0.058	36%	0.36	C	S	.	.	G	3₁₀ helix	trans	-84.5	-3.7	178.9	-53.2	180	0	0	0	113.3	I755 T756 L765 L809 R814 E815 P819 L820	I755-L817 HydrophobicContact CG2-CD2 3.82Å; T756-L817 HydrophobicContact CG2-CD1 3.77Å; T756-L817 HydrophobicContact CG2-CD2 4.45Å; L765-L817 HydrophobicContact CD2-CD2 4.35Å; L809-L817 HydrophobicContact CD1-CD1 3.85Å; L809-L817 HydrophobicContact CD2-CB 4.16Å; L809-L817 HydrophobicContact CG-CB 4.08Å; L809-L817 HydrophobicContact CG-CD1 4.01Å; R814-L817 HydrophobicContact CB-CD1 3.94Å; R814-L817 HydrophobicContact CB-CG 4.35Å; R814-L817 HydrophobicContact CG-CD1 4.46Å; R814-L817 WeakPolarHBondContact O-CB 3.41Å; R814-L817 PolarHBondContact O-N 3.34Å; E815-L817 PolarHBondContact O-N 3.34Å; E815-L817 VanDerWaalsContact O-N 3.16Å; L817-P819 WeakPolarHBondContact O-CD 3.38Å; L817-L820 HydrophobicContact CD2-CD1 4.26Å; L817-L820 WeakPolarHBondContact O-CB 3.46Å; L817-L820 PolarHBondContact O-N 3.19Å
818	Q	91.2	Very high	90.5	Very high	103 Å²	103	55 Å²	55	48%	0.481	35%	0.347	S	S	.	.	G	3₁₀ helix	trans	-46.5	-34.2	177.2	-177.9	66.8	94.6	0	0	115.2	I810 E815 G816 L820 V821	I810-Q818 HydrophobicContact CG2-CB 4.06Å; E815-Q818 WeakPolarHBondContact O-CB 3.42Å; E815-Q818 PolarHBondContact O-N 2.81Å; E815-Q818 VanDerWaalsContact O-N 3.1Å; G816-Q818 VanDerWaalsContact C-N 3.33Å; Q818-L820 VanDerWaalsContact C-N 3.26Å; Q818-L820 PolarHBondContact O-N 3.19Å; Q818-V821 PolarHBondContact O-N 2.87Å
819	P	92.3	Very high	90.8	Very high	49 Å²	49	54 Å²	54	32%	0.318	34%	0.342	S	S	.	.	G	3₁₀ helix	trans	-66.4	-20	175.3	-22.6	35.7	0	0	0	115.2	R769 G816 L817	R769-P819 WeakPolarHBondContact CD-O 3.46Å; R769-P819 PolarHBondContact NE-O 2.95Å; R769-P819 PolarHBondContact NH1-O 3.1Å; R769-P819 VanDerWaalsContact NH1-O 3.07Å; G816-P819 VanDerWaalsContact O-CD 3.24Å; G816-P819 WeakPolarHBondContact O-CD 3.35Å; L817-P819 WeakPolarHBondContact O-CD 3.38Å
820	L	93.9	Very high	91.1	Very high	3 Å²	3	58.2 Å²	58.2	2%	0.016	36%	0.364	C	S	.	.	G	3₁₀ helix	trans	-85.1	-20.3	179.8	-60.2	176.8	0	0	0	112.9	L752 I755 L765 L768 R769 F805 L809 L817 Q818 F822	L752-L820 HydrophobicContact CD1-CD1 3.89Å; I755-L820 HydrophobicContact CG2-CD1 4.3Å; L765-L820 HydrophobicContact CD2-CD1 3.87Å; L765-L820 HydrophobicContact CD2-CD2 4.26Å; L765-L820 HydrophobicContact CD2-CG 3.99Å; L765-L820 WeakPolarHBondContact O-CD2 3.06Å; L768-L820 HydrophobicContact CB-CD2 4.06Å; L768-L820 HydrophobicContact CD2-CD1 3.96Å; L768-L820 HydrophobicContact CD2-CD2 4.12Å; L768-L820 HydrophobicContact CG-CD2 4.09Å; R769-L820 HydrophobicContact CB-CD2 4.16Å; F805-L820 HydrophobicContact CD1-CB 4.07Å; F805-L820 HydrophobicContact CE1-CB 4.27Å; F805-L820 HydrophobicContact CE1-CD1 4.46Å; L809-L820 HydrophobicContact CD2-CB 4.04Å; L817-L820 HydrophobicContact CD2-CD1 4.26Å; L817-L820 WeakPolarHBondContact O-CB 3.46Å; L817-L820 PolarHBondContact O-N 3.19Å; Q818-L820 VanDerWaalsContact C-N 3.26Å; Q818-L820 PolarHBondContact O-N 3.19Å; L820-F822 PolarHBondContact O-N 2.86Å
821	V	94.8	Very high	91.4	Very high	21 Å²	21	59.5 Å²	59.5	13%	0.127	37%	0.37	C	S	.	.			trans	-57.5	130.5	-175.3	177.2	0	0	0	0	111.4	F805 I810 Q818	F805-V821 CarbonylContact O-C 3.48Å; F805-V821 WeakPolarHBondContact O-CA 3.29Å; I810-V821 HydrophobicContact CG2-CG2 4Å; Q818-V821 PolarHBondContact O-N 2.87Å
822	F	95.3	Very high	91.9	Very high	50 Å²	50	56.8 Å²	56.8	22%	0.219	35%	0.353	C	S	.	.			trans	-125.5	130.5	179.8	-173.6	-80.5	0	0	0	109.5	L776 L802 F805 L820 L828	L776-F822 HydrophobicContact CD1-CB 4.43Å; L776-F822 HydrophobicContact CD1-CD1 3.79Å; L776-F822 HydrophobicContact CD1-CD2 3.68Å; L776-F822 HydrophobicContact CD1-CE1 3.88Å; L776-F822 HydrophobicContact CD1-CE2 3.76Å; L776-F822 HydrophobicContact CD1-CG 3.7Å; L776-F822 HydrophobicContact CD1-CZ 3.86Å; L802-F822 HydrophobicContact CD2-CD1 3.57Å; L802-F822 HydrophobicContact CD2-CE1 3.7Å; F805-F822 HydrophobicContact CB-CB 4.38Å; F805-F822 PolarHBondContact O-N 3.44Å; L820-F822 PolarHBondContact O-N 2.86Å; F822-L828 HydrophobicContact CE1-CD2 4.42Å
823	N	93.3	Very high	92.6	Very high	113 Å²	113	53.2 Å²	53.2	60%	0.604	31%	0.313	S	S	*	.			trans	-114.3	132.1	173.5	-61.1	-5.2	0	0	0	107.8
824	P	95.4	Very high	93.4	Very high	9 Å²	9	53.9 Å²	53.9	6%	0.058	30%	0.301	C	S	.	.			trans	-69.4	138.2	178.8	29.8	-33.2	0	0	0	110.6	L802 L828 Q829 I883	L802-P824 HydrophobicContact CD1-CB 4.12Å; L802-P824 HydrophobicContact CD1-CG 4.39Å; L802-P824 HydrophobicContact CD2-CB 3.95Å; L802-P824 HydrophobicContact CD2-CG 4.24Å; P824-L828 HydrophobicContact CB-CB 4.36Å; P824-L828 HydrophobicContact CB-CD2 3.89Å; P824-L828 HydrophobicContact CB-CG 4.16Å; P824-Q829 HydrophobicContact CB-CG 3.96Å; P824-Q829 HydrophobicContact CG-CG 3.87Å; P824-Q829 PolarHBondContact O-NE2 3.16Å; P824-Q829 VanDerWaalsContact O-NE2 3.17Å; P824-I883 HydrophobicContact CG-CG2 4.03Å; P824-I883 WeakPolarHBondContact CG-O 3.49Å
825	D	94.1	Very high	93.8	Very high	89 Å²	89	51.6 Å²	51.6	48%	0.476	29%	0.293	S	S	.	.			trans	-77.7	166.5	173.7	81	12.1	0	0	0	111.7	T827 L828 Q829	D825-T827 PolarHBondContact O-N 2.96Å; D825-T827 WeakPolarHBondContact OD1-CA 3.24Å; D825-T827 WeakPolarHBondContact OD1-CB 3.33Å; D825-T827 PolarHBondContact OD1-N 3.26Å; D825-T827 PolarHBondContact OD1-OG1 2.89Å; D825-L828 PolarHBondContact O-N 3.39Å; D825-L828 VanDerWaalsContact O-N 3.15Å; D825-L828 PolarHBondContact OD1-N 3.47Å; D825-Q829 WeakPolarHBondContact O-CG 3.4Å; D825-Q829 PolarHBondContact O-N 3.33Å
826	G	93.6	Very high	94.4	Very high	48 Å²	48	44 Å²	44	50%	0.495	26%	0.258	S	S	.	.	H	α-helix	trans	-63.2	-10.8	-179.6	0	0	0	0	0	114.6	N830	G826-N830 PolarHBondContact O-ND2 2.71Å
827	T	95.1	Very high	94.8	Very high	79 Å²	79	43.5 Å²	43.5	49%	0.485	24%	0.241	S	C	.	.	H	α-helix	trans	-76.8	-56.1	171	-29.1	0	0	0	0	108.8	D825 Q829 N830 E831	D825-T827 PolarHBondContact O-N 2.96Å; D825-T827 WeakPolarHBondContact OD1-CA 3.24Å; D825-T827 WeakPolarHBondContact OD1-CB 3.33Å; D825-T827 PolarHBondContact OD1-N 3.26Å; D825-T827 PolarHBondContact OD1-OG1 2.89Å; T827-Q829 VanDerWaalsContact C-N 3.34Å; T827-Q829 PolarHBondContact O-N 2.87Å; T827-N830 PolarHBondContact O-N 3.4Å; T827-N830 VanDerWaalsContact O-N 3.12Å; T827-E831 WeakPolarHBondContact O-CG 3.39Å; T827-E831 PolarHBondContact O-N 3.39Å
828	L	95.4	Very high	94.9	Very high	3 Å²	3	48.3 Å²	48.3	2%	0.016	27%	0.267	C	S	.	.	H	α-helix	trans	-62	-38.8	-179.4	179.1	57.1	0	0	0	112.3	Q780 L798 L802 F822 P824 D825 N830 E831 L832	Q780-L828 HydrophobicContact CB-CD1 4.33Å; Q780-L828 HydrophobicContact CG-CD1 3.95Å; L798-L828 HydrophobicContact CD1-CD1 4.23Å; L798-L828 HydrophobicContact CD2-CD1 4.31Å; L802-L828 HydrophobicContact CD1-CD2 4.21Å; L802-L828 HydrophobicContact CD2-CD2 4.37Å; F822-L828 HydrophobicContact CE1-CD2 4.42Å; P824-L828 HydrophobicContact CB-CB 4.36Å; P824-L828 HydrophobicContact CB-CD2 3.89Å; P824-L828 HydrophobicContact CB-CG 4.16Å; D825-L828 PolarHBondContact O-N 3.39Å; D825-L828 VanDerWaalsContact O-N 3.15Å; D825-L828 PolarHBondContact OD1-N 3.47Å; L828-N830 VanDerWaalsContact C-N 3.32Å; L828-N830 PolarHBondContact O-N 2.69Å; L828-E831 PolarHBondContact O-N 3Å; L828-L832 HydrophobicContact CD1-CD1 4.13Å; L828-L832 HydrophobicContact CD1-CG 4.06Å; L828-L832 HydrophobicContact CG-CD1 4.15Å; L828-L832 WeakPolarHBondContact O-CB 2.99Å; L828-L832 VanDerWaalsContact O-CG 3.29Å; L828-L832 WeakPolarHBondContact O-CG 3.37Å; L828-L832 PolarHBondContact O-N 3.16Å
829	Q	96.4	Very high	94.9	Very high	27 Å²	27	44.9 Å²	44.9	13%	0.126	25%	0.251	C	S	.	.	H	α-helix	trans	-61.1	-39.1	175.6	-66	-169	35.8	0	0	112.4	P824 D825 T827 L833 V884	P824-Q829 HydrophobicContact CB-CG 3.96Å; P824-Q829 HydrophobicContact CG-CG 3.87Å; P824-Q829 PolarHBondContact O-NE2 3.16Å; P824-Q829 VanDerWaalsContact O-NE2 3.17Å; D825-Q829 WeakPolarHBondContact O-CG 3.4Å; D825-Q829 PolarHBondContact O-N 3.33Å; T827-Q829 VanDerWaalsContact C-N 3.34Å; T827-Q829 PolarHBondContact O-N 2.87Å; Q829-L833 PolarHBondContact O-N 3.3Å; Q829-L833 VanDerWaalsContact O-N 3.14Å; Q829-V884 HydrophobicContact CG-CG2 4.17Å
830	N	95.3	Very high	94.9	Very high	91 Å²	91	42.5 Å²	42.5	49%	0.487	24%	0.236	S	C	.	.	H	α-helix	trans	-75.5	-36.5	177.1	-79.4	-59.9	0	0	0	112.3	G826 T827 L828 L833 N834	G826-N830 PolarHBondContact O-ND2 2.71Å; T827-N830 PolarHBondContact O-N 3.4Å; T827-N830 VanDerWaalsContact O-N 3.12Å; L828-N830 VanDerWaalsContact C-N 3.32Å; L828-N830 PolarHBondContact O-N 2.69Å; N830-L833 PolarHBondContact O-N 3.02Å; N830-N834 WeakPolarHBondContact O-CB 3.5Å; N830-N834 PolarHBondContact O-N 3.04Å; N830-N834 PolarHBondContact O-ND2 3.26Å
831	E	96.6	Very high	94.9	Very high	72 Å²	72	43.1 Å²	43.1	34%	0.336	24%	0.238	S	C	.	.	H	α-helix	trans	-63.4	-41	175.9	-72.8	167.1	173	0	0	111.8	Q780 L783 T827 L828 F835	Q780-E831 VanDerWaalsContact CG-OE2 3.27Å; Q780-E831 WeakPolarHBondContact CG-OE2 3.47Å; Q780-E831 PolarHBondContact NE2-OE2 3.27Å; L783-E831 HydrophobicContact CD1-CB 4.19Å; T827-E831 WeakPolarHBondContact O-CG 3.39Å; T827-E831 PolarHBondContact O-N 3.39Å; L828-E831 PolarHBondContact O-N 3Å; E831-F835 PolarHBondContact O-N 2.83Å
832	L	97.3	Very high	94.5	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-66.1	-40.9	173.1	-67.9	171.4	0	0	0	112.2	L783 F795 L798 L802 L828 F835 V836 F875 L878	L783-L832 HydrophobicContact CD1-CD2 4.14Å; F795-L832 HydrophobicContact CD2-CD2 3.52Å; F795-L832 HydrophobicContact CE2-CB 4.28Å; F795-L832 HydrophobicContact CE2-CD2 3.8Å; F795-L832 HydrophobicContact CG-CD2 4.5Å; L798-L832 HydrophobicContact CB-CD2 4.12Å; L798-L832 HydrophobicContact CD1-CD2 4.12Å; L802-L832 HydrophobicContact CD1-CD1 3.64Å; L828-L832 HydrophobicContact CD1-CD1 4.13Å; L828-L832 HydrophobicContact CD1-CG 4.06Å; L828-L832 HydrophobicContact CG-CD1 4.15Å; L828-L832 WeakPolarHBondContact O-CB 2.99Å; L828-L832 VanDerWaalsContact O-CG 3.29Å; L828-L832 WeakPolarHBondContact O-CG 3.37Å; L828-L832 PolarHBondContact O-N 3.16Å; L832-F835 PolarHBondContact O-N 3.1Å; L832-V836 PolarHBondContact O-N 3.38Å; L832-F875 HydrophobicContact CB-CD2 3.9Å; L832-F875 HydrophobicContact CB-CE2 3.66Å; L832-L878 HydrophobicContact CD1-CD1 4.08Å
833	L	96.4	Very high	93.5	Very high	10 Å²	10	46.3 Å²	46.3	5%	0.052	26%	0.256	C	S	.	.	H	α-helix	trans	-64	-45.4	175.9	-179.8	61.4	0	0	0	111.8	Q829 N830 F835 V836 L837 F875 A888 D891	Q829-L833 PolarHBondContact O-N 3.3Å; Q829-L833 VanDerWaalsContact O-N 3.14Å; N830-L833 PolarHBondContact O-N 3.02Å; L833-F835 VanDerWaalsContact C-N 3.32Å; L833-F835 PolarHBondContact O-N 3.35Å; L833-V836 PolarHBondContact O-N 3.37Å; L833-V836 VanDerWaalsContact O-N 3.15Å; L833-L837 HydrophobicContact CG-CD1 4.39Å; L833-L837 WeakPolarHBondContact O-CG 3.35Å; L833-L837 PolarHBondContact O-N 2.9Å; L833-F875 HydrophobicContact CB-CE2 4.42Å; L833-F875 HydrophobicContact CB-CZ 3.85Å; L833-F875 HydrophobicContact CD1-CE1 3.8Å; L833-F875 HydrophobicContact CD1-CZ 3.94Å; L833-F875 HydrophobicContact CG-CZ 4.48Å; L833-A888 HydrophobicContact CD2-CB 4.25Å; L833-D891 HydrophobicContact CD1-CB 4.38Å
834	N	95.9	Very high	92	Very high	82 Å²	82	45.2 Å²	45.2	44%	0.439	25%	0.248	S	C	.	.	H	α-helix	trans	-60.6	-42.4	177.6	-69.1	-19.4	0	0	0	111.2	N830 V836 L837 D838	N830-N834 WeakPolarHBondContact O-CB 3.5Å; N830-N834 PolarHBondContact O-N 3.04Å; N830-N834 PolarHBondContact O-ND2 3.26Å; N834-V836 VanDerWaalsContact C-N 3.31Å; N834-V836 PolarHBondContact O-N 3.05Å; N834-L837 PolarHBondContact O-N 2.89Å; N834-L837 VanDerWaalsContact O-N 3.13Å; N834-D838 WeakPolarHBondContact O-CB 3.39Å; N834-D838 PolarHBondContact O-N 3.36Å
835	F	96.1	Very high	90.1	Very high	9 Å²	9	50.6 Å²	50.6	4%	0.039	28%	0.276	C	S	.	.	H	α-helix	trans	-57.4	-43	174.4	177.6	-83.5	0	0	0	112.2	K791 E792 F795 E831 L832 L833 D838 H839 L871	K791-F835 HydrophobicContact CB-CD2 4.36Å; K791-F835 HydrophobicContact CB-CE2 3.76Å; K791-F835 HydrophobicContact CD-CE2 4.34Å; E792-F835 HydrophobicContact CB-CZ 4.49Å; E792-F835 HydrophobicContact CG-CZ 3.94Å; F795-F835 HydrophobicContact CB-CD1 4.08Å; F795-F835 HydrophobicContact CB-CD2 4.49Å; F795-F835 HydrophobicContact CB-CE1 3.91Å; F795-F835 HydrophobicContact CB-CE2 4.35Å; F795-F835 HydrophobicContact CB-CG 4.37Å; F795-F835 HydrophobicContact CB-CZ 4.06Å; F795-F835 AromaticContact CD1-CD1 3.87Å; F795-F835 HydrophobicContact CD1-CD1 3.87Å; F795-F835 AromaticContact CD1-CE1 3.59Å; F795-F835 HydrophobicContact CD1-CE1 3.59Å; F795-F835 HydrophobicContact CD1-CZ 4.41Å; F795-F835 HydrophobicContact CD2-CB 3.95Å; F795-F835 AromaticContact CD2-CD1 3.14Å; F795-F835 HydrophobicContact CD2-CD1 3.14Å; F795-F835 HydrophobicContact CD2-CD2 4.46Å; F795-F835 AromaticContact CD2-CE1 3.74Å; F795-F835 HydrophobicContact CD2-CE1 3.74Å; F795-F835 AromaticContact CD2-CG 3.59Å; F795-F835 HydrophobicContact CD2-CG 3.59Å; F795-F835 HydrophobicContact CE1-CD1 4.04Å; F795-F835 AromaticContact CE1-CE1 3.96Å; F795-F835 HydrophobicContact CE1-CE1 3.96Å; F795-F835 HydrophobicContact CE2-CB 4.17Å; F795-F835 AromaticContact CE2-CD1 3.36Å; F795-F835 HydrophobicContact CE2-CD1 3.36Å; F795-F835 HydrophobicContact CE2-CE1 4.1Å; F795-F835 HydrophobicContact CE2-CG 4.05Å; F795-F835 AromaticContact CG-CD1 3.41Å; F795-F835 HydrophobicContact CG-CD1 3.41Å; F795-F835 VanDerWaalsContact CG-CD1 3.41Å; F795-F835 AromaticContact CG-CE1 3.45Å; F795-F835 HydrophobicContact CG-CE1 3.45Å; F795-F835 VanDerWaalsContact CG-CE1 3.45Å; F795-F835 HydrophobicContact CG-CG 4.05Å; F795-F835 HydrophobicContact CG-CZ 4.11Å; F795-F835 AromaticContact CZ-CD1 3.79Å; F795-F835 HydrophobicContact CZ-CD1 3.79Å; F795-F835 HydrophobicContact CZ-CE1 4.18Å; E831-F835 PolarHBondContact O-N 2.83Å; L832-F835 PolarHBondContact O-N 3.1Å; L833-F835 VanDerWaalsContact C-N 3.32Å; L833-F835 PolarHBondContact O-N 3.35Å; F835-D838 PolarHBondContact O-N 2.81Å; F835-H839 AromaticContact CD2-CD2 3.42Å; F835-H839 VanDerWaalsContact CD2-CD2 3.42Å; F835-H839 WeakPolarHBondContact CD2-CD2 3.42Å; F835-H839 AromaticContact CD2-NE2 3.93Å; F835-H839 HydrophobicContact CE1-CB 4.07Å; F835-H839 HydrophobicContact CE2-CB 4.27Å; F835-H839 AromaticContact CE2-CD2 3.33Å; F835-H839 WeakPolarHBondContact CE2-CD2 3.37Å; F835-H839 AromaticContact CE2-CG 3.73Å; F835-H839 AromaticContact CE2-NE2 3.71Å; F835-H839 HydrophobicContact CZ-CB 3.94Å; F835-H839 AromaticContact CZ-CD2 3.92Å; F835-H839 AromaticContact CZ-CG 3.87Å; F835-H839 WeakPolarHBondContact O-CB 3.37Å; F835-H839 PolarHBondContact O-N 3.49Å; F835-L871 HydrophobicContact CE1-CD1 4.14Å; F835-L871 HydrophobicContact CE1-CD2 4.09Å; F835-L871 HydrophobicContact CZ-CD1 4.35Å; F835-L871 HydrophobicContact CZ-CD2 4.44Å
836	V	96.7	Very high	88.1	Confident	0 Å²	0	51 Å²	51	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-63	-42.2	175.9	173.3	0	0	0	0	111.2	F795 L832 L833 N834 V840 F841 L872 F875	F795-V836 HydrophobicContact CE2-CG2 3.91Å; F795-V836 HydrophobicContact CZ-CG2 3.57Å; L832-V836 PolarHBondContact O-N 3.38Å; L833-V836 PolarHBondContact O-N 3.37Å; L833-V836 VanDerWaalsContact O-N 3.15Å; N834-V836 VanDerWaalsContact C-N 3.31Å; N834-V836 PolarHBondContact O-N 3.05Å; V836-V840 HydrophobicContact CG1-CB 4.25Å; V836-V840 HydrophobicContact CG1-CG2 4.1Å; V836-V840 WeakPolarHBondContact O-CB 3.36Å; V836-V840 PolarHBondContact O-N 3.5Å; V836-F841 HydrophobicContact CG1-CD2 4.31Å; V836-F841 HydrophobicContact CG1-CE2 3.83Å; V836-L872 HydrophobicContact CG1-CD1 3.77Å; V836-F875 HydrophobicContact CG2-CB 3.74Å; V836-F875 HydrophobicContact CG2-CD1 4.21Å; V836-F875 HydrophobicContact CG2-CD2 4.33Å; V836-F875 HydrophobicContact CG2-CG 3.86Å
837	L	94.3	Very high	86.1	Confident	45 Å²	45	51.2 Å²	51.2	24%	0.236	27%	0.266	C	S	.	.	H	α-helix	trans	-62.7	-46.6	177.1	-65.8	174.2	0	0	0	111.9	L833 N834 F841 D891	L833-L837 HydrophobicContact CG-CD1 4.39Å; L833-L837 WeakPolarHBondContact O-CG 3.35Å; L833-L837 PolarHBondContact O-N 2.9Å; N834-L837 PolarHBondContact O-N 2.89Å; N834-L837 VanDerWaalsContact O-N 3.13Å; L837-F841 HydrophobicContact CD2-CD2 4.08Å; L837-D891 HydrophobicContact CD1-CB 4.48Å; L837-D891 HydrophobicContact CD2-CB 4.3Å
838	D	92.8	Very high	83.8	Confident	112 Å²	112	51.6 Å²	51.6	60%	0.599	27%	0.265	S	S	*	.	H	α-helix	trans	-71.5	-35.3	-177.2	-68.1	-15.7	0	0	0	113.5	N834 F835	N834-D838 WeakPolarHBondContact O-CB 3.39Å; N834-D838 PolarHBondContact O-N 3.36Å; F835-D838 PolarHBondContact O-N 2.81Å
839	H	91.4	Very high	81.5	Confident	30 Å²	30	58.4 Å²	58.4	14%	0.139	30%	0.297	C	S	.	.	H	α-helix	trans	-109.7	-13.5	-170.1	-70.6	-88.7	0	0	0	115.3	K791 F835 R868	K791-H839 PolarHBondContact NZ-NE2 3.18Å; F835-H839 AromaticContact CD2-CD2 3.42Å; F835-H839 VanDerWaalsContact CD2-CD2 3.42Å; F835-H839 WeakPolarHBondContact CD2-CD2 3.42Å; F835-H839 AromaticContact CD2-NE2 3.93Å; F835-H839 HydrophobicContact CE1-CB 4.07Å; F835-H839 HydrophobicContact CE2-CB 4.27Å; F835-H839 AromaticContact CE2-CD2 3.33Å; F835-H839 WeakPolarHBondContact CE2-CD2 3.37Å; F835-H839 AromaticContact CE2-CG 3.73Å; F835-H839 AromaticContact CE2-NE2 3.71Å; F835-H839 HydrophobicContact CZ-CB 3.94Å; F835-H839 AromaticContact CZ-CD2 3.92Å; F835-H839 AromaticContact CZ-CG 3.87Å; F835-H839 WeakPolarHBondContact O-CB 3.37Å; F835-H839 PolarHBondContact O-N 3.49Å; H839-R868 WeakPolarHBondContact O-CD 3.35Å
840	V	93.6	Very high	79.2	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-106.1	-46.9	178.3	179.6	0	0	0	0	112.3	V836 I842 L871 L872 Y903	V836-V840 HydrophobicContact CG1-CB 4.25Å; V836-V840 HydrophobicContact CG1-CG2 4.1Å; V836-V840 WeakPolarHBondContact O-CB 3.36Å; V836-V840 PolarHBondContact O-N 3.5Å; V840-I842 VanDerWaalsContact C-N 3.33Å; V840-I842 PolarHBondContact O-N 3.5Å; V840-L871 HydrophobicContact CG2-CB 4.06Å; V840-L872 HydrophobicContact CG1-CB 4.03Å; V840-L872 HydrophobicContact CG1-CD1 4.46Å; V840-L872 HydrophobicContact CG1-CD2 4.3Å; V840-L872 HydrophobicContact CG1-CG 4.49Å; V840-L872 HydrophobicContact CG2-CB 4.42Å; V840-Y903 HydrophobicContact CG1-CD1 4.43Å; V840-Y903 HydrophobicContact CG1-CD2 4.11Å; V840-Y903 HydrophobicContact CG1-CE1 3.91Å; V840-Y903 HydrophobicContact CG1-CE2 3.53Å; V840-Y903 VanDerWaalsContact CG1-CZ 3.41Å; V840-Y903 WeakPolarHBondContact O-CE2 3.36Å; V840-Y903 PolarHBondContact O-OH 3.25Å
841	F	92.8	Very high	76.9	Confident	16 Å²	16	62.9 Å²	62.9	7%	0.07	33%	0.326	C	S	.	.	S	Bend	trans	-95	49.6	-170.1	-61.5	-65.9	0	0	0	113.4	V836 L837 L872 I892 H895 Y899 Y903 I907	V836-F841 HydrophobicContact CG1-CD2 4.31Å; V836-F841 HydrophobicContact CG1-CE2 3.83Å; L837-F841 HydrophobicContact CD2-CD2 4.08Å; F841-L872 HydrophobicContact CE2-CD1 4.18Å; F841-L872 HydrophobicContact CZ-CD1 3.86Å; F841-L872 HydrophobicContact CZ-CD2 4.25Å; F841-I892 HydrophobicContact CE2-CG1 4.24Å; F841-I892 HydrophobicContact CZ-CG2 4.34Å; F841-H895 HydrophobicContact CD1-CB 3.74Å; F841-H895 AromaticContact CD1-CD2 3.89Å; F841-H895 AromaticContact CD1-CG 3.77Å; F841-H895 AromaticContact CD2-CD2 3.57Å; F841-H895 HydrophobicContact CE1-CB 3.51Å; F841-H895 AromaticContact CE1-CG 3.97Å; F841-H895 AromaticContact CE2-CD2 3.77Å; F841-H895 HydrophobicContact CG-CB 4.38Å; F841-H895 AromaticContact CG-CD2 3.63Å; F841-H895 AromaticContact CG-CG 3.94Å; F841-H895 HydrophobicContact CZ-CB 3.99Å; F841-Y899 HydrophobicContact CB-CE2 3.98Å; F841-Y899 AromaticContact CD1-CD2 3.58Å; F841-Y899 HydrophobicContact CD1-CD2 3.58Å; F841-Y899 AromaticContact CD1-CE2 3.79Å; F841-Y899 HydrophobicContact CD1-CE2 3.79Å; F841-Y899 HydrophobicContact CD1-CG 4.11Å; F841-Y899 HydrophobicContact CE1-CD2 4.24Å; F841-Y899 HydrophobicContact CG-CE2 4.34Å; F841-Y899 PolarHBondContact O-OH 2.83Å; F841-Y903 AromaticContact CD1-CD2 3.89Å; F841-Y903 HydrophobicContact CD1-CD2 3.89Å; F841-Y903 AromaticContact CD1-CE2 3.95Å; F841-Y903 HydrophobicContact CD1-CE2 3.95Å; F841-Y903 AromaticContact CE1-CD2 3.61Å; F841-Y903 HydrophobicContact CE1-CD2 3.61Å; F841-Y903 HydrophobicContact CE1-CE2 4.1Å; F841-Y903 HydrophobicContact CE1-CG 4.48Å; F841-I907 HydrophobicContact CE1-CD1 4.26Å; F841-I907 HydrophobicContact CZ-CD1 4.4Å
842	I	87.2	Confident	74.3	Confident	62 Å²	62	68.7 Å²	68.7	32%	0.318	35%	0.353	S	S	.	.			trans	-73.1	149.6	178.2	-55.2	170.1	0	0	0	110.2	V840 Y899	V840-I842 VanDerWaalsContact C-N 3.33Å; V840-I842 PolarHBondContact O-N 3.5Å; I842-Y899 VanDerWaalsContact C-OH 3.31Å; I842-Y899 WeakPolarHBondContact O-CE1 3.5Å; I842-Y899 VanDerWaalsContact O-CZ 3.29Å; I842-Y899 PolarHBondContact O-OH 2.98Å
843	D	74.9	Confident	71.7	Confident	76 Å²	76	71.4 Å²	71.4	41%	0.406	38%	0.381	S	S	.	.			trans	-81.5	139.8	179	-100.9	-55.5	0	0	0	113.6	D845 D846 K898	D843-D845 PolarHBondContact O-N 3.11Å; D843-D846 PolarHBondContact O-N 2.67Å; D843-D846 VanDerWaalsContact O-N 3.11Å; D843-K898 WeakPolarHBondContact OD1-CE 3.34Å; D843-K898 IonicContact OD1-NZ 3.22Å; D843-K898 PolarHBondContact OD1-NZ 3.01Å; D843-K898 IonicContact OD2-NZ 3.62Å; D843-K898 PolarHBondContact OD2-NZ 3.42Å
844	Q	61.8	Low	69.3	Low	90 Å²	90	77.3 Å²	77.3	42%	0.421	41%	0.413	S	S	.	.	H	α-helix	trans	-68.5	-22.3	-171	-68.9	179.4	-10.9	0	0	113.2	N848 D902	Q844-N848 PolarHBondContact O-ND2 3.32Å; Q844-D902 PolarHBondContact NE2-OD2 3.11Å
845	D	55	Low	67.1	Low	122 Å²	122	82.8 Å²	82.8	65%	0.652	44%	0.436	S	S	*	.	H	α-helix	trans	-78.8	-20.3	175.7	-66.5	-39.4	0	0	0	112.8	D843 Q849	D843-D845 PolarHBondContact O-N 3.11Å; D845-Q849 WeakPolarHBondContact O-CG 3.43Å; D845-Q849 PolarHBondContact O-NE2 2.97Å
846	D	52.2	Low	64.8	Low	96 Å²	96	89.8 Å²	89.8	51%	0.513	47%	0.468	S	S	.	.	H	α-helix	trans	-80.9	-33.5	174.6	-68.3	-36.4	0	0	0	111.5	D843 N848 Q849	D843-D846 PolarHBondContact O-N 2.67Å; D843-D846 VanDerWaalsContact O-N 3.11Å; D846-N848 VanDerWaalsContact C-N 3.34Å; D846-N848 PolarHBondContact O-N 2.79Å; D846-Q849 PolarHBondContact O-N 2.92Å; D846-Q849 PolarHBondContact OD1-NE2 3.01Å
847	E	50.4	Low	63	Low	53 Å²	53	91.5 Å²	91.5	25%	0.248	48%	0.478	C	S	.	.	H	α-helix	trans	-57.4	-48	171.2	-64	-174	164.2	0	0	111	Q849 S850 R868	E847-Q849 VanDerWaalsContact C-N 3.27Å; E847-Q849 PolarHBondContact O-N 2.91Å; E847-S850 PolarHBondContact O-N 3.4Å; E847-S850 VanDerWaalsContact O-N 3.15Å; E847-S850 PolarHBondContact O-OG 2.9Å; E847-R868 IonicContact OE1-CZ 3.24Å; E847-R868 IonicContact OE1-NH1 2.77Å; E847-R868 PolarHBondContact OE1-NH1 2.91Å; E847-R868 IonicContact OE1-NH2 2.83Å; E847-R868 PolarHBondContact OE1-NH2 2.61Å
848	N	47.4	Very low	61.7	Low	87 Å²	87	93.1 Å²	93.1	47%	0.465	48%	0.484	S	S	.	.	H	α-helix	trans	-66	-23.9	-178.1	-68.7	-42.3	0	0	0	114	Q844 D846 S850	Q844-N848 PolarHBondContact O-ND2 3.32Å; D846-N848 VanDerWaalsContact C-N 3.34Å; D846-N848 PolarHBondContact O-N 2.79Å; N848-S850 VanDerWaalsContact C-N 3.34Å
849	Q	47	Very low	60.6	Low	146 Å²	146	91.2 Å²	91.2	68%	0.682	48%	0.484	S	S	*	.	H	α-helix	trans	-80.7	-13.8	176.7	-75.7	170.4	88	0	0	113.3	D845 D846 E847	D845-Q849 WeakPolarHBondContact O-CG 3.43Å; D845-Q849 PolarHBondContact O-NE2 2.97Å; D846-Q849 PolarHBondContact O-N 2.92Å; D846-Q849 PolarHBondContact OD1-NE2 3.01Å; E847-Q849 VanDerWaalsContact C-N 3.27Å; E847-Q849 PolarHBondContact O-N 2.91Å
850	S	47.5	Very low	59.8	Low	89 Å²	89	94.4 Å²	94.4	62%	0.622	50%	0.502	S	S	*	.	H	α-helix	trans	-90.3	-25.6	-176.8	70.8	0	0	0	0	114.2	E847 N848	E847-S850 PolarHBondContact O-N 3.4Å; E847-S850 VanDerWaalsContact O-N 3.15Å; E847-S850 PolarHBondContact O-OG 2.9Å; N848-S850 VanDerWaalsContact C-N 3.34Å
851	M	48.6	Very low	59.1	Low	123 Å²	123	97.4 Å²	97.4	61%	0.606	52%	0.515	S	S	*	.			trans	-140.3	89.6	-177.5	-65.4	-63.4	-160.6	0	0	110.3	G853	M851-G853 PolarHBondContact O-N 3.45Å
852	E	40.9	Very low	58.3	Low	195 Å²	195	99.6 Å²	99.6	91%	0.911	53%	0.527	S	S	*	.			trans	-91.6	83	168.9	-79.1	-159.2	136.8	0	0	111.2
853	G	43	Very low	57.8	Low	57 Å²	57	102.9 Å²	102.9	59%	0.588	54%	0.541	S	S	*	.			trans	108.8	101.7	148.2	0	0	0	0	0	118.5	M851	M851-G853 PolarHBondContact O-N 3.45Å
854	D	46	Very low	58.3	Low	134 Å²	134	101.3 Å²	101.3	72%	0.717	54%	0.539	S	S	*	.				-167.2	172.4	123.6	-99.2	-29.1	0	0	0	109	E856 D857	D854-E856 PolarHBondContact O-N 3.07Å; D854-D857 WeakPolarHBondContact O-CB 3.46Å; D854-D857 PolarHBondContact O-N 3.02Å
855	E	48.6	Very low	59.4	Low	196 Å²	196	98.2 Å²	98.2	92%	0.916	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-11.6	-175.6	-67.5	-166.4	140.8	0	0	114.2	D857	E855-D857 PolarHBondContact O-N 3.35Å
856	E	48.2	Very low	60.8	Low	156 Å²	156	96 Å²	96	73%	0.729	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-17	171.1	-62.2	-176.8	160.9	0	0	113.3	D854 E858 N860	D854-E856 PolarHBondContact O-N 3.07Å; E856-E858 VanDerWaalsContact C-N 3.34Å; E856-E858 PolarHBondContact O-N 2.92Å; E856-N860 PolarHBondContact O-ND2 3.27Å
857	D	58.9	Low	62.5	Low	37 Å²	37	96.1 Å²	96.1	20%	0.198	51%	0.506	C	S	.	.	H	α-helix	trans	-58.5	-37.4	-178.9	-122.2	-22.6	0	0	0	114	D854 E855 A859 N860 K861	D854-D857 WeakPolarHBondContact O-CB 3.46Å; D854-D857 PolarHBondContact O-N 3.02Å; E855-D857 PolarHBondContact O-N 3.35Å; D857-A859 PolarHBondContact O-N 2.68Å; D857-N860 PolarHBondContact O-N 3.11Å; D857-K861 HydrophobicContact CB-CD 4.15Å; D857-K861 VanDerWaalsContact CG-CE 3.42Å; D857-K861 VanDerWaalsContact O-CB 3.24Å; D857-K861 WeakPolarHBondContact O-CB 3.44Å; D857-K861 WeakPolarHBondContact O-CD 3.5Å; D857-K861 WeakPolarHBondContact O-CG 3.49Å; D857-K861 PolarHBondContact O-N 3.48Å; D857-K861 WeakPolarHBondContact OD1-CE 3.27Å; D857-K861 IonicContact OD1-NZ 3.52Å; D857-K861 PolarHBondContact OD1-NZ 3.26Å; D857-K861 VanDerWaalsContact OD1-NZ 3.12Å; D857-K861 IonicContact OD2-NZ 2.96Å; D857-K861 PolarHBondContact OD2-NZ 2.82Å
858	E	67.8	Low	64.5	Low	78 Å²	78	95 Å²	95	36%	0.364	50%	0.5	S	S	.	.	H	α-helix	trans	-69.9	-35.8	-168	-91	-84.2	146.1	0	0	113.1	E856 I862 R1235	E856-E858 VanDerWaalsContact C-N 3.34Å; E856-E858 PolarHBondContact O-N 2.92Å; E858-I862 WeakPolarHBondContact O-CD1 3.47Å; E858-I862 VanDerWaalsContact O-CG1 3.26Å; E858-I862 WeakPolarHBondContact O-CG1 3.49Å; E858-I862 PolarHBondContact O-N 3.26Å; E858-I862 VanDerWaalsContact O-N 3.14Å; E858-R1235 IonicContact OE1-CZ 2.82Å; E858-R1235 IonicContact OE1-NH2 3.59Å; E858-R1235 PolarHBondContact OE1-NH2 2.85Å; E858-R1235 IonicContact OE2-CZ 3.2Å; E858-R1235 IonicContact OE2-NE 3.71Å; E858-R1235 IonicContact OE2-NH2 2.66Å; E858-R1235 PolarHBondContact OE2-NH2 3.29Å
859	A	69.8	Low	66.7	Low	72 Å²	72	91.1 Å²	91.1	60%	0.595	48%	0.479	S	S	*	.	H	α-helix	trans	-68.5	-50.2	175.3	0	0	0	0	0	110.7	D857 K861 I862 E863	D857-A859 PolarHBondContact O-N 2.68Å; A859-K861 VanDerWaalsContact C-N 3.31Å; A859-K861 PolarHBondContact O-N 3.15Å; A859-I862 WeakPolarHBondContact O-CA 3.44Å; A859-I862 WeakPolarHBondContact O-CB 3.39Å; A859-I862 PolarHBondContact O-N 2.87Å; A859-E863 PolarHBondContact O-N 3.21Å
860	N	74.3	Confident	68.8	Low	98 Å²	98	86 Å²	86	52%	0.524	46%	0.456	S	S	.	.	H	α-helix	trans	-58.2	-40.8	177.3	-70.3	-67.2	0	0	0	112.3	E856 D857 I862 E863 A864	E856-N860 PolarHBondContact O-ND2 3.27Å; D857-N860 PolarHBondContact O-N 3.11Å; N860-I862 VanDerWaalsContact C-N 3.34Å; N860-I862 PolarHBondContact O-N 3.32Å; N860-E863 PolarHBondContact O-N 3.13Å; N860-A864 WeakPolarHBondContact O-CB 3.47Å; N860-A864 PolarHBondContact O-N 3.01Å
861	K	78.6	Confident	71.1	Confident	63 Å²	63	82.1 Å²	82.1	27%	0.274	43%	0.428	S	S	.	.	H	α-helix	trans	-67.4	-31	175.4	-75.7	167.9	175	170.9	0	112.7	D857 A859 L865	D857-K861 HydrophobicContact CB-CD 4.15Å; D857-K861 VanDerWaalsContact CG-CE 3.42Å; D857-K861 VanDerWaalsContact O-CB 3.24Å; D857-K861 WeakPolarHBondContact O-CB 3.44Å; D857-K861 WeakPolarHBondContact O-CD 3.5Å; D857-K861 WeakPolarHBondContact O-CG 3.49Å; D857-K861 PolarHBondContact O-N 3.48Å; D857-K861 WeakPolarHBondContact OD1-CE 3.27Å; D857-K861 IonicContact OD1-NZ 3.52Å; D857-K861 PolarHBondContact OD1-NZ 3.26Å; D857-K861 VanDerWaalsContact OD1-NZ 3.12Å; D857-K861 IonicContact OD2-NZ 2.96Å; D857-K861 PolarHBondContact OD2-NZ 2.82Å; A859-K861 VanDerWaalsContact C-N 3.31Å; A859-K861 PolarHBondContact O-N 3.15Å; K861-L865 VanDerWaalsContact O-CB 3.28Å; K861-L865 WeakPolarHBondContact O-CB 3.34Å; K861-L865 PolarHBondContact O-N 2.98Å; K861-L865 VanDerWaalsContact O-N 3.17Å
862	I	75.5	Confident	73.4	Confident	62 Å²	62	76.2 Å²	76.2	32%	0.318	40%	0.399	S	S	.	.	H	α-helix	trans	-71.5	-43.9	172.3	-72.2	166.7	0	0	0	111	E858 A859 N860 L865 H866	E858-I862 WeakPolarHBondContact O-CD1 3.47Å; E858-I862 VanDerWaalsContact O-CG1 3.26Å; E858-I862 WeakPolarHBondContact O-CG1 3.49Å; E858-I862 PolarHBondContact O-N 3.26Å; E858-I862 VanDerWaalsContact O-N 3.14Å; A859-I862 WeakPolarHBondContact O-CA 3.44Å; A859-I862 WeakPolarHBondContact O-CB 3.39Å; A859-I862 PolarHBondContact O-N 2.87Å; N860-I862 VanDerWaalsContact C-N 3.34Å; N860-I862 PolarHBondContact O-N 3.32Å; I862-L865 PolarHBondContact O-N 3.42Å; I862-H866 PolarHBondContact O-CD2 2.7Å; I862-H866 PolarHBondContact O-N 2.88Å
863	E	77.2	Confident	76.1	Confident	131 Å²	131	67 Å²	67	61%	0.612	36%	0.356	S	S	*	.	H	α-helix	trans	-62.4	-50	177.5	-165.4	-159.6	137.5	0	0	111.5	A859 N860 L865 H866 K867	A859-E863 PolarHBondContact O-N 3.21Å; N860-E863 PolarHBondContact O-N 3.13Å; E863-L865 PolarHBondContact O-N 3.1Å; E863-H866 WeakPolarHBondContact O-CB 3.47Å; E863-H866 PolarHBondContact O-N 3.3Å; E863-K867 PolarHBondContact O-N 3.02Å
864	A	84.5	Confident	78.5	Confident	43 Å²	43	64.3 Å²	64.3	36%	0.355	33%	0.329	S	S	.	.	H	α-helix	trans	-60.9	-28.9	176.7	0	0	0	0	0	113	N860 R868	N860-A864 WeakPolarHBondContact O-CB 3.47Å; N860-A864 PolarHBondContact O-N 3.01Å; A864-R868 WeakPolarHBondContact O-CG 3.37Å; A864-R868 PolarHBondContact O-N 3.17Å; A864-R868 PolarHBondContact O-NE 3.47Å
865	L	85.1	Confident	81	Confident	25 Å²	25	58 Å²	58	13%	0.131	29%	0.294	C	S	.	.	H	α-helix	trans	-73.9	-43.2	170.4	174.6	58.9	0	0	0	112	K861 I862 E863 K867 R868 R869 D902 Y903	K861-L865 VanDerWaalsContact O-CB 3.28Å; K861-L865 WeakPolarHBondContact O-CB 3.34Å; K861-L865 PolarHBondContact O-N 2.98Å; K861-L865 VanDerWaalsContact O-N 3.17Å; I862-L865 PolarHBondContact O-N 3.42Å; E863-L865 PolarHBondContact O-N 3.1Å; L865-K867 VanDerWaalsContact C-N 3.34Å; L865-K867 PolarHBondContact O-N 3.45Å; L865-R868 PolarHBondContact O-N 3.49Å; L865-R869 HydrophobicContact CD1-CG 4.12Å; L865-R869 HydrophobicContact CG-CG 4.46Å; L865-R869 WeakPolarHBondContact O-CB 3.36Å; L865-R869 VanDerWaalsContact O-CG 3.31Å; L865-R869 WeakPolarHBondContact O-CG 3.35Å; L865-R869 PolarHBondContact O-N 3.49Å; L865-D902 HydrophobicContact CD1-CB 3.75Å; L865-Y903 HydrophobicContact CD1-CE1 3.8Å
866	H	84.5	Confident	83.4	Confident	76 Å²	76	48.6 Å²	48.6	35%	0.352	25%	0.251	S	S	.	.	H	α-helix	trans	-60	-43.4	175.8	-90.5	-121.9	0	0	0	111.8	I862 E863 R869 N870	I862-H866 PolarHBondContact O-CD2 2.7Å; I862-H866 PolarHBondContact O-N 2.88Å; E863-H866 WeakPolarHBondContact O-CB 3.47Å; E863-H866 PolarHBondContact O-N 3.3Å; H866-R869 WeakPolarHBondContact O-CB 3.42Å; H866-R869 PolarHBondContact O-N 3.35Å; H866-N870 PolarHBondContact O-N 3.11Å
867	K	88	Confident	85.6	Confident	97 Å²	97	43.1 Å²	43.1	42%	0.422	22%	0.224	S	C	.	.	H	α-helix	trans	-56.9	-51	174.5	-165.6	-176	-173.4	-160.9	0	111.8	E792 E863 L865 R869 N870 L871	E792-K867 WeakPolarHBondContact OE1-CE 3.35Å; E792-K867 IonicContact OE1-NZ 2.82Å; E792-K867 PolarHBondContact OE1-NZ 2.86Å; E792-K867 WeakPolarHBondContact OE2-CE 3.39Å; E792-K867 IonicContact OE2-NZ 2.94Å; E792-K867 PolarHBondContact OE2-NZ 2.87Å; E863-K867 PolarHBondContact O-N 3.02Å; L865-K867 VanDerWaalsContact C-N 3.34Å; L865-K867 PolarHBondContact O-N 3.45Å; K867-R869 PolarHBondContact O-N 3.04Å; K867-N870 PolarHBondContact O-N 3.38Å; K867-N870 VanDerWaalsContact O-N 3.16Å; K867-L871 WeakPolarHBondContact O-CG 3.28Å; K867-L871 PolarHBondContact O-N 2.84Å
868	R	92.4	Very high	87.4	Confident	31 Å²	31	41.4 Å²	41.4	12%	0.117	22%	0.215	C	C	.	.	H	α-helix	trans	-65.8	-34.4	177.5	-71.9	179.6	-69.1	171.6	-4.9	113.5	H839 E847 A864 L865 N870 L871 L872 Y903	H839-R868 WeakPolarHBondContact O-CD 3.35Å; E847-R868 IonicContact OE1-CZ 3.24Å; E847-R868 IonicContact OE1-NH1 2.77Å; E847-R868 PolarHBondContact OE1-NH1 2.91Å; E847-R868 IonicContact OE1-NH2 2.83Å; E847-R868 PolarHBondContact OE1-NH2 2.61Å; A864-R868 WeakPolarHBondContact O-CG 3.37Å; A864-R868 PolarHBondContact O-N 3.17Å; A864-R868 PolarHBondContact O-NE 3.47Å; L865-R868 PolarHBondContact O-N 3.49Å; R868-N870 VanDerWaalsContact C-N 3.34Å; R868-L871 PolarHBondContact O-N 2.9Å; R868-L872 PolarHBondContact O-N 3.07Å; R868-Y903 HydrophobicContact CB-CE1 4.2Å; R868-Y903 WeakPolarHBondContact CB-OH 3.37Å
869	R	94	Very high	88.8	Confident	5 Å²	5	37.8 Å²	37.8	2%	0.019	20%	0.199	C	C	.	.	H	α-helix	trans	-60.6	-41.5	170.8	-78	172.6	66.7	93.1	-2.6	111.5	L865 H866 K867 L872 A873 D902 Y903 D905 I906 F1242	L865-R869 HydrophobicContact CD1-CG 4.12Å; L865-R869 HydrophobicContact CG-CG 4.46Å; L865-R869 WeakPolarHBondContact O-CB 3.36Å; L865-R869 VanDerWaalsContact O-CG 3.31Å; L865-R869 WeakPolarHBondContact O-CG 3.35Å; L865-R869 PolarHBondContact O-N 3.49Å; H866-R869 WeakPolarHBondContact O-CB 3.42Å; H866-R869 PolarHBondContact O-N 3.35Å; K867-R869 PolarHBondContact O-N 3.04Å; R869-L872 PolarHBondContact O-N 3.19Å; R869-A873 WeakPolarHBondContact O-CB 3.36Å; R869-A873 PolarHBondContact O-N 2.91Å; R869-D902 WeakPolarHBondContact CD-O 3.36Å; R869-D902 WeakPolarHBondContact CG-O 3.45Å; R869-D902 PolarHBondContact NH1-O 3.05Å; R869-Y903 HydrophobicContact CG-CD1 3.86Å; R869-Y903 HydrophobicContact CG-CE1 3.97Å; R869-D905 IonicContact CZ-OD1 2.68Å; R869-D905 IonicContact CZ-OD2 3.53Å; R869-D905 VanDerWaalsContact NH1-CG 3.32Å; R869-D905 IonicContact NH1-OD1 2.73Å; R869-D905 PolarHBondContact NH1-OD1 2.95Å; R869-D905 IonicContact NH1-OD2 2.74Å; R869-D905 PolarHBondContact NH1-OD2 2.82Å; R869-D905 IonicContact NH2-OD1 3.36Å; R869-D905 PolarHBondContact NH2-OD1 2.68Å; R869-D905 IonicContact NH2-OD2 3.73Å; R869-D905 PolarHBondContact NH2-OD2 2.69Å; R869-I906 HydrophobicContact CB-CD1 3.79Å; R869-I906 HydrophobicContact CG-CD1 3.93Å; R869-F1242 HydrophobicContact CB-CZ 4.5Å
870	N	92	Very high	90	Very high	39 Å²	39	35.2 Å²	35.2	21%	0.209	18%	0.175	C	C	.	.	H	α-helix	trans	-66.8	-46.2	176.5	-161.1	-2.4	0	0	0	111.7	H866 K867 R868 L872 A873 A874	H866-N870 PolarHBondContact O-N 3.11Å; K867-N870 PolarHBondContact O-N 3.38Å; K867-N870 VanDerWaalsContact O-N 3.16Å; R868-N870 VanDerWaalsContact C-N 3.34Å; N870-L872 VanDerWaalsContact C-N 3.3Å; N870-L872 PolarHBondContact O-N 3.4Å; N870-A873 PolarHBondContact O-N 3.46Å; N870-A873 VanDerWaalsContact O-N 3.11Å; N870-A874 WeakPolarHBondContact O-CB 3.22Å; N870-A874 PolarHBondContact O-N 2.87Å
871	L	95.8	Very high	91	Very high	6 Å²	6	34.8 Å²	34.8	3%	0.031	17%	0.166	C	C	.	.	H	α-helix	trans	-54.2	-44.9	174.3	-63.8	172.9	0	0	0	112	E792 F795 M796 F835 V840 K867 R868 F875	E792-L871 HydrophobicContact CG-CD1 4.49Å; F795-L871 HydrophobicContact CD1-CD2 3.64Å; F795-L871 HydrophobicContact CE1-CB 4.11Å; F795-L871 HydrophobicContact CE1-CD2 3.93Å; F795-L871 WeakPolarHBondContact CE1-O 3.37Å; M796-L871 HydrophobicContact CG-CD2 3.92Å; M796-L871 HydrophobicContact SD-CD2 3.84Å; F835-L871 HydrophobicContact CE1-CD1 4.14Å; F835-L871 HydrophobicContact CE1-CD2 4.09Å; F835-L871 HydrophobicContact CZ-CD1 4.35Å; F835-L871 HydrophobicContact CZ-CD2 4.44Å; V840-L871 HydrophobicContact CG2-CB 4.06Å; K867-L871 WeakPolarHBondContact O-CG 3.28Å; K867-L871 PolarHBondContact O-N 2.84Å; R868-L871 PolarHBondContact O-N 2.9Å; L871-F875 PolarHBondContact O-N 3.43Å
872	L	97.2	Very high	91.7	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-66.2	-43.8	176.3	-175.4	61.7	0	0	0	112.3	V836 V840 F841 R868 R869 N870 A874 F875 C876 I892 Y903 I906 I907	V836-L872 HydrophobicContact CG1-CD1 3.77Å; V840-L872 HydrophobicContact CG1-CB 4.03Å; V840-L872 HydrophobicContact CG1-CD1 4.46Å; V840-L872 HydrophobicContact CG1-CD2 4.3Å; V840-L872 HydrophobicContact CG1-CG 4.49Å; V840-L872 HydrophobicContact CG2-CB 4.42Å; F841-L872 HydrophobicContact CE2-CD1 4.18Å; F841-L872 HydrophobicContact CZ-CD1 3.86Å; F841-L872 HydrophobicContact CZ-CD2 4.25Å; R868-L872 PolarHBondContact O-N 3.07Å; R869-L872 PolarHBondContact O-N 3.19Å; N870-L872 VanDerWaalsContact C-N 3.3Å; N870-L872 PolarHBondContact O-N 3.4Å; L872-A874 VanDerWaalsContact C-N 3.35Å; L872-A874 PolarHBondContact O-N 3.06Å; L872-F875 PolarHBondContact O-N 3.5Å; L872-C876 WeakPolarHBondContact O-CB 3.36Å; L872-C876 PolarHBondContact O-N 3.38Å; L872-C876 PolarHBondContact O-SG 3.3Å; L872-I892 HydrophobicContact CD1-CD1 4.25Å; L872-I892 HydrophobicContact CD1-CG1 4.44Å; L872-I892 HydrophobicContact CD1-CG2 4.26Å; L872-Y903 HydrophobicContact CD2-CD1 3.94Å; L872-Y903 HydrophobicContact CD2-CD2 4.33Å; L872-Y903 HydrophobicContact CD2-CG 3.7Å; L872-I906 HydrophobicContact CD2-CB 4.44Å; L872-I906 HydrophobicContact CD2-CG2 4.06Å; L872-I906 HydrophobicContact CG-CG2 4.07Å; L872-I907 HydrophobicContact CD2-CG1 4.28Å
873	A	95.7	Very high	92.7	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-62.2	-41.6	178.5	0	0	0	0	0	111.6	R869 N870 F875 C876 K877 F1242	R869-A873 WeakPolarHBondContact O-CB 3.36Å; R869-A873 PolarHBondContact O-N 2.91Å; N870-A873 PolarHBondContact O-N 3.46Å; N870-A873 VanDerWaalsContact O-N 3.11Å; A873-F875 PolarHBondContact O-N 3.15Å; A873-C876 PolarHBondContact O-N 2.93Å; A873-K877 VanDerWaalsContact O-CG 3.31Å; A873-K877 WeakPolarHBondContact O-CG 3.44Å; A873-K877 PolarHBondContact O-N 3.04Å; A873-F1242 HydrophobicContact CB-CB 4.15Å; A873-F1242 HydrophobicContact CB-CD1 4.41Å; A873-F1242 HydrophobicContact CB-CG 4.39Å
874	A	95.4	Very high	93.6	Very high	2 Å²	2	28.1 Å²	28.1	2%	0.017	14%	0.138	C	C	.	.	H	α-helix	trans	-56.2	-47.8	176.9	0	0	0	0	0	112.3	F795 M796 C799 N870 L872 K877	F795-A874 HydrophobicContact CE1-CB 4.47Å; M796-A874 HydrophobicContact CE-CB 4.09Å; M796-A874 HydrophobicContact SD-CB 3.73Å; C799-A874 HydrophobicContact CB-CB 3.87Å; N870-A874 WeakPolarHBondContact O-CB 3.22Å; N870-A874 PolarHBondContact O-N 2.87Å; L872-A874 VanDerWaalsContact C-N 3.35Å; L872-A874 PolarHBondContact O-N 3.06Å; A874-K877 WeakPolarHBondContact O-CB 3.41Å; A874-K877 PolarHBondContact O-N 3.4Å
875	F	98	Very high	94	Very high	0 Å²	0	31 Å²	31	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-71.5	-36.9	175.7	-172.6	-99.1	0	0	0	113.1	F795 L832 L833 V836 L871 L872 A873 K877 L878 I879 V884 I892	F795-F875 HydrophobicContact CZ-CB 4.06Å; L832-F875 HydrophobicContact CB-CD2 3.9Å; L832-F875 HydrophobicContact CB-CE2 3.66Å; L833-F875 HydrophobicContact CB-CE2 4.42Å; L833-F875 HydrophobicContact CB-CZ 3.85Å; L833-F875 HydrophobicContact CD1-CE1 3.8Å; L833-F875 HydrophobicContact CD1-CZ 3.94Å; L833-F875 HydrophobicContact CG-CZ 4.48Å; V836-F875 HydrophobicContact CG2-CB 3.74Å; V836-F875 HydrophobicContact CG2-CD1 4.21Å; V836-F875 HydrophobicContact CG2-CD2 4.33Å; V836-F875 HydrophobicContact CG2-CG 3.86Å; L871-F875 PolarHBondContact O-N 3.43Å; L872-F875 PolarHBondContact O-N 3.5Å; A873-F875 PolarHBondContact O-N 3.15Å; F875-K877 VanDerWaalsContact C-N 3.28Å; F875-K877 PolarHBondContact O-N 3.16Å; F875-L878 HydrophobicContact CD2-CD1 4.13Å; F875-L878 WeakPolarHBondContact O-CB 3.48Å; F875-L878 PolarHBondContact O-N 3.33Å; F875-I879 HydrophobicContact CD1-CD1 3.75Å; F875-I879 HydrophobicContact CE1-CD1 3.51Å; F875-I879 HydrophobicContact CE1-CG1 4.32Å; F875-I879 HydrophobicContact CZ-CD1 4.43Å; F875-I879 PolarHBondContact O-N 3.13Å; F875-V884 HydrophobicContact CE2-CG1 4.29Å; F875-V884 HydrophobicContact CE2-CG2 4.26Å; F875-V884 HydrophobicContact CZ-CG1 3.91Å; F875-I892 HydrophobicContact CD1-CD1 3.51Å; F875-I892 HydrophobicContact CE1-CD1 3.65Å
876	C	97.5	Very high	94.5	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-62.1	-34.5	175.3	-69.9	0	0	0	0	112.3	L872 A873 L878 I879 I880 T910 F1243	L872-C876 WeakPolarHBondContact O-CB 3.36Å; L872-C876 PolarHBondContact O-N 3.38Å; L872-C876 PolarHBondContact O-SG 3.3Å; A873-C876 PolarHBondContact O-N 2.93Å; C876-L878 VanDerWaalsContact C-N 3.32Å; C876-L878 PolarHBondContact O-N 2.91Å; C876-I879 PolarHBondContact O-N 3.08Å; C876-I880 WeakPolarHBondContact O-CD1 3.42Å; C876-I880 VanDerWaalsContact O-CG1 3.25Å; C876-I880 WeakPolarHBondContact O-CG1 3.44Å; C876-I880 PolarHBondContact O-N 3.14Å; C876-T910 HydrophobicContact CB-CG2 4.04Å; C876-T910 WeakPolarHBondContact CB-OG1 3.42Å; C876-F1243 HydrophobicContact CB-CZ 4.43Å
877	K	95.8	Very high	95	Very high	40 Å²	40	29.2 Å²	29.2	17%	0.174	14%	0.144	C	C	.	.	H	α-helix	trans	-56.9	-44.1	170.5	-68.8	171.7	-131.4	177	0	111	M803 A873 A874 F875 I879 I880 Y881	M803-K877 HydrophobicContact CE-CB 3.9Å; A873-K877 VanDerWaalsContact O-CG 3.31Å; A873-K877 WeakPolarHBondContact O-CG 3.44Å; A873-K877 PolarHBondContact O-N 3.04Å; A874-K877 WeakPolarHBondContact O-CB 3.41Å; A874-K877 PolarHBondContact O-N 3.4Å; F875-K877 VanDerWaalsContact C-N 3.28Å; F875-K877 PolarHBondContact O-N 3.16Å; K877-I879 VanDerWaalsContact C-N 3.31Å; K877-I879 PolarHBondContact O-N 3.05Å; K877-I880 PolarHBondContact O-N 3.02Å; K877-Y881 HydrophobicContact CB-CD2 4.49Å; K877-Y881 VanDerWaalsContact O-CD2 3.32Å; K877-Y881 WeakPolarHBondContact O-CD2 3.42Å; K877-Y881 PolarHBondContact O-N 2.95Å
878	L	97.1	Very high	95.3	Very high	1 Å²	1	25.5 Å²	25.5	1%	0.005	13%	0.131	C	C	.	.	H	α-helix	trans	-60.2	-37.4	179.3	-53.9	-174.5	0	0	0	113.2	C799 L802 M803 L832 F875 C876 I883 V884	C799-L878 HydrophobicContact CB-CD1 4.45Å; C799-L878 HydrophobicContact CB-CD2 4.45Å; C799-L878 WeakPolarHBondContact O-CD2 3.35Å; L802-L878 HydrophobicContact CB-CD2 4.11Å; L802-L878 HydrophobicContact CD1-CD1 4.32Å; M803-L878 HydrophobicContact CE-CD2 3.79Å; L832-L878 HydrophobicContact CD1-CD1 4.08Å; F875-L878 HydrophobicContact CD2-CD1 4.13Å; F875-L878 WeakPolarHBondContact O-CB 3.48Å; F875-L878 PolarHBondContact O-N 3.33Å; C876-L878 VanDerWaalsContact C-N 3.32Å; C876-L878 PolarHBondContact O-N 2.91Å; L878-I883 HydrophobicContact CB-CB 4.42Å; L878-I883 HydrophobicContact CD2-CG2 4.28Å; L878-I883 WeakPolarHBondContact O-CB 3.49Å; L878-I883 PolarHBondContact O-N 3.22Å; L878-V884 HydrophobicContact CB-CB 4.06Å; L878-V884 HydrophobicContact CB-CG2 3.63Å; L878-V884 HydrophobicContact CD1-CG2 3.78Å; L878-V884 HydrophobicContact CG-CG2 4.36Å; L878-V884 PolarHBondContact O-N 3.4Å; L878-V884 VanDerWaalsContact O-N 3.11Å
879	I	96.6	Very high	95.5	Very high	3 Å²	3	24 Å²	24	2%	0.015	13%	0.126	C	C	.	.	H	α-helix	trans	-70.2	-43.2	175.8	-72.8	156.8	0	0	0	111.2	F875 C876 K877 Y881 D882 V884 A889 I892 T910 T914	F875-I879 HydrophobicContact CD1-CD1 3.75Å; F875-I879 HydrophobicContact CE1-CD1 3.51Å; F875-I879 HydrophobicContact CE1-CG1 4.32Å; F875-I879 HydrophobicContact CZ-CD1 4.43Å; F875-I879 PolarHBondContact O-N 3.13Å; C876-I879 PolarHBondContact O-N 3.08Å; K877-I879 VanDerWaalsContact C-N 3.31Å; K877-I879 PolarHBondContact O-N 3.05Å; I879-Y881 VanDerWaalsContact C-N 3.34Å; I879-Y881 PolarHBondContact O-N 3.18Å; I879-D882 PolarHBondContact O-N 2.95Å; I879-V884 HydrophobicContact CG1-CB 4.27Å; I879-V884 HydrophobicContact CG1-CG1 4.12Å; I879-A889 HydrophobicContact CD1-CB 3.83Å; I879-A889 HydrophobicContact CG1-CB 4.47Å; I879-A889 HydrophobicContact CG2-CB 3.97Å; I879-I892 HydrophobicContact CD1-CD1 4.01Å; I879-T910 HydrophobicContact CG2-CG2 4.41Å; I879-T914 HydrophobicContact CG2-CG2 3.61Å
880	I	95.6	Very high	95.6	Very high	18 Å²	18	23.8 Å²	23.8	9%	0.092	13%	0.125	C	C	.	.	H	α-helix	trans	-66.7	-37.1	-175.9	-70.8	164.9	0	0	0	111.6	C876 K877 T910 K913 F1243	C876-I880 WeakPolarHBondContact O-CD1 3.42Å; C876-I880 VanDerWaalsContact O-CG1 3.25Å; C876-I880 WeakPolarHBondContact O-CG1 3.44Å; C876-I880 PolarHBondContact O-N 3.14Å; K877-I880 PolarHBondContact O-N 3.02Å; I880-T910 HydrophobicContact CD1-CG2 4.32Å; I880-T910 HydrophobicContact CG1-CG2 4.23Å; I880-K913 HydrophobicContact CD1-CB 4.2Å; I880-K913 HydrophobicContact CD1-CG 4.29Å; I880-K913 HydrophobicContact CG1-CB 3.95Å; I880-K913 HydrophobicContact CG2-CB 3.92Å; I880-K913 HydrophobicContact CG2-CD 4.47Å; I880-K913 HydrophobicContact CG2-CG 4.35Å; I880-F1243 HydrophobicContact CD1-CD1 4Å; I880-F1243 HydrophobicContact CD1-CE1 3.49Å; I880-F1243 VanDerWaalsContact CD1-CE1 3.49Å; I880-F1243 HydrophobicContact CD1-CZ 4.37Å
881	Y	93.7	Very high	95.8	Very high	88 Å²	88	23.3 Å²	23.3	35%	0.345	12%	0.122	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.6	17.7	-178.5	-67	-69.8	0	0	0	114.4	M803 H807 K877 I879 I883	M803-Y881 HydrophobicContact CE-CD2 3.76Å; M803-Y881 HydrophobicContact CE-CG 4.32Å; M803-Y881 HydrophobicContact SD-CD2 3.64Å; M803-Y881 HydrophobicContact SD-CE2 4.37Å; M803-Y881 HydrophobicContact SD-CG 3.98Å; H807-Y881 PolarHBondContact CE1-O 3.47Å; K877-Y881 HydrophobicContact CB-CD2 4.49Å; K877-Y881 VanDerWaalsContact O-CD2 3.32Å; K877-Y881 WeakPolarHBondContact O-CD2 3.42Å; K877-Y881 PolarHBondContact O-N 2.95Å; I879-Y881 VanDerWaalsContact C-N 3.34Å; I879-Y881 PolarHBondContact O-N 3.18Å; Y881-I883 PolarHBondContact O-N 2.84Å
882	D	94.1	Very high	95.8	Very high	102 Å²	102	23.1 Å²	23.1	55%	0.545	12%	0.121	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.3	45.4	172.8	-158.7	47.9	0	0	0	113.7	H807 I879	H807-D882 PolarHBondContact CE1-O 3.47Å; H807-D882 VanDerWaalsContact CE1-O 3.27Å; I879-D882 PolarHBondContact O-N 2.95Å
883	I	95.6	Very high	95.8	Very high	14 Å²	14	23.1 Å²	23.1	7%	0.072	12%	0.121	C	C	.	.	S	Bend	trans	-109.5	-31.6	177.2	-65.4	152.4	0	0	0	111.3	L802 M803 S806 P824 L878 Y881	L802-I883 HydrophobicContact CB-CG2 4.18Å; M803-I883 HydrophobicContact CE-CD1 3.4Å; M803-I883 HydrophobicContact SD-CD1 3.65Å; S806-I883 VanDerWaalsContact CB-CD1 3.49Å; P824-I883 HydrophobicContact CG-CG2 4.03Å; P824-I883 WeakPolarHBondContact CG-O 3.49Å; L878-I883 HydrophobicContact CB-CB 4.42Å; L878-I883 HydrophobicContact CD2-CG2 4.28Å; L878-I883 WeakPolarHBondContact O-CB 3.49Å; L878-I883 PolarHBondContact O-N 3.22Å; Y881-I883 PolarHBondContact O-N 2.84Å
884	V	96.1	Very high	95.8	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	13%	0.125	C	C	.	.	S	Bend	trans	-113.8	135	168.7	168.4	0	0	0	0	108.2	Q829 F875 L878 I879 M886 A888	Q829-V884 HydrophobicContact CG-CG2 4.17Å; F875-V884 HydrophobicContact CE2-CG1 4.29Å; F875-V884 HydrophobicContact CE2-CG2 4.26Å; F875-V884 HydrophobicContact CZ-CG1 3.91Å; L878-V884 HydrophobicContact CB-CB 4.06Å; L878-V884 HydrophobicContact CB-CG2 3.63Å; L878-V884 HydrophobicContact CD1-CG2 3.78Å; L878-V884 HydrophobicContact CG-CG2 4.36Å; L878-V884 PolarHBondContact O-N 3.4Å; L878-V884 VanDerWaalsContact O-N 3.11Å; I879-V884 HydrophobicContact CG1-CB 4.27Å; I879-V884 HydrophobicContact CG1-CG1 4.12Å; V884-M886 PolarHBondContact O-N 2.95Å; V884-A888 HydrophobicContact CG1-CB 3.77Å
885	D	94.3	Very high	95.7	Very high	104 Å²	104	25.3 Å²	25.3	56%	0.556	13%	0.131	S	C	*	.			trans	-56.3	122.5	-176	-76.3	8	0	0	0	111.1	P887 A888	D885-P887 VanDerWaalsContact C-N 3.27Å; D885-P887 WeakPolarHBondContact O-CD 3.38Å; D885-A888 VanDerWaalsContact O-CB 3.28Å; D885-A888 WeakPolarHBondContact O-CB 3.32Å; D885-A888 PolarHBondContact O-N 2.88Å
886	M	94.9	Very high	95.6	Very high	9 Å²	9	26.1 Å²	26.1	4%	0.044	13%	0.134	C	C	.	.	G	3₁₀ helix	trans	-49.1	-31.5	-175.6	-167.3	-171.3	-66.2	0	0	116.1	V884 A888 A889 T914 D918 L921 C922 T925	V884-M886 PolarHBondContact O-N 2.95Å; M886-A888 PolarHBondContact O-N 3.23Å; M886-A889 WeakPolarHBondContact O-CB 3.47Å; M886-A889 PolarHBondContact O-N 2.91Å; M886-A889 VanDerWaalsContact O-N 3.09Å; M886-T914 HydrophobicContact CE-CG2 4.16Å; M886-T914 HydrophobicContact CG-CG2 3.97Å; M886-T914 HydrophobicContact SD-CG2 4.19Å; M886-D918 HydrophobicContact CE-CB 4.38Å; M886-L921 HydrophobicContact CB-CD2 3.79Å; M886-L921 HydrophobicContact CB-CG 4.12Å; M886-L921 HydrophobicContact CE-CD2 4.2Å; M886-L921 HydrophobicContact CG-CD2 4.45Å; M886-L921 HydrophobicContact CG-CG 4.39Å; M886-L921 HydrophobicContact SD-CB 3.96Å; M886-L921 HydrophobicContact SD-CD2 4Å; M886-L921 HydrophobicContact SD-CG 3.73Å; M886-C922 HydrophobicContact SD-CB 4.14Å; M886-T925 WeakPolarHBondContact O-CG2 3.46Å; M886-T925 PolarHBondContact O-OG1 2.87Å
887	P	95.1	Very high	95.2	Very high	55 Å²	55	29 Å²	29	36%	0.357	15%	0.148	S	C	.	.	G	3₁₀ helix	trans	-54.4	-27.5	170.3	-30.7	38.4	0	0	0	115.7	D885 A889 A890 L921 L928	D885-P887 VanDerWaalsContact C-N 3.27Å; D885-P887 WeakPolarHBondContact O-CD 3.38Å; P887-A889 PolarHBondContact O-N 3.18Å; P887-A890 VanDerWaalsContact O-CB 3.22Å; P887-A890 WeakPolarHBondContact O-CB 3.44Å; P887-A890 PolarHBondContact O-N 3.34Å; P887-L921 HydrophobicContact CG-CD1 4.38Å; P887-L928 HydrophobicContact CB-CD2 4.36Å
888	A	94.3	Very high	95	Very high	19 Å²	19	32 Å²	32	16%	0.157	16%	0.161	C	C	.	.	G	3₁₀ helix	trans	-60.7	-24.7	175.2	0	0	0	0	0	112.8	L833 V884 D885 M886 A890	L833-A888 HydrophobicContact CD2-CB 4.25Å; V884-A888 HydrophobicContact CG1-CB 3.77Å; D885-A888 VanDerWaalsContact O-CB 3.28Å; D885-A888 WeakPolarHBondContact O-CB 3.32Å; D885-A888 PolarHBondContact O-N 2.88Å; M886-A888 PolarHBondContact O-N 3.23Å; A888-A890 PolarHBondContact O-N 2.96Å
889	A	96.1	Very high	94.7	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	16%	0.162	C	C	.	.	G	3₁₀ helix	trans	-69.8	-9.1	174.9	0	0	0	0	0	113.5	I879 M886 P887 D891 I892 F893 T925	I879-A889 HydrophobicContact CD1-CB 3.83Å; I879-A889 HydrophobicContact CG1-CB 4.47Å; I879-A889 HydrophobicContact CG2-CB 3.97Å; M886-A889 WeakPolarHBondContact O-CB 3.47Å; M886-A889 PolarHBondContact O-N 2.91Å; M886-A889 VanDerWaalsContact O-N 3.09Å; P887-A889 PolarHBondContact O-N 3.18Å; A889-D891 VanDerWaalsContact C-N 3.34Å; A889-D891 PolarHBondContact O-N 3.02Å; A889-I892 PolarHBondContact O-N 3.14Å; A889-I892 VanDerWaalsContact O-N 3.14Å; A889-F893 HydrophobicContact CB-CD1 4.49Å; A889-F893 HydrophobicContact CB-CD2 4.41Å; A889-F893 HydrophobicContact CB-CE1 4.09Å; A889-F893 HydrophobicContact CB-CE2 4.01Å; A889-F893 HydrophobicContact CB-CZ 3.83Å; A889-F893 WeakPolarHBondContact O-CB 3.33Å; A889-F893 WeakPolarHBondContact O-CG 3.47Å; A889-F893 PolarHBondContact O-N 3.46Å; A889-T925 HydrophobicContact CB-CG2 4.05Å
890	A	97	Very high	94.3	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-63.1	-42	177.4	0	0	0	0	0	111.9	P887 A888 I892 F893 K894 T925 L928 S929 Q932	P887-A890 VanDerWaalsContact O-CB 3.22Å; P887-A890 WeakPolarHBondContact O-CB 3.44Å; P887-A890 PolarHBondContact O-N 3.34Å; A888-A890 PolarHBondContact O-N 2.96Å; A890-I892 PolarHBondContact O-N 2.65Å; A890-F893 PolarHBondContact O-N 3.49Å; A890-K894 PolarHBondContact O-N 3.06Å; A890-K894 VanDerWaalsContact O-N 3.07Å; A890-T925 HydrophobicContact CB-CG2 3.85Å; A890-T925 VanDerWaalsContact N-CG2 3.32Å; A890-L928 HydrophobicContact CB-CB 4Å; A890-L928 HydrophobicContact CB-CD2 3.82Å; A890-L928 HydrophobicContact CB-CG 3.76Å; A890-S929 WeakPolarHBondContact CA-OG 3.44Å; A890-S929 WeakPolarHBondContact O-CB 3.45Å; A890-S929 PolarHBondContact O-OG 2.86Å; A890-Q932 VanDerWaalsContact CB-OE1 3.24Å
891	D	95.8	Very high	93.8	Very high	29 Å²	29	40.9 Å²	40.9	16%	0.155	20%	0.201	C	C	.	.	H	α-helix	trans	-71.1	-10.8	175.9	-70.1	-76.5	0	0	0	113.6	L833 L837 A889 K894 H895 Q932	L833-D891 HydrophobicContact CD1-CB 4.38Å; L837-D891 HydrophobicContact CD1-CB 4.48Å; L837-D891 HydrophobicContact CD2-CB 4.3Å; A889-D891 VanDerWaalsContact C-N 3.34Å; A889-D891 PolarHBondContact O-N 3.02Å; D891-K894 WeakPolarHBondContact O-CE 3.29Å; D891-K894 WeakPolarHBondContact O-CG 3.31Å; D891-K894 WeakPolarHBondContact OD1-CE 3.21Å; D891-K894 IonicContact OD1-NZ 2.66Å; D891-K894 PolarHBondContact OD1-NZ 3.02Å; D891-H895 PolarHBondContact O-CD2 3.33Å; D891-H895 PolarHBondContact O-NE2 3.27Å; D891-Q932 PolarHBondContact OD1-NE2 2.96Å; D891-Q932 VanDerWaalsContact OD1-NE2 3.16Å; D891-Q932 PolarHBondContact OD2-NE2 2.86Å
892	I	97	Very high	93.5	Very high	1 Å²	1	37.9 Å²	37.9	1%	0.005	19%	0.191	C	C	.	.	H	α-helix	trans	-94.7	-46.6	170.6	-69.4	170	0	0	0	110.7	F841 L872 F875 I879 A889 A890 K894 H895 I907	F841-I892 HydrophobicContact CE2-CG1 4.24Å; F841-I892 HydrophobicContact CZ-CG2 4.34Å; L872-I892 HydrophobicContact CD1-CD1 4.25Å; L872-I892 HydrophobicContact CD1-CG1 4.44Å; L872-I892 HydrophobicContact CD1-CG2 4.26Å; F875-I892 HydrophobicContact CD1-CD1 3.51Å; F875-I892 HydrophobicContact CE1-CD1 3.65Å; I879-I892 HydrophobicContact CD1-CD1 4.01Å; A889-I892 PolarHBondContact O-N 3.14Å; A889-I892 VanDerWaalsContact O-N 3.14Å; A890-I892 PolarHBondContact O-N 2.65Å; I892-K894 PolarHBondContact O-N 3.21Å; I892-H895 WeakPolarHBondContact O-CB 3.29Å; I892-H895 PolarHBondContact O-N 2.77Å; I892-I907 HydrophobicContact CG2-CD1 4.36Å; I892-I907 HydrophobicContact CG2-CG1 3.94Å
893	F	97.1	Very high	93.5	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-60.7	-33.8	-179.3	-68.2	-13.8	0	0	0	111.9	A889 A890 H895 Y896 I907 T910 L911 T925 L926 S929 F962	A889-F893 HydrophobicContact CB-CD1 4.49Å; A889-F893 HydrophobicContact CB-CD2 4.41Å; A889-F893 HydrophobicContact CB-CE1 4.09Å; A889-F893 HydrophobicContact CB-CE2 4.01Å; A889-F893 HydrophobicContact CB-CZ 3.83Å; A889-F893 WeakPolarHBondContact O-CB 3.33Å; A889-F893 WeakPolarHBondContact O-CG 3.47Å; A889-F893 PolarHBondContact O-N 3.46Å; A890-F893 PolarHBondContact O-N 3.49Å; F893-H895 PolarHBondContact O-N 2.72Å; F893-H895 VanDerWaalsContact O-N 3.17Å; F893-Y896 VanDerWaalsContact O-CB 3.24Å; F893-Y896 WeakPolarHBondContact O-CB 3.42Å; F893-Y896 PolarHBondContact O-N 2.71Å; F893-Y896 VanDerWaalsContact O-N 3.11Å; F893-I907 HydrophobicContact CD1-CG2 4.06Å; F893-T910 HydrophobicContact CE1-CG2 4.07Å; F893-L911 HydrophobicContact CE1-CB 3.98Å; F893-L911 HydrophobicContact CZ-CB 4.12Å; F893-L911 HydrophobicContact CZ-CG 4.49Å; F893-T925 HydrophobicContact CD2-CG2 3.8Å; F893-T925 HydrophobicContact CE2-CG2 3.76Å; F893-L926 HydrophobicContact CB-CD2 4.44Å; F893-L926 HydrophobicContact CD2-CD2 3.6Å; F893-L926 HydrophobicContact CD2-CG 4.28Å; F893-L926 HydrophobicContact CE2-CD2 4.1Å; F893-L926 HydrophobicContact CG-CD2 4.2Å; F893-S929 WeakPolarHBondContact CB-OG 3.32Å; F893-F962 HydrophobicContact CB-CZ 3.97Å; F893-F962 WeakPolarHBondContact O-CZ 3.34Å
894	K	94.9	Very high	93.3	Very high	21 Å²	21	32.5 Å²	32.5	9%	0.091	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-28.9	174.1	69.9	-178.2	-172.8	-173.3	0	113.7	A890 D891 I892 Q932 L933 E936	A890-K894 PolarHBondContact O-N 3.06Å; A890-K894 VanDerWaalsContact O-N 3.07Å; D891-K894 WeakPolarHBondContact O-CE 3.29Å; D891-K894 WeakPolarHBondContact O-CG 3.31Å; D891-K894 WeakPolarHBondContact OD1-CE 3.21Å; D891-K894 IonicContact OD1-NZ 2.66Å; D891-K894 PolarHBondContact OD1-NZ 3.02Å; I892-K894 PolarHBondContact O-N 3.21Å; K894-Q932 HydrophobicContact CD-CB 4.41Å; K894-L933 HydrophobicContact CB-CD1 3.8Å; K894-L933 HydrophobicContact CB-CD2 4.01Å; K894-L933 HydrophobicContact CB-CG 3.71Å; K894-L933 HydrophobicContact CD-CD2 4.49Å; K894-E936 IonicContact NZ-OE1 2.66Å; K894-E936 PolarHBondContact NZ-OE1 3.24Å
895	H	94.3	Very high	93	Very high	28 Å²	28	35 Å²	35	13%	0.13	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-6.7	-179.2	-68.8	-52.6	0	0	0	114.7	F841 D891 I892 F893 M897 K898 Y899	F841-H895 HydrophobicContact CD1-CB 3.74Å; F841-H895 AromaticContact CD1-CD2 3.89Å; F841-H895 AromaticContact CD1-CG 3.77Å; F841-H895 AromaticContact CD2-CD2 3.57Å; F841-H895 HydrophobicContact CE1-CB 3.51Å; F841-H895 AromaticContact CE1-CG 3.97Å; F841-H895 AromaticContact CE2-CD2 3.77Å; F841-H895 HydrophobicContact CG-CB 4.38Å; F841-H895 AromaticContact CG-CD2 3.63Å; F841-H895 AromaticContact CG-CG 3.94Å; F841-H895 HydrophobicContact CZ-CB 3.99Å; D891-H895 PolarHBondContact O-CD2 3.33Å; D891-H895 PolarHBondContact O-NE2 3.27Å; I892-H895 WeakPolarHBondContact O-CB 3.29Å; I892-H895 PolarHBondContact O-N 2.77Å; F893-H895 PolarHBondContact O-N 2.72Å; F893-H895 VanDerWaalsContact O-N 3.17Å; H895-M897 PolarHBondContact O-N 3Å; H895-K898 PolarHBondContact O-N 3.47Å; H895-K898 VanDerWaalsContact O-N 3.1Å; H895-Y899 HydrophobicContact CB-CD2 3.99Å; H895-Y899 AromaticContact ND1-CE2 4Å; H895-Y899 PolarHBondContact O-N 3.14Å; H895-Y899 VanDerWaalsContact O-N 3.11Å
896	Y	94.3	Very high	92.9	Very high	16 Å²	16	30.2 Å²	30.2	6%	0.063	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-49.1	-34.3	-176.3	177	-129.1	0	0	0	114.8	F893 Y900 G904 I907 K908 L958 R961 F962	F893-Y896 VanDerWaalsContact O-CB 3.24Å; F893-Y896 WeakPolarHBondContact O-CB 3.42Å; F893-Y896 PolarHBondContact O-N 2.71Å; F893-Y896 VanDerWaalsContact O-N 3.11Å; Y896-Y900 HydrophobicContact CD2-CD2 4.43Å; Y896-Y900 AromaticContact CE2-CD2 3.94Å; Y896-Y900 HydrophobicContact CE2-CD2 3.94Å; Y896-Y900 AromaticContact CE2-CE2 3.93Å; Y896-Y900 HydrophobicContact CE2-CE2 3.93Å; Y896-Y900 AromaticContact CZ-CE2 3.93Å; Y896-Y900 WeakPolarHBondContact O-CA 3.5Å; Y896-Y900 WeakPolarHBondContact O-CB 3.42Å; Y896-G904 WeakPolarHBondContact CE2-O 3.43Å; Y896-I907 HydrophobicContact CD2-CB 4.08Å; Y896-I907 HydrophobicContact CD2-CG2 3.82Å; Y896-I907 HydrophobicContact CG-CG2 4.13Å; Y896-K908 HydrophobicContact CE2-CB 4.14Å; Y896-L958 HydrophobicContact CD1-CD1 3.81Å; Y896-L958 HydrophobicContact CG-CD1 4.44Å; Y896-R961 HydrophobicContact CE1-CB 4.34Å; Y896-F962 HydrophobicContact CD1-CE1 4.02Å
897	M	90.6	Very high	93	Very high	62 Å²	62	29.8 Å²	29.8	31%	0.305	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-38.5	178	-91.8	-167.8	72.6	0	0	114.6	H895 Y899 E957 L958	H895-M897 PolarHBondContact O-N 3Å; M897-Y899 VanDerWaalsContact C-N 3.31Å; M897-Y899 PolarHBondContact O-N 3.05Å; M897-E957 HydrophobicContact CE-CB 4.05Å; M897-E957 HydrophobicContact CE-CG 3.36Å; M897-E957 HydrophobicContact SD-CB 3.99Å; M897-E957 HydrophobicContact SD-CG 3.53Å; M897-E957 VanDerWaalsContact SD-CG 3.53Å; M897-L958 HydrophobicContact CB-CD1 4.3Å; M897-L958 HydrophobicContact CG-CB 4.45Å; M897-L958 HydrophobicContact CG-CD1 3.93Å; M897-L958 HydrophobicContact SD-CB 3.83Å; M897-L958 HydrophobicContact SD-CD1 4.37Å; M897-L958 PolarHBondContact SD-N 3.43Å; M897-L958 VanDerWaalsContact SD-N 3.43Å
898	K	89.9	Confident	92.9	Very high	103 Å²	103	31.4 Å²	31.4	45%	0.448	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-41.9	-178.7	-173.7	178.2	173.9	-158.2	0	110.5	D843 H895	D843-K898 WeakPolarHBondContact OD1-CE 3.34Å; D843-K898 IonicContact OD1-NZ 3.22Å; D843-K898 PolarHBondContact OD1-NZ 3.01Å; D843-K898 IonicContact OD2-NZ 3.62Å; D843-K898 PolarHBondContact OD2-NZ 3.42Å; H895-K898 PolarHBondContact O-N 3.47Å; H895-K898 VanDerWaalsContact O-N 3.1Å
899	Y	91	Very high	92.9	Very high	6 Å²	6	33.2 Å²	33.2	2%	0.024	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.8	35.3	-177.9	-59.3	-85.1	0	0	0	112.9	F841 I842 H895 M897 N901 D902 Y903 G904	F841-Y899 HydrophobicContact CB-CE2 3.98Å; F841-Y899 AromaticContact CD1-CD2 3.58Å; F841-Y899 HydrophobicContact CD1-CD2 3.58Å; F841-Y899 AromaticContact CD1-CE2 3.79Å; F841-Y899 HydrophobicContact CD1-CE2 3.79Å; F841-Y899 HydrophobicContact CD1-CG 4.11Å; F841-Y899 HydrophobicContact CE1-CD2 4.24Å; F841-Y899 HydrophobicContact CG-CE2 4.34Å; F841-Y899 PolarHBondContact O-OH 2.83Å; I842-Y899 VanDerWaalsContact C-OH 3.31Å; I842-Y899 WeakPolarHBondContact O-CE1 3.5Å; I842-Y899 VanDerWaalsContact O-CZ 3.29Å; I842-Y899 PolarHBondContact O-OH 2.98Å; H895-Y899 HydrophobicContact CB-CD2 3.99Å; H895-Y899 AromaticContact ND1-CE2 4Å; H895-Y899 PolarHBondContact O-N 3.14Å; H895-Y899 VanDerWaalsContact O-N 3.11Å; M897-Y899 VanDerWaalsContact C-N 3.31Å; M897-Y899 PolarHBondContact O-N 3.05Å; Y899-N901 VanDerWaalsContact C-N 3.28Å; Y899-N901 PolarHBondContact O-N 3.07Å; Y899-D902 PolarHBondContact O-N 2.76Å; Y899-D902 VanDerWaalsContact O-N 3.09Å; Y899-Y903 VanDerWaalsContact CB-CD2 3.45Å; Y899-Y903 HydrophobicContact CD1-CD2 4.27Å; Y899-Y903 AromaticContact CD1-CE2 3.98Å; Y899-Y903 HydrophobicContact CD1-CE2 3.98Å; Y899-Y903 AromaticContact CG-CD2 3.9Å; Y899-Y903 HydrophobicContact CG-CD2 3.9Å; Y899-Y903 HydrophobicContact CG-CE2 4.05Å; Y899-Y903 PolarHBondContact O-N 3.31Å; Y899-G904 PolarHBondContact O-N 3.37Å
900	Y	88.1	Confident	92.8	Very high	110 Å²	110	33.2 Å²	33.2	43%	0.431	16%	0.155	S	C	.	.	H	α-helix	trans	-59.6	-35.9	-174	-177.8	-92.1	0	0	0	113.4	Y896 D902 G904	Y896-Y900 HydrophobicContact CD2-CD2 4.43Å; Y896-Y900 AromaticContact CE2-CD2 3.94Å; Y896-Y900 HydrophobicContact CE2-CD2 3.94Å; Y896-Y900 AromaticContact CE2-CE2 3.93Å; Y896-Y900 HydrophobicContact CE2-CE2 3.93Å; Y896-Y900 AromaticContact CZ-CE2 3.93Å; Y896-Y900 WeakPolarHBondContact O-CA 3.5Å; Y896-Y900 WeakPolarHBondContact O-CB 3.42Å; Y900-D902 VanDerWaalsContact C-N 3.31Å; Y900-G904 VanDerWaalsContact O-CA 3.3Å; Y900-G904 WeakPolarHBondContact O-CA 3.37Å; Y900-G904 PolarHBondContact O-N 3.23Å
901	N	86.1	Confident	92.6	Very high	92 Å²	92	33.5 Å²	33.5	49%	0.492	16%	0.156	S	C	.	.	H	α-helix	trans	-69.3	-33.7	178.4	-59.1	-46.9	0	0	0	111.9	Y899 R1239	Y899-N901 VanDerWaalsContact C-N 3.28Å; Y899-N901 PolarHBondContact O-N 3.07Å; N901-R1239 PolarHBondContact O-NH1 3.04Å; N901-R1239 PolarHBondContact O-NH2 3.23Å
902	D	87.7	Confident	92.5	Very high	24 Å²	24	33.1 Å²	33.1	13%	0.128	16%	0.156	C	C	.	.	H	α-helix	trans	-97.4	-41	-160.6	-48.1	-42.4	0	0	0	110.5	Q844 L865 R869 Y899 Y900	Q844-D902 PolarHBondContact NE2-OD2 3.11Å; L865-D902 HydrophobicContact CD1-CB 3.75Å; R869-D902 WeakPolarHBondContact CD-O 3.36Å; R869-D902 WeakPolarHBondContact CG-O 3.45Å; R869-D902 PolarHBondContact NH1-O 3.05Å; Y899-D902 PolarHBondContact O-N 2.76Å; Y899-D902 VanDerWaalsContact O-N 3.09Å; Y900-D902 VanDerWaalsContact C-N 3.31Å
903	Y	93.7	Very high	92.3	Very high	2 Å²	2	36.1 Å²	36.1	1%	0.008	17%	0.169	C	C	.	.	H	α-helix	trans	-131.1	-1.1	-175	-49.8	-46	0	0	0	113.9	V840 F841 L865 R868 R869 L872 Y899 D905 I906 I907	V840-Y903 HydrophobicContact CG1-CD1 4.43Å; V840-Y903 HydrophobicContact CG1-CD2 4.11Å; V840-Y903 HydrophobicContact CG1-CE1 3.91Å; V840-Y903 HydrophobicContact CG1-CE2 3.53Å; V840-Y903 VanDerWaalsContact CG1-CZ 3.41Å; V840-Y903 WeakPolarHBondContact O-CE2 3.36Å; V840-Y903 PolarHBondContact O-OH 3.25Å; F841-Y903 AromaticContact CD1-CD2 3.89Å; F841-Y903 HydrophobicContact CD1-CD2 3.89Å; F841-Y903 AromaticContact CD1-CE2 3.95Å; F841-Y903 HydrophobicContact CD1-CE2 3.95Å; F841-Y903 AromaticContact CE1-CD2 3.61Å; F841-Y903 HydrophobicContact CE1-CD2 3.61Å; F841-Y903 HydrophobicContact CE1-CE2 4.1Å; F841-Y903 HydrophobicContact CE1-CG 4.48Å; L865-Y903 HydrophobicContact CD1-CE1 3.8Å; R868-Y903 HydrophobicContact CB-CE1 4.2Å; R868-Y903 WeakPolarHBondContact CB-OH 3.37Å; R869-Y903 HydrophobicContact CG-CD1 3.86Å; R869-Y903 HydrophobicContact CG-CE1 3.97Å; L872-Y903 HydrophobicContact CD2-CD1 3.94Å; L872-Y903 HydrophobicContact CD2-CD2 4.33Å; L872-Y903 HydrophobicContact CD2-CG 3.7Å; Y899-Y903 VanDerWaalsContact CB-CD2 3.45Å; Y899-Y903 HydrophobicContact CD1-CD2 4.27Å; Y899-Y903 AromaticContact CD1-CE2 3.98Å; Y899-Y903 HydrophobicContact CD1-CE2 3.98Å; Y899-Y903 AromaticContact CG-CD2 3.9Å; Y899-Y903 HydrophobicContact CG-CD2 3.9Å; Y899-Y903 HydrophobicContact CG-CE2 4.05Å; Y899-Y903 PolarHBondContact O-N 3.31Å; Y903-D905 VanDerWaalsContact C-N 3.25Å; Y903-D905 PolarHBondContact O-N 3.47Å; Y903-I906 PolarHBondContact O-N 3.03Å; Y903-I906 VanDerWaalsContact O-N 3.14Å; Y903-I907 WeakPolarHBondContact O-CG1 3.29Å; Y903-I907 PolarHBondContact O-N 2.83Å
904	G	91.1	Very high	92.1	Very high	2 Å²	2	36.1 Å²	36.1	2%	0.021	17%	0.169	C	C	.	.	H	α-helix	trans	-63.6	-25.6	-171	0	0	0	0	0	114.9	Y896 Y899 Y900 K908	Y896-G904 WeakPolarHBondContact CE2-O 3.43Å; Y899-G904 PolarHBondContact O-N 3.37Å; Y900-G904 VanDerWaalsContact O-CA 3.3Å; Y900-G904 WeakPolarHBondContact O-CA 3.37Å; Y900-G904 PolarHBondContact O-N 3.23Å; G904-K908 WeakPolarHBondContact O-CB 3.5Å; G904-K908 PolarHBondContact O-N 3.22Å; G904-K908 VanDerWaalsContact O-N 3.08Å
905	D	89.9	Confident	91.9	Very high	52 Å²	52	38.1 Å²	38.1	28%	0.278	18%	0.176	S	C	.	.	H	α-helix	trans	-69.7	-52	170.6	41.2	14.9	0	0	0	111.7	R869 Y903 I907 K908 E909 R1239	R869-D905 IonicContact CZ-OD1 2.68Å; R869-D905 IonicContact CZ-OD2 3.53Å; R869-D905 VanDerWaalsContact NH1-CG 3.32Å; R869-D905 IonicContact NH1-OD1 2.73Å; R869-D905 PolarHBondContact NH1-OD1 2.95Å; R869-D905 IonicContact NH1-OD2 2.74Å; R869-D905 PolarHBondContact NH1-OD2 2.82Å; R869-D905 IonicContact NH2-OD1 3.36Å; R869-D905 PolarHBondContact NH2-OD1 2.68Å; R869-D905 IonicContact NH2-OD2 3.73Å; R869-D905 PolarHBondContact NH2-OD2 2.69Å; Y903-D905 VanDerWaalsContact C-N 3.25Å; Y903-D905 PolarHBondContact O-N 3.47Å; D905-I907 VanDerWaalsContact C-N 3.33Å; D905-I907 PolarHBondContact O-N 2.87Å; D905-K908 PolarHBondContact O-N 3.44Å; D905-E909 PolarHBondContact O-N 2.79Å; D905-R1239 IonicContact OD1-NH1 3.85Å; D905-R1239 WeakPolarHBondContact OD2-CD 3.31Å; D905-R1239 IonicContact OD2-CZ 3.79Å; D905-R1239 IonicContact OD2-NE 3.84Å; D905-R1239 IonicContact OD2-NH1 2.91Å; D905-R1239 PolarHBondContact OD2-NH1 3.48Å
906	I	93.2	Very high	91.8	Very high	3 Å²	3	42.7 Å²	42.7	2%	0.015	20%	0.197	C	C	.	.	H	α-helix	trans	-58.8	-44.7	178.5	-62	171.6	0	0	0	111.1	R869 L872 Y903 E909 T910 F1242 F1243	R869-I906 HydrophobicContact CB-CD1 3.79Å; R869-I906 HydrophobicContact CG-CD1 3.93Å; L872-I906 HydrophobicContact CD2-CB 4.44Å; L872-I906 HydrophobicContact CD2-CG2 4.06Å; L872-I906 HydrophobicContact CG-CG2 4.07Å; Y903-I906 PolarHBondContact O-N 3.03Å; Y903-I906 VanDerWaalsContact O-N 3.14Å; I906-E909 PolarHBondContact O-N 3.15Å; I906-T910 WeakPolarHBondContact O-CB 3.38Å; I906-T910 PolarHBondContact O-N 3.39Å; I906-T910 PolarHBondContact O-OG1 3.3Å; I906-F1242 HydrophobicContact CD1-CD2 4.46Å; I906-F1243 HydrophobicContact CB-CE2 4.39Å; I906-F1243 HydrophobicContact CG1-CE2 4.46Å; I906-F1243 HydrophobicContact CG2-CE2 4.11Å; I906-F1243 HydrophobicContact CG2-CZ 4Å
907	I	96.1	Very high	91.6	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-69.8	-38.3	179.8	-62.2	169.9	0	0	0	111.2	F841 L872 I892 F893 Y896 Y903 D905 T910 L911	F841-I907 HydrophobicContact CE1-CD1 4.26Å; F841-I907 HydrophobicContact CZ-CD1 4.4Å; L872-I907 HydrophobicContact CD2-CG1 4.28Å; I892-I907 HydrophobicContact CG2-CD1 4.36Å; I892-I907 HydrophobicContact CG2-CG1 3.94Å; F893-I907 HydrophobicContact CD1-CG2 4.06Å; Y896-I907 HydrophobicContact CD2-CB 4.08Å; Y896-I907 HydrophobicContact CD2-CG2 3.82Å; Y896-I907 HydrophobicContact CG-CG2 4.13Å; Y903-I907 WeakPolarHBondContact O-CG1 3.29Å; Y903-I907 PolarHBondContact O-N 2.83Å; D905-I907 VanDerWaalsContact C-N 3.33Å; D905-I907 PolarHBondContact O-N 2.87Å; I907-T910 PolarHBondContact O-N 2.78Å; I907-L911 WeakPolarHBondContact O-CB 3.29Å; I907-L911 PolarHBondContact O-N 3.19Å
908	K	92.8	Very high	91.7	Very high	90 Å²	90	46.6 Å²	46.6	39%	0.391	22%	0.224	S	C	.	.	H	α-helix	trans	-61.1	-44.2	175.3	176.2	-170	176.6	-166.9	0	111.6	Y896 G904 D905 S912 E1201	Y896-K908 HydrophobicContact CE2-CB 4.14Å; G904-K908 WeakPolarHBondContact O-CB 3.5Å; G904-K908 PolarHBondContact O-N 3.22Å; G904-K908 VanDerWaalsContact O-N 3.08Å; D905-K908 PolarHBondContact O-N 3.44Å; K908-S912 WeakPolarHBondContact O-CB 3.41Å; K908-S912 PolarHBondContact O-N 3.38Å; K908-E1201 IonicContact NZ-OE1 2.99Å; K908-E1201 PolarHBondContact NZ-OE1 2.92Å
909	E	93.4	Very high	91.8	Very high	57 Å²	57	45.6 Å²	45.6	27%	0.266	22%	0.22	S	C	.	.	H	α-helix	trans	-76.5	-33.7	-179.2	-167.2	51.9	-151	0	0	112.5	D905 I906 L911 S912 K913 F1243	D905-E909 PolarHBondContact O-N 2.79Å; I906-E909 PolarHBondContact O-N 3.15Å; E909-L911 VanDerWaalsContact C-N 3.33Å; E909-L911 PolarHBondContact O-N 3.32Å; E909-S912 CarbonylContact O-C 3.6Å; E909-S912 WeakPolarHBondContact O-CA 3.3Å; E909-S912 VanDerWaalsContact O-CB 3.28Å; E909-S912 WeakPolarHBondContact O-CB 3.32Å; E909-S912 PolarHBondContact O-N 2.9Å; E909-S912 WeakPolarHBondContact OE2-CB 3.45Å; E909-S912 PolarHBondContact OE2-OG 2.97Å; E909-K913 HydrophobicContact CG-CG 4.2Å; E909-K913 VanDerWaalsContact O-CG 3.27Å; E909-K913 WeakPolarHBondContact O-CG 3.46Å; E909-K913 PolarHBondContact O-N 3.2Å; E909-K913 WeakPolarHBondContact OE1-CE 3.38Å; E909-K913 WeakPolarHBondContact OE1-CG 3.5Å; E909-F1243 HydrophobicContact CB-CD2 4.13Å; E909-F1243 HydrophobicContact CB-CE2 4.32Å; E909-F1243 HydrophobicContact CG-CB 4.37Å; E909-F1243 HydrophobicContact CG-CD2 4.13Å; E909-F1243 HydrophobicContact CG-CG 4.19Å
910	T	94.8	Very high	91.9	Very high	0 Å²	0	48 Å²	48	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-60.4	-42.3	170.8	-54.5	0	0	0	0	111.7	C876 I879 I880 F893 I906 I907 T914	C876-T910 HydrophobicContact CB-CG2 4.04Å; C876-T910 WeakPolarHBondContact CB-OG1 3.42Å; I879-T910 HydrophobicContact CG2-CG2 4.41Å; I880-T910 HydrophobicContact CD1-CG2 4.32Å; I880-T910 HydrophobicContact CG1-CG2 4.23Å; F893-T910 HydrophobicContact CE1-CG2 4.07Å; I906-T910 WeakPolarHBondContact O-CB 3.38Å; I906-T910 PolarHBondContact O-N 3.39Å; I906-T910 PolarHBondContact O-OG1 3.3Å; I907-T910 PolarHBondContact O-N 2.78Å; T910-T914 WeakPolarHBondContact O-CB 3.38Å; T910-T914 WeakPolarHBondContact O-CG2 3.22Å; T910-T914 PolarHBondContact O-N 3.44Å; T910-T914 PolarHBondContact O-OG1 3.43Å
911	L	93.6	Very high	92.3	Very high	6 Å²	6	45.4 Å²	45.4	3%	0.031	23%	0.225	C	C	.	.	H	α-helix	trans	-62.7	-43.3	170.4	-169.5	166	0	0	0	110.8	F893 I907 E909 K913 T914 R915 L926 F962 T965	F893-L911 HydrophobicContact CE1-CB 3.98Å; F893-L911 HydrophobicContact CZ-CB 4.12Å; F893-L911 HydrophobicContact CZ-CG 4.49Å; I907-L911 WeakPolarHBondContact O-CB 3.29Å; I907-L911 PolarHBondContact O-N 3.19Å; E909-L911 VanDerWaalsContact C-N 3.33Å; E909-L911 PolarHBondContact O-N 3.32Å; L911-K913 PolarHBondContact O-N 3.4Å; L911-T914 WeakPolarHBondContact CA-OG1 3.36Å; L911-T914 PolarHBondContact O-OG1 3.24Å; L911-T914 VanDerWaalsContact O-OG1 3.12Å; L911-R915 WeakPolarHBondContact O-CB 3.43Å; L911-R915 PolarHBondContact O-N 3.04Å; L911-R915 VanDerWaalsContact O-N 3.09Å; L911-L926 HydrophobicContact CD1-CD2 3.61Å; L911-L926 HydrophobicContact CG-CD2 4.05Å; L911-F962 HydrophobicContact CD1-CD1 4.02Å; L911-F962 HydrophobicContact CD1-CE1 4.01Å; L911-T965 HydrophobicContact CD1-CG2 4.13Å; L911-T965 HydrophobicContact CD2-CG2 3.76Å
912	S	92	Very high	92.7	Very high	20 Å²	20	41 Å²	41	14%	0.14	20%	0.202	C	C	.	.	H	α-helix	trans	-59.4	-45.6	179.4	-171	0	0	0	0	112.9	K908 E909 R915 Q916	K908-S912 WeakPolarHBondContact O-CB 3.41Å; K908-S912 PolarHBondContact O-N 3.38Å; E909-S912 CarbonylContact O-C 3.6Å; E909-S912 WeakPolarHBondContact O-CA 3.3Å; E909-S912 VanDerWaalsContact O-CB 3.28Å; E909-S912 WeakPolarHBondContact O-CB 3.32Å; E909-S912 PolarHBondContact O-N 2.9Å; E909-S912 WeakPolarHBondContact OE2-CB 3.45Å; E909-S912 PolarHBondContact OE2-OG 2.97Å; S912-R915 PolarHBondContact OG-NH2 2.97Å; S912-Q916 VanDerWaalsContact O-CG 3.29Å; S912-Q916 WeakPolarHBondContact O-CG 3.44Å; S912-Q916 PolarHBondContact O-N 2.94Å; S912-Q916 PolarHBondContact O-NE2 3.07Å; S912-Q916 PolarHBondContact OG-NE2 2.91Å
913	K	93.1	Very high	93	Very high	64 Å²	64	39.9 Å²	39.9	28%	0.278	20%	0.196	S	C	.	.	H	α-helix	trans	-74.2	-48.2	-178.3	-63.7	-89.8	177.1	156.2	0	111.7	I880 E909 L911 R915 Q916 T917	I880-K913 HydrophobicContact CD1-CB 4.2Å; I880-K913 HydrophobicContact CD1-CG 4.29Å; I880-K913 HydrophobicContact CG1-CB 3.95Å; I880-K913 HydrophobicContact CG2-CB 3.92Å; I880-K913 HydrophobicContact CG2-CD 4.47Å; I880-K913 HydrophobicContact CG2-CG 4.35Å; E909-K913 HydrophobicContact CG-CG 4.2Å; E909-K913 VanDerWaalsContact O-CG 3.27Å; E909-K913 WeakPolarHBondContact O-CG 3.46Å; E909-K913 PolarHBondContact O-N 3.2Å; E909-K913 WeakPolarHBondContact OE1-CE 3.38Å; E909-K913 WeakPolarHBondContact OE1-CG 3.5Å; L911-K913 PolarHBondContact O-N 3.4Å; K913-R915 VanDerWaalsContact C-N 3.26Å; K913-R915 PolarHBondContact O-N 3.22Å; K913-Q916 WeakPolarHBondContact O-CA 3.46Å; K913-Q916 WeakPolarHBondContact O-CB 3.35Å; K913-Q916 PolarHBondContact O-N 3.19Å; K913-T917 PolarHBondContact O-N 2.83Å; K913-T917 PolarHBondContact O-OG1 2.9Å
914	T	93.8	Very high	93.1	Very high	1 Å²	1	43.5 Å²	43.5	1%	0.006	21%	0.212	C	C	.	.	H	α-helix	trans	-57.1	-39.1	175.7	50.5	0	0	0	0	112.4	I879 M886 T910 L911 Q916 T917 D918	I879-T914 HydrophobicContact CG2-CG2 3.61Å; M886-T914 HydrophobicContact CE-CG2 4.16Å; M886-T914 HydrophobicContact CG-CG2 3.97Å; M886-T914 HydrophobicContact SD-CG2 4.19Å; T910-T914 WeakPolarHBondContact O-CB 3.38Å; T910-T914 WeakPolarHBondContact O-CG2 3.22Å; T910-T914 PolarHBondContact O-N 3.44Å; T910-T914 PolarHBondContact O-OG1 3.43Å; L911-T914 WeakPolarHBondContact CA-OG1 3.36Å; L911-T914 PolarHBondContact O-OG1 3.24Å; L911-T914 VanDerWaalsContact O-OG1 3.12Å; T914-Q916 VanDerWaalsContact C-N 3.32Å; T914-Q916 PolarHBondContact O-N 3.5Å; T914-T917 PolarHBondContact O-N 3.25Å; T914-D918 CarbonylContact O-C 3.57Å; T914-D918 PolarHBondContact O-N 3.37Å
915	R	91.4	Very high	93.4	Very high	63 Å²	63	43.4 Å²	43.4	24%	0.238	21%	0.211	C	C	.	.	H	α-helix	trans	-67.8	-24.8	172.9	-176	-164.4	60.3	-163.6	-16.2	113.7	L911 S912 K913 K919 C922 T965	L911-R915 WeakPolarHBondContact O-CB 3.43Å; L911-R915 PolarHBondContact O-N 3.04Å; L911-R915 VanDerWaalsContact O-N 3.09Å; S912-R915 PolarHBondContact OG-NH2 2.97Å; K913-R915 VanDerWaalsContact C-N 3.26Å; K913-R915 PolarHBondContact O-N 3.22Å; R915-K919 WeakPolarHBondContact O-CG 3.14Å; R915-C922 HydrophobicContact CB-CB 4.27Å; R915-T965 PolarHBondContact NH1-O 3.4Å
916	Q	90.6	Very high	93.7	Very high	124 Å²	124	41 Å²	41	58%	0.579	20%	0.198	S	C	*	.	H	α-helix	trans	-76.4	-41	172.1	-73.4	166.3	67	0	0	110.9	S912 K913 T914	S912-Q916 VanDerWaalsContact O-CG 3.29Å; S912-Q916 WeakPolarHBondContact O-CG 3.44Å; S912-Q916 PolarHBondContact O-N 2.94Å; S912-Q916 PolarHBondContact O-NE2 3.07Å; S912-Q916 PolarHBondContact OG-NE2 2.91Å; K913-Q916 WeakPolarHBondContact O-CA 3.46Å; K913-Q916 WeakPolarHBondContact O-CB 3.35Å; K913-Q916 PolarHBondContact O-N 3.19Å; T914-Q916 VanDerWaalsContact C-N 3.32Å; T914-Q916 PolarHBondContact O-N 3.5Å
917	T	90.4	Very high	93.9	Very high	94 Å²	94	40.9 Å²	40.9	58%	0.577	20%	0.198	S	C	*	.	H	α-helix	trans	-67.3	-59.3	177.4	-50.9	0	0	0	0	112.2	K913 T914	K913-T917 PolarHBondContact O-N 2.83Å; K913-T917 PolarHBondContact O-OG1 2.9Å; T914-T917 PolarHBondContact O-N 3.25Å
918	D	92.8	Very high	94	Very high	66 Å²	66	43.8 Å²	43.8	35%	0.353	21%	0.213	S	C	.	.			trans	-142.2	109.4	172.8	-175.1	-12.8	0	0	0	111.4	M886 T914 I920 L921 C922	M886-D918 HydrophobicContact CE-CB 4.38Å; T914-D918 CarbonylContact O-C 3.57Å; T914-D918 PolarHBondContact O-N 3.37Å; D918-I920 VanDerWaalsContact C-N 3.35Å; D918-I920 PolarHBondContact O-N 3.02Å; D918-I920 WeakPolarHBondContact OD1-CA 3.33Å; D918-I920 WeakPolarHBondContact OD1-CB 3.43Å; D918-I920 PolarHBondContact OD1-N 3.36Å; D918-L921 HydrophobicContact CB-CB 3.94Å; D918-L921 PolarHBondContact OD1-N 2.86Å; D918-L921 VanDerWaalsContact OD1-N 3.08Å; D918-L921 WeakPolarHBondContact OD2-CB 3.4Å; D918-C922 WeakPolarHBondContact O-CB 3.28Å; D918-C922 PolarHBondContact O-N 3.49Å
919	K	92.1	Very high	94.2	Very high	82 Å²	82	39.5 Å²	39.5	36%	0.357	19%	0.194	S	C	.	.	H	α-helix	trans	-62.9	-36.6	176.6	-65.1	171.9	-179.7	170.4	0	113.5	R915 A923 K972 A976	R915-K919 WeakPolarHBondContact O-CG 3.14Å; K919-A923 VanDerWaalsContact O-CB 3.25Å; K919-A923 WeakPolarHBondContact O-CB 3.24Å; K919-A923 PolarHBondContact O-N 3.16Å; K919-K972 WeakPolarHBondContact CD-O 3.14Å; K919-K972 PolarHBondContact NZ-O 3.32Å; K919-A976 HydrophobicContact CB-CB 4.05Å; K919-A976 VanDerWaalsContact O-CB 3.24Å; K919-A976 WeakPolarHBondContact O-CB 3.27Å
920	I	94.2	Very high	94.3	Very high	56 Å²	56	36.8 Å²	36.8	29%	0.287	18%	0.182	S	C	.	.	H	α-helix	trans	-76.9	-46.3	-175.7	-58.2	175.8	0	0	0	109.1	D918 A923 K924 E975 A976 T979	D918-I920 VanDerWaalsContact C-N 3.35Å; D918-I920 PolarHBondContact O-N 3.02Å; D918-I920 WeakPolarHBondContact OD1-CA 3.33Å; D918-I920 WeakPolarHBondContact OD1-CB 3.43Å; D918-I920 PolarHBondContact OD1-N 3.36Å; I920-A923 PolarHBondContact O-N 2.71Å; I920-K924 WeakPolarHBondContact O-CG 3.46Å; I920-K924 PolarHBondContact O-N 3.43Å; I920-E975 HydrophobicContact CD1-CB 4.46Å; I920-E975 HydrophobicContact CD1-CG 3.87Å; I920-A976 HydrophobicContact CG1-CB 4.27Å; I920-T979 HydrophobicContact CG2-CG2 4.19Å
921	L	94.7	Very high	94.4	Very high	55 Å²	55	38.2 Å²	38.2	29%	0.288	19%	0.188	S	C	.	.	H	α-helix	trans	-65.5	-44.2	176	-171.5	58.1	0	0	0	111.4	M886 P887 D918 A923 K924 T925	M886-L921 HydrophobicContact CB-CD2 3.79Å; M886-L921 HydrophobicContact CB-CG 4.12Å; M886-L921 HydrophobicContact CE-CD2 4.2Å; M886-L921 HydrophobicContact CG-CD2 4.45Å; M886-L921 HydrophobicContact CG-CG 4.39Å; M886-L921 HydrophobicContact SD-CB 3.96Å; M886-L921 HydrophobicContact SD-CD2 4Å; M886-L921 HydrophobicContact SD-CG 3.73Å; P887-L921 HydrophobicContact CG-CD1 4.38Å; D918-L921 HydrophobicContact CB-CB 3.94Å; D918-L921 PolarHBondContact OD1-N 2.86Å; D918-L921 VanDerWaalsContact OD1-N 3.08Å; D918-L921 WeakPolarHBondContact OD2-CB 3.4Å; L921-A923 VanDerWaalsContact C-N 3.31Å; L921-A923 PolarHBondContact O-N 3.23Å; L921-K924 WeakPolarHBondContact O-CA 3.34Å; L921-K924 WeakPolarHBondContact O-CB 3.23Å; L921-K924 PolarHBondContact O-N 3.44Å; L921-T925 PolarHBondContact O-N 2.73Å; L921-T925 PolarHBondContact O-OG1 2.64Å
922	C	94.8	Very high	94.5	Very high	1 Å²	1	39.7 Å²	39.7	1%	0.007	20%	0.195	C	C	.	.	H	α-helix	trans	-56.2	-44	172.9	-179	0	0	0	0	111.8	M886 R915 D918 K924 T925 L926	M886-C922 HydrophobicContact SD-CB 4.14Å; R915-C922 HydrophobicContact CB-CB 4.27Å; D918-C922 WeakPolarHBondContact O-CB 3.28Å; D918-C922 PolarHBondContact O-N 3.49Å; C922-K924 VanDerWaalsContact C-N 3.3Å; C922-K924 PolarHBondContact O-N 3.02Å; C922-T925 PolarHBondContact O-N 3.33Å; C922-L926 VanDerWaalsContact O-CG 3.31Å; C922-L926 WeakPolarHBondContact O-CG 3.2Å; C922-L926 PolarHBondContact O-N 3.12Å
923	A	95.1	Very high	94.5	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-65.1	-30.4	175.9	0	0	0	0	0	113.7	K919 I920 L921 I927 F966 A976 L980	K919-A923 VanDerWaalsContact O-CB 3.25Å; K919-A923 WeakPolarHBondContact O-CB 3.24Å; K919-A923 PolarHBondContact O-N 3.16Å; I920-A923 PolarHBondContact O-N 2.71Å; L921-A923 VanDerWaalsContact C-N 3.31Å; L921-A923 PolarHBondContact O-N 3.23Å; A923-I927 PolarHBondContact O-N 3.49Å; A923-F966 HydrophobicContact CB-CE1 3.95Å; A923-F966 HydrophobicContact CB-CZ 3.73Å; A923-A976 HydrophobicContact CB-CB 3.87Å; A923-L980 HydrophobicContact CB-CB 4.3Å; A923-L980 HydrophobicContact CB-CD1 4.49Å
924	K	96.4	Very high	94.5	Very high	77 Å²	77	37.3 Å²	37.3	34%	0.335	18%	0.183	S	C	.	.	H	α-helix	trans	-69.3	-43.6	170.3	-73.6	178.4	169.5	-81.8	0	111.8	I920 L921 C922 I927 L928 T979 D983	I920-K924 WeakPolarHBondContact O-CG 3.46Å; I920-K924 PolarHBondContact O-N 3.43Å; L921-K924 WeakPolarHBondContact O-CA 3.34Å; L921-K924 WeakPolarHBondContact O-CB 3.23Å; L921-K924 PolarHBondContact O-N 3.44Å; C922-K924 VanDerWaalsContact C-N 3.3Å; C922-K924 PolarHBondContact O-N 3.02Å; K924-I927 VanDerWaalsContact O-CG2 3.31Å; K924-I927 WeakPolarHBondContact O-CG2 3.36Å; K924-I927 PolarHBondContact O-N 2.8Å; K924-L928 WeakPolarHBondContact O-CB 3.32Å; K924-L928 PolarHBondContact O-N 3.25Å; K924-T979 HydrophobicContact CG-CG2 4.34Å; K924-D983 IonicContact NZ-OD1 3.31Å; K924-D983 PolarHBondContact NZ-OD1 3.05Å; K924-D983 IonicContact NZ-OD2 3.87Å; K924-D983 PolarHBondContact NZ-OD2 3.17Å
925	T	96.9	Very high	94.5	Very high	1 Å²	1	40.4 Å²	40.4	1%	0.006	20%	0.2	C	C	.	.	H	α-helix	trans	-62.7	-42	175.9	-57.1	0	0	0	0	111.6	M886 A889 A890 F893 L921 C922 I927 L928 S929	M886-T925 WeakPolarHBondContact O-CG2 3.46Å; M886-T925 PolarHBondContact O-OG1 2.87Å; A889-T925 HydrophobicContact CB-CG2 4.05Å; A890-T925 HydrophobicContact CB-CG2 3.85Å; A890-T925 VanDerWaalsContact N-CG2 3.32Å; F893-T925 HydrophobicContact CD2-CG2 3.8Å; F893-T925 HydrophobicContact CE2-CG2 3.76Å; L921-T925 PolarHBondContact O-N 2.73Å; L921-T925 PolarHBondContact O-OG1 2.64Å; C922-T925 PolarHBondContact O-N 3.33Å; T925-I927 PolarHBondContact O-N 2.97Å; T925-L928 WeakPolarHBondContact O-CB 3.42Å; T925-L928 PolarHBondContact O-N 2.54Å; T925-S929 PolarHBondContact O-N 2.77Å; T925-S929 PolarHBondContact O-OG 3.01Å
926	L	96.4	Very high	94.5	Very high	1 Å²	1	40.7 Å²	40.7	1%	0.005	20%	0.204	C	C	.	.	H	α-helix	trans	-63.2	-39.9	176.9	-70.3	171	0	0	0	112.9	F893 L911 C922 S929 L930 F962 F966	F893-L926 HydrophobicContact CB-CD2 4.44Å; F893-L926 HydrophobicContact CD2-CD2 3.6Å; F893-L926 HydrophobicContact CD2-CG 4.28Å; F893-L926 HydrophobicContact CE2-CD2 4.1Å; F893-L926 HydrophobicContact CG-CD2 4.2Å; L911-L926 HydrophobicContact CD1-CD2 3.61Å; L911-L926 HydrophobicContact CG-CD2 4.05Å; C922-L926 VanDerWaalsContact O-CG 3.31Å; C922-L926 WeakPolarHBondContact O-CG 3.2Å; C922-L926 PolarHBondContact O-N 3.12Å; L926-S929 WeakPolarHBondContact O-CB 3.48Å; L926-L930 PolarHBondContact O-N 3.05Å; L926-F962 HydrophobicContact CB-CD2 4.17Å; L926-F962 HydrophobicContact CD2-CD1 3.86Å; L926-F962 HydrophobicContact CD2-CD2 3.8Å; L926-F962 HydrophobicContact CD2-CE1 3.85Å; L926-F962 HydrophobicContact CD2-CE2 3.8Å; L926-F962 HydrophobicContact CD2-CG 3.84Å; L926-F962 HydrophobicContact CD2-CZ 3.82Å; L926-F966 HydrophobicContact CD1-CZ 4.25Å
927	I	96.8	Very high	94.4	Very high	1 Å²	1	35.2 Å²	35.2	1%	0.005	18%	0.179	C	C	.	.	H	α-helix	trans	-74.9	-32.6	175.3	-159.6	65	0	0	0	111.9	A923 K924 T925 S929 L930 Q931 L980 D983 F1006 L1010 F1013	A923-I927 PolarHBondContact O-N 3.49Å; K924-I927 VanDerWaalsContact O-CG2 3.31Å; K924-I927 WeakPolarHBondContact O-CG2 3.36Å; K924-I927 PolarHBondContact O-N 2.8Å; T925-I927 PolarHBondContact O-N 2.97Å; I927-S929 VanDerWaalsContact C-N 3.32Å; I927-S929 PolarHBondContact O-N 3.38Å; I927-L930 HydrophobicContact CD1-CD1 4.11Å; I927-L930 PolarHBondContact O-N 3.08Å; I927-Q931 VanDerWaalsContact O-CG 3.23Å; I927-Q931 WeakPolarHBondContact O-CG 3.17Å; I927-Q931 PolarHBondContact O-N 3.03Å; I927-L980 HydrophobicContact CB-CD1 4.29Å; I927-L980 HydrophobicContact CB-CG 4.01Å; I927-L980 HydrophobicContact CD1-CD2 4.39Å; I927-L980 HydrophobicContact CD1-CG 4.2Å; I927-L980 HydrophobicContact CG1-CG 4.3Å; I927-D983 HydrophobicContact CG2-CB 4.1Å; I927-F1006 HydrophobicContact CD1-CE1 3.82Å; I927-F1006 HydrophobicContact CD1-CZ 3.64Å; I927-F1006 HydrophobicContact CG1-CE1 4.21Å; I927-F1006 HydrophobicContact CG1-CZ 4.15Å; I927-L1010 HydrophobicContact CD1-CD1 3.84Å; I927-F1013 HydrophobicContact CD1-CE2 4.49Å
928	L	97.2	Very high	94.4	Very high	61 Å²	61	32 Å²	32	32%	0.319	16%	0.157	S	C	.	.	H	α-helix	trans	-60.1	-41.7	171.4	-179.4	60	0	0	0	111.5	P887 A890 K924 T925 L930 Q931 Q932	P887-L928 HydrophobicContact CB-CD2 4.36Å; A890-L928 HydrophobicContact CB-CB 4Å; A890-L928 HydrophobicContact CB-CD2 3.82Å; A890-L928 HydrophobicContact CB-CG 3.76Å; K924-L928 WeakPolarHBondContact O-CB 3.32Å; K924-L928 PolarHBondContact O-N 3.25Å; T925-L928 WeakPolarHBondContact O-CB 3.42Å; T925-L928 PolarHBondContact O-N 2.54Å; L928-L930 VanDerWaalsContact C-N 3.31Å; L928-L930 PolarHBondContact O-N 3.49Å; L928-Q931 WeakPolarHBondContact O-CB 3.36Å; L928-Q931 PolarHBondContact O-N 3.21Å; L928-Q931 VanDerWaalsContact O-N 3.1Å; L928-Q932 HydrophobicContact CD1-CG 4.49Å; L928-Q932 WeakPolarHBondContact O-CG 3.42Å; L928-Q932 PolarHBondContact O-N 3.38Å
929	S	97.3	Very high	94.2	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-56.1	-45.5	175.9	-41.4	0	0	0	0	111.6	A890 F893 T925 L926 I927 Q932 L933	A890-S929 WeakPolarHBondContact CA-OG 3.44Å; A890-S929 WeakPolarHBondContact O-CB 3.45Å; A890-S929 PolarHBondContact O-OG 2.86Å; F893-S929 WeakPolarHBondContact CB-OG 3.32Å; T925-S929 PolarHBondContact O-N 2.77Å; T925-S929 PolarHBondContact O-OG 3.01Å; L926-S929 WeakPolarHBondContact O-CB 3.48Å; I927-S929 VanDerWaalsContact C-N 3.32Å; I927-S929 PolarHBondContact O-N 3.38Å; S929-Q932 PolarHBondContact O-N 3.16Å; S929-L933 PolarHBondContact O-N 3.09Å
930	L	97	Very high	93.8	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-71.7	-33.7	178.5	-66	169.3	0	0	0	111.9	L926 I927 L928 F934 I955 L958 A959 F962 F1006 V1009 F1013	L926-L930 PolarHBondContact O-N 3.05Å; I927-L930 HydrophobicContact CD1-CD1 4.11Å; I927-L930 PolarHBondContact O-N 3.08Å; L928-L930 VanDerWaalsContact C-N 3.31Å; L928-L930 PolarHBondContact O-N 3.49Å; L930-F934 VanDerWaalsContact O-CB 3.25Å; L930-F934 WeakPolarHBondContact O-CB 3.16Å; L930-F934 PolarHBondContact O-N 3.36Å; L930-I955 HydrophobicContact CD2-CG2 3.97Å; L930-L958 HydrophobicContact CD2-CB 4.35Å; L930-L958 HydrophobicContact CD2-CD2 3.99Å; L930-L958 HydrophobicContact CD2-CG 4.09Å; L930-A959 HydrophobicContact CD1-CB 3.76Å; L930-A959 HydrophobicContact CD2-CB 4.05Å; L930-F962 HydrophobicContact CD1-CD2 3.99Å; L930-F962 HydrophobicContact CD2-CD2 4.31Å; L930-F962 HydrophobicContact CD2-CE2 4.26Å; L930-F962 HydrophobicContact CG-CD2 4.08Å; L930-F962 HydrophobicContact CG-CE2 4.12Å; L930-F1006 HydrophobicContact CB-CE2 3.95Å; L930-F1006 HydrophobicContact CB-CZ 3.99Å; L930-V1009 HydrophobicContact CB-CG1 4.4Å; L930-V1009 HydrophobicContact CD1-CG1 4.12Å; L930-V1009 HydrophobicContact CD2-CG1 4.25Å; L930-F1013 HydrophobicContact CD1-CE2 3.61Å; L930-F1013 HydrophobicContact CD1-CZ 3.67Å
931	Q	95.9	Very high	93.3	Very high	30 Å²	30	40.1 Å²	40.1	14%	0.14	20%	0.198	C	C	.	.	H	α-helix	trans	-67	-38	173.8	-71.1	175.9	29.5	0	0	111.7	I927 L928 F934 N935 D983 F987 F1006	I927-Q931 VanDerWaalsContact O-CG 3.23Å; I927-Q931 WeakPolarHBondContact O-CG 3.17Å; I927-Q931 PolarHBondContact O-N 3.03Å; L928-Q931 WeakPolarHBondContact O-CB 3.36Å; L928-Q931 PolarHBondContact O-N 3.21Å; L928-Q931 VanDerWaalsContact O-N 3.1Å; Q931-F934 PolarHBondContact O-N 2.87Å; Q931-N935 PolarHBondContact O-N 2.94Å; Q931-N935 PolarHBondContact O-ND2 2.73Å; Q931-D983 PolarHBondContact NE2-O 2.98Å; Q931-F987 HydrophobicContact CB-CD2 3.94Å; Q931-F987 HydrophobicContact CB-CE1 4.31Å; Q931-F987 HydrophobicContact CB-CE2 3.7Å; Q931-F987 HydrophobicContact CB-CG 4.34Å; Q931-F987 HydrophobicContact CB-CZ 3.87Å; Q931-F987 HydrophobicContact CG-CB 4.06Å; Q931-F987 HydrophobicContact CG-CD1 3.77Å; Q931-F987 HydrophobicContact CG-CD2 3.59Å; Q931-F987 HydrophobicContact CG-CE1 3.98Å; Q931-F987 HydrophobicContact CG-CE2 3.83Å; Q931-F987 HydrophobicContact CG-CG 3.53Å; Q931-F987 HydrophobicContact CG-CZ 3.99Å; Q931-F987 VanDerWaalsContact OE1-CD2 3.25Å; Q931-F1006 HydrophobicContact CG-CE1 4.08Å; Q931-F1006 HydrophobicContact CG-CE2 4.23Å; Q931-F1006 HydrophobicContact CG-CZ 3.67Å
932	Q	95.1	Very high	92.5	Very high	36 Å²	36	38.4 Å²	38.4	17%	0.168	19%	0.193	C	C	.	.	H	α-helix	trans	-61.4	-57.6	174.7	-74.5	166.1	-41.4	0	0	110.9	A890 D891 K894 L928 S929 F934 N935 E936	A890-Q932 VanDerWaalsContact CB-OE1 3.24Å; D891-Q932 PolarHBondContact OD1-NE2 2.96Å; D891-Q932 VanDerWaalsContact OD1-NE2 3.16Å; D891-Q932 PolarHBondContact OD2-NE2 2.86Å; K894-Q932 HydrophobicContact CD-CB 4.41Å; L928-Q932 HydrophobicContact CD1-CG 4.49Å; L928-Q932 WeakPolarHBondContact O-CG 3.42Å; L928-Q932 PolarHBondContact O-N 3.38Å; S929-Q932 PolarHBondContact O-N 3.16Å; Q932-F934 PolarHBondContact O-N 3.41Å; Q932-F934 VanDerWaalsContact O-N 3.14Å; Q932-N935 WeakPolarHBondContact O-CA 3.39Å; Q932-N935 PolarHBondContact O-N 3.09Å; Q932-E936 WeakPolarHBondContact O-CG 3.46Å; Q932-E936 PolarHBondContact O-N 2.92Å
933	L	93.6	Very high	91.6	Very high	31 Å²	31	42.7 Å²	42.7	16%	0.162	22%	0.221	C	C	.	.	H	α-helix	trans	-52.5	-38	175.1	-71.1	167.7	0	0	0	113.2	K894 S929 L937 I955 L958	K894-L933 HydrophobicContact CB-CD1 3.8Å; K894-L933 HydrophobicContact CB-CD2 4.01Å; K894-L933 HydrophobicContact CB-CG 3.71Å; K894-L933 HydrophobicContact CD-CD2 4.49Å; S929-L933 PolarHBondContact O-N 3.09Å; L933-L937 VanDerWaalsContact O-CB 3.29Å; L933-L937 WeakPolarHBondContact O-CB 3.27Å; L933-L937 PolarHBondContact O-N 3.25Å; L933-I955 HydrophobicContact CB-CD1 3.9Å; L933-I955 HydrophobicContact CB-CG1 4.1Å; L933-L958 HydrophobicContact CD1-CD2 3.44Å; L933-L958 VanDerWaalsContact CD1-CD2 3.44Å
934	F	92.9	Very high	90.6	Very high	4 Å²	4	49.2 Å²	49.2	2%	0.018	26%	0.256	C	S	.	.	H	α-helix	trans	-74.3	-30.6	179.2	-168.4	-92.2	0	0	0	112.9	L930 Q931 Q932 L938 L945 F987 N1003 A1005 F1006	L930-F934 VanDerWaalsContact O-CB 3.25Å; L930-F934 WeakPolarHBondContact O-CB 3.16Å; L930-F934 PolarHBondContact O-N 3.36Å; Q931-F934 PolarHBondContact O-N 2.87Å; Q932-F934 PolarHBondContact O-N 3.41Å; Q932-F934 VanDerWaalsContact O-N 3.14Å; F934-L938 HydrophobicContact CD1-CD1 3.77Å; F934-L938 HydrophobicContact CD1-CG 4.24Å; F934-L938 HydrophobicContact CE1-CD1 3.56Å; F934-L938 HydrophobicContact CE1-CG 4.01Å; F934-L938 WeakPolarHBondContact O-CB 3.34Å; F934-L938 VanDerWaalsContact O-CG 3.26Å; F934-L938 WeakPolarHBondContact O-CG 3.32Å; F934-L938 PolarHBondContact O-N 3.03Å; F934-L938 VanDerWaalsContact O-N 3.08Å; F934-L945 HydrophobicContact CE2-CD1 3.69Å; F934-L945 HydrophobicContact CZ-CD1 3.7Å; F934-F987 HydrophobicContact CB-CE1 4.45Å; F934-F987 AromaticContact CD1-CE1 3.67Å; F934-F987 HydrophobicContact CD1-CE1 3.67Å; F934-F987 AromaticContact CD1-CZ 3.95Å; F934-F987 HydrophobicContact CD1-CZ 3.95Å; F934-F987 HydrophobicContact CE1-CE1 4.32Å; F934-F987 HydrophobicContact CG-CE1 4.34Å; F934-N1003 HydrophobicContact CE1-CB 4.24Å; F934-A1005 HydrophobicContact CE2-CB 4.35Å; F934-A1005 HydrophobicContact CZ-CB 4.06Å; F934-F1006 HydrophobicContact CB-CD2 3.85Å; F934-F1006 HydrophobicContact CB-CE2 4.15Å; F934-F1006 HydrophobicContact CD1-CB 4.28Å; F934-F1006 HydrophobicContact CD1-CD2 4.14Å; F934-F1006 HydrophobicContact CD2-CB 4.49Å; F934-F1006 AromaticContact CD2-CD2 3.92Å; F934-F1006 HydrophobicContact CD2-CD2 3.92Å; F934-F1006 HydrophobicContact CE1-CB 4.09Å; F934-F1006 HydrophobicContact CE2-CB 4.32Å; F934-F1006 HydrophobicContact CG-CB 4.47Å; F934-F1006 AromaticContact CG-CD2 3.69Å; F934-F1006 HydrophobicContact CG-CD2 3.69Å; F934-F1006 HydrophobicContact CG-CE2 4.47Å; F934-F1006 HydrophobicContact CZ-CB 4.12Å
935	N	93.4	Very high	89.7	Confident	65 Å²	65	46.6 Å²	46.6	35%	0.348	25%	0.246	S	C	.	.	H	α-helix	trans	-73.7	-40.2	171.4	-65.3	-42.2	0	0	0	111.7	Q931 Q932 L938 Q939 F987	Q931-N935 PolarHBondContact O-N 2.94Å; Q931-N935 PolarHBondContact O-ND2 2.73Å; Q932-N935 WeakPolarHBondContact O-CA 3.39Å; Q932-N935 PolarHBondContact O-N 3.09Å; N935-L938 PolarHBondContact O-N 2.92Å; N935-Q939 WeakPolarHBondContact O-CB 3.29Å; N935-Q939 PolarHBondContact O-N 3.32Å; N935-F987 WeakPolarHBondContact OD1-CE2 3.44Å; N935-F987 VanDerWaalsContact OD1-CZ 3.31Å; N935-F987 WeakPolarHBondContact OD1-CZ 3.5Å
936	E	91.4	Very high	88.9	Confident	70 Å²	70	50.6 Å²	50.6	33%	0.327	27%	0.267	S	S	.	.	H	α-helix	trans	-56.4	-51.5	173.1	-68.5	160.2	-165.8	0	0	109.5	K894 Q932 L938 Q939 D940	K894-E936 IonicContact NZ-OE1 2.66Å; K894-E936 PolarHBondContact NZ-OE1 3.24Å; Q932-E936 WeakPolarHBondContact O-CG 3.46Å; Q932-E936 PolarHBondContact O-N 2.92Å; E936-L938 VanDerWaalsContact C-N 3.34Å; E936-L938 PolarHBondContact O-N 3.38Å; E936-Q939 WeakPolarHBondContact O-CA 3.4Å; E936-Q939 WeakPolarHBondContact O-CB 3.48Å; E936-Q939 PolarHBondContact O-N 3.47Å; E936-D940 PolarHBondContact O-N 3.17Å; E936-D940 VanDerWaalsContact O-N 3.09Å
937	L	89.1	Confident	87.8	Confident	9 Å²	9	54.1 Å²	54.1	5%	0.047	28%	0.28	C	S	.	.	H	α-helix	trans	-59.7	-38.2	175.4	-176.7	61.1	0	0	0	113.8	L933 Q939 Q941 L945 H951 V952 I955	L933-L937 VanDerWaalsContact O-CB 3.29Å; L933-L937 WeakPolarHBondContact O-CB 3.27Å; L933-L937 PolarHBondContact O-N 3.25Å; L937-Q939 VanDerWaalsContact C-N 3.31Å; L937-Q941 VanDerWaalsContact CD1-CD 3.47Å; L937-Q941 HydrophobicContact CD1-CG 3.97Å; L937-Q941 WeakPolarHBondContact O-CB 3.49Å; L937-Q941 PolarHBondContact O-N 2.97Å; L937-L945 HydrophobicContact CD2-CD1 4.22Å; L937-L945 HydrophobicContact CD2-CD2 4.42Å; L937-L945 HydrophobicContact CG-CD1 4.44Å; L937-L945 HydrophobicContact CG-CD2 3.92Å; L937-H951 HydrophobicContact CD1-CB 3.62Å; L937-H951 HydrophobicContact CD2-CB 4.31Å; L937-V952 HydrophobicContact CD2-CG2 3.7Å; L937-I955 HydrophobicContact CB-CD1 4.35Å; L937-I955 HydrophobicContact CD2-CD1 3.78Å
938	L	88.6	Confident	86.9	Confident	25 Å²	25	60 Å²	60	13%	0.131	32%	0.316	C	S	.	.	H	α-helix	trans	-69.4	-25.7	174.1	-81.3	173.9	0	0	0	113.2	F934 N935 E936 G942 L945 I1002	F934-L938 HydrophobicContact CD1-CD1 3.77Å; F934-L938 HydrophobicContact CD1-CG 4.24Å; F934-L938 HydrophobicContact CE1-CD1 3.56Å; F934-L938 HydrophobicContact CE1-CG 4.01Å; F934-L938 WeakPolarHBondContact O-CB 3.34Å; F934-L938 VanDerWaalsContact O-CG 3.26Å; F934-L938 WeakPolarHBondContact O-CG 3.32Å; F934-L938 PolarHBondContact O-N 3.03Å; F934-L938 VanDerWaalsContact O-N 3.08Å; N935-L938 PolarHBondContact O-N 2.92Å; E936-L938 VanDerWaalsContact C-N 3.34Å; E936-L938 PolarHBondContact O-N 3.38Å; L938-G942 CarbonylContact O-C 3.57Å; L938-G942 WeakPolarHBondContact O-CA 3.48Å; L938-G942 PolarHBondContact O-N 2.94Å; L938-L945 HydrophobicContact CD2-CD1 3.92Å; L938-L945 HydrophobicContact CD2-CD2 4.17Å; L938-L945 HydrophobicContact CD2-CG 3.9Å; L938-L945 HydrophobicContact CG-CD1 4.3Å; L938-I1002 HydrophobicContact CD1-CG2 4.36Å; L938-I1002 HydrophobicContact CD2-CG2 4.44Å
939	Q	88.6	Confident	86.2	Confident	167 Å²	167	58 Å²	58	78%	0.78	31%	0.307	S	S	*	.	H	α-helix	trans	-74.9	-42.3	176.2	-176.7	172.3	-58.7	0	0	110.7	N935 E936 L937	N935-Q939 WeakPolarHBondContact O-CB 3.29Å; N935-Q939 PolarHBondContact O-N 3.32Å; E936-Q939 WeakPolarHBondContact O-CA 3.4Å; E936-Q939 WeakPolarHBondContact O-CB 3.48Å; E936-Q939 PolarHBondContact O-N 3.47Å; L937-Q939 VanDerWaalsContact C-N 3.31Å
940	D	84.9	Confident	85.6	Confident	131 Å²	131	62.2 Å²	62.2	70%	0.701	34%	0.336	S	S	*	.	H	α-helix	trans	-77	-45.1	-178.2	-62.9	-21.1	0	0	0	113	E936	E936-D940 PolarHBondContact O-N 3.17Å; E936-D940 VanDerWaalsContact O-N 3.09Å
941	Q	83.4	Confident	84.9	Confident	78 Å²	78	67.4 Å²	67.4	36%	0.364	36%	0.36	S	S	.	.	H	α-helix	trans	-100	-10.6	-174.9	-60.4	-172.5	3.3	0	0	113.9	L937 L945	L937-Q941 VanDerWaalsContact CD1-CD 3.47Å; L937-Q941 HydrophobicContact CD1-CG 3.97Å; L937-Q941 WeakPolarHBondContact O-CB 3.49Å; L937-Q941 PolarHBondContact O-N 2.97Å; Q941-L945 HydrophobicContact CB-CD2 3.8Å
942	G	78.6	Confident	84.3	Confident	19 Å²	19	66.4 Å²	66.4	20%	0.196	36%	0.357	C	S	.	.			trans	74.9	-176.7	-175.6	0	0	0	0	0	114.2	L938 N944 L945	L938-G942 CarbonylContact O-C 3.57Å; L938-G942 WeakPolarHBondContact O-CA 3.48Å; L938-G942 PolarHBondContact O-N 2.94Å; G942-N944 PolarHBondContact O-N 3.24Å; G942-N944 VanDerWaalsContact O-N 3.11Å; G942-L945 WeakPolarHBondContact O-CD2 3.4Å
943	P	74.3	Confident	84	Confident	90 Å²	90	68.3 Å²	68.3	58%	0.584	37%	0.374	S	S	*	.	S	Bend	trans	-75.2	0.3	-169.6	31.3	-38	0	0	0	115.6	I1002	P943-I1002 HydrophobicContact CB-CG2 4.06Å
944	N	75.1	Confident	83.7	Confident	137 Å²	137	68.2 Å²	68.2	73%	0.733	38%	0.381	S	S	*	.	S	Bend	trans	-110.7	54.9	-178.3	-69.9	-17.8	0	0	0	110.6	G942 D946	G942-N944 PolarHBondContact O-N 3.24Å; G942-N944 VanDerWaalsContact O-N 3.11Å; N944-D946 PolarHBondContact O-N 3.18Å
945	L	77.8	Confident	83.7	Confident	23 Å²	23	68.7 Å²	68.7	12%	0.12	38%	0.383	C	S	.	.			trans	-56	133.2	-176.2	-61.4	-178.7	0	0	0	112.8	F934 L937 L938 Q941 G942 R947	F934-L945 HydrophobicContact CE2-CD1 3.69Å; F934-L945 HydrophobicContact CZ-CD1 3.7Å; L937-L945 HydrophobicContact CD2-CD1 4.22Å; L937-L945 HydrophobicContact CD2-CD2 4.42Å; L937-L945 HydrophobicContact CG-CD1 4.44Å; L937-L945 HydrophobicContact CG-CD2 3.92Å; L938-L945 HydrophobicContact CD2-CD1 3.92Å; L938-L945 HydrophobicContact CD2-CD2 4.17Å; L938-L945 HydrophobicContact CD2-CG 3.9Å; L938-L945 HydrophobicContact CG-CD1 4.3Å; Q941-L945 HydrophobicContact CB-CD2 3.8Å; G942-L945 WeakPolarHBondContact O-CD2 3.4Å; L945-R947 PolarHBondContact O-N 2.63Å
946	D	79.4	Confident	83.7	Confident	85 Å²	85	67.8 Å²	67.8	46%	0.455	38%	0.376	S	S	.	.			trans	-74.1	110.1	162.9	177.5	11.6	0	0	0	109.5	N944 T948 S949 V952	N944-D946 PolarHBondContact O-N 3.18Å; D946-T948 VanDerWaalsContact CG-OG1 3.31Å; D946-T948 PolarHBondContact O-N 3.14Å; D946-T948 WeakPolarHBondContact OD1-CB 3.24Å; D946-T948 PolarHBondContact OD1-N 2.75Å; D946-T948 PolarHBondContact OD1-OG1 2.8Å; D946-T948 PolarHBondContact OD2-OG1 3.01Å; D946-S949 VanDerWaalsContact O-CB 3.27Å; D946-S949 WeakPolarHBondContact O-CB 3.36Å; D946-S949 PolarHBondContact O-N 2.82Å; D946-S949 VanDerWaalsContact O-N 3.14Å; D946-S949 PolarHBondContact O-OG 3.15Å; D946-V952 WeakPolarHBondContact O-CG2 3.46Å
947	R	74.3	Confident	83.7	Confident	75 Å²	75	66.9 Å²	66.9	28%	0.283	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-11.1	179.7	-65.6	171.7	-69.4	153.5	-3.7	113.7	L945 E1008 D1043	L945-R947 PolarHBondContact O-N 2.63Å; R947-E1008 WeakPolarHBondContact CD-OE1 3.44Å; R947-E1008 IonicContact NH1-OE1 3.13Å; R947-D1043 VanDerWaalsContact CZ-O 3.3Å; R947-D1043 PolarHBondContact NH1-O 2.97Å; R947-D1043 PolarHBondContact NH2-O 2.59Å; R947-D1043 VanDerWaalsContact NH2-O 3.07Å
948	T	76.9	Confident	84	Confident	125 Å²	125	66.6 Å²	66.6	77%	0.767	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.9	-6.2	172.5	66	0	0	0	0	113.1	D946	D946-T948 VanDerWaalsContact CG-OG1 3.31Å; D946-T948 PolarHBondContact O-N 3.14Å; D946-T948 WeakPolarHBondContact OD1-CB 3.24Å; D946-T948 PolarHBondContact OD1-N 2.75Å; D946-T948 PolarHBondContact OD1-OG1 2.8Å; D946-T948 PolarHBondContact OD2-OG1 3.01Å
949	S	83.6	Confident	84.3	Confident	17 Å²	17	65.4 Å²	65.4	12%	0.119	36%	0.364	C	S	.	.	S	Bend	trans	-63.4	148.8	178.9	68.5	0	0	0	0	113.3	D946 H951 V952 S953	D946-S949 VanDerWaalsContact O-CB 3.27Å; D946-S949 WeakPolarHBondContact O-CB 3.36Å; D946-S949 PolarHBondContact O-N 2.82Å; D946-S949 VanDerWaalsContact O-N 3.14Å; D946-S949 PolarHBondContact O-OG 3.15Å; S949-H951 PolarHBondContact O-N 3.36Å; S949-V952 PolarHBondContact O-N 3.12Å; S949-V952 WeakPolarHBondContact OG-CG2 3.45Å; S949-V952 PolarHBondContact OG-N 2.89Å; S949-S953 PolarHBondContact O-N 3.18Å
950	S	83.4	Confident	84.6	Confident	89 Å²	89	61.9 Å²	61.9	62%	0.622	34%	0.344	S	S	*	.	H	α-helix	trans	-52.7	-39.2	173.6	49.4	0	0	0	0	112.7	S953 G954	S950-S953 WeakPolarHBondContact O-CB 3.47Å; S950-S953 PolarHBondContact O-N 2.99Å; S950-G954 PolarHBondContact O-N 3.38Å
951	H	82.8	Confident	84.9	Confident	109 Å²	109	58.7 Å²	58.7	51%	0.505	32%	0.322	S	S	.	.	H	α-helix	trans	-65.6	-47.4	-179.8	-57.1	-94.6	0	0	0	112.3	L937 S949 S953 G954 I955	L937-H951 HydrophobicContact CD1-CB 3.62Å; L937-H951 HydrophobicContact CD2-CB 4.31Å; S949-H951 PolarHBondContact O-N 3.36Å; H951-S953 VanDerWaalsContact C-N 3.3Å; H951-S953 PolarHBondContact O-N 3.46Å; H951-G954 PolarHBondContact O-N 2.68Å; H951-I955 PolarHBondContact O-N 3.38Å; H951-I955 VanDerWaalsContact O-N 3.17Å
952	V	84.1	Confident	85.4	Confident	10 Å²	10	55 Å²	55	6%	0.061	31%	0.305	C	S	.	.	H	α-helix	trans	-62.7	-39.9	174.5	174.3	0	0	0	0	110.8	L937 D946 S949 I955 K956	L937-V952 HydrophobicContact CD2-CG2 3.7Å; D946-V952 WeakPolarHBondContact O-CG2 3.46Å; S949-V952 PolarHBondContact O-N 3.12Å; S949-V952 WeakPolarHBondContact OG-CG2 3.45Å; S949-V952 PolarHBondContact OG-N 2.89Å; V952-I955 PolarHBondContact O-N 2.96Å; V952-K956 HydrophobicContact CG1-CD 4.01Å; V952-K956 WeakPolarHBondContact O-CG 3.35Å; V952-K956 PolarHBondContact O-N 3.49Å
953	S	87.2	Confident	86.1	Confident	75 Å²	75	54.1 Å²	54.1	52%	0.524	30%	0.296	S	S	.	.	H	α-helix	trans	-62.3	-41.9	176.1	-163.2	0	0	0	0	112.3	S949 S950 H951 K956 E957	S949-S953 PolarHBondContact O-N 3.18Å; S950-S953 WeakPolarHBondContact O-CB 3.47Å; S950-S953 PolarHBondContact O-N 2.99Å; H951-S953 VanDerWaalsContact C-N 3.3Å; H951-S953 PolarHBondContact O-N 3.46Å; S953-K956 PolarHBondContact O-N 2.89Å; S953-E957 PolarHBondContact O-N 3.37Å
954	G	88.9	Confident	86.8	Confident	30 Å²	30	51.7 Å²	51.7	31%	0.309	28%	0.278	S	S	.	.	H	α-helix	trans	-62.1	-42.3	177.2	0	0	0	0	0	113.6	S950 H951 K956 E957 L958	S950-G954 PolarHBondContact O-N 3.38Å; H951-G954 PolarHBondContact O-N 2.68Å; G954-K956 VanDerWaalsContact C-N 3.31Å; G954-K956 PolarHBondContact O-N 3.44Å; G954-E957 PolarHBondContact O-N 3.3Å; G954-L958 PolarHBondContact O-N 3.27Å
955	I	92.6	Very high	87.4	Confident	14 Å²	14	46.5 Å²	46.5	7%	0.072	25%	0.251	C	S	.	.	H	α-helix	trans	-65	-36.4	175.2	-60.2	173.9	0	0	0	110.8	L930 L933 L937 H951 V952 A959 V1009	L930-I955 HydrophobicContact CD2-CG2 3.97Å; L933-I955 HydrophobicContact CB-CD1 3.9Å; L933-I955 HydrophobicContact CB-CG1 4.1Å; L937-I955 HydrophobicContact CB-CD1 4.35Å; L937-I955 HydrophobicContact CD2-CD1 3.78Å; H951-I955 PolarHBondContact O-N 3.38Å; H951-I955 VanDerWaalsContact O-N 3.17Å; V952-I955 PolarHBondContact O-N 2.96Å; I955-A959 WeakPolarHBondContact O-CB 3.42Å; I955-A959 PolarHBondContact O-N 2.93Å; I955-V1009 HydrophobicContact CG2-CG1 3.83Å; I955-V1009 HydrophobicContact CG2-CG2 3.86Å
956	K	92.6	Very high	87.7	Confident	45 Å²	45	45.8 Å²	45.8	20%	0.196	25%	0.247	C	C	.	.	H	α-helix	trans	-69.8	-38.6	175.5	-68.7	167.8	67.3	174.9	0	112.3	V952 S953 G954 A959 R960 E1008 V1009	V952-K956 HydrophobicContact CG1-CD 4.01Å; V952-K956 WeakPolarHBondContact O-CG 3.35Å; V952-K956 PolarHBondContact O-N 3.49Å; S953-K956 PolarHBondContact O-N 2.89Å; G954-K956 VanDerWaalsContact C-N 3.31Å; G954-K956 PolarHBondContact O-N 3.44Å; K956-A959 PolarHBondContact O-N 2.9Å; K956-R960 PolarHBondContact O-N 3.46Å; K956-E1008 HydrophobicContact CD-CB 4.25Å; K956-E1008 IonicContact NZ-OE2 3.71Å; K956-E1008 PolarHBondContact NZ-OE2 2.98Å; K956-V1009 HydrophobicContact CG-CG2 3.99Å
957	E	92.1	Very high	87.6	Confident	51 Å²	51	42.3 Å²	42.3	24%	0.238	23%	0.231	C	C	.	.	H	α-helix	trans	-61.3	-47	171.8	178.6	62	-148.4	0	0	111.5	M897 S953 G954 A959 R960 R961	M897-E957 HydrophobicContact CE-CB 4.05Å; M897-E957 HydrophobicContact CE-CG 3.36Å; M897-E957 HydrophobicContact SD-CB 3.99Å; M897-E957 HydrophobicContact SD-CG 3.53Å; M897-E957 VanDerWaalsContact SD-CG 3.53Å; S953-E957 PolarHBondContact O-N 3.37Å; G954-E957 PolarHBondContact O-N 3.3Å; E957-A959 PolarHBondContact O-N 3.45Å; E957-R960 PolarHBondContact O-N 3.26Å; E957-R960 IonicContact OE1-NH1 3.32Å; E957-R960 IonicContact OE2-CZ 3.45Å; E957-R960 IonicContact OE2-NH1 3.95Å; E957-R960 PolarHBondContact OE2-NH1 3.03Å; E957-R960 IonicContact OE2-NH2 3.8Å; E957-R960 PolarHBondContact OE2-NH2 3.4Å; E957-R961 WeakPolarHBondContact O-CG 3.39Å; E957-R961 PolarHBondContact O-N 3.31Å; E957-R961 IonicContact OE1-CZ 3.47Å; E957-R961 IonicContact OE1-NE 3.67Å; E957-R961 PolarHBondContact OE1-NE 2.97Å; E957-R961 IonicContact OE1-NH2 3.46Å
958	L	94.5	Very high	87.7	Confident	4 Å²	4	44.6 Å²	44.6	2%	0.021	25%	0.248	C	C	.	.	H	α-helix	trans	-60.2	-45.1	175.7	-179.1	62.9	0	0	0	111.6	Y896 M897 L930 L933 G954 R960 R961 F962	Y896-L958 HydrophobicContact CD1-CD1 3.81Å; Y896-L958 HydrophobicContact CG-CD1 4.44Å; M897-L958 HydrophobicContact CB-CD1 4.3Å; M897-L958 HydrophobicContact CG-CB 4.45Å; M897-L958 HydrophobicContact CG-CD1 3.93Å; M897-L958 HydrophobicContact SD-CB 3.83Å; M897-L958 HydrophobicContact SD-CD1 4.37Å; M897-L958 PolarHBondContact SD-N 3.43Å; M897-L958 VanDerWaalsContact SD-N 3.43Å; L930-L958 HydrophobicContact CD2-CB 4.35Å; L930-L958 HydrophobicContact CD2-CD2 3.99Å; L930-L958 HydrophobicContact CD2-CG 4.09Å; L933-L958 HydrophobicContact CD1-CD2 3.44Å; L933-L958 VanDerWaalsContact CD1-CD2 3.44Å; G954-L958 PolarHBondContact O-N 3.27Å; L958-R960 VanDerWaalsContact C-N 3.32Å; L958-R960 PolarHBondContact O-N 2.89Å; L958-R961 PolarHBondContact O-N 3.05Å; L958-F962 HydrophobicContact CD1-CD1 4.17Å; L958-F962 HydrophobicContact CD1-CE1 3.61Å; L958-F962 HydrophobicContact CD1-CE2 4.22Å; L958-F962 HydrophobicContact CD1-CZ 3.64Å; L958-F962 HydrophobicContact CD2-CE2 4.19Å; L958-F962 HydrophobicContact CD2-CZ 4.11Å; L958-F962 HydrophobicContact CG-CD2 4.37Å; L958-F962 HydrophobicContact CG-CE1 4.22Å; L958-F962 HydrophobicContact CG-CE2 3.94Å; L958-F962 HydrophobicContact CG-CZ 3.85Å; L958-F962 WeakPolarHBondContact O-CG 3.32Å; L958-F962 PolarHBondContact O-N 2.83Å
959	A	95.6	Very high	87.9	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-60.2	-38.8	176	0	0	0	0	0	113	L930 I955 K956 E957 F962 A963 V1009 E1012 F1013	L930-A959 HydrophobicContact CD1-CB 3.76Å; L930-A959 HydrophobicContact CD2-CB 4.05Å; I955-A959 WeakPolarHBondContact O-CB 3.42Å; I955-A959 PolarHBondContact O-N 2.93Å; K956-A959 PolarHBondContact O-N 2.9Å; E957-A959 PolarHBondContact O-N 3.45Å; A959-F962 PolarHBondContact O-N 3.26Å; A959-A963 WeakPolarHBondContact O-CB 3.47Å; A959-A963 PolarHBondContact O-N 3.27Å; A959-V1009 HydrophobicContact CB-CG1 3.5Å; A959-V1009 VanDerWaalsContact CB-CG1 3.5Å; A959-E1012 HydrophobicContact CB-CB 4.42Å; A959-E1012 HydrophobicContact CB-CG 4.3Å; A959-F1013 HydrophobicContact CB-CE2 3.73Å; A959-F1013 HydrophobicContact CB-CZ 4.25Å; A959-F1013 WeakPolarHBondContact O-CZ 3.47Å
960	R	93.8	Very high	87.8	Confident	92 Å²	92	43.3 Å²	43.3	35%	0.347	23%	0.234	S	C	.	.	H	α-helix	trans	-67.2	-42.2	175.3	-156.2	-178.9	-23.8	96	8.8	111.8	K956 E957 L958 F962 A963 L964 E1012	K956-R960 PolarHBondContact O-N 3.46Å; E957-R960 PolarHBondContact O-N 3.26Å; E957-R960 IonicContact OE1-NH1 3.32Å; E957-R960 IonicContact OE2-CZ 3.45Å; E957-R960 IonicContact OE2-NH1 3.95Å; E957-R960 PolarHBondContact OE2-NH1 3.03Å; E957-R960 IonicContact OE2-NH2 3.8Å; E957-R960 PolarHBondContact OE2-NH2 3.4Å; L958-R960 VanDerWaalsContact C-N 3.32Å; L958-R960 PolarHBondContact O-N 2.89Å; R960-F962 PolarHBondContact O-N 3.2Å; R960-A963 WeakPolarHBondContact O-CB 3.38Å; R960-A963 PolarHBondContact O-N 3.45Å; R960-L964 HydrophobicContact CG-CD1 4.45Å; R960-L964 WeakPolarHBondContact O-CD1 3.44Å; R960-L964 VanDerWaalsContact O-CG 3.22Å; R960-L964 WeakPolarHBondContact O-CG 3.42Å; R960-L964 PolarHBondContact O-N 2.78Å; R960-L964 VanDerWaalsContact O-N 3.07Å; R960-E1012 HydrophobicContact CB-CB 4.19Å; R960-E1012 HydrophobicContact CB-CG 4.23Å; R960-E1012 WeakPolarHBondContact CB-OE2 3.49Å; R960-E1012 VanDerWaalsContact CD-OE2 3.23Å; R960-E1012 WeakPolarHBondContact CD-OE2 3.5Å; R960-E1012 HydrophobicContact CG-CB 4.4Å; R960-E1012 WeakPolarHBondContact CG-OE2 3.26Å; R960-E1012 IonicContact NE-OE2 2.76Å; R960-E1012 PolarHBondContact NE-OE2 3.35Å
961	R	91.7	Very high	87.8	Confident	65 Å²	65	45.7 Å²	45.7	25%	0.245	24%	0.238	C	C	.	.	H	α-helix	trans	-59.1	-45.4	173.2	-68.1	-179.7	177.3	-137.7	-2.6	111.3	Y896 E957 L958 L964 T965 M1204	Y896-R961 HydrophobicContact CE1-CB 4.34Å; E957-R961 WeakPolarHBondContact O-CG 3.39Å; E957-R961 PolarHBondContact O-N 3.31Å; E957-R961 IonicContact OE1-CZ 3.47Å; E957-R961 IonicContact OE1-NE 3.67Å; E957-R961 PolarHBondContact OE1-NE 2.97Å; E957-R961 IonicContact OE1-NH2 3.46Å; L958-R961 PolarHBondContact O-N 3.05Å; R961-L964 PolarHBondContact O-N 3.25Å; R961-T965 WeakPolarHBondContact O-CG2 3.47Å; R961-T965 PolarHBondContact O-N 3.44Å; R961-M1204 HydrophobicContact CB-CE 4.22Å; R961-M1204 HydrophobicContact CG-CE 3.97Å
962	F	94.7	Very high	87.8	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-61.6	-43	173.2	-71.3	-9.7	0	0	0	112.8	F893 Y896 L911 L926 L930 L958 A959 R960 L964 T965 F1013	F893-F962 HydrophobicContact CB-CZ 3.97Å; F893-F962 WeakPolarHBondContact O-CZ 3.34Å; Y896-F962 HydrophobicContact CD1-CE1 4.02Å; L911-F962 HydrophobicContact CD1-CD1 4.02Å; L911-F962 HydrophobicContact CD1-CE1 4.01Å; L926-F962 HydrophobicContact CB-CD2 4.17Å; L926-F962 HydrophobicContact CD2-CD1 3.86Å; L926-F962 HydrophobicContact CD2-CD2 3.8Å; L926-F962 HydrophobicContact CD2-CE1 3.85Å; L926-F962 HydrophobicContact CD2-CE2 3.8Å; L926-F962 HydrophobicContact CD2-CG 3.84Å; L926-F962 HydrophobicContact CD2-CZ 3.82Å; L930-F962 HydrophobicContact CD1-CD2 3.99Å; L930-F962 HydrophobicContact CD2-CD2 4.31Å; L930-F962 HydrophobicContact CD2-CE2 4.26Å; L930-F962 HydrophobicContact CG-CD2 4.08Å; L930-F962 HydrophobicContact CG-CE2 4.12Å; L958-F962 HydrophobicContact CD1-CD1 4.17Å; L958-F962 HydrophobicContact CD1-CE1 3.61Å; L958-F962 HydrophobicContact CD1-CE2 4.22Å; L958-F962 HydrophobicContact CD1-CZ 3.64Å; L958-F962 HydrophobicContact CD2-CE2 4.19Å; L958-F962 HydrophobicContact CD2-CZ 4.11Å; L958-F962 HydrophobicContact CG-CD2 4.37Å; L958-F962 HydrophobicContact CG-CE1 4.22Å; L958-F962 HydrophobicContact CG-CE2 3.94Å; L958-F962 HydrophobicContact CG-CZ 3.85Å; L958-F962 WeakPolarHBondContact O-CG 3.32Å; L958-F962 PolarHBondContact O-N 2.83Å; A959-F962 PolarHBondContact O-N 3.26Å; R960-F962 PolarHBondContact O-N 3.2Å; F962-L964 PolarHBondContact O-N 3.44Å; F962-T965 WeakPolarHBondContact O-CB 3.36Å; F962-T965 PolarHBondContact O-N 2.99Å; F962-T965 VanDerWaalsContact O-N 3.08Å; F962-T965 PolarHBondContact O-OG1 2.89Å; F962-F1013 HydrophobicContact CB-CE1 3.89Å; F962-F1013 HydrophobicContact CB-CZ 3.8Å
963	A	92.1	Very high	87.9	Confident	1 Å²	1	47.4 Å²	47.4	1%	0.008	24%	0.244	C	C	.	.	H	α-helix	trans	-58	-37.7	177.3	0	0	0	0	0	111.9	A959 R960 T965 F966 F1013 K1016	A959-A963 WeakPolarHBondContact O-CB 3.47Å; A959-A963 PolarHBondContact O-N 3.27Å; R960-A963 WeakPolarHBondContact O-CB 3.38Å; R960-A963 PolarHBondContact O-N 3.45Å; A963-T965 VanDerWaalsContact C-N 3.29Å; A963-T965 PolarHBondContact O-N 3.14Å; A963-F966 PolarHBondContact O-N 3.13Å; A963-F1013 HydrophobicContact CB-CB 4.45Å; A963-F1013 HydrophobicContact CB-CD1 3.54Å; A963-F1013 HydrophobicContact CB-CE1 3.9Å; A963-F1013 HydrophobicContact CB-CG 4.01Å; A963-K1016 HydrophobicContact CB-CG 4.49Å; A963-K1016 WeakPolarHBondContact O-CE 3.49Å; A963-K1016 WeakPolarHBondContact O-CG 3.42Å
964	L	90.4	Very high	88	Confident	39 Å²	39	48 Å²	48	20%	0.204	24%	0.235	C	C	.	.	H	α-helix	trans	-68.4	-25.4	179.6	-66.7	160.7	0	0	0	112.8	R960 R961 F962 F966 G967 V1203 M1204	R960-L964 HydrophobicContact CG-CD1 4.45Å; R960-L964 WeakPolarHBondContact O-CD1 3.44Å; R960-L964 VanDerWaalsContact O-CG 3.22Å; R960-L964 WeakPolarHBondContact O-CG 3.42Å; R960-L964 PolarHBondContact O-N 2.78Å; R960-L964 VanDerWaalsContact O-N 3.07Å; R961-L964 PolarHBondContact O-N 3.25Å; F962-L964 PolarHBondContact O-N 3.44Å; L964-F966 PolarHBondContact O-N 2.57Å; L964-F966 VanDerWaalsContact O-N 3.15Å; L964-G967 PolarHBondContact O-N 3.13Å; L964-V1203 HydrophobicContact CD2-CG1 3.98Å; L964-V1203 WeakPolarHBondContact CD2-O 3.28Å; L964-M1204 HydrophobicContact CB-CG 4.43Å; L964-M1204 HydrophobicContact CB-SD 3.44Å; L964-M1204 WeakPolarHBondContact CB-SD 3.28Å; L964-M1204 HydrophobicContact CD1-SD 3.55Å; L964-M1204 VanDerWaalsContact CD1-SD 3.55Å; L964-M1204 HydrophobicContact CG-SD 4.09Å
965	T	86.2	Confident	88.2	Confident	28 Å²	28	52.8 Å²	52.8	17%	0.172	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-16.1	174.9	75.3	0	0	0	0	114.6	L911 R915 R961 F962 A963 G967	L911-T965 HydrophobicContact CD1-CG2 4.13Å; L911-T965 HydrophobicContact CD2-CG2 3.76Å; R915-T965 PolarHBondContact NH1-O 3.4Å; R961-T965 WeakPolarHBondContact O-CG2 3.47Å; R961-T965 PolarHBondContact O-N 3.44Å; F962-T965 WeakPolarHBondContact O-CB 3.36Å; F962-T965 PolarHBondContact O-N 2.99Å; F962-T965 VanDerWaalsContact O-N 3.08Å; F962-T965 PolarHBondContact O-OG1 2.89Å; A963-T965 VanDerWaalsContact C-N 3.29Å; A963-T965 PolarHBondContact O-N 3.14Å; T965-G967 PolarHBondContact O-N 3.4Å
966	F	84.6	Confident	88.2	Confident	7 Å²	7	52.2 Å²	52.2	3%	0.031	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.1	0.8	172.3	-63.6	-71.6	0	0	0	113.8	A923 L926 A963 L964 T973 A976 V977 L980 F1013	A923-F966 HydrophobicContact CB-CE1 3.95Å; A923-F966 HydrophobicContact CB-CZ 3.73Å; L926-F966 HydrophobicContact CD1-CZ 4.25Å; A963-F966 PolarHBondContact O-N 3.13Å; L964-F966 PolarHBondContact O-N 2.57Å; L964-F966 VanDerWaalsContact O-N 3.15Å; F966-T973 HydrophobicContact CB-CG2 4.15Å; F966-T973 HydrophobicContact CD1-CG2 4Å; F966-T973 WeakPolarHBondContact O-CG2 3.33Å; F966-T973 PolarHBondContact O-OG1 3.34Å; F966-A976 HydrophobicContact CE1-CB 4.23Å; F966-V977 HydrophobicContact CB-CG2 4.07Å; F966-V977 HydrophobicContact CD1-CG2 3.75Å; F966-V977 HydrophobicContact CD2-CG2 3.87Å; F966-V977 HydrophobicContact CE1-CG2 4.13Å; F966-V977 HydrophobicContact CE2-CG2 4.24Å; F966-V977 HydrophobicContact CG-CG2 3.61Å; F966-V977 HydrophobicContact CZ-CG2 4.36Å; F966-L980 HydrophobicContact CE2-CD1 4.13Å; F966-L980 HydrophobicContact CZ-CD1 4.19Å; F966-F1013 HydrophobicContact CE2-CD1 4.09Å; F966-F1013 HydrophobicContact CE2-CE1 4.04Å
967	G	78.4	Confident	88.2	Confident	13 Å²	13	50.1 Å²	50.1	13%	0.134	24%	0.238	C	C	.	.			trans	71.8	-155.4	171.8	0	0	0	0	0	114.6	L964 T965 K1016	L964-G967 PolarHBondContact O-N 3.13Å; T965-G967 PolarHBondContact O-N 3.4Å; G967-K1016 PolarHBondContact O-NZ 2.99Å
968	L	76.1	Confident	88.4	Confident	122 Å²	122	48.3 Å²	48.3	64%	0.639	23%	0.231	S	C	*	.	S	Bend	trans	-101.7	-24	174.6	-65.5	176.9	0	0	0	113.1	Q970 V1203	L968-Q970 VanDerWaalsContact C-N 3.31Å; L968-Q970 PolarHBondContact O-N 3.23Å; L968-V1203 HydrophobicContact CD1-CG2 4.22Å; L968-V1203 HydrophobicContact CD2-CG1 3.78Å; L968-V1203 HydrophobicContact CD2-CG2 4.3Å; L968-V1203 HydrophobicContact CG-CG1 4.27Å; L968-V1203 HydrophobicContact CG-CG2 3.91Å
969	D	80.3	Confident	88.4	Confident	53 Å²	53	48.7 Å²	48.7	28%	0.283	23%	0.234	S	C	.	.			trans	-78.5	79.6	178.4	-170.2	-25.8	0	0	0	110.9	I971 K972 T973	D969-I971 PolarHBondContact O-N 3.41Å; D969-I971 VanDerWaalsContact O-N 3.08Å; D969-I971 WeakPolarHBondContact OD1-CB 3.41Å; D969-I971 PolarHBondContact OD1-N 3.18Å; D969-I971 VanDerWaalsContact OD1-N 3.13Å; D969-K972 HydrophobicContact CB-CB 4.32Å; D969-K972 PolarHBondContact O-N 3.38Å; D969-K972 PolarHBondContact OD1-N 3.46Å; D969-K972 VanDerWaalsContact OD2-CD 3.22Å; D969-K972 WeakPolarHBondContact OD2-CD 3.1Å; D969-K972 VanDerWaalsContact OD2-CE 3.3Å; D969-K972 WeakPolarHBondContact OD2-CE 3.41Å; D969-K972 VanDerWaalsContact OD2-CG 3.28Å; D969-K972 WeakPolarHBondContact OD2-CG 3.47Å; D969-K972 IonicContact OD2-NZ 3.55Å; D969-K972 PolarHBondContact OD2-NZ 3.2Å; D969-T973 PolarHBondContact O-OG1 3.37Å
970	Q	82	Confident	88.4	Confident	63 Å²	63	48.7 Å²	48.7	29%	0.294	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-11	177.8	-58.6	-173.9	-9.2	0	0	113.4	L968 R974 S1015 I1018	L968-Q970 VanDerWaalsContact C-N 3.31Å; L968-Q970 PolarHBondContact O-N 3.23Å; Q970-R974 WeakPolarHBondContact O-CA 3.35Å; Q970-R974 WeakPolarHBondContact O-CB 3.16Å; Q970-R974 PolarHBondContact O-N 2.75Å; Q970-S1015 PolarHBondContact NE2-O 3.48Å; Q970-I1018 HydrophobicContact CB-CG2 3.54Å
971	I	82.3	Confident	88.5	Confident	139 Å²	139	44.3 Å²	44.3	71%	0.713	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-45.7	176	-55.2	177.8	0	0	0	109.3	D969 T973 R974	D969-I971 PolarHBondContact O-N 3.41Å; D969-I971 VanDerWaalsContact O-N 3.08Å; D969-I971 WeakPolarHBondContact OD1-CB 3.41Å; D969-I971 PolarHBondContact OD1-N 3.18Å; D969-I971 VanDerWaalsContact OD1-N 3.13Å; I971-T973 VanDerWaalsContact C-N 3.26Å; I971-T973 PolarHBondContact O-N 3Å; I971-R974 WeakPolarHBondContact O-CB 3.29Å; I971-R974 PolarHBondContact O-N 3.17Å
972	K	83	Confident	88.8	Confident	139 Å²	139	44.4 Å²	44.4	60%	0.604	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-14.5	179.2	-76.3	-172.9	-170.3	109.2	0	115.1	K919 D969	K919-K972 WeakPolarHBondContact CD-O 3.14Å; K919-K972 PolarHBondContact NZ-O 3.32Å; D969-K972 HydrophobicContact CB-CB 4.32Å; D969-K972 PolarHBondContact O-N 3.38Å; D969-K972 PolarHBondContact OD1-N 3.46Å; D969-K972 VanDerWaalsContact OD2-CD 3.22Å; D969-K972 WeakPolarHBondContact OD2-CD 3.1Å; D969-K972 VanDerWaalsContact OD2-CE 3.3Å; D969-K972 WeakPolarHBondContact OD2-CE 3.41Å; D969-K972 VanDerWaalsContact OD2-CG 3.28Å; D969-K972 WeakPolarHBondContact OD2-CG 3.47Å; D969-K972 IonicContact OD2-NZ 3.55Å; D969-K972 PolarHBondContact OD2-NZ 3.2Å
973	T	86	Confident	88.8	Confident	15 Å²	15	46.2 Å²	46.2	9%	0.092	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-119.1	-0.8	179.8	51.7	0	0	0	0	113.8	F966 D969 I971 E975 A976 V977	F966-T973 HydrophobicContact CB-CG2 4.15Å; F966-T973 HydrophobicContact CD1-CG2 4Å; F966-T973 WeakPolarHBondContact O-CG2 3.33Å; F966-T973 PolarHBondContact O-OG1 3.34Å; D969-T973 PolarHBondContact O-OG1 3.37Å; I971-T973 VanDerWaalsContact C-N 3.26Å; I971-T973 PolarHBondContact O-N 3Å; T973-E975 PolarHBondContact O-N 3.48Å; T973-A976 WeakPolarHBondContact O-CB 3.3Å; T973-A976 PolarHBondContact O-N 3.4Å; T973-V977 PolarHBondContact O-N 3.06Å; T973-V977 VanDerWaalsContact O-N 3.1Å
974	R	91.1	Very high	89	Confident	88 Å²	88	46.1 Å²	46.1	33%	0.332	23%	0.229	S	C	.	.	H	α-helix	trans	-39.3	-59.1	-176.2	-173.3	-171.7	172.3	154	9.2	114.9	Q970 I971 A978 I1018 Q1020 D1021	Q970-R974 WeakPolarHBondContact O-CA 3.35Å; Q970-R974 WeakPolarHBondContact O-CB 3.16Å; Q970-R974 PolarHBondContact O-N 2.75Å; I971-R974 WeakPolarHBondContact O-CB 3.29Å; I971-R974 PolarHBondContact O-N 3.17Å; R974-A978 VanDerWaalsContact O-CB 3.25Å; R974-A978 WeakPolarHBondContact O-CB 3.47Å; R974-A978 PolarHBondContact O-N 3.1Å; R974-I1018 HydrophobicContact CG-CD1 4.2Å; R974-Q1020 VanDerWaalsContact NH2-CD 3.32Å; R974-D1021 WeakPolarHBondContact CD-OD2 3.3Å; R974-D1021 WeakPolarHBondContact CG-OD2 3.18Å; R974-D1021 IonicContact CZ-OD1 3.2Å; R974-D1021 IonicContact CZ-OD2 3.36Å; R974-D1021 VanDerWaalsContact CZ-OD2 3.32Å; R974-D1021 IonicContact NE-OD1 3.77Å; R974-D1021 IonicContact NE-OD2 3.85Å; R974-D1021 PolarHBondContact NE-OD2 3.06Å; R974-D1021 IonicContact NH2-OD1 3.93Å; R974-D1021 PolarHBondContact NH2-OD1 3.15Å; R974-D1021 IonicContact NH2-OD2 3.61Å; R974-D1021 PolarHBondContact NH2-OD2 3.25Å
975	E	91.8	Very high	89.3	Confident	130 Å²	130	44.3 Å²	44.3	61%	0.607	22%	0.219	S	C	*	.	H	α-helix	trans	-73.5	-32.6	-171.9	-176.3	162.6	-152.5	0	0	113	I920 T973 T979	I920-E975 HydrophobicContact CD1-CB 4.46Å; I920-E975 HydrophobicContact CD1-CG 3.87Å; T973-E975 PolarHBondContact O-N 3.48Å; E975-T979 VanDerWaalsContact O-CB 3.28Å; E975-T979 WeakPolarHBondContact O-CB 3.48Å; E975-T979 PolarHBondContact O-N 3.16Å; E975-T979 PolarHBondContact O-OG1 3.41Å
976	A	92.9	Very high	89.8	Confident	2 Å²	2	47 Å²	47	2%	0.017	23%	0.23	C	C	.	.	H	α-helix	trans	-64.4	-51.3	174.6	0	0	0	0	0	110.9	K919 I920 A923 F966 T973 A978 T979 L980	K919-A976 HydrophobicContact CB-CB 4.05Å; K919-A976 VanDerWaalsContact O-CB 3.24Å; K919-A976 WeakPolarHBondContact O-CB 3.27Å; I920-A976 HydrophobicContact CG1-CB 4.27Å; A923-A976 HydrophobicContact CB-CB 3.87Å; F966-A976 HydrophobicContact CE1-CB 4.23Å; T973-A976 WeakPolarHBondContact O-CB 3.3Å; T973-A976 PolarHBondContact O-N 3.4Å; A976-A978 PolarHBondContact O-N 2.87Å; A976-T979 PolarHBondContact O-N 3.31Å; A976-T979 VanDerWaalsContact O-N 3.09Å; A976-L980 PolarHBondContact O-N 2.56Å
977	V	93.7	Very high	90.3	Very high	1 Å²	1	46.9 Å²	46.9	1%	0.006	23%	0.229	C	C	.	.	H	α-helix	trans	-63	-43.7	176.8	-180	0	0	0	0	110.8	F966 T973 T979 L980 H981 K1016 L1017	F966-V977 HydrophobicContact CB-CG2 4.07Å; F966-V977 HydrophobicContact CD1-CG2 3.75Å; F966-V977 HydrophobicContact CD2-CG2 3.87Å; F966-V977 HydrophobicContact CE1-CG2 4.13Å; F966-V977 HydrophobicContact CE2-CG2 4.24Å; F966-V977 HydrophobicContact CG-CG2 3.61Å; F966-V977 HydrophobicContact CZ-CG2 4.36Å; T973-V977 PolarHBondContact O-N 3.06Å; T973-V977 VanDerWaalsContact O-N 3.1Å; V977-T979 PolarHBondContact O-N 3.06Å; V977-L980 PolarHBondContact O-N 3.43Å; V977-H981 PolarHBondContact O-CD2 2.82Å; V977-H981 VanDerWaalsContact O-CD2 3.22Å; V977-H981 PolarHBondContact O-N 2.85Å; V977-H981 VanDerWaalsContact O-N 3.07Å; V977-K1016 HydrophobicContact CG1-CB 4.13Å; V977-K1016 HydrophobicContact CG2-CB 4.37Å; V977-L1017 HydrophobicContact CG1-CD2 3.81Å; V977-L1017 HydrophobicContact CG1-CG 4Å
978	A	94.3	Very high	91	Very high	13 Å²	13	46.3 Å²	46.3	11%	0.107	22%	0.223	C	C	.	.	H	α-helix	trans	-65.8	-17	175.9	0	0	0	0	0	114.1	R974 A976 K982 L1017	R974-A978 VanDerWaalsContact O-CB 3.25Å; R974-A978 WeakPolarHBondContact O-CB 3.47Å; R974-A978 PolarHBondContact O-N 3.1Å; A976-A978 PolarHBondContact O-N 2.87Å; A978-K982 VanDerWaalsContact O-CE 3.27Å; A978-K982 WeakPolarHBondContact O-CE 3.29Å; A978-K982 WeakPolarHBondContact O-CG 3.43Å; A978-L1017 HydrophobicContact CB-CD2 4.26Å
979	T	94.8	Very high	91.8	Very high	13 Å²	13	41.6 Å²	41.6	8%	0.08	20%	0.198	C	C	.	.	H	α-helix	trans	-90.9	-44.5	174.9	-61.4	0	0	0	0	111.2	I920 K924 E975 A976 V977 H981 K982 D983	I920-T979 HydrophobicContact CG2-CG2 4.19Å; K924-T979 HydrophobicContact CG-CG2 4.34Å; E975-T979 VanDerWaalsContact O-CB 3.28Å; E975-T979 WeakPolarHBondContact O-CB 3.48Å; E975-T979 PolarHBondContact O-N 3.16Å; E975-T979 PolarHBondContact O-OG1 3.41Å; A976-T979 PolarHBondContact O-N 3.31Å; A976-T979 VanDerWaalsContact O-N 3.09Å; V977-T979 PolarHBondContact O-N 3.06Å; T979-H981 PolarHBondContact O-N 3.38Å; T979-H981 VanDerWaalsContact O-N 3.16Å; T979-K982 WeakPolarHBondContact O-CB 3.47Å; T979-K982 PolarHBondContact O-N 3.36Å; T979-D983 PolarHBondContact O-N 3.24Å; T979-D983 VanDerWaalsContact O-N 3.07Å
980	L	96.3	Very high	92.3	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-48	-42.2	168.3	173.9	149.5	0	0	0	112.1	A923 I927 F966 A976 V977 K982 G984 L1010 F1013	A923-L980 HydrophobicContact CB-CB 4.3Å; A923-L980 HydrophobicContact CB-CD1 4.49Å; I927-L980 HydrophobicContact CB-CD1 4.29Å; I927-L980 HydrophobicContact CB-CG 4.01Å; I927-L980 HydrophobicContact CD1-CD2 4.39Å; I927-L980 HydrophobicContact CD1-CG 4.2Å; I927-L980 HydrophobicContact CG1-CG 4.3Å; F966-L980 HydrophobicContact CE2-CD1 4.13Å; F966-L980 HydrophobicContact CZ-CD1 4.19Å; A976-L980 PolarHBondContact O-N 2.56Å; V977-L980 PolarHBondContact O-N 3.43Å; L980-K982 PolarHBondContact O-N 3.17Å; L980-G984 PolarHBondContact O-N 2.96Å; L980-L1010 HydrophobicContact CD2-CD1 3.84Å; L980-F1013 HydrophobicContact CD1-CD1 3.76Å; L980-F1013 HydrophobicContact CD1-CE1 3.6Å; L980-F1013 HydrophobicContact CD1-CG 4.35Å; L980-F1013 HydrophobicContact CD1-CZ 4.03Å; L980-F1013 HydrophobicContact CD2-CB 3.77Å; L980-F1013 HydrophobicContact CD2-CD1 3.74Å; L980-F1013 HydrophobicContact CD2-CD2 3.87Å; L980-F1013 HydrophobicContact CD2-CE1 4.28Å; L980-F1013 HydrophobicContact CD2-CE2 4.37Å; L980-F1013 HydrophobicContact CD2-CG 3.52Å; L980-F1013 HydrophobicContact CG-CD1 4.46Å
981	H	96.7	Very high	92.5	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-69.4	-26.2	176.3	-83.2	-74.5	0	0	0	115	V977 T979 I985 L1010 F1013 S1014 L1017 V1025 Y1051	V977-H981 PolarHBondContact O-CD2 2.82Å; V977-H981 VanDerWaalsContact O-CD2 3.22Å; V977-H981 PolarHBondContact O-N 2.85Å; V977-H981 VanDerWaalsContact O-N 3.07Å; T979-H981 PolarHBondContact O-N 3.38Å; T979-H981 VanDerWaalsContact O-N 3.16Å; H981-I985 VanDerWaalsContact O-CD1 3.22Å; H981-I985 WeakPolarHBondContact O-CD1 3.46Å; H981-I985 WeakPolarHBondContact O-CG1 3.39Å; H981-I985 PolarHBondContact O-N 2.91Å; H981-L1010 PolarHBondContact CE1-O 2.67Å; H981-L1010 VanDerWaalsContact CE1-O 3.25Å; H981-F1013 WeakPolarHBondContact NE2-CB 3.38Å; H981-F1013 PolarHBondContact NE2-O 2.9Å; H981-S1014 PolarHBondContact NE2-N 3.04Å; H981-L1017 VanDerWaalsContact CD2-CD1 3.48Å; H981-L1017 WeakPolarHBondContact CD2-CD1 3.43Å; H981-V1025 HydrophobicContact CB-CG1 3.83Å; H981-V1025 HydrophobicContact CB-CG2 3.97Å; H981-Y1051 AromaticContact CE1-CE2 3.9Å; H981-Y1051 AromaticContact ND1-CE2 3.66Å; H981-Y1051 AromaticContact ND1-CZ 3.72Å; H981-Y1051 PolarHBondContact ND1-OH 2.96Å
982	K	96.3	Very high	92.5	Very high	67 Å²	67	48.5 Å²	48.5	29%	0.291	22%	0.219	S	C	.	.	H	α-helix	trans	-75.4	-52.7	174.3	-64.8	164.2	-161.8	152	0	110.1	A978 T979 L980 G984 I985 E986 Y1028	A978-K982 VanDerWaalsContact O-CE 3.27Å; A978-K982 WeakPolarHBondContact O-CE 3.29Å; A978-K982 WeakPolarHBondContact O-CG 3.43Å; T979-K982 WeakPolarHBondContact O-CB 3.47Å; T979-K982 PolarHBondContact O-N 3.36Å; L980-K982 PolarHBondContact O-N 3.17Å; K982-G984 VanDerWaalsContact C-N 3.26Å; K982-G984 PolarHBondContact O-N 3.14Å; K982-I985 WeakPolarHBondContact O-CA 3.43Å; K982-I985 WeakPolarHBondContact O-CB 3.39Å; K982-I985 PolarHBondContact O-N 2.96Å; K982-E986 PolarHBondContact O-N 3.47Å; K982-Y1028 HydrophobicContact CB-CD1 4.15Å; K982-Y1028 HydrophobicContact CB-CE1 3.78Å; K982-Y1028 HydrophobicContact CG-CD1 3.97Å; K982-Y1028 HydrophobicContact CG-CE1 3.93Å; K982-Y1028 HydrophobicContact CG-CG 4.32Å
983	D	96.4	Very high	92.4	Very high	37 Å²	37	43.9 Å²	43.9	20%	0.198	20%	0.201	C	C	.	.	H	α-helix	trans	-60.3	-37.7	-177.8	-65.8	34	0	0	0	110.9	K924 I927 Q931 T979 F987	K924-D983 IonicContact NZ-OD1 3.31Å; K924-D983 PolarHBondContact NZ-OD1 3.05Å; K924-D983 IonicContact NZ-OD2 3.87Å; K924-D983 PolarHBondContact NZ-OD2 3.17Å; I927-D983 HydrophobicContact CG2-CB 4.1Å; Q931-D983 PolarHBondContact NE2-O 2.98Å; T979-D983 PolarHBondContact O-N 3.24Å; T979-D983 VanDerWaalsContact O-N 3.07Å; D983-F987 PolarHBondContact O-N 3.36Å
984	G	96.4	Very high	92	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-69.6	-33.5	172.2	0	0	0	0	0	115.1	L980 K982 A988	L980-G984 PolarHBondContact O-N 2.96Å; K982-G984 VanDerWaalsContact C-N 3.26Å; K982-G984 PolarHBondContact O-N 3.14Å; G984-A988 WeakPolarHBondContact O-CB 3.48Å; G984-A988 PolarHBondContact O-N 3.28Å; G984-A988 VanDerWaalsContact O-N 3.12Å
985	I	96.4	Very high	91.2	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-67.5	-46.4	171.5	-74.2	166	0	0	0	109.8	H981 K982 F987 A988 F989 L1010 V1025 Y1028 L1029 F1032 Y1051	H981-I985 VanDerWaalsContact O-CD1 3.22Å; H981-I985 WeakPolarHBondContact O-CD1 3.46Å; H981-I985 WeakPolarHBondContact O-CG1 3.39Å; H981-I985 PolarHBondContact O-N 2.91Å; K982-I985 WeakPolarHBondContact O-CA 3.43Å; K982-I985 WeakPolarHBondContact O-CB 3.39Å; K982-I985 PolarHBondContact O-N 2.96Å; I985-F987 VanDerWaalsContact C-N 3.29Å; I985-F987 PolarHBondContact O-N 3.48Å; I985-A988 PolarHBondContact O-N 3.13Å; I985-A988 VanDerWaalsContact O-N 3.14Å; I985-F989 HydrophobicContact CG2-CD2 4.14Å; I985-F989 HydrophobicContact CG2-CE2 4.44Å; I985-F989 WeakPolarHBondContact O-CD2 3.19Å; I985-F989 PolarHBondContact O-N 3.04Å; I985-L1010 HydrophobicContact CG1-CD2 4.1Å; I985-V1025 HydrophobicContact CD1-CG1 3.88Å; I985-Y1028 HydrophobicContact CD1-CD1 4.39Å; I985-Y1028 HydrophobicContact CG2-CD1 4.44Å; I985-L1029 HydrophobicContact CD1-CB 3.94Å; I985-L1029 HydrophobicContact CD1-CD1 4.28Å; I985-L1029 HydrophobicContact CG1-CD1 4.18Å; I985-L1029 HydrophobicContact CG2-CD1 4.16Å; I985-F1032 HydrophobicContact CG2-CD2 3.61Å; I985-F1032 HydrophobicContact CG2-CE2 3.83Å; I985-F1032 HydrophobicContact CG2-CG 4.16Å; I985-Y1051 HydrophobicContact CD1-CE1 4.01Å; I985-Y1051 HydrophobicContact CG1-CE1 3.87Å
986	E	96.1	Very high	90.2	Very high	85 Å²	85	48.1 Å²	48.1	40%	0.397	24%	0.243	S	C	.	.	H	α-helix	trans	-59.9	-40.1	179.7	-76.7	172.1	-145.1	0	0	111.6	K982 K990 Y1028 F1032	K982-E986 PolarHBondContact O-N 3.47Å; E986-K990 WeakPolarHBondContact O-CA 3.44Å; E986-K990 WeakPolarHBondContact O-CB 3.29Å; E986-K990 PolarHBondContact O-N 2.7Å; E986-Y1028 HydrophobicContact CG-CE1 4.3Å; E986-Y1028 WeakPolarHBondContact OE1-CE1 3.46Å; E986-Y1028 PolarHBondContact OE1-OH 2.97Å; E986-F1032 HydrophobicContact CG-CE1 4.15Å; E986-F1032 HydrophobicContact CG-CZ 3.65Å
987	F	95.4	Very high	89	Confident	5 Å²	5	52.3 Å²	52.3	2%	0.022	27%	0.272	C	S	.	.	H	α-helix	trans	-62.1	-48	171.3	178.9	-99.2	0	0	0	113.2	Q931 F934 N935 D983 I985 F989 K990 N1003 F1006	Q931-F987 HydrophobicContact CB-CD2 3.94Å; Q931-F987 HydrophobicContact CB-CE1 4.31Å; Q931-F987 HydrophobicContact CB-CE2 3.7Å; Q931-F987 HydrophobicContact CB-CG 4.34Å; Q931-F987 HydrophobicContact CB-CZ 3.87Å; Q931-F987 HydrophobicContact CG-CB 4.06Å; Q931-F987 HydrophobicContact CG-CD1 3.77Å; Q931-F987 HydrophobicContact CG-CD2 3.59Å; Q931-F987 HydrophobicContact CG-CE1 3.98Å; Q931-F987 HydrophobicContact CG-CE2 3.83Å; Q931-F987 HydrophobicContact CG-CG 3.53Å; Q931-F987 HydrophobicContact CG-CZ 3.99Å; Q931-F987 VanDerWaalsContact OE1-CD2 3.25Å; F934-F987 HydrophobicContact CB-CE1 4.45Å; F934-F987 AromaticContact CD1-CE1 3.67Å; F934-F987 HydrophobicContact CD1-CE1 3.67Å; F934-F987 AromaticContact CD1-CZ 3.95Å; F934-F987 HydrophobicContact CD1-CZ 3.95Å; F934-F987 HydrophobicContact CE1-CE1 4.32Å; F934-F987 HydrophobicContact CG-CE1 4.34Å; N935-F987 WeakPolarHBondContact OD1-CE2 3.44Å; N935-F987 VanDerWaalsContact OD1-CZ 3.31Å; N935-F987 WeakPolarHBondContact OD1-CZ 3.5Å; D983-F987 PolarHBondContact O-N 3.36Å; I985-F987 VanDerWaalsContact C-N 3.29Å; I985-F987 PolarHBondContact O-N 3.48Å; F987-F989 PolarHBondContact O-N 3.21Å; F987-K990 VanDerWaalsContact O-CB 3.23Å; F987-K990 WeakPolarHBondContact O-CB 3.44Å; F987-K990 PolarHBondContact O-N 3.03Å; F987-K990 VanDerWaalsContact O-N 3.11Å; F987-N1003 HydrophobicContact CD1-CB 4.24Å; F987-N1003 HydrophobicContact CE1-CB 4.09Å; F987-N1003 VanDerWaalsContact CE1-ND2 3.3Å; F987-N1003 WeakPolarHBondContact CE1-ND2 3.41Å; F987-N1003 VanDerWaalsContact CE2-ND2 3.34Å; F987-N1003 WeakPolarHBondContact CE2-ND2 3.25Å; F987-N1003 WeakPolarHBondContact CZ-ND2 3.42Å; F987-N1003 WeakPolarHBondContact O-CB 3.41Å; F987-F1006 HydrophobicContact CD1-CB 4.03Å; F987-F1006 AromaticContact CD1-CD1 3.53Å; F987-F1006 HydrophobicContact CD1-CD1 3.53Å; F987-F1006 HydrophobicContact CD1-CD2 4.1Å; F987-F1006 AromaticContact CD1-CE1 3.93Å; F987-F1006 HydrophobicContact CD1-CE1 3.93Å; F987-F1006 HydrophobicContact CD1-CE2 4.46Å; F987-F1006 AromaticContact CD1-CG 3.61Å; F987-F1006 HydrophobicContact CD1-CG 3.61Å; F987-F1006 HydrophobicContact CD1-CZ 4.37Å; F987-F1006 HydrophobicContact CE1-CB 4Å; F987-F1006 HydrophobicContact CE1-CD1 4.06Å; F987-F1006 AromaticContact CE1-CD2 3.77Å; F987-F1006 HydrophobicContact CE1-CD2 3.77Å; F987-F1006 HydrophobicContact CE1-CE1 4.48Å; F987-F1006 HydrophobicContact CE1-CE2 4.22Å; F987-F1006 AromaticContact CE1-CG 3.67Å; F987-F1006 HydrophobicContact CE1-CG 3.67Å
988	A	93.6	Very high	87.7	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-60.6	-28.8	-177.6	0	0	0	0	0	113.6	G984 I985 N1003 L1007	G984-A988 WeakPolarHBondContact O-CB 3.48Å; G984-A988 PolarHBondContact O-N 3.28Å; G984-A988 VanDerWaalsContact O-N 3.12Å; I985-A988 PolarHBondContact O-N 3.13Å; I985-A988 VanDerWaalsContact O-N 3.14Å; A988-N1003 CarbonylContact O-C 3.59Å; A988-L1007 HydrophobicContact CB-CD1 4.49Å; A988-L1007 HydrophobicContact CB-CD2 3.57Å; A988-L1007 HydrophobicContact CB-CG 3.78Å
989	F	92.4	Very high	86.8	Confident	24 Å²	24	62.5 Å²	62.5	11%	0.105	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.2	3.7	177.7	-69.1	-86.3	0	0	0	114.3	I985 F987 Y991 P1001 L1004 L1007 L1029 F1032 M1033 M1037 L1048	I985-F989 HydrophobicContact CG2-CD2 4.14Å; I985-F989 HydrophobicContact CG2-CE2 4.44Å; I985-F989 WeakPolarHBondContact O-CD2 3.19Å; I985-F989 PolarHBondContact O-N 3.04Å; F987-F989 PolarHBondContact O-N 3.21Å; F989-Y991 VanDerWaalsContact C-N 3.32Å; F989-Y991 PolarHBondContact O-N 3.18Å; F989-P1001 HydrophobicContact CD1-CG 3.83Å; F989-P1001 HydrophobicContact CE1-CG 4.09Å; F989-L1004 HydrophobicContact CE1-CD1 4.14Å; F989-L1004 HydrophobicContact CZ-CD1 3.95Å; F989-L1007 HydrophobicContact CE2-CD1 4.22Å; F989-L1029 HydrophobicContact CE2-CD1 3.68Å; F989-L1029 HydrophobicContact CZ-CD1 4.22Å; F989-F1032 HydrophobicContact CB-CB 4.17Å; F989-F1032 HydrophobicContact CB-CD1 3.85Å; F989-F1032 HydrophobicContact CB-CG 4.33Å; F989-F1032 HydrophobicContact CD1-CB 3.99Å; F989-F1032 HydrophobicContact CD2-CB 3.72Å; F989-F1032 HydrophobicContact CD2-CG 4.22Å; F989-F1032 HydrophobicContact CE1-CB 4.31Å; F989-F1032 HydrophobicContact CE2-CB 4.08Å; F989-F1032 HydrophobicContact CG-CB 3.69Å; F989-F1032 HydrophobicContact CG-CD1 4.3Å; F989-F1032 HydrophobicContact CG-CG 4.28Å; F989-F1032 HydrophobicContact CZ-CB 4.35Å; F989-M1033 HydrophobicContact CZ-CG 4.4Å; F989-M1037 HydrophobicContact CE1-SD 4.27Å; F989-L1048 HydrophobicContact CZ-CD1 4.03Å
990	K	90.7	Very high	86.3	Confident	121 Å²	121	63.2 Å²	63.2	53%	0.526	32%	0.321	S	S	.	.	S	Bend	trans	-57.8	-38.6	-174.3	-171.2	178.4	-179.7	-168.2	0	113.9	E986 F987	E986-K990 WeakPolarHBondContact O-CA 3.44Å; E986-K990 WeakPolarHBondContact O-CB 3.29Å; E986-K990 PolarHBondContact O-N 2.7Å; F987-K990 VanDerWaalsContact O-CB 3.23Å; F987-K990 WeakPolarHBondContact O-CB 3.44Å; F987-K990 PolarHBondContact O-N 3.03Å; F987-K990 VanDerWaalsContact O-N 3.11Å
991	Y	86.3	Confident	85.8	Confident	111 Å²	111	63.7 Å²	63.7	44%	0.435	32%	0.324	S	S	.	.	S	Bend	trans	-120.3	110.3	-177.3	-57.4	-66.3	0	0	0	111.1	F989 I1002	F989-Y991 VanDerWaalsContact C-N 3.32Å; F989-Y991 PolarHBondContact O-N 3.18Å; Y991-I1002 PolarHBondContact O-N 2.75Å; Y991-I1002 VanDerWaalsContact O-N 3.13Å
992	Q	81.8	Confident	85.3	Confident	168 Å²	168	66.8 Å²	66.8	79%	0.785	34%	0.34	S	S	*	.			trans	-69.9	150.6	173.4	-64.4	-172.5	3.7	0	0	111.1	A994	Q992-A994 PolarHBondContact O-N 2.96Å
993	N	80	Confident	85	Confident	41 Å²	41	63.7 Å²	63.7	22%	0.219	33%	0.327	C	S	.	.			trans	-72.4	125.7	-178.7	-157.5	-56.9	0	0	0	111.4	R995 G996 F999 P1000	N993-R995 PolarHBondContact O-N 3.36Å; N993-R995 VanDerWaalsContact O-N 3.08Å; N993-R995 WeakPolarHBondContact OD1-CB 3.49Å; N993-R995 PolarHBondContact OD1-N 3.2Å; N993-G996 PolarHBondContact O-N 3Å; N993-F999 HydrophobicContact CB-CB 3.84Å; N993-P1000 WeakPolarHBondContact CB-O 3.17Å; N993-P1000 PolarHBondContact ND2-O 3.08Å
994	A	77.6	Confident	84.7	Confident	107 Å²	107	62.1 Å²	62.1	88%	0.884	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-17.1	178.5	0	0	0	0	0	113.8	Q992 G996	Q992-A994 PolarHBondContact O-N 2.96Å; A994-G996 PolarHBondContact O-N 3.47Å
995	R	75	Confident	84.4	Confident	183 Å²	183	63.2 Å²	63.2	69%	0.691	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-0.9	173.6	-58.8	-178.3	-179.5	-176.2	0.7	113.6	N993 F999	N993-R995 PolarHBondContact O-N 3.36Å; N993-R995 VanDerWaalsContact O-N 3.08Å; N993-R995 WeakPolarHBondContact OD1-CB 3.49Å; N993-R995 PolarHBondContact OD1-N 3.2Å; R995-F999 HydrophobicContact CB-CD2 3.41Å; R995-F999 VanDerWaalsContact CB-CD2 3.41Å; R995-F999 HydrophobicContact CB-CE2 3.61Å; R995-F999 HydrophobicContact CB-CG 3.91Å; R995-F999 HydrophobicContact CB-CZ 4.25Å; R995-F999 WeakPolarHBondContact O-CD2 3.44Å; R995-F999 WeakPolarHBondContact O-CE2 3.33Å
996	G	71.1	Confident	84.2	Confident	32 Å²	32	63.2 Å²	63.2	33%	0.33	33%	0.327	S	S	.	.			trans	105.5	167.8	177.6	0	0	0	0	0	113.5	N993 A994 E998 F999	N993-G996 PolarHBondContact O-N 3Å; A994-G996 PolarHBondContact O-N 3.47Å; G996-E998 PolarHBondContact O-N 3.31Å; G996-F999 PolarHBondContact O-N 3.07Å; G996-F999 VanDerWaalsContact O-N 3.08Å
997	S	67.1	Low	84.1	Confident	91 Å²	91	59.1 Å²	59.1	64%	0.636	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	0.7	-176.2	50.9	0	0	0	0	115.8
998	E	66.8	Low	83.9	Confident	136 Å²	136	60 Å²	60	64%	0.636	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.5	-10.4	173	-67.2	-170.8	179.6	0	0	112.9	G996 R1040	G996-E998 PolarHBondContact O-N 3.31Å; E998-R1040 PolarHBondContact O-NH1 3.5Å; E998-R1040 VanDerWaalsContact O-NH1 3.16Å; E998-R1040 PolarHBondContact O-NH2 3.43Å
999	F	76.4	Confident	83.9	Confident	91 Å²	91	60.1 Å²	60.1	40%	0.399	31%	0.313	S	S	.	.	S	Bend	trans	-105.2	150.7	176.9	-65.2	-90.5	0	0	0	110.8	N993 R995 G996	N993-F999 HydrophobicContact CB-CB 3.84Å; R995-F999 HydrophobicContact CB-CD2 3.41Å; R995-F999 VanDerWaalsContact CB-CD2 3.41Å; R995-F999 HydrophobicContact CB-CE2 3.61Å; R995-F999 HydrophobicContact CB-CG 3.91Å; R995-F999 HydrophobicContact CB-CZ 4.25Å; R995-F999 WeakPolarHBondContact O-CD2 3.44Å; R995-F999 WeakPolarHBondContact O-CE2 3.33Å; G996-F999 PolarHBondContact O-N 3.07Å; G996-F999 VanDerWaalsContact O-N 3.08Å
1000	P	82.6	Confident	84.1	Confident	28 Å²	28	59 Å²	59	18%	0.182	31%	0.308	C	S	.	.			trans	-61.3	142.9	178.2	25.7	-35.1	0	0	0	111.7	N993 L1004 V1044 W1045	N993-P1000 WeakPolarHBondContact CB-O 3.17Å; N993-P1000 PolarHBondContact ND2-O 3.08Å; P1000-L1004 HydrophobicContact CB-CB 4.35Å; P1000-L1004 HydrophobicContact CB-CD2 3.59Å; P1000-V1044 HydrophobicContact CG-CB 4.3Å; P1000-V1044 HydrophobicContact CG-CG2 4.23Å; P1000-W1045 HydrophobicContact CB-CD2 4.45Å; P1000-W1045 HydrophobicContact CB-CE3 4.46Å; P1000-W1045 HydrophobicContact CB-CH2 4.22Å; P1000-W1045 HydrophobicContact CB-CZ2 4.2Å; P1000-W1045 HydrophobicContact CB-CZ3 4.33Å
1001	P	86.9	Confident	84.3	Confident	11 Å²	11	54.6 Å²	54.6	7%	0.071	29%	0.292	C	S	.	.			trans	-50.5	148.1	167.4	-26	34.2	0	0	0	111.7	F989 N1003 L1004	F989-P1001 HydrophobicContact CD1-CG 3.83Å; F989-P1001 HydrophobicContact CE1-CG 4.09Å; P1001-N1003 PolarHBondContact O-N 3.24Å; P1001-L1004 HydrophobicContact CB-CB 4.43Å; P1001-L1004 HydrophobicContact CG-CD1 4.39Å; P1001-L1004 VanDerWaalsContact O-CB 3.3Å; P1001-L1004 WeakPolarHBondContact O-CB 3.27Å; P1001-L1004 PolarHBondContact O-N 2.99Å; P1001-L1004 VanDerWaalsContact O-N 3.1Å
1002	I	85.7	Confident	84.7	Confident	64 Å²	64	51.3 Å²	51.3	33%	0.328	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-38.5	-172.2	-57.8	179.6	0	0	0	110.9	L938 P943 Y991	L938-I1002 HydrophobicContact CD1-CG2 4.36Å; L938-I1002 HydrophobicContact CD2-CG2 4.44Å; P943-I1002 HydrophobicContact CB-CG2 4.06Å; Y991-I1002 PolarHBondContact O-N 2.75Å; Y991-I1002 VanDerWaalsContact O-N 3.13Å
1003	N	90.7	Very high	85.3	Confident	3 Å²	3	43.3 Å²	43.3	2%	0.016	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.9	12.7	-174.7	-61	36.3	0	0	0	113	F934 F987 A988 P1001 A1005 F1006	F934-N1003 HydrophobicContact CE1-CB 4.24Å; F987-N1003 HydrophobicContact CD1-CB 4.24Å; F987-N1003 HydrophobicContact CE1-CB 4.09Å; F987-N1003 VanDerWaalsContact CE1-ND2 3.3Å; F987-N1003 WeakPolarHBondContact CE1-ND2 3.41Å; F987-N1003 VanDerWaalsContact CE2-ND2 3.34Å; F987-N1003 WeakPolarHBondContact CE2-ND2 3.25Å; F987-N1003 WeakPolarHBondContact CZ-ND2 3.42Å; F987-N1003 WeakPolarHBondContact O-CB 3.41Å; A988-N1003 CarbonylContact O-C 3.59Å; P1001-N1003 PolarHBondContact O-N 3.24Å; N1003-A1005 VanDerWaalsContact C-N 3.27Å; N1003-A1005 PolarHBondContact O-N 2.88Å; N1003-F1006 WeakPolarHBondContact O-CB 3.5Å; N1003-F1006 PolarHBondContact O-N 2.73Å
1004	L	90.2	Very high	85.9	Confident	4 Å²	4	41.7 Å²	41.7	2%	0.021	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-32.8	-172.3	-167.8	71.2	0	0	0	113.4	F989 P1000 P1001 F1006 L1007 W1045 P1047 L1048	F989-L1004 HydrophobicContact CE1-CD1 4.14Å; F989-L1004 HydrophobicContact CZ-CD1 3.95Å; P1000-L1004 HydrophobicContact CB-CB 4.35Å; P1000-L1004 HydrophobicContact CB-CD2 3.59Å; P1001-L1004 HydrophobicContact CB-CB 4.43Å; P1001-L1004 HydrophobicContact CG-CD1 4.39Å; P1001-L1004 VanDerWaalsContact O-CB 3.3Å; P1001-L1004 WeakPolarHBondContact O-CB 3.27Å; P1001-L1004 PolarHBondContact O-N 2.99Å; P1001-L1004 VanDerWaalsContact O-N 3.1Å; L1004-F1006 PolarHBondContact O-N 3.34Å; L1004-L1007 HydrophobicContact CD1-CD1 3.8Å; L1004-L1007 WeakPolarHBondContact O-CB 3.45Å; L1004-L1007 WeakPolarHBondContact O-CG 3.44Å; L1004-L1007 PolarHBondContact O-N 2.78Å; L1004-L1007 VanDerWaalsContact O-N 3.15Å; L1004-W1045 HydrophobicContact CD2-CD2 4.33Å; L1004-W1045 HydrophobicContact CD2-CE3 3.63Å; L1004-W1045 HydrophobicContact CD2-CZ3 4.01Å; L1004-P1047 VanDerWaalsContact O-CB 3.31Å; L1004-P1047 WeakPolarHBondContact O-CB 3.44Å; L1004-L1048 HydrophobicContact CD1-CB 4.21Å; L1004-L1048 HydrophobicContact CD2-CB 4.39Å
1005	A	89.4	Confident	86.4	Confident	22 Å²	22	39.9 Å²	39.9	18%	0.182	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-18.7	178.3	0	0	0	0	0	113.6	F934 N1003 L1007 E1008 P1047	F934-A1005 HydrophobicContact CE2-CB 4.35Å; F934-A1005 HydrophobicContact CZ-CB 4.06Å; N1003-A1005 VanDerWaalsContact C-N 3.27Å; N1003-A1005 PolarHBondContact O-N 2.88Å; A1005-L1007 PolarHBondContact O-N 3.46Å; A1005-L1007 VanDerWaalsContact O-N 3.13Å; A1005-E1008 PolarHBondContact O-N 3.37Å; A1005-P1047 HydrophobicContact CB-CG 4.27Å
1006	F	92.9	Very high	87.2	Confident	0 Å²	0	32 Å²	32	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-60.5	-21.2	172.4	-168.7	-104.9	0	0	0	113	I927 L930 Q931 F934 F987 N1003 L1004 E1008 V1009 L1010	I927-F1006 HydrophobicContact CD1-CE1 3.82Å; I927-F1006 HydrophobicContact CD1-CZ 3.64Å; I927-F1006 HydrophobicContact CG1-CE1 4.21Å; I927-F1006 HydrophobicContact CG1-CZ 4.15Å; L930-F1006 HydrophobicContact CB-CE2 3.95Å; L930-F1006 HydrophobicContact CB-CZ 3.99Å; Q931-F1006 HydrophobicContact CG-CE1 4.08Å; Q931-F1006 HydrophobicContact CG-CE2 4.23Å; Q931-F1006 HydrophobicContact CG-CZ 3.67Å; F934-F1006 HydrophobicContact CB-CD2 3.85Å; F934-F1006 HydrophobicContact CB-CE2 4.15Å; F934-F1006 HydrophobicContact CD1-CB 4.28Å; F934-F1006 HydrophobicContact CD1-CD2 4.14Å; F934-F1006 HydrophobicContact CD2-CB 4.49Å; F934-F1006 AromaticContact CD2-CD2 3.92Å; F934-F1006 HydrophobicContact CD2-CD2 3.92Å; F934-F1006 HydrophobicContact CE1-CB 4.09Å; F934-F1006 HydrophobicContact CE2-CB 4.32Å; F934-F1006 HydrophobicContact CG-CB 4.47Å; F934-F1006 AromaticContact CG-CD2 3.69Å; F934-F1006 HydrophobicContact CG-CD2 3.69Å; F934-F1006 HydrophobicContact CG-CE2 4.47Å; F934-F1006 HydrophobicContact CZ-CB 4.12Å; F987-F1006 HydrophobicContact CD1-CB 4.03Å; F987-F1006 AromaticContact CD1-CD1 3.53Å; F987-F1006 HydrophobicContact CD1-CD1 3.53Å; F987-F1006 HydrophobicContact CD1-CD2 4.1Å; F987-F1006 AromaticContact CD1-CE1 3.93Å; F987-F1006 HydrophobicContact CD1-CE1 3.93Å; F987-F1006 HydrophobicContact CD1-CE2 4.46Å; F987-F1006 AromaticContact CD1-CG 3.61Å; F987-F1006 HydrophobicContact CD1-CG 3.61Å; F987-F1006 HydrophobicContact CD1-CZ 4.37Å; F987-F1006 HydrophobicContact CE1-CB 4Å; F987-F1006 HydrophobicContact CE1-CD1 4.06Å; F987-F1006 AromaticContact CE1-CD2 3.77Å; F987-F1006 HydrophobicContact CE1-CD2 3.77Å; F987-F1006 HydrophobicContact CE1-CE1 4.48Å; F987-F1006 HydrophobicContact CE1-CE2 4.22Å; F987-F1006 AromaticContact CE1-CG 3.67Å; F987-F1006 HydrophobicContact CE1-CG 3.67Å; N1003-F1006 WeakPolarHBondContact O-CB 3.5Å; N1003-F1006 PolarHBondContact O-N 2.73Å; L1004-F1006 PolarHBondContact O-N 3.34Å; F1006-E1008 PolarHBondContact O-N 3.15Å; F1006-V1009 HydrophobicContact CD2-CB 4.17Å; F1006-V1009 HydrophobicContact CD2-CG2 4.25Å; F1006-V1009 HydrophobicContact CE2-CB 4.26Å; F1006-V1009 HydrophobicContact CE2-CG1 4.16Å; F1006-V1009 WeakPolarHBondContact O-CB 3.48Å; F1006-V1009 PolarHBondContact O-N 3Å; F1006-V1009 VanDerWaalsContact O-N 3.11Å; F1006-L1010 PolarHBondContact O-N 2.97Å
1007	L	93.9	Very high	88.1	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-64.4	-21.6	173.9	-62.9	-178.6	0	0	0	113.3	A988 F989 L1004 A1005 L1010 S1011 P1047 L1048 Y1051	A988-L1007 HydrophobicContact CB-CD1 4.49Å; A988-L1007 HydrophobicContact CB-CD2 3.57Å; A988-L1007 HydrophobicContact CB-CG 3.78Å; F989-L1007 HydrophobicContact CE2-CD1 4.22Å; L1004-L1007 HydrophobicContact CD1-CD1 3.8Å; L1004-L1007 WeakPolarHBondContact O-CB 3.45Å; L1004-L1007 WeakPolarHBondContact O-CG 3.44Å; L1004-L1007 PolarHBondContact O-N 2.78Å; L1004-L1007 VanDerWaalsContact O-N 3.15Å; A1005-L1007 PolarHBondContact O-N 3.46Å; A1005-L1007 VanDerWaalsContact O-N 3.13Å; L1007-L1010 HydrophobicContact CD2-CD2 4Å; L1007-S1011 WeakPolarHBondContact O-CB 3.48Å; L1007-S1011 PolarHBondContact O-N 3.06Å; L1007-S1011 VanDerWaalsContact O-N 3.09Å; L1007-P1047 HydrophobicContact CB-CB 4.24Å; L1007-L1048 HydrophobicContact CD1-CB 4.16Å; L1007-L1048 HydrophobicContact CD1-CD1 3.65Å; L1007-Y1051 HydrophobicContact CB-CD1 4.35Å; L1007-Y1051 HydrophobicContact CB-CG 4.17Å; L1007-Y1051 HydrophobicContact CD1-CD1 4.31Å; L1007-Y1051 HydrophobicContact CD2-CD1 3.85Å; L1007-Y1051 HydrophobicContact CD2-CE1 4.01Å; L1007-Y1051 HydrophobicContact CD2-CG 4.38Å; L1007-Y1051 HydrophobicContact CG-CD1 4.4Å
1008	E	91	Very high	89.2	Confident	23 Å²	23	28.1 Å²	28.1	11%	0.107	15%	0.152	C	C	.	.	H	α-helix	trans	-69.8	-45	169.6	-64.8	-166.6	-158.8	0	0	111.2	R947 K956 A1005 F1006 L1010 S1011 P1047	R947-E1008 WeakPolarHBondContact CD-OE1 3.44Å; R947-E1008 IonicContact NH1-OE1 3.13Å; K956-E1008 HydrophobicContact CD-CB 4.25Å; K956-E1008 IonicContact NZ-OE2 3.71Å; K956-E1008 PolarHBondContact NZ-OE2 2.98Å; A1005-E1008 PolarHBondContact O-N 3.37Å; F1006-E1008 PolarHBondContact O-N 3.15Å; E1008-L1010 VanDerWaalsContact C-N 3.31Å; E1008-L1010 PolarHBondContact O-N 2.78Å; E1008-S1011 WeakPolarHBondContact O-CB 3.42Å; E1008-S1011 PolarHBondContact O-N 3.4Å; E1008-S1011 VanDerWaalsContact O-N 3.07Å; E1008-S1011 PolarHBondContact O-OG 3.22Å; E1008-P1047 HydrophobicContact CG-CB 3.84Å; E1008-P1047 HydrophobicContact CG-CG 4.04Å
1009	V	93.5	Very high	90.1	Very high	2 Å²	2	28.1 Å²	28.1	1%	0.012	15%	0.146	C	C	.	.	H	α-helix	trans	-59.4	-43.8	174.2	-174.8	0	0	0	0	110.5	L930 I955 K956 A959 F1006 S1011	L930-V1009 HydrophobicContact CB-CG1 4.4Å; L930-V1009 HydrophobicContact CD1-CG1 4.12Å; L930-V1009 HydrophobicContact CD2-CG1 4.25Å; I955-V1009 HydrophobicContact CG2-CG1 3.83Å; I955-V1009 HydrophobicContact CG2-CG2 3.86Å; K956-V1009 HydrophobicContact CG-CG2 3.99Å; A959-V1009 HydrophobicContact CB-CG1 3.5Å; A959-V1009 VanDerWaalsContact CB-CG1 3.5Å; F1006-V1009 HydrophobicContact CD2-CB 4.17Å; F1006-V1009 HydrophobicContact CD2-CG2 4.25Å; F1006-V1009 HydrophobicContact CE2-CB 4.26Å; F1006-V1009 HydrophobicContact CE2-CG1 4.16Å; F1006-V1009 WeakPolarHBondContact O-CB 3.48Å; F1006-V1009 PolarHBondContact O-N 3Å; F1006-V1009 VanDerWaalsContact O-N 3.11Å; V1009-S1011 PolarHBondContact O-N 3.09Å
1010	L	95.8	Very high	90.6	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-67.5	-19.3	177.3	-163.2	61.4	0	0	0	113.4	I927 L980 H981 I985 F1006 L1007 E1008 Y1051	I927-L1010 HydrophobicContact CD1-CD1 3.84Å; L980-L1010 HydrophobicContact CD2-CD1 3.84Å; H981-L1010 PolarHBondContact CE1-O 2.67Å; H981-L1010 VanDerWaalsContact CE1-O 3.25Å; I985-L1010 HydrophobicContact CG1-CD2 4.1Å; F1006-L1010 PolarHBondContact O-N 2.97Å; L1007-L1010 HydrophobicContact CD2-CD2 4Å; E1008-L1010 VanDerWaalsContact C-N 3.31Å; E1008-L1010 PolarHBondContact O-N 2.78Å; L1010-Y1051 HydrophobicContact CB-CD2 4.47Å; L1010-Y1051 HydrophobicContact CB-CE2 4.14Å; L1010-Y1051 HydrophobicContact CD2-CE1 4.21Å; L1010-Y1051 HydrophobicContact CD2-CE2 3.93Å; L1010-Y1051 WeakPolarHBondContact CD2-OH 3.33Å; L1010-Y1051 HydrophobicContact CG-CE2 3.77Å
1011	S	94.8	Very high	91.1	Very high	29 Å²	29	28.8 Å²	28.8	20%	0.203	15%	0.148	C	C	.	.	H	α-helix	trans	-72.6	-28.3	-178.3	78.7	0	0	0	0	113.3	L1007 E1008 V1009 F1013 S1014	L1007-S1011 WeakPolarHBondContact O-CB 3.48Å; L1007-S1011 PolarHBondContact O-N 3.06Å; L1007-S1011 VanDerWaalsContact O-N 3.09Å; E1008-S1011 WeakPolarHBondContact O-CB 3.42Å; E1008-S1011 PolarHBondContact O-N 3.4Å; E1008-S1011 VanDerWaalsContact O-N 3.07Å; E1008-S1011 PolarHBondContact O-OG 3.22Å; V1009-S1011 PolarHBondContact O-N 3.09Å; S1011-F1013 VanDerWaalsContact C-N 3.28Å; S1011-F1013 PolarHBondContact O-N 3.02Å; S1011-S1014 VanDerWaalsContact O-CB 3.28Å; S1011-S1014 WeakPolarHBondContact O-CB 3.37Å; S1011-S1014 PolarHBondContact O-N 2.88Å; S1011-S1014 PolarHBondContact O-OG 2.91Å
1012	E	94.8	Very high	91.3	Very high	42 Å²	42	29.9 Å²	29.9	20%	0.196	15%	0.151	C	C	.	.	H	α-helix	trans	-57.7	-41.4	177	-56.9	-69.3	155.7	0	0	111.3	A959 R960 S1014 S1015	A959-E1012 HydrophobicContact CB-CB 4.42Å; A959-E1012 HydrophobicContact CB-CG 4.3Å; R960-E1012 HydrophobicContact CB-CB 4.19Å; R960-E1012 HydrophobicContact CB-CG 4.23Å; R960-E1012 WeakPolarHBondContact CB-OE2 3.49Å; R960-E1012 VanDerWaalsContact CD-OE2 3.23Å; R960-E1012 WeakPolarHBondContact CD-OE2 3.5Å; R960-E1012 HydrophobicContact CG-CB 4.4Å; R960-E1012 WeakPolarHBondContact CG-OE2 3.26Å; R960-E1012 IonicContact NE-OE2 2.76Å; R960-E1012 PolarHBondContact NE-OE2 3.35Å; E1012-S1014 VanDerWaalsContact C-N 3.28Å; E1012-S1014 PolarHBondContact O-N 2.8Å; E1012-S1015 PolarHBondContact O-OG 2.9Å
1013	F	94.6	Very high	91.5	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-68	-22.5	176.8	-62.9	-87	0	0	0	114	I927 L930 A959 F962 A963 F966 L980 H981 S1011 S1015 K1016	I927-F1013 HydrophobicContact CD1-CE2 4.49Å; L930-F1013 HydrophobicContact CD1-CE2 3.61Å; L930-F1013 HydrophobicContact CD1-CZ 3.67Å; A959-F1013 HydrophobicContact CB-CE2 3.73Å; A959-F1013 HydrophobicContact CB-CZ 4.25Å; A959-F1013 WeakPolarHBondContact O-CZ 3.47Å; F962-F1013 HydrophobicContact CB-CE1 3.89Å; F962-F1013 HydrophobicContact CB-CZ 3.8Å; A963-F1013 HydrophobicContact CB-CB 4.45Å; A963-F1013 HydrophobicContact CB-CD1 3.54Å; A963-F1013 HydrophobicContact CB-CE1 3.9Å; A963-F1013 HydrophobicContact CB-CG 4.01Å; F966-F1013 HydrophobicContact CE2-CD1 4.09Å; F966-F1013 HydrophobicContact CE2-CE1 4.04Å; L980-F1013 HydrophobicContact CD1-CD1 3.76Å; L980-F1013 HydrophobicContact CD1-CE1 3.6Å; L980-F1013 HydrophobicContact CD1-CG 4.35Å; L980-F1013 HydrophobicContact CD1-CZ 4.03Å; L980-F1013 HydrophobicContact CD2-CB 3.77Å; L980-F1013 HydrophobicContact CD2-CD1 3.74Å; L980-F1013 HydrophobicContact CD2-CD2 3.87Å; L980-F1013 HydrophobicContact CD2-CE1 4.28Å; L980-F1013 HydrophobicContact CD2-CE2 4.37Å; L980-F1013 HydrophobicContact CD2-CG 3.52Å; L980-F1013 HydrophobicContact CG-CD1 4.46Å; H981-F1013 WeakPolarHBondContact NE2-CB 3.38Å; H981-F1013 PolarHBondContact NE2-O 2.9Å; S1011-F1013 VanDerWaalsContact C-N 3.28Å; S1011-F1013 PolarHBondContact O-N 3.02Å; F1013-S1015 PolarHBondContact O-N 3.06Å; F1013-K1016 PolarHBondContact O-N 3.03Å
1014	S	92.6	Very high	91.6	Very high	8 Å²	8	36.2 Å²	36.2	6%	0.056	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-12.2	-176	74.7	0	0	0	0	113.6	H981 S1011 E1012 K1016 K1022 S1054	H981-S1014 PolarHBondContact NE2-N 3.04Å; S1011-S1014 VanDerWaalsContact O-CB 3.28Å; S1011-S1014 WeakPolarHBondContact O-CB 3.37Å; S1011-S1014 PolarHBondContact O-N 2.88Å; S1011-S1014 PolarHBondContact O-OG 2.91Å; E1012-S1014 VanDerWaalsContact C-N 3.28Å; E1012-S1014 PolarHBondContact O-N 2.8Å; S1014-K1016 VanDerWaalsContact C-N 3.3Å; S1014-K1022 WeakPolarHBondContact O-CE 3.42Å; S1014-K1022 PolarHBondContact O-NZ 3.35Å; S1014-S1054 WeakPolarHBondContact CB-OG 3.45Å; S1014-S1054 VanDerWaalsContact OG-CB 3.26Å; S1014-S1054 WeakPolarHBondContact OG-CB 3.34Å; S1014-S1054 PolarHBondContact OG-OG 2.94Å
1015	S	89.6	Confident	91.8	Very high	69 Å²	69	36.2 Å²	36.2	48%	0.483	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-26.4	168.4	61	0	0	0	0	113.5	Q970 E1012 F1013	Q970-S1015 PolarHBondContact NE2-O 3.48Å; E1012-S1015 PolarHBondContact O-OG 2.9Å; F1013-S1015 PolarHBondContact O-N 3.06Å
1016	K	91.4	Very high	92	Very high	17 Å²	17	35.9 Å²	35.9	7%	0.074	18%	0.178	C	C	.	.	S	Bend	trans	-94.5	-9.6	-176.1	-57.5	-62.9	-176.5	172.2	0	114.1	A963 G967 V977 F1013 S1014	A963-K1016 HydrophobicContact CB-CG 4.49Å; A963-K1016 WeakPolarHBondContact O-CE 3.49Å; A963-K1016 WeakPolarHBondContact O-CG 3.42Å; G967-K1016 PolarHBondContact O-NZ 2.99Å; V977-K1016 HydrophobicContact CG1-CB 4.13Å; V977-K1016 HydrophobicContact CG2-CB 4.37Å; F1013-K1016 PolarHBondContact O-N 3.03Å; S1014-K1016 VanDerWaalsContact C-N 3.3Å
1017	L	90.4	Very high	92	Very high	6 Å²	6	39 Å²	39	3%	0.031	20%	0.2	C	C	.	.	S	Bend	trans	-74.9	125.2	172.7	-76.3	175	0	0	0	111.7	V977 A978 H981 D1021 K1022 V1025 L1055	V977-L1017 HydrophobicContact CG1-CD2 3.81Å; V977-L1017 HydrophobicContact CG1-CG 4Å; A978-L1017 HydrophobicContact CB-CD2 4.26Å; H981-L1017 VanDerWaalsContact CD2-CD1 3.48Å; H981-L1017 WeakPolarHBondContact CD2-CD1 3.43Å; L1017-D1021 HydrophobicContact CD2-CB 4.1Å; L1017-K1022 HydrophobicContact CB-CG 3.63Å; L1017-K1022 HydrophobicContact CD1-CG 4.24Å; L1017-K1022 VanDerWaalsContact O-CE 3.29Å; L1017-K1022 WeakPolarHBondContact O-CE 3.43Å; L1017-V1025 HydrophobicContact CD1-CB 4.25Å; L1017-V1025 HydrophobicContact CD1-CG1 4.4Å; L1017-V1025 HydrophobicContact CD1-CG2 3.99Å; L1017-V1025 HydrophobicContact CD2-CG2 4.24Å; L1017-L1055 HydrophobicContact CD1-CD2 3.57Å
1018	I	88.4	Confident	92	Very high	36 Å²	36	41.6 Å²	41.6	19%	0.185	21%	0.21	C	C	.	.			trans	-62	154.8	169.3	66.6	168.3	0	0	0	111.7	Q970 R974 Q1020 D1021 K1022	Q970-I1018 HydrophobicContact CB-CG2 3.54Å; R974-I1018 HydrophobicContact CG-CD1 4.2Å; I1018-Q1020 HydrophobicContact CD1-CB 4.13Å; I1018-Q1020 HydrophobicContact CG1-CB 4.37Å; I1018-Q1020 PolarHBondContact O-N 3.37Å; I1018-D1021 HydrophobicContact CG1-CB 4.2Å; I1018-D1021 WeakPolarHBondContact CG1-OD2 3.17Å; I1018-D1021 PolarHBondContact O-N 3.18Å; I1018-K1022 PolarHBondContact O-N 2.89Å
1019	R	86.1	Confident	92.2	Very high	135 Å²	135	40.5 Å²	40.5	51%	0.509	21%	0.205	S	C	.	.	H	α-helix	trans	-51.8	-30.2	-179.1	-167.7	178.1	-171.2	-152.5	-8.7	114.8	G1058 D1060	R1019-G1058 VanDerWaalsContact CZ-O 3.23Å; R1019-G1058 PolarHBondContact NE-O 3.01Å; R1019-G1058 PolarHBondContact NH2-O 3.4Å; R1019-D1060 IonicContact CZ-OD1 3.75Å; R1019-D1060 IonicContact NH2-OD1 2.8Å; R1019-D1060 PolarHBondContact NH2-OD1 2.79Å
1020	Q	88.3	Confident	92	Very high	122 Å²	122	45.2 Å²	45.2	57%	0.57	23%	0.227	S	C	*	.	H	α-helix	trans	-71.6	-45.2	176.1	-169.3	-179.7	13.3	0	0	111.8	R974 I1018 K1023 T1024	R974-Q1020 VanDerWaalsContact NH2-CD 3.32Å; I1018-Q1020 HydrophobicContact CD1-CB 4.13Å; I1018-Q1020 HydrophobicContact CG1-CB 4.37Å; I1018-Q1020 PolarHBondContact O-N 3.37Å; Q1020-K1023 WeakPolarHBondContact O-CB 3.38Å; Q1020-K1023 PolarHBondContact O-N 2.85Å; Q1020-T1024 PolarHBondContact O-N 3.2Å; Q1020-T1024 PolarHBondContact O-OG1 2.76Å
1021	D	91.1	Very high	91.8	Very high	12 Å²	12	52.2 Å²	52.2	6%	0.064	26%	0.257	C	S	.	.	H	α-helix	trans	-83.4	-22.1	-173.5	-61.2	-36	0	0	0	113.1	R974 L1017 I1018 K1023 T1024 V1025	R974-D1021 WeakPolarHBondContact CD-OD2 3.3Å; R974-D1021 WeakPolarHBondContact CG-OD2 3.18Å; R974-D1021 IonicContact CZ-OD1 3.2Å; R974-D1021 IonicContact CZ-OD2 3.36Å; R974-D1021 VanDerWaalsContact CZ-OD2 3.32Å; R974-D1021 IonicContact NE-OD1 3.77Å; R974-D1021 IonicContact NE-OD2 3.85Å; R974-D1021 PolarHBondContact NE-OD2 3.06Å; R974-D1021 IonicContact NH2-OD1 3.93Å; R974-D1021 PolarHBondContact NH2-OD1 3.15Å; R974-D1021 IonicContact NH2-OD2 3.61Å; R974-D1021 PolarHBondContact NH2-OD2 3.25Å; L1017-D1021 HydrophobicContact CD2-CB 4.1Å; I1018-D1021 HydrophobicContact CG1-CB 4.2Å; I1018-D1021 WeakPolarHBondContact CG1-OD2 3.17Å; I1018-D1021 PolarHBondContact O-N 3.18Å; D1021-K1023 PolarHBondContact O-N 3.19Å; D1021-T1024 CarbonylContact O-C 3.54Å; D1021-T1024 WeakPolarHBondContact O-CB 3.32Å; D1021-T1024 PolarHBondContact O-N 3.25Å; D1021-V1025 WeakPolarHBondContact O-CB 3.28Å; D1021-V1025 WeakPolarHBondContact O-CG2 3.41Å; D1021-V1025 PolarHBondContact O-N 3.24Å
1022	K	92.4	Very high	91.5	Very high	33 Å²	33	54.1 Å²	54.1	14%	0.143	26%	0.262	C	S	.	.	H	α-helix	trans	-52	-39.5	163.4	-71.7	-163.9	173.7	-152.4	0	112	S1014 L1017 I1018 H1026 S1054 L1055	S1014-K1022 WeakPolarHBondContact O-CE 3.42Å; S1014-K1022 PolarHBondContact O-NZ 3.35Å; L1017-K1022 HydrophobicContact CB-CG 3.63Å; L1017-K1022 HydrophobicContact CD1-CG 4.24Å; L1017-K1022 VanDerWaalsContact O-CE 3.29Å; L1017-K1022 WeakPolarHBondContact O-CE 3.43Å; I1018-K1022 PolarHBondContact O-N 2.89Å; K1022-H1026 VanDerWaalsContact O-CB 3.26Å; K1022-H1026 WeakPolarHBondContact O-CB 3.49Å; K1022-H1026 PolarHBondContact O-N 3.02Å; K1022-S1054 PolarHBondContact NZ-O 3.28Å; K1022-L1055 HydrophobicContact CB-CD2 4.43Å; K1022-L1055 WeakPolarHBondContact CB-O 3.46Å; K1022-L1055 HydrophobicContact CG-CD2 4.34Å
1023	K	90.6	Very high	91.1	Very high	120 Å²	120	53.3 Å²	53.3	52%	0.522	26%	0.259	S	S	.	.	H	α-helix	trans	-70.7	-41.8	174.3	-60.7	-175.3	177.9	-173.4	0	111.9	Q1020 D1021 H1026 S1027	Q1020-K1023 WeakPolarHBondContact O-CB 3.38Å; Q1020-K1023 PolarHBondContact O-N 2.85Å; D1021-K1023 PolarHBondContact O-N 3.19Å; K1023-H1026 PolarHBondContact O-N 3.45Å; K1023-S1027 PolarHBondContact O-N 3.01Å
1024	T	92.5	Very high	90.4	Very high	80 Å²	80	55.2 Å²	55.2	49%	0.491	27%	0.272	S	S	.	.	H	α-helix	trans	-60.7	-44.4	176.2	-50.4	0	0	0	0	112.4	Q1020 D1021 Y1028	Q1020-T1024 PolarHBondContact O-N 3.2Å; Q1020-T1024 PolarHBondContact O-OG1 2.76Å; D1021-T1024 CarbonylContact O-C 3.54Å; D1021-T1024 WeakPolarHBondContact O-CB 3.32Å; D1021-T1024 PolarHBondContact O-N 3.25Å; T1024-Y1028 PolarHBondContact O-N 2.88Å
1025	V	94.4	Very high	89.4	Confident	4 Å²	4	62.7 Å²	62.7	2%	0.024	31%	0.306	C	S	.	.	H	α-helix	trans	-71.2	-39.5	178.3	173.4	0	0	0	0	110.9	H981 I985 L1017 D1021 Y1028 L1029 L1055	H981-V1025 HydrophobicContact CB-CG1 3.83Å; H981-V1025 HydrophobicContact CB-CG2 3.97Å; I985-V1025 HydrophobicContact CD1-CG1 3.88Å; L1017-V1025 HydrophobicContact CD1-CB 4.25Å; L1017-V1025 HydrophobicContact CD1-CG1 4.4Å; L1017-V1025 HydrophobicContact CD1-CG2 3.99Å; L1017-V1025 HydrophobicContact CD2-CG2 4.24Å; D1021-V1025 WeakPolarHBondContact O-CB 3.28Å; D1021-V1025 WeakPolarHBondContact O-CG2 3.41Å; D1021-V1025 PolarHBondContact O-N 3.24Å; V1025-Y1028 WeakPolarHBondContact O-CA 3.43Å; V1025-Y1028 VanDerWaalsContact O-CB 3.3Å; V1025-Y1028 WeakPolarHBondContact O-CB 3.3Å; V1025-Y1028 PolarHBondContact O-N 2.92Å; V1025-L1029 PolarHBondContact O-N 3.24Å; V1025-L1055 HydrophobicContact CB-CD2 4.22Å; V1025-L1055 HydrophobicContact CG1-CD1 3.85Å; V1025-L1055 HydrophobicContact CG1-CD2 3.93Å
1026	H	93.4	Very high	88.6	Confident	15 Å²	15	62.4 Å²	62.4	7%	0.069	30%	0.304	C	S	.	.	H	α-helix	trans	-59	-48	172.7	-176.9	-82.4	0	0	0	111.6	K1022 K1023 Y1028 L1029 E1030 R1052 L1055	K1022-H1026 VanDerWaalsContact O-CB 3.26Å; K1022-H1026 WeakPolarHBondContact O-CB 3.49Å; K1022-H1026 PolarHBondContact O-N 3.02Å; K1023-H1026 PolarHBondContact O-N 3.45Å; H1026-Y1028 PolarHBondContact O-N 3.25Å; H1026-L1029 WeakPolarHBondContact O-CB 3.39Å; H1026-L1029 PolarHBondContact O-N 2.96Å; H1026-L1029 VanDerWaalsContact O-N 3.16Å; H1026-E1030 IonicContact CE1-OE1 2.75Å; H1026-E1030 PolarHBondContact CE1-OE1 3.12Å; H1026-E1030 IonicContact CE1-OE2 3.74Å; H1026-E1030 IonicContact ND1-OE1 2.75Å; H1026-E1030 IonicContact ND1-OE2 3.83Å; H1026-E1030 PolarHBondContact ND1-OE2 3.31Å; H1026-E1030 WeakPolarHBondContact O-CG 3.32Å; H1026-E1030 PolarHBondContact O-N 3.39Å; H1026-R1052 PolarHBondContact NE2-NE 3.14Å; H1026-L1055 HydrophobicContact CB-CB 4.36Å; H1026-L1055 HydrophobicContact CB-CD1 4.42Å
1027	S	92.4	Very high	88.1	Confident	66 Å²	66	62.9 Å²	62.9	46%	0.462	31%	0.307	S	S	.	.	H	α-helix	trans	-75.7	1.6	174.4	-64.8	0	0	0	0	114.7	K1023 E1030	K1023-S1027 PolarHBondContact O-N 3.01Å; S1027-E1030 WeakPolarHBondContact CA-OE2 3.46Å; S1027-E1030 PolarHBondContact OG-OE2 2.67Å
1028	Y	94.7	Very high	87.2	Confident	55 Å²	55	65 Å²	65	22%	0.216	32%	0.323	C	S	.	.	H	α-helix	trans	-87.3	-48.8	161.2	-157.6	-106.5	0	0	0	110.6	K982 I985 E986 T1024 V1025 H1026 E1030 K1031 F1032	K982-Y1028 HydrophobicContact CB-CD1 4.15Å; K982-Y1028 HydrophobicContact CB-CE1 3.78Å; K982-Y1028 HydrophobicContact CG-CD1 3.97Å; K982-Y1028 HydrophobicContact CG-CE1 3.93Å; K982-Y1028 HydrophobicContact CG-CG 4.32Å; I985-Y1028 HydrophobicContact CD1-CD1 4.39Å; I985-Y1028 HydrophobicContact CG2-CD1 4.44Å; E986-Y1028 HydrophobicContact CG-CE1 4.3Å; E986-Y1028 WeakPolarHBondContact OE1-CE1 3.46Å; E986-Y1028 PolarHBondContact OE1-OH 2.97Å; T1024-Y1028 PolarHBondContact O-N 2.88Å; V1025-Y1028 WeakPolarHBondContact O-CA 3.43Å; V1025-Y1028 VanDerWaalsContact O-CB 3.3Å; V1025-Y1028 WeakPolarHBondContact O-CB 3.3Å; V1025-Y1028 PolarHBondContact O-N 2.92Å; H1026-Y1028 PolarHBondContact O-N 3.25Å; Y1028-E1030 VanDerWaalsContact C-N 3.3Å; Y1028-E1030 PolarHBondContact O-N 2.85Å; Y1028-K1031 HydrophobicContact CD2-CD 4.29Å; Y1028-K1031 VanDerWaalsContact O-CB 3.3Å; Y1028-K1031 WeakPolarHBondContact O-CB 3.42Å; Y1028-K1031 WeakPolarHBondContact O-CG 3.32Å; Y1028-K1031 PolarHBondContact O-N 2.85Å; Y1028-F1032 AromaticContact CD1-CE2 3.94Å; Y1028-F1032 HydrophobicContact CD1-CE2 3.94Å; Y1028-F1032 AromaticContact CE1-CE2 3.72Å; Y1028-F1032 HydrophobicContact CE1-CE2 3.72Å; Y1028-F1032 HydrophobicContact CE1-CZ 4.16Å; Y1028-F1032 WeakPolarHBondContact O-CD2 3.45Å
1029	L	93.6	Very high	86.6	Confident	0 Å²	0	70.6 Å²	70.6	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-54.9	-41.9	175	-178.9	65.3	0	0	0	112.4	I985 F989 V1025 H1026 K1031 F1032 M1033 L1048 Y1051 R1052 L1055	I985-L1029 HydrophobicContact CD1-CB 3.94Å; I985-L1029 HydrophobicContact CD1-CD1 4.28Å; I985-L1029 HydrophobicContact CG1-CD1 4.18Å; I985-L1029 HydrophobicContact CG2-CD1 4.16Å; F989-L1029 HydrophobicContact CE2-CD1 3.68Å; F989-L1029 HydrophobicContact CZ-CD1 4.22Å; V1025-L1029 PolarHBondContact O-N 3.24Å; H1026-L1029 WeakPolarHBondContact O-CB 3.39Å; H1026-L1029 PolarHBondContact O-N 2.96Å; H1026-L1029 VanDerWaalsContact O-N 3.16Å; L1029-K1031 PolarHBondContact O-N 3.49Å; L1029-F1032 PolarHBondContact O-N 3.04Å; L1029-M1033 HydrophobicContact CD1-CG 4.49Å; L1029-M1033 HydrophobicContact CD1-SD 4.49Å; L1029-M1033 HydrophobicContact CD2-SD 4.07Å; L1029-M1033 HydrophobicContact CG-CG 4.26Å; L1029-M1033 HydrophobicContact CG-SD 3.79Å; L1029-M1033 PolarHBondContact O-N 3.16Å; L1029-L1048 HydrophobicContact CD1-CD1 4Å; L1029-L1048 HydrophobicContact CD2-CD1 4.21Å; L1029-L1048 HydrophobicContact CG-CD1 4.43Å; L1029-Y1051 HydrophobicContact CD1-CD1 4.45Å; L1029-Y1051 HydrophobicContact CD1-CE1 4.31Å; L1029-Y1051 HydrophobicContact CD2-CD1 3.88Å; L1029-Y1051 HydrophobicContact CD2-CE1 4.03Å; L1029-R1052 HydrophobicContact CD2-CB 4.24Å; L1029-L1055 HydrophobicContact CD2-CD1 4.36Å
1030	E	90.5	Very high	86.2	Confident	100 Å²	100	66.9 Å²	66.9	47%	0.467	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-17.1	176.5	-74.9	177.2	132.9	0	0	114.2	H1026 S1027 Y1028	H1026-E1030 IonicContact CE1-OE1 2.75Å; H1026-E1030 PolarHBondContact CE1-OE1 3.12Å; H1026-E1030 IonicContact CE1-OE2 3.74Å; H1026-E1030 IonicContact ND1-OE1 2.75Å; H1026-E1030 IonicContact ND1-OE2 3.83Å; H1026-E1030 PolarHBondContact ND1-OE2 3.31Å; H1026-E1030 WeakPolarHBondContact O-CG 3.32Å; H1026-E1030 PolarHBondContact O-N 3.39Å; S1027-E1030 WeakPolarHBondContact CA-OE2 3.46Å; S1027-E1030 PolarHBondContact OG-OE2 2.67Å; Y1028-E1030 VanDerWaalsContact C-N 3.3Å; Y1028-E1030 PolarHBondContact O-N 2.85Å
1031	K	91.7	Very high	85.5	Confident	147 Å²	147	69 Å²	69	64%	0.639	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.8	-22	175.7	-55.9	177.1	-175	173.9	0	113.6	Y1028 L1029	Y1028-K1031 HydrophobicContact CD2-CD 4.29Å; Y1028-K1031 VanDerWaalsContact O-CB 3.3Å; Y1028-K1031 WeakPolarHBondContact O-CB 3.42Å; Y1028-K1031 WeakPolarHBondContact O-CG 3.32Å; Y1028-K1031 PolarHBondContact O-N 2.85Å; L1029-K1031 PolarHBondContact O-N 3.49Å
1032	F	88.6	Confident	85	Confident	70 Å²	70	73.2 Å²	73.2	31%	0.307	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.1	-20.5	-178.7	-61.2	-94.5	0	0	0	112.1	I985 E986 F989 Y1028 L1029	I985-F1032 HydrophobicContact CG2-CD2 3.61Å; I985-F1032 HydrophobicContact CG2-CE2 3.83Å; I985-F1032 HydrophobicContact CG2-CG 4.16Å; E986-F1032 HydrophobicContact CG-CE1 4.15Å; E986-F1032 HydrophobicContact CG-CZ 3.65Å; F989-F1032 HydrophobicContact CB-CB 4.17Å; F989-F1032 HydrophobicContact CB-CD1 3.85Å; F989-F1032 HydrophobicContact CB-CG 4.33Å; F989-F1032 HydrophobicContact CD1-CB 3.99Å; F989-F1032 HydrophobicContact CD2-CB 3.72Å; F989-F1032 HydrophobicContact CD2-CG 4.22Å; F989-F1032 HydrophobicContact CE1-CB 4.31Å; F989-F1032 HydrophobicContact CE2-CB 4.08Å; F989-F1032 HydrophobicContact CG-CB 3.69Å; F989-F1032 HydrophobicContact CG-CD1 4.3Å; F989-F1032 HydrophobicContact CG-CG 4.28Å; F989-F1032 HydrophobicContact CZ-CB 4.35Å; Y1028-F1032 AromaticContact CD1-CE2 3.94Å; Y1028-F1032 HydrophobicContact CD1-CE2 3.94Å; Y1028-F1032 AromaticContact CE1-CE2 3.72Å; Y1028-F1032 HydrophobicContact CE1-CE2 3.72Å; Y1028-F1032 HydrophobicContact CE1-CZ 4.16Å; Y1028-F1032 WeakPolarHBondContact O-CD2 3.45Å; L1029-F1032 PolarHBondContact O-N 3.04Å
1033	M	84.9	Confident	84.2	Confident	24 Å²	24	77.3 Å²	77.3	12%	0.118	38%	0.379	C	S	.	.			trans	-80.1	135.2	176.7	-66.3	-179.9	59.5	0	0	111.8	F989 L1029 S1038 L1048	F989-M1033 HydrophobicContact CZ-CG 4.4Å; L1029-M1033 HydrophobicContact CD1-CG 4.49Å; L1029-M1033 HydrophobicContact CD1-SD 4.49Å; L1029-M1033 HydrophobicContact CD2-SD 4.07Å; L1029-M1033 HydrophobicContact CG-CG 4.26Å; L1029-M1033 HydrophobicContact CG-SD 3.79Å; L1029-M1033 PolarHBondContact O-N 3.16Å; M1033-S1038 WeakPolarHBondContact CE-OG 3.44Å; M1033-L1048 HydrophobicContact CE-CD1 4.47Å; M1033-L1048 HydrophobicContact CE-CD2 4.08Å; M1033-L1048 HydrophobicContact CE-CG 4.35Å; M1033-L1048 HydrophobicContact CG-CD1 4.23Å; M1033-L1048 HydrophobicContact CG-CD2 4.33Å; M1033-L1048 HydrophobicContact SD-CD1 3.93Å; M1033-L1048 HydrophobicContact SD-CD2 4.44Å; M1033-L1048 HydrophobicContact SD-CG 4.45Å
1034	S	80.8	Confident	83.7	Confident	40 Å²	40	75.3 Å²	75.3	28%	0.28	38%	0.377	S	S	.	.			trans	-84.6	164.5	163.4	74.6	0	0	0	0	111.8	S1036 M1037 S1038	S1034-S1036 VanDerWaalsContact C-N 3.26Å; S1034-S1036 PolarHBondContact O-N 2.93Å; S1034-S1036 PolarHBondContact OG-N 2.79Å; S1034-S1036 PolarHBondContact OG-OG 3.03Å; S1034-M1037 PolarHBondContact O-N 3.27Å; S1034-M1037 VanDerWaalsContact OG-CG 3.27Å; S1034-M1037 WeakPolarHBondContact OG-CG 3.42Å; S1034-M1037 PolarHBondContact OG-N 3.25Å; S1034-S1038 PolarHBondContact O-N 3.32Å; S1034-S1038 VanDerWaalsContact O-N 3.15Å; S1034-S1038 PolarHBondContact O-OG 3.36Å
1035	E	71.5	Confident	83.4	Confident	165 Å²	165	71.6 Å²	71.6	77%	0.771	35%	0.354	S	S	*	.	H	α-helix	trans	-57.6	-41.9	169.7	-160.4	163.3	-145.4	0	0	110.5	M1037 S1038 E1039	E1035-M1037 PolarHBondContact O-N 3.01Å; E1035-S1038 WeakPolarHBondContact O-CB 3.33Å; E1035-S1038 PolarHBondContact O-N 3.39Å; E1035-S1038 VanDerWaalsContact O-N 3.16Å; E1035-E1039 PolarHBondContact O-N 3.44Å
1036	S	72.8	Confident	83.1	Confident	63 Å²	63	74.7 Å²	74.7	44%	0.441	37%	0.37	S	S	.	.	H	α-helix	trans	-68.4	-26.8	176.7	56.9	0	0	0	0	115.3	S1034 R1040	S1034-S1036 VanDerWaalsContact C-N 3.26Å; S1034-S1036 PolarHBondContact O-N 2.93Å; S1034-S1036 PolarHBondContact OG-N 2.79Å; S1034-S1036 PolarHBondContact OG-OG 3.03Å; S1036-R1040 WeakPolarHBondContact O-CG 3.24Å
1037	M	80.4	Confident	82.9	Confident	27 Å²	27	74.1 Å²	74.1	13%	0.133	37%	0.367	C	S	.	.	H	α-helix	trans	-74.2	-33.2	171.2	-70	174	-177.7	0	0	111.4	F989 S1034 E1035 E1039 W1045 L1048	F989-M1037 HydrophobicContact CE1-SD 4.27Å; S1034-M1037 PolarHBondContact O-N 3.27Å; S1034-M1037 VanDerWaalsContact OG-CG 3.27Å; S1034-M1037 WeakPolarHBondContact OG-CG 3.42Å; S1034-M1037 PolarHBondContact OG-N 3.25Å; E1035-M1037 PolarHBondContact O-N 3.01Å; M1037-E1039 VanDerWaalsContact C-N 3.31Å; M1037-E1039 PolarHBondContact O-N 2.91Å; M1037-W1045 HydrophobicContact CB-CZ3 4.08Å; M1037-W1045 HydrophobicContact CE-CH2 4.19Å; M1037-W1045 HydrophobicContact CE-CZ3 4.35Å; M1037-W1045 HydrophobicContact CG-CE3 4.46Å; M1037-W1045 HydrophobicContact CG-CH2 3.71Å; M1037-W1045 HydrophobicContact CG-CZ3 3.54Å; M1037-W1045 HydrophobicContact SD-CH2 4.4Å; M1037-W1045 HydrophobicContact SD-CZ3 4.06Å; M1037-L1048 HydrophobicContact CB-CD2 4.46Å
1038	S	72.8	Confident	82.8	Confident	52 Å²	52	71.1 Å²	71.1	36%	0.364	35%	0.346	S	S	.	.	H	α-helix	trans	-69.6	-26.8	-176.2	-56.8	0	0	0	0	113.4	M1033 S1034 E1035 R1041	M1033-S1038 WeakPolarHBondContact CE-OG 3.44Å; S1034-S1038 PolarHBondContact O-N 3.32Å; S1034-S1038 VanDerWaalsContact O-N 3.15Å; S1034-S1038 PolarHBondContact O-OG 3.36Å; E1035-S1038 WeakPolarHBondContact O-CB 3.33Å; E1035-S1038 PolarHBondContact O-N 3.39Å; E1035-S1038 VanDerWaalsContact O-N 3.16Å; S1038-R1041 PolarHBondContact O-NH1 2.77Å; S1038-R1041 PolarHBondContact O-NH2 3.44Å
1039	E	74.9	Confident	82.5	Confident	152 Å²	152	70.4 Å²	70.4	71%	0.71	35%	0.346	S	S	*	.	H	α-helix	trans	-91	-19	-178.2	-63.9	-168.9	143.7	0	0	114	E1035 M1037 R1041	E1035-E1039 PolarHBondContact O-N 3.44Å; M1037-E1039 VanDerWaalsContact C-N 3.31Å; M1037-E1039 PolarHBondContact O-N 2.91Å; E1039-R1041 PolarHBondContact O-NH1 3.04Å
1040	R	77.8	Confident	82.3	Confident	58 Å²	58	72.8 Å²	72.8	22%	0.219	36%	0.362	C	S	.	.			trans	-69.2	146.9	-178.3	-76.1	175.7	-180	-107.9	6.9	113.2	E998 S1036 E1042 W1045	E998-R1040 PolarHBondContact O-NH1 3.5Å; E998-R1040 VanDerWaalsContact O-NH1 3.16Å; E998-R1040 PolarHBondContact O-NH2 3.43Å; S1036-R1040 WeakPolarHBondContact O-CG 3.24Å; R1040-E1042 IonicContact CZ-OE2 3.97Å; R1040-E1042 IonicContact NH1-OE1 3.41Å; R1040-E1042 PolarHBondContact NH1-OE1 3.49Å; R1040-E1042 IonicContact NH1-OE2 3.42Å; R1040-E1042 PolarHBondContact NH1-OE2 2.85Å; R1040-W1045 HydrophobicContact CB-CD2 4.45Å; R1040-W1045 HydrophobicContact CB-CG 4.12Å; R1040-W1045 VanDerWaalsContact CD-CE2 3.49Å
1041	R	74	Confident	82.5	Confident	167 Å²	167	68 Å²	68	63%	0.63	34%	0.34	S	S	*	.			trans	-137.3	13.6	-176.5	-60.7	-64.8	178.5	-92.4	-4.3	113.3	S1038 E1039	S1038-R1041 PolarHBondContact O-NH1 2.77Å; S1038-R1041 PolarHBondContact O-NH2 3.44Å; E1039-R1041 PolarHBondContact O-NH1 3.04Å
1042	E	80.4	Confident	82.5	Confident	99 Å²	99	64.9 Å²	64.9	46%	0.463	32%	0.324	S	S	.	.	S	Bend	trans	-73.2	147.8	176.9	-49.2	150.9	145.8	0	0	109.2	R1040 V1044 W1045	R1040-E1042 IonicContact CZ-OE2 3.97Å; R1040-E1042 IonicContact NH1-OE1 3.41Å; R1040-E1042 PolarHBondContact NH1-OE1 3.49Å; R1040-E1042 IonicContact NH1-OE2 3.42Å; R1040-E1042 PolarHBondContact NH1-OE2 2.85Å; E1042-V1044 HydrophobicContact CB-CG2 4.28Å; E1042-V1044 PolarHBondContact O-N 2.93Å; E1042-W1045 PolarHBondContact O-N 2.93Å; E1042-W1045 VanDerWaalsContact OE2-CD1 3.28Å; E1042-W1045 PolarHBondContact OE2-NE1 3.13Å
1043	D	76	Confident	82.6	Confident	120 Å²	120	65.1 Å²	65.1	64%	0.642	33%	0.329	S	S	*	.	G	3₁₀ helix	trans	-58.9	-24.9	-171.4	-57.5	-52.6	0	0	0	114.3	R947 W1045 L1046	R947-D1043 VanDerWaalsContact CZ-O 3.3Å; R947-D1043 PolarHBondContact NH1-O 2.97Å; R947-D1043 PolarHBondContact NH2-O 2.59Å; R947-D1043 VanDerWaalsContact NH2-O 3.07Å; D1043-W1045 PolarHBondContact O-N 2.58Å; D1043-L1046 WeakPolarHBondContact O-CB 3.49Å; D1043-L1046 PolarHBondContact O-N 3Å
1044	V	79.5	Confident	82.9	Confident	78 Å²	78	65.1 Å²	65.1	47%	0.473	33%	0.331	S	S	.	.	G	3₁₀ helix	trans	-69.3	-15	176.1	-57.2	0	0	0	0	113.7	P1000 E1042	P1000-V1044 HydrophobicContact CG-CB 4.3Å; P1000-V1044 HydrophobicContact CG-CG2 4.23Å; E1042-V1044 HydrophobicContact CB-CG2 4.28Å; E1042-V1044 PolarHBondContact O-N 2.93Å
1045	W	86.3	Confident	83.3	Confident	1 Å²	1	63.5 Å²	63.5	0%	0.004	32%	0.319	C	S	.	.	G	3₁₀ helix	trans	-100.4	-1.3	172.9	-61	90.7	0	0	0	113.1	P1000 L1004 M1037 R1040 E1042 D1043 P1047 L1048 I1049	P1000-W1045 HydrophobicContact CB-CD2 4.45Å; P1000-W1045 HydrophobicContact CB-CE3 4.46Å; P1000-W1045 HydrophobicContact CB-CH2 4.22Å; P1000-W1045 HydrophobicContact CB-CZ2 4.2Å; P1000-W1045 HydrophobicContact CB-CZ3 4.33Å; L1004-W1045 HydrophobicContact CD2-CD2 4.33Å; L1004-W1045 HydrophobicContact CD2-CE3 3.63Å; L1004-W1045 HydrophobicContact CD2-CZ3 4.01Å; M1037-W1045 HydrophobicContact CB-CZ3 4.08Å; M1037-W1045 HydrophobicContact CE-CH2 4.19Å; M1037-W1045 HydrophobicContact CE-CZ3 4.35Å; M1037-W1045 HydrophobicContact CG-CE3 4.46Å; M1037-W1045 HydrophobicContact CG-CH2 3.71Å; M1037-W1045 HydrophobicContact CG-CZ3 3.54Å; M1037-W1045 HydrophobicContact SD-CH2 4.4Å; M1037-W1045 HydrophobicContact SD-CZ3 4.06Å; R1040-W1045 HydrophobicContact CB-CD2 4.45Å; R1040-W1045 HydrophobicContact CB-CG 4.12Å; R1040-W1045 VanDerWaalsContact CD-CE2 3.49Å; E1042-W1045 PolarHBondContact O-N 2.93Å; E1042-W1045 VanDerWaalsContact OE2-CD1 3.28Å; E1042-W1045 PolarHBondContact OE2-NE1 3.13Å; D1043-W1045 PolarHBondContact O-N 2.58Å; W1045-P1047 VanDerWaalsContact C-N 3.33Å; W1045-L1048 HydrophobicContact CE3-CD2 4.21Å; W1045-L1048 WeakPolarHBondContact O-CB 3.43Å; W1045-L1048 PolarHBondContact O-N 2.75Å; W1045-L1048 VanDerWaalsContact O-N 3.07Å; W1045-I1049 HydrophobicContact CB-CD1 4.46Å; W1045-I1049 WeakPolarHBondContact O-CG1 3.45Å; W1045-I1049 PolarHBondContact O-N 3.11Å; W1045-I1049 VanDerWaalsContact O-N 3.16Å
1046	L	87.9	Confident	83.9	Confident	70 Å²	70	59.1 Å²	59.1	37%	0.366	30%	0.301	S	S	.	.	H	α-helix	trans	-53.1	-37.9	179	-172.6	63.1	0	0	0	114.2	D1043 L1048 I1049 S1050	D1043-L1046 WeakPolarHBondContact O-CB 3.49Å; D1043-L1046 PolarHBondContact O-N 3Å; L1046-L1048 VanDerWaalsContact C-N 3.3Å; L1046-L1048 PolarHBondContact O-N 2.92Å; L1046-I1049 PolarHBondContact O-N 3.08Å; L1046-I1049 VanDerWaalsContact O-N 3.14Å; L1046-S1050 WeakPolarHBondContact O-CB 3.43Å; L1046-S1050 PolarHBondContact O-N 3.15Å; L1046-S1050 PolarHBondContact O-OG 3.15Å
1047	P	89.6	Confident	83.3	Confident	2 Å²	2	61.7 Å²	61.7	1%	0.013	31%	0.314	C	S	.	.	H	α-helix	trans	-52.8	-45.3	173.9	-28.8	35.4	0	0	0	113.4	L1004 A1005 L1007 E1008 W1045 Y1051	L1004-P1047 VanDerWaalsContact O-CB 3.31Å; L1004-P1047 WeakPolarHBondContact O-CB 3.44Å; A1005-P1047 HydrophobicContact CB-CG 4.27Å; L1007-P1047 HydrophobicContact CB-CB 4.24Å; E1008-P1047 HydrophobicContact CG-CB 3.84Å; E1008-P1047 HydrophobicContact CG-CG 4.04Å; W1045-P1047 VanDerWaalsContact C-N 3.33Å; P1047-Y1051 VanDerWaalsContact O-CB 3.27Å; P1047-Y1051 WeakPolarHBondContact O-CB 3.41Å; P1047-Y1051 PolarHBondContact O-N 2.77Å
1048	L	90.5	Very high	82	Confident	4 Å²	4	61.7 Å²	61.7	2%	0.021	32%	0.321	C	S	.	.	H	α-helix	trans	-69.8	-39.3	179.2	-178.3	58.9	0	0	0	111.7	F989 L1004 L1007 L1029 M1033 M1037 W1045 L1046 R1052	F989-L1048 HydrophobicContact CZ-CD1 4.03Å; L1004-L1048 HydrophobicContact CD1-CB 4.21Å; L1004-L1048 HydrophobicContact CD2-CB 4.39Å; L1007-L1048 HydrophobicContact CD1-CB 4.16Å; L1007-L1048 HydrophobicContact CD1-CD1 3.65Å; L1029-L1048 HydrophobicContact CD1-CD1 4Å; L1029-L1048 HydrophobicContact CD2-CD1 4.21Å; L1029-L1048 HydrophobicContact CG-CD1 4.43Å; M1033-L1048 HydrophobicContact CE-CD1 4.47Å; M1033-L1048 HydrophobicContact CE-CD2 4.08Å; M1033-L1048 HydrophobicContact CE-CG 4.35Å; M1033-L1048 HydrophobicContact CG-CD1 4.23Å; M1033-L1048 HydrophobicContact CG-CD2 4.33Å; M1033-L1048 HydrophobicContact SD-CD1 3.93Å; M1033-L1048 HydrophobicContact SD-CD2 4.44Å; M1033-L1048 HydrophobicContact SD-CG 4.45Å; M1037-L1048 HydrophobicContact CB-CD2 4.46Å; W1045-L1048 HydrophobicContact CE3-CD2 4.21Å; W1045-L1048 WeakPolarHBondContact O-CB 3.43Å; W1045-L1048 PolarHBondContact O-N 2.75Å; W1045-L1048 VanDerWaalsContact O-N 3.07Å; L1046-L1048 VanDerWaalsContact C-N 3.3Å; L1046-L1048 PolarHBondContact O-N 2.92Å; L1048-R1052 WeakPolarHBondContact O-CB 3.5Å; L1048-R1052 PolarHBondContact O-N 3.16Å
1049	I	88.8	Confident	80.3	Confident	40 Å²	40	61.7 Å²	61.7	21%	0.205	33%	0.329	C	S	.	.	H	α-helix	trans	-65.5	-49.5	178.6	-63.2	167.8	0	0	0	110.1	W1045 L1046 R1052 N1053	W1045-I1049 HydrophobicContact CB-CD1 4.46Å; W1045-I1049 WeakPolarHBondContact O-CG1 3.45Å; W1045-I1049 PolarHBondContact O-N 3.11Å; W1045-I1049 VanDerWaalsContact O-N 3.16Å; L1046-I1049 PolarHBondContact O-N 3.08Å; L1046-I1049 VanDerWaalsContact O-N 3.14Å; I1049-R1052 PolarHBondContact O-N 3.39Å; I1049-N1053 VanDerWaalsContact O-CB 3.31Å; I1049-N1053 WeakPolarHBondContact O-CB 3.31Å; I1049-N1053 PolarHBondContact O-N 3.14Å; I1049-N1053 PolarHBondContact O-ND2 2.75Å; I1049-N1053 PolarHBondContact O-OD1 3.1Å
1050	S	89.3	Confident	78.5	Confident	49 Å²	49	60.1 Å²	60.1	34%	0.343	33%	0.325	S	S	.	.	H	α-helix	trans	-63.6	-47.5	-179.7	-64.4	0	0	0	0	112.3	L1046 N1053 S1054	L1046-S1050 WeakPolarHBondContact O-CB 3.43Å; L1046-S1050 PolarHBondContact O-N 3.15Å; L1046-S1050 PolarHBondContact O-OG 3.15Å; S1050-N1053 PolarHBondContact O-N 2.71Å; S1050-S1054 PolarHBondContact O-N 2.78Å
1051	Y	94	Very high	76.4	Confident	0 Å²	0	66.4 Å²	66.4	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-63.8	-42.8	176.8	179.9	-114.1	0	0	0	112.5	H981 I985 L1007 L1010 L1029 P1047 N1053 S1054 L1055	H981-Y1051 AromaticContact CE1-CE2 3.9Å; H981-Y1051 AromaticContact ND1-CE2 3.66Å; H981-Y1051 AromaticContact ND1-CZ 3.72Å; H981-Y1051 PolarHBondContact ND1-OH 2.96Å; I985-Y1051 HydrophobicContact CD1-CE1 4.01Å; I985-Y1051 HydrophobicContact CG1-CE1 3.87Å; L1007-Y1051 HydrophobicContact CB-CD1 4.35Å; L1007-Y1051 HydrophobicContact CB-CG 4.17Å; L1007-Y1051 HydrophobicContact CD1-CD1 4.31Å; L1007-Y1051 HydrophobicContact CD2-CD1 3.85Å; L1007-Y1051 HydrophobicContact CD2-CE1 4.01Å; L1007-Y1051 HydrophobicContact CD2-CG 4.38Å; L1007-Y1051 HydrophobicContact CG-CD1 4.4Å; L1010-Y1051 HydrophobicContact CB-CD2 4.47Å; L1010-Y1051 HydrophobicContact CB-CE2 4.14Å; L1010-Y1051 HydrophobicContact CD2-CE1 4.21Å; L1010-Y1051 HydrophobicContact CD2-CE2 3.93Å; L1010-Y1051 WeakPolarHBondContact CD2-OH 3.33Å; L1010-Y1051 HydrophobicContact CG-CE2 3.77Å; L1029-Y1051 HydrophobicContact CD1-CD1 4.45Å; L1029-Y1051 HydrophobicContact CD1-CE1 4.31Å; L1029-Y1051 HydrophobicContact CD2-CD1 3.88Å; L1029-Y1051 HydrophobicContact CD2-CE1 4.03Å; P1047-Y1051 VanDerWaalsContact O-CB 3.27Å; P1047-Y1051 WeakPolarHBondContact O-CB 3.41Å; P1047-Y1051 PolarHBondContact O-N 2.77Å; Y1051-N1053 VanDerWaalsContact C-N 3.29Å; Y1051-N1053 PolarHBondContact O-N 2.99Å; Y1051-S1054 PolarHBondContact O-N 3.03Å; Y1051-S1054 PolarHBondContact O-OG 2.97Å; Y1051-L1055 HydrophobicContact CD1-CD1 4.31Å; Y1051-L1055 HydrophobicContact CE1-CD1 3.87Å; Y1051-L1055 HydrophobicContact CE2-CD1 4.47Å; Y1051-L1055 WeakPolarHBondContact O-CG 3.25Å; Y1051-L1055 PolarHBondContact O-N 2.76Å
1052	R	91.6	Very high	74.4	Confident	82 Å²	82	66.7 Å²	66.7	31%	0.309	37%	0.371	S	S	.	.	H	α-helix	trans	-62.5	-38.3	174.2	-177.1	176.4	172.2	-80.7	-1.9	111.5	H1026 L1029 L1048 I1049 L1055 L1056	H1026-R1052 PolarHBondContact NE2-NE 3.14Å; L1029-R1052 HydrophobicContact CD2-CB 4.24Å; L1048-R1052 WeakPolarHBondContact O-CB 3.5Å; L1048-R1052 PolarHBondContact O-N 3.16Å; I1049-R1052 PolarHBondContact O-N 3.39Å; R1052-L1055 PolarHBondContact O-N 2.92Å; R1052-L1056 HydrophobicContact CG-CD1 3.99Å; R1052-L1056 VanDerWaalsContact O-CG 3.29Å; R1052-L1056 WeakPolarHBondContact O-CG 3.24Å; R1052-L1056 PolarHBondContact O-N 3.29Å
1053	N	90.2	Very high	72.1	Confident	74 Å²	74	70 Å²	70	40%	0.396	39%	0.387	S	S	.	.	H	α-helix	trans	-66.9	-42.2	177.3	-71.9	-13.2	0	0	0	112	I1049 S1050 Y1051 L1055 L1056 T1057	I1049-N1053 VanDerWaalsContact O-CB 3.31Å; I1049-N1053 WeakPolarHBondContact O-CB 3.31Å; I1049-N1053 PolarHBondContact O-N 3.14Å; I1049-N1053 PolarHBondContact O-ND2 2.75Å; I1049-N1053 PolarHBondContact O-OD1 3.1Å; S1050-N1053 PolarHBondContact O-N 2.71Å; Y1051-N1053 VanDerWaalsContact C-N 3.29Å; Y1051-N1053 PolarHBondContact O-N 2.99Å; N1053-L1055 PolarHBondContact O-N 3Å; N1053-L1056 CarbonylContact O-C 3.57Å; N1053-L1056 WeakPolarHBondContact O-CA 3.47Å; N1053-L1056 PolarHBondContact O-N 2.96Å; N1053-T1057 WeakPolarHBondContact O-CG2 3.25Å; N1053-T1057 PolarHBondContact O-N 3.13Å; N1053-T1057 PolarHBondContact O-OG1 3.29Å
1054	S	92.1	Very high	69.8	Low	25 Å²	25	72.1 Å²	72.1	18%	0.175	40%	0.395	C	S	.	.	H	α-helix	trans	-68.1	-20.5	179.9	77.4	0	0	0	0	114.1	S1014 K1022 S1050 Y1051	S1014-S1054 WeakPolarHBondContact CB-OG 3.45Å; S1014-S1054 VanDerWaalsContact OG-CB 3.26Å; S1014-S1054 WeakPolarHBondContact OG-CB 3.34Å; S1014-S1054 PolarHBondContact OG-OG 2.94Å; K1022-S1054 PolarHBondContact NZ-O 3.28Å; S1050-S1054 PolarHBondContact O-N 2.78Å; Y1051-S1054 PolarHBondContact O-N 3.03Å; Y1051-S1054 PolarHBondContact O-OG 2.97Å
1055	L	89.4	Confident	67.3	Low	6 Å²	6	73.8 Å²	73.8	3%	0.031	41%	0.409	C	S	.	.	H	α-helix	trans	-79.6	-27.1	167.1	-63.2	173	0	0	0	112.8	L1017 K1022 V1025 H1026 L1029 Y1051 R1052 N1053	L1017-L1055 HydrophobicContact CD1-CD2 3.57Å; K1022-L1055 HydrophobicContact CB-CD2 4.43Å; K1022-L1055 WeakPolarHBondContact CB-O 3.46Å; K1022-L1055 HydrophobicContact CG-CD2 4.34Å; V1025-L1055 HydrophobicContact CB-CD2 4.22Å; V1025-L1055 HydrophobicContact CG1-CD1 3.85Å; V1025-L1055 HydrophobicContact CG1-CD2 3.93Å; H1026-L1055 HydrophobicContact CB-CB 4.36Å; H1026-L1055 HydrophobicContact CB-CD1 4.42Å; L1029-L1055 HydrophobicContact CD2-CD1 4.36Å; Y1051-L1055 HydrophobicContact CD1-CD1 4.31Å; Y1051-L1055 HydrophobicContact CE1-CD1 3.87Å; Y1051-L1055 HydrophobicContact CE2-CD1 4.47Å; Y1051-L1055 WeakPolarHBondContact O-CG 3.25Å; Y1051-L1055 PolarHBondContact O-N 2.76Å; R1052-L1055 PolarHBondContact O-N 2.92Å; N1053-L1055 PolarHBondContact O-N 3Å
1056	L	83	Confident	64.7	Low	73 Å²	73	80.1 Å²	80.1	38%	0.382	45%	0.448	S	S	.	.	H	α-helix	trans	-92.7	-23.2	-177.7	-71	173.8	0	0	0	114.4	R1052 N1053 G1058 G1059	R1052-L1056 HydrophobicContact CG-CD1 3.99Å; R1052-L1056 VanDerWaalsContact O-CG 3.29Å; R1052-L1056 WeakPolarHBondContact O-CG 3.24Å; R1052-L1056 PolarHBondContact O-N 3.29Å; N1053-L1056 CarbonylContact O-C 3.57Å; N1053-L1056 WeakPolarHBondContact O-CA 3.47Å; N1053-L1056 PolarHBondContact O-N 2.96Å; L1056-G1058 PolarHBondContact O-N 3.33Å; L1056-G1059 PolarHBondContact O-N 3.24Å
1057	T	61.6	Low	61.9	Low	117 Å²	117	82.4 Å²	82.4	72%	0.718	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	18.7	179.2	47.5	0	0	0	0	115.1	N1053	N1053-T1057 WeakPolarHBondContact O-CG2 3.25Å; N1053-T1057 PolarHBondContact O-N 3.13Å; N1053-T1057 PolarHBondContact O-OG1 3.29Å
1058	G	53.1	Low	59	Low	27 Å²	27	88.5 Å²	88.5	28%	0.278	51%	0.508	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.4	25.7	158.5	0	0	0	0	0	112.4	R1019 L1056	R1019-G1058 VanDerWaalsContact CZ-O 3.23Å; R1019-G1058 PolarHBondContact NE-O 3.01Å; R1019-G1058 PolarHBondContact NH2-O 3.4Å; L1056-G1058 PolarHBondContact O-N 3.33Å
1059	G	37.4	Very low	56	Low	51 Å²	51	91.4 Å²	91.4	53%	0.526	54%	0.538	S	S	.	.	S	Bend	trans	-105	82.7	-170.9	0	0	0	0	0	114.5	L1056	L1056-G1059 PolarHBondContact O-N 3.24Å
1060	D	37	Very low	53.2	Low	120 Å²	120	95.4 Å²	95.4	64%	0.642	57%	0.57	S	S	*	*	S	Bend	trans	65.3	74.5	151.7	-53.3	-35.8	0	0	0	118.1	R1019	R1019-D1060 IonicContact CZ-OD1 3.75Å; R1019-D1060 IonicContact NH2-OD1 2.8Å; R1019-D1060 PolarHBondContact NH2-OD1 2.79Å
1061	E	33.1	Very low	50.3	Low	190 Å²	190	98 Å²	98	89%	0.888	59%	0.588	S	S	*	*			trans	-142.6	-22.7	145.3	-79.6	-147.2	144.7	0	0	115.3	H1063	E1061-H1063 PolarHBondContact O-N 3.37Å
1062	D	32.8	Very low	47.1	Very low	173 Å²	173	102.6 Å²	102.6	93%	0.925	62%	0.62	S	S	*	*	S	Bend	trans	-71.7	51.4	-178	-69.3	-49.5	0	0	0	116.1
1063	H	31.1	Very low	44.2	Very low	169 Å²	169	108 Å²	108	78%	0.782	65%	0.646	S	S	*	*	S	Bend	trans	-155.7	109.3	156.3	-142.7	-93.8	0	0	0	111.7	E1061	E1061-H1063 PolarHBondContact O-N 3.37Å
1064	M	28.2	Very low	41.2	Very low	164 Å²	164	111.2 Å²	111.2	81%	0.808	67%	0.668	S	S	*	*			trans	71.9	84.3	170.5	-53.3	-65.3	-68.8	0	0	118.4
1065	S	27.1	Very low	38	Very low	112 Å²	112	113.5 Å²	113.5	78%	0.783	70%	0.696	S	S	*	*				-162.4	111.8	118.5	56.8	0	0	0	0	113.8
1066	V	32	Very low	34.9	Very low	134 Å²	134	118.6 Å²	118.6	81%	0.812	73%	0.732	S	S	*	*			trans	-77	153.7	144.1	178.3	0	0	0	0	107.3
1067	T	27.7	Very low	32.3	Very low	119 Å²	119	120.8 Å²	120.8	73%	0.73	75%	0.748	S	S	*	*			trans	92.6	146.8	173.9	76.4	0	0	0	0	118.6
1068	S	29.8	Very low	30.6	Very low	130 Å²	130	126.4 Å²	126.4	91%	0.909	76%	0.756	S	S	*	*			trans	72.6	148.4	176.1	78.9	0	0	0	0	117
1069	G	27.1	Very low	29.4	Very low	64 Å²	64	129.4 Å²	129.4	66%	0.66	77%	0.773	S	S	*	*			trans	-159.4	175.4	-179.1	0	0	0	0	0	111.7
1070	S	29.2	Very low	29	Very low	124 Å²	124	135.8 Å²	135.8	87%	0.867	79%	0.786	S	S	*	*			trans	63.2	110.4	-176.3	72.8	0	0	0	0	116.6
1071	S	28.6	Very low	28.6	Very low	105 Å²	105	140.1 Å²	140.1	73%	0.734	80%	0.8	S	S	*	*				159.8	137.8	102.2	-169.9	0	0	0	0	113.8
1072	S	27.5	Very low	28.2	Very low	96 Å²	96	135.2 Å²	135.2	67%	0.671	80%	0.8	S	S	*	*			trans	46.9	109.2	146.1	62.8	0	0	0	0	122.2
1073	K	30.2	Very low	27.8	Very low	196 Å²	196	138.5 Å²	138.5	85%	0.852	80%	0.799	S	S	*	*				41.8	139.9	126.4	-65.3	-176.5	173	178.7	0	121.6
1074	T	26.8	Very low	28.6	Very low	140 Å²	140	135.6 Å²	135.6	86%	0.859	80%	0.796	S	S	*	*			trans	102.2	112.1	152.6	71.5	0	0	0	0	119
1075	G	24.3	Very low	29.6	Very low	74 Å²	74	132.6 Å²	132.6	76%	0.763	79%	0.788	S	S	*	*				90.1	105.2	108.5	0	0	0	0	0	120.8
1076	S	25.3	Very low	29.6	Very low	113 Å²	113	134.4 Å²	134.4	79%	0.79	79%	0.788	S	S	*	*				87.9	113	124.7	-139	0	0	0	0	121.4
1077	V	27.6	Very low	29.4	Very low	118 Å²	118	134.2 Å²	134.2	72%	0.715	78%	0.778	S	S	*	*				85.3	112.7	123.2	163.8	0	0	0	0	122
1078	R	26.3	Very low	29.2	Very low	236 Å²	236	136.2 Å²	136.2	89%	0.891	78%	0.777	S	S	*	*			trans	70.6	116.4	136.4	-80	-175.2	173.6	173	-2	123.2
1079	S	28.2	Very low	29.1	Very low	90 Å²	90	138.5 Å²	138.5	63%	0.629	77%	0.77	S	S	*	*				107.5	106.1	98.5	-179.6	0	0	0	0	122.5
1080	K	29.7	Very low	29	Very low	185 Å²	185	145.3 Å²	145.3	80%	0.804	78%	0.776	S	S	*	*				77.6	134.3	128.5	-70.5	179.7	178	174.4	0	122.9
1081	K	28.3	Very low	28.8	Very low	211 Å²	211	146.2 Å²	146.2	92%	0.917	77%	0.77	S	S	*	*			trans	76.5	125	143.6	-77.2	179.8	172.7	-171.5	0	119.6
1082	G	24.8	Very low	28.7	Very low	87 Å²	87	147 Å²	147	90%	0.897	76%	0.762	S	S	*	*			trans	164.4	73.5	165	0	0	0	0	0	115.9
1083	R	24.1	Very low	28.6	Very low	241 Å²	241	150.4 Å²	150.4	91%	0.909	77%	0.767	S	S	*	*			trans	-115.5	166.6	167.3	-105	-165.8	178.9	-172.9	1.8	108.2
1084	P	47.2	Very low	28.3	Very low	109 Å²	109	149 Å²	149	71%	0.708	76%	0.763	S	S	*	*			cis	-129.8	-133.5	-34.6	36.3	-14	0	0	0	107.2
1085	P	49.5	Very low	28.1	Very low	100 Å²	100	147.9 Å²	147.9	65%	0.649	76%	0.762	S	S	*	*			cis	-133	-160.5	-23.5	29.4	-4.4	0	0	0	114.1
1086	L	26.6	Very low	28.1	Very low	150 Å²	150	148.9 Å²	148.9	79%	0.785	76%	0.757	S	S	*	*			trans	95.6	140.1	159.6	-59.1	165.3	0	0	0	117.5
1087	H	27.6	Very low	28.1	Very low	131 Å²	131	148.9 Å²	148.9	61%	0.606	75%	0.752	S	S	*	*			cis	-170.8	129.6	-21.2	-160.5	39	0	0	0	113.1
1088	K	25.4	Very low	27.9	Very low	160 Å²	160	152.5 Å²	152.5	70%	0.696	76%	0.761	S	S	*	*			trans	62	166	164.1	-70.7	165.1	178.4	153.5	0	115.6
1089	K	26.2	Very low	27.8	Very low	178 Å²	178	144.1 Å²	144.1	77%	0.774	75%	0.749	S	S	*	*			cis	-153.7	133.8	-10.6	-118.7	178.1	175.3	-168.4	0	104.9
1090	R	25	Very low	27.5	Very low	208 Å²	208	144.8 Å²	144.8	79%	0.785	75%	0.753	S	S	*	*				69	146.2	84.4	-157	-178.6	-170.4	-151	4.5	115.5	E1092	R1090-E1092 IonicContact CZ-OE1 2.9Å; R1090-E1092 IonicContact NE-OE1 3.78Å; R1090-E1092 IonicContact NH2-OE1 3.84Å
1091	I	26.3	Very low	27.2	Very low	142 Å²	142	146 Å²	146	73%	0.728	75%	0.753	S	S	*	*			trans	106.2	109.9	-174.2	-64.1	163.5	0	0	0	108.2
1092	E	25.4	Very low	26.9	Very low	123 Å²	123	142.9 Å²	142.9	58%	0.575	74%	0.743	S	S	*	*				75.2	135.7	65.6	-65.8	141.7	-160.3	0	0	110.5	R1090	R1090-E1092 IonicContact CZ-OE1 2.9Å; R1090-E1092 IonicContact NE-OE1 3.78Å; R1090-E1092 IonicContact NH2-OE1 3.84Å
1093	E	24.9	Very low	26.9	Very low	166 Å²	166	145 Å²	145	78%	0.776	73%	0.732	S	S	*	*			cis	-161.1	169	8.5	-123	166.9	-177.1	0	0	113.3
1094	E	24.6	Very low	26.9	Very low	166 Å²	166	143.3 Å²	143.3	78%	0.776	73%	0.725	S	S	*	*			trans	41.8	141.7	155.9	-59.4	-160	134.6	0	0	126.6
1095	S	23.8	Very low	25.8	Very low	117 Å²	117	143.6 Å²	143.6	82%	0.818	72%	0.721	S	S	*	*			trans	76	155.7	144.7	84.4	0	0	0	0	118.8
1096	S	24	Very low	24.5	Very low	95 Å²	95	144.7 Å²	144.7	66%	0.664	72%	0.721	S	S	*	*			cis	-168.5	134.9	-9.6	141.2	0	0	0	0	112.7
1097	V	24.6	Very low	24.3	Very low	114 Å²	114	142.8 Å²	142.8	69%	0.691	72%	0.716	S	S	*	*			trans	62.8	125.1	141.7	-179.5	0	0	0	0	122
1098	E	24	Very low	24.2	Very low	193 Å²	193	144 Å²	144	90%	0.902	73%	0.726	S	S	*	*			trans	53.3	164.3	151.7	-67.1	173.6	138.2	0	0	122.7
1099	G	23.6	Very low	24	Very low	61 Å²	61	145.6 Å²	145.6	63%	0.629	74%	0.736	S	S	*	*			trans	-173.5	-52.6	168.3	0	0	0	0	0	120.2
1100	S	22.8	Very low	24	Very low	104 Å²	104	143.2 Å²	143.2	73%	0.727	74%	0.736	S	S	*	*			trans	65.7	179	-179	-161.5	0	0	0	0	117.5
1101	W	22.1	Very low	24.4	Very low	209 Å²	209	138.5 Å²	138.5	79%	0.792	73%	0.733	S	S	*	*			trans	72	109.9	174.2	-46.1	97.8	0	0	0	116.2
1102	M	23.6	Very low	24.3	Very low	147 Å²	147	137.3 Å²	137.3	72%	0.724	74%	0.737	S	S	*	*				88.4	147.9	53.4	-80	-161.4	167.7	0	0	115.3
1103	M	24.9	Very low	24.4	Very low	132 Å²	132	135 Å²	135	65%	0.65	74%	0.739	S	S	*	*			trans	91.6	112.6	159.8	-62	-57	-168.8	0	0	120.6
1104	R	23.5	Very low	24.5	Very low	205 Å²	205	135.1 Å²	135.1	77%	0.774	74%	0.744	S	S	*	*				66	153.2	120.1	-65.8	-171.5	172.5	172	-2.4	119.1
1105	N	23	Very low	24.4	Very low	114 Å²	114	136 Å²	136	61%	0.61	75%	0.748	S	S	*	*			cis	-161.3	-177.4	2.3	-131.8	37.7	0	0	0	113.1
1106	D	21.9	Very low	24.6	Very low	123 Å²	123	136.6 Å²	136.6	66%	0.658	75%	0.747	S	S	*	*			trans	87.5	107.1	140.6	-70.8	-22.8	0	0	0	123.7
1107	T	23.6	Very low	25.2	Very low	110 Å²	110	137.1 Å²	137.1	68%	0.675	75%	0.748	S	S	*	*				90.2	112.9	124.3	59.3	0	0	0	0	123.3
1108	L	24.2	Very low	25.2	Very low	156 Å²	156	140 Å²	140	82%	0.817	75%	0.754	S	S	*	*				51.9	119.9	123.6	-59.7	166.4	0	0	0	120.6
1109	Q	22.6	Very low	25.2	Very low	194 Å²	194	136.6 Å²	136.6	91%	0.907	74%	0.742	S	S	*	*				-170.7	150.4	99.3	-100.7	174.8	23.8	0	0	114.5
1110	T	25	Very low	25.3	Very low	128 Å²	128	139.7 Å²	139.7	79%	0.785	75%	0.749	S	S	*	*			trans	-77.6	167.8	166.7	27.9	0	0	0	0	110.9
1111	P	35	Very low	25.4	Very low	110 Å²	110	138.8 Å²	138.8	71%	0.714	74%	0.742	S	S	*	*			cis	-157.5	169.7	44.4	45.1	-23.5	0	0	0	121.3
1112	S	23.7	Very low	25.6	Very low	117 Å²	117	135 Å²	135	82%	0.818	74%	0.742	S	S	*	*			trans	62.6	151.9	140.1	-69.8	0	0	0	0	122.7
1113	A	26.9	Very low	25.7	Very low	75 Å²	75	134 Å²	134	62%	0.62	74%	0.744	S	S	*	*			cis	-174.7	150.3	-17.7	0	0	0	0	0	112.5
1114	L	26.5	Very low	25.7	Very low	168 Å²	168	134.6 Å²	134.6	88%	0.88	75%	0.749	S	S	*	*			trans	66.9	160.1	156	-64.5	161.3	0	0	0	117.1
1115	Q	24.2	Very low	25.8	Very low	184 Å²	184	134.3 Å²	134.3	86%	0.86	75%	0.748	S	S	*	*			cis	-133	165.6	14.5	-69.9	177.6	-46.3	0	0	113.8
1116	T	26.8	Very low	25.8	Very low	129 Å²	129	135.2 Å²	135.2	79%	0.791	75%	0.749	S	S	*	*			trans	-113.7	165.3	157.3	63.3	0	0	0	0	108.8
1117	P	36.3	Very low	26	Very low	106 Å²	106	135.5 Å²	135.5	69%	0.688	75%	0.75	S	S	*	*				-158.6	154.8	87.5	42.7	-23.2	0	0	0	118.5
1118	Q	25.2	Very low	26	Very low	174 Å²	174	140.8 Å²	140.8	81%	0.813	76%	0.758	S	S	*	*				51.3	157.8	127.5	-62.4	-166.3	-20	0	0	122.6
1119	L	24.5	Very low	26.8	Very low	123 Å²	123	139 Å²	139	64%	0.644	76%	0.755	S	S	*	*			cis	-166.8	169.6	-4.1	-117.2	173.5	0	0	0	111
1120	T	24.7	Very low	27	Very low	126 Å²	126	134.2 Å²	134.2	77%	0.773	75%	0.749	S	S	*	*			trans	62	168.1	155.3	48.1	0	0	0	0	119.8
1121	S	25.9	Very low	27	Very low	85 Å²	85	137.7 Å²	137.7	59%	0.594	76%	0.756	S	S	*	*			cis	177.7	139.7	-36	178.9	0	0	0	0	110.3
1122	T	25.8	Very low	26.7	Very low	128 Å²	128	140 Å²	140	79%	0.785	76%	0.757	S	S	*	*			trans	61.6	165.1	153.5	43.1	0	0	0	0	120.4
1123	V	25.3	Very low	26.9	Very low	127 Å²	127	141.6 Å²	141.6	77%	0.77	75%	0.754	S	S	*	*			cis	-174.7	174.8	-46.5	118.9	0	0	0	0	110.2
1124	L	25.1	Very low	27.6	Very low	144 Å²	144	143.5 Å²	143.5	75%	0.754	76%	0.759	S	S	*	*			trans	83.7	112.8	165.1	-82.9	162.4	0	0	0	121.9
1125	R	24.8	Very low	27.8	Very low	200 Å²	200	142.6 Å²	142.6	76%	0.755	76%	0.756	S	S	*	*				64.8	144.1	122.3	-94.5	-172.5	179	-153.6	-1.6	126.6
1126	E	24.7	Very low	28.8	Very low	133 Å²	133	138.7 Å²	138.7	62%	0.621	75%	0.746	S	S	*	*			trans	96.4	98.8	133.1	-84.4	172.8	-177.2	0	0	125.5
1127	N	24.8	Very low	28.8	Very low	128 Å²	128	139.4 Å²	139.4	68%	0.684	75%	0.745	S	S	*	*				62.5	122.3	114.3	-83.8	-31.7	0	0	0	126
1128	R	23.7	Very low	28.4	Very low	221 Å²	221	140 Å²	140	83%	0.834	75%	0.752	S	S	*	*			trans	67.5	174	139.5	-62.3	179.2	175.4	-160.3	-3.4	119
1129	P	40.7	Very low	28.5	Very low	119 Å²	119	140.3 Å²	140.3	77%	0.773	75%	0.753	S	S	*	*			cis	-110.2	173.2	-23.4	11.2	14.1	0	0	0	111.6
1130	A	27	Very low	29.3	Very low	93 Å²	93	140.2 Å²	140.2	77%	0.769	76%	0.76	S	S	*	*			cis	96.1	111.6	30.7	0	0	0	0	0	116.4
1131	E	25.9	Very low	29.3	Very low	202 Å²	202	137.3 Å²	137.3	94%	0.944	76%	0.755	S	S	*	*			trans	-179.1	174.2	161.7	-107.4	173.4	-156.6	0	0	110.2
1132	H	27.4	Very low	29.4	Very low	159 Å²	159	139.5 Å²	139.5	74%	0.736	77%	0.771	S	S	*	*				-158.3	145.4	-74.3	-158.3	49	0	0	0	112.6
1133	M	28.2	Very low	29.3	Very low	150 Å²	150	141.9 Å²	141.9	74%	0.739	77%	0.773	S	S	*	*			trans	65.1	166.7	160.7	-70.9	-69.7	-162.3	0	0	120.5
1134	P	42.2	Very low	29.4	Very low	114 Å²	114	142.7 Å²	142.7	74%	0.74	77%	0.773	S	S	*	*			cis	-134.2	175.8	-29.5	35.8	-17.6	0	0	0	115.8
1135	D	29.8	Very low	29.4	Very low	150 Å²	150	141.3 Å²	141.3	80%	0.802	77%	0.766	S	S	*	*			trans	-78.5	171	166.1	-129	-30.6	0	0	0	112.1
1136	P	45.2	Very low	29.4	Very low	101 Å²	101	141.4 Å²	141.4	66%	0.656	77%	0.768	S	S	*	*				-161.3	177.6	72.6	44.7	-23.3	0	0	0	120.5
1137	D	27.6	Very low	29.5	Very low	144 Å²	144	141.4 Å²	141.4	77%	0.77	78%	0.777	S	S	*	*				123	119.7	126.8	-89.5	-25.8	0	0	0	122.4
1138	S	27.6	Very low	29.5	Very low	118 Å²	118	143.7 Å²	143.7	83%	0.825	78%	0.783	S	S	*	*			trans	88.3	143.6	142.3	69.2	0	0	0	0	123.8
1139	E	28.3	Very low	29.5	Very low	181 Å²	181	140.7 Å²	140.7	85%	0.846	78%	0.783	S	S	*	*			trans	-103.3	-157.2	-176.4	-38.9	176.3	123.1	0	0	111.3
1140	P	40.2	Very low	29.1	Very low	122 Å²	122	139.6 Å²	139.6	79%	0.792	78%	0.777	S	S	*	*			cis	-136.8	-178.8	-17.7	37.4	-18.8	0	0	0	115.6
1141	G	24.7	Very low	29	Very low	65 Å²	65	144.6 Å²	144.6	67%	0.67	78%	0.784	S	S	*	*			trans	144.2	121.8	135.8	0	0	0	0	0	122
1142	S	28.2	Very low	29.1	Very low	131 Å²	131	142.2 Å²	142.2	92%	0.916	78%	0.776	S	S	*	*			trans	77.1	158.9	148.8	59.2	0	0	0	0	121.8
1143	E	24.4	Very low	29.1	Very low	178 Å²	178	143.9 Å²	143.9	83%	0.832	78%	0.784	S	S	*	*			trans	-123.8	-167.1	-159.8	-56.9	170	108.3	0	0	112.6
1144	N	26.3	Very low	28.9	Very low	144 Å²	144	143.5 Å²	143.5	77%	0.77	78%	0.782	S	S	*	*			trans	84	138.7	163.1	-66.9	-0.4	0	0	0	118.2
1145	D	25.6	Very low	28.2	Very low	115 Å²	115	142.9 Å²	142.9	62%	0.615	78%	0.781	S	S	*	*			cis	-167.7	164.1	-12.5	-157.8	-5.4	0	0	0	110.8
1146	Y	24.3	Very low	28.4	Very low	201 Å²	201	145.3 Å²	145.3	79%	0.788	78%	0.779	S	S	*	*			trans	59.8	158.9	170.1	-72.5	-81.5	0	0	0	118.3
1147	V	26.7	Very low	27.9	Very low	134 Å²	134	146 Å²	146	81%	0.812	78%	0.776	S	S	*	*			cis	-126.8	160.8	-5.9	-173.4	0	0	0	0	108.6
1148	H	25.3	Very low	27.9	Very low	175 Å²	175	142 Å²	142	81%	0.81	77%	0.769	S	S	*	*			trans	-121.8	139.1	175.7	-155.9	61	0	0	0	111.4
1149	N	23.2	Very low	28.1	Very low	158 Å²	158	146 Å²	146	85%	0.845	78%	0.775	S	S	*	*			trans	-148.7	143.9	163.5	-149.3	33.3	0	0	0	109
1150	P	32.1	Very low	28.1	Very low	97 Å²	97	146.7 Å²	146.7	63%	0.63	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-97.6	148	-158.3	36.3	-34.6	0	0	0	114.9
1151	Q	26.6	Very low	27.5	Very low	197 Å²	197	151 Å²	151	92%	0.921	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-77.8	143.4	158.6	-75.8	176.1	-54.8	0	0	110.4
1152	I	27	Very low	27.5	Very low	153 Å²	153	155.2 Å²	155.2	79%	0.785	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-86.5	133.1	177.7	-67.9	171.2	0	0	0	109	M1154	I1152-M1154 HydrophobicContact CG2-CG 3.75Å
1153	Q	27.4	Very low	27.5	Very low	194 Å²	194	156.7 Å²	156.7	91%	0.907	78%	0.781	S	S	*	*			trans	-119.2	111.1	176.1	-170.6	175.8	33.2	0	0	108.6
1154	M	25.2	Very low	27.5	Very low	141 Å²	141	156.6 Å²	156.6	70%	0.695	78%	0.78	S	S	*	*			trans	-114.9	137.8	-177.2	-77	-74.4	-87.6	0	0	111	I1152	I1152-M1154 HydrophobicContact CG2-CG 3.75Å
1155	S	26.5	Very low	27.5	Very low	101 Å²	101	154.8 Å²	154.8	71%	0.706	77%	0.774	S	S	*	*			trans	-151.9	102.2	-178.9	149.6	0	0	0	0	107.9
1156	W	34.2	Very low	27.5	Very low	201 Å²	201	155.5 Å²	155.5	76%	0.761	78%	0.778	S	S	*	*			trans	-131.4	88.3	-171.3	-85.5	99	0	0	0	113.9
1157	L	35.3	Very low	27.8	Very low	116 Å²	116	155.8 Å²	155.8	61%	0.607	78%	0.778	S	S	*	*			trans	-152.1	62.2	157.5	-114.3	170.9	0	0	0	109.7
1158	G	27.9	Very low	27.8	Very low	60 Å²	60	156.8 Å²	156.8	62%	0.619	77%	0.771	S	S	*	*			trans	-131.8	124.3	-175.7	0	0	0	0	0	113
1159	Q	30.2	Very low	27.8	Very low	202 Å²	202	153.7 Å²	153.7	94%	0.944	76%	0.761	S	S	*	*			trans	-78.8	148.5	178.7	-73.7	-174.6	-17.4	0	0	113
1160	Q	28.5	Very low	28	Very low	196 Å²	196	155.9 Å²	155.9	92%	0.916	76%	0.757	S	S	*	*			trans	-67.1	132.6	175.8	-64.9	176.8	-11.2	0	0	112.7
1161	K	27.2	Very low	27.7	Very low	212 Å²	212	156.4 Å²	156.4	92%	0.922	76%	0.759	S	S	*	*			trans	-148.4	143.5	155.4	-105.4	171.4	-174.9	168.5	0	109.9
1162	M	25.2	Very low	27.7	Very low	153 Å²	153	152 Å²	152	75%	0.754	75%	0.75	S	S	*	*			trans	-84.6	151	-177	-82.8	173.7	60.4	0	0	113.2
1163	E	27.6	Very low	27.5	Very low	163 Å²	163	152.8 Å²	152.8	76%	0.762	75%	0.752	S	S	*	*			trans	44.5	118	147.4	-58.9	178.1	143.8	0	0	117.9
1164	E	24.9	Very low	27.4	Very low	175 Å²	175	149.8 Å²	149.8	82%	0.818	74%	0.742	S	S	*	*				-165.4	138.7	69.7	-95	-156.1	108.5	0	0	115.1
1165	V	26.4	Very low	27.3	Very low	106 Å²	106	152.7 Å²	152.7	64%	0.642	75%	0.747	S	S	*	*				56.5	112.1	127.4	-174.2	0	0	0	0	122
1166	N	26.8	Very low	27.1	Very low	131 Å²	131	155.4 Å²	155.4	70%	0.701	75%	0.752	S	S	*	*			trans	88.8	131.8	142.9	-92.8	-48.7	0	0	0	124.1
1167	R	28.9	Very low	26.5	Very low	207 Å²	207	154.3 Å²	154.3	78%	0.781	75%	0.753	S	S	*	*			trans	87	94.7	136.4	-77	174.3	-176.8	-169.3	-0.5	122.3
1168	K	28.5	Very low	25.9	Very low	154 Å²	154	154.2 Å²	154.2	67%	0.67	76%	0.762	S	S	*	*				86.4	134.9	106.8	-88.5	-170.6	150.1	-69.4	0	120.9
1169	D	25.3	Very low	25.6	Very low	111 Å²	111	163.3 Å²	163.3	59%	0.594	78%	0.777	S	S	*	*			trans	56	122.1	138.2	-57.1	1	0	0	0	117.3
1170	R	26.9	Very low	25.3	Very low	203 Å²	203	158.5 Å²	158.5	77%	0.766	77%	0.766	S	S	*	*			cis	169.1	154.4	36.1	-118.8	171.5	64.2	175.7	4.7	109
1171	T	26.4	Very low	25	Very low	109 Å²	109	154.9 Å²	154.9	67%	0.669	75%	0.753	S	S	*	*			trans	58.6	138.2	148.7	55.5	0	0	0	0	120.2
1172	S	25	Very low	24.8	Very low	104 Å²	104	150.8 Å²	150.8	73%	0.727	74%	0.737	S	S	*	*			cis	-164.1	157.6	-7.6	-89.6	0	0	0	0	111.5
1173	M	23.5	Very low	24.8	Very low	169 Å²	169	146.9 Å²	146.9	83%	0.833	74%	0.736	S	S	*	*			trans	-27.4	148.8	141.3	-79.2	158	164.4	0	0	114.1
1174	N	24.4	Very low	24.6	Very low	131 Å²	131	146.2 Å²	146.2	70%	0.701	74%	0.743	S	S	*	*			cis	-162.9	160.5	45.4	-118.5	-17.6	0	0	0	115
1175	Y	23.3	Very low	24.6	Very low	203 Å²	203	147 Å²	147	80%	0.796	74%	0.738	S	S	*	*			trans	-9.6	140.3	152.5	-76.8	-99.6	0	0	0	120.5
1176	I	22.9	Very low	24.7	Very low	158 Å²	158	148.6 Å²	148.6	81%	0.81	74%	0.739	S	S	*	*				-173.3	113.4	109.2	-98.5	162	0	0	0	108.9
1177	K	21.9	Very low	24.7	Very low	178 Å²	178	147.1 Å²	147.1	77%	0.774	74%	0.735	S	S	*	*				77.9	100	82.4	-141.3	178.6	-169.6	178.5	0	114.1
1178	S	22.3	Very low	24.7	Very low	114 Å²	114	143.6 Å²	143.6	80%	0.797	74%	0.736	S	S	*	*			trans	42.5	119.7	147.2	-45.2	0	0	0	0	121.2
1179	R	22.2	Very low	24.7	Very low	251 Å²	251	146.1 Å²	146.1	95%	0.947	74%	0.741	S	S	*	*			trans	-134.1	123.4	139.6	-88.8	-167.7	166.7	-171.9	-6.2	110.5
1180	S	22.7	Very low	24.5	Very low	101 Å²	101	143.7 Å²	143.7	71%	0.706	74%	0.742	S	S	*	*			trans	-87.1	-175.2	174.7	57.2	0	0	0	0	111.8
1181	N	22.1	Very low	24.6	Very low	120 Å²	120	140.8 Å²	140.8	64%	0.642	74%	0.741	S	S	*	*			trans	88.1	108.5	178.1	-57.1	45.1	0	0	0	112.2
1182	Q	24.1	Very low	24.7	Very low	125 Å²	125	142.5 Å²	142.5	58%	0.584	74%	0.743	S	S	*	*				63.1	125.8	68.6	-60.6	160.8	-29.9	0	0	111.2	D1225	Q1182-D1225 VanDerWaalsContact NE2-CB 3.26Å; Q1182-D1225 PolarHBondContact NE2-OD2 3.19Å
1183	G	24.8	Very low	24.7	Very low	72 Å²	72	143.9 Å²	143.9	74%	0.742	74%	0.739	S	S	*	*			cis	-177	-164.3	-3.4	0	0	0	0	0	110.3
1184	V	22.7	Very low	24.8	Very low	149 Å²	149	143.7 Å²	143.7	90%	0.903	74%	0.741	S	S	*	*			trans	162.3	116.7	150.2	152.6	0	0	0	0	109.2
1185	R	24.8	Very low	24.8	Very low	190 Å²	190	145.2 Å²	145.2	72%	0.717	75%	0.749	S	S	*	*			trans	-86.2	156.8	160.4	-65.3	172	168.1	153	-3.5	107.2
1186	Q	28.5	Very low	24.8	Very low	141 Å²	141	139.7 Å²	139.7	66%	0.659	75%	0.745	S	S	*	*				-177.8	159.2	69.2	-88.5	-162.2	4.5	0	0	112.3
1187	T	28.1	Very low	24.8	Very low	99 Å²	99	140.9 Å²	140.9	61%	0.607	75%	0.747	S	S	*	*			trans	62.1	153.6	140.7	57.8	0	0	0	0	121
1188	V	28.7	Very low	25.1	Very low	134 Å²	134	137.6 Å²	137.6	81%	0.812	74%	0.744	S	S	*	*			cis	-151.9	177.1	-8.1	110.6	0	0	0	0	111.6
1189	R	27.4	Very low	25.5	Very low	207 Å²	207	139 Å²	139	78%	0.781	74%	0.741	S	S	*	*			trans	-108.3	154.3	-175.4	-173.4	-163.8	-162.6	-171	9.4	112.3
1190	G	22.4	Very low	25.8	Very low	60 Å²	60	134.1 Å²	134.1	62%	0.619	73%	0.727	S	S	*	*			trans	-139.7	151	152.4	0	0	0	0	0	108.5
1191	L	28.5	Very low	26.2	Very low	141 Å²	141	134.8 Å²	134.8	74%	0.738	72%	0.719	S	S	*	*			cis	69	137	29	-52.6	177.7	0	0	0	112.7
1192	M	27.4	Very low	26.5	Very low	145 Å²	145	136.3 Å²	136.3	71%	0.714	73%	0.727	S	S	*	*			cis	-152.9	-149.4	6.3	-139.3	162.3	71	0	0	114
1193	E	26.1	Very low	26.9	Very low	134 Å²	134	131.9 Å²	131.9	63%	0.626	71%	0.709	S	S	*	*			trans	70.5	139	177	-46.5	99.7	-106.1	0	0	116.6
1194	D	25.6	Very low	27.2	Very low	164 Å²	164	132 Å²	132	88%	0.877	69%	0.691	S	S	*	*	S	Bend	cis	-115.1	174.1	-6.5	-28.9	-86.7	0	0	0	109.6
1195	D	23.9	Very low	27.6	Very low	163 Å²	163	132.9 Å²	132.9	87%	0.872	69%	0.687	S	S	*	*			cis	-149.8	-179.2	1.1	-168.5	7.3	0	0	0	109.1
1196	A	23.4	Very low	27.8	Very low	87 Å²	87	128.6 Å²	128.6	72%	0.719	69%	0.686	S	S	*	*			trans	-132.4	139.1	-148.7	0	0	0	0	0	119.8
1197	E	23.3	Very low	27.7	Very low	183 Å²	183	127.8 Å²	127.8	86%	0.855	70%	0.696	S	S	*	*			trans	-136	156.4	141.8	-105.6	-161.5	-153.2	0	0	110.4
1198	P	28.7	Very low	27.9	Very low	110 Å²	110	134.2 Å²	134.2	71%	0.714	71%	0.709	S	S	*	*			trans	-91.8	117.6	-145.3	33.1	-36.6	0	0	0	117.4
1199	I	29.6	Very low	28	Very low	142 Å²	142	131.3 Å²	131.3	73%	0.728	71%	0.707	S	S	*	*			trans	-102.1	138.7	174.6	-63.5	174.1	0	0	0	111.4	E1201	I1199-E1201 HydrophobicContact CG2-CG 4.01Å; I1199-E1201 PolarHBondContact O-N 3.41Å
1200	F	28.5	Very low	28.2	Very low	149 Å²	149	130.4 Å²	130.4	65%	0.654	71%	0.711	S	S	*	*			trans	-96.6	55.7	-170.3	-98.9	-87.9	0	0	0	114.5
1201	E	31.1	Very low	28.4	Very low	116 Å²	116	135.1 Å²	135.1	54%	0.542	72%	0.722	S	S	.	*			trans	-106.9	-30.2	-177.9	-69.1	-155.9	122.5	0	0	116.8	K908 I1199 V1203 M1204	K908-E1201 IonicContact NZ-OE1 2.99Å; K908-E1201 PolarHBondContact NZ-OE1 2.92Å; I1199-E1201 HydrophobicContact CG2-CG 4.01Å; I1199-E1201 PolarHBondContact O-N 3.41Å; E1201-V1203 PolarHBondContact O-N 3.38Å; E1201-M1204 PolarHBondContact O-N 2.86Å
1202	D	29.4	Very low	28.5	Very low	152 Å²	152	137.7 Å²	137.7	81%	0.813	73%	0.73	S	S	*	*	G	3₁₀ helix	trans	-65.2	-11.9	-170.1	-74.2	-44.1	0	0	0	116.2	M1204	D1202-M1204 PolarHBondContact O-N 3.27Å
1203	V	31.4	Very low	28.6	Very low	32 Å²	32	138.2 Å²	138.2	19%	0.194	74%	0.735	C	S	.	*	G	3₁₀ helix	trans	-69.2	-17.6	-176.5	-160.1	0	0	0	0	112.4	L964 L968 E1201	L964-V1203 HydrophobicContact CD2-CG1 3.98Å; L964-V1203 WeakPolarHBondContact CD2-O 3.28Å; L968-V1203 HydrophobicContact CD1-CG2 4.22Å; L968-V1203 HydrophobicContact CD2-CG1 3.78Å; L968-V1203 HydrophobicContact CD2-CG2 4.3Å; L968-V1203 HydrophobicContact CG-CG1 4.27Å; L968-V1203 HydrophobicContact CG-CG2 3.91Å; E1201-V1203 PolarHBondContact O-N 3.38Å
1204	M	31.6	Very low	28.7	Very low	74 Å²	74	140.2 Å²	140.2	37%	0.365	75%	0.747	S	S	.	*	G	3₁₀ helix	trans	-84.6	-17.8	-170.7	-72.8	-81.6	-72.1	0	0	115.7	R961 L964 E1201 D1202	R961-M1204 HydrophobicContact CB-CE 4.22Å; R961-M1204 HydrophobicContact CG-CE 3.97Å; L964-M1204 HydrophobicContact CB-CG 4.43Å; L964-M1204 HydrophobicContact CB-SD 3.44Å; L964-M1204 WeakPolarHBondContact CB-SD 3.28Å; L964-M1204 HydrophobicContact CD1-SD 3.55Å; L964-M1204 VanDerWaalsContact CD1-SD 3.55Å; L964-M1204 HydrophobicContact CG-SD 4.09Å; E1201-M1204 PolarHBondContact O-N 2.86Å; D1202-M1204 PolarHBondContact O-N 3.27Å
1205	M	30.8	Very low	28.7	Very low	167 Å²	167	140.6 Å²	140.6	82%	0.823	75%	0.749	S	S	*	*	S	Bend	trans	-124.7	-2.4	-161.5	-67.3	-62.6	-69.5	0	0	116.4	S1207	M1205-S1207 PolarHBondContact O-N 3.47Å; M1205-S1207 VanDerWaalsContact O-N 3.16Å
1206	S	28.8	Very low	29	Very low	100 Å²	100	141.7 Å²	141.7	70%	0.699	75%	0.749	S	S	*	*			trans	-90.4	67.3	-173.8	64	0	0	0	0	114
1207	S	28	Very low	29.4	Very low	125 Å²	125	146.2 Å²	146.2	87%	0.874	76%	0.755	S	S	*	*			trans	-143.7	51.7	173.4	-69.6	0	0	0	0	112.7	M1205	M1205-S1207 PolarHBondContact O-N 3.47Å; M1205-S1207 VanDerWaalsContact O-N 3.16Å
1208	R	31.5	Very low	29.4	Very low	233 Å²	233	147.3 Å²	147.3	88%	0.879	76%	0.757	S	S	*	*			trans	-129.4	43.9	-178.8	-155.3	178.4	-173.5	-179.4	0.9	112.7
1209	G	30.5	Very low	29.4	Very low	73 Å²	73	151.3 Å²	151.3	75%	0.753	77%	0.767	S	S	*	*	S	Bend	trans	-137.9	23.2	-169.9	0	0	0	0	0	115.6
1210	Q	31.2	Very low	29.3	Very low	189 Å²	189	152.1 Å²	152.1	88%	0.883	77%	0.772	S	S	*	*	S	Bend	trans	-166.7	98	169.2	-109.7	169.8	25.7	0	0	108.6
1211	L	27.9	Very low	29.2	Very low	159 Å²	159	151.7 Å²	151.7	83%	0.832	78%	0.782	S	S	*	*			trans	180	48.9	162.7	-104.1	165.3	0	0	0	110.7
1212	E	30.4	Very low	28.9	Very low	194 Å²	194	154.9 Å²	154.9	91%	0.907	80%	0.799	S	S	*	*			trans	-104	60.3	168.4	-70.7	-170.3	154.1	0	0	109.8
1213	D	28.9	Very low	28.6	Very low	156 Å²	156	153.4 Å²	153.4	83%	0.834	80%	0.795	S	S	*	*	S	Bend	trans	-180	84.7	164	-101.6	-21.5	0	0	0	109.4
1214	M	27.3	Very low	28.3	Very low	176 Å²	176	158.9 Å²	158.9	87%	0.867	82%	0.822	S	S	*	*			trans	168.6	69.3	157.6	-98.5	-173.6	70.7	0	0	109.6
1215	N	27.3	Very low	27.8	Very low	173 Å²	173	160.5 Å²	160.5	93%	0.925	83%	0.832	S	S	*	*			trans	-128.8	65.2	-178.5	-131.1	60.8	0	0	0	110.7
1216	E	30.3	Very low	27.4	Very low	186 Å²	186	159.2 Å²	159.2	87%	0.869	83%	0.828	S	S	*	*	S	Bend	trans	-148	142.9	167.3	-110.3	170.5	-154.5	0	0	108.1
1217	E	29.9	Very low	27.2	Very low	182 Å²	182	159.6 Å²	159.6	85%	0.85	83%	0.828	S	S	*	*	S	Bend	trans	71.7	153.4	-166.8	-52.3	-170.2	152.3	0	0	116
1218	F	25	Very low	27.1	Very low	205 Å²	205	158.7 Å²	158.7	90%	0.899	82%	0.819	S	S	*	*			trans	73.4	43.9	-175.2	-59.8	-80.1	0	0	0	119.1
1219	E	27.4	Very low	26.8	Very low	195 Å²	195	151.4 Å²	151.4	91%	0.911	80%	0.804	S	S	*	*			trans	-87.4	92.3	141.9	-75.8	-168.6	151.9	0	0	109.4
1220	D	28.3	Very low	26.9	Very low	158 Å²	158	156.5 Å²	156.5	85%	0.845	80%	0.8	S	S	*	*			trans	-172.7	86.9	153.2	-116.1	-21.7	0	0	0	112.3
1221	T	25.8	Very low	27	Very low	140 Å²	140	150.9 Å²	150.9	86%	0.859	78%	0.777	S	S	*	*	S	Bend	trans	-162.3	145.6	152.8	-6.4	0	0	0	0	109.6	V1223	T1221-V1223 PolarHBondContact O-N 2.73Å
1222	M	25.8	Very low	27.1	Very low	184 Å²	184	152.7 Å²	152.7	91%	0.906	77%	0.772	S	S	*	*			trans	-71.6	121.1	-159.4	-64.8	177.3	-71.2	0	0	114
1223	V	23	Very low	27.1	Very low	120 Å²	120	149.9 Å²	149.9	73%	0.727	75%	0.753	S	S	*	*			trans	-89.2	120.3	164.8	176.8	0	0	0	0	108.7	T1221 D1225	T1221-V1223 PolarHBondContact O-N 2.73Å; V1223-D1225 PolarHBondContact O-N 2.87Å
1224	I	23.9	Very low	27.2	Very low	148 Å²	148	145.1 Å²	145.1	76%	0.759	73%	0.726	S	S	*	*			trans	-82.5	105.4	169.5	-60.6	177	0	0	0	108	L1226	I1224-L1226 HydrophobicContact CG2-CG 4.46Å; I1224-L1226 PolarHBondContact O-N 2.97Å
1225	D	22.2	Very low	27.5	Very low	108 Å²	108	141.7 Å²	141.7	58%	0.578	70%	0.703	S	S	*	*			trans	-78.4	100.4	175.4	-98.1	-60.7	0	0	0	111.4	Q1182 V1223	Q1182-D1225 VanDerWaalsContact NE2-CB 3.26Å; Q1182-D1225 PolarHBondContact NE2-OD2 3.19Å; V1223-D1225 PolarHBondContact O-N 2.87Å
1226	L	23	Very low	27.7	Very low	140 Å²	140	136.7 Å²	136.7	73%	0.733	69%	0.686	S	S	*	*			trans	-97.4	136.3	162	-75.7	169.7	0	0	0	110.5	I1224	I1224-L1226 HydrophobicContact CG2-CG 4.46Å; I1224-L1226 PolarHBondContact O-N 2.97Å
1227	P	23.6	Very low	27.7	Very low	107 Å²	107	134.2 Å²	134.2	70%	0.695	68%	0.675	S	S	*	*			trans	-65.8	152.3	179.2	28.5	-34.8	0	0	0	111.5	S1229	P1227-S1229 PolarHBondContact O-N 3.39Å; P1227-S1229 VanDerWaalsContact O-N 3.09Å
1228	P	25.8	Very low	27.8	Very low	107 Å²	107	129.2 Å²	129.2	70%	0.695	65%	0.654	S	S	*	*			trans	-71.8	104.8	178	29.4	-33.2	0	0	0	111
1229	S	25	Very low	28.5	Very low	79 Å²	79	123.8 Å²	123.8	55%	0.552	63%	0.627	S	S	*	*			trans	-62.9	151	171.2	58.1	0	0	0	0	112	P1227 N1231	P1227-S1229 PolarHBondContact O-N 3.39Å; P1227-S1229 VanDerWaalsContact O-N 3.09Å; S1229-N1231 VanDerWaalsContact C-N 3.31Å; S1229-N1231 PolarHBondContact O-N 2.96Å
1230	R	33.4	Very low	29.1	Very low	180 Å²	180	117.5 Å²	117.5	68%	0.679	60%	0.603	S	S	*	*	G	3₁₀ helix	trans	-56.6	-42.7	-177.6	-83.3	173	161.9	158.2	-7.4	112.2	R1232	R1230-R1232 VanDerWaalsContact C-N 3.33Å; R1230-R1232 PolarHBondContact O-N 3.42Å
1231	N	33.4	Very low	29.9	Very low	72 Å²	72	114.8 Å²	114.8	39%	0.385	59%	0.589	S	S	.	*	G	3₁₀ helix	trans	-82.6	-2.5	-156.8	-49.1	15.3	0	0	0	114.6	S1229 R1233 E1234 R1235	S1229-N1231 VanDerWaalsContact C-N 3.31Å; S1229-N1231 PolarHBondContact O-N 2.96Å; N1231-R1233 PolarHBondContact O-N 2.97Å; N1231-E1234 WeakPolarHBondContact CA-OE2 3.46Å; N1231-E1234 PolarHBondContact O-N 2.92Å; N1231-E1234 VanDerWaalsContact O-N 3.08Å; N1231-R1235 PolarHBondContact O-N 3.02Å
1232	R	29.8	Very low	30.8	Very low	197 Å²	197	109.7 Å²	109.7	74%	0.743	56%	0.555	S	S	*	*	G	3₁₀ helix	trans	-69.4	-7.3	-170.6	-146.2	-174.3	-166.4	-168.9	7.8	115.1	R1230	R1230-R1232 VanDerWaalsContact C-N 3.33Å; R1230-R1232 PolarHBondContact O-N 3.42Å
1233	R	29.8	Very low	31.8	Very low	134 Å²	134	102.7 Å²	102.7	51%	0.506	52%	0.519	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.9	-38.5	167.7	-94.7	-178.2	165.8	177	-8.1	112.6	N1231 R1235 A1236	N1231-R1233 PolarHBondContact O-N 2.97Å; R1233-R1235 VanDerWaalsContact C-N 3.31Å; R1233-R1235 PolarHBondContact O-N 2.9Å; R1233-A1236 WeakPolarHBondContact O-CB 3.5Å; R1233-A1236 PolarHBondContact O-N 3.13Å
1234	E	32.1	Very low	32.3	Very low	57 Å²	57	100.5 Å²	100.5	27%	0.266	50%	0.503	S	S	.	.	H	α-helix	trans	-64.9	-35.5	-176.6	-71.1	154.2	152.2	0	0	111.3	A426 N1231 A1236 E1237 L1238	A426-E1234 HydrophobicContact CB-CG 4.03Å; N1231-E1234 WeakPolarHBondContact CA-OE2 3.46Å; N1231-E1234 PolarHBondContact O-N 2.92Å; N1231-E1234 VanDerWaalsContact O-N 3.08Å; E1234-A1236 PolarHBondContact O-N 3.03Å; E1234-E1237 PolarHBondContact O-N 3.34Å; E1234-E1237 VanDerWaalsContact O-N 3.16Å; E1234-L1238 PolarHBondContact O-N 3.49Å
1235	R	33.3	Very low	32.4	Very low	103 Å²	103	97.4 Å²	97.4	39%	0.389	50%	0.495	S	S	.	.	H	α-helix	trans	-60.5	-4	170.2	-63.8	-159.4	-161.6	166.3	10.2	115.7	E858 N1231 R1233 R1239	E858-R1235 IonicContact OE1-CZ 2.82Å; E858-R1235 IonicContact OE1-NH2 3.59Å; E858-R1235 PolarHBondContact OE1-NH2 2.85Å; E858-R1235 IonicContact OE2-CZ 3.2Å; E858-R1235 IonicContact OE2-NE 3.71Å; E858-R1235 IonicContact OE2-NH2 2.66Å; E858-R1235 PolarHBondContact OE2-NH2 3.29Å; N1231-R1235 PolarHBondContact O-N 3.02Å; R1233-R1235 VanDerWaalsContact C-N 3.31Å; R1233-R1235 PolarHBondContact O-N 2.9Å; R1235-R1239 PolarHBondContact O-NE 3.24Å; R1235-R1239 PolarHBondContact O-NH2 3.18Å
1236	A	30.6	Very low	32.6	Very low	68 Å²	68	94 Å²	94	56%	0.562	48%	0.482	S	S	*	.	H	α-helix	trans	-106.6	-23.9	176.6	0	0	0	0	0	113.6	R1233 E1234	R1233-A1236 WeakPolarHBondContact O-CB 3.5Å; R1233-A1236 PolarHBondContact O-N 3.13Å; E1234-A1236 PolarHBondContact O-N 3.03Å
1237	E	30.7	Very low	32.8	Very low	134 Å²	134	88.9 Å²	88.9	63%	0.626	46%	0.46	S	S	*	.	H	α-helix	trans	-101.6	-6.4	-173.2	-65.7	177.2	179.5	0	0	112.8	E1234	E1234-E1237 PolarHBondContact O-N 3.34Å; E1234-E1237 VanDerWaalsContact O-N 3.16Å
1238	L	32.4	Very low	32.9	Very low	78 Å²	78	88.4 Å²	88.4	41%	0.408	45%	0.45	S	S	.	.	S	Bend	trans	-106.5	17.3	178.7	-67.8	171.3	0	0	0	114.4	E1234 P1240	E1234-L1238 PolarHBondContact O-N 3.49Å; L1238-P1240 WeakPolarHBondContact O-CD 3.38Å
1239	R	39.5	Very low	33	Very low	90 Å²	90	88.7 Å²	88.7	34%	0.34	44%	0.444	S	S	.	.			trans	-86.9	123.9	-176.7	-63.6	-174.7	177.8	-142.5	-8.9	111.5	N901 D905 R1235	N901-R1239 PolarHBondContact O-NH1 3.04Å; N901-R1239 PolarHBondContact O-NH2 3.23Å; D905-R1239 IonicContact OD1-NH1 3.85Å; D905-R1239 WeakPolarHBondContact OD2-CD 3.31Å; D905-R1239 IonicContact OD2-CZ 3.79Å; D905-R1239 IonicContact OD2-NE 3.84Å; D905-R1239 IonicContact OD2-NH1 2.91Å; D905-R1239 PolarHBondContact OD2-NH1 3.48Å; R1235-R1239 PolarHBondContact O-NE 3.24Å; R1235-R1239 PolarHBondContact O-NH2 3.18Å
1240	P	40.2	Very low	32.9	Very low	64 Å²	64	93.1 Å²	93.1	42%	0.416	46%	0.456	S	S	.	.			trans	-62.5	143.7	168.7	-20.9	33	0	0	0	111.5	L1238 F1242	L1238-P1240 WeakPolarHBondContact O-CD 3.38Å; P1240-F1242 HydrophobicContact CB-CD2 4.38Å; P1240-F1242 HydrophobicContact CB-CE1 4.41Å; P1240-F1242 HydrophobicContact CB-CE2 3.99Å; P1240-F1242 HydrophobicContact CB-CZ 4.02Å; P1240-F1242 HydrophobicContact CG-CE2 4.24Å; P1240-F1242 HydrophobicContact CG-CZ 4.02Å; P1240-F1242 WeakPolarHBondContact O-CD2 3.38Å; P1240-F1242 WeakPolarHBondContact O-CE2 3.41Å; P1240-F1242 PolarHBondContact O-N 3.01Å
1241	D	44	Very low	32.6	Very low	101 Å²	101	88.2 Å²	88.2	54%	0.54	44%	0.443	S	S	.	.			trans	-85.1	91.6	166.6	-170	-15.9	0	0	0	109.3	F1243 D1244 A1247	D1241-F1243 PolarHBondContact O-N 2.73Å; D1241-F1243 PolarHBondContact OD1-N 3.09Å; D1241-D1244 HydrophobicContact CB-CB 4.42Å; D1241-D1244 PolarHBondContact O-N 2.72Å; D1241-A1247 WeakPolarHBondContact O-CB 3.48Å
1242	F	46.2	Very low	32.4	Very low	33 Å²	33	92.5 Å²	92.5	15%	0.145	46%	0.461	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	3.5	178.9	-62.6	-86.5	0	0	0	114.5	R869 A873 I906 P1240	R869-F1242 HydrophobicContact CB-CZ 4.5Å; A873-F1242 HydrophobicContact CB-CB 4.15Å; A873-F1242 HydrophobicContact CB-CD1 4.41Å; A873-F1242 HydrophobicContact CB-CG 4.39Å; I906-F1242 HydrophobicContact CD1-CD2 4.46Å; P1240-F1242 HydrophobicContact CB-CD2 4.38Å; P1240-F1242 HydrophobicContact CB-CE1 4.41Å; P1240-F1242 HydrophobicContact CB-CE2 3.99Å; P1240-F1242 HydrophobicContact CB-CZ 4.02Å; P1240-F1242 HydrophobicContact CG-CE2 4.24Å; P1240-F1242 HydrophobicContact CG-CZ 4.02Å; P1240-F1242 WeakPolarHBondContact O-CD2 3.38Å; P1240-F1242 WeakPolarHBondContact O-CE2 3.41Å; P1240-F1242 PolarHBondContact O-N 3.01Å
1243	F	45.6	Very low	32.5	Very low	36 Å²	36	86.2 Å²	86.2	16%	0.158	45%	0.447	C	S	.	.	T	Hydrogen-bonded Turn	trans	-126.8	4.2	-179.7	-59.6	-79.6	0	0	0	115	C876 I880 I906 E909 D1241	C876-F1243 HydrophobicContact CB-CZ 4.43Å; I880-F1243 HydrophobicContact CD1-CD1 4Å; I880-F1243 HydrophobicContact CD1-CE1 3.49Å; I880-F1243 VanDerWaalsContact CD1-CE1 3.49Å; I880-F1243 HydrophobicContact CD1-CZ 4.37Å; I906-F1243 HydrophobicContact CB-CE2 4.39Å; I906-F1243 HydrophobicContact CG1-CE2 4.46Å; I906-F1243 HydrophobicContact CG2-CE2 4.11Å; I906-F1243 HydrophobicContact CG2-CZ 4Å; E909-F1243 HydrophobicContact CB-CD2 4.13Å; E909-F1243 HydrophobicContact CB-CE2 4.32Å; E909-F1243 HydrophobicContact CG-CB 4.37Å; E909-F1243 HydrophobicContact CG-CD2 4.13Å; E909-F1243 HydrophobicContact CG-CG 4.19Å; D1241-F1243 PolarHBondContact O-N 2.73Å; D1241-F1243 PolarHBondContact OD1-N 3.09Å
1244	D	32.9	Very low	32.4	Very low	74 Å²	74	81.6 Å²	81.6	40%	0.396	44%	0.441	S	S	.	.			trans	-75.4	131.9	167.3	-172.3	-6.5	0	0	0	110	D1241 A1246 A1247 M1248	D1241-D1244 HydrophobicContact CB-CB 4.42Å; D1241-D1244 PolarHBondContact O-N 2.72Å; D1244-A1246 PolarHBondContact O-N 2.71Å; D1244-A1246 PolarHBondContact OD1-N 3.4Å; D1244-A1247 HydrophobicContact CB-CB 4.03Å; D1244-A1247 WeakPolarHBondContact O-CB 3.5Å; D1244-A1247 PolarHBondContact O-N 3.22Å; D1244-M1248 PolarHBondContact O-N 3.2Å
1245	S	27.1	Very low	32.3	Very low	83 Å²	83	80.6 Å²	80.6	58%	0.58	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-22.7	173	-56.8	0	0	0	0	112.9
1246	A	25.7	Very low	31.9	Very low	36 Å²	36	79.5 Å²	79.5	30%	0.298	44%	0.444	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-32	170.2	0	0	0	0	0	113	D1244 M1248 I1249	D1244-A1246 PolarHBondContact O-N 2.71Å; D1244-A1246 PolarHBondContact OD1-N 3.4Å; A1246-M1248 VanDerWaalsContact C-N 3.26Å; A1246-M1248 PolarHBondContact O-N 2.86Å; A1246-I1249 WeakPolarHBondContact O-CB 3.49Å; A1246-I1249 PolarHBondContact O-N 3.38Å
1247	A	26.8	Very low	31.8	Very low	34 Å²	34	78.3 Å²	78.3	28%	0.281	43%	0.427	S	S	.	.	G	3₁₀ helix	trans	-70.4	-23.1	176.6	0	0	0	0	0	112.4	D1241 D1244 I1249 E1250	D1241-A1247 WeakPolarHBondContact O-CB 3.48Å; D1244-A1247 HydrophobicContact CB-CB 4.03Å; D1244-A1247 WeakPolarHBondContact O-CB 3.5Å; D1244-A1247 PolarHBondContact O-N 3.22Å; A1247-I1249 PolarHBondContact O-N 2.83Å; A1247-E1250 PolarHBondContact O-N 3.31Å
1248	M	27.3	Very low	31.4	Very low	97 Å²	97	78 Å²	78	48%	0.478	44%	0.437	S	S	.	.	G	3₁₀ helix	trans	-65.4	4.9	170.4	-54.8	-159.2	-49	0	0	114.4	D1244 A1246	D1244-M1248 PolarHBondContact O-N 3.2Å; A1246-M1248 VanDerWaalsContact C-N 3.26Å; A1246-M1248 PolarHBondContact O-N 2.86Å
1249	I	27.6	Very low	31.1	Very low	112 Å²	112	76.2 Å²	76.2	57%	0.574	43%	0.427	S	S	*	.	G	3₁₀ helix	trans	-119	-17.3	-178.4	-51.4	176.7	0	0	0	111.7	A1246 A1247	A1246-I1249 WeakPolarHBondContact O-CB 3.49Å; A1246-I1249 PolarHBondContact O-N 3.38Å; A1247-I1249 PolarHBondContact O-N 2.83Å
1250	E	23.2	Very low	30.5	Very low	173 Å²	173	79.3 Å²	79.3	81%	0.808	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.6	8.7	-171.7	-68.2	-178.7	177.1	0	0	114.3	A1247	A1247-E1250 PolarHBondContact O-N 3.31Å
1251	D	25.8	Very low	30	Very low	76 Å²	76	80.1 Å²	80.1	41%	0.406	45%	0.445	S	S	.	.	S	Bend	trans	-65.6	140.2	163.9	-102.2	-23.1	0	0	0	110.1	S1253 G1254	D1251-S1253 PolarHBondContact O-N 3.03Å; D1251-G1254 PolarHBondContact O-N 3.41Å
1252	E	29.5	Very low	29.2	Very low	162 Å²	162	79 Å²	79	76%	0.757	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-19.7	-169.2	-65.1	-178.4	131.5	0	0	114.9	K641 G1254	K641-E1252 PolarHBondContact NZ-O 3.35Å; E1252-G1254 PolarHBondContact O-N 3.18Å
1253	S	31.1	Very low	28.3	Very low	65 Å²	65	81.6 Å²	81.6	46%	0.455	46%	0.456	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47.3	-22.2	175.2	69.2	0	0	0	0	115.2	N706 D1251 F1255	N706-S1253 VanDerWaalsContact CG-O 3.27Å; N706-S1253 PolarHBondContact ND2-O 3.39Å; N706-S1253 PolarHBondContact OD1-O 2.72Å; D1251-S1253 PolarHBondContact O-N 3.03Å; S1253-F1255 PolarHBondContact O-N 3.16Å
1254	G	28.4	Very low	27.3	Very low	37 Å²	37	84.2 Å²	84.2	38%	0.381	47%	0.474	S	S	.	.			trans	69	-4.6	169.7	0	0	0	0	0	116.2	D1251 E1252 S1256	D1251-G1254 PolarHBondContact O-N 3.41Å; E1252-G1254 PolarHBondContact O-N 3.18Å; G1254-S1256 VanDerWaalsContact C-N 3.3Å; G1254-S1256 PolarHBondContact O-N 3.13Å; G1254-S1256 VanDerWaalsContact O-N 3.08Å
1255	F	31.1	Very low	26.9	Very low	37 Å²	37	84.9 Å²	84.9	16%	0.162	48%	0.479	C	S	.	.			trans	-86.8	64.8	-178.9	-146.7	-74.2	0	0	0	111	N706 Y746 L749 W750 S1253 M1257	N706-F1255 VanDerWaalsContact O-CD2 3.22Å; N706-F1255 WeakPolarHBondContact O-CD2 3.29Å; N706-F1255 WeakPolarHBondContact O-CE2 3.29Å; Y746-F1255 HydrophobicContact CD1-CD2 4.01Å; Y746-F1255 HydrophobicContact CD1-CE2 4.19Å; Y746-F1255 HydrophobicContact CE1-CD2 4.4Å; L749-F1255 HydrophobicContact CB-CE1 3.74Å; L749-F1255 HydrophobicContact CB-CE2 4.16Å; L749-F1255 HydrophobicContact CB-CZ 3.47Å; L749-F1255 VanDerWaalsContact CB-CZ 3.47Å; L749-F1255 HydrophobicContact CD1-CD1 3.68Å; L749-F1255 HydrophobicContact CD1-CD2 4.24Å; L749-F1255 HydrophobicContact CD1-CE1 3.64Å; L749-F1255 HydrophobicContact CD1-CE2 4.19Å; L749-F1255 HydrophobicContact CD1-CG 4.01Å; L749-F1255 HydrophobicContact CD1-CZ 3.91Å; L749-F1255 HydrophobicContact CG-CE1 4.37Å; L749-F1255 HydrophobicContact CG-CZ 4.35Å; W750-F1255 AromaticContact CD1-CE2 4Å; W750-F1255 HydrophobicContact CD2-CE2 4.43Å; W750-F1255 HydrophobicContact CD2-CZ 4.02Å; W750-F1255 AromaticContact CE2-CE2 3.72Å; W750-F1255 AromaticContact CE2-CZ 3.7Å; W750-F1255 HydrophobicContact CG-CZ 4.26Å; W750-F1255 HydrophobicContact CZ2-CE2 4.07Å; W750-F1255 HydrophobicContact CZ2-CZ 4.09Å; W750-F1255 AromaticContact NE1-CE2 3.43Å; W750-F1255 AromaticContact NE1-CZ 3.77Å; S1253-F1255 PolarHBondContact O-N 3.16Å; F1255-M1257 VanDerWaalsContact C-N 3.33Å; F1255-M1257 HydrophobicContact CD1-CB 4.38Å; F1255-M1257 PolarHBondContact O-N 2.82Å
1256	S	24	Very low	26.9	Very low	79 Å²	79	85 Å²	85	55%	0.552	47%	0.472	S	S	*	.			trans	-70	84.8	179.9	51.6	0	0	0	0	111.6	G1254 P1258	G1254-S1256 VanDerWaalsContact C-N 3.3Å; G1254-S1256 PolarHBondContact O-N 3.13Å; G1254-S1256 VanDerWaalsContact O-N 3.08Å; S1256-P1258 VanDerWaalsContact O-CD 3.25Å; S1256-P1258 WeakPolarHBondContact O-CD 3.41Å
1257	M	27.7	Very low	27	Very low	43 Å²	43	88.5 Å²	88.5	21%	0.212	48%	0.484	C	S	.	.			trans	-85.5	109.4	179.1	-153	-166.2	-155.5	0	0	110.5	L752 V753 F1255 M1259	L752-M1257 HydrophobicContact CD2-CE 4.23Å; L752-M1257 HydrophobicContact CG-CE 4.34Å; V753-M1257 HydrophobicContact CG2-CE 3.53Å; F1255-M1257 VanDerWaalsContact C-N 3.33Å; F1255-M1257 HydrophobicContact CD1-CB 4.38Å; F1255-M1257 PolarHBondContact O-N 2.82Å; M1257-M1259 HydrophobicContact CE-CG 4.42Å; M1257-M1259 HydrophobicContact CG-CB 4.01Å; M1257-M1259 HydrophobicContact CG-CG 3.85Å; M1257-M1259 PolarHBondContact O-N 3.08Å; M1257-M1259 HydrophobicContact SD-CB 4.04Å; M1257-M1259 HydrophobicContact SD-CG 4.13Å
1258	P	22.6	Very low	27	Very low	128 Å²	128	92.7 Å²	92.7	83%	0.831	50%	0.5	S	S	*	.			trans	-81	60.5	-175.1	35.3	-37.2	0	0	0	111.4	S1256	S1256-P1258 VanDerWaalsContact O-CD 3.25Å; S1256-P1258 WeakPolarHBondContact O-CD 3.41Å
1259	M	26	Very low	27	Very low	41 Å²	41	92.3 Å²	92.3	20%	0.202	50%	0.502	C	S	.	.			trans	-131.1	-0.8	-162.3	-78.6	-73.8	-90.1	0	0	115.8	T756 R814 M1257	T756-M1259 HydrophobicContact CG2-CE 3.45Å; T756-M1259 VanDerWaalsContact CG2-CE 3.45Å; T756-M1259 WeakPolarHBondContact OG1-CE 3.49Å; R814-M1259 PolarHBondContact NH1-O 3.38Å; R814-M1259 PolarHBondContact NH1-SD 3.16Å; R814-M1259 PolarHBondContact NH2-O 2.97Å; M1257-M1259 HydrophobicContact CE-CG 4.42Å; M1257-M1259 HydrophobicContact CG-CB 4.01Å; M1257-M1259 HydrophobicContact CG-CG 3.85Å; M1257-M1259 PolarHBondContact O-N 3.08Å; M1257-M1259 HydrophobicContact SD-CB 4.04Å; M1257-M1259 HydrophobicContact SD-CG 4.13Å
1260	F	26.7	Very low	26.9	Very low	155 Å²	155	90.5 Å²	90.5	68%	0.68	50%	0.495	S	S	*	.			trans	-131.2	0	173	-72	-68	0	0	0	110.9	I804 Q808	I804-F1260 HydrophobicContact CG1-CE2 4.44Å; Q808-F1260 HydrophobicContact CB-CE1 3.77Å

Retrieved 1,260 of 1,260 residues in 362.7 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).