A0A061I2V2_CRIGR 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 , UniProt , Accession A0A061I2V2, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene Stag1, Length 1,258 aa.

						>A0A061I2V2_CRIGR|A0A061I2V2|Stag1
MITSELPVLQDSTNETTAHSDAGSELEETEVKGKRKRGRPGRPPSTNKKPRKSPGEKSRIEAAIRGVGRGRANGHPQQNGEGDPVTLFEVVKLGKSAMQSVVDDWIESYKQDRDIALLDLINFFIQCSGCRGTVRIEMFRNMQNAEIIRKMTEEFDEDSGDYPLTMPGPQWKKFRSNFCEFIGVLIRQCQYSIIYDEYMMDTVISLLTGLSDSQVRAFRHTSTLAAMKLMTALVNVALNLSIHQDNTQRQYEAERNKMIGKRANERLELLLQKRKELQENQDEIENMMNSIFKGIFVHRYRDAIAEIRAICIEEIGVWMKMYSDAFLNDSYLKYVGWTLHDRQGEVRLKCLKALQSLYTNRELFPKLELFTNRFKDRIVSMTLDKEYDVAVEAIRLVTLILHGSEEALSNEDCENVYHLVYSAHRPVAVAAGEFLHKKLFSRHDPQAEEALAKRRGRNSPNGNLIRMLVLFFLESELHEHAAYLVDSLWESSQELLKDWECMTELLLEEPVQGEEAMSDRQESALIELMVCTIRQAAEAHPPVGRGTGKRVLTAKERKTQIDDRNKLTEHFIITLPMLLSKYSADAEKVANLLQIPQYFDLEIYSTGRMEKHLDALLKQIKFVVEKHVESDVLEACSKTYSILCSEEYTIQNRVDIARSQLIDEFVDRFNHSVEDLLQEGEEADDDDIYNVLSTLKRLTSFHNAHDLTKWDLFGNCYRLLKTGIEHGAMPEQIVVQALQCSHYSILWQLVKITDGSPSKEDLLVLRKTVKSFLAVCQQCLSNVNTPVKEQAFMLLCDLLMIFSHQLMTGGREGLQPLVFNPDTGLQSELLSFVMDHVFIDQDEENQSMEGDEEDEANKIEALHKRRNLLAAFSKLIIYDIVDMHAAADIFKHYMKYYNDYGDIIKETLSKTRQIDKIQCAKTLILSLQQLFNELVQEQGPNLDRTSAHVSGIKELARRFALTFGLDQIKTREAVATLHKDGIEFAFKYQNQKGQEYPPPNLAFLEVLSEFSSKLLRQDKKTVHSYLEKFLTEQMMERREDVWLPLISYRNSLVTGGEDDRMSVNSGSSSSKTSSVRSKKGRPPLHRKRVEDESLDNTWLNRTDTMIQTPGPLPTPQLTSTVLRENSRPMGEQIQEPESEHGSEPDFLHNPQMQISWLGQPKLEDLNRKDRTGMNYMKVRAGVRHAVRGLMEEDAEPIFEDVMMSSRSQLEDMNEEFEDTMVIDLPPSRNRRERAELRPDFFDSAAIIEDDSGFGMPMF
					

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(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	27.7	Very low	30.6	Very low	233 Å²	233	150.5 Å²	150.5	100%	1.148	81%	0.813	S	S	*	*				0	145.3	0	-92.6	-176.6	167.5	0	0	108.1
2	I	25.8	Very low	30.4	Very low	148 Å²	148	148.5 Å²	148.5	76%	0.759	82%	0.819	S	S	*	*			trans	60.9	90.3	162	-58.1	166.8	0	0	0	114.1
3	T	26.4	Very low	30.3	Very low	117 Å²	117	146.2 Å²	146.2	72%	0.718	81%	0.812	S	S	*	*				90.8	110.6	55.3	61.9	0	0	0	0	116
4	S	30.3	Very low	30.2	Very low	110 Å²	110	147.1 Å²	147.1	77%	0.769	82%	0.815	S	S	*	*			trans	-179.5	109.9	143.9	53.3	0	0	0	0	107.6
5	E	29.3	Very low	30.2	Very low	169 Å²	169	149 Å²	149	79%	0.79	82%	0.815	S	S	*	*				65.1	137.6	58.7	-59.2	-165.2	167.4	0	0	114.4
6	L	31.3	Very low	30.2	Very low	149 Å²	149	148.9 Å²	148.9	78%	0.78	82%	0.821	S	S	*	*			cis	-161.4	170.6	-12.8	-103.1	174.4	0	0	0	107.9
7	P	54.3	Low	30.1	Very low	106 Å²	106	147.5 Å²	147.5	69%	0.688	82%	0.818	S	S	*	*			trans	-98.3	-179.1	-171.2	40.3	-37.2	0	0	0	115
8	V	26.2	Very low	29.9	Very low	143 Å²	143	144.2 Å²	144.2	87%	0.867	81%	0.813	S	S	*	*			trans	-132.4	141.2	167.7	179.9	0	0	0	0	110.4
9	L	28.9	Very low	29.9	Very low	145 Å²	145	146.2 Å²	146.2	76%	0.759	81%	0.814	S	S	*	*			trans	-100.7	162.2	-179.1	-48.8	106.4	0	0	0	112
10	Q	28.2	Very low	29.8	Very low	189 Å²	189	144.6 Å²	144.6	88%	0.883	81%	0.813	S	S	*	*				179.7	151.4	105	-99.2	-176.1	-24.5	0	0	114.2
11	D	28.7	Very low	29.7	Very low	146 Å²	146	145.2 Å²	145.2	78%	0.781	82%	0.815	S	S	*	*			trans	-72.9	161.2	178	-48.4	-92.6	0	0	0	114
12	S	27.5	Very low	29.8	Very low	127 Å²	127	138.2 Å²	138.2	89%	0.888	79%	0.794	S	S	*	*			trans	-152.9	130.6	130.8	36.4	0	0	0	0	111.4
13	T	29.8	Very low	29.8	Very low	119 Å²	119	134.8 Å²	134.8	73%	0.73	80%	0.795	S	S	*	*			trans	-83.1	150.5	-179.1	51.7	0	0	0	0	112.1
14	N	27.9	Very low	29.9	Very low	158 Å²	158	134.1 Å²	134.1	85%	0.845	80%	0.795	S	S	*	*				-170.7	128.3	119.9	-95.3	-10.7	0	0	0	112
15	E	31.2	Very low	29.9	Very low	176 Å²	176	137.2 Å²	137.2	82%	0.822	80%	0.798	S	S	*	*			trans	-81.9	156.2	165.6	-56.9	172.7	117.8	0	0	110.5
16	T	29.4	Very low	29.9	Very low	148 Å²	148	135.9 Å²	135.9	91%	0.908	80%	0.795	S	S	*	*			trans	-158.8	123.9	141.5	-13.7	0	0	0	0	111.1
17	T	28.3	Very low	29.7	Very low	125 Å²	125	137.2 Å²	137.2	77%	0.767	80%	0.798	S	S	*	*			trans	-117.6	134.9	-172.6	51.2	0	0	0	0	113.6
18	A	27.4	Very low	28.4	Very low	88 Å²	88	139.8 Å²	139.8	73%	0.727	80%	0.8	S	S	*	*			trans	-169.8	135	151.7	0	0	0	0	0	107.5
19	H	28.9	Very low	28.5	Very low	181 Å²	181	139 Å²	139	84%	0.838	80%	0.796	S	S	*	*				57.5	137.3	58.2	-59.6	-59.6	0	0	0	112.2
20	S	28.6	Very low	28.5	Very low	114 Å²	114	138.5 Å²	138.5	80%	0.797	79%	0.79	S	S	*	*			cis	-169.7	160.3	10.4	42.3	0	0	0	0	109.3
21	D	28.2	Very low	28.6	Very low	158 Å²	158	134.5 Å²	134.5	85%	0.845	78%	0.778	S	S	*	*			cis	-177.4	179.7	-15.1	-177.2	31.1	0	0	0	109.1
22	A	28.8	Very low	28.7	Very low	86 Å²	86	136 Å²	136	71%	0.711	78%	0.778	S	S	*	*			trans	81.6	118.9	154.3	0	0	0	0	0	122.9
23	G	26.3	Very low	28.6	Very low	76 Å²	76	133.8 Å²	133.8	78%	0.784	78%	0.775	S	S	*	*			trans	75	165	138.2	0	0	0	0	0	120.8
24	S	29.5	Very low	28.6	Very low	103 Å²	103	137.9 Å²	137.9	72%	0.72	78%	0.782	S	S	*	*			cis	-179	137.6	-18.7	47.4	0	0	0	0	110.5
25	E	29.1	Very low	28.6	Very low	176 Å²	176	142.5 Å²	142.5	82%	0.822	79%	0.788	S	S	*	*			trans	63.2	167.1	156.9	-63.9	175.5	-180	0	0	117.2
26	L	29.7	Very low	28.5	Very low	141 Å²	141	143.6 Å²	143.6	74%	0.738	79%	0.79	S	S	*	*			cis	-159.7	177	-30.7	-108.4	170.1	0	0	0	108.5
27	E	27.7	Very low	28.5	Very low	177 Å²	177	148.7 Å²	148.7	83%	0.827	79%	0.792	S	S	*	*			trans	62.8	166.4	164.8	-70.3	175	-175.8	0	0	118.3
28	E	27.3	Very low	28.3	Very low	160 Å²	160	146.1 Å²	146.1	75%	0.748	79%	0.791	S	S	*	*				173.3	129.4	-51	-109.2	-151.5	148.3	0	0	107.8
29	T	27.8	Very low	28.6	Very low	126 Å²	126	153.7 Å²	153.7	77%	0.773	80%	0.801	S	S	*	*			trans	60.7	173.7	158.7	76.2	0	0	0	0	118.1
30	E	28.7	Very low	28.8	Very low	135 Å²	135	151.1 Å²	151.1	63%	0.631	80%	0.8	S	S	*	*			cis	-144.8	139.4	-11.8	-143.4	-141.5	-173	0	0	112.6	K32	E30-K32 IonicContact OE2-NZ 2.7Å; E30-K32 PolarHBondContact OE2-NZ 3.04Å
31	V	29.6	Very low	28.6	Very low	104 Å²	104	149.1 Å²	149.1	63%	0.63	80%	0.798	S	S	*	*			trans	16.4	125.1	139.8	176.7	0	0	0	0	121.4
32	K	30.2	Very low	28.7	Very low	179 Å²	179	153.5 Å²	153.5	78%	0.778	80%	0.802	S	S	*	*				169.7	149	121.9	-100.5	126.2	-144.2	140.9	0	114.3	E30	E30-K32 IonicContact OE2-NZ 2.7Å; E30-K32 PolarHBondContact OE2-NZ 3.04Å
33	G	25.8	Very low	29.7	Very low	80 Å²	80	154.5 Å²	154.5	83%	0.825	80%	0.802	S	S	*	*			trans	149.9	105.7	157.9	0	0	0	0	0	118.1
34	K	30.3	Very low	30.7	Very low	204 Å²	204	156 Å²	156	89%	0.887	80%	0.798	S	S	*	*			trans	-119.1	141.3	173.3	-65	175.2	179.7	172.5	0	111.3
35	R	27.8	Very low	30.8	Very low	255 Å²	255	156 Å²	156	96%	0.962	80%	0.798	S	S	*	*				178.3	152.2	123	-98.3	164.9	180	-166.2	0.1	117.8
36	K	30.1	Very low	30.7	Very low	199 Å²	199	154.6 Å²	154.6	87%	0.865	80%	0.801	S	S	*	*			trans	-76.3	173	-173.9	-67.2	173	168.2	176.7	0	116.3
37	R	27.6	Very low	30.7	Very low	255 Å²	255	155.2 Å²	155.2	96%	0.962	81%	0.805	S	S	*	*			trans	102.4	145.6	162.5	-61.3	176.6	172.6	-177.1	-2.4	114
38	G	25.2	Very low	30.7	Very low	72 Å²	72	156.8 Å²	156.8	74%	0.742	81%	0.809	S	S	*	*			cis	-176	156.5	-3.9	0	0	0	0	0	112.9
39	R	34.4	Very low	30.6	Very low	246 Å²	246	158.7 Å²	158.7	93%	0.928	82%	0.815	S	S	*	*			trans	-73.9	159.8	-173.4	-124	-176.9	-171.2	172.7	2.7	114.1
40	P	31.6	Very low	31.3	Very low	128 Å²	128	158.3 Å²	158.3	83%	0.831	82%	0.815	S	S	*	*				-134.1	176.1	129.4	39.9	-31.4	0	0	0	114
41	G	26	Very low	31.1	Very low	72 Å²	72	163.6 Å²	163.6	74%	0.742	83%	0.829	S	S	*	*			trans	163.1	150.1	165.8	0	0	0	0	0	113.9
42	R	28.3	Very low	31	Very low	249 Å²	249	167.7 Å²	167.7	94%	0.94	84%	0.838	S	S	*	*			trans	-162.3	157.5	162.2	-107.9	-153.2	162.1	-174.6	-5.5	114.9
43	P	50.7	Low	30.8	Very low	107 Å²	107	164.1 Å²	164.1	70%	0.695	84%	0.836	S	S	*	*			trans	-96.3	-165.9	177.5	44.3	-38	0	0	0	111.5
44	P	48.4	Very low	31	Very low	109 Å²	109	166.9 Å²	166.9	71%	0.708	84%	0.839	S	S	*	*			cis	-152	170.5	17.3	46.5	-25.1	0	0	0	122.1
45	S	31.5	Very low	30.7	Very low	102 Å²	102	160.4 Å²	160.4	71%	0.713	83%	0.83	S	S	*	*			trans	32.9	138.1	142.1	69.8	0	0	0	0	125.1
46	T	25.8	Very low	30.6	Very low	147 Å²	147	157 Å²	157	90%	0.902	83%	0.825	S	S	*	*			trans	-144.2	172.7	139.3	45.4	0	0	0	0	111.7
47	N	29.1	Very low	30.5	Very low	153 Å²	153	157.5 Å²	157.5	82%	0.818	83%	0.828	S	S	*	*			trans	-123.3	149.4	-166.3	-86.1	-63	0	0	0	114.5
48	K	28	Very low	30.4	Very low	210 Å²	210	150.2 Å²	150.2	91%	0.913	82%	0.816	S	S	*	*				175.4	169	121.9	-94.4	164	-175.8	178.5	0	115.1
49	K	25.3	Very low	30.4	Very low	201 Å²	201	158.5 Å²	158.5	87%	0.874	83%	0.825	S	S	*	*			trans	-116.6	-164.5	-169.3	-64	-177.8	177.1	-179.4	0	111.4
50	P	42.2	Very low	30	Very low	117 Å²	117	154.4 Å²	154.4	76%	0.76	82%	0.819	S	S	*	*				-133.9	174.8	-65.1	38.3	-22.3	0	0	0	115.1
51	R	24.8	Very low	29.8	Very low	246 Å²	246	157.7 Å²	157.7	93%	0.928	82%	0.823	S	S	*	*			trans	-164.8	122.9	150.4	-105	168	177.7	178.3	-1.6	108.1
52	K	27.1	Very low	29.7	Very low	191 Å²	191	158.8 Å²	158.8	83%	0.83	83%	0.825	S	S	*	*				84.6	103.6	61.5	-102.5	-154.5	176.7	-167.3	0	115.6
53	S	26.6	Very low	29.5	Very low	104 Å²	104	151.3 Å²	151.3	73%	0.727	82%	0.817	S	S	*	*			trans	57.5	151.4	135	-47.1	0	0	0	0	120.7
54	P	29.6	Very low	28.5	Very low	137 Å²	137	153 Å²	153	89%	0.89	82%	0.819	S	S	*	*				-135	165.3	93.8	39.6	-31.2	0	0	0	115
55	G	23.8	Very low	27.7	Very low	68 Å²	68	158.7 Å²	158.7	70%	0.701	83%	0.826	S	S	*	*			trans	-159.4	157	167.3	0	0	0	0	0	109.9
56	E	27	Very low	27.5	Very low	185 Å²	185	157.5 Å²	157.5	86%	0.864	83%	0.83	S	S	*	*			trans	51.3	122.3	169.6	-62.3	-165.1	108.4	0	0	121.4
57	K	26.6	Very low	27.7	Very low	209 Å²	209	157.9 Å²	157.9	91%	0.909	83%	0.832	S	S	*	*				-137.6	119	116	-70	-169	-179.6	179.4	0	106.7
58	S	25.7	Very low	27.8	Very low	102 Å²	102	153.9 Å²	153.9	71%	0.713	83%	0.827	S	S	*	*			cis	98.7	111.5	47.9	178	0	0	0	0	112
59	R	26.1	Very low	27.9	Very low	246 Å²	246	155.9 Å²	155.9	93%	0.928	83%	0.829	S	S	*	*			trans	-165.2	109.1	135.8	-119	-179.8	175.3	-179.5	-2.3	111.9
60	I	25.3	Very low	28.1	Very low	159 Å²	159	149.6 Å²	149.6	82%	0.815	82%	0.821	S	S	*	*			trans	-138.3	123.6	157.1	-63.8	-178.6	0	0	0	107.8
61	E	26.8	Very low	27.5	Very low	197 Å²	197	156.6 Å²	156.6	92%	0.921	83%	0.832	S	S	*	*			trans	-130.9	144.7	144.5	-68.7	-177.7	138	0	0	105.1
62	A	24.6	Very low	27.8	Very low	95 Å²	95	149.3 Å²	149.3	79%	0.785	83%	0.825	S	S	*	*			cis	-134.5	167.4	2.9	0	0	0	0	0	111.1
63	A	25.4	Very low	28.2	Very low	93 Å²	93	148.3 Å²	148.3	77%	0.769	83%	0.829	S	S	*	*			trans	-93.7	152.2	178.9	0	0	0	0	0	112.8
64	I	28.1	Very low	28.2	Very low	142 Å²	142	147 Å²	147	73%	0.728	83%	0.831	S	S	*	*			trans	-164.9	120.1	149.3	-105.3	150.9	0	0	0	109.6
65	R	31.2	Very low	28.2	Very low	229 Å²	229	149.1 Å²	149.1	86%	0.864	83%	0.829	S	S	*	*			trans	53.1	119.1	161.3	-53.2	166.5	-152.1	-174.5	6.9	116.1
66	G	27.3	Very low	28.7	Very low	77 Å²	77	152 Å²	152	79%	0.794	84%	0.835	S	S	*	*			cis	97.5	134.7	48.4	0	0	0	0	0	108.9
67	V	30.8	Very low	28.8	Very low	155 Å²	155	151.6 Å²	151.6	94%	0.939	83%	0.833	S	S	*	*			cis	-141.6	158.4	14.8	173.6	0	0	0	0	109.3
68	G	31.2	Very low	29	Very low	69 Å²	69	150.2 Å²	150.2	71%	0.711	83%	0.83	S	S	*	*			trans	-96	171.3	-171	0	0	0	0	0	117.7
69	R	30.6	Very low	29.3	Very low	252 Å²	252	152.8 Å²	152.8	95%	0.951	84%	0.836	S	S	*	*			trans	-137.2	151.2	161.7	-77.3	-176.9	173	179.7	-3.7	107.1
70	G	28.6	Very low	29.5	Very low	69 Å²	69	144.2 Å²	144.2	71%	0.711	82%	0.824	S	S	*	*			cis	100.4	83.7	17.2	0	0	0	0	0	109.7
71	R	31.3	Very low	30.2	Very low	263 Å²	263	147 Å²	147	99%	0.992	83%	0.833	S	S	*	*			trans	-72.1	129.1	179.1	-84.5	-177	168.6	177.6	-5	110.3
72	A	30.6	Very low	30.5	Very low	94 Å²	94	140.7 Å²	140.7	78%	0.777	82%	0.822	S	S	*	*			trans	-146.5	173.7	169.1	0	0	0	0	0	108.6
73	N	35.5	Very low	31.4	Very low	170 Å²	170	143.4 Å²	143.4	91%	0.909	82%	0.823	S	S	*	*			trans	-37.4	143.9	-171.7	-58.9	4.1	0	0	0	116.4
74	G	27.1	Very low	33.3	Very low	76 Å²	76	144.4 Å²	144.4	78%	0.784	82%	0.822	S	S	*	*			trans	-128.8	113	163	0	0	0	0	0	110.5
75	H	28.4	Very low	35.7	Very low	182 Å²	182	142.4 Å²	142.4	84%	0.843	82%	0.816	S	S	*	*			trans	-63.6	144.9	162.9	-75.1	-68.6	0	0	0	109.8	Q77	H75-Q77 VanDerWaalsContact C-N 3.3Å; H75-Q77 PolarHBondContact O-N 3.12Å
76	P	34.3	Very low	38.5	Very low	127 Å²	127	133.5 Å²	133.5	83%	0.825	79%	0.787	S	S	*	*			trans	-74.5	86.7	159.6	31.5	-30.3	0	0	0	108.9	Q78	P76-Q78 PolarHBondContact O-N 3.43Å
77	Q	29.6	Very low	41.6	Very low	177 Å²	177	131.2 Å²	131.2	83%	0.827	76%	0.756	S	S	*	*			trans	-75.5	88.4	174.9	-169.9	170.1	18.5	0	0	109.7	H75	H75-Q77 VanDerWaalsContact C-N 3.3Å; H75-Q77 PolarHBondContact O-N 3.12Å
78	Q	31.1	Very low	44.6	Very low	181 Å²	181	125.1 Å²	125.1	85%	0.846	72%	0.717	S	S	*	*			trans	-91.8	116.4	175.7	-168.4	166	29.6	0	0	109.5	P76 G80	P76-Q78 PolarHBondContact O-N 3.43Å; Q78-G80 PolarHBondContact O-N 2.97Å; Q78-G80 VanDerWaalsContact O-N 3.1Å
79	N	31.6	Very low	47.6	Very low	155 Å²	155	126 Å²	126	83%	0.829	70%	0.703	S	S	*	*			trans	-73.4	103.1	176.9	-82.4	3.7	0	0	0	110.6
80	G	31	Very low	50.6	Low	66 Å²	66	116.1 Å²	116.1	68%	0.68	67%	0.671	S	S	*	*			trans	-166.7	132.9	165.2	0	0	0	0	0	108	Q78 G82	Q78-G80 PolarHBondContact O-N 2.97Å; Q78-G80 VanDerWaalsContact O-N 3.1Å; G80-G82 PolarHBondContact O-N 2.97Å
81	E	39.3	Very low	53.8	Low	217 Å²	217	112.9 Å²	112.9	100%	1.014	64%	0.637	S	S	*	*			trans	-73.5	111.2	175	-69.1	174.7	138.2	0	0	108.4
82	G	34	Very low	56.7	Low	66 Å²	66	103 Å²	103	68%	0.68	60%	0.601	S	S	*	*			trans	-158.2	140.9	176	0	0	0	0	0	108.6	G80	G80-G82 PolarHBondContact O-N 2.97Å
83	D	43.4	Very low	59.5	Low	152 Å²	152	102.1 Å²	102.1	81%	0.813	58%	0.583	S	S	*	*	P	Polyproline II helix	trans	-63.6	153.4	-174	-69	-63.3	0	0	0	112.7	V85	D83-V85 PolarHBondContact O-N 3.41Å
84	P	63.5	Low	61.9	Low	113 Å²	113	94.9 Å²	94.9	73%	0.734	55%	0.549	S	S	*	.	P	Polyproline II helix	trans	-62.4	119.1	177.3	25.7	-34.2	0	0	0	110.7	T86	P84-T86 PolarHBondContact O-N 3.12Å; P84-T86 VanDerWaalsContact O-N 3.17Å
85	V	80.4	Confident	64.8	Low	100 Å²	100	99.8 Å²	99.8	61%	0.606	55%	0.548	S	S	*	.	P	Polyproline II helix	trans	-52.9	117.9	-178	-179.5	0	0	0	0	110.6	D83 E89 V90	D83-V85 PolarHBondContact O-N 3.41Å; V85-E89 WeakPolarHBondContact CA-OE2 3.47Å; V85-E89 HydrophobicContact CG1-CB 3.98Å; V85-V90 HydrophobicContact CG1-CG2 4.03Å
86	T	88.9	Confident	67.5	Low	43 Å²	43	94.4 Å²	94.4	26%	0.264	53%	0.532	S	S	.	.	P	Polyproline II helix	trans	-82.2	160	-171.7	84.2	0	0	0	0	111.7	P84 F88 E89 V90 Q126	P84-T86 PolarHBondContact O-N 3.12Å; P84-T86 VanDerWaalsContact O-N 3.17Å; T86-F88 PolarHBondContact O-N 3.13Å; T86-F88 PolarHBondContact OG1-N 3.3Å; T86-E89 PolarHBondContact N-OE2 3.36Å; T86-E89 WeakPolarHBondContact O-CB 3.49Å; T86-E89 PolarHBondContact O-N 2.98Å; T86-E89 PolarHBondContact OG1-N 3.22Å; T86-V90 PolarHBondContact O-N 3.29Å; T86-V90 VanDerWaalsContact O-N 3.07Å; T86-Q126 PolarHBondContact OG1-OE1 3.25Å
87	L	92.6	Very high	70.2	Confident	28 Å²	28	91.8 Å²	91.8	15%	0.147	52%	0.52	C	S	.	.	H	α-helix	trans	-56.5	-32.7	174.8	-177.9	56.8	0	0	0	112.3	V90 V91 V101 F123 F181	L87-V90 PolarHBondContact O-N 3.2Å; L87-V91 HydrophobicContact CD1-CG2 4.31Å; L87-V91 WeakPolarHBondContact O-CG2 3.5Å; L87-V91 PolarHBondContact O-N 2.8Å; L87-V101 HydrophobicContact CD1-CG1 3.48Å; L87-V101 VanDerWaalsContact CD1-CG1 3.48Å; L87-F123 HydrophobicContact CB-CB 4.3Å; L87-F123 HydrophobicContact CB-CD2 4.09Å; L87-F123 HydrophobicContact CD2-CB 3.9Å; L87-F123 HydrophobicContact CD2-CD2 4.11Å; L87-F123 HydrophobicContact CD2-CG 3.93Å; L87-F123 HydrophobicContact CG-CB 4.21Å; L87-F123 HydrophobicContact CG-CD2 3.66Å; L87-F123 HydrophobicContact CG-CE2 4.19Å; L87-F123 HydrophobicContact CG-CG 4.02Å; L87-F181 HydrophobicContact CD1-CE2 4.11Å; L87-F181 HydrophobicContact CD1-CZ 4.31Å; L87-F181 HydrophobicContact CD2-CE1 4.37Å; L87-F181 HydrophobicContact CD2-CE2 4.45Å; L87-F181 HydrophobicContact CD2-CZ 3.83Å; L87-F181 HydrophobicContact CG-CZ 4.47Å
88	F	94.6	Very high	73.3	Confident	27 Å²	27	84 Å²	84	12%	0.118	48%	0.484	C	S	.	.	H	α-helix	trans	-63.6	-43.8	173.6	164.9	-111.3	0	0	0	111.7	T86 V91 K92 F123 Q126 C127 P163 W171 F174	T86-F88 PolarHBondContact O-N 3.13Å; T86-F88 PolarHBondContact OG1-N 3.3Å; F88-V91 PolarHBondContact O-N 3.49Å; F88-K92 HydrophobicContact CE1-CD 4.04Å; F88-K92 HydrophobicContact CE2-CD 4.36Å; F88-K92 HydrophobicContact CZ-CD 3.83Å; F88-K92 WeakPolarHBondContact O-CB 3.42Å; F88-K92 PolarHBondContact O-N 3.15Å; F88-F123 HydrophobicContact CB-CD2 4.25Å; F88-Q126 HydrophobicContact CB-CB 3.82Å; F88-Q126 HydrophobicContact CD1-CB 4.09Å; F88-Q126 HydrophobicContact CG-CB 3.91Å; F88-C127 HydrophobicContact CD2-CB 4.47Å; F88-P163 HydrophobicContact CE2-CB 4.5Å; F88-P163 HydrophobicContact CE2-CG 4.16Å; F88-P163 HydrophobicContact CZ-CG 4.1Å; F88-W171 HydrophobicContact CZ-CZ3 4.42Å; F88-F174 AromaticContact CD2-CE2 3.8Å; F88-F174 HydrophobicContact CD2-CE2 3.8Å; F88-F174 HydrophobicContact CD2-CZ 4.18Å; F88-F174 HydrophobicContact CE2-CD2 4.37Å; F88-F174 AromaticContact CE2-CE2 3.67Å; F88-F174 HydrophobicContact CE2-CE2 3.67Å; F88-F174 AromaticContact CE2-CZ 3.82Å; F88-F174 HydrophobicContact CE2-CZ 3.82Å
89	E	93.3	Very high	76.3	Confident	89 Å²	89	78.5 Å²	78.5	42%	0.416	46%	0.458	S	S	.	.	H	α-helix	trans	-65.5	-41.1	177.3	-61.9	-165.1	117.2	0	0	112.4	V85 T86 V91 K92 L93	V85-E89 WeakPolarHBondContact CA-OE2 3.47Å; V85-E89 HydrophobicContact CG1-CB 3.98Å; T86-E89 PolarHBondContact N-OE2 3.36Å; T86-E89 WeakPolarHBondContact O-CB 3.49Å; T86-E89 PolarHBondContact O-N 2.98Å; T86-E89 PolarHBondContact OG1-N 3.22Å; E89-V91 PolarHBondContact O-N 3.09Å; E89-K92 PolarHBondContact O-N 3.47Å; E89-L93 WeakPolarHBondContact O-CB 3.44Å; E89-L93 VanDerWaalsContact O-CG 3.26Å; E89-L93 WeakPolarHBondContact O-CG 3.37Å; E89-L93 PolarHBondContact O-N 3.45Å
90	V	94.1	Very high	79.4	Confident	44 Å²	44	73.7 Å²	73.7	27%	0.267	44%	0.437	S	S	.	.	H	α-helix	trans	-58.5	-49.3	175.9	177.1	0	0	0	0	110.7	V85 T86 L87 G94 V101	V85-V90 HydrophobicContact CG1-CG2 4.03Å; T86-V90 PolarHBondContact O-N 3.29Å; T86-V90 VanDerWaalsContact O-N 3.07Å; L87-V90 PolarHBondContact O-N 3.2Å; V90-G94 PolarHBondContact O-N 3.3Å; V90-V101 HydrophobicContact CG1-CB 4.49Å; V90-V101 HydrophobicContact CG1-CG1 3.89Å; V90-V101 HydrophobicContact CG1-CG2 3.7Å
91	V	94.5	Very high	82.4	Confident	1 Å²	1	71.2 Å²	71.2	1%	0.006	41%	0.409	C	S	.	.	H	α-helix	trans	-68.7	-40.2	179.1	173.3	0	0	0	0	111.7	L87 F88 E89 G94 M98 F123 F174 N177 F181	L87-V91 HydrophobicContact CD1-CG2 4.31Å; L87-V91 WeakPolarHBondContact O-CG2 3.5Å; L87-V91 PolarHBondContact O-N 2.8Å; F88-V91 PolarHBondContact O-N 3.49Å; E89-V91 PolarHBondContact O-N 3.09Å; V91-G94 PolarHBondContact O-N 3.21Å; V91-M98 HydrophobicContact CG1-CE 4.45Å; V91-M98 HydrophobicContact CG2-SD 4.29Å; V91-F123 HydrophobicContact CB-CE2 3.93Å; V91-F123 HydrophobicContact CB-CZ 4.46Å; V91-F123 HydrophobicContact CG1-CE2 4.19Å; V91-F123 HydrophobicContact CG1-CZ 4.31Å; V91-F123 HydrophobicContact CG2-CE2 3.74Å; V91-F123 HydrophobicContact CG2-CZ 4.13Å; V91-F174 HydrophobicContact CG1-CD2 4.45Å; V91-F174 HydrophobicContact CG1-CE2 4.44Å; V91-N177 HydrophobicContact CG1-CB 3.81Å; V91-N177 WeakPolarHBondContact O-CB 3.18Å; V91-N177 PolarHBondContact O-ND2 3.35Å; V91-F181 HydrophobicContact CG2-CB 4.46Å; V91-F181 HydrophobicContact CG2-CD2 4.21Å; V91-F181 HydrophobicContact CG2-CG 4.31Å
92	K	93.1	Very high	85.2	Confident	54 Å²	54	60.9 Å²	60.9	24%	0.235	36%	0.36	C	S	.	.	H	α-helix	trans	-64.8	-38.6	177.2	179.1	-178.9	175.5	-177.5	0	113.2	F88 E89 W171 F174	F88-K92 HydrophobicContact CE1-CD 4.04Å; F88-K92 HydrophobicContact CE2-CD 4.36Å; F88-K92 HydrophobicContact CZ-CD 3.83Å; F88-K92 WeakPolarHBondContact O-CB 3.42Å; F88-K92 PolarHBondContact O-N 3.15Å; E89-K92 PolarHBondContact O-N 3.47Å; K92-W171 HydrophobicContact CD-CH2 4.06Å; K92-W171 HydrophobicContact CD-CZ3 4.01Å; K92-W171 HydrophobicContact CG-CZ3 4.37Å; K92-W171 VanDerWaalsContact NZ-CH2 3.33Å; K92-F174 HydrophobicContact CB-CD2 3.98Å; K92-F174 HydrophobicContact CG-CD2 4.48Å
93	L	90.1	Very high	88.1	Confident	76 Å²	76	61 Å²	61	40%	0.398	35%	0.345	S	S	.	.	H	α-helix	trans	-75.4	-42.8	174.5	-67.7	172.3	0	0	0	110.9	E89 K95 K173	E89-L93 WeakPolarHBondContact O-CB 3.44Å; E89-L93 VanDerWaalsContact O-CG 3.26Å; E89-L93 WeakPolarHBondContact O-CG 3.37Å; E89-L93 PolarHBondContact O-N 3.45Å; L93-K95 HydrophobicContact CB-CD 4.41Å; L93-K95 HydrophobicContact CB-CG 4.23Å; L93-K173 PolarHBondContact O-NZ 3.5Å
94	G	85.6	Confident	90.6	Very high	19 Å²	19	59 Å²	59	20%	0.196	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	55.5	52.4	-179.2	0	0	0	0	0	112.1	V90 V91 K173	V90-G94 PolarHBondContact O-N 3.3Å; V91-G94 PolarHBondContact O-N 3.21Å; G94-K173 PolarHBondContact O-NZ 3.21Å
95	K	87.4	Confident	92.2	Very high	178 Å²	178	54.2 Å²	54.2	77%	0.774	30%	0.302	S	S	*	.			trans	-91.7	-26.4	176.7	-70.1	175.4	-179.6	174.2	0	112.6	L93	L93-K95 HydrophobicContact CB-CD 4.41Å; L93-K95 HydrophobicContact CB-CG 4.23Å
96	S	85.9	Confident	92.9	Very high	70 Å²	70	50.1 Å²	50.1	49%	0.49	28%	0.276	S	S	.	.	S	Bend	trans	-95.8	157.1	175.6	-55.4	0	0	0	0	110.6
97	A	91.1	Very high	93.3	Very high	71 Å²	71	52.6 Å²	52.6	59%	0.587	29%	0.285	S	S	*	.			trans	-65.9	133.9	167.7	0	0	0	0	0	109.7	Q99 S100	A97-Q99 PolarHBondContact O-N 3.33Å; A97-S100 WeakPolarHBondContact O-CB 3.07Å; A97-S100 PolarHBondContact O-N 3.1Å
98	M	94.2	Very high	93.4	Very high	13 Å²	13	53.1 Å²	53.1	6%	0.064	29%	0.291	C	S	.	.	H	α-helix	trans	-58.2	-36.2	-172.7	-163.1	58.5	66.3	0	0	112.9	V91 S100 V101 V102 N177 E180 F181 V184	V91-M98 HydrophobicContact CG1-CE 4.45Å; V91-M98 HydrophobicContact CG2-SD 4.29Å; M98-S100 VanDerWaalsContact C-N 3.33Å; M98-S100 PolarHBondContact O-N 3.17Å; M98-V101 PolarHBondContact O-N 3.5Å; M98-V102 PolarHBondContact O-N 3.14Å; M98-V102 VanDerWaalsContact O-N 3.09Å; M98-N177 HydrophobicContact CE-CB 3.72Å; M98-N177 WeakPolarHBondContact CE-O 3.39Å; M98-E180 HydrophobicContact CB-CG 4.22Å; M98-E180 HydrophobicContact CG-CB 4.43Å; M98-E180 HydrophobicContact CG-CG 4.07Å; M98-F181 HydrophobicContact CG-CB 4.21Å; M98-F181 HydrophobicContact SD-CB 3.65Å; M98-F181 HydrophobicContact SD-CD2 3.8Å; M98-F181 HydrophobicContact SD-CG 4.22Å; M98-V184 HydrophobicContact CG-CG2 4.34Å
99	Q	94.3	Very high	93.5	Very high	66 Å²	66	52 Å²	52	31%	0.308	29%	0.286	S	S	.	.	H	α-helix	trans	-51.7	-45.8	172	-178.8	57	47.8	0	0	113.2	A97 V101 V102 D103 Q188	A97-Q99 PolarHBondContact O-N 3.33Å; Q99-V101 PolarHBondContact O-N 3.11Å; Q99-V102 PolarHBondContact O-N 3.3Å; Q99-D103 PolarHBondContact NE2-OD1 3.31Å; Q99-D103 PolarHBondContact NE2-OD2 3.45Å; Q99-D103 VanDerWaalsContact O-CG 3.29Å; Q99-D103 PolarHBondContact O-N 3.07Å; Q99-Q188 VanDerWaalsContact CD-NE2 3.27Å; Q99-Q188 VanDerWaalsContact NE2-NE2 3.13Å
100	S	95.3	Very high	93.6	Very high	54 Å²	54	53.9 Å²	53.9	38%	0.378	29%	0.293	S	S	.	.	H	α-helix	trans	-63.7	-42.8	179.6	-169	0	0	0	0	111.3	A97 M98 V102 D103 D104	A97-S100 WeakPolarHBondContact O-CB 3.07Å; A97-S100 PolarHBondContact O-N 3.1Å; M98-S100 VanDerWaalsContact C-N 3.33Å; M98-S100 PolarHBondContact O-N 3.17Å; S100-V102 VanDerWaalsContact C-N 3.25Å; S100-V102 PolarHBondContact O-N 2.89Å; S100-D103 PolarHBondContact O-N 3.03Å; S100-D104 WeakPolarHBondContact O-CB 3.23Å; S100-D104 PolarHBondContact O-N 3.5Å; S100-D104 PolarHBondContact OG-OD2 2.97Å
101	V	95.4	Very high	93.6	Very high	15 Å²	15	58.9 Å²	58.9	9%	0.091	31%	0.313	C	S	.	.	H	α-helix	trans	-63.4	-36.2	-179.9	-173	0	0	0	0	110.9	L87 V90 M98 Q99 W105 F181	L87-V101 HydrophobicContact CD1-CG1 3.48Å; L87-V101 VanDerWaalsContact CD1-CG1 3.48Å; V90-V101 HydrophobicContact CG1-CB 4.49Å; V90-V101 HydrophobicContact CG1-CG1 3.89Å; V90-V101 HydrophobicContact CG1-CG2 3.7Å; M98-V101 PolarHBondContact O-N 3.5Å; Q99-V101 PolarHBondContact O-N 3.11Å; V101-W105 WeakPolarHBondContact O-CB 3.3Å; V101-W105 PolarHBondContact O-N 2.81Å; V101-W105 VanDerWaalsContact O-N 3.15Å; V101-F181 HydrophobicContact CG1-CE2 4.29Å
102	V	96.8	Very high	93.6	Very high	0 Å²	0	61.8 Å²	61.8	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-70.1	-44.4	172.9	163.5	0	0	0	0	111.9	M98 Q99 S100 W105 I106 F181 V184 L185 Q188	M98-V102 PolarHBondContact O-N 3.14Å; M98-V102 VanDerWaalsContact O-N 3.09Å; Q99-V102 PolarHBondContact O-N 3.3Å; S100-V102 VanDerWaalsContact C-N 3.25Å; S100-V102 PolarHBondContact O-N 2.89Å; V102-W105 PolarHBondContact O-N 2.73Å; V102-I106 HydrophobicContact CG1-CD1 3.65Å; V102-I106 HydrophobicContact CG1-CG1 4.32Å; V102-I106 WeakPolarHBondContact O-CB 3.23Å; V102-I106 VanDerWaalsContact O-CG1 3.31Å; V102-I106 WeakPolarHBondContact O-CG1 3.2Å; V102-I106 PolarHBondContact O-N 2.96Å; V102-F181 HydrophobicContact CG2-CD2 3.77Å; V102-F181 HydrophobicContact CG2-CE2 3.68Å; V102-V184 HydrophobicContact CB-CG1 3.99Å; V102-V184 HydrophobicContact CG1-CG1 4.13Å; V102-V184 HydrophobicContact CG2-CB 4.1Å; V102-V184 HydrophobicContact CG2-CG1 3.82Å; V102-L185 HydrophobicContact CG1-CB 4.43Å; V102-L185 HydrophobicContact CG1-CD1 4.19Å; V102-L185 HydrophobicContact CG2-CB 4.09Å; V102-Q188 HydrophobicContact CG1-CB 4.04Å; V102-Q188 HydrophobicContact CG1-CG 4.01Å
103	D	95.7	Very high	93.7	Very high	68 Å²	68	64.5 Å²	64.5	36%	0.364	34%	0.338	S	S	.	.	H	α-helix	trans	-63.6	-41.8	178.6	-70	-36.4	0	0	0	111.8	Q99 S100 I106 E107	Q99-D103 PolarHBondContact NE2-OD1 3.31Å; Q99-D103 PolarHBondContact NE2-OD2 3.45Å; Q99-D103 VanDerWaalsContact O-CG 3.29Å; Q99-D103 PolarHBondContact O-N 3.07Å; S100-D103 PolarHBondContact O-N 3.03Å; D103-I106 PolarHBondContact O-N 3.04Å; D103-E107 PolarHBondContact O-N 2.85Å
104	D	95.4	Very high	93.8	Very high	109 Å²	109	62.7 Å²	62.7	58%	0.583	33%	0.328	S	S	*	.	H	α-helix	trans	-62.2	-42.3	175.1	-68.3	-40.9	0	0	0	111	S100 E107 S108	S100-D104 WeakPolarHBondContact O-CB 3.23Å; S100-D104 PolarHBondContact O-N 3.5Å; S100-D104 PolarHBondContact OG-OD2 2.97Å; D104-E107 PolarHBondContact O-N 3.19Å; D104-S108 PolarHBondContact O-N 3.21Å
105	W	96.6	Very high	94.2	Very high	14 Å²	14	65.7 Å²	65.7	5%	0.053	34%	0.339	C	S	.	.	H	α-helix	trans	-67.3	-41.9	174.6	-176.2	88.6	0	0	0	112.5	V101 V102 E107 S108 Y109 A116 L117 L120 L185 M199	V101-W105 WeakPolarHBondContact O-CB 3.3Å; V101-W105 PolarHBondContact O-N 2.81Å; V101-W105 VanDerWaalsContact O-N 3.15Å; V102-W105 PolarHBondContact O-N 2.73Å; W105-E107 VanDerWaalsContact C-N 3.3Å; W105-E107 PolarHBondContact O-N 3.27Å; W105-S108 VanDerWaalsContact O-CB 3.32Å; W105-S108 WeakPolarHBondContact O-CB 3.1Å; W105-S108 PolarHBondContact O-N 3.2Å; W105-S108 VanDerWaalsContact O-N 3.14Å; W105-Y109 AromaticContact CH2-CD2 3.84Å; W105-Y109 HydrophobicContact CH2-CD2 3.84Å; W105-Y109 HydrophobicContact CH2-CG 4.04Å; W105-Y109 HydrophobicContact CZ2-CD2 4.23Å; W105-Y109 HydrophobicContact CZ3-CG 4.3Å; W105-Y109 PolarHBondContact O-N 3.4Å; W105-A116 HydrophobicContact CZ2-CB 4.15Å; W105-A116 WeakPolarHBondContact CZ2-O 3.27Å; W105-A116 PolarHBondContact NE1-O 3.23Å; W105-L117 HydrophobicContact CH2-CD2 4.5Å; W105-L117 HydrophobicContact CZ2-CD2 4.36Å; W105-L120 HydrophobicContact CH2-CD2 4.06Å; W105-L120 HydrophobicContact CZ2-CB 3.98Å; W105-L120 HydrophobicContact CZ2-CD2 3.7Å; W105-L120 HydrophobicContact CZ2-CG 4.41Å; W105-L185 HydrophobicContact CD2-CD1 4.45Å; W105-L185 HydrophobicContact CE3-CD1 3.53Å; W105-L185 HydrophobicContact CZ3-CD1 3.67Å; W105-M199 HydrophobicContact CH2-CE 3.89Å; W105-M199 HydrophobicContact CH2-CG 4.17Å; W105-M199 HydrophobicContact CH2-SD 4.3Å; W105-M199 HydrophobicContact CZ3-CE 4.03Å; W105-M199 HydrophobicContact CZ3-SD 4.41Å
106	I	96.5	Very high	94.5	Very high	13 Å²	13	57.2 Å²	57.2	7%	0.067	30%	0.302	C	S	.	.	H	α-helix	trans	-62.2	-36.9	176.6	-79.1	174.2	0	0	0	111.2	V102 D103 Y109 K110 L185 Q188 I193	V102-I106 HydrophobicContact CG1-CD1 3.65Å; V102-I106 HydrophobicContact CG1-CG1 4.32Å; V102-I106 WeakPolarHBondContact O-CB 3.23Å; V102-I106 VanDerWaalsContact O-CG1 3.31Å; V102-I106 WeakPolarHBondContact O-CG1 3.2Å; V102-I106 PolarHBondContact O-N 2.96Å; D103-I106 PolarHBondContact O-N 3.04Å; I106-Y109 PolarHBondContact O-N 3.37Å; I106-K110 VanDerWaalsContact CG2-CE 3.43Å; I106-K110 WeakPolarHBondContact O-CE 3.4Å; I106-K110 WeakPolarHBondContact O-CG 3.44Å; I106-K110 PolarHBondContact O-N 3.07Å; I106-L185 HydrophobicContact CG1-CD1 4.34Å; I106-Q188 HydrophobicContact CD1-CB 3.52Å; I106-I193 HydrophobicContact CG1-CD1 4.46Å; I106-I193 HydrophobicContact CG2-CD1 3.87Å
107	E	96.1	Very high	94.9	Very high	95 Å²	95	53.9 Å²	53.9	44%	0.444	28%	0.279	S	S	.	.	H	α-helix	trans	-74.1	-29.7	175.3	-164.5	60.8	-158.3	0	0	112.4	D103 D104 W105 K110 Q111	D103-E107 PolarHBondContact O-N 2.85Å; D104-E107 PolarHBondContact O-N 3.19Å; W105-E107 VanDerWaalsContact C-N 3.3Å; W105-E107 PolarHBondContact O-N 3.27Å; E107-K110 WeakPolarHBondContact OE2-CD 3.34Å; E107-K110 IonicContact OE2-NZ 2.72Å; E107-K110 PolarHBondContact OE2-NZ 3.38Å; E107-Q111 WeakPolarHBondContact O-CG 3.25Å; E107-Q111 PolarHBondContact O-N 2.78Å; E107-Q111 PolarHBondContact O-NE2 2.95Å
108	S	95.4	Very high	95.1	Very high	39 Å²	39	51.5 Å²	51.5	27%	0.273	26%	0.256	S	S	.	.	H	α-helix	trans	-64.1	-46.9	167.9	-168.3	0	0	0	0	111.4	D104 W105 K110 Q111 D112	D104-S108 PolarHBondContact O-N 3.21Å; W105-S108 VanDerWaalsContact O-CB 3.32Å; W105-S108 WeakPolarHBondContact O-CB 3.1Å; W105-S108 PolarHBondContact O-N 3.2Å; W105-S108 VanDerWaalsContact O-N 3.14Å; S108-K110 VanDerWaalsContact C-N 3.26Å; S108-K110 PolarHBondContact O-N 3.27Å; S108-Q111 WeakPolarHBondContact O-CA 3.38Å; S108-Q111 WeakPolarHBondContact O-CB 3.49Å; S108-Q111 PolarHBondContact O-N 3.08Å; S108-D112 PolarHBondContact O-N 3.04Å
109	Y	96.8	Very high	95.1	Very high	3 Å²	3	54.6 Å²	54.6	1%	0.012	27%	0.273	C	S	.	.	H	α-helix	trans	-61.3	-30.6	179.3	-175.8	-98.2	0	0	0	113.6	W105 I106 Q111 R113 A116 L117 I193 D196 M199	W105-Y109 AromaticContact CH2-CD2 3.84Å; W105-Y109 HydrophobicContact CH2-CD2 3.84Å; W105-Y109 HydrophobicContact CH2-CG 4.04Å; W105-Y109 HydrophobicContact CZ2-CD2 4.23Å; W105-Y109 HydrophobicContact CZ3-CG 4.3Å; W105-Y109 PolarHBondContact O-N 3.4Å; I106-Y109 PolarHBondContact O-N 3.37Å; Y109-Q111 VanDerWaalsContact C-N 3.31Å; Y109-R113 HydrophobicContact CD1-CG 4.45Å; Y109-R113 HydrophobicContact CD2-CB 4.15Å; Y109-R113 HydrophobicContact CD2-CG 4.19Å; Y109-R113 HydrophobicContact CE1-CG 4.04Å; Y109-R113 HydrophobicContact CE2-CB 3.69Å; Y109-R113 HydrophobicContact CE2-CG 3.75Å; Y109-R113 WeakPolarHBondContact O-CG 3.35Å; Y109-A116 VanDerWaalsContact CA-CB 3.48Å; Y109-A116 HydrophobicContact CD2-CB 4.06Å; Y109-A116 HydrophobicContact CG-CB 4.45Å; Y109-L117 HydrophobicContact CD2-CG 4.27Å; Y109-L117 HydrophobicContact CE2-CD1 4Å; Y109-L117 HydrophobicContact CE2-CD2 4.3Å; Y109-L117 HydrophobicContact CE2-CG 3.85Å; Y109-I193 HydrophobicContact CD1-CD1 4.06Å; Y109-I193 HydrophobicContact CD1-CG1 4.3Å; Y109-I193 HydrophobicContact CD1-CG2 3.95Å; Y109-I193 HydrophobicContact CE1-CG1 4.35Å; Y109-I193 HydrophobicContact CE1-CG2 3.63Å; Y109-D196 VanDerWaalsContact CE1-OD2 3.27Å; Y109-D196 WeakPolarHBondContact CE1-OD2 3.49Å; Y109-D196 PolarHBondContact OH-OD1 2.81Å; Y109-D196 PolarHBondContact OH-OD2 3.05Å; Y109-M199 HydrophobicContact CE2-CB 4.38Å
110	K	94.3	Very high	95.2	Very high	129 Å²	129	51.5 Å²	51.5	56%	0.561	26%	0.258	S	S	*	.	H	α-helix	trans	-71.9	-21.9	171.8	-68.9	171.9	-140.8	156.3	0	113.7	I106 E107 S108	I106-K110 VanDerWaalsContact CG2-CE 3.43Å; I106-K110 WeakPolarHBondContact O-CE 3.4Å; I106-K110 WeakPolarHBondContact O-CG 3.44Å; I106-K110 PolarHBondContact O-N 3.07Å; E107-K110 WeakPolarHBondContact OE2-CD 3.34Å; E107-K110 IonicContact OE2-NZ 2.72Å; E107-K110 PolarHBondContact OE2-NZ 3.38Å; S108-K110 VanDerWaalsContact C-N 3.26Å; S108-K110 PolarHBondContact O-N 3.27Å
111	Q	95.6	Very high	95.2	Very high	150 Å²	150	49.1 Å²	49.1	70%	0.701	24%	0.242	S	C	*	.	H	α-helix	trans	-90.8	-48.3	180	-70.6	170	64.9	0	0	111.5	E107 S108 Y109	E107-Q111 WeakPolarHBondContact O-CG 3.25Å; E107-Q111 PolarHBondContact O-N 2.78Å; E107-Q111 PolarHBondContact O-NE2 2.95Å; S108-Q111 WeakPolarHBondContact O-CA 3.38Å; S108-Q111 WeakPolarHBondContact O-CB 3.49Å; S108-Q111 PolarHBondContact O-N 3.08Å; Y109-Q111 VanDerWaalsContact C-N 3.31Å
112	D	94.8	Very high	95.2	Very high	62 Å²	62	49 Å²	49	33%	0.332	24%	0.241	S	C	.	.			trans	-147.3	112.6	172.5	-168.9	-45.1	0	0	0	110.1	S108 D114 I115 A116	S108-D112 PolarHBondContact O-N 3.04Å; D112-D114 WeakPolarHBondContact OD1-CB 3.41Å; D112-D114 PolarHBondContact OD1-N 3.23Å; D112-I115 HydrophobicContact CB-CB 4.17Å; D112-I115 HydrophobicContact CB-CD1 4.02Å; D112-I115 HydrophobicContact CB-CG1 4.18Å; D112-I115 PolarHBondContact OD1-N 3.12Å; D112-I115 VanDerWaalsContact OD1-N 3.1Å; D112-I115 WeakPolarHBondContact OD2-CD1 3.31Å; D112-A116 WeakPolarHBondContact O-CB 3.38Å; D112-A116 PolarHBondContact O-N 2.85Å
113	R	94.3	Very high	95.3	Very high	111 Å²	111	49.1 Å²	49.1	42%	0.419	24%	0.241	S	C	.	.	H	α-helix	trans	-67.4	-38.6	-178	-65.6	-176.5	172.9	-158.6	-7.1	112.5	Y109 L117 D196 Y198	Y109-R113 HydrophobicContact CD1-CG 4.45Å; Y109-R113 HydrophobicContact CD2-CB 4.15Å; Y109-R113 HydrophobicContact CD2-CG 4.19Å; Y109-R113 HydrophobicContact CE1-CG 4.04Å; Y109-R113 HydrophobicContact CE2-CB 3.69Å; Y109-R113 HydrophobicContact CE2-CG 3.75Å; Y109-R113 WeakPolarHBondContact O-CG 3.35Å; R113-L117 WeakPolarHBondContact O-CB 3.47Å; R113-L117 WeakPolarHBondContact O-CG 3.4Å; R113-L117 PolarHBondContact O-N 3.14Å; R113-D196 IonicContact CZ-OD2 3.76Å; R113-D196 IonicContact NE-OD2 3.03Å; R113-D196 IonicContact NH1-OD2 3.76Å; R113-D196 PolarHBondContact NH1-OD2 3.12Å; R113-D196 VanDerWaalsContact NH1-OD2 3.1Å; R113-D196 IonicContact NH2-OD2 2.76Å; R113-D196 PolarHBondContact NH2-OD2 3.09Å; R113-Y198 HydrophobicContact CB-CD1 4.19Å; R113-Y198 HydrophobicContact CB-CE1 3.94Å
114	D	93	Very high	95.4	Very high	37 Å²	37	46.2 Å²	46.2	20%	0.198	23%	0.225	C	C	.	.	H	α-helix	trans	-67.9	-42.6	-177	-73.9	22.8	0	0	0	110.4	D112 L118 I136 F139 R140 Y198	D112-D114 WeakPolarHBondContact OD1-CB 3.41Å; D112-D114 PolarHBondContact OD1-N 3.23Å; D114-L118 VanDerWaalsContact O-CB 3.28Å; D114-L118 WeakPolarHBondContact O-CB 3.28Å; D114-L118 PolarHBondContact O-N 3.14Å; D114-I136 HydrophobicContact CB-CD1 4.03Å; D114-F139 HydrophobicContact CB-CE1 4.2Å; D114-R140 IonicContact OD2-CZ 2.66Å; D114-R140 IonicContact OD2-NE 3.32Å; D114-R140 PolarHBondContact OD2-NE 2.91Å; D114-R140 IonicContact OD2-NH2 2.67Å; D114-R140 PolarHBondContact OD2-NH2 2.94Å; D114-Y198 PolarHBondContact OD1-OH 3.28Å
115	I	93.3	Very high	95.4	Very high	82 Å²	82	41 Å²	41	42%	0.421	20%	0.197	S	C	.	.	H	α-helix	trans	-68.6	-47.8	-179.7	-62.4	176.1	0	0	0	110.3	D112 L117 L118 D119	D112-I115 HydrophobicContact CB-CB 4.17Å; D112-I115 HydrophobicContact CB-CD1 4.02Å; D112-I115 HydrophobicContact CB-CG1 4.18Å; D112-I115 PolarHBondContact OD1-N 3.12Å; D112-I115 VanDerWaalsContact OD1-N 3.1Å; D112-I115 WeakPolarHBondContact OD2-CD1 3.31Å; I115-L117 VanDerWaalsContact C-N 3.35Å; I115-L117 PolarHBondContact O-N 3.13Å; I115-L118 WeakPolarHBondContact O-CB 3.47Å; I115-L118 PolarHBondContact O-N 3.23Å; I115-L118 VanDerWaalsContact O-N 3.15Å; I115-D119 PolarHBondContact O-N 3.11Å
116	A	94.2	Very high	95.3	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-64.9	-36.4	179.8	0	0	0	0	0	112.8	W105 Y109 D112 L120	W105-A116 HydrophobicContact CZ2-CB 4.15Å; W105-A116 WeakPolarHBondContact CZ2-O 3.27Å; W105-A116 PolarHBondContact NE1-O 3.23Å; Y109-A116 VanDerWaalsContact CA-CB 3.48Å; Y109-A116 HydrophobicContact CD2-CB 4.06Å; Y109-A116 HydrophobicContact CG-CB 4.45Å; D112-A116 WeakPolarHBondContact O-CB 3.38Å; D112-A116 PolarHBondContact O-N 2.85Å; A116-L120 PolarHBondContact O-N 3.12Å; A116-L120 VanDerWaalsContact O-N 3.14Å
117	L	94.8	Very high	95.4	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-68.6	-39.1	171.4	-74.7	172.9	0	0	0	112	W105 Y109 R113 I115 D119 L120 I121 F139 Y198 M199 T202	W105-L117 HydrophobicContact CH2-CD2 4.5Å; W105-L117 HydrophobicContact CZ2-CD2 4.36Å; Y109-L117 HydrophobicContact CD2-CG 4.27Å; Y109-L117 HydrophobicContact CE2-CD1 4Å; Y109-L117 HydrophobicContact CE2-CD2 4.3Å; Y109-L117 HydrophobicContact CE2-CG 3.85Å; R113-L117 WeakPolarHBondContact O-CB 3.47Å; R113-L117 WeakPolarHBondContact O-CG 3.4Å; R113-L117 PolarHBondContact O-N 3.14Å; I115-L117 VanDerWaalsContact C-N 3.35Å; I115-L117 PolarHBondContact O-N 3.13Å; L117-D119 VanDerWaalsContact C-N 3.27Å; L117-D119 PolarHBondContact O-N 3.24Å; L117-L120 HydrophobicContact CD2-CD2 4.43Å; L117-L120 PolarHBondContact O-N 3.37Å; L117-L120 VanDerWaalsContact O-N 3.09Å; L117-I121 WeakPolarHBondContact O-CB 3.46Å; L117-I121 WeakPolarHBondContact O-CG1 3.21Å; L117-I121 PolarHBondContact O-N 3.42Å; L117-F139 HydrophobicContact CB-CZ 4.23Å; L117-F139 HydrophobicContact CD1-CZ 4.44Å; L117-Y198 HydrophobicContact CD1-CD1 3.67Å; L117-Y198 HydrophobicContact CD1-CE1 3.37Å; L117-M199 HydrophobicContact CD2-CG 4.09Å; L117-T202 HydrophobicContact CD1-CG2 4.24Å; L117-T202 HydrophobicContact CD2-CG2 4.49Å
118	L	94.8	Very high	95.4	Very high	21 Å²	21	36.7 Å²	36.7	11%	0.11	18%	0.178	C	C	.	.	H	α-helix	trans	-58.8	-39.4	175.1	-173.4	67.9	0	0	0	112	D114 I115 N122 V134 I136 F139	D114-L118 VanDerWaalsContact O-CB 3.28Å; D114-L118 WeakPolarHBondContact O-CB 3.28Å; D114-L118 PolarHBondContact O-N 3.14Å; I115-L118 WeakPolarHBondContact O-CB 3.47Å; I115-L118 PolarHBondContact O-N 3.23Å; I115-L118 VanDerWaalsContact O-N 3.15Å; L118-N122 WeakPolarHBondContact O-CB 3.32Å; L118-N122 PolarHBondContact O-N 3.29Å; L118-N122 PolarHBondContact O-ND2 2.7Å; L118-V134 HydrophobicContact CD1-CB 4.21Å; L118-V134 HydrophobicContact CD1-CG1 3.86Å; L118-V134 WeakPolarHBondContact CD1-O 3.48Å; L118-I136 HydrophobicContact CD2-CB 3.89Å; L118-I136 HydrophobicContact CD2-CD1 4.28Å; L118-F139 HydrophobicContact CD1-CB 3.87Å; L118-F139 HydrophobicContact CD1-CG 4.43Å
119	D	94.8	Very high	95.3	Very high	78 Å²	78	36 Å²	36	42%	0.417	18%	0.177	S	C	.	.	H	α-helix	trans	-66.4	-38.8	174.2	-72.5	-20.1	0	0	0	112.1	I115 L117 F123	I115-D119 PolarHBondContact O-N 3.11Å; L117-D119 VanDerWaalsContact C-N 3.27Å; L117-D119 PolarHBondContact O-N 3.24Å; D119-F123 WeakPolarHBondContact O-CB 3.48Å; D119-F123 PolarHBondContact O-N 3.12Å
120	L	95.9	Very high	95.2	Very high	1 Å²	1	36 Å²	36	1%	0.005	18%	0.177	C	C	.	.	H	α-helix	trans	-70.6	-35.7	177.1	-174.6	60.9	0	0	0	112.6	W105 A116 L117 F123 F124 F181 L185 M199 V203	W105-L120 HydrophobicContact CH2-CD2 4.06Å; W105-L120 HydrophobicContact CZ2-CB 3.98Å; W105-L120 HydrophobicContact CZ2-CD2 3.7Å; W105-L120 HydrophobicContact CZ2-CG 4.41Å; A116-L120 PolarHBondContact O-N 3.12Å; A116-L120 VanDerWaalsContact O-N 3.14Å; L117-L120 HydrophobicContact CD2-CD2 4.43Å; L117-L120 PolarHBondContact O-N 3.37Å; L117-L120 VanDerWaalsContact O-N 3.09Å; L120-F123 HydrophobicContact CD1-CD1 4.1Å; L120-F123 WeakPolarHBondContact O-CB 3.41Å; L120-F123 PolarHBondContact O-N 3.02Å; L120-F124 HydrophobicContact CD1-CE2 3.88Å; L120-F124 HydrophobicContact CD1-CZ 4.22Å; L120-F124 HydrophobicContact CD2-CE2 4.5Å; L120-F124 HydrophobicContact CG-CD2 4.41Å; L120-F124 HydrophobicContact CG-CE2 3.86Å; L120-F124 WeakPolarHBondContact O-CD2 3.42Å; L120-F124 PolarHBondContact O-N 3.03Å; L120-F181 HydrophobicContact CD1-CE1 3.84Å; L120-F181 HydrophobicContact CD1-CZ 4.3Å; L120-L185 HydrophobicContact CD1-CD2 4.24Å; L120-L185 HydrophobicContact CD2-CD2 4.16Å; L120-M199 HydrophobicContact CD2-CE 4.15Å; L120-V203 HydrophobicContact CD2-CG2 3.66Å; L120-V203 HydrophobicContact CG-CG2 4.48Å
121	I	95.4	Very high	95.1	Very high	5 Å²	5	35.7 Å²	35.7	3%	0.026	17%	0.172	C	C	.	.	H	α-helix	trans	-63	-51.8	172.1	-70.6	171.9	0	0	0	109.7	L117 F123 F124 I125 V134 F139 T202 L206	L117-I121 WeakPolarHBondContact O-CB 3.46Å; L117-I121 WeakPolarHBondContact O-CG1 3.21Å; L117-I121 PolarHBondContact O-N 3.42Å; I121-F123 VanDerWaalsContact C-N 3.27Å; I121-F123 PolarHBondContact O-N 3.04Å; I121-F124 PolarHBondContact O-N 3.02Å; I121-I125 WeakPolarHBondContact O-CG1 3.26Å; I121-I125 PolarHBondContact O-N 3.2Å; I121-I125 VanDerWaalsContact O-N 3.14Å; I121-V134 HydrophobicContact CG2-CB 4.19Å; I121-V134 HydrophobicContact CG2-CG1 4.29Å; I121-V134 HydrophobicContact CG2-CG2 3.94Å; I121-F139 HydrophobicContact CD1-CD2 3.44Å; I121-F139 VanDerWaalsContact CD1-CD2 3.44Å; I121-F139 HydrophobicContact CD1-CE2 3.43Å; I121-F139 VanDerWaalsContact CD1-CE2 3.43Å; I121-F139 HydrophobicContact CD1-CG 4.36Å; I121-F139 HydrophobicContact CD1-CZ 4.34Å; I121-T202 HydrophobicContact CD1-CG2 4.13Å; I121-L206 HydrophobicContact CB-CD2 3.98Å; I121-L206 HydrophobicContact CG1-CD2 3.75Å; I121-L206 HydrophobicContact CG2-CD2 3.76Å
122	N	95.5	Very high	94.8	Very high	13 Å²	13	28.9 Å²	28.9	7%	0.07	14%	0.142	C	C	.	.	H	α-helix	trans	-62.3	-33.9	177.4	-80.7	-61.9	0	0	0	112.3	L118 I125 Q126 T133 V134	L118-N122 WeakPolarHBondContact O-CB 3.32Å; L118-N122 PolarHBondContact O-N 3.29Å; L118-N122 PolarHBondContact O-ND2 2.7Å; N122-I125 PolarHBondContact O-N 3.03Å; N122-Q126 WeakPolarHBondContact O-CB 3.26Å; N122-Q126 VanDerWaalsContact O-CG 3.27Å; N122-Q126 WeakPolarHBondContact O-CG 3.29Å; N122-Q126 PolarHBondContact O-N 3.42Å; N122-T133 WeakPolarHBondContact OD1-CA 3.47Å; N122-V134 PolarHBondContact ND2-O 2.67Å; N122-V134 PolarHBondContact OD1-N 2.74Å
123	F	97.4	Very high	94.7	Very high	2 Å²	2	29 Å²	29	1%	0.009	15%	0.146	C	C	.	.	H	α-helix	trans	-58.2	-48.3	172.3	169.3	-104.9	0	0	0	112.5	L87 F88 V91 D119 L120 I121 I125 Q126 C127 F178 F181	L87-F123 HydrophobicContact CB-CB 4.3Å; L87-F123 HydrophobicContact CB-CD2 4.09Å; L87-F123 HydrophobicContact CD2-CB 3.9Å; L87-F123 HydrophobicContact CD2-CD2 4.11Å; L87-F123 HydrophobicContact CD2-CG 3.93Å; L87-F123 HydrophobicContact CG-CB 4.21Å; L87-F123 HydrophobicContact CG-CD2 3.66Å; L87-F123 HydrophobicContact CG-CE2 4.19Å; L87-F123 HydrophobicContact CG-CG 4.02Å; F88-F123 HydrophobicContact CB-CD2 4.25Å; V91-F123 HydrophobicContact CB-CE2 3.93Å; V91-F123 HydrophobicContact CB-CZ 4.46Å; V91-F123 HydrophobicContact CG1-CE2 4.19Å; V91-F123 HydrophobicContact CG1-CZ 4.31Å; V91-F123 HydrophobicContact CG2-CE2 3.74Å; V91-F123 HydrophobicContact CG2-CZ 4.13Å; D119-F123 WeakPolarHBondContact O-CB 3.48Å; D119-F123 PolarHBondContact O-N 3.12Å; L120-F123 HydrophobicContact CD1-CD1 4.1Å; L120-F123 WeakPolarHBondContact O-CB 3.41Å; L120-F123 PolarHBondContact O-N 3.02Å; I121-F123 VanDerWaalsContact C-N 3.27Å; I121-F123 PolarHBondContact O-N 3.04Å; F123-I125 PolarHBondContact O-N 3.18Å; F123-Q126 PolarHBondContact O-N 3.28Å; F123-C127 WeakPolarHBondContact CE2-SG 3.4Å; F123-C127 VanDerWaalsContact O-CB 3.26Å; F123-C127 WeakPolarHBondContact O-CB 3.45Å; F123-C127 PolarHBondContact O-N 2.97Å; F123-C127 PolarHBondContact O-SG 2.93Å; F123-F178 AromaticContact CE1-CD2 3.96Å; F123-F178 HydrophobicContact CE1-CD2 3.96Å; F123-F178 AromaticContact CE1-CE2 3.84Å; F123-F178 HydrophobicContact CE1-CE2 3.84Å; F123-F178 AromaticContact CZ-CD2 3.66Å; F123-F178 HydrophobicContact CZ-CD2 3.66Å; F123-F178 HydrophobicContact CZ-CE2 4.01Å; F123-F181 HydrophobicContact CD1-CD1 4.36Å; F123-F181 HydrophobicContact CD1-CE1 4.09Å; F123-F181 AromaticContact CE1-CD1 3.48Å; F123-F181 HydrophobicContact CE1-CD1 3.48Å; F123-F181 VanDerWaalsContact CE1-CD1 3.48Å; F123-F181 AromaticContact CE1-CE1 3.65Å; F123-F181 HydrophobicContact CE1-CE1 3.65Å; F123-F181 HydrophobicContact CE1-CG 4.46Å; F123-F181 AromaticContact CZ-CD1 3.63Å; F123-F181 HydrophobicContact CZ-CD1 3.63Å; F123-F181 HydrophobicContact CZ-CE1 4.08Å; F123-F181 HydrophobicContact CZ-CG 4.2Å
124	F	97.6	Very high	94.7	Very high	7 Å²	7	23.9 Å²	23.9	3%	0.031	13%	0.126	C	C	.	.	H	α-helix	trans	-66	-36.6	177.8	-69.6	-58.4	0	0	0	113	L120 I121 S128 F178 I182 V203 L207 A225	L120-F124 HydrophobicContact CD1-CE2 3.88Å; L120-F124 HydrophobicContact CD1-CZ 4.22Å; L120-F124 HydrophobicContact CD2-CE2 4.5Å; L120-F124 HydrophobicContact CG-CD2 4.41Å; L120-F124 HydrophobicContact CG-CE2 3.86Å; L120-F124 WeakPolarHBondContact O-CD2 3.42Å; L120-F124 PolarHBondContact O-N 3.03Å; I121-F124 PolarHBondContact O-N 3.02Å; F124-S128 PolarHBondContact O-N 3.05Å; F124-S128 PolarHBondContact O-OG 2.77Å; F124-F178 HydrophobicContact CD1-CE2 4.07Å; F124-F178 HydrophobicContact CD1-CZ 4.14Å; F124-F178 HydrophobicContact CE1-CE2 4.25Å; F124-F178 HydrophobicContact CE1-CZ 4.32Å; F124-I182 HydrophobicContact CE1-CD1 3.89Å; F124-I182 HydrophobicContact CE1-CG1 4.18Å; F124-I182 HydrophobicContact CZ-CG1 4.46Å; F124-V203 HydrophobicContact CE2-CG1 4.03Å; F124-V203 HydrophobicContact CZ-CG1 4.42Å; F124-L207 HydrophobicContact CD1-CD2 4.1Å; F124-L207 HydrophobicContact CD2-CD2 4.3Å; F124-L207 HydrophobicContact CE1-CD2 4.36Å; F124-L207 HydrophobicContact CG-CD2 4.08Å; F124-L207 HydrophobicContact CZ-CD1 4.47Å; F124-A225 HydrophobicContact CD1-CB 4.06Å; F124-A225 HydrophobicContact CE1-CB 3.74Å
125	I	95.8	Very high	94.7	Very high	0 Å²	0	29 Å²	29	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-63.8	-50.9	174.2	-65.2	-63.6	0	0	0	110.8	I121 N122 F123 C127 S128 C130 V134 M151 L210 F218	I121-I125 WeakPolarHBondContact O-CG1 3.26Å; I121-I125 PolarHBondContact O-N 3.2Å; I121-I125 VanDerWaalsContact O-N 3.14Å; N122-I125 PolarHBondContact O-N 3.03Å; F123-I125 PolarHBondContact O-N 3.18Å; I125-C127 PolarHBondContact O-N 3.41Å; I125-S128 WeakPolarHBondContact O-CA 3.42Å; I125-S128 VanDerWaalsContact O-CB 3.23Å; I125-S128 WeakPolarHBondContact O-CB 3.23Å; I125-S128 PolarHBondContact O-N 2.88Å; I125-C130 HydrophobicContact CG2-CB 3.64Å; I125-C130 WeakPolarHBondContact CG2-SG 3.47Å; I125-V134 HydrophobicContact CG1-CG2 4.34Å; I125-M151 HydrophobicContact CD1-CB 4.31Å; I125-M151 HydrophobicContact CD1-CG 4.21Å; I125-M151 HydrophobicContact CG2-CB 4.49Å; I125-M151 HydrophobicContact CG2-CG 4.33Å; I125-M151 HydrophobicContact CG2-SD 4.05Å; I125-L210 HydrophobicContact CD1-CD1 4.28Å; I125-L210 HydrophobicContact CD1-CD2 3.87Å; I125-F218 HydrophobicContact CD1-CD1 4.3Å; I125-F218 HydrophobicContact CD1-CE1 3.75Å; I125-F218 HydrophobicContact CD1-CZ 4.33Å; I125-F218 HydrophobicContact CG2-CE1 4.24Å
126	Q	95.8	Very high	94.6	Very high	30 Å²	30	27.7 Å²	27.7	14%	0.14	14%	0.136	C	C	.	.	H	α-helix	trans	-67.6	-34.7	179.7	-70	175	6.8	0	0	112.8	T86 F88 N122 F123 S128 G129	T86-Q126 PolarHBondContact OG1-OE1 3.25Å; F88-Q126 HydrophobicContact CB-CB 3.82Å; F88-Q126 HydrophobicContact CD1-CB 4.09Å; F88-Q126 HydrophobicContact CG-CB 3.91Å; N122-Q126 WeakPolarHBondContact O-CB 3.26Å; N122-Q126 VanDerWaalsContact O-CG 3.27Å; N122-Q126 WeakPolarHBondContact O-CG 3.29Å; N122-Q126 PolarHBondContact O-N 3.42Å; F123-Q126 PolarHBondContact O-N 3.28Å; Q126-S128 PolarHBondContact O-N 3Å; Q126-G129 PolarHBondContact O-N 2.88Å
127	C	97.1	Very high	94.5	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-61.3	-23.7	170.6	-72.5	0	0	0	0	112.7	F88 F123 I125 G129 P163 F174 F178 T221	F88-C127 HydrophobicContact CD2-CB 4.47Å; F123-C127 WeakPolarHBondContact CE2-SG 3.4Å; F123-C127 VanDerWaalsContact O-CB 3.26Å; F123-C127 WeakPolarHBondContact O-CB 3.45Å; F123-C127 PolarHBondContact O-N 2.97Å; F123-C127 PolarHBondContact O-SG 2.93Å; I125-C127 PolarHBondContact O-N 3.41Å; C127-G129 VanDerWaalsContact C-N 3.29Å; C127-P163 WeakPolarHBondContact O-CB 3.49Å; C127-P163 WeakPolarHBondContact O-CG 3.32Å; C127-F174 HydrophobicContact CB-CZ 3.96Å; C127-F178 HydrophobicContact CB-CD2 4.05Å; C127-F178 HydrophobicContact CB-CE2 3.57Å; C127-F178 HydrophobicContact CB-CZ 4.22Å; C127-F178 VanDerWaalsContact SG-CD2 3.52Å; C127-F178 WeakPolarHBondContact SG-CE2 3.41Å; C127-T221 HydrophobicContact CB-CG2 3.93Å
128	S	96.7	Very high	94.3	Very high	1 Å²	1	34.7 Å²	34.7	1%	0.007	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-1.7	174.5	-50.2	0	0	0	0	113	F124 I125 Q126 F155 Y162 A217 F218 T221	F124-S128 PolarHBondContact O-N 3.05Å; F124-S128 PolarHBondContact O-OG 2.77Å; I125-S128 WeakPolarHBondContact O-CA 3.42Å; I125-S128 VanDerWaalsContact O-CB 3.23Å; I125-S128 WeakPolarHBondContact O-CB 3.23Å; I125-S128 PolarHBondContact O-N 2.88Å; Q126-S128 PolarHBondContact O-N 3Å; S128-F155 WeakPolarHBondContact O-CZ 3.43Å; S128-Y162 WeakPolarHBondContact O-CB 3.42Å; S128-A217 WeakPolarHBondContact O-CB 3.45Å; S128-F218 VanDerWaalsContact CB-CD1 3.47Å; S128-T221 WeakPolarHBondContact OG-CB 3.49Å
129	G	94.1	Very high	94.1	Very high	25 Å²	25	35.2 Å²	35.2	26%	0.258	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	92.8	-14.1	-179.7	0	0	0	0	0	115.3	Q126 C127 R131	Q126-G129 PolarHBondContact O-N 2.88Å; C127-G129 VanDerWaalsContact C-N 3.29Å; G129-R131 PolarHBondContact O-N 2.84Å
130	C	94.8	Very high	93.9	Very high	3 Å²	3	38.5 Å²	38.5	2%	0.02	18%	0.177	C	C	.	.			trans	-60.7	130.5	176.5	173.3	0	0	0	0	111.5	I125 G132 M151 F155 F218	I125-C130 HydrophobicContact CG2-CB 3.64Å; I125-C130 WeakPolarHBondContact CG2-SG 3.47Å; C130-G132 PolarHBondContact SG-N 2.84Å; C130-M151 PolarHBondContact SG-O 3.3Å; C130-M151 VanDerWaalsContact SG-O 3.41Å; C130-F155 HydrophobicContact CB-CD1 4.46Å; C130-F155 HydrophobicContact CB-CD2 3.65Å; C130-F155 HydrophobicContact CB-CE1 4.48Å; C130-F155 HydrophobicContact CB-CE2 3.67Å; C130-F155 HydrophobicContact CB-CG 4.07Å; C130-F155 HydrophobicContact CB-CZ 4.11Å; C130-F218 HydrophobicContact CB-CE1 3.74Å; C130-F218 HydrophobicContact CB-CZ 3.75Å
131	R	91.3	Very high	93.7	Very high	121 Å²	121	44.7 Å²	44.7	46%	0.457	21%	0.21	S	C	.	.			trans	-88.7	-22	174	-57.3	176.4	179.7	157.7	2.2	112.9	G129 T133 F155 D156 D158	G129-R131 PolarHBondContact O-N 2.84Å; R131-T133 PolarHBondContact O-OG1 3.1Å; R131-F155 PolarHBondContact N-O 3.04Å; R131-D156 HydrophobicContact CB-CB 4.17Å; R131-D156 VanDerWaalsContact CD-O 3.22Å; R131-D156 WeakPolarHBondContact CD-O 3.27Å; R131-D156 WeakPolarHBondContact CD-OD2 3.42Å; R131-D156 HydrophobicContact CG-CB 4.47Å; R131-D156 VanDerWaalsContact CZ-O 3.27Å; R131-D156 IonicContact CZ-OD2 2.66Å; R131-D156 PolarHBondContact NE-O 3.09Å; R131-D156 IonicContact NE-OD2 2.66Å; R131-D156 PolarHBondContact NH1-O 3.07Å; R131-D156 IonicContact NH1-OD2 2.8Å; R131-D156 PolarHBondContact NH1-OD2 3.04Å; R131-D158 IonicContact CZ-OD1 3.65Å; R131-D158 IonicContact CZ-OD2 3.48Å; R131-D158 IonicContact NH1-OD1 3.92Å; R131-D158 PolarHBondContact NH1-OD1 3.5Å; R131-D158 VanDerWaalsContact NH1-OD1 3.14Å; R131-D158 IonicContact NH1-OD2 3.48Å; R131-D158 VanDerWaalsContact NH2-CG 3.27Å; R131-D158 IonicContact NH2-OD1 2.67Å; R131-D158 PolarHBondContact NH2-OD1 3.07Å; R131-D158 IonicContact NH2-OD2 3.14Å; R131-D158 PolarHBondContact NH2-OD2 2.74Å
132	G	90.5	Very high	93.5	Very high	7 Å²	7	47.4 Å²	47.4	7%	0.072	22%	0.224	C	C	.	.			trans	-50.8	143	170	0	0	0	0	0	112.1	C130 E154	C130-G132 PolarHBondContact SG-N 2.84Å; G132-E154 WeakPolarHBondContact CA-O 3.47Å; G132-E154 PolarHBondContact N-O 2.53Å
133	T	92.3	Very high	93.3	Very high	66 Å²	66	54 Å²	54	41%	0.405	25%	0.254	S	S	.	.			trans	-127.8	120.4	-173.6	-64.3	0	0	0	0	110.6	N122 R131 R135	N122-T133 WeakPolarHBondContact OD1-CA 3.47Å; R131-T133 PolarHBondContact O-OG1 3.1Å; T133-R135 PolarHBondContact O-N 3.31Å
134	V	93.8	Very high	93	Very high	2 Å²	2	55.4 Å²	55.4	1%	0.012	26%	0.262	C	S	.	.			trans	-67.1	126.8	175	-174	0	0	0	0	108.7	L118 I121 N122 I125 M138 I147 M151	L118-V134 HydrophobicContact CD1-CB 4.21Å; L118-V134 HydrophobicContact CD1-CG1 3.86Å; L118-V134 WeakPolarHBondContact CD1-O 3.48Å; I121-V134 HydrophobicContact CG2-CB 4.19Å; I121-V134 HydrophobicContact CG2-CG1 4.29Å; I121-V134 HydrophobicContact CG2-CG2 3.94Å; N122-V134 PolarHBondContact ND2-O 2.67Å; N122-V134 PolarHBondContact OD1-N 2.74Å; I125-V134 HydrophobicContact CG1-CG2 4.34Å; V134-M138 HydrophobicContact CG1-CB 4.15Å; V134-M138 HydrophobicContact CG1-CE 4.32Å; V134-I147 HydrophobicContact CG1-CG2 4.02Å; V134-I147 HydrophobicContact CG2-CG2 3.67Å; V134-M151 HydrophobicContact CG2-CG 3.89Å; V134-M151 HydrophobicContact CG2-SD 3.64Å
135	R	93	Very high	92.6	Very high	144 Å²	144	58.6 Å²	58.6	54%	0.543	29%	0.289	S	S	.	.			trans	-98.1	156.7	179.6	-54.8	-176.7	-169.8	179.4	2.2	110.8	T133 E137 M138 F139	T133-R135 PolarHBondContact O-N 3.31Å; R135-E137 PolarHBondContact O-N 2.61Å; R135-E137 VanDerWaalsContact O-N 3.15Å; R135-M138 HydrophobicContact CB-CG 4.36Å; R135-M138 HydrophobicContact CB-SD 4.32Å; R135-M138 HydrophobicContact CG-SD 4.36Å; R135-M138 WeakPolarHBondContact O-CA 3.47Å; R135-M138 WeakPolarHBondContact O-CB 3.44Å; R135-M138 PolarHBondContact O-N 2.82Å; R135-F139 PolarHBondContact O-N 3.21Å
136	I	91.7	Very high	92.5	Very high	55 Å²	55	63.2 Å²	63.2	28%	0.282	31%	0.311	S	S	.	.	H	α-helix	trans	-55.8	-33.5	177.8	-170.3	62	0	0	0	112.9	D114 L118 M138 F139 R140	D114-I136 HydrophobicContact CB-CD1 4.03Å; L118-I136 HydrophobicContact CD2-CB 3.89Å; L118-I136 HydrophobicContact CD2-CD1 4.28Å; I136-M138 VanDerWaalsContact C-N 3.32Å; I136-M138 PolarHBondContact O-N 3.43Å; I136-F139 HydrophobicContact CD1-CD1 4.25Å; I136-R140 HydrophobicContact CD1-CG 4.41Å; I136-R140 WeakPolarHBondContact O-CB 3.33Å; I136-R140 WeakPolarHBondContact O-CG 3Å; I136-R140 PolarHBondContact O-N 3.3Å; I136-R140 VanDerWaalsContact O-N 3.09Å
137	E	91.3	Very high	92.3	Very high	138 Å²	138	61.9 Å²	61.9	65%	0.645	31%	0.305	S	S	*	.	H	α-helix	trans	-66.8	-31.7	174.5	-62.4	177	156.8	0	0	112.8	R135 N141	R135-E137 PolarHBondContact O-N 2.61Å; R135-E137 VanDerWaalsContact O-N 3.15Å; E137-N141 WeakPolarHBondContact O-CB 3.4Å; E137-N141 PolarHBondContact O-N 2.92Å; E137-N141 PolarHBondContact O-ND2 2.97Å
138	M	91.2	Very high	92.1	Very high	10 Å²	10	62.5 Å²	62.5	5%	0.049	31%	0.308	C	S	.	.	H	α-helix	trans	-75.3	-49.8	175.6	-61.8	171.7	47.1	0	0	109.8	V134 R135 I136 R140 N141 M142 I147 K150 M151	V134-M138 HydrophobicContact CG1-CB 4.15Å; V134-M138 HydrophobicContact CG1-CE 4.32Å; R135-M138 HydrophobicContact CB-CG 4.36Å; R135-M138 HydrophobicContact CB-SD 4.32Å; R135-M138 HydrophobicContact CG-SD 4.36Å; R135-M138 WeakPolarHBondContact O-CA 3.47Å; R135-M138 WeakPolarHBondContact O-CB 3.44Å; R135-M138 PolarHBondContact O-N 2.82Å; I136-M138 VanDerWaalsContact C-N 3.32Å; I136-M138 PolarHBondContact O-N 3.43Å; M138-R140 VanDerWaalsContact C-N 3.25Å; M138-R140 PolarHBondContact O-N 3.04Å; M138-N141 PolarHBondContact O-N 3.25Å; M138-N141 VanDerWaalsContact O-N 3.16Å; M138-M142 HydrophobicContact CB-SD 3.82Å; M138-M142 HydrophobicContact CE-SD 4.34Å; M138-M142 HydrophobicContact CG-SD 3.71Å; M138-M142 WeakPolarHBondContact O-CB 3.45Å; M138-M142 PolarHBondContact O-N 3.38Å; M138-I147 HydrophobicContact CE-CG2 4.31Å; M138-K150 HydrophobicContact CE-CB 4.42Å; M138-K150 HydrophobicContact CE-CD 3.72Å; M138-K150 HydrophobicContact CE-CG 4.29Å; M138-K150 HydrophobicContact SD-CD 4.05Å; M138-K150 PolarHBondContact SD-NZ 3.45Å; M138-K150 VanDerWaalsContact SD-NZ 3.42Å; M138-M151 HydrophobicContact CE-CE 4.16Å
139	F	91	Very high	91.9	Very high	31 Å²	31	70.4 Å²	70.4	14%	0.136	34%	0.337	C	S	.	.	H	α-helix	trans	-56.3	-36.7	179	177.4	-119.4	0	0	0	113.3	D114 L117 L118 I121 R135 I136 T202	D114-F139 HydrophobicContact CB-CE1 4.2Å; L117-F139 HydrophobicContact CB-CZ 4.23Å; L117-F139 HydrophobicContact CD1-CZ 4.44Å; L118-F139 HydrophobicContact CD1-CB 3.87Å; L118-F139 HydrophobicContact CD1-CG 4.43Å; I121-F139 HydrophobicContact CD1-CD2 3.44Å; I121-F139 VanDerWaalsContact CD1-CD2 3.44Å; I121-F139 HydrophobicContact CD1-CE2 3.43Å; I121-F139 VanDerWaalsContact CD1-CE2 3.43Å; I121-F139 HydrophobicContact CD1-CG 4.36Å; I121-F139 HydrophobicContact CD1-CZ 4.34Å; R135-F139 PolarHBondContact O-N 3.21Å; I136-F139 HydrophobicContact CD1-CD1 4.25Å; F139-T202 HydrophobicContact CE2-CG2 3.85Å; F139-T202 HydrophobicContact CZ-CG2 4.23Å
140	R	89.7	Confident	91.9	Very high	148 Å²	148	71.6 Å²	71.6	56%	0.558	34%	0.336	S	S	*	.	H	α-helix	trans	-84	-16.2	179.5	-71.7	-179.3	173.2	156.1	0.4	115.7	D114 I136 M138	D114-R140 IonicContact OD2-CZ 2.66Å; D114-R140 IonicContact OD2-NE 3.32Å; D114-R140 PolarHBondContact OD2-NE 2.91Å; D114-R140 IonicContact OD2-NH2 2.67Å; D114-R140 PolarHBondContact OD2-NH2 2.94Å; I136-R140 HydrophobicContact CD1-CG 4.41Å; I136-R140 WeakPolarHBondContact O-CB 3.33Å; I136-R140 WeakPolarHBondContact O-CG 3Å; I136-R140 PolarHBondContact O-N 3.3Å; I136-R140 VanDerWaalsContact O-N 3.09Å; M138-R140 VanDerWaalsContact C-N 3.25Å; M138-R140 PolarHBondContact O-N 3.04Å
141	N	91.7	Very high	91.9	Very high	131 Å²	131	71.5 Å²	71.5	70%	0.701	34%	0.335	S	S	*	.	H	α-helix	trans	-132.1	-8.2	-170.2	-57.4	-79.7	0	0	0	115.4	E137 M138	E137-N141 WeakPolarHBondContact O-CB 3.4Å; E137-N141 PolarHBondContact O-N 2.92Å; E137-N141 PolarHBondContact O-ND2 2.97Å; M138-N141 PolarHBondContact O-N 3.25Å; M138-N141 VanDerWaalsContact O-N 3.16Å
142	M	91.5	Very high	91.9	Very high	61 Å²	61	68.4 Å²	68.4	30%	0.3	33%	0.33	S	S	.	.	S	Bend	trans	-118.9	146.6	-178.1	-61.6	178.9	65.8	0	0	110.8	M138 E146 I147	M138-M142 HydrophobicContact CB-SD 3.82Å; M138-M142 HydrophobicContact CE-SD 4.34Å; M138-M142 HydrophobicContact CG-SD 3.71Å; M138-M142 WeakPolarHBondContact O-CB 3.45Å; M138-M142 PolarHBondContact O-N 3.38Å; M142-E146 WeakPolarHBondContact CA-OE2 3.32Å; M142-E146 HydrophobicContact CB-CB 4.3Å; M142-E146 HydrophobicContact CE-CB 3.63Å; M142-I147 HydrophobicContact CB-CD1 4.32Å; M142-I147 HydrophobicContact CB-CG1 3.79Å
143	Q	91.6	Very high	91.9	Very high	151 Å²	151	74 Å²	74	71%	0.706	35%	0.354	S	S	*	.			trans	-78.5	155.9	172.8	-65.4	-169.2	-12.2	0	0	111.5	A145 E146 I147	Q143-A145 PolarHBondContact O-N 3.37Å; Q143-A145 VanDerWaalsContact O-N 3.12Å; Q143-E146 HydrophobicContact CB-CG 4.4Å; Q143-E146 PolarHBondContact N-OE2 2.95Å; Q143-E146 WeakPolarHBondContact O-CA 3.31Å; Q143-E146 WeakPolarHBondContact O-CB 3.46Å; Q143-E146 PolarHBondContact O-N 3.5Å; Q143-I147 PolarHBondContact O-N 3.04Å
144	N	90.5	Very high	91.9	Very high	33 Å²	33	74 Å²	74	18%	0.176	35%	0.349	C	S	.	.	H	α-helix	trans	-51.6	-39.2	179.9	-81.1	-28.2	0	0	0	113.1	E146 I147 I148 S205 L206	N144-E146 VanDerWaalsContact C-N 3.34Å; N144-E146 PolarHBondContact O-N 3.43Å; N144-I147 PolarHBondContact O-N 3.1Å; N144-I148 WeakPolarHBondContact O-CB 3.28Å; N144-I148 WeakPolarHBondContact O-CD1 3.42Å; N144-I148 WeakPolarHBondContact O-CG1 3.14Å; N144-I148 PolarHBondContact O-N 3.33Å; N144-S205 PolarHBondContact ND2-OG 3.5Å; N144-L206 PolarHBondContact ND2-N 3.21Å
145	A	89.6	Confident	91.7	Very high	73 Å²	73	74.6 Å²	74.6	60%	0.603	35%	0.352	S	S	*	.	H	α-helix	trans	-61.4	-38.6	175.7	0	0	0	0	0	113.3	Q143 R149	Q143-A145 PolarHBondContact O-N 3.37Å; Q143-A145 VanDerWaalsContact O-N 3.12Å; A145-R149 WeakPolarHBondContact O-CB 3.47Å; A145-R149 PolarHBondContact O-N 2.61Å
146	E	92.5	Very high	91.3	Very high	98 Å²	98	72.7 Å²	72.7	46%	0.458	35%	0.352	S	S	.	.	H	α-helix	trans	-74	-39.2	178.2	-54	177	128.8	0	0	111.3	M142 Q143 N144 R149 K150	M142-E146 WeakPolarHBondContact CA-OE2 3.32Å; M142-E146 HydrophobicContact CB-CB 4.3Å; M142-E146 HydrophobicContact CE-CB 3.63Å; Q143-E146 HydrophobicContact CB-CG 4.4Å; Q143-E146 PolarHBondContact N-OE2 2.95Å; Q143-E146 WeakPolarHBondContact O-CA 3.31Å; Q143-E146 WeakPolarHBondContact O-CB 3.46Å; Q143-E146 PolarHBondContact O-N 3.5Å; N144-E146 VanDerWaalsContact C-N 3.34Å; N144-E146 PolarHBondContact O-N 3.43Å; E146-R149 PolarHBondContact O-N 2.98Å; E146-K150 WeakPolarHBondContact O-CB 3.47Å; E146-K150 PolarHBondContact O-N 3.36Å
147	I	92.2	Very high	91	Very high	2 Å²	2	75.7 Å²	75.7	1%	0.01	37%	0.365	C	S	.	.	H	α-helix	trans	-61.1	-48.1	173.7	-64.5	173	0	0	0	109.9	V134 M138 M142 Q143 N144 K150 M151	V134-I147 HydrophobicContact CG1-CG2 4.02Å; V134-I147 HydrophobicContact CG2-CG2 3.67Å; M138-I147 HydrophobicContact CE-CG2 4.31Å; M142-I147 HydrophobicContact CB-CD1 4.32Å; M142-I147 HydrophobicContact CB-CG1 3.79Å; Q143-I147 PolarHBondContact O-N 3.04Å; N144-I147 PolarHBondContact O-N 3.1Å; I147-K150 CarbonylContact O-C 3.51Å; I147-K150 PolarHBondContact O-N 2.87Å; I147-M151 HydrophobicContact CG2-CG 4.29Å; I147-M151 VanDerWaalsContact O-CG 3.3Å; I147-M151 WeakPolarHBondContact O-CG 3.12Å; I147-M151 PolarHBondContact O-N 2.98Å
148	I	93.7	Very high	90.5	Very high	12 Å²	12	75.7 Å²	75.7	6%	0.062	37%	0.369	C	S	.	.	H	α-helix	trans	-65	-40.9	179.9	-66.7	163.1	0	0	0	111.4	N144 K150 M151 T152 L206 L210	N144-I148 WeakPolarHBondContact O-CB 3.28Å; N144-I148 WeakPolarHBondContact O-CD1 3.42Å; N144-I148 WeakPolarHBondContact O-CG1 3.14Å; N144-I148 PolarHBondContact O-N 3.33Å; I148-K150 VanDerWaalsContact C-N 3.33Å; I148-K150 PolarHBondContact O-N 3.05Å; I148-M151 PolarHBondContact O-N 2.36Å; I148-T152 WeakPolarHBondContact O-CB 3.49Å; I148-T152 PolarHBondContact O-N 3.24Å; I148-T152 PolarHBondContact O-OG1 2.9Å; I148-L206 HydrophobicContact CD1-CD1 4.32Å; I148-L206 HydrophobicContact CG1-CD1 4.31Å; I148-L210 HydrophobicContact CD1-CD2 4.07Å; I148-L210 HydrophobicContact CD1-CG 3.98Å; I148-L210 HydrophobicContact CG1-CD2 3.74Å; I148-L210 HydrophobicContact CG1-CG 4.13Å; I148-L210 HydrophobicContact CG2-CD2 4.19Å
149	R	92.4	Very high	90.3	Very high	167 Å²	167	78 Å²	78	63%	0.63	39%	0.387	S	S	*	.	H	α-helix	trans	-60.8	-44.7	173.6	-152.4	-164.9	87.6	-161.5	2.5	110.7	A145 E146 T152 E153	A145-R149 WeakPolarHBondContact O-CB 3.47Å; A145-R149 PolarHBondContact O-N 2.61Å; E146-R149 PolarHBondContact O-N 2.98Å; R149-T152 WeakPolarHBondContact O-CA 3.34Å; R149-T152 VanDerWaalsContact O-CB 3.3Å; R149-T152 WeakPolarHBondContact O-CB 3.31Å; R149-T152 PolarHBondContact O-N 3.23Å; R149-T152 VanDerWaalsContact O-N 3.08Å; R149-E153 IonicContact CZ-OE1 2.67Å; R149-E153 IonicContact NE-OE1 2.69Å; R149-E153 PolarHBondContact NE-OE1 2.92Å; R149-E153 IonicContact NH2-OE1 3.99Å; R149-E153 PolarHBondContact NH2-OE1 3.22Å; R149-E153 IonicContact NH2-OE2 2.75Å; R149-E153 PolarHBondContact O-N 3.44Å
150	K	93.2	Very high	90	Very high	51 Å²	51	79.5 Å²	79.5	22%	0.222	41%	0.411	C	S	.	.	H	α-helix	trans	-67.4	-36.4	177.8	-174.6	173.8	170.1	-162.6	0	113.2	M138 E146 I147 I148 T152 E153 E154	M138-K150 HydrophobicContact CE-CB 4.42Å; M138-K150 HydrophobicContact CE-CD 3.72Å; M138-K150 HydrophobicContact CE-CG 4.29Å; M138-K150 HydrophobicContact SD-CD 4.05Å; M138-K150 PolarHBondContact SD-NZ 3.45Å; M138-K150 VanDerWaalsContact SD-NZ 3.42Å; E146-K150 WeakPolarHBondContact O-CB 3.47Å; E146-K150 PolarHBondContact O-N 3.36Å; I147-K150 CarbonylContact O-C 3.51Å; I147-K150 PolarHBondContact O-N 2.87Å; I148-K150 VanDerWaalsContact C-N 3.33Å; I148-K150 PolarHBondContact O-N 3.05Å; K150-T152 PolarHBondContact O-N 3.02Å; K150-E153 PolarHBondContact O-N 3.46Å; K150-E154 WeakPolarHBondContact CE-OE1 3.23Å; K150-E154 HydrophobicContact CG-CG 4.42Å; K150-E154 IonicContact NZ-OE1 2.63Å; K150-E154 PolarHBondContact NZ-OE1 2.84Å; K150-E154 WeakPolarHBondContact O-CB 3.45Å; K150-E154 PolarHBondContact O-N 3.01Å
151	M	95	Very high	90.1	Very high	0 Å²	0	76.7 Å²	76.7	0%	0	41%	0.407	C	S	.	.	H	α-helix	trans	-72.9	-12.1	172.1	-63.2	-69.3	88.2	0	0	113	I125 C130 V134 M138 I147 I148 E154 F155 F218	I125-M151 HydrophobicContact CD1-CB 4.31Å; I125-M151 HydrophobicContact CD1-CG 4.21Å; I125-M151 HydrophobicContact CG2-CB 4.49Å; I125-M151 HydrophobicContact CG2-CG 4.33Å; I125-M151 HydrophobicContact CG2-SD 4.05Å; C130-M151 PolarHBondContact SG-O 3.3Å; C130-M151 VanDerWaalsContact SG-O 3.41Å; V134-M151 HydrophobicContact CG2-CG 3.89Å; V134-M151 HydrophobicContact CG2-SD 3.64Å; M138-M151 HydrophobicContact CE-CE 4.16Å; I147-M151 HydrophobicContact CG2-CG 4.29Å; I147-M151 VanDerWaalsContact O-CG 3.3Å; I147-M151 WeakPolarHBondContact O-CG 3.12Å; I147-M151 PolarHBondContact O-N 2.98Å; I148-M151 PolarHBondContact O-N 2.36Å; M151-E154 HydrophobicContact CE-CB 4.14Å; M151-E154 WeakPolarHBondContact CE-OE2 3.44Å; M151-F155 PolarHBondContact O-N 3.33Å; M151-F218 HydrophobicContact CB-CE2 4.48Å; M151-F218 HydrophobicContact CB-CZ 3.92Å; M151-F218 WeakPolarHBondContact O-CZ 3.46Å
152	T	91.3	Very high	90.2	Very high	57 Å²	57	70.8 Å²	70.8	35%	0.35	38%	0.375	S	S	.	.	H	α-helix	trans	-84.9	-36.7	167.3	-53.4	0	0	0	0	110.9	I148 R149 K150 V215	I148-T152 WeakPolarHBondContact O-CB 3.49Å; I148-T152 PolarHBondContact O-N 3.24Å; I148-T152 PolarHBondContact O-OG1 2.9Å; R149-T152 WeakPolarHBondContact O-CA 3.34Å; R149-T152 VanDerWaalsContact O-CB 3.3Å; R149-T152 WeakPolarHBondContact O-CB 3.31Å; R149-T152 PolarHBondContact O-N 3.23Å; R149-T152 VanDerWaalsContact O-N 3.08Å; K150-T152 PolarHBondContact O-N 3.02Å; T152-V215 HydrophobicContact CG2-CG2 3.55Å
153	E	90.4	Very high	90.4	Very high	124 Å²	124	68.1 Å²	68.1	58%	0.579	36%	0.362	S	S	*	.	H	α-helix	trans	-68	-35.1	171.2	-67.9	166.8	-155.1	0	0	112.8	R149 K150	R149-E153 IonicContact CZ-OE1 2.67Å; R149-E153 IonicContact NE-OE1 2.69Å; R149-E153 PolarHBondContact NE-OE1 2.92Å; R149-E153 IonicContact NH2-OE1 3.99Å; R149-E153 PolarHBondContact NH2-OE1 3.22Å; R149-E153 IonicContact NH2-OE2 2.75Å; R149-E153 PolarHBondContact O-N 3.44Å; K150-E153 PolarHBondContact O-N 3.46Å
154	E	91.8	Very high	90.6	Very high	67 Å²	67	61.7 Å²	61.7	31%	0.313	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.1	24	178.8	-62.5	-177.2	171.9	0	0	113.1	G132 K150 M151 D156	G132-E154 WeakPolarHBondContact CA-O 3.47Å; G132-E154 PolarHBondContact N-O 2.53Å; K150-E154 WeakPolarHBondContact CE-OE1 3.23Å; K150-E154 HydrophobicContact CG-CG 4.42Å; K150-E154 IonicContact NZ-OE1 2.63Å; K150-E154 PolarHBondContact NZ-OE1 2.84Å; K150-E154 WeakPolarHBondContact O-CB 3.45Å; K150-E154 PolarHBondContact O-N 3.01Å; M151-E154 HydrophobicContact CE-CB 4.14Å; M151-E154 WeakPolarHBondContact CE-OE2 3.44Å; E154-D156 PolarHBondContact O-N 3.04Å
155	F	90.4	Very high	90.8	Very high	14 Å²	14	62.1 Å²	62.1	6%	0.061	34%	0.336	C	S	.	.			trans	-65.6	-40.8	-173.9	-160.6	-77.7	0	0	0	113.3	S128 C130 R131 M151 E157 V215 A217 F218	S128-F155 WeakPolarHBondContact O-CZ 3.43Å; C130-F155 HydrophobicContact CB-CD1 4.46Å; C130-F155 HydrophobicContact CB-CD2 3.65Å; C130-F155 HydrophobicContact CB-CE1 4.48Å; C130-F155 HydrophobicContact CB-CE2 3.67Å; C130-F155 HydrophobicContact CB-CG 4.07Å; C130-F155 HydrophobicContact CB-CZ 4.11Å; R131-F155 PolarHBondContact N-O 3.04Å; M151-F155 PolarHBondContact O-N 3.33Å; F155-E157 HydrophobicContact CD1-CB 3.83Å; F155-E157 HydrophobicContact CD1-CG 4.04Å; F155-E157 WeakPolarHBondContact CD1-OE2 3.38Å; F155-E157 HydrophobicContact CE1-CB 4.1Å; F155-E157 WeakPolarHBondContact CE1-OE2 3.39Å; F155-V215 HydrophobicContact CE2-CG1 4.13Å; F155-A217 HydrophobicContact CE2-CB 4.24Å; F155-A217 HydrophobicContact CZ-CB 3.79Å; F155-F218 HydrophobicContact CD2-CD2 4.45Å; F155-F218 HydrophobicContact CD2-CE1 4.25Å; F155-F218 AromaticContact CD2-CE2 3.62Å; F155-F218 HydrophobicContact CD2-CE2 3.62Å; F155-F218 AromaticContact CD2-CZ 3.48Å; F155-F218 HydrophobicContact CD2-CZ 3.48Å; F155-F218 VanDerWaalsContact CD2-CZ 3.48Å; F155-F218 HydrophobicContact CE2-CD1 4.35Å; F155-F218 HydrophobicContact CE2-CD2 4.24Å; F155-F218 AromaticContact CE2-CE1 3.88Å; F155-F218 HydrophobicContact CE2-CE1 3.88Å; F155-F218 AromaticContact CE2-CE2 3.77Å; F155-F218 HydrophobicContact CE2-CE2 3.77Å; F155-F218 HydrophobicContact CE2-CG 4.49Å; F155-F218 AromaticContact CE2-CZ 3.56Å; F155-F218 HydrophobicContact CE2-CZ 3.56Å
156	D	85.3	Confident	91	Very high	104 Å²	104	61.4 Å²	61.4	56%	0.556	32%	0.321	S	S	*	.			trans	54	63.6	177.8	-165.7	65.9	0	0	0	114	R131 E154	R131-D156 HydrophobicContact CB-CB 4.17Å; R131-D156 VanDerWaalsContact CD-O 3.22Å; R131-D156 WeakPolarHBondContact CD-O 3.27Å; R131-D156 WeakPolarHBondContact CD-OD2 3.42Å; R131-D156 HydrophobicContact CG-CB 4.47Å; R131-D156 VanDerWaalsContact CZ-O 3.27Å; R131-D156 IonicContact CZ-OD2 2.66Å; R131-D156 PolarHBondContact NE-O 3.09Å; R131-D156 IonicContact NE-OD2 2.66Å; R131-D156 PolarHBondContact NH1-O 3.07Å; R131-D156 IonicContact NH1-OD2 2.8Å; R131-D156 PolarHBondContact NH1-OD2 3.04Å; E154-D156 PolarHBondContact O-N 3.04Å
157	E	84.7	Confident	90.9	Very high	118 Å²	118	62.3 Å²	62.3	55%	0.551	34%	0.335	S	S	*	.			trans	-94	132.2	179.4	48.4	-177.4	-130.7	0	0	113.5	F155	F155-E157 HydrophobicContact CD1-CB 3.83Å; F155-E157 HydrophobicContact CD1-CG 4.04Å; F155-E157 WeakPolarHBondContact CD1-OE2 3.38Å; F155-E157 HydrophobicContact CE1-CB 4.1Å; F155-E157 WeakPolarHBondContact CE1-OE2 3.39Å
158	D	79.8	Confident	90.9	Very high	137 Å²	137	63.6 Å²	63.6	73%	0.733	35%	0.35	S	S	*	.	S	Bend	trans	-85	-22.3	171.8	-54.6	-32.8	0	0	0	112.3	R131	R131-D158 IonicContact CZ-OD1 3.65Å; R131-D158 IonicContact CZ-OD2 3.48Å; R131-D158 IonicContact NH1-OD1 3.92Å; R131-D158 PolarHBondContact NH1-OD1 3.5Å; R131-D158 VanDerWaalsContact NH1-OD1 3.14Å; R131-D158 IonicContact NH1-OD2 3.48Å; R131-D158 VanDerWaalsContact NH2-CG 3.27Å; R131-D158 IonicContact NH2-OD1 2.67Å; R131-D158 PolarHBondContact NH2-OD1 3.07Å; R131-D158 IonicContact NH2-OD2 3.14Å; R131-D158 PolarHBondContact NH2-OD2 2.74Å
159	S	87.5	Confident	90.8	Very high	59 Å²	59	68.6 Å²	68.6	41%	0.413	38%	0.383	S	S	.	.	S	Bend	trans	-154.2	167.6	174.7	75.6	0	0	0	0	109.8	D161	S159-D161 PolarHBondContact O-N 3.42Å; S159-D161 WeakPolarHBondContact OG-CB 3.43Å; S159-D161 PolarHBondContact OG-N 2.9Å; S159-D161 PolarHBondContact OG-OD2 3.14Å
160	G	85.7	Confident	90.8	Very high	63 Å²	63	65.3 Å²	65.3	65%	0.649	37%	0.374	S	S	*	.	S	Bend	trans	-70.9	15	174.9	0	0	0	0	0	115.5
161	D	91	Very high	90.9	Very high	88 Å²	88	64.9 Å²	64.9	47%	0.471	37%	0.371	S	S	.	.			trans	-91.5	135.5	180	-64.5	-73.2	0	0	0	112	S159 M166	S159-D161 PolarHBondContact O-N 3.42Å; S159-D161 WeakPolarHBondContact OG-CB 3.43Å; S159-D161 PolarHBondContact OG-N 2.9Å; S159-D161 PolarHBondContact OG-OD2 3.14Å; D161-M166 HydrophobicContact CB-CE 4.32Å; D161-M166 HydrophobicContact CB-CG 4.1Å
162	Y	95.1	Very high	90.8	Very high	8 Å²	8	72.8 Å²	72.8	3%	0.031	41%	0.406	C	S	.	.			trans	-133.1	163.2	178.2	56.9	-79.3	0	0	0	110.7	S128 L164 T165 M166 R216 A217 H220	S128-Y162 WeakPolarHBondContact O-CB 3.42Å; Y162-L164 HydrophobicContact CD2-CB 4.23Å; Y162-L164 HydrophobicContact CE2-CB 4.05Å; Y162-L164 PolarHBondContact O-N 2.66Å; Y162-T165 HydrophobicContact CD1-CG2 4.31Å; Y162-T165 HydrophobicContact CE1-CG2 3.58Å; Y162-T165 HydrophobicContact CE2-CG2 4.07Å; Y162-T165 VanDerWaalsContact CZ-CG2 3.42Å; Y162-T165 PolarHBondContact N-OG1 2.9Å; Y162-T165 PolarHBondContact O-N 3.27Å; Y162-T165 PolarHBondContact O-OG1 3.25Å; Y162-T165 WeakPolarHBondContact OH-CG2 3.34Å; Y162-M166 PolarHBondContact O-N 3.48Å; Y162-R216 HydrophobicContact CE1-CG 4.36Å; Y162-R216 PolarHBondContact OH-NE 2.8Å; Y162-A217 HydrophobicContact CD1-CB 3.69Å; Y162-A217 HydrophobicContact CD2-CB 3.92Å; Y162-A217 HydrophobicContact CE1-CB 4.25Å; Y162-A217 HydrophobicContact CE2-CB 4.44Å; Y162-A217 HydrophobicContact CG-CB 3.54Å; Y162-H220 HydrophobicContact CE2-CB 3.96Å; Y162-H220 AromaticContact CE2-ND1 3.52Å; Y162-H220 AromaticContact CZ-ND1 3.64Å; Y162-H220 PolarHBondContact OH-ND1 3.32Å
163	P	95.5	Very high	90.9	Very high	4 Å²	4	74.4 Å²	74.4	3%	0.026	41%	0.408	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.5	-14.9	-168.1	-35	40.9	0	0	0	118.3	F88 C127 W171 F174	F88-P163 HydrophobicContact CE2-CB 4.5Å; F88-P163 HydrophobicContact CE2-CG 4.16Å; F88-P163 HydrophobicContact CZ-CG 4.1Å; C127-P163 WeakPolarHBondContact O-CB 3.49Å; C127-P163 WeakPolarHBondContact O-CG 3.32Å; P163-W171 HydrophobicContact CB-CE3 3.98Å; P163-W171 HydrophobicContact CB-CH2 4.37Å; P163-W171 HydrophobicContact CB-CZ3 3.59Å; P163-W171 HydrophobicContact CG-CH2 4.32Å; P163-W171 HydrophobicContact CG-CZ3 3.97Å; P163-F174 HydrophobicContact CB-CD1 3.86Å; P163-F174 HydrophobicContact CB-CE1 3.34Å; P163-F174 HydrophobicContact CB-CZ 4.01Å
164	L	95.1	Very high	91.2	Very high	16 Å²	16	68.5 Å²	68.5	8%	0.084	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.1	-19	176.6	-63	-179	0	0	0	114.6	Y162 F174 R175 T221 L224	Y162-L164 HydrophobicContact CD2-CB 4.23Å; Y162-L164 HydrophobicContact CE2-CB 4.05Å; Y162-L164 PolarHBondContact O-N 2.66Å; L164-F174 HydrophobicContact CD2-CE1 4.19Å; L164-R175 HydrophobicContact CD2-CB 4.11Å; L164-R175 HydrophobicContact CD2-CG 3.94Å; L164-T221 HydrophobicContact CD1-CG2 4.2Å; L164-L224 HydrophobicContact CD1-CB 4.44Å; L164-L224 HydrophobicContact CD1-CD2 3.76Å; L164-L224 HydrophobicContact CD2-CD2 3.82Å; L164-L224 HydrophobicContact CG-CD2 4.48Å
165	T	94.1	Very high	91.4	Very high	43 Å²	43	69.3 Å²	69.3	26%	0.264	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.8	-23.2	175.3	55.4	0	0	0	0	113.2	Y162	Y162-T165 HydrophobicContact CD1-CG2 4.31Å; Y162-T165 HydrophobicContact CE1-CG2 3.58Å; Y162-T165 HydrophobicContact CE2-CG2 4.07Å; Y162-T165 VanDerWaalsContact CZ-CG2 3.42Å; Y162-T165 PolarHBondContact N-OG1 2.9Å; Y162-T165 PolarHBondContact O-N 3.27Å; Y162-T165 PolarHBondContact O-OG1 3.25Å; Y162-T165 WeakPolarHBondContact OH-CG2 3.34Å
166	M	93.4	Very high	91.7	Very high	58 Å²	58	72.2 Å²	72.2	29%	0.286	40%	0.403	S	S	.	.			trans	-59.2	129.9	-177.7	-68.7	-171	-155.1	0	0	112.4	D161 Y162 W171	D161-M166 HydrophobicContact CB-CE 4.32Å; D161-M166 HydrophobicContact CB-CG 4.1Å; Y162-M166 PolarHBondContact O-N 3.48Å; M166-W171 HydrophobicContact CB-CB 4.31Å; M166-W171 VanDerWaalsContact CB-CD1 3.41Å; M166-W171 HydrophobicContact CB-CD2 4.01Å; M166-W171 HydrophobicContact CB-CG 3.69Å; M166-W171 HydrophobicContact CE-CH2 4.49Å; M166-W171 HydrophobicContact CE-CZ2 4.26Å; M166-W171 VanDerWaalsContact O-CB 3.24Å; M166-W171 WeakPolarHBondContact O-CB 3.48Å; M166-W171 HydrophobicContact SD-CD2 4.23Å; M166-W171 HydrophobicContact SD-CH2 3.99Å; M166-W171 HydrophobicContact SD-CZ2 3.28Å; M166-W171 WeakPolarHBondContact SD-CZ2 3.45Å
167	P	91.1	Very high	92.2	Very high	116 Å²	116	67.9 Å²	67.9	75%	0.753	38%	0.379	S	S	*	.			trans	-75.7	154.6	-178	29.9	-35.2	0	0	0	112.9
168	G	92	Very high	92.8	Very high	30 Å²	30	62.3 Å²	62.3	31%	0.309	35%	0.353	S	S	.	.	S	Bend	trans	115.1	168.8	167.3	0	0	0	0	0	115.7	Q170 W171 K172	G168-Q170 PolarHBondContact O-N 3.14Å; G168-W171 PolarHBondContact O-N 3.42Å; G168-K172 PolarHBondContact O-N 3.47Å; G168-K172 VanDerWaalsContact O-N 3.14Å
169	P	92.5	Very high	93.7	Very high	116 Å²	116	57 Å²	57	75%	0.753	33%	0.326	S	S	*	.	H	α-helix	trans	-63.9	-34.6	-171.3	-24.2	35.1	0	0	0	114.4	K173	P169-K173 WeakPolarHBondContact O-CB 3.46Å; P169-K173 PolarHBondContact O-N 3.11Å
170	Q	92.8	Very high	94.1	Very high	98 Å²	98	58.4 Å²	58.4	46%	0.458	33%	0.327	S	S	.	.	H	α-helix	trans	-64.3	-43	179.4	-176.8	175.3	6.2	0	0	111.8	G168 K173 F174	G168-Q170 PolarHBondContact O-N 3.14Å; Q170-K173 WeakPolarHBondContact O-CB 3.48Å; Q170-K173 PolarHBondContact O-N 3.39Å; Q170-F174 PolarHBondContact O-N 3.33Å
171	W	93.8	Very high	94.7	Very high	42 Å²	42	55.4 Å²	55.4	16%	0.159	30%	0.296	C	S	.	.	H	α-helix	trans	-75.8	-33.9	-179.5	-63.3	117.5	0	0	0	112.3	F88 K92 P163 M166 G168 K173 F174 R175	F88-W171 HydrophobicContact CZ-CZ3 4.42Å; K92-W171 HydrophobicContact CD-CH2 4.06Å; K92-W171 HydrophobicContact CD-CZ3 4.01Å; K92-W171 HydrophobicContact CG-CZ3 4.37Å; K92-W171 VanDerWaalsContact NZ-CH2 3.33Å; P163-W171 HydrophobicContact CB-CE3 3.98Å; P163-W171 HydrophobicContact CB-CH2 4.37Å; P163-W171 HydrophobicContact CB-CZ3 3.59Å; P163-W171 HydrophobicContact CG-CH2 4.32Å; P163-W171 HydrophobicContact CG-CZ3 3.97Å; M166-W171 HydrophobicContact CB-CB 4.31Å; M166-W171 VanDerWaalsContact CB-CD1 3.41Å; M166-W171 HydrophobicContact CB-CD2 4.01Å; M166-W171 HydrophobicContact CB-CG 3.69Å; M166-W171 HydrophobicContact CE-CH2 4.49Å; M166-W171 HydrophobicContact CE-CZ2 4.26Å; M166-W171 VanDerWaalsContact O-CB 3.24Å; M166-W171 WeakPolarHBondContact O-CB 3.48Å; M166-W171 HydrophobicContact SD-CD2 4.23Å; M166-W171 HydrophobicContact SD-CH2 3.99Å; M166-W171 HydrophobicContact SD-CZ2 3.28Å; M166-W171 WeakPolarHBondContact SD-CZ2 3.45Å; G168-W171 PolarHBondContact O-N 3.42Å; W171-K173 VanDerWaalsContact C-N 3.34Å; W171-K173 PolarHBondContact O-N 3.35Å; W171-F174 HydrophobicContact CE3-CB 4.16Å; W171-F174 AromaticContact CE3-CD1 3.96Å; W171-F174 HydrophobicContact CE3-CD1 3.96Å; W171-F174 HydrophobicContact CE3-CG 4.18Å; W171-F174 HydrophobicContact CZ3-CD1 4.31Å; W171-F174 HydrophobicContact CZ3-CG 4.45Å; W171-F174 PolarHBondContact O-N 3.35Å; W171-R175 PolarHBondContact O-N 2.73Å
172	K	93.3	Very high	95.1	Very high	166 Å²	166	51.5 Å²	51.5	72%	0.722	28%	0.275	S	S	*	.	H	α-helix	trans	-58.7	-43.2	165.8	-71.3	-173.9	176.3	-174.1	0	112	G168 S176	G168-K172 PolarHBondContact O-N 3.47Å; G168-K172 VanDerWaalsContact O-N 3.14Å; K172-S176 PolarHBondContact O-N 2.83Å
173	K	93.9	Very high	95.1	Very high	91 Å²	91	51.7 Å²	51.7	40%	0.396	28%	0.28	S	S	.	.	H	α-helix	trans	-63.4	-46.6	173.3	-168.9	-166.2	177.3	-164.3	0	111.4	L93 G94 P169 Q170 W171 R175 S176 N177	L93-K173 PolarHBondContact O-NZ 3.5Å; G94-K173 PolarHBondContact O-NZ 3.21Å; P169-K173 WeakPolarHBondContact O-CB 3.46Å; P169-K173 PolarHBondContact O-N 3.11Å; Q170-K173 WeakPolarHBondContact O-CB 3.48Å; Q170-K173 PolarHBondContact O-N 3.39Å; W171-K173 VanDerWaalsContact C-N 3.34Å; W171-K173 PolarHBondContact O-N 3.35Å; K173-R175 PolarHBondContact O-N 3.12Å; K173-S176 WeakPolarHBondContact O-CB 3.46Å; K173-S176 PolarHBondContact O-N 3.12Å; K173-S176 VanDerWaalsContact O-N 3.16Å; K173-N177 WeakPolarHBondContact O-CB 3.05Å; K173-N177 PolarHBondContact O-N 2.82Å; K173-N177 PolarHBondContact O-OD1 2.69Å
174	F	96.5	Very high	95.2	Very high	1 Å²	1	51.8 Å²	51.8	0%	0.004	28%	0.28	C	S	.	.	H	α-helix	trans	-56.7	-47.4	176.7	164.2	-101.5	0	0	0	112.1	F88 V91 K92 C127 P163 L164 Q170 W171 S176 N177 F178	F88-F174 AromaticContact CD2-CE2 3.8Å; F88-F174 HydrophobicContact CD2-CE2 3.8Å; F88-F174 HydrophobicContact CD2-CZ 4.18Å; F88-F174 HydrophobicContact CE2-CD2 4.37Å; F88-F174 AromaticContact CE2-CE2 3.67Å; F88-F174 HydrophobicContact CE2-CE2 3.67Å; F88-F174 AromaticContact CE2-CZ 3.82Å; F88-F174 HydrophobicContact CE2-CZ 3.82Å; V91-F174 HydrophobicContact CG1-CD2 4.45Å; V91-F174 HydrophobicContact CG1-CE2 4.44Å; K92-F174 HydrophobicContact CB-CD2 3.98Å; K92-F174 HydrophobicContact CG-CD2 4.48Å; C127-F174 HydrophobicContact CB-CZ 3.96Å; P163-F174 HydrophobicContact CB-CD1 3.86Å; P163-F174 HydrophobicContact CB-CE1 3.34Å; P163-F174 HydrophobicContact CB-CZ 4.01Å; L164-F174 HydrophobicContact CD2-CE1 4.19Å; Q170-F174 PolarHBondContact O-N 3.33Å; W171-F174 HydrophobicContact CE3-CB 4.16Å; W171-F174 AromaticContact CE3-CD1 3.96Å; W171-F174 HydrophobicContact CE3-CD1 3.96Å; W171-F174 HydrophobicContact CE3-CG 4.18Å; W171-F174 HydrophobicContact CZ3-CD1 4.31Å; W171-F174 HydrophobicContact CZ3-CG 4.45Å; W171-F174 PolarHBondContact O-N 3.35Å; F174-S176 VanDerWaalsContact C-N 3.27Å; F174-S176 PolarHBondContact O-N 3.43Å; F174-N177 PolarHBondContact O-N 3.14Å; F174-N177 VanDerWaalsContact O-N 3.16Å; F174-F178 HydrophobicContact CE2-CB 4.3Å; F174-F178 HydrophobicContact CZ-CB 4.26Å; F174-F178 HydrophobicContact CZ-CD2 4.31Å; F174-F178 HydrophobicContact CZ-CG 4.4Å; F174-F178 VanDerWaalsContact O-CB 3.29Å; F174-F178 WeakPolarHBondContact O-CB 3.46Å; F174-F178 PolarHBondContact O-N 2.74Å
175	R	96.1	Very high	95.3	Very high	84 Å²	84	51.3 Å²	51.3	32%	0.317	28%	0.277	S	S	.	.	H	α-helix	trans	-57.9	-39.7	176.9	-178.8	171.4	173.9	159.4	-1.8	112	L164 W171 K173 C179 L224	L164-R175 HydrophobicContact CD2-CB 4.11Å; L164-R175 HydrophobicContact CD2-CG 3.94Å; W171-R175 PolarHBondContact O-N 2.73Å; K173-R175 PolarHBondContact O-N 3.12Å; R175-C179 PolarHBondContact O-N 3.38Å; R175-C179 PolarHBondContact O-SG 3.17Å; R175-L224 HydrophobicContact CG-CD2 4.26Å
176	S	95.9	Very high	95.4	Very high	74 Å²	74	49.3 Å²	49.3	52%	0.517	27%	0.265	S	S	.	.	H	α-helix	trans	-64.6	-51.7	173.3	-167.3	0	0	0	0	111.8	K172 K173 F174 F178 C179 E180	K172-S176 PolarHBondContact O-N 2.83Å; K173-S176 WeakPolarHBondContact O-CB 3.46Å; K173-S176 PolarHBondContact O-N 3.12Å; K173-S176 VanDerWaalsContact O-N 3.16Å; F174-S176 VanDerWaalsContact C-N 3.27Å; F174-S176 PolarHBondContact O-N 3.43Å; S176-F178 VanDerWaalsContact C-N 3.3Å; S176-F178 PolarHBondContact O-N 3.38Å; S176-C179 PolarHBondContact O-N 2.94Å; S176-E180 WeakPolarHBondContact O-CB 3.45Å; S176-E180 PolarHBondContact O-N 2.97Å
177	N	96.9	Very high	95.4	Very high	13 Å²	13	51.5 Å²	51.5	7%	0.07	27%	0.27	C	S	.	.	H	α-helix	trans	-59.8	-38.4	-179.6	-66.7	2.2	0	0	0	112.3	V91 M98 K173 F174 E180 F181	V91-N177 HydrophobicContact CG1-CB 3.81Å; V91-N177 WeakPolarHBondContact O-CB 3.18Å; V91-N177 PolarHBondContact O-ND2 3.35Å; M98-N177 HydrophobicContact CE-CB 3.72Å; M98-N177 WeakPolarHBondContact CE-O 3.39Å; K173-N177 WeakPolarHBondContact O-CB 3.05Å; K173-N177 PolarHBondContact O-N 2.82Å; K173-N177 PolarHBondContact O-OD1 2.69Å; F174-N177 PolarHBondContact O-N 3.14Å; F174-N177 VanDerWaalsContact O-N 3.16Å; N177-E180 PolarHBondContact O-N 3.35Å; N177-F181 WeakPolarHBondContact O-CB 3.35Å; N177-F181 PolarHBondContact O-N 3.1Å
178	F	97.8	Very high	95.6	Very high	1 Å²	1	49.8 Å²	49.8	0%	0.004	25%	0.252	C	S	.	.	H	α-helix	trans	-64.1	-46.5	176.7	177.4	-107.9	0	0	0	111.6	F123 F124 C127 F174 S176 E180 F181 I182 T221 L224 A225	F123-F178 AromaticContact CE1-CD2 3.96Å; F123-F178 HydrophobicContact CE1-CD2 3.96Å; F123-F178 AromaticContact CE1-CE2 3.84Å; F123-F178 HydrophobicContact CE1-CE2 3.84Å; F123-F178 AromaticContact CZ-CD2 3.66Å; F123-F178 HydrophobicContact CZ-CD2 3.66Å; F123-F178 HydrophobicContact CZ-CE2 4.01Å; F124-F178 HydrophobicContact CD1-CE2 4.07Å; F124-F178 HydrophobicContact CD1-CZ 4.14Å; F124-F178 HydrophobicContact CE1-CE2 4.25Å; F124-F178 HydrophobicContact CE1-CZ 4.32Å; C127-F178 HydrophobicContact CB-CD2 4.05Å; C127-F178 HydrophobicContact CB-CE2 3.57Å; C127-F178 HydrophobicContact CB-CZ 4.22Å; C127-F178 VanDerWaalsContact SG-CD2 3.52Å; C127-F178 WeakPolarHBondContact SG-CE2 3.41Å; F174-F178 HydrophobicContact CE2-CB 4.3Å; F174-F178 HydrophobicContact CZ-CB 4.26Å; F174-F178 HydrophobicContact CZ-CD2 4.31Å; F174-F178 HydrophobicContact CZ-CG 4.4Å; F174-F178 VanDerWaalsContact O-CB 3.29Å; F174-F178 WeakPolarHBondContact O-CB 3.46Å; F174-F178 PolarHBondContact O-N 2.74Å; S176-F178 VanDerWaalsContact C-N 3.3Å; S176-F178 PolarHBondContact O-N 3.38Å; F178-E180 VanDerWaalsContact C-N 3.34Å; F178-F181 PolarHBondContact O-N 3.01Å; F178-I182 HydrophobicContact CD1-CD1 4.42Å; F178-I182 HydrophobicContact CE1-CD1 4.08Å; F178-I182 HydrophobicContact CE2-CD1 4.28Å; F178-I182 HydrophobicContact CZ-CD1 4.02Å; F178-I182 WeakPolarHBondContact O-CG1 3.4Å; F178-I182 PolarHBondContact O-N 3.34Å; F178-T221 HydrophobicContact CE1-CG2 4.21Å; F178-T221 HydrophobicContact CE2-CG2 4.5Å; F178-T221 HydrophobicContact CZ-CG2 3.77Å; F178-L224 HydrophobicContact CD1-CD2 4.15Å; F178-L224 HydrophobicContact CD1-CG 4.48Å; F178-L224 HydrophobicContact CE1-CD2 4.23Å; F178-L224 HydrophobicContact CE1-CG 4.28Å; F178-A225 HydrophobicContact CE1-CB 4.2Å; F178-A225 HydrophobicContact CZ-CB 3.9Å
179	C	97.8	Very high	95.7	Very high	25 Å²	25	48.4 Å²	48.4	17%	0.169	24%	0.238	C	C	.	.	H	α-helix	trans	-63.8	-39.8	174.4	-64.5	0	0	0	0	111.9	R175 S176 G183 K228	R175-C179 PolarHBondContact O-N 3.38Å; R175-C179 PolarHBondContact O-SG 3.17Å; S176-C179 PolarHBondContact O-N 2.94Å; C179-G183 PolarHBondContact O-N 2.89Å; C179-K228 HydrophobicContact CB-CD 3.9Å; C179-K228 HydrophobicContact CB-CG 4.03Å
180	E	96.7	Very high	95.7	Very high	90 Å²	90	43.8 Å²	43.8	42%	0.421	21%	0.206	S	C	.	.	H	α-helix	trans	-65.8	-46.5	177.6	-170	-173.7	171.8	0	0	111.7	M98 S176 N177 F178 I182 G183 V184	M98-E180 HydrophobicContact CB-CG 4.22Å; M98-E180 HydrophobicContact CG-CB 4.43Å; M98-E180 HydrophobicContact CG-CG 4.07Å; S176-E180 WeakPolarHBondContact O-CB 3.45Å; S176-E180 PolarHBondContact O-N 2.97Å; N177-E180 PolarHBondContact O-N 3.35Å; F178-E180 VanDerWaalsContact C-N 3.34Å; E180-I182 PolarHBondContact O-N 2.74Å; E180-G183 CarbonylContact O-C 3.56Å; E180-G183 PolarHBondContact O-N 2.88Å; E180-G183 VanDerWaalsContact O-N 3.15Å; E180-V184 HydrophobicContact CG-CG2 3.95Å; E180-V184 WeakPolarHBondContact O-CB 3.39Å; E180-V184 VanDerWaalsContact O-CG2 3.28Å; E180-V184 WeakPolarHBondContact O-CG2 3.46Å; E180-V184 PolarHBondContact O-N 3.26Å
181	F	98.1	Very high	95.5	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-52.1	-53.5	179.7	176.1	-101.4	0	0	0	111.8	L87 V91 M98 V101 V102 L120 F123 N177 F178 G183 V184 L185	L87-F181 HydrophobicContact CD1-CE2 4.11Å; L87-F181 HydrophobicContact CD1-CZ 4.31Å; L87-F181 HydrophobicContact CD2-CE1 4.37Å; L87-F181 HydrophobicContact CD2-CE2 4.45Å; L87-F181 HydrophobicContact CD2-CZ 3.83Å; L87-F181 HydrophobicContact CG-CZ 4.47Å; V91-F181 HydrophobicContact CG2-CB 4.46Å; V91-F181 HydrophobicContact CG2-CD2 4.21Å; V91-F181 HydrophobicContact CG2-CG 4.31Å; M98-F181 HydrophobicContact CG-CB 4.21Å; M98-F181 HydrophobicContact SD-CB 3.65Å; M98-F181 HydrophobicContact SD-CD2 3.8Å; M98-F181 HydrophobicContact SD-CG 4.22Å; V101-F181 HydrophobicContact CG1-CE2 4.29Å; V102-F181 HydrophobicContact CG2-CD2 3.77Å; V102-F181 HydrophobicContact CG2-CE2 3.68Å; L120-F181 HydrophobicContact CD1-CE1 3.84Å; L120-F181 HydrophobicContact CD1-CZ 4.3Å; F123-F181 HydrophobicContact CD1-CD1 4.36Å; F123-F181 HydrophobicContact CD1-CE1 4.09Å; F123-F181 AromaticContact CE1-CD1 3.48Å; F123-F181 HydrophobicContact CE1-CD1 3.48Å; F123-F181 VanDerWaalsContact CE1-CD1 3.48Å; F123-F181 AromaticContact CE1-CE1 3.65Å; F123-F181 HydrophobicContact CE1-CE1 3.65Å; F123-F181 HydrophobicContact CE1-CG 4.46Å; F123-F181 AromaticContact CZ-CD1 3.63Å; F123-F181 HydrophobicContact CZ-CD1 3.63Å; F123-F181 HydrophobicContact CZ-CE1 4.08Å; F123-F181 HydrophobicContact CZ-CG 4.2Å; N177-F181 WeakPolarHBondContact O-CB 3.35Å; N177-F181 PolarHBondContact O-N 3.1Å; F178-F181 PolarHBondContact O-N 3.01Å; F181-G183 VanDerWaalsContact C-N 3.35Å; F181-G183 PolarHBondContact O-N 3.39Å; F181-V184 PolarHBondContact O-N 2.91Å; F181-L185 HydrophobicContact CE1-CD2 4.09Å; F181-L185 HydrophobicContact CZ-CD2 4.27Å; F181-L185 VanDerWaalsContact O-CB 3.3Å; F181-L185 WeakPolarHBondContact O-CB 3.39Å; F181-L185 PolarHBondContact O-N 2.68Å
182	I	97.8	Very high	95.4	Very high	5 Å²	5	48.3 Å²	48.3	3%	0.026	23%	0.232	C	C	.	.	H	α-helix	trans	-60.5	-46.6	179.2	-59.7	168	0	0	0	110.2	F124 F178 E180 V184 L185 I186 A225 K228 L229	F124-I182 HydrophobicContact CE1-CD1 3.89Å; F124-I182 HydrophobicContact CE1-CG1 4.18Å; F124-I182 HydrophobicContact CZ-CG1 4.46Å; F178-I182 HydrophobicContact CD1-CD1 4.42Å; F178-I182 HydrophobicContact CE1-CD1 4.08Å; F178-I182 HydrophobicContact CE2-CD1 4.28Å; F178-I182 HydrophobicContact CZ-CD1 4.02Å; F178-I182 WeakPolarHBondContact O-CG1 3.4Å; F178-I182 PolarHBondContact O-N 3.34Å; E180-I182 PolarHBondContact O-N 2.74Å; I182-V184 VanDerWaalsContact C-N 3.33Å; I182-V184 PolarHBondContact O-N 3.3Å; I182-L185 PolarHBondContact O-N 3.41Å; I182-I186 WeakPolarHBondContact O-CG1 3.32Å; I182-I186 PolarHBondContact O-N 2.7Å; I182-A225 HydrophobicContact CD1-CB 3.67Å; I182-K228 HydrophobicContact CG2-CB 4.31Å; I182-L229 HydrophobicContact CG2-CB 4.11Å
183	G	96.3	Very high	95.4	Very high	13 Å²	13	41.3 Å²	41.3	13%	0.134	20%	0.202	C	C	.	.	H	α-helix	trans	-64.6	-32.5	179	0	0	0	0	0	114	C179 E180 F181 R187	C179-G183 PolarHBondContact O-N 2.89Å; E180-G183 CarbonylContact O-C 3.56Å; E180-G183 PolarHBondContact O-N 2.88Å; E180-G183 VanDerWaalsContact O-N 3.15Å; F181-G183 VanDerWaalsContact C-N 3.35Å; F181-G183 PolarHBondContact O-N 3.39Å; G183-R187 WeakPolarHBondContact O-CG 3.28Å; G183-R187 PolarHBondContact O-NE 3.19Å; G183-R187 PolarHBondContact O-NH2 3.45Å
184	V	97.1	Very high	95.5	Very high	6 Å²	6	37.1 Å²	37.1	4%	0.036	18%	0.184	C	C	.	.	H	α-helix	trans	-76.5	-45.4	176	175.5	0	0	0	0	110.8	M98 V102 E180 F181 I182 I186 R187 Q188	M98-V184 HydrophobicContact CG-CG2 4.34Å; V102-V184 HydrophobicContact CB-CG1 3.99Å; V102-V184 HydrophobicContact CG1-CG1 4.13Å; V102-V184 HydrophobicContact CG2-CB 4.1Å; V102-V184 HydrophobicContact CG2-CG1 3.82Å; E180-V184 HydrophobicContact CG-CG2 3.95Å; E180-V184 WeakPolarHBondContact O-CB 3.39Å; E180-V184 VanDerWaalsContact O-CG2 3.28Å; E180-V184 WeakPolarHBondContact O-CG2 3.46Å; E180-V184 PolarHBondContact O-N 3.26Å; F181-V184 PolarHBondContact O-N 2.91Å; I182-V184 VanDerWaalsContact C-N 3.33Å; I182-V184 PolarHBondContact O-N 3.3Å; V184-I186 PolarHBondContact O-N 2.9Å; V184-R187 PolarHBondContact O-N 3.24Å; V184-R187 VanDerWaalsContact O-N 3.16Å; V184-Q188 HydrophobicContact CG1-CG 4.38Å; V184-Q188 PolarHBondContact O-N 3.05Å
185	L	97.2	Very high	95.4	Very high	5 Å²	5	39.3 Å²	39.3	3%	0.026	19%	0.192	C	C	.	.	H	α-helix	trans	-50.2	-55	179.9	176.6	57.7	0	0	0	111.8	V102 W105 I106 L120 F181 I182 R187 Q188 C189 M199	V102-L185 HydrophobicContact CG1-CB 4.43Å; V102-L185 HydrophobicContact CG1-CD1 4.19Å; V102-L185 HydrophobicContact CG2-CB 4.09Å; W105-L185 HydrophobicContact CD2-CD1 4.45Å; W105-L185 HydrophobicContact CE3-CD1 3.53Å; W105-L185 HydrophobicContact CZ3-CD1 3.67Å; I106-L185 HydrophobicContact CG1-CD1 4.34Å; L120-L185 HydrophobicContact CD1-CD2 4.24Å; L120-L185 HydrophobicContact CD2-CD2 4.16Å; F181-L185 HydrophobicContact CE1-CD2 4.09Å; F181-L185 HydrophobicContact CZ-CD2 4.27Å; F181-L185 VanDerWaalsContact O-CB 3.3Å; F181-L185 WeakPolarHBondContact O-CB 3.39Å; F181-L185 PolarHBondContact O-N 2.68Å; I182-L185 PolarHBondContact O-N 3.41Å; L185-R187 PolarHBondContact O-N 3.46Å; L185-Q188 PolarHBondContact O-N 2.83Å; L185-Q188 VanDerWaalsContact O-N 3.15Å; L185-C189 PolarHBondContact O-N 2.94Å; L185-C189 PolarHBondContact O-SG 3.16Å; L185-C189 VanDerWaalsContact O-SG 3.34Å; L185-M199 HydrophobicContact CD1-CE 4.16Å; L185-M199 HydrophobicContact CD2-CE 3.79Å; L185-M199 HydrophobicContact CG-CE 3.94Å
186	I	96.8	Very high	95.3	Very high	2 Å²	2	36.6 Å²	36.6	1%	0.01	18%	0.184	C	C	.	.	H	α-helix	trans	-64.8	-39.4	-178.5	-59.4	-60.3	0	0	0	112	I182 V184 Q188 C189 Q190 I194 M200 L229 A232 L233 V236	I182-I186 WeakPolarHBondContact O-CG1 3.32Å; I182-I186 PolarHBondContact O-N 2.7Å; V184-I186 PolarHBondContact O-N 2.9Å; I186-Q188 VanDerWaalsContact C-N 3.27Å; I186-Q188 PolarHBondContact O-N 3.46Å; I186-C189 PolarHBondContact O-N 3.01Å; I186-Q190 PolarHBondContact O-N 3.2Å; I186-I194 HydrophobicContact CG2-CD1 3.76Å; I186-M200 HydrophobicContact CD1-CE 3.99Å; I186-M200 HydrophobicContact CD1-SD 3.57Å; I186-M200 VanDerWaalsContact CD1-SD 3.57Å; I186-L229 HydrophobicContact CD1-CD1 3.38Å; I186-L229 HydrophobicContact CG1-CD1 3.55Å; I186-A232 HydrophobicContact CB-CB 3.7Å; I186-A232 HydrophobicContact CG1-CB 4.18Å; I186-A232 HydrophobicContact CG2-CB 3.67Å; I186-L233 HydrophobicContact CG2-CD2 4.4Å; I186-V236 HydrophobicContact CG2-CG2 4.32Å
187	R	93.1	Very high	95.2	Very high	104 Å²	104	41.6 Å²	41.6	39%	0.392	20%	0.199	S	C	.	.	H	α-helix	trans	-64.9	-26.5	175.8	-80.8	-178.8	-69.2	150.4	-0.1	113.4	G183 V184 L185 Q190	G183-R187 WeakPolarHBondContact O-CG 3.28Å; G183-R187 PolarHBondContact O-NE 3.19Å; G183-R187 PolarHBondContact O-NH2 3.45Å; V184-R187 PolarHBondContact O-N 3.24Å; V184-R187 VanDerWaalsContact O-N 3.16Å; L185-R187 PolarHBondContact O-N 3.46Å; R187-Q190 WeakPolarHBondContact O-CG 2.99Å; R187-Q190 PolarHBondContact O-NE2 3.11Å
188	Q	94.9	Very high	95	Very high	80 Å²	80	44.4 Å²	44.4	37%	0.374	21%	0.209	S	C	.	.	H	α-helix	trans	-86.7	-30.6	174.7	-63.7	-58.3	-13.6	0	0	112.7	Q99 V102 I106 V184 L185 I186 Q190	Q99-Q188 VanDerWaalsContact CD-NE2 3.27Å; Q99-Q188 VanDerWaalsContact NE2-NE2 3.13Å; V102-Q188 HydrophobicContact CG1-CB 4.04Å; V102-Q188 HydrophobicContact CG1-CG 4.01Å; I106-Q188 HydrophobicContact CD1-CB 3.52Å; V184-Q188 HydrophobicContact CG1-CG 4.38Å; V184-Q188 PolarHBondContact O-N 3.05Å; L185-Q188 PolarHBondContact O-N 2.83Å; L185-Q188 VanDerWaalsContact O-N 3.15Å; I186-Q188 VanDerWaalsContact C-N 3.27Å; I186-Q188 PolarHBondContact O-N 3.46Å; Q188-Q190 VanDerWaalsContact C-N 3.31Å; Q188-Q190 PolarHBondContact O-N 3.06Å
189	C	94.9	Very high	94.9	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-73.7	-17	173.6	-65.7	0	0	0	0	114	L185 I186 Y191 S192 I193 I194	L185-C189 PolarHBondContact O-N 2.94Å; L185-C189 PolarHBondContact O-SG 3.16Å; L185-C189 VanDerWaalsContact O-SG 3.34Å; I186-C189 PolarHBondContact O-N 3.01Å; C189-Y191 PolarHBondContact O-N 3.2Å; C189-S192 PolarHBondContact O-N 3.13Å; C189-I193 HydrophobicContact CB-CB 4.01Å; C189-I193 HydrophobicContact CB-CG2 4.28Å; C189-I193 PolarHBondContact O-N 3.24Å; C189-I194 HydrophobicContact CB-CB 4.19Å; C189-I194 PolarHBondContact O-N 3.11Å; C189-I194 VanDerWaalsContact O-N 3.17Å
190	Q	91.5	Very high	94.8	Very high	20 Å²	20	43.4 Å²	43.4	9%	0.093	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-14.9	-165.7	82.1	-179.5	-71.2	0	0	117.5	I186 R187 Q188 Y195 V236	I186-Q190 PolarHBondContact O-N 3.2Å; R187-Q190 WeakPolarHBondContact O-CG 2.99Å; R187-Q190 PolarHBondContact O-NE2 3.11Å; Q188-Q190 VanDerWaalsContact C-N 3.31Å; Q188-Q190 PolarHBondContact O-N 3.06Å; Q190-Y195 WeakPolarHBondContact O-CE2 3.45Å; Q190-Y195 PolarHBondContact O-OH 2.97Å; Q190-V236 HydrophobicContact CB-CG1 4.08Å; Q190-V236 HydrophobicContact CB-CG2 3.62Å
191	Y	89.4	Confident	94.7	Very high	160 Å²	160	43.4 Å²	43.4	63%	0.627	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-110.5	-0.5	-178	-59	-63.6	0	0	0	114.1	C189	C189-Y191 PolarHBondContact O-N 3.2Å
192	S	91.8	Very high	94.5	Very high	75 Å²	75	44.4 Å²	44.4	52%	0.524	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-158.5	-75.6	179.9	50.1	0	0	0	0	113.1	C189 I194 Y195	C189-S192 PolarHBondContact O-N 3.13Å; S192-I194 PolarHBondContact O-N 3.29Å; S192-I194 VanDerWaalsContact O-N 3.1Å; S192-Y195 PolarHBondContact O-N 3.18Å
193	I	93.9	Very high	94.4	Very high	18 Å²	18	44.7 Å²	44.7	9%	0.092	21%	0.213	C	C	.	.	G	3₁₀ helix	trans	-57.4	-30.4	-171.4	-67.9	167.2	0	0	0	112.6	I106 Y109 C189 Y195 D196 M199	I106-I193 HydrophobicContact CG1-CD1 4.46Å; I106-I193 HydrophobicContact CG2-CD1 3.87Å; Y109-I193 HydrophobicContact CD1-CD1 4.06Å; Y109-I193 HydrophobicContact CD1-CG1 4.3Å; Y109-I193 HydrophobicContact CD1-CG2 3.95Å; Y109-I193 HydrophobicContact CE1-CG1 4.35Å; Y109-I193 HydrophobicContact CE1-CG2 3.63Å; C189-I193 HydrophobicContact CB-CB 4.01Å; C189-I193 HydrophobicContact CB-CG2 4.28Å; C189-I193 PolarHBondContact O-N 3.24Å; I193-Y195 PolarHBondContact O-N 3.14Å; I193-D196 WeakPolarHBondContact O-CB 3.46Å; I193-D196 VanDerWaalsContact O-CG 3.29Å; I193-D196 PolarHBondContact O-N 3.37Å; I193-M199 HydrophobicContact CG2-CB 4.13Å; I193-M199 HydrophobicContact CG2-CG 4.29Å; I193-M199 HydrophobicContact CG2-SD 3.67Å
194	I	95.2	Very high	94.4	Very high	3 Å²	3	44.7 Å²	44.7	2%	0.015	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	-64.2	-22.5	-179.9	-155.3	166.6	0	0	0	113.6	I186 C189 S192 M200 L233 V236 I284 M287	I186-I194 HydrophobicContact CG2-CD1 3.76Å; C189-I194 HydrophobicContact CB-CB 4.19Å; C189-I194 PolarHBondContact O-N 3.11Å; C189-I194 VanDerWaalsContact O-N 3.17Å; S192-I194 PolarHBondContact O-N 3.29Å; S192-I194 VanDerWaalsContact O-N 3.1Å; I194-M200 HydrophobicContact CG1-CE 4.47Å; I194-M200 HydrophobicContact CG1-CG 3.75Å; I194-M200 HydrophobicContact CG1-SD 3.94Å; I194-L233 HydrophobicContact CD1-CD2 3.8Å; I194-V236 HydrophobicContact CD1-CG2 4.45Å; I194-I284 HydrophobicContact CD1-CD1 3.69Å; I194-I284 HydrophobicContact CG1-CD1 4.06Å; I194-I284 HydrophobicContact CG2-CD1 4.4Å; I194-M287 HydrophobicContact CG1-CE 4.41Å; I194-M287 HydrophobicContact CG1-SD 4.29Å; I194-M287 VanDerWaalsContact O-CE 3.31Å; I194-M287 WeakPolarHBondContact O-CE 3.21Å
195	Y	94.6	Very high	94.4	Very high	48 Å²	48	47.4 Å²	47.4	19%	0.188	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-106.5	25.1	179.9	-41.4	-80.4	0	0	0	112.2	Q190 S192 I193 N280 I284	Q190-Y195 WeakPolarHBondContact O-CE2 3.45Å; Q190-Y195 PolarHBondContact O-OH 2.97Å; S192-Y195 PolarHBondContact O-N 3.18Å; I193-Y195 PolarHBondContact O-N 3.14Å; Y195-N280 HydrophobicContact CD1-CB 4.18Å; Y195-N280 HydrophobicContact CE1-CB 3.56Å; Y195-N280 WeakPolarHBondContact CE2-ND2 3.33Å; Y195-I284 HydrophobicContact CE1-CD1 4.09Å; Y195-I284 HydrophobicContact CE1-CG1 3.88Å
196	D	94	Very high	94.4	Very high	27 Å²	27	47.2 Å²	47.2	14%	0.144	23%	0.228	C	C	.	.	S	Bend	trans	-93.2	11.8	-172.6	92.1	-20.9	0	0	0	115.6	Y109 R113 I193 Y198 M199	Y109-D196 VanDerWaalsContact CE1-OD2 3.27Å; Y109-D196 WeakPolarHBondContact CE1-OD2 3.49Å; Y109-D196 PolarHBondContact OH-OD1 2.81Å; Y109-D196 PolarHBondContact OH-OD2 3.05Å; R113-D196 IonicContact CZ-OD2 3.76Å; R113-D196 IonicContact NE-OD2 3.03Å; R113-D196 IonicContact NH1-OD2 3.76Å; R113-D196 PolarHBondContact NH1-OD2 3.12Å; R113-D196 VanDerWaalsContact NH1-OD2 3.1Å; R113-D196 IonicContact NH2-OD2 2.76Å; R113-D196 PolarHBondContact NH2-OD2 3.09Å; I193-D196 WeakPolarHBondContact O-CB 3.46Å; I193-D196 VanDerWaalsContact O-CG 3.29Å; I193-D196 PolarHBondContact O-N 3.37Å; D196-Y198 PolarHBondContact O-N 3.24Å; D196-Y198 VanDerWaalsContact O-N 3.1Å; D196-Y198 PolarHBondContact OD1-N 3.22Å; D196-Y198 VanDerWaalsContact OD1-N 3.15Å; D196-M199 PolarHBondContact OD1-N 3.09Å
197	E	92.5	Very high	94.4	Very high	179 Å²	179	47.2 Å²	47.2	84%	0.836	23%	0.228	S	C	*	.	S	Bend	trans	53.5	23	179.8	-62.6	174.4	-150.6	0	0	113.8
198	Y	93.9	Very high	94.6	Very high	72 Å²	72	44.2 Å²	44.2	28%	0.282	22%	0.221	S	C	.	.	S	Bend	trans	-143.1	-49.6	-175.3	-166.6	-120.5	0	0	0	114.9	R113 D114 L117 D196 T202	R113-Y198 HydrophobicContact CB-CD1 4.19Å; R113-Y198 HydrophobicContact CB-CE1 3.94Å; D114-Y198 PolarHBondContact OD1-OH 3.28Å; L117-Y198 HydrophobicContact CD1-CD1 3.67Å; L117-Y198 HydrophobicContact CD1-CE1 3.37Å; D196-Y198 PolarHBondContact O-N 3.24Å; D196-Y198 VanDerWaalsContact O-N 3.1Å; D196-Y198 PolarHBondContact OD1-N 3.22Å; D196-Y198 VanDerWaalsContact OD1-N 3.15Å; Y198-T202 WeakPolarHBondContact O-CB 3.47Å; Y198-T202 PolarHBondContact O-N 3.26Å; Y198-T202 PolarHBondContact O-OG1 3.46Å
199	M	95.2	Very high	94.7	Very high	1 Å²	1	41.7 Å²	41.7	1%	0.005	22%	0.217	C	C	.	.	H	α-helix	trans	-63.9	-52.8	-175.8	-174	-146.9	162.4	0	0	111.8	W105 Y109 L117 L120 L185 I193 D196 V203	W105-M199 HydrophobicContact CH2-CE 3.89Å; W105-M199 HydrophobicContact CH2-CG 4.17Å; W105-M199 HydrophobicContact CH2-SD 4.3Å; W105-M199 HydrophobicContact CZ3-CE 4.03Å; W105-M199 HydrophobicContact CZ3-SD 4.41Å; Y109-M199 HydrophobicContact CE2-CB 4.38Å; L117-M199 HydrophobicContact CD2-CG 4.09Å; L120-M199 HydrophobicContact CD2-CE 4.15Å; L185-M199 HydrophobicContact CD1-CE 4.16Å; L185-M199 HydrophobicContact CD2-CE 3.79Å; L185-M199 HydrophobicContact CG-CE 3.94Å; I193-M199 HydrophobicContact CG2-CB 4.13Å; I193-M199 HydrophobicContact CG2-CG 4.29Å; I193-M199 HydrophobicContact CG2-SD 3.67Å; D196-M199 PolarHBondContact OD1-N 3.09Å; M199-V203 WeakPolarHBondContact O-CG2 3.18Å; M199-V203 PolarHBondContact O-N 3.34Å
200	M	95.8	Very high	94.8	Very high	3 Å²	3	41.8 Å²	41.8	2%	0.015	22%	0.218	C	C	.	.	H	α-helix	trans	-70	-45.6	-171	-69	-61.2	-61.2	0	0	111.7	I186 I194 T202 V203 I204 L229 L233 M287	I186-M200 HydrophobicContact CD1-CE 3.99Å; I186-M200 HydrophobicContact CD1-SD 3.57Å; I186-M200 VanDerWaalsContact CD1-SD 3.57Å; I194-M200 HydrophobicContact CG1-CE 4.47Å; I194-M200 HydrophobicContact CG1-CG 3.75Å; I194-M200 HydrophobicContact CG1-SD 3.94Å; M200-T202 VanDerWaalsContact C-N 3.32Å; M200-T202 PolarHBondContact O-N 3.05Å; M200-V203 PolarHBondContact O-N 2.93Å; M200-I204 HydrophobicContact CB-CD1 4.46Å; M200-I204 HydrophobicContact CE-CD1 4.1Å; M200-I204 WeakPolarHBondContact O-CB 3.44Å; M200-I204 VanDerWaalsContact O-CG1 3.31Å; M200-I204 WeakPolarHBondContact O-CG1 3.42Å; M200-I204 PolarHBondContact O-N 3.46Å; M200-L229 HydrophobicContact CE-CD1 3.77Å; M200-L229 HydrophobicContact CE-CG 4.48Å; M200-L233 HydrophobicContact CE-CD1 4.19Å; M200-L233 HydrophobicContact CE-CD2 3.97Å; M200-L233 HydrophobicContact CE-CG 4.43Å; M200-M287 HydrophobicContact CB-SD 3.78Å; M200-M287 HydrophobicContact CE-SD 3.74Å; M200-M287 HydrophobicContact CG-CE 4.44Å; M200-M287 HydrophobicContact CG-SD 3.73Å
201	D	94.2	Very high	95.2	Very high	91 Å²	91	40.9 Å²	40.9	49%	0.487	21%	0.214	S	C	.	.	H	α-helix	trans	-56.2	-45	176.2	-73.1	29.6	0	0	0	112.2	V203 S205	D201-V203 PolarHBondContact O-N 3.13Å; D201-S205 WeakPolarHBondContact O-CB 3.41Å; D201-S205 PolarHBondContact O-N 2.93Å
202	T	94.4	Very high	95.5	Very high	20 Å²	20	38.2 Å²	38.2	12%	0.123	21%	0.21	C	C	.	.	H	α-helix	trans	-60.3	-46.6	177.5	-58.7	0	0	0	0	111.2	L117 I121 F139 Y198 M200 L206	L117-T202 HydrophobicContact CD1-CG2 4.24Å; L117-T202 HydrophobicContact CD2-CG2 4.49Å; I121-T202 HydrophobicContact CD1-CG2 4.13Å; F139-T202 HydrophobicContact CE2-CG2 3.85Å; F139-T202 HydrophobicContact CZ-CG2 4.23Å; Y198-T202 WeakPolarHBondContact O-CB 3.47Å; Y198-T202 PolarHBondContact O-N 3.26Å; Y198-T202 PolarHBondContact O-OG1 3.46Å; M200-T202 VanDerWaalsContact C-N 3.32Å; M200-T202 PolarHBondContact O-N 3.05Å; T202-L206 WeakPolarHBondContact O-CB 3.27Å; T202-L206 PolarHBondContact O-N 3.12Å; T202-L206 VanDerWaalsContact O-N 3.11Å
203	V	96.2	Very high	95.7	Very high	11 Å²	11	35.5 Å²	35.5	7%	0.067	19%	0.191	C	C	.	.	H	α-helix	trans	-69.6	-46.4	-179.4	172.3	0	0	0	0	111.7	L120 F124 M199 M200 D201 L206 L207 L229	L120-V203 HydrophobicContact CD2-CG2 3.66Å; L120-V203 HydrophobicContact CG-CG2 4.48Å; F124-V203 HydrophobicContact CE2-CG1 4.03Å; F124-V203 HydrophobicContact CZ-CG1 4.42Å; M199-V203 WeakPolarHBondContact O-CG2 3.18Å; M199-V203 PolarHBondContact O-N 3.34Å; M200-V203 PolarHBondContact O-N 2.93Å; D201-V203 PolarHBondContact O-N 3.13Å; V203-L206 PolarHBondContact O-N 3.39Å; V203-L207 HydrophobicContact CG1-CD1 3.78Å; V203-L207 HydrophobicContact CG1-CG 4.27Å; V203-L207 WeakPolarHBondContact O-CB 3.45Å; V203-L207 VanDerWaalsContact O-CG 3.28Å; V203-L207 WeakPolarHBondContact O-CG 3.42Å; V203-L207 PolarHBondContact O-N 3.4Å; V203-L229 HydrophobicContact CG1-CD2 4.02Å
204	I	97	Very high	95.7	Very high	14 Å²	14	42.5 Å²	42.5	7%	0.072	22%	0.223	C	C	.	.	H	α-helix	trans	-64.7	-43.8	-179.9	-68.1	170.9	0	0	0	110.2	M200 L207 T208 L229 M287 I291	M200-I204 HydrophobicContact CB-CD1 4.46Å; M200-I204 HydrophobicContact CE-CD1 4.1Å; M200-I204 WeakPolarHBondContact O-CB 3.44Å; M200-I204 VanDerWaalsContact O-CG1 3.31Å; M200-I204 WeakPolarHBondContact O-CG1 3.42Å; M200-I204 PolarHBondContact O-N 3.46Å; I204-L207 PolarHBondContact O-N 2.86Å; I204-T208 VanDerWaalsContact O-CB 3.28Å; I204-T208 WeakPolarHBondContact O-CB 3.41Å; I204-T208 PolarHBondContact O-N 3.2Å; I204-T208 PolarHBondContact O-OG1 3.18Å; I204-L229 HydrophobicContact CG1-CD2 3.99Å; I204-M287 HydrophobicContact CD1-CB 3.85Å; I204-M287 HydrophobicContact CD1-CG 4.06Å; I204-I291 HydrophobicContact CD1-CD1 4.09Å; I204-I291 HydrophobicContact CD1-CG1 4.17Å; I204-I291 HydrophobicContact CG1-CD1 4.09Å; I204-I291 HydrophobicContact CG1-CG1 4.03Å; I204-I291 HydrophobicContact CG2-CG1 4.07Å
205	S	96.4	Very high	95.7	Very high	63 Å²	63	44 Å²	44	44%	0.441	23%	0.233	S	C	.	.	H	α-helix	trans	-59.9	-46.3	176.1	-175.1	0	0	0	0	112.3	N144 D201 T208 G209	N144-S205 PolarHBondContact ND2-OG 3.5Å; D201-S205 WeakPolarHBondContact O-CB 3.41Å; D201-S205 PolarHBondContact O-N 2.93Å; S205-T208 PolarHBondContact O-N 3.02Å; S205-G209 PolarHBondContact O-N 2.85Å; S205-G209 VanDerWaalsContact O-N 3.07Å
206	L	96.1	Very high	95.8	Very high	1 Å²	1	46 Å²	46	1%	0.005	24%	0.24	C	C	.	.	H	α-helix	trans	-64.8	-48.7	177.3	175.5	63	0	0	0	111.9	I121 N144 I148 T202 V203 T208 G209 L210	I121-L206 HydrophobicContact CB-CD2 3.98Å; I121-L206 HydrophobicContact CG1-CD2 3.75Å; I121-L206 HydrophobicContact CG2-CD2 3.76Å; N144-L206 PolarHBondContact ND2-N 3.21Å; I148-L206 HydrophobicContact CD1-CD1 4.32Å; I148-L206 HydrophobicContact CG1-CD1 4.31Å; T202-L206 WeakPolarHBondContact O-CB 3.27Å; T202-L206 PolarHBondContact O-N 3.12Å; T202-L206 VanDerWaalsContact O-N 3.11Å; V203-L206 PolarHBondContact O-N 3.39Å; L206-T208 VanDerWaalsContact C-N 3.26Å; L206-T208 PolarHBondContact O-N 3.15Å; L206-G209 PolarHBondContact O-N 2.88Å; L206-L210 HydrophobicContact CD1-CD1 3.87Å; L206-L210 HydrophobicContact CD1-CG 3.97Å; L206-L210 HydrophobicContact CD2-CD1 4.34Å; L206-L210 HydrophobicContact CG-CD1 3.78Å; L206-L210 HydrophobicContact CG-CG 4.31Å; L206-L210 WeakPolarHBondContact O-CB 3.13Å; L206-L210 WeakPolarHBondContact O-CG 3.23Å; L206-L210 PolarHBondContact O-N 2.85Å
207	L	97.9	Very high	96	Very high	1 Å²	1	45 Å²	45	1%	0.005	24%	0.236	C	C	.	.	H	α-helix	trans	-63.4	-34.9	-179.4	-70.2	179.6	0	0	0	111.7	F124 V203 I204 S211 A225 A226 L229 I295	F124-L207 HydrophobicContact CD1-CD2 4.1Å; F124-L207 HydrophobicContact CD2-CD2 4.3Å; F124-L207 HydrophobicContact CE1-CD2 4.36Å; F124-L207 HydrophobicContact CG-CD2 4.08Å; F124-L207 HydrophobicContact CZ-CD1 4.47Å; V203-L207 HydrophobicContact CG1-CD1 3.78Å; V203-L207 HydrophobicContact CG1-CG 4.27Å; V203-L207 WeakPolarHBondContact O-CB 3.45Å; V203-L207 VanDerWaalsContact O-CG 3.28Å; V203-L207 WeakPolarHBondContact O-CG 3.42Å; V203-L207 PolarHBondContact O-N 3.4Å; I204-L207 PolarHBondContact O-N 2.86Å; L207-S211 VanDerWaalsContact O-CB 3.27Å; L207-S211 WeakPolarHBondContact O-CB 3.46Å; L207-S211 PolarHBondContact O-N 3.4Å; L207-S211 PolarHBondContact O-OG 3.42Å; L207-A225 HydrophobicContact CD1-CB 4.03Å; L207-A225 HydrophobicContact CD2-CB 3.77Å; L207-A226 HydrophobicContact CD1-CB 4.48Å; L207-L229 HydrophobicContact CD1-CD2 3.83Å; L207-I295 HydrophobicContact CB-CD1 4.31Å
208	T	97.9	Very high	96.2	Very high	41 Å²	41	36.5 Å²	36.5	25%	0.252	20%	0.196	S	C	.	.	H	α-helix	trans	-64.1	-51.7	174.9	-56.1	0	0	0	0	110.2	I204 S205 L206 L210 S211 D212 I295	I204-T208 VanDerWaalsContact O-CB 3.28Å; I204-T208 WeakPolarHBondContact O-CB 3.41Å; I204-T208 PolarHBondContact O-N 3.2Å; I204-T208 PolarHBondContact O-OG1 3.18Å; S205-T208 PolarHBondContact O-N 3.02Å; L206-T208 VanDerWaalsContact C-N 3.26Å; L206-T208 PolarHBondContact O-N 3.15Å; T208-L210 PolarHBondContact O-N 3.12Å; T208-S211 PolarHBondContact O-N 2.97Å; T208-S211 VanDerWaalsContact O-N 3.08Å; T208-S211 PolarHBondContact O-OG 2.98Å; T208-D212 PolarHBondContact O-N 2.83Å; T208-I295 HydrophobicContact CG2-CG1 4.26Å
209	G	96.8	Very high	96.4	Very high	28 Å²	28	34.2 Å²	34.2	29%	0.289	19%	0.187	S	C	.	.	H	α-helix	trans	-59.4	-42.3	176.6	0	0	0	0	0	113.4	S205 L206 S211 D212 S213	S205-G209 PolarHBondContact O-N 2.85Å; S205-G209 VanDerWaalsContact O-N 3.07Å; L206-G209 PolarHBondContact O-N 2.88Å; G209-S211 VanDerWaalsContact C-N 3.27Å; G209-S211 PolarHBondContact O-N 3.09Å; G209-D212 PolarHBondContact O-N 3.22Å; G209-S213 PolarHBondContact O-N 3.12Å
210	L	97.3	Very high	96.6	Very high	1 Å²	1	34.2 Å²	34.2	1%	0.005	19%	0.187	C	C	.	.	H	α-helix	trans	-65.1	-32.4	176.2	-73.9	170.3	0	0	0	111.9	I125 I148 L206 T208 D212 S213 F218 R219 S222	I125-L210 HydrophobicContact CD1-CD1 4.28Å; I125-L210 HydrophobicContact CD1-CD2 3.87Å; I148-L210 HydrophobicContact CD1-CD2 4.07Å; I148-L210 HydrophobicContact CD1-CG 3.98Å; I148-L210 HydrophobicContact CG1-CD2 3.74Å; I148-L210 HydrophobicContact CG1-CG 4.13Å; I148-L210 HydrophobicContact CG2-CD2 4.19Å; L206-L210 HydrophobicContact CD1-CD1 3.87Å; L206-L210 HydrophobicContact CD1-CG 3.97Å; L206-L210 HydrophobicContact CD2-CD1 4.34Å; L206-L210 HydrophobicContact CG-CD1 3.78Å; L206-L210 HydrophobicContact CG-CG 4.31Å; L206-L210 WeakPolarHBondContact O-CB 3.13Å; L206-L210 WeakPolarHBondContact O-CG 3.23Å; L206-L210 PolarHBondContact O-N 2.85Å; T208-L210 PolarHBondContact O-N 3.12Å; L210-D212 VanDerWaalsContact C-N 3.29Å; L210-D212 PolarHBondContact O-N 2.92Å; L210-S213 VanDerWaalsContact O-CB 3.3Å; L210-S213 WeakPolarHBondContact O-CB 3.49Å; L210-S213 PolarHBondContact O-N 2.8Å; L210-F218 HydrophobicContact CD2-CB 3.86Å; L210-F218 HydrophobicContact CD2-CD1 3.68Å; L210-F218 HydrophobicContact CD2-CD2 4.36Å; L210-F218 HydrophobicContact CD2-CE1 4.33Å; L210-F218 HydrophobicContact CD2-CG 3.73Å; L210-R219 WeakPolarHBondContact O-CA 3.27Å; L210-S222 WeakPolarHBondContact CB-OG 3.22Å; L210-S222 PolarHBondContact O-OG 3.29Å
211	S	97.9	Very high	96.7	Very high	2 Å²	2	34.1 Å²	34.1	1%	0.014	19%	0.187	C	C	.	.	H	α-helix	trans	-76.4	-12.3	179.2	80.6	0	0	0	0	114.1	L207 T208 G209 R219 S222 R299	L207-S211 VanDerWaalsContact O-CB 3.27Å; L207-S211 WeakPolarHBondContact O-CB 3.46Å; L207-S211 PolarHBondContact O-N 3.4Å; L207-S211 PolarHBondContact O-OG 3.42Å; T208-S211 PolarHBondContact O-N 2.97Å; T208-S211 VanDerWaalsContact O-N 3.08Å; T208-S211 PolarHBondContact O-OG 2.98Å; G209-S211 VanDerWaalsContact C-N 3.27Å; G209-S211 PolarHBondContact O-N 3.09Å; S211-R219 WeakPolarHBondContact O-CD 3.48Å; S211-R219 VanDerWaalsContact O-CG 3.26Å; S211-R219 WeakPolarHBondContact O-CG 3.27Å; S211-S222 WeakPolarHBondContact CA-OG 3.47Å; S211-S222 PolarHBondContact N-OG 2.79Å; S211-S222 VanDerWaalsContact N-OG 3.13Å; S211-R299 WeakPolarHBondContact O-CD 3.45Å; S211-R299 PolarHBondContact O-NE 2.95Å
212	D	96.9	Very high	96.9	Very high	103 Å²	103	29.9 Å²	29.9	55%	0.551	16%	0.164	S	C	*	.	H	α-helix	trans	-98.9	-4.5	170.4	-156	50	0	0	0	112.9	T208 G209 L210 Q214 R299	T208-D212 PolarHBondContact O-N 2.83Å; G209-D212 PolarHBondContact O-N 3.22Å; L210-D212 VanDerWaalsContact C-N 3.29Å; L210-D212 PolarHBondContact O-N 2.92Å; D212-Q214 PolarHBondContact O-N 2.94Å; D212-R299 IonicContact OD1-NH2 2.71Å
213	S	96.3	Very high	97.1	Very high	18 Å²	18	28.9 Å²	28.9	13%	0.126	16%	0.158	C	C	.	.			trans	-61.8	136.9	176.6	-172.8	0	0	0	0	111.9	G209 L210 V215 R219	G209-S213 PolarHBondContact O-N 3.12Å; L210-S213 VanDerWaalsContact O-CB 3.3Å; L210-S213 WeakPolarHBondContact O-CB 3.49Å; L210-S213 PolarHBondContact O-N 2.8Å; S213-V215 PolarHBondContact O-N 3.47Å; S213-V215 PolarHBondContact OG-N 2.97Å; S213-R219 WeakPolarHBondContact O-CB 3.44Å; S213-R219 WeakPolarHBondContact O-CD 3.22Å; S213-R219 PolarHBondContact O-NH1 3.45Å
214	Q	94.3	Very high	97.2	Very high	165 Å²	165	28.6 Å²	28.6	77%	0.771	16%	0.156	S	C	*	.	S	Bend	trans	-66.2	-25.9	173.8	-62	-56.8	-44.8	0	0	111.9	D212 R216 R219	D212-Q214 PolarHBondContact O-N 2.94Å; Q214-R216 PolarHBondContact O-N 3.45Å; Q214-R216 VanDerWaalsContact O-N 3.13Å; Q214-R219 PolarHBondContact O-NH1 3.19Å
215	V	95.1	Very high	97.3	Very high	36 Å²	36	28 Å²	28	22%	0.218	15%	0.153	C	C	.	.			trans	-63.1	111.1	175.1	-176.8	0	0	0	0	109.8	T152 F155 S213 A217 F218 R219	T152-V215 HydrophobicContact CG2-CG2 3.55Å; F155-V215 HydrophobicContact CE2-CG1 4.13Å; S213-V215 PolarHBondContact O-N 3.47Å; S213-V215 PolarHBondContact OG-N 2.97Å; V215-A217 HydrophobicContact CG1-CB 4.17Å; V215-A217 PolarHBondContact O-N 3.45Å; V215-F218 HydrophobicContact CB-CB 4.42Å; V215-F218 HydrophobicContact CB-CD2 3.81Å; V215-F218 HydrophobicContact CB-CG 4.5Å; V215-F218 HydrophobicContact CG1-CD2 3.83Å; V215-F218 HydrophobicContact CG1-CE2 4.42Å; V215-F218 HydrophobicContact CG1-CG 4.39Å; V215-F218 HydrophobicContact CG2-CD2 4.15Å; V215-F218 PolarHBondContact O-N 3.4Å; V215-R219 PolarHBondContact O-N 2.89Å
216	R	96.3	Very high	97.4	Very high	88 Å²	88	25 Å²	25	33%	0.332	13%	0.132	S	C	.	.	H	α-helix	trans	-54.7	-39.3	-178.4	179.1	179.5	171.9	-173.7	-4.5	112.3	Y162 Q214 R219 H220 I304 E306	Y162-R216 HydrophobicContact CE1-CG 4.36Å; Y162-R216 PolarHBondContact OH-NE 2.8Å; Q214-R216 PolarHBondContact O-N 3.45Å; Q214-R216 VanDerWaalsContact O-N 3.13Å; R216-R219 PolarHBondContact O-N 3.19Å; R216-H220 VanDerWaalsContact O-CB 3.25Å; R216-H220 WeakPolarHBondContact O-CB 3.36Å; R216-H220 PolarHBondContact O-N 3Å; R216-I304 HydrophobicContact CG-CG1 4.24Å; R216-E306 IonicContact CZ-OE1 3.9Å; R216-E306 IonicContact CZ-OE2 2.64Å; R216-E306 IonicContact NH2-OE1 2.71Å; R216-E306 PolarHBondContact NH2-OE1 2.85Å; R216-E306 IonicContact NH2-OE2 3.71Å; R216-E306 PolarHBondContact NH2-OE2 3.23Å
217	A	97	Very high	97.5	Very high	8 Å²	8	24.9 Å²	24.9	7%	0.066	13%	0.132	C	C	.	.	H	α-helix	trans	-62.8	-48.6	-176.8	0	0	0	0	0	112.7	S128 F155 Y162 V215 T221	S128-A217 WeakPolarHBondContact O-CB 3.45Å; F155-A217 HydrophobicContact CE2-CB 4.24Å; F155-A217 HydrophobicContact CZ-CB 3.79Å; Y162-A217 HydrophobicContact CD1-CB 3.69Å; Y162-A217 HydrophobicContact CD2-CB 3.92Å; Y162-A217 HydrophobicContact CE1-CB 4.25Å; Y162-A217 HydrophobicContact CE2-CB 4.44Å; Y162-A217 HydrophobicContact CG-CB 3.54Å; V215-A217 HydrophobicContact CG1-CB 4.17Å; V215-A217 PolarHBondContact O-N 3.45Å; A217-T221 VanDerWaalsContact O-CB 3.31Å; A217-T221 WeakPolarHBondContact O-CB 3.38Å; A217-T221 PolarHBondContact O-N 3.36Å; A217-T221 PolarHBondContact O-OG1 2.79Å
218	F	97.7	Very high	97.5	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-62.5	-47.5	171.7	-71.6	-44.4	0	0	0	111.5	I125 S128 C130 M151 F155 L210 V215 T221 S222	I125-F218 HydrophobicContact CD1-CD1 4.3Å; I125-F218 HydrophobicContact CD1-CE1 3.75Å; I125-F218 HydrophobicContact CD1-CZ 4.33Å; I125-F218 HydrophobicContact CG2-CE1 4.24Å; S128-F218 VanDerWaalsContact CB-CD1 3.47Å; C130-F218 HydrophobicContact CB-CE1 3.74Å; C130-F218 HydrophobicContact CB-CZ 3.75Å; M151-F218 HydrophobicContact CB-CE2 4.48Å; M151-F218 HydrophobicContact CB-CZ 3.92Å; M151-F218 WeakPolarHBondContact O-CZ 3.46Å; F155-F218 HydrophobicContact CD2-CD2 4.45Å; F155-F218 HydrophobicContact CD2-CE1 4.25Å; F155-F218 AromaticContact CD2-CE2 3.62Å; F155-F218 HydrophobicContact CD2-CE2 3.62Å; F155-F218 AromaticContact CD2-CZ 3.48Å; F155-F218 HydrophobicContact CD2-CZ 3.48Å; F155-F218 VanDerWaalsContact CD2-CZ 3.48Å; F155-F218 HydrophobicContact CE2-CD1 4.35Å; F155-F218 HydrophobicContact CE2-CD2 4.24Å; F155-F218 AromaticContact CE2-CE1 3.88Å; F155-F218 HydrophobicContact CE2-CE1 3.88Å; F155-F218 AromaticContact CE2-CE2 3.77Å; F155-F218 HydrophobicContact CE2-CE2 3.77Å; F155-F218 HydrophobicContact CE2-CG 4.49Å; F155-F218 AromaticContact CE2-CZ 3.56Å; F155-F218 HydrophobicContact CE2-CZ 3.56Å; L210-F218 HydrophobicContact CD2-CB 3.86Å; L210-F218 HydrophobicContact CD2-CD1 3.68Å; L210-F218 HydrophobicContact CD2-CD2 4.36Å; L210-F218 HydrophobicContact CD2-CE1 4.33Å; L210-F218 HydrophobicContact CD2-CG 3.73Å; V215-F218 HydrophobicContact CB-CB 4.42Å; V215-F218 HydrophobicContact CB-CD2 3.81Å; V215-F218 HydrophobicContact CB-CG 4.5Å; V215-F218 HydrophobicContact CG1-CD2 3.83Å; V215-F218 HydrophobicContact CG1-CE2 4.42Å; V215-F218 HydrophobicContact CG1-CG 4.39Å; V215-F218 HydrophobicContact CG2-CD2 4.15Å; V215-F218 PolarHBondContact O-N 3.4Å; F218-T221 PolarHBondContact O-N 3.16Å; F218-S222 VanDerWaalsContact O-CB 3.29Å; F218-S222 WeakPolarHBondContact O-CB 3.28Å; F218-S222 PolarHBondContact O-N 3.18Å; F218-S222 PolarHBondContact O-OG 3.06Å
219	R	98.1	Very high	97.5	Very high	24 Å²	24	25.4 Å²	25.4	9%	0.091	13%	0.131	C	C	.	.	H	α-helix	trans	-65.2	-43.5	-174.2	-172.7	163	78.8	-100.8	2.4	113.6	L210 S211 S213 Q214 V215 R216 S222 T223 D302 I307	L210-R219 WeakPolarHBondContact O-CA 3.27Å; S211-R219 WeakPolarHBondContact O-CD 3.48Å; S211-R219 VanDerWaalsContact O-CG 3.26Å; S211-R219 WeakPolarHBondContact O-CG 3.27Å; S213-R219 WeakPolarHBondContact O-CB 3.44Å; S213-R219 WeakPolarHBondContact O-CD 3.22Å; S213-R219 PolarHBondContact O-NH1 3.45Å; Q214-R219 PolarHBondContact O-NH1 3.19Å; V215-R219 PolarHBondContact O-N 2.89Å; R216-R219 PolarHBondContact O-N 3.19Å; R219-S222 PolarHBondContact O-OG 2.9Å; R219-T223 VanDerWaalsContact O-CB 3.28Å; R219-T223 WeakPolarHBondContact O-CB 3.31Å; R219-T223 PolarHBondContact O-N 3.03Å; R219-T223 PolarHBondContact O-OG1 3.42Å; R219-D302 WeakPolarHBondContact CD-OD2 3.17Å; R219-D302 IonicContact CZ-OD1 3.69Å; R219-D302 IonicContact CZ-OD2 3.78Å; R219-D302 IonicContact NE-OD1 3.64Å; R219-D302 PolarHBondContact NE-OD1 2.84Å; R219-D302 IonicContact NE-OD2 3.38Å; R219-D302 PolarHBondContact NE-OD2 2.78Å; R219-D302 IonicContact NH2-OD1 2.82Å; R219-D302 PolarHBondContact NH2-OD1 2.6Å; R219-D302 IonicContact NH2-OD2 3.66Å; R219-I307 HydrophobicContact CG-CD1 4.23Å
220	H	98.4	Very high	97.6	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-64.8	-49	176	-175.4	179.9	0	0	0	110.8	Y162 R216 T223 L224 E306 I307 I310	Y162-H220 HydrophobicContact CE2-CB 3.96Å; Y162-H220 AromaticContact CE2-ND1 3.52Å; Y162-H220 AromaticContact CZ-ND1 3.64Å; Y162-H220 PolarHBondContact OH-ND1 3.32Å; R216-H220 VanDerWaalsContact O-CB 3.25Å; R216-H220 WeakPolarHBondContact O-CB 3.36Å; R216-H220 PolarHBondContact O-N 3Å; H220-T223 PolarHBondContact O-N 3.18Å; H220-L224 PolarHBondContact O-N 3.27Å; H220-E306 IonicContact CE1-OE2 3.28Å; H220-E306 PolarHBondContact CE1-OE2 3.04Å; H220-E306 IonicContact ND1-OE2 3.08Å; H220-E306 PolarHBondContact ND1-OE2 3.3Å; H220-I307 HydrophobicContact CB-CD1 3.88Å; H220-I307 HydrophobicContact CB-CG1 4.02Å; H220-I310 WeakPolarHBondContact NE2-CD1 3.21Å
221	T	98.4	Very high	97.7	Very high	1 Å²	1	25.1 Å²	25.1	1%	0.006	12%	0.123	C	C	.	.	H	α-helix	trans	-66.9	-43.3	-175.5	-51.3	0	0	0	0	112.4	C127 S128 L164 F178 A217 F218 L224 A225	C127-T221 HydrophobicContact CB-CG2 3.93Å; S128-T221 WeakPolarHBondContact OG-CB 3.49Å; L164-T221 HydrophobicContact CD1-CG2 4.2Å; F178-T221 HydrophobicContact CE1-CG2 4.21Å; F178-T221 HydrophobicContact CE2-CG2 4.5Å; F178-T221 HydrophobicContact CZ-CG2 3.77Å; A217-T221 VanDerWaalsContact O-CB 3.31Å; A217-T221 WeakPolarHBondContact O-CB 3.38Å; A217-T221 PolarHBondContact O-N 3.36Å; A217-T221 PolarHBondContact O-OG1 2.79Å; F218-T221 PolarHBondContact O-N 3.16Å; T221-L224 PolarHBondContact O-N 3.24Å; T221-A225 WeakPolarHBondContact O-CB 3.41Å; T221-A225 PolarHBondContact O-N 3.48Å
222	S	98.4	Very high	97.7	Very high	2 Å²	2	25.3 Å²	25.3	1%	0.014	13%	0.125	C	C	.	.	H	α-helix	trans	-67.9	-37.3	175.5	57.5	0	0	0	0	113	L210 S211 F218 R219 A225 A226	L210-S222 WeakPolarHBondContact CB-OG 3.22Å; L210-S222 PolarHBondContact O-OG 3.29Å; S211-S222 WeakPolarHBondContact CA-OG 3.47Å; S211-S222 PolarHBondContact N-OG 2.79Å; S211-S222 VanDerWaalsContact N-OG 3.13Å; F218-S222 VanDerWaalsContact O-CB 3.29Å; F218-S222 WeakPolarHBondContact O-CB 3.28Å; F218-S222 PolarHBondContact O-N 3.18Å; F218-S222 PolarHBondContact O-OG 3.06Å; R219-S222 PolarHBondContact O-OG 2.9Å; S222-A225 PolarHBondContact O-N 3.27Å; S222-A226 VanDerWaalsContact O-CB 3.24Å; S222-A226 WeakPolarHBondContact O-CB 3.33Å; S222-A226 PolarHBondContact O-N 3.15Å
223	T	98.7	Very high	97.7	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-62.8	-46.8	173.2	-55.5	0	0	0	0	110.6	R219 H220 A225 A226 M227 I295 R299 I307	R219-T223 VanDerWaalsContact O-CB 3.28Å; R219-T223 WeakPolarHBondContact O-CB 3.31Å; R219-T223 PolarHBondContact O-N 3.03Å; R219-T223 PolarHBondContact O-OG1 3.42Å; H220-T223 PolarHBondContact O-N 3.18Å; T223-A225 VanDerWaalsContact C-N 3.31Å; T223-A225 PolarHBondContact O-N 3.41Å; T223-A226 PolarHBondContact O-N 2.88Å; T223-M227 HydrophobicContact CG2-CG 4.18Å; T223-M227 VanDerWaalsContact O-CG 3.3Å; T223-M227 WeakPolarHBondContact O-CG 3.47Å; T223-M227 PolarHBondContact O-N 3.24Å; T223-I295 HydrophobicContact CG2-CG2 4.47Å; T223-R299 HydrophobicContact CG2-CB 3.77Å; T223-R299 HydrophobicContact CG2-CG 4.06Å; T223-R299 WeakPolarHBondContact OG1-CG 3.05Å; T223-I307 HydrophobicContact CG2-CG2 3.9Å
224	L	98.6	Very high	97.8	Very high	5 Å²	5	19.6 Å²	19.6	3%	0.026	9%	0.093	C	C	.	.	H	α-helix	trans	-59.3	-43	176.2	-179.2	59.9	0	0	0	111.7	L164 R175 F178 H220 T221 K228 I310	L164-L224 HydrophobicContact CD1-CB 4.44Å; L164-L224 HydrophobicContact CD1-CD2 3.76Å; L164-L224 HydrophobicContact CD2-CD2 3.82Å; L164-L224 HydrophobicContact CG-CD2 4.48Å; R175-L224 HydrophobicContact CG-CD2 4.26Å; F178-L224 HydrophobicContact CD1-CD2 4.15Å; F178-L224 HydrophobicContact CD1-CG 4.48Å; F178-L224 HydrophobicContact CE1-CD2 4.23Å; F178-L224 HydrophobicContact CE1-CG 4.28Å; H220-L224 PolarHBondContact O-N 3.27Å; T221-L224 PolarHBondContact O-N 3.24Å; L224-K228 HydrophobicContact CD1-CG 4.39Å; L224-K228 WeakPolarHBondContact O-CG 3.43Å; L224-K228 PolarHBondContact O-N 2.93Å; L224-K228 VanDerWaalsContact O-N 3.13Å; L224-I310 HydrophobicContact CB-CD1 4.34Å; L224-I310 HydrophobicContact CB-CG2 4.49Å; L224-I310 HydrophobicContact CD1-CD1 4.18Å; L224-I310 HydrophobicContact CD1-CG1 4.34Å; L224-I310 HydrophobicContact CD1-CG2 3.93Å
225	A	98.6	Very high	97.9	Very high	0 Å²	0	14 Å²	14	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-61.5	-48	175.7	0	0	0	0	0	112.2	F124 F178 I182 L207 T221 S222 T223 K228 L229	F124-A225 HydrophobicContact CD1-CB 4.06Å; F124-A225 HydrophobicContact CE1-CB 3.74Å; F178-A225 HydrophobicContact CE1-CB 4.2Å; F178-A225 HydrophobicContact CZ-CB 3.9Å; I182-A225 HydrophobicContact CD1-CB 3.67Å; L207-A225 HydrophobicContact CD1-CB 4.03Å; L207-A225 HydrophobicContact CD2-CB 3.77Å; T221-A225 WeakPolarHBondContact O-CB 3.41Å; T221-A225 PolarHBondContact O-N 3.48Å; S222-A225 PolarHBondContact O-N 3.27Å; T223-A225 VanDerWaalsContact C-N 3.31Å; T223-A225 PolarHBondContact O-N 3.41Å; A225-K228 PolarHBondContact O-N 3Å; A225-L229 VanDerWaalsContact O-CB 3.26Å; A225-L229 WeakPolarHBondContact O-CB 3.47Å; A225-L229 PolarHBondContact O-N 3.06Å
226	A	98.6	Very high	98	Very high	0 Å²	0	12.4 Å²	12.4	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-64.2	-40.3	-179.4	0	0	0	0	0	113	L207 S222 T223 L229 M230 I291 I295	L207-A226 HydrophobicContact CD1-CB 4.48Å; S222-A226 VanDerWaalsContact O-CB 3.24Å; S222-A226 WeakPolarHBondContact O-CB 3.33Å; S222-A226 PolarHBondContact O-N 3.15Å; T223-A226 PolarHBondContact O-N 2.88Å; A226-L229 WeakPolarHBondContact O-CB 3.45Å; A226-L229 PolarHBondContact O-N 3.31Å; A226-M230 WeakPolarHBondContact O-CB 3.24Å; A226-M230 PolarHBondContact O-N 3.49Å; A226-I291 HydrophobicContact CB-CG2 4.2Å; A226-I295 HydrophobicContact CB-CD1 3.43Å; A226-I295 VanDerWaalsContact CB-CD1 3.43Å; A226-I295 HydrophobicContact CB-CG2 4.07Å
227	M	98.6	Very high	98	Very high	0 Å²	0	8.2 Å²	8.2	0%	0	4%	0.043	C	C	.	.	H	α-helix	trans	-69.5	-35.8	177.1	-58	-59.1	90	0	0	111.1	T223 M230 T231 I291 I295 F296 I310 E314 W318	T223-M227 HydrophobicContact CG2-CG 4.18Å; T223-M227 VanDerWaalsContact O-CG 3.3Å; T223-M227 WeakPolarHBondContact O-CG 3.47Å; T223-M227 PolarHBondContact O-N 3.24Å; M227-M230 WeakPolarHBondContact O-CB 3.36Å; M227-M230 PolarHBondContact O-N 3.05Å; M227-T231 PolarHBondContact O-N 3.49Å; M227-T231 PolarHBondContact O-OG1 3.44Å; M227-I291 HydrophobicContact CE-CG2 3.9Å; M227-I295 HydrophobicContact CE-CB 4.25Å; M227-I295 HydrophobicContact CE-CG2 3.89Å; M227-F296 HydrophobicContact CE-CB 4.14Å; M227-F296 HydrophobicContact SD-CB 4.16Å; M227-F296 HydrophobicContact SD-CD2 3.89Å; M227-I310 HydrophobicContact CB-CG2 4.4Å; M227-I310 HydrophobicContact CG-CG2 4.12Å; M227-E314 HydrophobicContact CB-CB 3.89Å; M227-E314 HydrophobicContact CB-CG 3.7Å; M227-W318 HydrophobicContact CB-CZ2 4.46Å; M227-W318 HydrophobicContact SD-CH2 3.78Å; M227-W318 HydrophobicContact SD-CZ2 4.02Å
228	K	98.3	Very high	98	Very high	49 Å²	49	9.8 Å²	9.8	21%	0.213	5%	0.05	C	C	.	.	H	α-helix	trans	-70.4	-34.3	173.1	-68.1	-69.4	166.2	-159.7	0	113.3	C179 I182 L224 A225 T231 A232 E314	C179-K228 HydrophobicContact CB-CD 3.9Å; C179-K228 HydrophobicContact CB-CG 4.03Å; I182-K228 HydrophobicContact CG2-CB 4.31Å; L224-K228 HydrophobicContact CD1-CG 4.39Å; L224-K228 WeakPolarHBondContact O-CG 3.43Å; L224-K228 PolarHBondContact O-N 2.93Å; L224-K228 VanDerWaalsContact O-N 3.13Å; A225-K228 PolarHBondContact O-N 3Å; K228-T231 PolarHBondContact O-N 2.83Å; K228-A232 PolarHBondContact O-N 2.85Å; K228-A232 VanDerWaalsContact O-N 3.07Å; K228-E314 WeakPolarHBondContact CD-OE2 3.48Å; K228-E314 WeakPolarHBondContact CE-OE2 3.46Å; K228-E314 IonicContact NZ-OE1 2.69Å; K228-E314 PolarHBondContact NZ-OE1 2.93Å; K228-E314 IonicContact NZ-OE2 3.34Å; K228-E314 PolarHBondContact NZ-OE2 3.31Å
229	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	-61.4	-48.6	170.8	178.8	59.1	0	0	0	110.8	I182 I186 M200 V203 I204 L207 A225 A226 A232 L233 I291	I182-L229 HydrophobicContact CG2-CB 4.11Å; I186-L229 HydrophobicContact CD1-CD1 3.38Å; I186-L229 HydrophobicContact CG1-CD1 3.55Å; M200-L229 HydrophobicContact CE-CD1 3.77Å; M200-L229 HydrophobicContact CE-CG 4.48Å; V203-L229 HydrophobicContact CG1-CD2 4.02Å; I204-L229 HydrophobicContact CG1-CD2 3.99Å; L207-L229 HydrophobicContact CD1-CD2 3.83Å; A225-L229 VanDerWaalsContact O-CB 3.26Å; A225-L229 WeakPolarHBondContact O-CB 3.47Å; A225-L229 PolarHBondContact O-N 3.06Å; A226-L229 WeakPolarHBondContact O-CB 3.45Å; A226-L229 PolarHBondContact O-N 3.31Å; L229-A232 PolarHBondContact O-N 2.96Å; L229-A232 VanDerWaalsContact O-N 3.16Å; L229-L233 HydrophobicContact CG-CD1 4.47Å; L229-L233 WeakPolarHBondContact O-CG 3.44Å; L229-L233 PolarHBondContact O-N 2.87Å; L229-I291 HydrophobicContact CB-CD1 4.39Å; L229-I291 HydrophobicContact CD2-CD1 3.77Å; L229-I291 HydrophobicContact CG-CD1 3.74Å
230	M	98.3	Very high	97.7	Very high	2 Å²	2	11.4 Å²	11.4	1%	0.01	6%	0.06	C	C	.	.	H	α-helix	trans	-57.7	-49	173.1	-174.2	71.3	176.7	0	0	111.8	A226 M227 A232 L233 V234 M288 I291 F292 W318 F326	A226-M230 WeakPolarHBondContact O-CB 3.24Å; A226-M230 PolarHBondContact O-N 3.49Å; M227-M230 WeakPolarHBondContact O-CB 3.36Å; M227-M230 PolarHBondContact O-N 3.05Å; M230-A232 PolarHBondContact O-N 2.79Å; M230-L233 PolarHBondContact O-N 2.93Å; M230-V234 HydrophobicContact CE-CG2 4.46Å; M230-V234 WeakPolarHBondContact O-CG2 3.3Å; M230-V234 PolarHBondContact O-N 2.88Å; M230-M288 HydrophobicContact CE-CB 3.76Å; M230-M288 HydrophobicContact CE-CG 4.03Å; M230-M288 HydrophobicContact CE-SD 4.3Å; M230-M288 HydrophobicContact SD-CB 3.73Å; M230-M288 HydrophobicContact SD-CG 3.72Å; M230-I291 HydrophobicContact CB-CG2 4.11Å; M230-I291 HydrophobicContact SD-CB 4.32Å; M230-I291 HydrophobicContact SD-CG2 4.45Å; M230-F292 HydrophobicContact CE-CB 4.36Å; M230-W318 HydrophobicContact CB-CH2 4.38Å; M230-W318 HydrophobicContact CB-CZ2 3.71Å; M230-W318 HydrophobicContact CE-CE3 4.26Å; M230-W318 HydrophobicContact CE-CZ3 4.37Å; M230-W318 HydrophobicContact CG-CD2 3.98Å; M230-W318 VanDerWaalsContact CG-CE2 3.45Å; M230-W318 HydrophobicContact CG-CE3 4.29Å; M230-W318 HydrophobicContact CG-CH2 3.76Å; M230-W318 HydrophobicContact CG-CZ2 3.36Å; M230-W318 HydrophobicContact CG-CZ3 4.19Å; M230-F326 HydrophobicContact CE-CE1 3.94Å; M230-F326 HydrophobicContact CE-CZ 4Å
231	T	98.4	Very high	97.5	Very high	20 Å²	20	13 Å²	13	12%	0.123	7%	0.071	C	C	.	.	H	α-helix	trans	-56.9	-32.8	176.5	-60.8	0	0	0	0	112.7	M227 K228 E314 V317 W318 M321	M227-T231 PolarHBondContact O-N 3.49Å; M227-T231 PolarHBondContact O-OG1 3.44Å; K228-T231 PolarHBondContact O-N 2.83Å; T231-E314 PolarHBondContact OG1-OE2 3.01Å; T231-V317 HydrophobicContact CG2-CG1 3.8Å; T231-W318 PolarHBondContact OG1-NE1 2.86Å; T231-M321 HydrophobicContact CG2-CE 3.8Å
232	A	98	Very high	97.3	Very high	7 Å²	7	16.7 Å²	16.7	6%	0.058	9%	0.09	C	C	.	.	H	α-helix	trans	-76.5	-38.7	174.6	0	0	0	0	0	112.8	I186 K228 L229 M230 N235 V236	I186-A232 HydrophobicContact CB-CB 3.7Å; I186-A232 HydrophobicContact CG1-CB 4.18Å; I186-A232 HydrophobicContact CG2-CB 3.67Å; K228-A232 PolarHBondContact O-N 2.85Å; K228-A232 VanDerWaalsContact O-N 3.07Å; L229-A232 PolarHBondContact O-N 2.96Å; L229-A232 VanDerWaalsContact O-N 3.16Å; M230-A232 PolarHBondContact O-N 2.79Å; A232-N235 WeakPolarHBondContact O-CB 3.38Å; A232-N235 PolarHBondContact O-N 2.98Å; A232-V236 PolarHBondContact O-N 3.22Å; A232-V236 VanDerWaalsContact O-N 3.16Å
233	L	98	Very high	97.1	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-63.9	-39.7	174.7	-70.8	167.7	0	0	0	112.5	I186 I194 M200 L229 M230 N235 V236 A237 I284 M287 M288 I291	I186-L233 HydrophobicContact CG2-CD2 4.4Å; I194-L233 HydrophobicContact CD1-CD2 3.8Å; M200-L233 HydrophobicContact CE-CD1 4.19Å; M200-L233 HydrophobicContact CE-CD2 3.97Å; M200-L233 HydrophobicContact CE-CG 4.43Å; L229-L233 HydrophobicContact CG-CD1 4.47Å; L229-L233 WeakPolarHBondContact O-CG 3.44Å; L229-L233 PolarHBondContact O-N 2.87Å; M230-L233 PolarHBondContact O-N 2.93Å; L233-N235 PolarHBondContact O-N 3.47Å; L233-V236 PolarHBondContact O-N 2.85Å; L233-A237 PolarHBondContact O-N 2.86Å; L233-I284 HydrophobicContact CB-CG2 4.35Å; L233-I284 HydrophobicContact CD2-CD1 3.74Å; L233-I284 HydrophobicContact CD2-CG2 4.27Å; L233-M287 HydrophobicContact CD1-CB 3.9Å; L233-M287 HydrophobicContact CD2-CB 4.45Å; L233-M287 HydrophobicContact CD2-SD 3.96Å; L233-M288 HydrophobicContact CB-CG 3.64Å; L233-M288 HydrophobicContact CB-SD 4.17Å; L233-M288 HydrophobicContact CD1-CG 4.22Å; L233-I291 HydrophobicContact CD1-CD1 3.66Å
234	V	98.1	Very high	96.8	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-58.1	-36.7	174.5	173.3	0	0	0	0	111.6	M230 L238 M288 W318 M321 F326	M230-V234 HydrophobicContact CE-CG2 4.46Å; M230-V234 WeakPolarHBondContact O-CG2 3.3Å; M230-V234 PolarHBondContact O-N 2.88Å; V234-L238 WeakPolarHBondContact O-CB 3.37Å; V234-L238 PolarHBondContact O-N 3.39Å; V234-M288 HydrophobicContact CB-SD 4.43Å; V234-M288 HydrophobicContact CG2-SD 3.7Å; V234-W318 HydrophobicContact CG1-CB 4.48Å; V234-W318 HydrophobicContact CG2-CB 4.22Å; V234-W318 HydrophobicContact CG2-CG 4Å; V234-M321 HydrophobicContact CG1-CB 4.48Å; V234-M321 HydrophobicContact CG1-SD 4.26Å; V234-F326 HydrophobicContact CB-CE2 4.43Å; V234-F326 HydrophobicContact CG1-CD2 4.23Å; V234-F326 HydrophobicContact CG1-CE2 3.97Å; V234-F326 HydrophobicContact CG2-CE1 4.49Å; V234-F326 HydrophobicContact CG2-CE2 3.7Å; V234-F326 HydrophobicContact CG2-CZ 3.69Å
235	N	96.7	Very high	96.5	Very high	49 Å²	49	25.9 Å²	25.9	26%	0.262	14%	0.135	S	C	.	.	H	α-helix	trans	-68.2	-41.7	174.4	-167.9	-30.3	0	0	0	111.6	A232 L233 L238 N239 M321	A232-N235 WeakPolarHBondContact O-CB 3.38Å; A232-N235 PolarHBondContact O-N 2.98Å; L233-N235 PolarHBondContact O-N 3.47Å; N235-L238 PolarHBondContact O-N 2.94Å; N235-N239 VanDerWaalsContact O-CG 3.26Å; N235-N239 PolarHBondContact O-N 3.12Å; N235-N239 PolarHBondContact O-ND2 3.3Å; N235-N239 PolarHBondContact OD1-ND2 3.2Å; N235-M321 HydrophobicContact CB-SD 3.8Å
236	V	96.9	Very high	96.4	Very high	2 Å²	2	28.7 Å²	28.7	1%	0.012	15%	0.15	C	C	.	.	H	α-helix	trans	-62.6	-45.2	174.8	179.4	0	0	0	0	111.2	I186 Q190 I194 A232 L233 L238 N239 L240 I284	I186-V236 HydrophobicContact CG2-CG2 4.32Å; Q190-V236 HydrophobicContact CB-CG1 4.08Å; Q190-V236 HydrophobicContact CB-CG2 3.62Å; I194-V236 HydrophobicContact CD1-CG2 4.45Å; A232-V236 PolarHBondContact O-N 3.22Å; A232-V236 VanDerWaalsContact O-N 3.16Å; L233-V236 PolarHBondContact O-N 2.85Å; V236-L238 PolarHBondContact O-N 3.47Å; V236-N239 PolarHBondContact O-N 2.99Å; V236-L240 HydrophobicContact CG1-CD1 4.13Å; V236-L240 HydrophobicContact CG1-CG 4.36Å; V236-L240 WeakPolarHBondContact O-CB 3.49Å; V236-L240 WeakPolarHBondContact O-CG 3.38Å; V236-L240 PolarHBondContact O-N 3.12Å; V236-I284 HydrophobicContact CB-CD1 4.45Å; V236-I284 HydrophobicContact CG1-CD1 3.87Å; V236-I284 HydrophobicContact CG1-CG1 4.06Å
237	A	96.7	Very high	96.2	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-59.8	-42.3	175.5	0	0	0	0	0	112.3	L233 L240 S241 Q281 I284 M288 Y322	L233-A237 PolarHBondContact O-N 2.86Å; A237-L240 PolarHBondContact O-N 3.4Å; A237-S241 WeakPolarHBondContact O-CB 3.23Å; A237-S241 PolarHBondContact O-N 3.19Å; A237-Q281 PolarHBondContact O-OE1 2.75Å; A237-I284 HydrophobicContact CB-CG2 3.96Å; A237-M288 HydrophobicContact CB-CE 3.87Å; A237-M288 HydrophobicContact CB-SD 4.42Å; A237-Y322 HydrophobicContact CB-CD1 4.44Å; A237-Y322 HydrophobicContact CB-CE1 4.13Å
238	L	96	Very high	95.9	Very high	41 Å²	41	31.2 Å²	31.2	22%	0.215	16%	0.163	C	C	.	.	H	α-helix	trans	-61.9	-44.5	174.3	178.5	62.2	0	0	0	111.8	V234 N235 V236 S241 I242 M321 Y322	V234-L238 WeakPolarHBondContact O-CB 3.37Å; V234-L238 PolarHBondContact O-N 3.39Å; N235-L238 PolarHBondContact O-N 2.94Å; V236-L238 PolarHBondContact O-N 3.47Å; L238-S241 PolarHBondContact O-N 3.21Å; L238-I242 HydrophobicContact CD1-CD1 4.02Å; L238-I242 HydrophobicContact CD1-CG1 4.43Å; L238-I242 HydrophobicContact CG-CD1 3.98Å; L238-I242 WeakPolarHBondContact O-CB 3.16Å; L238-I242 WeakPolarHBondContact O-CD1 3.45Å; L238-I242 VanDerWaalsContact O-CG1 3.25Å; L238-I242 WeakPolarHBondContact O-CG1 3.16Å; L238-I242 PolarHBondContact O-N 3.49Å; L238-M321 HydrophobicContact CD2-CG 4.36Å; L238-Y322 HydrophobicContact CB-CD1 4.11Å; L238-Y322 HydrophobicContact CB-CE1 4.47Å; L238-Y322 HydrophobicContact CB-CG 4.25Å; L238-Y322 HydrophobicContact CD1-CD2 3.78Å; L238-Y322 HydrophobicContact CD1-CE2 4.02Å; L238-Y322 HydrophobicContact CD1-CG 4.1Å
239	N	94.9	Very high	95.7	Very high	46 Å²	46	34.7 Å²	34.7	25%	0.246	17%	0.174	C	C	.	.	H	α-helix	trans	-65.7	-39.3	177.2	-66.3	-39.6	0	0	0	112.2	N235 V236 H243	N235-N239 VanDerWaalsContact O-CG 3.26Å; N235-N239 PolarHBondContact O-N 3.12Å; N235-N239 PolarHBondContact O-ND2 3.3Å; N235-N239 PolarHBondContact OD1-ND2 3.2Å; V236-N239 PolarHBondContact O-N 2.99Å; N239-H243 WeakPolarHBondContact O-CB 3.21Å; N239-H243 PolarHBondContact O-CD2 3.24Å; N239-H243 PolarHBondContact O-N 3.13Å
240	L	94.6	Very high	95.4	Very high	11 Å²	11	38.7 Å²	38.7	6%	0.058	19%	0.193	C	C	.	.	H	α-helix	trans	-62.6	-49.1	174.1	-77.1	174.3	0	0	0	111.2	V236 A237 I242 H243 Q244 L277 N280 I284	V236-L240 HydrophobicContact CG1-CD1 4.13Å; V236-L240 HydrophobicContact CG1-CG 4.36Å; V236-L240 WeakPolarHBondContact O-CB 3.49Å; V236-L240 WeakPolarHBondContact O-CG 3.38Å; V236-L240 PolarHBondContact O-N 3.12Å; A237-L240 PolarHBondContact O-N 3.4Å; L240-I242 PolarHBondContact O-N 3.1Å; L240-H243 CarbonylContact O-C 3.54Å; L240-H243 WeakPolarHBondContact O-CA 3.4Å; L240-H243 WeakPolarHBondContact O-CB 3.46Å; L240-H243 PolarHBondContact O-N 2.85Å; L240-Q244 WeakPolarHBondContact O-CG 3.38Å; L240-Q244 PolarHBondContact O-N 3.36Å; L240-L277 HydrophobicContact CD2-CD2 3.86Å; L240-N280 HydrophobicContact CD1-CB 4.17Å; L240-N280 HydrophobicContact CD2-CB 4.08Å; L240-I284 HydrophobicContact CD1-CB 4.45Å; L240-I284 HydrophobicContact CD1-CG1 3.9Å
241	S	95	Very high	95.1	Very high	33 Å²	33	40.3 Å²	40.3	23%	0.231	20%	0.199	C	C	.	.	H	α-helix	trans	-55.4	-50	174.8	-177.6	0	0	0	0	111.6	A237 L238 H243 Q244 D245 Y322	A237-S241 WeakPolarHBondContact O-CB 3.23Å; A237-S241 PolarHBondContact O-N 3.19Å; L238-S241 PolarHBondContact O-N 3.21Å; S241-H243 VanDerWaalsContact C-N 3.25Å; S241-H243 PolarHBondContact O-N 2.93Å; S241-Q244 WeakPolarHBondContact O-CB 3.18Å; S241-Q244 PolarHBondContact O-N 2.96Å; S241-Q244 VanDerWaalsContact O-N 3.14Å; S241-D245 WeakPolarHBondContact O-CB 3.37Å; S241-D245 PolarHBondContact O-N 3.32Å; S241-Y322 WeakPolarHBondContact CB-OH 3.47Å; S241-Y322 PolarHBondContact OG-OH 3.25Å; S241-Y322 VanDerWaalsContact OG-OH 3.13Å
242	I	94.5	Very high	94.9	Very high	79 Å²	79	43 Å²	43	41%	0.405	21%	0.211	S	C	.	.	H	α-helix	trans	-58	-37.1	174.6	-68.8	165.9	0	0	0	111.5	L238 L240 N246	L238-I242 HydrophobicContact CD1-CD1 4.02Å; L238-I242 HydrophobicContact CD1-CG1 4.43Å; L238-I242 HydrophobicContact CG-CD1 3.98Å; L238-I242 WeakPolarHBondContact O-CB 3.16Å; L238-I242 WeakPolarHBondContact O-CD1 3.45Å; L238-I242 VanDerWaalsContact O-CG1 3.25Å; L238-I242 WeakPolarHBondContact O-CG1 3.16Å; L238-I242 PolarHBondContact O-N 3.49Å; L240-I242 PolarHBondContact O-N 3.1Å; I242-N246 WeakPolarHBondContact CG2-ND2 3.27Å; I242-N246 WeakPolarHBondContact O-CB 3.49Å; I242-N246 PolarHBondContact O-N 3.28Å; I242-N246 VanDerWaalsContact O-N 3.09Å; I242-N246 PolarHBondContact O-ND2 3.02Å
243	H	93.4	Very high	94.6	Very high	81 Å²	81	45.7 Å²	45.7	38%	0.375	23%	0.233	S	C	.	.	H	α-helix	trans	-73.7	-35.9	176	-76.5	-41.5	0	0	0	113.9	N239 L240 S241 T247 L277	N239-H243 WeakPolarHBondContact O-CB 3.21Å; N239-H243 PolarHBondContact O-CD2 3.24Å; N239-H243 PolarHBondContact O-N 3.13Å; L240-H243 CarbonylContact O-C 3.54Å; L240-H243 WeakPolarHBondContact O-CA 3.4Å; L240-H243 WeakPolarHBondContact O-CB 3.46Å; L240-H243 PolarHBondContact O-N 2.85Å; S241-H243 VanDerWaalsContact C-N 3.25Å; S241-H243 PolarHBondContact O-N 2.93Å; H243-T247 VanDerWaalsContact O-CB 3.3Å; H243-T247 WeakPolarHBondContact O-CB 3.42Å; H243-T247 PolarHBondContact O-N 3.03Å; H243-T247 PolarHBondContact O-OG1 3.08Å; H243-L277 HydrophobicContact CB-CD1 4.18Å; H243-L277 HydrophobicContact CB-CD2 4.22Å
244	Q	92.4	Very high	94.2	Very high	36 Å²	36	45.9 Å²	45.9	17%	0.168	23%	0.234	C	C	.	.	H	α-helix	trans	-59.8	-49.4	171.3	-71.9	179.6	2.9	0	0	109.6	L240 S241 N246 T247 Q248 L277 Q281	L240-Q244 WeakPolarHBondContact O-CG 3.38Å; L240-Q244 PolarHBondContact O-N 3.36Å; S241-Q244 WeakPolarHBondContact O-CB 3.18Å; S241-Q244 PolarHBondContact O-N 2.96Å; S241-Q244 VanDerWaalsContact O-N 3.14Å; Q244-N246 PolarHBondContact O-N 3Å; Q244-T247 CarbonylContact O-C 3.51Å; Q244-T247 WeakPolarHBondContact O-CA 3.32Å; Q244-T247 WeakPolarHBondContact O-CB 3.28Å; Q244-T247 PolarHBondContact O-N 3.2Å; Q244-Q248 WeakPolarHBondContact O-CB 3.46Å; Q244-Q248 PolarHBondContact O-N 3.3Å; Q244-L277 HydrophobicContact CG-CB 3.8Å; Q244-L277 PolarHBondContact NE2-O 2.79Å; Q244-Q281 VanDerWaalsContact NE2-CB 3.3Å
245	D	93.2	Very high	93.8	Very high	83 Å²	83	52 Å²	52	44%	0.444	26%	0.257	S	S	.	.	H	α-helix	trans	-60	-45.9	-178.4	-140.2	52.6	0	0	0	112.8	S241 T247 Q248 R249	S241-D245 WeakPolarHBondContact O-CB 3.37Å; S241-D245 PolarHBondContact O-N 3.32Å; D245-T247 VanDerWaalsContact C-N 3.29Å; D245-T247 PolarHBondContact O-N 2.89Å; D245-Q248 PolarHBondContact O-N 2.91Å; D245-R249 WeakPolarHBondContact O-CB 3.18Å; D245-R249 WeakPolarHBondContact O-CG 3.19Å; D245-R249 PolarHBondContact O-N 2.93Å; D245-R249 PolarHBondContact O-NE 3.41Å; D245-R249 IonicContact OD2-CZ 3.61Å; D245-R249 IonicContact OD2-NE 2.77Å; D245-R249 PolarHBondContact OD2-NE 3.03Å; D245-R249 IonicContact OD2-NH2 2.66Å; D245-R249 PolarHBondContact OD2-NH2 3.26Å
246	N	95	Very high	93.5	Very high	59 Å²	59	55.9 Å²	55.9	32%	0.316	28%	0.277	S	S	.	.	H	α-helix	trans	-66.9	-29.1	174	-78.4	-60.5	0	0	0	112.7	I242 Q244 R249 Q250	I242-N246 WeakPolarHBondContact CG2-ND2 3.27Å; I242-N246 WeakPolarHBondContact O-CB 3.49Å; I242-N246 PolarHBondContact O-N 3.28Å; I242-N246 VanDerWaalsContact O-N 3.09Å; I242-N246 PolarHBondContact O-ND2 3.02Å; Q244-N246 PolarHBondContact O-N 3Å; N246-R249 PolarHBondContact OD1-NH1 3.43Å; N246-Q250 VanDerWaalsContact O-CG 3.28Å; N246-Q250 WeakPolarHBondContact O-CG 3.48Å; N246-Q250 PolarHBondContact O-N 3.45Å; N246-Q250 PolarHBondContact O-NE2 2.95Å; N246-Q250 VanDerWaalsContact O-NE2 3.14Å
247	T	94.3	Very high	93.2	Very high	6 Å²	6	59.5 Å²	59.5	4%	0.037	29%	0.293	C	S	.	.	H	α-helix	trans	-77.8	-38.9	175.8	-57.7	0	0	0	0	111.1	H243 Q244 D245 Q250 Y251 L270 K273 R274	H243-T247 VanDerWaalsContact O-CB 3.3Å; H243-T247 WeakPolarHBondContact O-CB 3.42Å; H243-T247 PolarHBondContact O-N 3.03Å; H243-T247 PolarHBondContact O-OG1 3.08Å; Q244-T247 CarbonylContact O-C 3.51Å; Q244-T247 WeakPolarHBondContact O-CA 3.32Å; Q244-T247 WeakPolarHBondContact O-CB 3.28Å; Q244-T247 PolarHBondContact O-N 3.2Å; D245-T247 VanDerWaalsContact C-N 3.29Å; D245-T247 PolarHBondContact O-N 2.89Å; T247-Q250 PolarHBondContact O-N 3.38Å; T247-Y251 WeakPolarHBondContact O-CB 3.46Å; T247-Y251 PolarHBondContact O-N 2.9Å; T247-L270 HydrophobicContact CG2-CD2 4.06Å; T247-K273 HydrophobicContact CG2-CG 4.37Å; T247-R274 HydrophobicContact CG2-CB 4.15Å
248	Q	93	Very high	92.5	Very high	48 Å²	48	66.6 Å²	66.6	22%	0.224	33%	0.328	C	S	.	.	H	α-helix	trans	-62.7	-48.6	174.5	-179.8	62.6	22.5	0	0	111	Q244 D245 Q250 Y251 E252 R274	Q244-Q248 WeakPolarHBondContact O-CB 3.46Å; Q244-Q248 PolarHBondContact O-N 3.3Å; D245-Q248 PolarHBondContact O-N 2.91Å; Q248-Q250 VanDerWaalsContact C-N 3.29Å; Q248-Q250 PolarHBondContact O-N 3.35Å; Q248-Y251 WeakPolarHBondContact O-CB 3.22Å; Q248-Y251 PolarHBondContact O-N 3.1Å; Q248-Y251 VanDerWaalsContact O-N 3.13Å; Q248-E252 PolarHBondContact NE2-OE1 2.67Å; Q248-E252 WeakPolarHBondContact O-CG 3.33Å; Q248-E252 PolarHBondContact O-N 3Å; Q248-R274 VanDerWaalsContact OE1-CD 3.22Å
249	R	94.3	Very high	91.5	Very high	122 Å²	122	71.5 Å²	71.5	46%	0.46	35%	0.353	S	S	.	.	H	α-helix	trans	-60.5	-35.6	174.6	-75.4	-178.8	-94.5	115.9	-4.2	112.6	D245 N246 A253	D245-R249 WeakPolarHBondContact O-CB 3.18Å; D245-R249 WeakPolarHBondContact O-CG 3.19Å; D245-R249 PolarHBondContact O-N 2.93Å; D245-R249 PolarHBondContact O-NE 3.41Å; D245-R249 IonicContact OD2-CZ 3.61Å; D245-R249 IonicContact OD2-NE 2.77Å; D245-R249 PolarHBondContact OD2-NE 3.03Å; D245-R249 IonicContact OD2-NH2 2.66Å; D245-R249 PolarHBondContact OD2-NH2 3.26Å; N246-R249 PolarHBondContact OD1-NH1 3.43Å; R249-A253 VanDerWaalsContact O-CB 3.26Å; R249-A253 WeakPolarHBondContact O-CB 3.43Å; R249-A253 PolarHBondContact O-N 3.34Å
250	Q	92.1	Very high	90.4	Very high	88 Å²	88	73.2 Å²	73.2	41%	0.411	38%	0.381	S	S	.	.	H	α-helix	trans	-68.9	-41	172.5	-78.7	176.4	65.9	0	0	113.1	N246 T247 Q248 A253 E254 L270	N246-Q250 VanDerWaalsContact O-CG 3.28Å; N246-Q250 WeakPolarHBondContact O-CG 3.48Å; N246-Q250 PolarHBondContact O-N 3.45Å; N246-Q250 PolarHBondContact O-NE2 2.95Å; N246-Q250 VanDerWaalsContact O-NE2 3.14Å; T247-Q250 PolarHBondContact O-N 3.38Å; Q248-Q250 VanDerWaalsContact C-N 3.29Å; Q248-Q250 PolarHBondContact O-N 3.35Å; Q250-A253 PolarHBondContact O-N 3.09Å; Q250-E254 WeakPolarHBondContact O-CB 3.4Å; Q250-E254 PolarHBondContact O-N 2.69Å; Q250-L270 HydrophobicContact CB-CD1 4.29Å; Q250-L270 HydrophobicContact CB-CD2 4.13Å
251	Y	92.5	Very high	89.5	Confident	35 Å²	35	80.5 Å²	80.5	14%	0.137	41%	0.412	C	S	.	.	H	α-helix	trans	-61.4	-46.4	175.8	171.6	-101.4	0	0	0	111.1	T247 Q248 E254 R255 L267 L270 L271	T247-Y251 WeakPolarHBondContact O-CB 3.46Å; T247-Y251 PolarHBondContact O-N 2.9Å; Q248-Y251 WeakPolarHBondContact O-CB 3.22Å; Q248-Y251 PolarHBondContact O-N 3.1Å; Q248-Y251 VanDerWaalsContact O-N 3.13Å; Y251-E254 PolarHBondContact O-N 2.82Å; Y251-R255 WeakPolarHBondContact O-CB 3.38Å; Y251-R255 PolarHBondContact O-N 3.38Å; Y251-L267 HydrophobicContact CD2-CD2 3.52Å; Y251-L267 HydrophobicContact CE2-CB 4.21Å; Y251-L267 HydrophobicContact CE2-CD2 3.55Å; Y251-L267 HydrophobicContact CE2-CG 4.47Å; Y251-L267 HydrophobicContact CG-CD2 4.36Å; Y251-L267 WeakPolarHBondContact O-CD2 3.44Å; Y251-L270 HydrophobicContact CD2-CB 4.29Å; Y251-L271 HydrophobicContact CD2-CD2 4.18Å; Y251-L271 HydrophobicContact CD2-CG 3.9Å; Y251-L271 HydrophobicContact CE1-CD2 4.38Å; Y251-L271 HydrophobicContact CE2-CD1 3.7Å; Y251-L271 HydrophobicContact CE2-CD2 3.68Å; Y251-L271 HydrophobicContact CE2-CG 3.41Å; Y251-L271 VanDerWaalsContact CE2-CG 3.41Å
252	E	92.8	Very high	89	Confident	78 Å²	78	83.1 Å²	83.1	36%	0.364	42%	0.417	S	S	.	.	H	α-helix	trans	-64.1	-43.7	176.2	-71.5	175.5	-174.9	0	0	112.4	Q248 E254 R255 N256	Q248-E252 PolarHBondContact NE2-OE1 2.67Å; Q248-E252 WeakPolarHBondContact O-CG 3.33Å; Q248-E252 PolarHBondContact O-N 3Å; E252-E254 VanDerWaalsContact C-N 3.3Å; E252-E254 PolarHBondContact O-N 3.01Å; E252-R255 PolarHBondContact O-N 3.47Å; E252-N256 VanDerWaalsContact O-CB 3.28Å; E252-N256 WeakPolarHBondContact O-CB 3.4Å; E252-N256 PolarHBondContact O-N 3.27Å; E252-N256 PolarHBondContact O-ND2 3.26Å
253	A	92.3	Very high	88.7	Confident	63 Å²	63	81.4 Å²	81.4	52%	0.521	42%	0.415	S	S	.	.	H	α-helix	trans	-62.6	-34.1	176.6	0	0	0	0	0	113.1	R249 Q250	R249-A253 VanDerWaalsContact O-CB 3.26Å; R249-A253 WeakPolarHBondContact O-CB 3.43Å; R249-A253 PolarHBondContact O-N 3.34Å; Q250-A253 PolarHBondContact O-N 3.09Å
254	E	89.9	Confident	88.3	Confident	4 Å²	4	82.9 Å²	82.9	2%	0.019	43%	0.426	C	S	.	.	H	α-helix	trans	-76.4	-37.5	173.3	-168.1	66.2	-127.6	0	0	111.6	Q250 Y251 E252 K257 A263 R266 L267 L270	Q250-E254 WeakPolarHBondContact O-CB 3.4Å; Q250-E254 PolarHBondContact O-N 2.69Å; Y251-E254 PolarHBondContact O-N 2.82Å; E252-E254 VanDerWaalsContact C-N 3.3Å; E252-E254 PolarHBondContact O-N 3.01Å; E254-K257 PolarHBondContact O-N 2.7Å; E254-K257 WeakPolarHBondContact OE1-CD 3.47Å; E254-K257 WeakPolarHBondContact OE1-CE 3.43Å; E254-K257 IonicContact OE1-NZ 3.74Å; E254-K257 PolarHBondContact OE1-NZ 2.9Å; E254-K257 WeakPolarHBondContact OE2-CE 3.26Å; E254-K257 IonicContact OE2-NZ 2.75Å; E254-K257 PolarHBondContact OE2-NZ 2.66Å; E254-A263 PolarHBondContact OE1-N 3.41Å; E254-R266 HydrophobicContact CG-CB 4.45Å; E254-R266 HydrophobicContact CG-CG 4.45Å; E254-R266 WeakPolarHBondContact OE2-CD 3.29Å; E254-R266 IonicContact OE2-CZ 3.68Å; E254-R266 IonicContact OE2-NE 3.68Å; E254-R266 IonicContact OE2-NH1 2.67Å; E254-R266 PolarHBondContact OE2-NH1 2.74Å; E254-L267 HydrophobicContact CB-CD2 3.76Å; E254-L267 HydrophobicContact CB-CG 4.29Å; E254-L267 HydrophobicContact CG-CD2 3.92Å; E254-L267 HydrophobicContact CG-CG 3.87Å; E254-L270 HydrophobicContact CB-CD1 4.44Å
255	R	89.3	Confident	88	Confident	129 Å²	129	89.1 Å²	89.1	49%	0.487	46%	0.455	S	S	.	.	H	α-helix	trans	-66.2	-41.1	179.6	-178.2	-179.1	179.1	-164.6	1	111.4	Y251 E252 K257 R262 L267	Y251-R255 WeakPolarHBondContact O-CB 3.38Å; Y251-R255 PolarHBondContact O-N 3.38Å; E252-R255 PolarHBondContact O-N 3.47Å; R255-K257 PolarHBondContact O-N 3.01Å; R255-R262 VanDerWaalsContact O-CZ 3.26Å; R255-R262 PolarHBondContact O-NE 3.49Å; R255-R262 VanDerWaalsContact O-NE 3.1Å; R255-R262 PolarHBondContact O-NH2 2.93Å; R255-L267 HydrophobicContact CB-CD2 3.97Å
256	N	90.8	Very high	87.8	Confident	129 Å²	129	90.7 Å²	90.7	69%	0.69	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-3.4	-176.3	-66.9	-15.8	0	0	0	113.6	E252	E252-N256 VanDerWaalsContact O-CB 3.28Å; E252-N256 WeakPolarHBondContact O-CB 3.4Å; E252-N256 PolarHBondContact O-N 3.27Å; E252-N256 PolarHBondContact O-ND2 3.26Å
257	K	90.8	Very high	87.5	Confident	79 Å²	79	88.7 Å²	88.7	34%	0.343	44%	0.444	S	S	.	.	S	Bend	trans	-64.9	147.4	169	-63.5	-175.9	-169.3	168.5	0	111.7	E254 R255 K261 R262	E254-K257 PolarHBondContact O-N 2.7Å; E254-K257 WeakPolarHBondContact OE1-CD 3.47Å; E254-K257 WeakPolarHBondContact OE1-CE 3.43Å; E254-K257 IonicContact OE1-NZ 3.74Å; E254-K257 PolarHBondContact OE1-NZ 2.9Å; E254-K257 WeakPolarHBondContact OE2-CE 3.26Å; E254-K257 IonicContact OE2-NZ 2.75Å; E254-K257 PolarHBondContact OE2-NZ 2.66Å; R255-K257 PolarHBondContact O-N 3.01Å; K257-K261 WeakPolarHBondContact CD-O 3.24Å; K257-R262 HydrophobicContact CB-CB 4.41Å; K257-R262 PolarHBondContact O-NH2 3.3Å
258	M	82.4	Confident	87.3	Confident	149 Å²	149	95.2 Å²	95.2	73%	0.734	47%	0.474	S	S	*	.			trans	-53.3	142.9	170.1	-56.1	-177	94.5	0	0	110.5	G260 K261 R262	M258-G260 VanDerWaalsContact C-N 3.27Å; M258-G260 PolarHBondContact O-N 3.47Å; M258-G260 VanDerWaalsContact O-N 3.1Å; M258-K261 WeakPolarHBondContact O-CA 3.5Å; M258-K261 PolarHBondContact O-N 3.04Å; M258-R262 PolarHBondContact O-N 2.85Å
259	I	74.3	Confident	87.3	Confident	143 Å²	143	98.9 Å²	98.9	73%	0.733	49%	0.494	S	S	*	.	G	3₁₀ helix	trans	-53.2	-40.5	-168.6	-62.8	169.2	0	0	0	112.8	K261	I259-K261 PolarHBondContact O-N 3.38Å
260	G	71.9	Confident	87.2	Confident	82 Å²	82	93.8 Å²	93.8	85%	0.845	48%	0.476	S	S	*	.	G	3₁₀ helix	trans	-76.8	5.1	176.9	0	0	0	0	0	116.4	M258	M258-G260 VanDerWaalsContact C-N 3.27Å; M258-G260 PolarHBondContact O-N 3.47Å; M258-G260 VanDerWaalsContact O-N 3.1Å
261	K	75.8	Confident	87.2	Confident	164 Å²	164	92.8 Å²	92.8	71%	0.713	47%	0.473	S	S	*	.	G	3₁₀ helix	trans	-129.8	6.2	177.4	-67.6	-173.9	177.9	179.7	0	113.2	K257 M258 I259	K257-K261 WeakPolarHBondContact CD-O 3.24Å; M258-K261 WeakPolarHBondContact O-CA 3.5Å; M258-K261 PolarHBondContact O-N 3.04Å; I259-K261 PolarHBondContact O-N 3.38Å
262	R	84.7	Confident	87.3	Confident	88 Å²	88	95.4 Å²	95.4	33%	0.332	49%	0.487	S	S	.	.			trans	-89.2	124.4	-179	178.1	-173.2	-69.2	164	0.4	109.8	R255 K257 M258 N264 L267	R255-R262 VanDerWaalsContact O-CZ 3.26Å; R255-R262 PolarHBondContact O-NE 3.49Å; R255-R262 VanDerWaalsContact O-NE 3.1Å; R255-R262 PolarHBondContact O-NH2 2.93Å; K257-R262 HydrophobicContact CB-CB 4.41Å; K257-R262 PolarHBondContact O-NH2 3.3Å; M258-R262 PolarHBondContact O-N 2.85Å; R262-N264 WeakPolarHBondContact CD-OD1 3.48Å; R262-N264 PolarHBondContact O-N 3.27Å; R262-L267 HydrophobicContact CG-CD1 3.52Å
263	A	87.2	Confident	87.3	Confident	44 Å²	44	96.4 Å²	96.4	36%	0.364	49%	0.49	S	S	.	.			trans	-86.6	98.1	173.5	0	0	0	0	0	110.3	E254 E265 R266 L267	E254-A263 PolarHBondContact OE1-N 3.41Å; A263-E265 PolarHBondContact O-N 3.28Å; A263-R266 HydrophobicContact CB-CB 3.76Å; A263-R266 WeakPolarHBondContact O-CB 3.47Å; A263-R266 PolarHBondContact O-N 2.85Å; A263-R266 VanDerWaalsContact O-N 3.13Å; A263-L267 PolarHBondContact O-N 3.42Å; A263-L267 VanDerWaalsContact O-N 3.1Å
264	N	84.6	Confident	87.2	Confident	111 Å²	111	98.1 Å²	98.1	59%	0.594	48%	0.483	S	S	*	.	H	α-helix	trans	-62	-42.2	-177.7	-71.2	-13	0	0	0	112.6	R262 R266 L267 E268	R262-N264 WeakPolarHBondContact CD-OD1 3.48Å; R262-N264 PolarHBondContact O-N 3.27Å; N264-R266 PolarHBondContact O-N 3.05Å; N264-L267 WeakPolarHBondContact O-CB 3.47Å; N264-L267 PolarHBondContact O-N 3.16Å; N264-E268 PolarHBondContact O-N 3.09Å
265	E	87.4	Confident	87.4	Confident	168 Å²	168	102.9 Å²	102.9	79%	0.785	50%	0.503	S	S	*	.	H	α-helix	trans	-56.6	-37.5	174.1	-63.7	169.2	-178.4	0	0	111.8	A263 E268 L269	A263-E265 PolarHBondContact O-N 3.28Å; E265-E268 PolarHBondContact O-N 2.9Å; E265-L269 WeakPolarHBondContact O-CB 3.26Å; E265-L269 PolarHBondContact O-N 2.7Å
266	R	88.7	Confident	87.6	Confident	115 Å²	115	101 Å²	101	43%	0.434	50%	0.5	S	S	.	.	H	α-helix	trans	-71	-33.8	176.3	-171.2	178.6	-179.5	-154.6	5.3	112.1	E254 A263 N264 L270	E254-R266 HydrophobicContact CG-CB 4.45Å; E254-R266 HydrophobicContact CG-CG 4.45Å; E254-R266 WeakPolarHBondContact OE2-CD 3.29Å; E254-R266 IonicContact OE2-CZ 3.68Å; E254-R266 IonicContact OE2-NE 3.68Å; E254-R266 IonicContact OE2-NH1 2.67Å; E254-R266 PolarHBondContact OE2-NH1 2.74Å; A263-R266 HydrophobicContact CB-CB 3.76Å; A263-R266 WeakPolarHBondContact O-CB 3.47Å; A263-R266 PolarHBondContact O-N 2.85Å; A263-R266 VanDerWaalsContact O-N 3.13Å; N264-R266 PolarHBondContact O-N 3.05Å; R266-L270 HydrophobicContact CG-CD1 4.04Å; R266-L270 HydrophobicContact CG-CG 4.45Å; R266-L270 VanDerWaalsContact O-CB 3.31Å; R266-L270 WeakPolarHBondContact O-CB 3.41Å; R266-L270 WeakPolarHBondContact O-CD1 3.37Å; R266-L270 WeakPolarHBondContact O-CG 3.14Å; R266-L270 PolarHBondContact O-N 3.45Å
267	L	88.4	Confident	87.7	Confident	17 Å²	17	95.7 Å²	95.7	9%	0.089	47%	0.472	C	S	.	.	H	α-helix	trans	-67.5	-40.2	174.2	-75	169.7	0	0	0	111.9	Y251 E254 R255 R262 A263 N264 L270 L271	Y251-L267 HydrophobicContact CD2-CD2 3.52Å; Y251-L267 HydrophobicContact CE2-CB 4.21Å; Y251-L267 HydrophobicContact CE2-CD2 3.55Å; Y251-L267 HydrophobicContact CE2-CG 4.47Å; Y251-L267 HydrophobicContact CG-CD2 4.36Å; Y251-L267 WeakPolarHBondContact O-CD2 3.44Å; E254-L267 HydrophobicContact CB-CD2 3.76Å; E254-L267 HydrophobicContact CB-CG 4.29Å; E254-L267 HydrophobicContact CG-CD2 3.92Å; E254-L267 HydrophobicContact CG-CG 3.87Å; R255-L267 HydrophobicContact CB-CD2 3.97Å; R262-L267 HydrophobicContact CG-CD1 3.52Å; A263-L267 PolarHBondContact O-N 3.42Å; A263-L267 VanDerWaalsContact O-N 3.1Å; N264-L267 WeakPolarHBondContact O-CB 3.47Å; N264-L267 PolarHBondContact O-N 3.16Å; L267-L270 PolarHBondContact O-N 2.85Å; L267-L271 WeakPolarHBondContact O-CB 3.31Å; L267-L271 WeakPolarHBondContact O-CG 3.35Å; L267-L271 PolarHBondContact O-N 3.48Å
268	E	91.2	Very high	87.9	Confident	144 Å²	144	95.9 Å²	95.9	67%	0.673	47%	0.474	S	S	*	.	H	α-helix	trans	-64.6	-46	175.5	-171.6	166.1	-157.9	0	0	111.2	N264 E265 L270 L271 Q272	N264-E268 PolarHBondContact O-N 3.09Å; E265-E268 PolarHBondContact O-N 2.9Å; E268-L270 PolarHBondContact O-N 3.36Å; E268-L271 PolarHBondContact O-N 2.7Å; E268-Q272 WeakPolarHBondContact O-CB 3.49Å; E268-Q272 PolarHBondContact O-N 2.91Å
269	L	92.4	Very high	88.5	Confident	125 Å²	125	93.1 Å²	93.1	65%	0.654	46%	0.459	S	S	*	.	H	α-helix	trans	-64.4	-37	176.1	-153	163.4	0	0	0	112.1	E265 K273	E265-L269 WeakPolarHBondContact O-CB 3.26Å; E265-L269 PolarHBondContact O-N 2.7Å; L269-K273 WeakPolarHBondContact O-CB 3.19Å; L269-K273 PolarHBondContact O-N 2.9Å
270	L	92.4	Very high	89.4	Confident	14 Å²	14	88.7 Å²	88.7	7%	0.073	44%	0.437	C	S	.	.	H	α-helix	trans	-69.9	-34.9	173.4	-75.3	167.6	0	0	0	112.9	T247 Q250 Y251 E254 R266 L267 E268 R274	T247-L270 HydrophobicContact CG2-CD2 4.06Å; Q250-L270 HydrophobicContact CB-CD1 4.29Å; Q250-L270 HydrophobicContact CB-CD2 4.13Å; Y251-L270 HydrophobicContact CD2-CB 4.29Å; E254-L270 HydrophobicContact CB-CD1 4.44Å; R266-L270 HydrophobicContact CG-CD1 4.04Å; R266-L270 HydrophobicContact CG-CG 4.45Å; R266-L270 VanDerWaalsContact O-CB 3.31Å; R266-L270 WeakPolarHBondContact O-CB 3.41Å; R266-L270 WeakPolarHBondContact O-CD1 3.37Å; R266-L270 WeakPolarHBondContact O-CG 3.14Å; R266-L270 PolarHBondContact O-N 3.45Å; L267-L270 PolarHBondContact O-N 2.85Å; E268-L270 PolarHBondContact O-N 3.36Å; L270-R274 WeakPolarHBondContact O-CB 3.24Å; L270-R274 PolarHBondContact O-N 3.43Å
271	L	92	Very high	90.5	Very high	67 Å²	67	85.1 Å²	85.1	35%	0.351	40%	0.398	S	S	.	.	H	α-helix	trans	-67.3	-45.2	173	-78.9	166.6	0	0	0	111.6	Y251 L267 E268 R274 K275	Y251-L271 HydrophobicContact CD2-CD2 4.18Å; Y251-L271 HydrophobicContact CD2-CG 3.9Å; Y251-L271 HydrophobicContact CE1-CD2 4.38Å; Y251-L271 HydrophobicContact CE2-CD1 3.7Å; Y251-L271 HydrophobicContact CE2-CD2 3.68Å; Y251-L271 HydrophobicContact CE2-CG 3.41Å; Y251-L271 VanDerWaalsContact CE2-CG 3.41Å; L267-L271 WeakPolarHBondContact O-CB 3.31Å; L267-L271 WeakPolarHBondContact O-CG 3.35Å; L267-L271 PolarHBondContact O-N 3.48Å; E268-L271 PolarHBondContact O-N 2.7Å; L271-R274 PolarHBondContact O-N 2.96Å; L271-K275 PolarHBondContact O-N 3.02Å
272	Q	93.6	Very high	91.4	Very high	91 Å²	91	80.8 Å²	80.8	43%	0.425	38%	0.383	S	S	.	.	H	α-helix	trans	-60.2	-49	176.3	176.7	55.2	30	0	0	110.8	E268 R274 K275 E276	E268-Q272 WeakPolarHBondContact O-CB 3.49Å; E268-Q272 PolarHBondContact O-N 2.91Å; Q272-R274 VanDerWaalsContact C-N 3.3Å; Q272-R274 PolarHBondContact O-N 3.09Å; Q272-K275 WeakPolarHBondContact O-CA 3.4Å; Q272-K275 WeakPolarHBondContact O-CB 3.18Å; Q272-K275 PolarHBondContact O-N 2.96Å; Q272-E276 WeakPolarHBondContact CG-OE1 3.13Å; Q272-E276 PolarHBondContact NE2-OE1 3Å; Q272-E276 WeakPolarHBondContact O-CG 3.35Å; Q272-E276 PolarHBondContact O-N 3.23Å
273	K	93.1	Very high	91.9	Very high	99 Å²	99	79.9 Å²	79.9	43%	0.43	38%	0.383	S	S	.	.	H	α-helix	trans	-60.5	-36.5	174.7	180	167.6	-180	169.2	0	113.1	T247 L269 K275 L277	T247-K273 HydrophobicContact CG2-CG 4.37Å; L269-K273 WeakPolarHBondContact O-CB 3.19Å; L269-K273 PolarHBondContact O-N 2.9Å; K273-K275 VanDerWaalsContact C-N 3.32Å; K273-L277 HydrophobicContact CG-CD1 4.13Å; K273-L277 HydrophobicContact CG-CG 4.44Å; K273-L277 WeakPolarHBondContact O-CB 3.4Å; K273-L277 VanDerWaalsContact O-CG 3.31Å; K273-L277 WeakPolarHBondContact O-CG 3.14Å; K273-L277 PolarHBondContact O-N 3.13Å
274	R	91	Very high	92.4	Very high	99 Å²	99	77.8 Å²	77.8	37%	0.374	37%	0.365	S	S	.	.	H	α-helix	trans	-68.4	-32.5	175.7	-164.3	-167.7	69.7	161.5	9.8	111.8	T247 Q248 L270 L271 Q272 Q278	T247-R274 HydrophobicContact CG2-CB 4.15Å; Q248-R274 VanDerWaalsContact OE1-CD 3.22Å; L270-R274 WeakPolarHBondContact O-CB 3.24Å; L270-R274 PolarHBondContact O-N 3.43Å; L271-R274 PolarHBondContact O-N 2.96Å; Q272-R274 VanDerWaalsContact C-N 3.3Å; Q272-R274 PolarHBondContact O-N 3.09Å; R274-Q278 PolarHBondContact O-N 2.91Å; R274-Q278 VanDerWaalsContact O-N 3.13Å
275	K	93.9	Very high	92.8	Very high	103 Å²	103	76.4 Å²	76.4	45%	0.448	36%	0.355	S	S	.	.	H	α-helix	trans	-68.4	-47.5	173.6	-173.8	-178.7	169.3	-72.1	0	111	L271 Q272 K273 L277 Q278 E279	L271-K275 PolarHBondContact O-N 3.02Å; Q272-K275 WeakPolarHBondContact O-CA 3.4Å; Q272-K275 WeakPolarHBondContact O-CB 3.18Å; Q272-K275 PolarHBondContact O-N 2.96Å; K273-K275 VanDerWaalsContact C-N 3.32Å; K275-L277 VanDerWaalsContact C-N 3.32Å; K275-L277 PolarHBondContact O-N 3.34Å; K275-Q278 WeakPolarHBondContact O-CA 3.45Å; K275-Q278 WeakPolarHBondContact O-CB 3.21Å; K275-Q278 PolarHBondContact O-N 2.84Å; K275-E279 IonicContact NZ-OE1 3.1Å; K275-E279 PolarHBondContact NZ-OE1 3.37Å; K275-E279 IonicContact NZ-OE2 3.84Å; K275-E279 PolarHBondContact NZ-OE2 3.06Å; K275-E279 WeakPolarHBondContact O-CG 3.37Å; K275-E279 PolarHBondContact O-N 3.28Å
276	E	93.4	Very high	93.3	Very high	89 Å²	89	72.5 Å²	72.5	42%	0.416	34%	0.34	S	S	.	.	H	α-helix	trans	-56.9	-43.2	173.9	-68	160.5	-175.2	0	0	112	Q272 Q278 E279 N280	Q272-E276 WeakPolarHBondContact CG-OE1 3.13Å; Q272-E276 PolarHBondContact NE2-OE1 3Å; Q272-E276 WeakPolarHBondContact O-CG 3.35Å; Q272-E276 PolarHBondContact O-N 3.23Å; E276-Q278 VanDerWaalsContact C-N 3.27Å; E276-Q278 PolarHBondContact O-N 3.47Å; E276-E279 PolarHBondContact O-N 3.44Å; E276-N280 WeakPolarHBondContact O-CB 3.37Å; E276-N280 PolarHBondContact O-N 2.97Å; E276-N280 PolarHBondContact O-OD1 2.95Å
277	L	92.7	Very high	93.7	Very high	18 Å²	18	67.3 Å²	67.3	9%	0.094	32%	0.32	C	S	.	.	H	α-helix	trans	-69.3	-19.5	175.4	-73.3	171.9	0	0	0	114	L240 H243 Q244 K273 K275 Q281	L240-L277 HydrophobicContact CD2-CD2 3.86Å; H243-L277 HydrophobicContact CB-CD1 4.18Å; H243-L277 HydrophobicContact CB-CD2 4.22Å; Q244-L277 HydrophobicContact CG-CB 3.8Å; Q244-L277 PolarHBondContact NE2-O 2.79Å; K273-L277 HydrophobicContact CG-CD1 4.13Å; K273-L277 HydrophobicContact CG-CG 4.44Å; K273-L277 WeakPolarHBondContact O-CB 3.4Å; K273-L277 VanDerWaalsContact O-CG 3.31Å; K273-L277 WeakPolarHBondContact O-CG 3.14Å; K273-L277 PolarHBondContact O-N 3.13Å; K275-L277 VanDerWaalsContact C-N 3.32Å; K275-L277 PolarHBondContact O-N 3.34Å; L277-Q281 WeakPolarHBondContact O-CB 3.39Å; L277-Q281 PolarHBondContact O-N 3.46Å
278	Q	94.3	Very high	94.1	Very high	83 Å²	83	67 Å²	67	39%	0.388	32%	0.319	S	S	.	.	H	α-helix	trans	-81.5	-46.9	171.5	-172.5	67.8	60.7	0	0	110.4	R274 K275 E276 N280 Q281 D282	R274-Q278 PolarHBondContact O-N 2.91Å; R274-Q278 VanDerWaalsContact O-N 3.13Å; K275-Q278 WeakPolarHBondContact O-CA 3.45Å; K275-Q278 WeakPolarHBondContact O-CB 3.21Å; K275-Q278 PolarHBondContact O-N 2.84Å; E276-Q278 VanDerWaalsContact C-N 3.27Å; E276-Q278 PolarHBondContact O-N 3.47Å; Q278-N280 VanDerWaalsContact C-N 3.26Å; Q278-N280 PolarHBondContact O-N 2.9Å; Q278-Q281 WeakPolarHBondContact O-CA 3.19Å; Q278-Q281 WeakPolarHBondContact O-CB 3.26Å; Q278-Q281 PolarHBondContact O-N 3.07Å; Q278-D282 PolarHBondContact NE2-OD1 3.37Å; Q278-D282 PolarHBondContact O-N 2.94Å
279	E	94.5	Very high	94.4	Very high	92 Å²	92	63.3 Å²	63.3	43%	0.43	30%	0.304	S	S	.	.	H	α-helix	trans	-59.1	-39.2	178.4	-68.4	171.8	135.2	0	0	111.1	K275 E276 Q281 E283	K275-E279 IonicContact NZ-OE1 3.1Å; K275-E279 PolarHBondContact NZ-OE1 3.37Å; K275-E279 IonicContact NZ-OE2 3.84Å; K275-E279 PolarHBondContact NZ-OE2 3.06Å; K275-E279 WeakPolarHBondContact O-CG 3.37Å; K275-E279 PolarHBondContact O-N 3.28Å; E276-E279 PolarHBondContact O-N 3.44Å; E279-Q281 PolarHBondContact O-N 2.98Å; E279-E283 WeakPolarHBondContact O-CB 3.46Å; E279-E283 PolarHBondContact O-N 2.88Å
280	N	94.8	Very high	94.6	Very high	50 Å²	50	60.3 Å²	60.3	27%	0.267	29%	0.293	S	S	.	.	H	α-helix	trans	-66.6	-31.3	171.2	-74.2	20	0	0	0	114.1	Y195 L240 E276 Q278 I284	Y195-N280 HydrophobicContact CD1-CB 4.18Å; Y195-N280 HydrophobicContact CE1-CB 3.56Å; Y195-N280 WeakPolarHBondContact CE2-ND2 3.33Å; L240-N280 HydrophobicContact CD1-CB 4.17Å; L240-N280 HydrophobicContact CD2-CB 4.08Å; E276-N280 WeakPolarHBondContact O-CB 3.37Å; E276-N280 PolarHBondContact O-N 2.97Å; E276-N280 PolarHBondContact O-OD1 2.95Å; Q278-N280 VanDerWaalsContact C-N 3.26Å; Q278-N280 PolarHBondContact O-N 2.9Å; N280-I284 VanDerWaalsContact O-CG1 3.26Å; N280-I284 WeakPolarHBondContact O-CG1 3.37Å; N280-I284 PolarHBondContact O-N 3.06Å
281	Q	93.8	Very high	94.9	Very high	6 Å²	6	59.7 Å²	59.7	3%	0.028	29%	0.29	C	S	.	.	H	α-helix	trans	-73.8	-48.8	178.8	176.9	71.4	24.6	0	0	110.4	A237 Q244 L277 Q278 E279 E283 I284 E285	A237-Q281 PolarHBondContact O-OE1 2.75Å; Q244-Q281 VanDerWaalsContact NE2-CB 3.3Å; L277-Q281 WeakPolarHBondContact O-CB 3.39Å; L277-Q281 PolarHBondContact O-N 3.46Å; Q278-Q281 WeakPolarHBondContact O-CA 3.19Å; Q278-Q281 WeakPolarHBondContact O-CB 3.26Å; Q278-Q281 PolarHBondContact O-N 3.07Å; E279-Q281 PolarHBondContact O-N 2.98Å; Q281-E283 PolarHBondContact O-N 3.05Å; Q281-I284 PolarHBondContact O-N 2.84Å; Q281-E285 PolarHBondContact NE2-OE1 3.21Å; Q281-E285 WeakPolarHBondContact O-CG 3.45Å; Q281-E285 PolarHBondContact O-N 3.08Å
282	D	95.1	Very high	95.2	Very high	73 Å²	73	57.4 Å²	57.4	39%	0.39	28%	0.277	S	S	.	.	H	α-helix	trans	-54.5	-40.4	177.2	-58.2	-11.1	0	0	0	110.1	Q278 E285 N286	Q278-D282 PolarHBondContact NE2-OD1 3.37Å; Q278-D282 PolarHBondContact O-N 2.94Å; D282-E285 PolarHBondContact O-N 3.13Å; D282-N286 VanDerWaalsContact O-CG 3.26Å; D282-N286 PolarHBondContact O-N 2.89Å; D282-N286 PolarHBondContact O-ND2 3.04Å
283	E	95.4	Very high	95.3	Very high	70 Å²	70	59.6 Å²	59.6	33%	0.327	29%	0.285	S	S	.	.	H	α-helix	trans	-73.8	-38.2	-179.6	-167.2	46.3	-139.1	0	0	113.8	E279 Q281 E285 N286 M287	E279-E283 WeakPolarHBondContact O-CB 3.46Å; E279-E283 PolarHBondContact O-N 2.88Å; Q281-E283 PolarHBondContact O-N 3.05Å; E283-E285 VanDerWaalsContact C-N 3.27Å; E283-E285 PolarHBondContact O-N 3.31Å; E283-N286 WeakPolarHBondContact O-CB 2.9Å; E283-N286 PolarHBondContact O-N 3.39Å; E283-N286 PolarHBondContact OE2-ND2 3.02Å; E283-M287 HydrophobicContact CG-CE 3.84Å; E283-M287 WeakPolarHBondContact O-CG 3.4Å; E283-M287 PolarHBondContact O-N 2.95Å; E283-M287 VanDerWaalsContact O-N 3.07Å
284	I	96.6	Very high	95.5	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-65.2	-35	170.7	-66	-72.3	0	0	0	110.5	I194 Y195 L233 V236 A237 L240 N280 Q281 M287 M288	I194-I284 HydrophobicContact CD1-CD1 3.69Å; I194-I284 HydrophobicContact CG1-CD1 4.06Å; I194-I284 HydrophobicContact CG2-CD1 4.4Å; Y195-I284 HydrophobicContact CE1-CD1 4.09Å; Y195-I284 HydrophobicContact CE1-CG1 3.88Å; L233-I284 HydrophobicContact CB-CG2 4.35Å; L233-I284 HydrophobicContact CD2-CD1 3.74Å; L233-I284 HydrophobicContact CD2-CG2 4.27Å; V236-I284 HydrophobicContact CB-CD1 4.45Å; V236-I284 HydrophobicContact CG1-CD1 3.87Å; V236-I284 HydrophobicContact CG1-CG1 4.06Å; A237-I284 HydrophobicContact CB-CG2 3.96Å; L240-I284 HydrophobicContact CD1-CB 4.45Å; L240-I284 HydrophobicContact CD1-CG1 3.9Å; N280-I284 VanDerWaalsContact O-CG1 3.26Å; N280-I284 WeakPolarHBondContact O-CG1 3.37Å; N280-I284 PolarHBondContact O-N 3.06Å; Q281-I284 PolarHBondContact O-N 2.84Å; I284-M287 HydrophobicContact CD1-CE 3.98Å; I284-M287 HydrophobicContact CD1-SD 4.18Å; I284-M287 PolarHBondContact O-N 3.3Å; I284-M288 HydrophobicContact CG2-CE 4.18Å; I284-M288 HydrophobicContact CG2-CG 4.47Å; I284-M288 HydrophobicContact CG2-SD 4.47Å; I284-M288 WeakPolarHBondContact O-CB 3.33Å; I284-M288 VanDerWaalsContact O-CG 3.29Å; I284-M288 WeakPolarHBondContact O-CG 3.49Å; I284-M288 PolarHBondContact O-N 2.7Å
285	E	94.9	Very high	95.8	Very high	82 Å²	82	51.6 Å²	51.6	38%	0.383	26%	0.261	S	S	.	.	H	α-helix	trans	-67.6	-34.2	172.9	-73.8	-177.8	-152	0	0	112.8	Q281 D282 E283 M288 N289	Q281-E285 PolarHBondContact NE2-OE1 3.21Å; Q281-E285 WeakPolarHBondContact O-CG 3.45Å; Q281-E285 PolarHBondContact O-N 3.08Å; D282-E285 PolarHBondContact O-N 3.13Å; E283-E285 VanDerWaalsContact C-N 3.27Å; E283-E285 PolarHBondContact O-N 3.31Å; E285-M288 HydrophobicContact CB-CE 4.44Å; E285-M288 HydrophobicContact CG-CE 3.76Å; E285-M288 PolarHBondContact O-N 3.42Å; E285-N289 VanDerWaalsContact O-CB 3.3Å; E285-N289 WeakPolarHBondContact O-CB 3.45Å; E285-N289 PolarHBondContact O-N 3.32Å; E285-N289 PolarHBondContact O-ND2 3.32Å
286	N	96.3	Very high	96	Very high	85 Å²	85	46.7 Å²	46.7	46%	0.455	24%	0.24	S	C	.	.	H	α-helix	trans	-62.3	-47.7	171.2	-69.9	-30.3	0	0	0	111.6	D282 E283 N289 S290	D282-N286 VanDerWaalsContact O-CG 3.26Å; D282-N286 PolarHBondContact O-N 2.89Å; D282-N286 PolarHBondContact O-ND2 3.04Å; E283-N286 WeakPolarHBondContact O-CB 2.9Å; E283-N286 PolarHBondContact O-N 3.39Å; E283-N286 PolarHBondContact OE2-ND2 3.02Å; N286-N289 PolarHBondContact O-N 2.83Å; N286-S290 WeakPolarHBondContact O-CB 3.42Å; N286-S290 PolarHBondContact O-N 3.21Å; N286-S290 PolarHBondContact O-OG 3.45Å
287	M	97.6	Very high	96.3	Very high	6 Å²	6	43.8 Å²	43.8	3%	0.03	23%	0.228	C	C	.	.	H	α-helix	trans	-60.5	-46.2	175.6	-65.1	176.8	-136.1	0	0	111.9	I194 M200 I204 L233 E283 I284 S290 I291	I194-M287 HydrophobicContact CG1-CE 4.41Å; I194-M287 HydrophobicContact CG1-SD 4.29Å; I194-M287 VanDerWaalsContact O-CE 3.31Å; I194-M287 WeakPolarHBondContact O-CE 3.21Å; M200-M287 HydrophobicContact CB-SD 3.78Å; M200-M287 HydrophobicContact CE-SD 3.74Å; M200-M287 HydrophobicContact CG-CE 4.44Å; M200-M287 HydrophobicContact CG-SD 3.73Å; I204-M287 HydrophobicContact CD1-CB 3.85Å; I204-M287 HydrophobicContact CD1-CG 4.06Å; L233-M287 HydrophobicContact CD1-CB 3.9Å; L233-M287 HydrophobicContact CD2-CB 4.45Å; L233-M287 HydrophobicContact CD2-SD 3.96Å; E283-M287 HydrophobicContact CG-CE 3.84Å; E283-M287 WeakPolarHBondContact O-CG 3.4Å; E283-M287 PolarHBondContact O-N 2.95Å; E283-M287 VanDerWaalsContact O-N 3.07Å; I284-M287 HydrophobicContact CD1-CE 3.98Å; I284-M287 HydrophobicContact CD1-SD 4.18Å; I284-M287 PolarHBondContact O-N 3.3Å; M287-S290 PolarHBondContact O-N 2.92Å; M287-I291 PolarHBondContact O-N 3.31Å; M287-I291 VanDerWaalsContact O-N 3.09Å
288	M	97.6	Very high	96.5	Very high	12 Å²	12	47.2 Å²	47.2	6%	0.059	24%	0.244	C	C	.	.	H	α-helix	trans	-62.2	-45.3	177.8	-76.1	-166.7	-57	0	0	112	M230 L233 V234 A237 I284 E285 S290 I291 F292 F326	M230-M288 HydrophobicContact CE-CB 3.76Å; M230-M288 HydrophobicContact CE-CG 4.03Å; M230-M288 HydrophobicContact CE-SD 4.3Å; M230-M288 HydrophobicContact SD-CB 3.73Å; M230-M288 HydrophobicContact SD-CG 3.72Å; L233-M288 HydrophobicContact CB-CG 3.64Å; L233-M288 HydrophobicContact CB-SD 4.17Å; L233-M288 HydrophobicContact CD1-CG 4.22Å; V234-M288 HydrophobicContact CB-SD 4.43Å; V234-M288 HydrophobicContact CG2-SD 3.7Å; A237-M288 HydrophobicContact CB-CE 3.87Å; A237-M288 HydrophobicContact CB-SD 4.42Å; I284-M288 HydrophobicContact CG2-CE 4.18Å; I284-M288 HydrophobicContact CG2-CG 4.47Å; I284-M288 HydrophobicContact CG2-SD 4.47Å; I284-M288 WeakPolarHBondContact O-CB 3.33Å; I284-M288 VanDerWaalsContact O-CG 3.29Å; I284-M288 WeakPolarHBondContact O-CG 3.49Å; I284-M288 PolarHBondContact O-N 2.7Å; E285-M288 HydrophobicContact CB-CE 4.44Å; E285-M288 HydrophobicContact CG-CE 3.76Å; E285-M288 PolarHBondContact O-N 3.42Å; M288-S290 VanDerWaalsContact C-N 3.29Å; M288-S290 PolarHBondContact O-N 3.24Å; M288-I291 PolarHBondContact O-N 3.34Å; M288-F292 VanDerWaalsContact O-CB 3.25Å; M288-F292 WeakPolarHBondContact O-CB 3.48Å; M288-F292 PolarHBondContact O-N 2.86Å; M288-F326 HydrophobicContact CE-CZ 4.5Å; M288-F326 HydrophobicContact SD-CE2 4.46Å; M288-F326 HydrophobicContact SD-CZ 4.06Å
289	N	96.4	Very high	96.7	Very high	66 Å²	66	44.6 Å²	44.6	35%	0.353	23%	0.23	S	C	.	.	H	α-helix	trans	-61.1	-38.2	175.4	-89.6	-80.8	0	0	0	112.2	E285 N286 F292 K293	E285-N289 VanDerWaalsContact O-CB 3.3Å; E285-N289 WeakPolarHBondContact O-CB 3.45Å; E285-N289 PolarHBondContact O-N 3.32Å; E285-N289 PolarHBondContact O-ND2 3.32Å; N286-N289 PolarHBondContact O-N 2.83Å; N289-F292 PolarHBondContact O-N 3.16Å; N289-K293 WeakPolarHBondContact O-CB 3.44Å; N289-K293 WeakPolarHBondContact O-CG 3.25Å; N289-K293 PolarHBondContact O-N 2.66Å
290	S	96.9	Very high	96.9	Very high	62 Å²	62	41.5 Å²	41.5	43%	0.434	22%	0.215	S	C	.	.	H	α-helix	trans	-64.7	-47	179.3	-61.1	0	0	0	0	111.8	N286 M287 M288 G294	N286-S290 WeakPolarHBondContact O-CB 3.42Å; N286-S290 PolarHBondContact O-N 3.21Å; N286-S290 PolarHBondContact O-OG 3.45Å; M287-S290 PolarHBondContact O-N 2.92Å; M288-S290 VanDerWaalsContact C-N 3.29Å; M288-S290 PolarHBondContact O-N 3.24Å; S290-G294 WeakPolarHBondContact O-CA 3.28Å; S290-G294 PolarHBondContact O-N 3.03Å
291	I	98.3	Very high	97	Very high	1 Å²	1	45.7 Å²	45.7	1%	0.005	23%	0.227	C	C	.	.	H	α-helix	trans	-65.6	-41	174.4	-62.8	166.3	0	0	0	111.1	I204 A226 M227 L229 M230 L233 M287 M288 I295 F296	I204-I291 HydrophobicContact CD1-CD1 4.09Å; I204-I291 HydrophobicContact CD1-CG1 4.17Å; I204-I291 HydrophobicContact CG1-CD1 4.09Å; I204-I291 HydrophobicContact CG1-CG1 4.03Å; I204-I291 HydrophobicContact CG2-CG1 4.07Å; A226-I291 HydrophobicContact CB-CG2 4.2Å; M227-I291 HydrophobicContact CE-CG2 3.9Å; L229-I291 HydrophobicContact CB-CD1 4.39Å; L229-I291 HydrophobicContact CD2-CD1 3.77Å; L229-I291 HydrophobicContact CG-CD1 3.74Å; M230-I291 HydrophobicContact CB-CG2 4.11Å; M230-I291 HydrophobicContact SD-CB 4.32Å; M230-I291 HydrophobicContact SD-CG2 4.45Å; L233-I291 HydrophobicContact CD1-CD1 3.66Å; M287-I291 PolarHBondContact O-N 3.31Å; M287-I291 VanDerWaalsContact O-N 3.09Å; M288-I291 PolarHBondContact O-N 3.34Å; I291-I295 HydrophobicContact CG2-CD1 4.44Å; I291-I295 WeakPolarHBondContact O-CA 3.42Å; I291-I295 VanDerWaalsContact O-CB 3.3Å; I291-I295 WeakPolarHBondContact O-CB 3.45Å; I291-I295 PolarHBondContact O-N 3.31Å; I291-F296 PolarHBondContact O-N 2.8Å; I291-F296 VanDerWaalsContact O-N 3.15Å
292	F	98.2	Very high	97.3	Very high	19 Å²	19	45.7 Å²	45.7	8%	0.083	23%	0.227	C	C	.	.	I	π-helix	trans	-66.4	-50.8	-177.2	-171.5	-100.9	0	0	0	112.2	M230 M288 N289 F296 V297 I315 W318 Y331 Y334	M230-F292 HydrophobicContact CE-CB 4.36Å; M288-F292 VanDerWaalsContact O-CB 3.25Å; M288-F292 WeakPolarHBondContact O-CB 3.48Å; M288-F292 PolarHBondContact O-N 2.86Å; N289-F292 PolarHBondContact O-N 3.16Å; F292-F296 HydrophobicContact CD2-CB 3.92Å; F292-F296 AromaticContact CD2-CD1 3.74Å; F292-F296 HydrophobicContact CD2-CD1 3.74Å; F292-F296 AromaticContact CD2-CG 3.9Å; F292-F296 HydrophobicContact CD2-CG 3.9Å; F292-F296 HydrophobicContact CE2-CB 4.3Å; F292-F296 AromaticContact CE2-CD1 3.22Å; F292-F296 HydrophobicContact CE2-CD1 3.22Å; F292-F296 AromaticContact CE2-CE1 3.63Å; F292-F296 HydrophobicContact CE2-CE1 3.63Å; F292-F296 AromaticContact CE2-CG 3.78Å; F292-F296 HydrophobicContact CE2-CG 3.78Å; F292-F296 HydrophobicContact CE2-CZ 4.44Å; F292-F296 AromaticContact CZ-CD1 3.68Å; F292-F296 HydrophobicContact CZ-CD1 3.68Å; F292-F296 AromaticContact CZ-CE1 3.9Å; F292-F296 HydrophobicContact CZ-CE1 3.9Å; F292-F296 WeakPolarHBondContact O-CB 3.36Å; F292-F296 PolarHBondContact O-N 2.88Å; F292-V297 HydrophobicContact CD1-CG2 4.09Å; F292-V297 HydrophobicContact CE1-CG2 3.86Å; F292-V297 HydrophobicContact CZ-CG2 4.37Å; F292-V297 WeakPolarHBondContact O-CG2 3.38Å; F292-V297 PolarHBondContact O-N 3.09Å; F292-I315 HydrophobicContact CE2-CD1 4.37Å; F292-W318 AromaticContact CD2-CZ3 3.95Å; F292-W318 HydrophobicContact CD2-CZ3 3.95Å; F292-W318 HydrophobicContact CE2-CZ3 4.11Å; F292-Y331 HydrophobicContact CD2-CE1 4.11Å; F292-Y331 HydrophobicContact CE1-CE1 4.09Å; F292-Y331 AromaticContact CE2-CD1 3.74Å; F292-Y331 HydrophobicContact CE2-CD1 3.74Å; F292-Y331 AromaticContact CE2-CE1 3.58Å; F292-Y331 HydrophobicContact CE2-CE1 3.58Å; F292-Y331 AromaticContact CZ-CD1 3.69Å; F292-Y331 HydrophobicContact CZ-CD1 3.69Å; F292-Y331 AromaticContact CZ-CE1 3.56Å; F292-Y331 HydrophobicContact CZ-CE1 3.56Å; F292-Y334 HydrophobicContact CE1-CE2 4.34Å; F292-Y334 HydrophobicContact CZ-CD2 4.34Å; F292-Y334 AromaticContact CZ-CE2 3.67Å; F292-Y334 HydrophobicContact CZ-CE2 3.67Å
293	K	96.9	Very high	97.4	Very high	136 Å²	136	46.6 Å²	46.6	59%	0.591	24%	0.244	S	C	*	.	I	π-helix	trans	-70.8	-47.1	179	-66.2	177.7	-177.4	178.6	0	111.6	N289 H298	N289-K293 WeakPolarHBondContact O-CB 3.44Å; N289-K293 WeakPolarHBondContact O-CG 3.25Å; N289-K293 PolarHBondContact O-N 2.66Å; K293-H298 PolarHBondContact O-CD2 3.34Å; K293-H298 VanDerWaalsContact O-CD2 3.31Å
294	G	96.1	Very high	97.5	Very high	29 Å²	29	45.1 Å²	45.1	30%	0.299	24%	0.239	S	C	.	.	I	π-helix	trans	-73.2	-31.3	-175.5	0	0	0	0	0	114.7	S290	S290-G294 WeakPolarHBondContact O-CA 3.28Å; S290-G294 PolarHBondContact O-N 3.03Å
295	I	98.4	Very high	97.5	Very high	1 Å²	1	45.8 Å²	45.8	1%	0.005	24%	0.244	C	C	.	.	I	π-helix	trans	-119.8	-62.3	-172.7	-51.3	-178.4	0	0	0	111.4	L207 T208 T223 A226 M227 I291 V297 H298 R299	L207-I295 HydrophobicContact CB-CD1 4.31Å; T208-I295 HydrophobicContact CG2-CG1 4.26Å; T223-I295 HydrophobicContact CG2-CG2 4.47Å; A226-I295 HydrophobicContact CB-CD1 3.43Å; A226-I295 VanDerWaalsContact CB-CD1 3.43Å; A226-I295 HydrophobicContact CB-CG2 4.07Å; M227-I295 HydrophobicContact CE-CB 4.25Å; M227-I295 HydrophobicContact CE-CG2 3.89Å; I291-I295 HydrophobicContact CG2-CD1 4.44Å; I291-I295 WeakPolarHBondContact O-CA 3.42Å; I291-I295 VanDerWaalsContact O-CB 3.3Å; I291-I295 WeakPolarHBondContact O-CB 3.45Å; I291-I295 PolarHBondContact O-N 3.31Å; I295-V297 PolarHBondContact O-N 3.35Å; I295-H298 PolarHBondContact O-N 2.77Å; I295-H298 VanDerWaalsContact O-N 3.11Å; I295-R299 HydrophobicContact CG2-CG 3.93Å; I295-R299 WeakPolarHBondContact O-CB 3.49Å; I295-R299 WeakPolarHBondContact O-CG 3.39Å; I295-R299 PolarHBondContact O-N 3.28Å
296	F	98.7	Very high	97.6	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	24%	0.239	C	C	.	.	I	π-helix	trans	-57.4	-49.9	-172.1	173.6	-87.1	0	0	0	112.2	M227 I291 F292 H298 R299 Y300 C311 I315 W318 Y334	M227-F296 HydrophobicContact CE-CB 4.14Å; M227-F296 HydrophobicContact SD-CB 4.16Å; M227-F296 HydrophobicContact SD-CD2 3.89Å; I291-F296 PolarHBondContact O-N 2.8Å; I291-F296 VanDerWaalsContact O-N 3.15Å; F292-F296 HydrophobicContact CD2-CB 3.92Å; F292-F296 AromaticContact CD2-CD1 3.74Å; F292-F296 HydrophobicContact CD2-CD1 3.74Å; F292-F296 AromaticContact CD2-CG 3.9Å; F292-F296 HydrophobicContact CD2-CG 3.9Å; F292-F296 HydrophobicContact CE2-CB 4.3Å; F292-F296 AromaticContact CE2-CD1 3.22Å; F292-F296 HydrophobicContact CE2-CD1 3.22Å; F292-F296 AromaticContact CE2-CE1 3.63Å; F292-F296 HydrophobicContact CE2-CE1 3.63Å; F292-F296 AromaticContact CE2-CG 3.78Å; F292-F296 HydrophobicContact CE2-CG 3.78Å; F292-F296 HydrophobicContact CE2-CZ 4.44Å; F292-F296 AromaticContact CZ-CD1 3.68Å; F292-F296 HydrophobicContact CZ-CD1 3.68Å; F292-F296 AromaticContact CZ-CE1 3.9Å; F292-F296 HydrophobicContact CZ-CE1 3.9Å; F292-F296 WeakPolarHBondContact O-CB 3.36Å; F292-F296 PolarHBondContact O-N 2.88Å; F296-H298 PolarHBondContact O-N 3.37Å; F296-R299 PolarHBondContact O-N 3.12Å; F296-R299 VanDerWaalsContact O-N 3.14Å; F296-Y300 HydrophobicContact CE1-CD1 4.33Å; F296-Y300 HydrophobicContact CE1-CG 4.43Å; F296-Y300 HydrophobicContact CZ-CG 4.45Å; F296-Y300 WeakPolarHBondContact O-CD1 3.39Å; F296-Y300 PolarHBondContact O-N 3.39Å; F296-C311 HydrophobicContact CD2-CB 3.88Å; F296-C311 HydrophobicContact CE2-CB 3.8Å; F296-C311 WeakPolarHBondContact CE2-O 3.44Å; F296-I315 HydrophobicContact CE1-CD1 3.97Å; F296-I315 HydrophobicContact CE2-CB 3.89Å; F296-I315 HydrophobicContact CE2-CD1 4Å; F296-I315 HydrophobicContact CE2-CG2 4.05Å; F296-I315 HydrophobicContact CZ-CB 4.19Å; F296-I315 HydrophobicContact CZ-CD1 3.45Å; F296-I315 VanDerWaalsContact CZ-CD1 3.45Å; F296-I315 HydrophobicContact CZ-CG1 4.4Å; F296-I315 HydrophobicContact CZ-CG2 4.21Å; F296-W318 AromaticContact CD2-CH2 3.84Å; F296-W318 HydrophobicContact CD2-CH2 3.84Å; F296-W318 HydrophobicContact CD2-CZ3 4.07Å; F296-W318 HydrophobicContact CE2-CH2 4.46Å; F296-W318 HydrophobicContact CE2-CZ3 4.42Å; F296-W318 HydrophobicContact CG-CH2 4.39Å; F296-W318 HydrophobicContact CG-CZ3 4.44Å; F296-Y334 AromaticContact CE1-CD1 3.99Å; F296-Y334 HydrophobicContact CE1-CD1 3.99Å; F296-Y334 AromaticContact CE1-CD2 3.78Å; F296-Y334 HydrophobicContact CE1-CD2 3.78Å; F296-Y334 HydrophobicContact CE1-CE1 4.29Å; F296-Y334 HydrophobicContact CE1-CE2 4.1Å; F296-Y334 AromaticContact CE1-CG 3.72Å; F296-Y334 HydrophobicContact CE1-CG 3.72Å; F296-Y334 HydrophobicContact CZ-CD2 4.29Å; F296-Y334 HydrophobicContact CZ-CG 4.05Å
297	V	98.1	Very high	97.8	Very high	29 Å²	29	40.7 Å²	40.7	18%	0.176	22%	0.218	C	C	.	.	H	α-helix	trans	-61.5	-18.4	-177.6	168.6	0	0	0	0	113.2	F292 I295 Y300 R301	F292-V297 HydrophobicContact CD1-CG2 4.09Å; F292-V297 HydrophobicContact CE1-CG2 3.86Å; F292-V297 HydrophobicContact CZ-CG2 4.37Å; F292-V297 WeakPolarHBondContact O-CG2 3.38Å; F292-V297 PolarHBondContact O-N 3.09Å; I295-V297 PolarHBondContact O-N 3.35Å; V297-Y300 WeakPolarHBondContact O-CE1 3.18Å; V297-R301 VanDerWaalsContact O-CZ 3.28Å; V297-R301 PolarHBondContact O-NE 2.77Å; V297-R301 PolarHBondContact O-NH2 3.49Å
298	H	97.9	Very high	97.8	Very high	89 Å²	89	41.7 Å²	41.7	41%	0.412	22%	0.221	S	C	.	.	H	α-helix	trans	-98.4	-37.8	173.8	-64.7	-88.9	0	0	0	112.6	K293 I295 F296 R301	K293-H298 PolarHBondContact O-CD2 3.34Å; K293-H298 VanDerWaalsContact O-CD2 3.31Å; I295-H298 PolarHBondContact O-N 2.77Å; I295-H298 VanDerWaalsContact O-N 3.11Å; F296-H298 PolarHBondContact O-N 3.37Å; H298-R301 WeakPolarHBondContact O-CG 3.32Å
299	R	98.3	Very high	97.9	Very high	29 Å²	29	41.3 Å²	41.3	11%	0.109	22%	0.22	C	C	.	.	H	α-helix	trans	-88.3	-21.7	-171.6	-62.6	-63.9	123.7	-112.8	-7.9	115.2	S211 D212 T223 I295 F296 R301 D302 I307	S211-R299 WeakPolarHBondContact O-CD 3.45Å; S211-R299 PolarHBondContact O-NE 2.95Å; D212-R299 IonicContact OD1-NH2 2.71Å; T223-R299 HydrophobicContact CG2-CB 3.77Å; T223-R299 HydrophobicContact CG2-CG 4.06Å; T223-R299 WeakPolarHBondContact OG1-CG 3.05Å; I295-R299 HydrophobicContact CG2-CG 3.93Å; I295-R299 WeakPolarHBondContact O-CB 3.49Å; I295-R299 WeakPolarHBondContact O-CG 3.39Å; I295-R299 PolarHBondContact O-N 3.28Å; F296-R299 PolarHBondContact O-N 3.12Å; F296-R299 VanDerWaalsContact O-N 3.14Å; R299-R301 PolarHBondContact O-N 3.21Å; R299-D302 WeakPolarHBondContact CD-OD2 3.48Å; R299-D302 IonicContact CZ-OD2 2.68Å; R299-D302 IonicContact NE-OD2 2.78Å; R299-D302 IonicContact NH1-OD2 2.69Å; R299-D302 PolarHBondContact NH1-OD2 2.85Å; R299-D302 PolarHBondContact O-N 2.69Å; R299-D302 VanDerWaalsContact O-N 3.11Å; R299-I307 HydrophobicContact CB-CG2 4.09Å
300	Y	98.3	Very high	98	Very high	27 Å²	27	38.4 Å²	38.4	11%	0.106	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-18.1	171.4	91.6	-88.8	0	0	0	112.9	F296 V297 R308 Y334	F296-Y300 HydrophobicContact CE1-CD1 4.33Å; F296-Y300 HydrophobicContact CE1-CG 4.43Å; F296-Y300 HydrophobicContact CZ-CG 4.45Å; F296-Y300 WeakPolarHBondContact O-CD1 3.39Å; F296-Y300 PolarHBondContact O-N 3.39Å; V297-Y300 WeakPolarHBondContact O-CE1 3.18Å; Y300-R308 WeakPolarHBondContact O-CB 3.33Å; Y300-R308 VanDerWaalsContact O-CD 3.26Å; Y300-R308 WeakPolarHBondContact O-CD 3.09Å; Y300-R308 VanDerWaalsContact O-CG 3.23Å; Y300-R308 WeakPolarHBondContact O-CG 3.39Å; Y300-Y334 HydrophobicContact CD1-CD1 4.07Å; Y300-Y334 HydrophobicContact CD1-CE1 4.3Å; Y300-Y334 HydrophobicContact CD2-CD1 4.19Å; Y300-Y334 AromaticContact CE1-CD1 3.74Å; Y300-Y334 HydrophobicContact CE1-CD1 3.74Å; Y300-Y334 AromaticContact CE1-CE1 3.75Å; Y300-Y334 HydrophobicContact CE1-CE1 3.75Å; Y300-Y334 AromaticContact CE2-CD1 3.88Å; Y300-Y334 HydrophobicContact CE2-CD1 3.88Å; Y300-Y334 HydrophobicContact CG-CD1 4.29Å; Y300-Y334 AromaticContact CZ-CD1 3.65Å; Y300-Y334 AromaticContact CZ-CE1 3.93Å
301	R	97.9	Very high	98	Very high	137 Å²	137	35.5 Å²	35.5	52%	0.517	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-122	30.4	179.3	56.1	-178.9	158.2	170.4	-4.8	112.9	V297 H298 R299	V297-R301 VanDerWaalsContact O-CZ 3.28Å; V297-R301 PolarHBondContact O-NE 2.77Å; V297-R301 PolarHBondContact O-NH2 3.49Å; H298-R301 WeakPolarHBondContact O-CG 3.32Å; R299-R301 PolarHBondContact O-N 3.21Å
302	D	98.6	Very high	98.1	Very high	7 Å²	7	35.4 Å²	35.4	4%	0.037	18%	0.183	C	C	.	.			trans	-59.1	156.3	170.8	-153.4	-75.4	0	0	0	111.9	R219 R299 I304 I307 R308	R219-D302 WeakPolarHBondContact CD-OD2 3.17Å; R219-D302 IonicContact CZ-OD1 3.69Å; R219-D302 IonicContact CZ-OD2 3.78Å; R219-D302 IonicContact NE-OD1 3.64Å; R219-D302 PolarHBondContact NE-OD1 2.84Å; R219-D302 IonicContact NE-OD2 3.38Å; R219-D302 PolarHBondContact NE-OD2 2.78Å; R219-D302 IonicContact NH2-OD1 2.82Å; R219-D302 PolarHBondContact NH2-OD1 2.6Å; R219-D302 IonicContact NH2-OD2 3.66Å; R299-D302 WeakPolarHBondContact CD-OD2 3.48Å; R299-D302 IonicContact CZ-OD2 2.68Å; R299-D302 IonicContact NE-OD2 2.78Å; R299-D302 IonicContact NH1-OD2 2.69Å; R299-D302 PolarHBondContact NH1-OD2 2.85Å; R299-D302 PolarHBondContact O-N 2.69Å; R299-D302 VanDerWaalsContact O-N 3.11Å; D302-I304 PolarHBondContact O-N 2.94Å; D302-I304 PolarHBondContact OD1-N 3.39Å; D302-I307 HydrophobicContact CB-CB 3.96Å; D302-I307 HydrophobicContact CB-CG2 3.87Å; D302-R308 HydrophobicContact CB-CG 4.23Å; D302-R308 WeakPolarHBondContact O-CD 3.24Å; D302-R308 WeakPolarHBondContact O-CG 3.46Å; D302-R308 PolarHBondContact O-NH1 3.5Å
303	A	97.2	Very high	98.1	Very high	91 Å²	91	38 Å²	38	75%	0.752	20%	0.195	S	C	*	.	S	Bend	trans	-62.8	-34.6	169.1	0	0	0	0	0	111.7	R308	A303-R308 PolarHBondContact O-NH1 3.21Å
304	I	97.6	Very high	98.1	Very high	40 Å²	40	31.8 Å²	31.8	21%	0.205	17%	0.169	C	C	.	.	S	Bend	trans	-81.1	121.8	-179	-52.2	-57.1	0	0	0	110.9	R216 D302 E306 I307 R308	R216-I304 HydrophobicContact CG-CG1 4.24Å; D302-I304 PolarHBondContact O-N 2.94Å; D302-I304 PolarHBondContact OD1-N 3.39Å; I304-E306 HydrophobicContact CG2-CB 4.21Å; I304-I307 HydrophobicContact CB-CB 4.42Å; I304-I307 HydrophobicContact CB-CD1 3.87Å; I304-I307 HydrophobicContact CB-CG1 3.95Å; I304-I307 HydrophobicContact CG1-CD1 4.24Å; I304-I307 HydrophobicContact CG2-CD1 4.21Å; I304-I307 HydrophobicContact CG2-CG1 3.95Å; I304-I307 PolarHBondContact O-N 3.3Å; I304-R308 PolarHBondContact O-N 3.1Å
305	A	98	Very high	98.2	Very high	14 Å²	14	30.4 Å²	30.4	12%	0.116	15%	0.154	C	C	.	.	H	α-helix	trans	-65.6	-43.6	-174.6	0	0	0	0	0	113.6	I307 R308 A309 Q343 E345 V346	A305-I307 PolarHBondContact O-N 2.95Å; A305-I307 VanDerWaalsContact O-N 3.1Å; A305-R308 WeakPolarHBondContact O-CB 3.44Å; A305-R308 PolarHBondContact O-N 3.13Å; A305-A309 WeakPolarHBondContact O-CB 3.44Å; A305-A309 PolarHBondContact O-N 3.22Å; A305-Q343 HydrophobicContact CB-CB 3.96Å; A305-Q343 HydrophobicContact CB-CG 3.87Å; A305-E345 HydrophobicContact CB-CG 4.24Å; A305-E345 WeakPolarHBondContact CB-OE1 3.31Å; A305-V346 HydrophobicContact CB-CG2 3.88Å
306	E	97.5	Very high	98.2	Very high	60 Å²	60	30.4 Å²	30.4	28%	0.28	16%	0.155	S	C	.	.	H	α-helix	trans	-47.9	-38.7	171.4	-64.8	163.1	-154.3	0	0	113.4	R216 H220 I304 I310 E345	R216-E306 IonicContact CZ-OE1 3.9Å; R216-E306 IonicContact CZ-OE2 2.64Å; R216-E306 IonicContact NH2-OE1 2.71Å; R216-E306 PolarHBondContact NH2-OE1 2.85Å; R216-E306 IonicContact NH2-OE2 3.71Å; R216-E306 PolarHBondContact NH2-OE2 3.23Å; H220-E306 IonicContact CE1-OE2 3.28Å; H220-E306 PolarHBondContact CE1-OE2 3.04Å; H220-E306 IonicContact ND1-OE2 3.08Å; H220-E306 PolarHBondContact ND1-OE2 3.3Å; I304-E306 HydrophobicContact CG2-CB 4.21Å; E306-I310 WeakPolarHBondContact O-CD1 3.5Å; E306-I310 VanDerWaalsContact O-CG1 3.3Å; E306-I310 WeakPolarHBondContact O-CG1 3.46Å; E306-I310 PolarHBondContact O-N 3.43Å; E306-E345 PolarHBondContact N-OE1 3.48Å
307	I	98.6	Very high	98.1	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-72.9	-43	-179	-58.4	-176.2	0	0	0	110.2	R219 H220 T223 R299 D302 I304 A305 I310 C311	R219-I307 HydrophobicContact CG-CD1 4.23Å; H220-I307 HydrophobicContact CB-CD1 3.88Å; H220-I307 HydrophobicContact CB-CG1 4.02Å; T223-I307 HydrophobicContact CG2-CG2 3.9Å; R299-I307 HydrophobicContact CB-CG2 4.09Å; D302-I307 HydrophobicContact CB-CB 3.96Å; D302-I307 HydrophobicContact CB-CG2 3.87Å; I304-I307 HydrophobicContact CB-CB 4.42Å; I304-I307 HydrophobicContact CB-CD1 3.87Å; I304-I307 HydrophobicContact CB-CG1 3.95Å; I304-I307 HydrophobicContact CG1-CD1 4.24Å; I304-I307 HydrophobicContact CG2-CD1 4.21Å; I304-I307 HydrophobicContact CG2-CG1 3.95Å; I304-I307 PolarHBondContact O-N 3.3Å; A305-I307 PolarHBondContact O-N 2.95Å; A305-I307 VanDerWaalsContact O-N 3.1Å; I307-I310 PolarHBondContact O-N 3.29Å; I307-C311 PolarHBondContact O-N 3.46Å; I307-C311 PolarHBondContact O-SG 3.25Å
308	R	98.8	Very high	98.1	Very high	27 Å²	27	31.5 Å²	31.5	10%	0.102	16%	0.161	C	C	.	.	H	α-helix	trans	-60.8	-45.3	173.1	-57.3	-162	-63.6	-76.9	2.2	111.2	Y300 D302 A303 I304 A305 I310 C311 I312 D341 V346	Y300-R308 WeakPolarHBondContact O-CB 3.33Å; Y300-R308 VanDerWaalsContact O-CD 3.26Å; Y300-R308 WeakPolarHBondContact O-CD 3.09Å; Y300-R308 VanDerWaalsContact O-CG 3.23Å; Y300-R308 WeakPolarHBondContact O-CG 3.39Å; D302-R308 HydrophobicContact CB-CG 4.23Å; D302-R308 WeakPolarHBondContact O-CD 3.24Å; D302-R308 WeakPolarHBondContact O-CG 3.46Å; D302-R308 PolarHBondContact O-NH1 3.5Å; A303-R308 PolarHBondContact O-NH1 3.21Å; I304-R308 PolarHBondContact O-N 3.1Å; A305-R308 WeakPolarHBondContact O-CB 3.44Å; A305-R308 PolarHBondContact O-N 3.13Å; R308-I310 VanDerWaalsContact C-N 3.33Å; R308-I310 PolarHBondContact O-N 2.92Å; R308-C311 PolarHBondContact O-N 2.99Å; R308-I312 WeakPolarHBondContact O-CG1 3.44Å; R308-I312 PolarHBondContact O-N 3.14Å; R308-D341 IonicContact CZ-OD1 2.67Å; R308-D341 IonicContact CZ-OD2 2.72Å; R308-D341 VanDerWaalsContact CZ-OD2 3.28Å; R308-D341 IonicContact NE-OD1 3.25Å; R308-D341 IonicContact NE-OD2 3.05Å; R308-D341 PolarHBondContact NE-OD2 2.95Å; R308-D341 VanDerWaalsContact NH2-CG 3.34Å; R308-D341 IonicContact NH2-OD1 3.58Å; R308-D341 PolarHBondContact NH2-OD1 2.88Å; R308-D341 IonicContact NH2-OD2 3.16Å; R308-D341 PolarHBondContact NH2-OD2 3.29Å; R308-D341 VanDerWaalsContact NH2-OD2 3.08Å; R308-V346 HydrophobicContact CB-CG1 3.96Å; R308-V346 HydrophobicContact CB-CG2 4.26Å
309	A	98.5	Very high	98.1	Very high	4 Å²	4	27.2 Å²	27.2	3%	0.033	14%	0.142	C	C	.	.	H	α-helix	trans	-57.8	-41.2	177.6	0	0	0	0	0	112.5	A305 I312 E313 V346 K349	A305-A309 WeakPolarHBondContact O-CB 3.44Å; A305-A309 PolarHBondContact O-N 3.22Å; A309-I312 PolarHBondContact O-N 3.36Å; A309-E313 WeakPolarHBondContact O-CB 3.47Å; A309-E313 PolarHBondContact O-N 3.2Å; A309-V346 HydrophobicContact CB-CG2 4.38Å; A309-K349 HydrophobicContact CB-CG 4Å
310	I	98.6	Very high	98	Very high	5 Å²	5	30.9 Å²	30.9	3%	0.026	16%	0.158	C	C	.	.	H	α-helix	trans	-64	-44.2	175.1	-75.5	163.1	0	0	0	112	H220 L224 M227 E306 I307 R308 E313 E314	H220-I310 WeakPolarHBondContact NE2-CD1 3.21Å; L224-I310 HydrophobicContact CB-CD1 4.34Å; L224-I310 HydrophobicContact CB-CG2 4.49Å; L224-I310 HydrophobicContact CD1-CD1 4.18Å; L224-I310 HydrophobicContact CD1-CG1 4.34Å; L224-I310 HydrophobicContact CD1-CG2 3.93Å; M227-I310 HydrophobicContact CB-CG2 4.4Å; M227-I310 HydrophobicContact CG-CG2 4.12Å; E306-I310 WeakPolarHBondContact O-CD1 3.5Å; E306-I310 VanDerWaalsContact O-CG1 3.3Å; E306-I310 WeakPolarHBondContact O-CG1 3.46Å; E306-I310 PolarHBondContact O-N 3.43Å; I307-I310 PolarHBondContact O-N 3.29Å; R308-I310 VanDerWaalsContact C-N 3.33Å; R308-I310 PolarHBondContact O-N 2.92Å; I310-E313 PolarHBondContact O-N 2.91Å; I310-E314 PolarHBondContact O-N 3.07Å
311	C	98.8	Very high	97.8	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-62.5	-44.8	177.1	-67.9	0	0	0	0	111.7	F296 I307 R308 E314 I315	F296-C311 HydrophobicContact CD2-CB 3.88Å; F296-C311 HydrophobicContact CE2-CB 3.8Å; F296-C311 WeakPolarHBondContact CE2-O 3.44Å; I307-C311 PolarHBondContact O-N 3.46Å; I307-C311 PolarHBondContact O-SG 3.25Å; R308-C311 PolarHBondContact O-N 2.99Å; C311-E314 PolarHBondContact O-N 3.29Å; C311-I315 WeakPolarHBondContact O-CG2 3.22Å; C311-I315 PolarHBondContact O-N 3.35Å; C311-I315 VanDerWaalsContact O-N 3.12Å
312	I	98.6	Very high	97.8	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-67.2	-35.1	179.6	-66.3	-59.7	0	0	0	112.6	R308 A309 I315 G316 T338 V346 K349 C350	R308-I312 WeakPolarHBondContact O-CG1 3.44Å; R308-I312 PolarHBondContact O-N 3.14Å; A309-I312 PolarHBondContact O-N 3.36Å; I312-I315 WeakPolarHBondContact O-CG2 3.29Å; I312-G316 PolarHBondContact O-N 2.89Å; I312-T338 HydrophobicContact CD1-CG2 4.03Å; I312-T338 HydrophobicContact CG1-CG2 3.88Å; I312-V346 HydrophobicContact CG1-CG1 4.48Å; I312-K349 HydrophobicContact CB-CB 4.36Å; I312-K349 HydrophobicContact CG2-CB 3.89Å; I312-C350 HydrophobicContact CG2-CB 4.31Å
313	E	98.2	Very high	97.6	Very high	72 Å²	72	28.1 Å²	28.1	34%	0.336	15%	0.154	S	C	.	.	H	α-helix	trans	-62.3	-49.9	174.8	-173.2	154.2	-129.3	0	0	111.6	A309 I310 G316 V317 K349	A309-E313 WeakPolarHBondContact O-CB 3.47Å; A309-E313 PolarHBondContact O-N 3.2Å; I310-E313 PolarHBondContact O-N 2.91Å; E313-G316 PolarHBondContact O-N 2.96Å; E313-V317 PolarHBondContact O-N 3.23Å; E313-K349 HydrophobicContact CB-CD 4.16Å; E313-K349 HydrophobicContact CG-CD 4.37Å; E313-K349 IonicContact OE1-NZ 3.77Å; E313-K349 PolarHBondContact OE1-NZ 2.81Å; E313-K349 IonicContact OE2-NZ 2.68Å; E313-K349 PolarHBondContact OE2-NZ 3.15Å
314	E	98.3	Very high	97.4	Very high	6 Å²	6	29.9 Å²	29.9	3%	0.028	15%	0.151	C	C	.	.	H	α-helix	trans	-75.6	-34.1	-173.7	-62.4	-63.8	112.7	0	0	113.2	M227 K228 T231 I310 C311 G316 V317 W318	M227-E314 HydrophobicContact CB-CB 3.89Å; M227-E314 HydrophobicContact CB-CG 3.7Å; K228-E314 WeakPolarHBondContact CD-OE2 3.48Å; K228-E314 WeakPolarHBondContact CE-OE2 3.46Å; K228-E314 IonicContact NZ-OE1 2.69Å; K228-E314 PolarHBondContact NZ-OE1 2.93Å; K228-E314 IonicContact NZ-OE2 3.34Å; K228-E314 PolarHBondContact NZ-OE2 3.31Å; T231-E314 PolarHBondContact OG1-OE2 3.01Å; I310-E314 PolarHBondContact O-N 3.07Å; C311-E314 PolarHBondContact O-N 3.29Å; E314-G316 VanDerWaalsContact C-N 3.25Å; E314-G316 PolarHBondContact O-N 2.97Å; E314-V317 CarbonylContact O-C 3.5Å; E314-V317 WeakPolarHBondContact O-CA 3.47Å; E314-V317 WeakPolarHBondContact O-CB 3.45Å; E314-V317 PolarHBondContact O-N 3.34Å; E314-W318 HydrophobicContact CB-CZ2 3.79Å; E314-W318 VanDerWaalsContact O-CG 3.23Å; E314-W318 PolarHBondContact O-N 3.47Å; E314-W318 PolarHBondContact O-NE1 2.92Å
315	I	98.4	Very high	97.2	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-62.9	-33.8	171.7	-168.4	170.1	0	0	0	111.9	F292 F296 C311 I312 V317 W318 M319 Y331 Y334 V335	F292-I315 HydrophobicContact CE2-CD1 4.37Å; F296-I315 HydrophobicContact CE1-CD1 3.97Å; F296-I315 HydrophobicContact CE2-CB 3.89Å; F296-I315 HydrophobicContact CE2-CD1 4Å; F296-I315 HydrophobicContact CE2-CG2 4.05Å; F296-I315 HydrophobicContact CZ-CB 4.19Å; F296-I315 HydrophobicContact CZ-CD1 3.45Å; F296-I315 VanDerWaalsContact CZ-CD1 3.45Å; F296-I315 HydrophobicContact CZ-CG1 4.4Å; F296-I315 HydrophobicContact CZ-CG2 4.21Å; C311-I315 WeakPolarHBondContact O-CG2 3.22Å; C311-I315 PolarHBondContact O-N 3.35Å; C311-I315 VanDerWaalsContact O-N 3.12Å; I312-I315 WeakPolarHBondContact O-CG2 3.29Å; I315-V317 VanDerWaalsContact C-N 3.34Å; I315-W318 HydrophobicContact CB-CE3 3.92Å; I315-W318 HydrophobicContact CB-CZ3 3.9Å; I315-W318 HydrophobicContact CG1-CE3 3.87Å; I315-W318 HydrophobicContact CG1-CZ3 4.07Å; I315-W318 PolarHBondContact O-N 3.37Å; I315-M319 HydrophobicContact CG1-CE 4.31Å; I315-M319 WeakPolarHBondContact O-CG 3.38Å; I315-M319 PolarHBondContact O-N 3.29Å; I315-Y331 HydrophobicContact CD1-CD1 4.02Å; I315-Y334 HydrophobicContact CD1-CD2 4.09Å; I315-V335 HydrophobicContact CG2-CG2 4.13Å
316	G	97.2	Very high	97.2	Very high	1 Å²	1	29.4 Å²	29.4	1%	0.01	15%	0.152	C	C	.	.	H	α-helix	trans	-60.3	-42.7	169	0	0	0	0	0	112.6	I312 E313 E314 K320	I312-G316 PolarHBondContact O-N 2.89Å; E313-G316 PolarHBondContact O-N 2.96Å; E314-G316 VanDerWaalsContact C-N 3.25Å; E314-G316 PolarHBondContact O-N 2.97Å; G316-K320 WeakPolarHBondContact O-CB 3.28Å; G316-K320 PolarHBondContact O-N 3.5Å
317	V	97.6	Very high	97.1	Very high	52 Å²	52	26.9 Å²	26.9	32%	0.315	14%	0.14	S	C	.	.	H	α-helix	trans	-63.6	-41.9	175	175.2	0	0	0	0	111.7	T231 E313 E314 I315 K320 M321	T231-V317 HydrophobicContact CG2-CG1 3.8Å; E313-V317 PolarHBondContact O-N 3.23Å; E314-V317 CarbonylContact O-C 3.5Å; E314-V317 WeakPolarHBondContact O-CA 3.47Å; E314-V317 WeakPolarHBondContact O-CB 3.45Å; E314-V317 PolarHBondContact O-N 3.34Å; I315-V317 VanDerWaalsContact C-N 3.34Å; V317-K320 PolarHBondContact O-N 2.86Å; V317-M321 HydrophobicContact CG1-CE 3.79Å; V317-M321 VanDerWaalsContact O-CB 3.24Å; V317-M321 WeakPolarHBondContact O-CB 3.49Å; V317-M321 PolarHBondContact O-N 3.08Å
318	W	98	Very high	97	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-64.3	-47.5	178.2	-48.8	-24.8	0	0	0	111.7	M227 M230 T231 V234 F292 F296 E314 I315 K320 M321 Y322 F326	M227-W318 HydrophobicContact CB-CZ2 4.46Å; M227-W318 HydrophobicContact SD-CH2 3.78Å; M227-W318 HydrophobicContact SD-CZ2 4.02Å; M230-W318 HydrophobicContact CB-CH2 4.38Å; M230-W318 HydrophobicContact CB-CZ2 3.71Å; M230-W318 HydrophobicContact CE-CE3 4.26Å; M230-W318 HydrophobicContact CE-CZ3 4.37Å; M230-W318 HydrophobicContact CG-CD2 3.98Å; M230-W318 VanDerWaalsContact CG-CE2 3.45Å; M230-W318 HydrophobicContact CG-CE3 4.29Å; M230-W318 HydrophobicContact CG-CH2 3.76Å; M230-W318 HydrophobicContact CG-CZ2 3.36Å; M230-W318 HydrophobicContact CG-CZ3 4.19Å; T231-W318 PolarHBondContact OG1-NE1 2.86Å; V234-W318 HydrophobicContact CG1-CB 4.48Å; V234-W318 HydrophobicContact CG2-CB 4.22Å; V234-W318 HydrophobicContact CG2-CG 4Å; F292-W318 AromaticContact CD2-CZ3 3.95Å; F292-W318 HydrophobicContact CD2-CZ3 3.95Å; F292-W318 HydrophobicContact CE2-CZ3 4.11Å; F296-W318 AromaticContact CD2-CH2 3.84Å; F296-W318 HydrophobicContact CD2-CH2 3.84Å; F296-W318 HydrophobicContact CD2-CZ3 4.07Å; F296-W318 HydrophobicContact CE2-CH2 4.46Å; F296-W318 HydrophobicContact CE2-CZ3 4.42Å; F296-W318 HydrophobicContact CG-CH2 4.39Å; F296-W318 HydrophobicContact CG-CZ3 4.44Å; E314-W318 HydrophobicContact CB-CZ2 3.79Å; E314-W318 VanDerWaalsContact O-CG 3.23Å; E314-W318 PolarHBondContact O-N 3.47Å; E314-W318 PolarHBondContact O-NE1 2.92Å; I315-W318 HydrophobicContact CB-CE3 3.92Å; I315-W318 HydrophobicContact CB-CZ3 3.9Å; I315-W318 HydrophobicContact CG1-CE3 3.87Å; I315-W318 HydrophobicContact CG1-CZ3 4.07Å; I315-W318 PolarHBondContact O-N 3.37Å; W318-K320 PolarHBondContact O-N 2.93Å; W318-M321 PolarHBondContact O-N 3.18Å; W318-Y322 PolarHBondContact O-N 3.43Å; W318-F326 HydrophobicContact CB-CB 4.43Å; W318-F326 HydrophobicContact CB-CD1 4.02Å; W318-F326 HydrophobicContact CB-CD2 4.43Å; W318-F326 HydrophobicContact CB-CE1 4.43Å; W318-F326 HydrophobicContact CB-CG 4.02Å; W318-F326 HydrophobicContact CE3-CE1 4.4Å
319	M	97.6	Very high	96.7	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-60.5	-33.2	177.1	-70.2	-171.4	-65.8	0	0	112.8	I315 S323 F326 L327 L332 V335 L357	I315-M319 HydrophobicContact CG1-CE 4.31Å; I315-M319 WeakPolarHBondContact O-CG 3.38Å; I315-M319 PolarHBondContact O-N 3.29Å; M319-S323 WeakPolarHBondContact O-CA 3.24Å; M319-S323 VanDerWaalsContact O-CB 3.31Å; M319-S323 WeakPolarHBondContact O-CB 3.45Å; M319-F326 HydrophobicContact CG-CB 4.08Å; M319-F326 WeakPolarHBondContact CG-O 3.27Å; M319-L327 HydrophobicContact CB-CD1 4.18Å; M319-L327 HydrophobicContact SD-CD1 4.21Å; M319-L332 HydrophobicContact CE-CD2 4.1Å; M319-L332 HydrophobicContact SD-CD2 3.65Å; M319-L332 HydrophobicContact SD-CG 3.83Å; M319-V335 HydrophobicContact CE-CG2 3.87Å; M319-L357 HydrophobicContact CB-CD1 4.32Å; M319-L357 HydrophobicContact CB-CD2 4.01Å; M319-L357 HydrophobicContact CE-CD1 4.22Å
320	K	95.4	Very high	96.6	Very high	106 Å²	106	34.7 Å²	34.7	46%	0.461	19%	0.188	S	C	.	.	H	α-helix	trans	-78	-37.8	175.1	-177.6	165.3	-176.4	150.5	0	113.2	G316 V317 W318 S356 L357	G316-K320 WeakPolarHBondContact O-CB 3.28Å; G316-K320 PolarHBondContact O-N 3.5Å; V317-K320 PolarHBondContact O-N 2.86Å; W318-K320 PolarHBondContact O-N 2.93Å; K320-S356 WeakPolarHBondContact CD-O 3.41Å; K320-S356 WeakPolarHBondContact CE-O 3.07Å; K320-S356 PolarHBondContact NZ-O 3.12Å; K320-L357 HydrophobicContact CB-CD2 3.82Å
321	M	95.4	Very high	96.5	Very high	60 Å²	60	36.3 Å²	36.3	30%	0.296	19%	0.194	S	C	.	.	H	α-helix	trans	-77	-41.2	-174.4	-168.2	-173.6	-47.9	0	0	112.5	T231 V234 N235 L238 V317 W318	T231-M321 HydrophobicContact CG2-CE 3.8Å; V234-M321 HydrophobicContact CG1-CB 4.48Å; V234-M321 HydrophobicContact CG1-SD 4.26Å; N235-M321 HydrophobicContact CB-SD 3.8Å; L238-M321 HydrophobicContact CD2-CG 4.36Å; V317-M321 HydrophobicContact CG1-CE 3.79Å; V317-M321 VanDerWaalsContact O-CB 3.24Å; V317-M321 WeakPolarHBondContact O-CB 3.49Å; V317-M321 PolarHBondContact O-N 3.08Å; W318-M321 PolarHBondContact O-N 3.18Å
322	Y	96	Very high	96.4	Very high	29 Å²	29	36.3 Å²	36.3	11%	0.114	19%	0.194	C	C	.	.	S	Bend	trans	-135.5	69.2	-178	-167.9	-173.8	0	0	0	110.4	A237 L238 S241 W318 D324 A325 F326	A237-Y322 HydrophobicContact CB-CD1 4.44Å; A237-Y322 HydrophobicContact CB-CE1 4.13Å; L238-Y322 HydrophobicContact CB-CD1 4.11Å; L238-Y322 HydrophobicContact CB-CE1 4.47Å; L238-Y322 HydrophobicContact CB-CG 4.25Å; L238-Y322 HydrophobicContact CD1-CD2 3.78Å; L238-Y322 HydrophobicContact CD1-CE2 4.02Å; L238-Y322 HydrophobicContact CD1-CG 4.1Å; S241-Y322 WeakPolarHBondContact CB-OH 3.47Å; S241-Y322 PolarHBondContact OG-OH 3.25Å; S241-Y322 VanDerWaalsContact OG-OH 3.13Å; W318-Y322 PolarHBondContact O-N 3.43Å; Y322-D324 HydrophobicContact CE2-CB 4.31Å; Y322-D324 PolarHBondContact O-N 3.44Å; Y322-A325 HydrophobicContact CD1-CB 3.86Å; Y322-A325 HydrophobicContact CD2-CB 4.2Å; Y322-A325 HydrophobicContact CE1-CB 3.86Å; Y322-A325 HydrophobicContact CE2-CB 4.22Å; Y322-A325 HydrophobicContact CG-CB 4.02Å; Y322-A325 PolarHBondContact O-N 3.41Å; Y322-A325 VanDerWaalsContact O-N 3.16Å; Y322-F326 PolarHBondContact O-N 3.33Å
323	S	95.2	Very high	96.4	Very high	23 Å²	23	40 Å²	40	16%	0.161	21%	0.21	C	C	.	.	H	α-helix	trans	-66.7	-15.7	-171.6	69.4	0	0	0	0	114.8	M319 L327 K366	M319-S323 WeakPolarHBondContact O-CA 3.24Å; M319-S323 VanDerWaalsContact O-CB 3.31Å; M319-S323 WeakPolarHBondContact O-CB 3.45Å; S323-L327 VanDerWaalsContact O-CB 3.26Å; S323-L327 WeakPolarHBondContact O-CB 3.29Å; S323-L327 PolarHBondContact O-N 3.07Å; S323-K366 PolarHBondContact O-NZ 3.24Å
324	D	93	Very high	96.4	Very high	128 Å²	128	37.6 Å²	37.6	68%	0.684	20%	0.198	S	C	*	.	H	α-helix	trans	-78.1	-29.6	173.8	-66.6	-43.6	0	0	0	113	Y322 K366	Y322-D324 HydrophobicContact CE2-CB 4.31Å; Y322-D324 PolarHBondContact O-N 3.44Å; D324-K366 IonicContact OD1-NZ 3.16Å; D324-K366 PolarHBondContact OD1-NZ 3.39Å
325	A	94.2	Very high	96.4	Very high	38 Å²	38	37.3 Å²	37.3	31%	0.314	20%	0.197	S	C	.	.	H	α-helix	trans	-90.6	-41	173.9	0	0	0	0	0	112.5	Y322 N328	Y322-A325 HydrophobicContact CD1-CB 3.86Å; Y322-A325 HydrophobicContact CD2-CB 4.2Å; Y322-A325 HydrophobicContact CE1-CB 3.86Å; Y322-A325 HydrophobicContact CE2-CB 4.22Å; Y322-A325 HydrophobicContact CG-CB 4.02Å; Y322-A325 PolarHBondContact O-N 3.41Å; Y322-A325 VanDerWaalsContact O-N 3.16Å; A325-N328 PolarHBondContact O-ND2 3.02Å
326	F	96.4	Very high	96.4	Very high	6 Å²	6	37.3 Å²	37.3	3%	0.026	20%	0.197	C	C	.	.	H	α-helix	trans	-105	-26.3	-168.3	-72.6	-87	0	0	0	115.5	M230 V234 M288 W318 M319 Y322 N328 Y331	M230-F326 HydrophobicContact CE-CE1 3.94Å; M230-F326 HydrophobicContact CE-CZ 4Å; V234-F326 HydrophobicContact CB-CE2 4.43Å; V234-F326 HydrophobicContact CG1-CD2 4.23Å; V234-F326 HydrophobicContact CG1-CE2 3.97Å; V234-F326 HydrophobicContact CG2-CE1 4.49Å; V234-F326 HydrophobicContact CG2-CE2 3.7Å; V234-F326 HydrophobicContact CG2-CZ 3.69Å; M288-F326 HydrophobicContact CE-CZ 4.5Å; M288-F326 HydrophobicContact SD-CE2 4.46Å; M288-F326 HydrophobicContact SD-CZ 4.06Å; W318-F326 HydrophobicContact CB-CB 4.43Å; W318-F326 HydrophobicContact CB-CD1 4.02Å; W318-F326 HydrophobicContact CB-CD2 4.43Å; W318-F326 HydrophobicContact CB-CE1 4.43Å; W318-F326 HydrophobicContact CB-CG 4.02Å; W318-F326 HydrophobicContact CE3-CE1 4.4Å; M319-F326 HydrophobicContact CG-CB 4.08Å; M319-F326 WeakPolarHBondContact CG-O 3.27Å; Y322-F326 PolarHBondContact O-N 3.33Å; F326-N328 PolarHBondContact O-N 3.15Å; F326-Y331 HydrophobicContact CB-CD2 4.4Å; F326-Y331 AromaticContact CD1-CD1 3.99Å; F326-Y331 HydrophobicContact CD1-CD1 3.99Å; F326-Y331 HydrophobicContact CD1-CD2 4.05Å; F326-Y331 AromaticContact CD1-CE1 3.66Å; F326-Y331 HydrophobicContact CD1-CE1 3.66Å; F326-Y331 AromaticContact CD1-CE2 3.71Å; F326-Y331 HydrophobicContact CD1-CE2 3.71Å; F326-Y331 HydrophobicContact CD1-CG 4.18Å; F326-Y331 AromaticContact CD1-CZ 3.51Å; F326-Y331 HydrophobicContact CE1-CD1 4.48Å; F326-Y331 AromaticContact CE1-CE1 3.76Å; F326-Y331 HydrophobicContact CE1-CE1 3.76Å; F326-Y331 HydrophobicContact CE1-CE2 4.21Å; F326-Y331 AromaticContact CE1-CZ 3.59Å; F326-Y331 HydrophobicContact CG-CE2 4.38Å; F326-Y331 WeakPolarHBondContact O-CB 3.21Å; F326-Y331 WeakPolarHBondContact O-CD2 3.47Å
327	L	96.9	Very high	96.4	Very high	7 Å²	7	43 Å²	43	4%	0.037	22%	0.218	C	C	.	.	S	Bend	trans	-83.2	81.2	-177.3	-172.2	64.7	0	0	0	111.4	M319 S323 L332 L357 L363 K366 L367	M319-L327 HydrophobicContact CB-CD1 4.18Å; M319-L327 HydrophobicContact SD-CD1 4.21Å; S323-L327 VanDerWaalsContact O-CB 3.26Å; S323-L327 WeakPolarHBondContact O-CB 3.29Å; S323-L327 PolarHBondContact O-N 3.07Å; L327-L332 HydrophobicContact CD1-CD1 3.94Å; L327-L332 HydrophobicContact CD1-CD2 3.91Å; L327-L332 HydrophobicContact CD1-CG 4.07Å; L327-L357 HydrophobicContact CD1-CD1 3.85Å; L327-L357 HydrophobicContact CD1-CD2 4.34Å; L327-L363 HydrophobicContact CD2-CB 3.85Å; L327-L363 HydrophobicContact CD2-CD1 4.09Å; L327-L363 HydrophobicContact CD2-CD2 4.01Å; L327-L363 HydrophobicContact CD2-CG 4.19Å; L327-K366 HydrophobicContact CB-CD 4.35Å; L327-K366 HydrophobicContact CD2-CB 3.84Å; L327-K366 HydrophobicContact CD2-CD 3.99Å; L327-K366 HydrophobicContact CG-CB 4.06Å; L327-K366 HydrophobicContact CG-CD 4.29Å; L327-L367 HydrophobicContact CD1-CD2 3.96Å; L327-L367 HydrophobicContact CD2-CG 4.47Å
328	N	95.1	Very high	96.5	Very high	56 Å²	56	41 Å²	41	30%	0.299	21%	0.206	S	C	.	.	S	Bend	trans	-154.9	167.2	175.3	60.7	72.5	0	0	0	111.2	A325 F326 S330 Y331 L332	A325-N328 PolarHBondContact O-ND2 3.02Å; F326-N328 PolarHBondContact O-N 3.15Å; N328-S330 PolarHBondContact O-N 3.15Å; N328-S330 WeakPolarHBondContact OD1-CB 3.48Å; N328-S330 PolarHBondContact OD1-N 2.67Å; N328-S330 VanDerWaalsContact OD1-N 3.12Å; N328-S330 PolarHBondContact OD1-OG 2.84Å; N328-Y331 PolarHBondContact O-N 2.99Å; N328-L332 PolarHBondContact O-N 3.23Å
329	D	94.3	Very high	96.5	Very high	82 Å²	82	41 Å²	41	44%	0.439	21%	0.206	S	C	.	.	H	α-helix	trans	-51.5	-31.2	-177.3	-75.5	9.3	0	0	0	114.7	Y331 K333	D329-Y331 PolarHBondContact O-N 3.21Å; D329-K333 WeakPolarHBondContact O-CB 3.4Å; D329-K333 WeakPolarHBondContact O-CG 3.49Å; D329-K333 PolarHBondContact O-N 2.84Å; D329-K333 VanDerWaalsContact O-N 3.16Å
330	S	94.9	Very high	96.5	Very high	58 Å²	58	46 Å²	46	41%	0.406	23%	0.229	S	C	.	.	H	α-helix	trans	-65.5	-26.2	-178.2	80.8	0	0	0	0	112.8	N328 K333 Y334	N328-S330 PolarHBondContact O-N 3.15Å; N328-S330 WeakPolarHBondContact OD1-CB 3.48Å; N328-S330 PolarHBondContact OD1-N 2.67Å; N328-S330 VanDerWaalsContact OD1-N 3.12Å; N328-S330 PolarHBondContact OD1-OG 2.84Å; S330-K333 VanDerWaalsContact O-CE 3.23Å; S330-K333 WeakPolarHBondContact O-CE 3.19Å; S330-Y334 WeakPolarHBondContact O-CE2 3.49Å
331	Y	97.4	Very high	96.7	Very high	39 Å²	39	42.2 Å²	42.2	15%	0.153	21%	0.214	C	C	.	.	H	α-helix	trans	-102.7	-43.6	174.7	-65.1	-75.2	0	0	0	112.2	F292 I315 F326 N328 D329 K333 Y334	F292-Y331 HydrophobicContact CD2-CE1 4.11Å; F292-Y331 HydrophobicContact CE1-CE1 4.09Å; F292-Y331 AromaticContact CE2-CD1 3.74Å; F292-Y331 HydrophobicContact CE2-CD1 3.74Å; F292-Y331 AromaticContact CE2-CE1 3.58Å; F292-Y331 HydrophobicContact CE2-CE1 3.58Å; F292-Y331 AromaticContact CZ-CD1 3.69Å; F292-Y331 HydrophobicContact CZ-CD1 3.69Å; F292-Y331 AromaticContact CZ-CE1 3.56Å; F292-Y331 HydrophobicContact CZ-CE1 3.56Å; I315-Y331 HydrophobicContact CD1-CD1 4.02Å; F326-Y331 HydrophobicContact CB-CD2 4.4Å; F326-Y331 AromaticContact CD1-CD1 3.99Å; F326-Y331 HydrophobicContact CD1-CD1 3.99Å; F326-Y331 HydrophobicContact CD1-CD2 4.05Å; F326-Y331 AromaticContact CD1-CE1 3.66Å; F326-Y331 HydrophobicContact CD1-CE1 3.66Å; F326-Y331 AromaticContact CD1-CE2 3.71Å; F326-Y331 HydrophobicContact CD1-CE2 3.71Å; F326-Y331 HydrophobicContact CD1-CG 4.18Å; F326-Y331 AromaticContact CD1-CZ 3.51Å; F326-Y331 HydrophobicContact CE1-CD1 4.48Å; F326-Y331 AromaticContact CE1-CE1 3.76Å; F326-Y331 HydrophobicContact CE1-CE1 3.76Å; F326-Y331 HydrophobicContact CE1-CE2 4.21Å; F326-Y331 AromaticContact CE1-CZ 3.59Å; F326-Y331 HydrophobicContact CG-CE2 4.38Å; F326-Y331 WeakPolarHBondContact O-CB 3.21Å; F326-Y331 WeakPolarHBondContact O-CD2 3.47Å; N328-Y331 PolarHBondContact O-N 2.99Å; D329-Y331 PolarHBondContact O-N 3.21Å; Y331-K333 PolarHBondContact O-N 3.28Å; Y331-Y334 WeakPolarHBondContact O-CD2 3.19Å; Y331-Y334 PolarHBondContact O-N 3.39Å; Y331-Y334 VanDerWaalsContact O-N 3.16Å
332	L	97.1	Very high	96.8	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-57.6	-33.5	-179.1	-79.8	169.4	0	0	0	113.1	M319 L327 N328 Y334 V335 G336 L357 L367 F370	M319-L332 HydrophobicContact CE-CD2 4.1Å; M319-L332 HydrophobicContact SD-CD2 3.65Å; M319-L332 HydrophobicContact SD-CG 3.83Å; L327-L332 HydrophobicContact CD1-CD1 3.94Å; L327-L332 HydrophobicContact CD1-CD2 3.91Å; L327-L332 HydrophobicContact CD1-CG 4.07Å; N328-L332 PolarHBondContact O-N 3.23Å; L332-Y334 PolarHBondContact O-N 3.37Å; L332-Y334 VanDerWaalsContact O-N 3.16Å; L332-V335 PolarHBondContact O-N 3.04Å; L332-G336 PolarHBondContact O-N 3.37Å; L332-L357 HydrophobicContact CD2-CD1 4.41Å; L332-L367 HydrophobicContact CD1-CD2 4.32Å; L332-L367 HydrophobicContact CD2-CD2 4.17Å; L332-F370 HydrophobicContact CB-CD2 3.83Å; L332-F370 HydrophobicContact CB-CE2 4.26Å; L332-F370 HydrophobicContact CD1-CB 4.23Å; L332-F370 HydrophobicContact CD2-CD2 4.37Å; L332-F370 HydrophobicContact CG-CD2 4.49Å; L332-F370 WeakPolarHBondContact O-CE2 3.48Å
333	K	97.3	Very high	96.9	Very high	76 Å²	76	53.6 Å²	53.6	33%	0.33	26%	0.258	S	S	.	.	H	α-helix	trans	-54.1	-34.6	178	71.3	-171.6	-172.6	-173.9	0	113.7	D329 S330 Y331 V335 G336 W337	D329-K333 WeakPolarHBondContact O-CB 3.4Å; D329-K333 WeakPolarHBondContact O-CG 3.49Å; D329-K333 PolarHBondContact O-N 2.84Å; D329-K333 VanDerWaalsContact O-N 3.16Å; S330-K333 VanDerWaalsContact O-CE 3.23Å; S330-K333 WeakPolarHBondContact O-CE 3.19Å; Y331-K333 PolarHBondContact O-N 3.28Å; K333-V335 PolarHBondContact O-N 2.84Å; K333-G336 PolarHBondContact O-N 3.04Å; K333-W337 HydrophobicContact CB-CZ2 4.32Å; K333-W337 HydrophobicContact CD-CH2 3.79Å; K333-W337 HydrophobicContact CD-CZ2 4.17Å; K333-W337 HydrophobicContact CD-CZ3 4.23Å; K333-W337 HydrophobicContact CG-CE3 4.43Å; K333-W337 HydrophobicContact CG-CH2 4.05Å; K333-W337 HydrophobicContact CG-CZ2 4.33Å; K333-W337 HydrophobicContact CG-CZ3 4.08Å; K333-W337 WeakPolarHBondContact O-CB 3.34Å; K333-W337 VanDerWaalsContact O-CD2 3.31Å; K333-W337 PolarHBondContact O-N 3.5Å
334	Y	98.5	Very high	97	Very high	22 Å²	22	52.6 Å²	52.6	9%	0.086	25%	0.251	C	S	.	.	H	α-helix	trans	-68	-36.9	-179.9	-63.1	-73.5	0	0	0	111.5	F292 F296 Y300 I315 S330 Y331 L332 W337 T338	F292-Y334 HydrophobicContact CE1-CE2 4.34Å; F292-Y334 HydrophobicContact CZ-CD2 4.34Å; F292-Y334 AromaticContact CZ-CE2 3.67Å; F292-Y334 HydrophobicContact CZ-CE2 3.67Å; F296-Y334 AromaticContact CE1-CD1 3.99Å; F296-Y334 HydrophobicContact CE1-CD1 3.99Å; F296-Y334 AromaticContact CE1-CD2 3.78Å; F296-Y334 HydrophobicContact CE1-CD2 3.78Å; F296-Y334 HydrophobicContact CE1-CE1 4.29Å; F296-Y334 HydrophobicContact CE1-CE2 4.1Å; F296-Y334 AromaticContact CE1-CG 3.72Å; F296-Y334 HydrophobicContact CE1-CG 3.72Å; F296-Y334 HydrophobicContact CZ-CD2 4.29Å; F296-Y334 HydrophobicContact CZ-CG 4.05Å; Y300-Y334 HydrophobicContact CD1-CD1 4.07Å; Y300-Y334 HydrophobicContact CD1-CE1 4.3Å; Y300-Y334 HydrophobicContact CD2-CD1 4.19Å; Y300-Y334 AromaticContact CE1-CD1 3.74Å; Y300-Y334 HydrophobicContact CE1-CD1 3.74Å; Y300-Y334 AromaticContact CE1-CE1 3.75Å; Y300-Y334 HydrophobicContact CE1-CE1 3.75Å; Y300-Y334 AromaticContact CE2-CD1 3.88Å; Y300-Y334 HydrophobicContact CE2-CD1 3.88Å; Y300-Y334 HydrophobicContact CG-CD1 4.29Å; Y300-Y334 AromaticContact CZ-CD1 3.65Å; Y300-Y334 AromaticContact CZ-CE1 3.93Å; I315-Y334 HydrophobicContact CD1-CD2 4.09Å; S330-Y334 WeakPolarHBondContact O-CE2 3.49Å; Y331-Y334 WeakPolarHBondContact O-CD2 3.19Å; Y331-Y334 PolarHBondContact O-N 3.39Å; Y331-Y334 VanDerWaalsContact O-N 3.16Å; L332-Y334 PolarHBondContact O-N 3.37Å; L332-Y334 VanDerWaalsContact O-N 3.16Å; Y334-W337 AromaticContact CD1-CE3 3.99Å; Y334-W337 HydrophobicContact CD1-CE3 3.99Å; Y334-W337 AromaticContact CD1-CZ3 3.85Å; Y334-W337 HydrophobicContact CD1-CZ3 3.85Å; Y334-W337 HydrophobicContact CE1-CE3 4.42Å; Y334-W337 AromaticContact CE1-CZ3 3.82Å; Y334-W337 HydrophobicContact CE1-CZ3 3.82Å; Y334-T338 VanDerWaalsContact O-CB 3.27Å; Y334-T338 WeakPolarHBondContact O-CB 3.13Å; Y334-T338 PolarHBondContact O-N 3.38Å; Y334-T338 VanDerWaalsContact O-N 3.17Å; Y334-T338 PolarHBondContact O-OG1 3.4Å
335	V	98.5	Very high	97.2	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-70.1	-45.4	173.6	-176.1	0	0	0	0	110.3	I315 M319 L332 K333 W337 T338 L339 C350 L354	I315-V335 HydrophobicContact CG2-CG2 4.13Å; M319-V335 HydrophobicContact CE-CG2 3.87Å; L332-V335 PolarHBondContact O-N 3.04Å; K333-V335 PolarHBondContact O-N 2.84Å; V335-W337 PolarHBondContact O-N 2.66Å; V335-T338 PolarHBondContact O-N 3.33Å; V335-T338 VanDerWaalsContact O-N 3.07Å; V335-L339 PolarHBondContact O-N 3.18Å; V335-C350 HydrophobicContact CG1-CB 3.85Å; V335-L354 HydrophobicContact CG1-CD1 4.12Å; V335-L354 HydrophobicContact CG1-CD2 4.19Å; V335-L354 HydrophobicContact CG1-CG 3.93Å
336	G	97.8	Very high	97.4	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-60.4	-42.3	179.3	0	0	0	0	0	114.1	L332 K333 H340 F374	L332-G336 PolarHBondContact O-N 3.37Å; K333-G336 PolarHBondContact O-N 3.04Å; G336-H340 PolarHBondContact O-CE1 3.36Å; G336-H340 PolarHBondContact O-ND1 3.09Å; G336-F374 WeakPolarHBondContact O-CE1 3.45Å
337	W	98.3	Very high	97.5	Very high	121 Å²	121	48.9 Å²	48.9	46%	0.458	22%	0.223	S	C	.	.	H	α-helix	trans	-62.3	-44.9	170.7	-64.7	-29.1	0	0	0	111.4	K333 Y334 V335 L339 H340	K333-W337 HydrophobicContact CB-CZ2 4.32Å; K333-W337 HydrophobicContact CD-CH2 3.79Å; K333-W337 HydrophobicContact CD-CZ2 4.17Å; K333-W337 HydrophobicContact CD-CZ3 4.23Å; K333-W337 HydrophobicContact CG-CE3 4.43Å; K333-W337 HydrophobicContact CG-CH2 4.05Å; K333-W337 HydrophobicContact CG-CZ2 4.33Å; K333-W337 HydrophobicContact CG-CZ3 4.08Å; K333-W337 WeakPolarHBondContact O-CB 3.34Å; K333-W337 VanDerWaalsContact O-CD2 3.31Å; K333-W337 PolarHBondContact O-N 3.5Å; Y334-W337 AromaticContact CD1-CE3 3.99Å; Y334-W337 HydrophobicContact CD1-CE3 3.99Å; Y334-W337 AromaticContact CD1-CZ3 3.85Å; Y334-W337 HydrophobicContact CD1-CZ3 3.85Å; Y334-W337 HydrophobicContact CE1-CE3 4.42Å; Y334-W337 AromaticContact CE1-CZ3 3.82Å; Y334-W337 HydrophobicContact CE1-CZ3 3.82Å; V335-W337 PolarHBondContact O-N 2.66Å; W337-L339 VanDerWaalsContact C-N 3.3Å; W337-L339 PolarHBondContact O-N 3.19Å; W337-H340 WeakPolarHBondContact O-CB 3.45Å; W337-H340 PolarHBondContact O-N 3.16Å; W337-H340 VanDerWaalsContact O-N 3.08Å; W337-H340 PolarHBondContact O-ND1 3.41Å; W337-H340 VanDerWaalsContact O-ND1 3.1Å
338	T	98.6	Very high	97.6	Very high	10 Å²	10	50.1 Å²	50.1	6%	0.061	23%	0.229	C	C	.	.	H	α-helix	trans	-77.9	-9.9	-171.4	-46.5	0	0	0	0	114	I312 Y334 V335 H340 D341 V346	I312-T338 HydrophobicContact CD1-CG2 4.03Å; I312-T338 HydrophobicContact CG1-CG2 3.88Å; Y334-T338 VanDerWaalsContact O-CB 3.27Å; Y334-T338 WeakPolarHBondContact O-CB 3.13Å; Y334-T338 PolarHBondContact O-N 3.38Å; Y334-T338 VanDerWaalsContact O-N 3.17Å; Y334-T338 PolarHBondContact O-OG1 3.4Å; V335-T338 PolarHBondContact O-N 3.33Å; V335-T338 VanDerWaalsContact O-N 3.07Å; T338-H340 PolarHBondContact O-N 3.28Å; T338-D341 HydrophobicContact CG2-CB 4.16Å; T338-D341 WeakPolarHBondContact O-CB 3.45Å; T338-D341 PolarHBondContact O-N 2.93Å; T338-V346 HydrophobicContact CG2-CG1 3.41Å; T338-V346 VanDerWaalsContact CG2-CG1 3.41Å
339	L	98.5	Very high	97.8	Very high	0 Å²	0	50 Å²	50	0%	0	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-16.1	161.4	-71.3	169.6	0	0	0	113.3	V335 W337 C350 L351 L354 F370 F374 R377 I378 M381	V335-L339 PolarHBondContact O-N 3.18Å; W337-L339 VanDerWaalsContact C-N 3.3Å; W337-L339 PolarHBondContact O-N 3.19Å; L339-C350 HydrophobicContact CD2-CB 3.54Å; L339-C350 HydrophobicContact CG-CB 4.07Å; L339-L351 HydrophobicContact CD2-CD2 4.07Å; L339-L351 HydrophobicContact CD2-CG 4.42Å; L339-L354 HydrophobicContact CD1-CD1 4.25Å; L339-L354 HydrophobicContact CD2-CD1 4.36Å; L339-F370 HydrophobicContact CD1-CZ 4.43Å; L339-F374 HydrophobicContact CD1-CB 4.42Å; L339-R377 HydrophobicContact CB-CG 4.1Å; L339-R377 PolarHBondContact O-NE 3.43Å; L339-R377 PolarHBondContact O-NH2 2.97Å; L339-I378 HydrophobicContact CD1-CG1 4.05Å; L339-M381 HydrophobicContact CB-SD 4.16Å; L339-M381 HydrophobicContact CD2-CE 3.97Å; L339-M381 HydrophobicContact CD2-SD 3.88Å
340	H	98.3	Very high	98	Very high	106 Å²	106	46.1 Å²	46.1	49%	0.491	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.9	11	177.6	-52.9	81	0	0	0	113.2	G336 W337 T338 R377	G336-H340 PolarHBondContact O-CE1 3.36Å; G336-H340 PolarHBondContact O-ND1 3.09Å; W337-H340 WeakPolarHBondContact O-CB 3.45Å; W337-H340 PolarHBondContact O-N 3.16Å; W337-H340 VanDerWaalsContact O-N 3.08Å; W337-H340 PolarHBondContact O-ND1 3.41Å; W337-H340 VanDerWaalsContact O-ND1 3.1Å; T338-H340 PolarHBondContact O-N 3.28Å; H340-R377 WeakPolarHBondContact NE2-CG 3.4Å
341	D	98.6	Very high	98.2	Very high	25 Å²	25	43.3 Å²	43.3	13%	0.134	19%	0.186	C	C	.	.			trans	-61.7	145.1	177.5	-159.5	-69.8	0	0	0	112.1	R308 T338 Q343 V346 R347	R308-D341 IonicContact CZ-OD1 2.67Å; R308-D341 IonicContact CZ-OD2 2.72Å; R308-D341 VanDerWaalsContact CZ-OD2 3.28Å; R308-D341 IonicContact NE-OD1 3.25Å; R308-D341 IonicContact NE-OD2 3.05Å; R308-D341 PolarHBondContact NE-OD2 2.95Å; R308-D341 VanDerWaalsContact NH2-CG 3.34Å; R308-D341 IonicContact NH2-OD1 3.58Å; R308-D341 PolarHBondContact NH2-OD1 2.88Å; R308-D341 IonicContact NH2-OD2 3.16Å; R308-D341 PolarHBondContact NH2-OD2 3.29Å; R308-D341 VanDerWaalsContact NH2-OD2 3.08Å; T338-D341 HydrophobicContact CG2-CB 4.16Å; T338-D341 WeakPolarHBondContact O-CB 3.45Å; T338-D341 PolarHBondContact O-N 2.93Å; D341-Q343 VanDerWaalsContact C-N 3.29Å; D341-Q343 PolarHBondContact O-N 3.45Å; D341-Q343 PolarHBondContact OD1-N 2.87Å; D341-V346 HydrophobicContact CB-CB 3.95Å; D341-V346 HydrophobicContact CB-CG1 4.1Å; D341-R347 HydrophobicContact CB-CG 4.19Å; D341-R347 VanDerWaalsContact O-CD 3.27Å; D341-R347 WeakPolarHBondContact O-CD 3.4Å; D341-R347 WeakPolarHBondContact O-CG 3.18Å; D341-R347 PolarHBondContact O-NH1 3.42Å
342	R	97.5	Very high	98.2	Very high	226 Å²	226	45.7 Å²	45.7	85%	0.853	20%	0.197	S	C	*	.	S	Bend	trans	-69.8	-24.2	178.6	-63.7	-176.1	-179.8	-175.4	-0.2	112.9	R347	R342-R347 PolarHBondContact O-NH1 2.74Å
343	Q	98.3	Very high	98.2	Very high	103 Å²	103	46 Å²	46	48%	0.481	20%	0.2	S	C	.	.	S	Bend	trans	-104.5	126.2	-176.5	-56.4	-61.2	-18.6	0	0	111.6	A305 D341 E345 V346 R347	A305-Q343 HydrophobicContact CB-CB 3.96Å; A305-Q343 HydrophobicContact CB-CG 3.87Å; D341-Q343 VanDerWaalsContact C-N 3.29Å; D341-Q343 PolarHBondContact O-N 3.45Å; D341-Q343 PolarHBondContact OD1-N 2.87Å; Q343-E345 VanDerWaalsContact C-N 3.32Å; Q343-E345 PolarHBondContact O-N 3.23Å; Q343-V346 HydrophobicContact CB-CG2 4.23Å; Q343-V346 PolarHBondContact O-N 3.27Å; Q343-V346 VanDerWaalsContact O-N 3.13Å; Q343-R347 PolarHBondContact O-N 2.73Å
344	G	97.8	Very high	98.2	Very high	2 Å²	2	42.4 Å²	42.4	2%	0.021	18%	0.184	C	C	.	.	H	α-helix	trans	-68.1	-26.6	-173.6	0	0	0	0	0	114.4	V346 R347 L348 E386 V389	G344-V346 PolarHBondContact O-N 3.39Å; G344-V346 VanDerWaalsContact O-N 3.15Å; G344-R347 VanDerWaalsContact CA-CZ 3.46Å; G344-R347 PolarHBondContact O-N 2.93Å; G344-L348 WeakPolarHBondContact O-CB 3.48Å; G344-L348 PolarHBondContact O-N 3.42Å; G344-E386 VanDerWaalsContact CA-CD 3.44Å; G344-E386 WeakPolarHBondContact CA-OE1 3.32Å; G344-E386 WeakPolarHBondContact CA-OE2 3.47Å; G344-E386 PolarHBondContact N-OE1 3.43Å; G344-E386 PolarHBondContact N-OE2 3.25Å; G344-V389 WeakPolarHBondContact O-CG2 3.39Å
345	E	97.3	Very high	98.1	Very high	81 Å²	81	42.8 Å²	42.8	38%	0.379	19%	0.187	S	C	.	.	H	α-helix	trans	-56	-33.4	172.3	72.4	165.6	148.2	0	0	112.2	A305 E306 Q343 K349	A305-E345 HydrophobicContact CB-CG 4.24Å; A305-E345 WeakPolarHBondContact CB-OE1 3.31Å; E306-E345 PolarHBondContact N-OE1 3.48Å; Q343-E345 VanDerWaalsContact C-N 3.32Å; Q343-E345 PolarHBondContact O-N 3.23Å; E345-K349 WeakPolarHBondContact O-CG 3.15Å; E345-K349 PolarHBondContact O-N 2.9Å
346	V	98.7	Very high	97.9	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-80	-44.4	179.9	-166.6	0	0	0	0	110	A305 R308 A309 I312 T338 D341 Q343 G344 L348 K349 C350	A305-V346 HydrophobicContact CB-CG2 3.88Å; R308-V346 HydrophobicContact CB-CG1 3.96Å; R308-V346 HydrophobicContact CB-CG2 4.26Å; A309-V346 HydrophobicContact CB-CG2 4.38Å; I312-V346 HydrophobicContact CG1-CG1 4.48Å; T338-V346 HydrophobicContact CG2-CG1 3.41Å; T338-V346 VanDerWaalsContact CG2-CG1 3.41Å; D341-V346 HydrophobicContact CB-CB 3.95Å; D341-V346 HydrophobicContact CB-CG1 4.1Å; Q343-V346 HydrophobicContact CB-CG2 4.23Å; Q343-V346 PolarHBondContact O-N 3.27Å; Q343-V346 VanDerWaalsContact O-N 3.13Å; G344-V346 PolarHBondContact O-N 3.39Å; G344-V346 VanDerWaalsContact O-N 3.15Å; V346-L348 VanDerWaalsContact C-N 3.27Å; V346-L348 PolarHBondContact O-N 2.86Å; V346-K349 PolarHBondContact O-N 3.41Å; V346-K349 VanDerWaalsContact O-N 3.14Å; V346-C350 PolarHBondContact O-N 2.85Å; V346-C350 VanDerWaalsContact O-N 3.09Å; V346-C350 PolarHBondContact O-SG 3.48Å; V346-C350 VanDerWaalsContact O-SG 3.41Å
347	R	98.8	Very high	97.7	Very high	13 Å²	13	44.1 Å²	44.1	5%	0.049	20%	0.196	C	C	.	.	H	α-helix	trans	-58	-40.2	174.1	-62.4	-163.6	-64	-70.4	-5.9	111.7	D341 R342 Q343 G344 K349 C350 L351 M381 D384 E386 V389	D341-R347 HydrophobicContact CB-CG 4.19Å; D341-R347 VanDerWaalsContact O-CD 3.27Å; D341-R347 WeakPolarHBondContact O-CD 3.4Å; D341-R347 WeakPolarHBondContact O-CG 3.18Å; D341-R347 PolarHBondContact O-NH1 3.42Å; R342-R347 PolarHBondContact O-NH1 2.74Å; Q343-R347 PolarHBondContact O-N 2.73Å; G344-R347 VanDerWaalsContact CA-CZ 3.46Å; G344-R347 PolarHBondContact O-N 2.93Å; R347-K349 PolarHBondContact O-N 3.22Å; R347-C350 WeakPolarHBondContact O-CB 3.43Å; R347-C350 PolarHBondContact O-N 2.8Å; R347-L351 WeakPolarHBondContact O-CG 3.37Å; R347-L351 PolarHBondContact O-N 3.34Å; R347-M381 HydrophobicContact CB-CE 3.82Å; R347-M381 HydrophobicContact CG-CE 4.39Å; R347-D384 IonicContact CZ-OD1 2.67Å; R347-D384 IonicContact CZ-OD2 3.18Å; R347-D384 IonicContact NE-OD1 3.03Å; R347-D384 IonicContact NE-OD2 3.24Å; R347-D384 PolarHBondContact NE-OD2 3.42Å; R347-D384 IonicContact NH2-OD1 2.85Å; R347-D384 PolarHBondContact NH2-OD1 3.28Å; R347-D384 IonicContact NH2-OD2 2.86Å; R347-D384 PolarHBondContact NH2-OD2 3.47Å; R347-E386 IonicContact CZ-OE1 3.37Å; R347-E386 IonicContact NH1-OE1 2.66Å; R347-E386 IonicContact NH2-OE1 2.71Å; R347-E386 PolarHBondContact NH2-OE1 3.35Å; R347-V389 HydrophobicContact CB-CG1 3.91Å; R347-V389 HydrophobicContact CB-CG2 4.41Å
348	L	98.5	Very high	97.5	Very high	33 Å²	33	38.6 Å²	38.6	17%	0.173	18%	0.175	C	C	.	.	H	α-helix	trans	-60.4	-40.9	176.3	-169.4	72.1	0	0	0	112	G344 V346 L351 K352 D388 V389 E392	G344-L348 WeakPolarHBondContact O-CB 3.48Å; G344-L348 PolarHBondContact O-N 3.42Å; V346-L348 VanDerWaalsContact C-N 3.27Å; V346-L348 PolarHBondContact O-N 2.86Å; L348-L351 PolarHBondContact O-N 3.35Å; L348-K352 HydrophobicContact CG-CD 4.4Å; L348-K352 WeakPolarHBondContact O-CG 3.46Å; L348-K352 PolarHBondContact O-N 2.88Å; L348-D388 HydrophobicContact CD1-CB 4.2Å; L348-D388 VanDerWaalsContact CD1-O 3.26Å; L348-D388 WeakPolarHBondContact CD1-O 3.38Å; L348-V389 HydrophobicContact CB-CG2 4.36Å; L348-E392 HydrophobicContact CD1-CB 4.18Å; L348-E392 HydrophobicContact CD1-CG 3.63Å
349	K	98.4	Very high	97.1	Very high	53 Å²	53	42.5 Å²	42.5	23%	0.23	20%	0.199	C	C	.	.	H	α-helix	trans	-68.7	-37.8	174.9	-64.5	-68.2	178.7	155	0	111.9	A309 I312 E313 E345 V346 R347 L351 K352 A353	A309-K349 HydrophobicContact CB-CG 4Å; I312-K349 HydrophobicContact CB-CB 4.36Å; I312-K349 HydrophobicContact CG2-CB 3.89Å; E313-K349 HydrophobicContact CB-CD 4.16Å; E313-K349 HydrophobicContact CG-CD 4.37Å; E313-K349 IonicContact OE1-NZ 3.77Å; E313-K349 PolarHBondContact OE1-NZ 2.81Å; E313-K349 IonicContact OE2-NZ 2.68Å; E313-K349 PolarHBondContact OE2-NZ 3.15Å; E345-K349 WeakPolarHBondContact O-CG 3.15Å; E345-K349 PolarHBondContact O-N 2.9Å; V346-K349 PolarHBondContact O-N 3.41Å; V346-K349 VanDerWaalsContact O-N 3.14Å; R347-K349 PolarHBondContact O-N 3.22Å; K349-L351 PolarHBondContact O-N 3.08Å; K349-K352 PolarHBondContact O-N 3.26Å; K349-A353 VanDerWaalsContact O-CB 3.29Å; K349-A353 WeakPolarHBondContact O-CB 3.47Å; K349-A353 PolarHBondContact O-N 2.82Å
350	C	98.8	Very high	96.6	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-57.6	-49.3	173	-62.6	0	0	0	0	111.3	I312 V335 L339 V346 R347 A353 L354	I312-C350 HydrophobicContact CG2-CB 4.31Å; V335-C350 HydrophobicContact CG1-CB 3.85Å; L339-C350 HydrophobicContact CD2-CB 3.54Å; L339-C350 HydrophobicContact CG-CB 4.07Å; V346-C350 PolarHBondContact O-N 2.85Å; V346-C350 VanDerWaalsContact O-N 3.09Å; V346-C350 PolarHBondContact O-SG 3.48Å; V346-C350 VanDerWaalsContact O-SG 3.41Å; R347-C350 WeakPolarHBondContact O-CB 3.43Å; R347-C350 PolarHBondContact O-N 2.8Å; C350-A353 PolarHBondContact O-N 3.01Å; C350-L354 WeakPolarHBondContact O-CG 3.47Å; C350-L354 PolarHBondContact O-N 3.35Å
351	L	98.6	Very high	95.8	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-61.5	-47.4	178.8	-66.5	171.1	0	0	0	111.9	L339 R347 L348 K349 A353 L354 Q355 M381 V389 E392 A393 L396	L339-L351 HydrophobicContact CD2-CD2 4.07Å; L339-L351 HydrophobicContact CD2-CG 4.42Å; R347-L351 WeakPolarHBondContact O-CG 3.37Å; R347-L351 PolarHBondContact O-N 3.34Å; L348-L351 PolarHBondContact O-N 3.35Å; K349-L351 PolarHBondContact O-N 3.08Å; L351-A353 PolarHBondContact O-N 3.18Å; L351-L354 PolarHBondContact O-N 2.75Å; L351-Q355 WeakPolarHBondContact O-CG 3.24Å; L351-Q355 PolarHBondContact O-N 2.8Å; L351-M381 HydrophobicContact CD1-CE 3.83Å; L351-M381 HydrophobicContact CD2-CE 4Å; L351-M381 HydrophobicContact CG-CE 3.91Å; L351-V389 HydrophobicContact CD1-CG1 3.67Å; L351-V389 WeakPolarHBondContact CD1-O 3.45Å; L351-E392 HydrophobicContact CB-CB 4.17Å; L351-E392 HydrophobicContact CD1-CB 3.98Å; L351-A393 HydrophobicContact CD1-CB 4.01Å; L351-A393 HydrophobicContact CD2-CB 4.21Å; L351-L396 HydrophobicContact CD2-CD2 3.62Å
352	K	97.8	Very high	95.3	Very high	88 Å²	88	54.2 Å²	54.2	38%	0.383	25%	0.248	S	C	.	.	H	α-helix	trans	-66.8	-35.7	-179.4	-69.8	-177.1	-174.4	-152.9	0	112.9	L348 K349 S356 E392	L348-K352 HydrophobicContact CG-CD 4.4Å; L348-K352 WeakPolarHBondContact O-CG 3.46Å; L348-K352 PolarHBondContact O-N 2.88Å; K349-K352 PolarHBondContact O-N 3.26Å; K352-S356 WeakPolarHBondContact O-CB 3.43Å; K352-S356 PolarHBondContact O-N 3.18Å; K352-S356 VanDerWaalsContact O-N 3.15Å; K352-E392 VanDerWaalsContact CE-CG 3.43Å; K352-E392 WeakPolarHBondContact CE-OE1 3.18Å; K352-E392 IonicContact NZ-OE1 2.8Å; K352-E392 PolarHBondContact NZ-OE1 2.8Å
353	A	96.9	Very high	94.8	Very high	8 Å²	8	44 Å²	44	7%	0.066	21%	0.211	C	C	.	.	H	α-helix	trans	-58.6	-51	170.2	0	0	0	0	0	110.7	K349 C350 L351 S356	K349-A353 VanDerWaalsContact O-CB 3.29Å; K349-A353 WeakPolarHBondContact O-CB 3.47Å; K349-A353 PolarHBondContact O-N 2.82Å; C350-A353 PolarHBondContact O-N 3.01Å; L351-A353 PolarHBondContact O-N 3.18Å; A353-S356 WeakPolarHBondContact O-CB 3.31Å; A353-S356 PolarHBondContact O-N 2.86Å; A353-S356 PolarHBondContact O-OG 2.73Å
354	L	97.4	Very high	94.3	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-62.2	-51.8	178.8	-68.9	171.6	0	0	0	112.6	V335 L339 C350 L351 S356 L357 Y358 F370 I378 L396	V335-L354 HydrophobicContact CG1-CD1 4.12Å; V335-L354 HydrophobicContact CG1-CD2 4.19Å; V335-L354 HydrophobicContact CG1-CG 3.93Å; L339-L354 HydrophobicContact CD1-CD1 4.25Å; L339-L354 HydrophobicContact CD2-CD1 4.36Å; C350-L354 WeakPolarHBondContact O-CG 3.47Å; C350-L354 PolarHBondContact O-N 3.35Å; L351-L354 PolarHBondContact O-N 2.75Å; L354-S356 PolarHBondContact O-N 2.77Å; L354-S356 VanDerWaalsContact O-N 3.12Å; L354-L357 WeakPolarHBondContact O-CA 3.07Å; L354-L357 WeakPolarHBondContact O-CB 3.12Å; L354-L357 PolarHBondContact O-N 2.87Å; L354-Y358 HydrophobicContact CB-CD2 4.29Å; L354-Y358 HydrophobicContact CB-CE2 4.12Å; L354-Y358 HydrophobicContact CD2-CE2 4.34Å; L354-Y358 VanDerWaalsContact O-CD2 3.23Å; L354-Y358 WeakPolarHBondContact O-CD2 3.17Å; L354-Y358 PolarHBondContact O-N 3.19Å; L354-F370 HydrophobicContact CD1-CE1 3.81Å; L354-F370 HydrophobicContact CD1-CZ 4.08Å; L354-F370 HydrophobicContact CD2-CD1 4.19Å; L354-F370 HydrophobicContact CD2-CE1 3.5Å; L354-F370 VanDerWaalsContact CD2-CE1 3.5Å; L354-F370 HydrophobicContact CD2-CZ 3.87Å; L354-F370 HydrophobicContact CG-CE1 4.33Å; L354-I378 HydrophobicContact CD1-CD1 4.47Å; L354-L396 HydrophobicContact CB-CD1 3.93Å; L354-L396 HydrophobicContact CB-CD2 3.84Å; L354-L396 HydrophobicContact CD1-CD2 3.87Å
355	Q	96.3	Very high	93.9	Very high	30 Å²	30	45.3 Å²	45.3	14%	0.14	23%	0.225	C	C	.	.	H	α-helix	trans	-48.3	-43.3	175.8	-74.2	175.9	-4.6	0	0	111.4	L351 L357 Y358 T359 E392 L396 L399	L351-Q355 WeakPolarHBondContact O-CG 3.24Å; L351-Q355 PolarHBondContact O-N 2.8Å; Q355-L357 PolarHBondContact O-N 3.03Å; Q355-Y358 PolarHBondContact O-N 2.88Å; Q355-T359 PolarHBondContact O-N 3.46Å; Q355-T359 PolarHBondContact O-OG1 3.42Å; Q355-E392 PolarHBondContact NE2-O 3.26Å; Q355-E392 PolarHBondContact NE2-OE2 3.41Å; Q355-L396 HydrophobicContact CG-CB 4.09Å; Q355-L396 HydrophobicContact CG-CD1 4.19Å; Q355-L399 HydrophobicContact CB-CD1 3.94Å; Q355-L399 HydrophobicContact CG-CD1 4.11Å
356	S	94.1	Very high	93.5	Very high	28 Å²	28	45 Å²	45	20%	0.196	22%	0.222	C	C	.	.	H	α-helix	trans	-63.8	-23.6	-178.7	87.9	0	0	0	0	113.7	K320 K352 A353 L354	K320-S356 WeakPolarHBondContact CD-O 3.41Å; K320-S356 WeakPolarHBondContact CE-O 3.07Å; K320-S356 PolarHBondContact NZ-O 3.12Å; K352-S356 WeakPolarHBondContact O-CB 3.43Å; K352-S356 PolarHBondContact O-N 3.18Å; K352-S356 VanDerWaalsContact O-N 3.15Å; A353-S356 WeakPolarHBondContact O-CB 3.31Å; A353-S356 PolarHBondContact O-N 2.86Å; A353-S356 PolarHBondContact O-OG 2.73Å; L354-S356 PolarHBondContact O-N 2.77Å; L354-S356 VanDerWaalsContact O-N 3.12Å
357	L	94.8	Very high	93.3	Very high	0 Å²	0	45 Å²	45	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-86.7	-50.4	175.5	-57.6	168.6	0	0	0	111.1	M319 K320 L327 L332 L354 Q355 T359 N360 L363 L367	M319-L357 HydrophobicContact CB-CD1 4.32Å; M319-L357 HydrophobicContact CB-CD2 4.01Å; M319-L357 HydrophobicContact CE-CD1 4.22Å; K320-L357 HydrophobicContact CB-CD2 3.82Å; L327-L357 HydrophobicContact CD1-CD1 3.85Å; L327-L357 HydrophobicContact CD1-CD2 4.34Å; L332-L357 HydrophobicContact CD2-CD1 4.41Å; L354-L357 WeakPolarHBondContact O-CA 3.07Å; L354-L357 WeakPolarHBondContact O-CB 3.12Å; L354-L357 PolarHBondContact O-N 2.87Å; Q355-L357 PolarHBondContact O-N 3.03Å; L357-T359 PolarHBondContact O-N 2.8Å; L357-T359 VanDerWaalsContact O-N 3.08Å; L357-N360 PolarHBondContact O-N 3.32Å; L357-L363 HydrophobicContact CD2-CD1 4.34Å; L357-L367 HydrophobicContact CB-CD1 4Å; L357-L367 HydrophobicContact CB-CD2 4.49Å; L357-L367 HydrophobicContact CD1-CD2 4.31Å
358	Y	93.4	Very high	92.9	Very high	5 Å²	5	50.1 Å²	50.1	2%	0.02	25%	0.247	C	C	.	.	H	α-helix	trans	-64.9	-9.2	175.5	-65.8	-83.1	0	0	0	113.6	L354 Q355 N360 F364 L367 T371 L396 I400	L354-Y358 HydrophobicContact CB-CD2 4.29Å; L354-Y358 HydrophobicContact CB-CE2 4.12Å; L354-Y358 HydrophobicContact CD2-CE2 4.34Å; L354-Y358 VanDerWaalsContact O-CD2 3.23Å; L354-Y358 WeakPolarHBondContact O-CD2 3.17Å; L354-Y358 PolarHBondContact O-N 3.19Å; Q355-Y358 PolarHBondContact O-N 2.88Å; Y358-N360 VanDerWaalsContact C-N 3.27Å; Y358-F364 HydrophobicContact CD1-CD1 4.12Å; Y358-F364 AromaticContact CD1-CE1 3.64Å; Y358-F364 HydrophobicContact CD1-CE1 3.64Å; Y358-F364 HydrophobicContact CD1-CE2 4.27Å; Y358-F364 AromaticContact CD1-CZ 3.74Å; Y358-F364 HydrophobicContact CD1-CZ 3.74Å; Y358-F364 HydrophobicContact CE1-CE1 4.34Å; Y358-F364 HydrophobicContact CG-CZ 4.36Å; Y358-F364 WeakPolarHBondContact O-CE2 3.36Å; Y358-F364 WeakPolarHBondContact O-CZ 3.33Å; Y358-L367 HydrophobicContact CD1-CD1 3.75Å; Y358-L367 HydrophobicContact CD2-CD1 4.29Å; Y358-L367 HydrophobicContact CE1-CB 3.85Å; Y358-L367 HydrophobicContact CE1-CD1 3.81Å; Y358-L367 HydrophobicContact CE1-CG 4.36Å; Y358-L367 HydrophobicContact CE2-CD1 4.31Å; Y358-L367 HydrophobicContact CG-CD1 4.01Å; Y358-T371 PolarHBondContact OH-OG1 2.95Å; Y358-L396 HydrophobicContact CD2-CD1 3.43Å; Y358-L396 VanDerWaalsContact CD2-CD1 3.43Å; Y358-L396 HydrophobicContact CE2-CD1 3.8Å; Y358-L396 HydrophobicContact CG-CD1 4.28Å; Y358-I400 HydrophobicContact CD1-CG1 4.11Å; Y358-I400 HydrophobicContact CE1-CG1 3.86Å; Y358-I400 HydrophobicContact CE2-CG1 4.44Å; Y358-I400 HydrophobicContact CG-CG1 4.49Å
359	T	90.9	Very high	92.5	Very high	92 Å²	92	54 Å²	54	56%	0.564	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-26.8	167.2	-53.1	0	0	0	0	112.1	Q355 L357	Q355-T359 PolarHBondContact O-N 3.46Å; Q355-T359 PolarHBondContact O-OG1 3.42Å; L357-T359 PolarHBondContact O-N 2.8Å; L357-T359 VanDerWaalsContact O-N 3.08Å
360	N	86.4	Confident	92.4	Very high	61 Å²	61	51.7 Å²	51.7	33%	0.326	26%	0.257	S	S	.	.	S	Bend	trans	-98.8	110.8	174.5	-175.3	2.1	0	0	0	110.9	L357 Y358 E362 L363	L357-N360 PolarHBondContact O-N 3.32Å; Y358-N360 VanDerWaalsContact C-N 3.27Å; N360-E362 PolarHBondContact ND2-OE2 2.86Å; N360-E362 PolarHBondContact O-N 3.16Å; N360-E362 WeakPolarHBondContact OD1-CB 3.26Å; N360-E362 PolarHBondContact OD1-N 2.91Å; N360-L363 HydrophobicContact CB-CD1 3.96Å; N360-L363 HydrophobicContact CB-CG 3.97Å; N360-L363 PolarHBondContact O-N 3.43Å
361	R	82.3	Confident	92.2	Very high	155 Å²	155	52 Å²	52	59%	0.585	26%	0.259	S	S	*	.	G	3₁₀ helix	trans	-55.4	-30.4	176.9	-76.8	-178.5	162.8	-150.7	-9.1	113.9	L363 F364 H402	R361-L363 PolarHBondContact O-N 3.1Å; R361-F364 PolarHBondContact O-N 3.08Å; R361-H402 PolarHBondContact NH2-CE1 2.81Å; R361-H402 VanDerWaalsContact NH2-CE1 3.25Å; R361-H402 PolarHBondContact NH2-NE2 2.84Å; R361-H402 PolarHBondContact NH2-O 3.37Å; R361-H402 VanDerWaalsContact NH2-O 3.12Å
362	E	87.5	Confident	91.8	Very high	161 Å²	161	56.7 Å²	56.7	75%	0.752	28%	0.284	S	S	*	.	G	3₁₀ helix	trans	-67	-19.3	178.8	-59.4	176	149.5	0	0	113.4	N360	N360-E362 PolarHBondContact ND2-OE2 2.86Å; N360-E362 PolarHBondContact O-N 3.16Å; N360-E362 WeakPolarHBondContact OD1-CB 3.26Å; N360-E362 PolarHBondContact OD1-N 2.91Å
363	L	88.4	Confident	91.7	Very high	12 Å²	12	61.2 Å²	61.2	6%	0.063	30%	0.298	C	S	.	.	G	3₁₀ helix	trans	-91	-10.9	-176.3	-57.2	-177.2	0	0	0	113.7	L327 L357 N360 R361 K366 L367	L327-L363 HydrophobicContact CD2-CB 3.85Å; L327-L363 HydrophobicContact CD2-CD1 4.09Å; L327-L363 HydrophobicContact CD2-CD2 4.01Å; L327-L363 HydrophobicContact CD2-CG 4.19Å; L357-L363 HydrophobicContact CD2-CD1 4.34Å; N360-L363 HydrophobicContact CB-CD1 3.96Å; N360-L363 HydrophobicContact CB-CG 3.97Å; N360-L363 PolarHBondContact O-N 3.43Å; R361-L363 PolarHBondContact O-N 3.1Å; L363-K366 WeakPolarHBondContact O-CB 3.27Å; L363-K366 PolarHBondContact O-N 2.76Å; L363-L367 HydrophobicContact CB-CD1 4.3Å; L363-L367 PolarHBondContact O-N 2.99Å
364	F	87.3	Confident	91.7	Very high	30 Å²	30	61.9 Å²	61.9	13%	0.132	30%	0.3	C	S	.	.	H	α-helix	trans	-56.2	-42.6	-175.9	-84.2	-109.9	0	0	0	114.3	Y358 R361 K366 L367 E368 G403	Y358-F364 HydrophobicContact CD1-CD1 4.12Å; Y358-F364 AromaticContact CD1-CE1 3.64Å; Y358-F364 HydrophobicContact CD1-CE1 3.64Å; Y358-F364 HydrophobicContact CD1-CE2 4.27Å; Y358-F364 AromaticContact CD1-CZ 3.74Å; Y358-F364 HydrophobicContact CD1-CZ 3.74Å; Y358-F364 HydrophobicContact CE1-CE1 4.34Å; Y358-F364 HydrophobicContact CG-CZ 4.36Å; Y358-F364 WeakPolarHBondContact O-CE2 3.36Å; Y358-F364 WeakPolarHBondContact O-CZ 3.33Å; R361-F364 PolarHBondContact O-N 3.08Å; F364-K366 PolarHBondContact O-N 3.28Å; F364-L367 CarbonylContact O-C 3.49Å; F364-L367 WeakPolarHBondContact O-CA 3.39Å; F364-L367 PolarHBondContact O-N 3.31Å; F364-E368 PolarHBondContact O-N 3.26Å; F364-G403 VanDerWaalsContact CE1-CA 3.41Å
365	P	89.4	Confident	91.6	Very high	102 Å²	102	63.8 Å²	63.8	66%	0.662	31%	0.308	S	S	*	.	H	α-helix	trans	-62.5	-23.2	177	-24.8	35.8	0	0	0	114.3
366	K	89.9	Confident	91.6	Very high	75 Å²	75	67.7 Å²	67.7	33%	0.326	33%	0.33	S	S	.	.	H	α-helix	trans	-84.5	-13.4	172.5	-65.6	179.8	175.7	178.3	0	112.9	S323 D324 L327 L363 F364	S323-K366 PolarHBondContact O-NZ 3.24Å; D324-K366 IonicContact OD1-NZ 3.16Å; D324-K366 PolarHBondContact OD1-NZ 3.39Å; L327-K366 HydrophobicContact CB-CD 4.35Å; L327-K366 HydrophobicContact CD2-CB 3.84Å; L327-K366 HydrophobicContact CD2-CD 3.99Å; L327-K366 HydrophobicContact CG-CB 4.06Å; L327-K366 HydrophobicContact CG-CD 4.29Å; L363-K366 WeakPolarHBondContact O-CB 3.27Å; L363-K366 PolarHBondContact O-N 2.76Å; F364-K366 PolarHBondContact O-N 3.28Å
367	L	93.3	Very high	91.8	Very high	0 Å²	0	69 Å²	69	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-104.2	-17.5	-178	-70.3	166.8	0	0	0	113.3	L327 L332 L357 Y358 L363 F364 L369 F370 T371	L327-L367 HydrophobicContact CD1-CD2 3.96Å; L327-L367 HydrophobicContact CD2-CG 4.47Å; L332-L367 HydrophobicContact CD1-CD2 4.32Å; L332-L367 HydrophobicContact CD2-CD2 4.17Å; L357-L367 HydrophobicContact CB-CD1 4Å; L357-L367 HydrophobicContact CB-CD2 4.49Å; L357-L367 HydrophobicContact CD1-CD2 4.31Å; Y358-L367 HydrophobicContact CD1-CD1 3.75Å; Y358-L367 HydrophobicContact CD2-CD1 4.29Å; Y358-L367 HydrophobicContact CE1-CB 3.85Å; Y358-L367 HydrophobicContact CE1-CD1 3.81Å; Y358-L367 HydrophobicContact CE1-CG 4.36Å; Y358-L367 HydrophobicContact CE2-CD1 4.31Å; Y358-L367 HydrophobicContact CG-CD1 4.01Å; L363-L367 HydrophobicContact CB-CD1 4.3Å; L363-L367 PolarHBondContact O-N 2.99Å; F364-L367 CarbonylContact O-C 3.49Å; F364-L367 WeakPolarHBondContact O-CA 3.39Å; F364-L367 PolarHBondContact O-N 3.31Å; L367-L369 PolarHBondContact O-N 3.12Å; L367-F370 WeakPolarHBondContact O-CB 3.18Å; L367-F370 PolarHBondContact O-N 2.89Å; L367-F370 VanDerWaalsContact O-N 3.13Å; L367-T371 PolarHBondContact O-N 2.99Å; L367-T371 PolarHBondContact O-OG1 2.8Å
368	E	90.1	Very high	91.9	Very high	120 Å²	120	69.1 Å²	69.1	56%	0.561	33%	0.331	S	S	*	.	H	α-helix	trans	-53.9	-51	-173.5	-166.4	-168.7	147.9	0	0	113	F364 F370 T371 N372	F364-E368 PolarHBondContact O-N 3.26Å; E368-F370 VanDerWaalsContact C-N 3.32Å; E368-F370 PolarHBondContact O-N 2.98Å; E368-T371 WeakPolarHBondContact O-CB 3.31Å; E368-T371 PolarHBondContact O-N 3.39Å; E368-T371 VanDerWaalsContact O-N 3.11Å; E368-N372 VanDerWaalsContact O-CG 3.3Å; E368-N372 PolarHBondContact O-N 3.09Å
369	L	91.6	Very high	92.1	Very high	113 Å²	113	69.5 Å²	69.5	59%	0.592	33%	0.334	S	S	*	.	H	α-helix	trans	-61.8	-37.1	178.8	-178.7	61.4	0	0	0	112.9	L367 R373	L367-L369 PolarHBondContact O-N 3.12Å; L369-R373 WeakPolarHBondContact O-CB 3.33Å; L369-R373 PolarHBondContact O-N 3.06Å
370	F	95.6	Very high	92.4	Very high	6 Å²	6	67.8 Å²	67.8	3%	0.026	33%	0.326	C	S	.	.	H	α-helix	trans	-67.1	-44.3	173.5	177.7	-86.7	0	0	0	111.2	L332 L339 L354 L367 E368 R373 F374	L332-F370 HydrophobicContact CB-CD2 3.83Å; L332-F370 HydrophobicContact CB-CE2 4.26Å; L332-F370 HydrophobicContact CD1-CB 4.23Å; L332-F370 HydrophobicContact CD2-CD2 4.37Å; L332-F370 HydrophobicContact CG-CD2 4.49Å; L332-F370 WeakPolarHBondContact O-CE2 3.48Å; L339-F370 HydrophobicContact CD1-CZ 4.43Å; L354-F370 HydrophobicContact CD1-CE1 3.81Å; L354-F370 HydrophobicContact CD1-CZ 4.08Å; L354-F370 HydrophobicContact CD2-CD1 4.19Å; L354-F370 HydrophobicContact CD2-CE1 3.5Å; L354-F370 VanDerWaalsContact CD2-CE1 3.5Å; L354-F370 HydrophobicContact CD2-CZ 3.87Å; L354-F370 HydrophobicContact CG-CE1 4.33Å; L367-F370 WeakPolarHBondContact O-CB 3.18Å; L367-F370 PolarHBondContact O-N 2.89Å; L367-F370 VanDerWaalsContact O-N 3.13Å; E368-F370 VanDerWaalsContact C-N 3.32Å; E368-F370 PolarHBondContact O-N 2.98Å; F370-R373 PolarHBondContact O-N 3.44Å; F370-F374 HydrophobicContact CD1-CD2 4.39Å; F370-F374 AromaticContact CD2-CD2 3.58Å; F370-F374 HydrophobicContact CD2-CD2 3.58Å; F370-F374 AromaticContact CD2-CE2 3.8Å; F370-F374 HydrophobicContact CD2-CE2 3.8Å; F370-F374 HydrophobicContact CE1-CB 4.34Å; F370-F374 HydrophobicContact CE1-CD2 4.23Å; F370-F374 AromaticContact CE2-CD2 3.41Å; F370-F374 HydrophobicContact CE2-CD2 3.41Å; F370-F374 VanDerWaalsContact CE2-CD2 3.41Å; F370-F374 AromaticContact CE2-CE2 3.62Å; F370-F374 HydrophobicContact CE2-CE2 3.62Å; F370-F374 HydrophobicContact CE2-CG 4.29Å; F370-F374 HydrophobicContact CG-CD2 4.09Å; F370-F374 HydrophobicContact CZ-CB 4.38Å; F370-F374 AromaticContact CZ-CD2 3.75Å; F370-F374 HydrophobicContact CZ-CD2 3.75Å; F370-F374 HydrophobicContact CZ-CE2 4.35Å; F370-F374 HydrophobicContact CZ-CG 4.22Å; F370-F374 WeakPolarHBondContact O-CD2 3.47Å; F370-F374 PolarHBondContact O-N 2.96Å
371	T	93.6	Very high	93	Very high	7 Å²	7	64.9 Å²	64.9	4%	0.043	31%	0.31	C	S	.	.	H	α-helix	trans	-56.9	-55.9	177.5	-45.4	0	0	0	0	109.5	Y358 L367 E368 R373 F374 K375 I400	Y358-T371 PolarHBondContact OH-OG1 2.95Å; L367-T371 PolarHBondContact O-N 2.99Å; L367-T371 PolarHBondContact O-OG1 2.8Å; E368-T371 WeakPolarHBondContact O-CB 3.31Å; E368-T371 PolarHBondContact O-N 3.39Å; E368-T371 VanDerWaalsContact O-N 3.11Å; T371-R373 PolarHBondContact O-N 3.47Å; T371-R373 VanDerWaalsContact O-N 3.09Å; T371-F374 PolarHBondContact O-N 3.1Å; T371-F374 VanDerWaalsContact O-N 3.09Å; T371-K375 WeakPolarHBondContact O-CA 3.3Å; T371-K375 VanDerWaalsContact O-CB 3.28Å; T371-K375 WeakPolarHBondContact O-CB 3.22Å; T371-K375 PolarHBondContact O-N 2.69Å; T371-I400 HydrophobicContact CG2-CD1 4.12Å; T371-I400 HydrophobicContact CG2-CG1 4.27Å; T371-I400 HydrophobicContact CG2-CG2 3.9Å
372	N	91.4	Very high	93.7	Very high	97 Å²	97	57.7 Å²	57.7	52%	0.519	28%	0.284	S	S	.	.	H	α-helix	trans	-62.1	-22.4	-178.4	-64.4	-12.5	0	0	0	113.3	E368	E368-N372 VanDerWaalsContact O-CG 3.3Å; E368-N372 PolarHBondContact O-N 3.09Å
373	R	95.3	Very high	94.2	Very high	183 Å²	183	54.6 Å²	54.6	69%	0.691	27%	0.272	S	S	*	.	H	α-helix	trans	-87.4	-28.4	176.2	-175.8	172.4	-176.9	164.9	5	114.2	L369 F370 T371	L369-R373 WeakPolarHBondContact O-CB 3.33Å; L369-R373 PolarHBondContact O-N 3.06Å; F370-R373 PolarHBondContact O-N 3.44Å; T371-R373 PolarHBondContact O-N 3.47Å; T371-R373 VanDerWaalsContact O-N 3.09Å
374	F	96.9	Very high	94.7	Very high	23 Å²	23	55 Å²	55	10%	0.101	27%	0.274	C	S	.	.	H	α-helix	trans	-120.5	0.1	-172.7	-67.9	-74.9	0	0	0	114.6	G336 L339 F370 T371 D376 R377 I378	G336-F374 WeakPolarHBondContact O-CE1 3.45Å; L339-F374 HydrophobicContact CD1-CB 4.42Å; F370-F374 HydrophobicContact CD1-CD2 4.39Å; F370-F374 AromaticContact CD2-CD2 3.58Å; F370-F374 HydrophobicContact CD2-CD2 3.58Å; F370-F374 AromaticContact CD2-CE2 3.8Å; F370-F374 HydrophobicContact CD2-CE2 3.8Å; F370-F374 HydrophobicContact CE1-CB 4.34Å; F370-F374 HydrophobicContact CE1-CD2 4.23Å; F370-F374 AromaticContact CE2-CD2 3.41Å; F370-F374 HydrophobicContact CE2-CD2 3.41Å; F370-F374 VanDerWaalsContact CE2-CD2 3.41Å; F370-F374 AromaticContact CE2-CE2 3.62Å; F370-F374 HydrophobicContact CE2-CE2 3.62Å; F370-F374 HydrophobicContact CE2-CG 4.29Å; F370-F374 HydrophobicContact CG-CD2 4.09Å; F370-F374 HydrophobicContact CZ-CB 4.38Å; F370-F374 AromaticContact CZ-CD2 3.75Å; F370-F374 HydrophobicContact CZ-CD2 3.75Å; F370-F374 HydrophobicContact CZ-CE2 4.35Å; F370-F374 HydrophobicContact CZ-CG 4.22Å; F370-F374 WeakPolarHBondContact O-CD2 3.47Å; F370-F374 PolarHBondContact O-N 2.96Å; T371-F374 PolarHBondContact O-N 3.1Å; T371-F374 VanDerWaalsContact O-N 3.09Å; F374-D376 PolarHBondContact O-N 3.27Å; F374-R377 WeakPolarHBondContact O-CB 3.35Å; F374-R377 PolarHBondContact O-N 3.27Å; F374-I378 HydrophobicContact CB-CD1 4.46Å; F374-I378 WeakPolarHBondContact O-CG1 3.06Å; F374-I378 PolarHBondContact O-N 3.29Å
375	K	95.4	Very high	95.1	Very high	39 Å²	39	62.3 Å²	62.3	17%	0.17	31%	0.306	C	S	.	.	H	α-helix	trans	-48	-55	178.1	-176.9	-142.4	56.8	144.9	0	111.8	T371 R377 I378 V379 A407 L408 D412	T371-K375 WeakPolarHBondContact O-CA 3.3Å; T371-K375 VanDerWaalsContact O-CB 3.28Å; T371-K375 WeakPolarHBondContact O-CB 3.22Å; T371-K375 PolarHBondContact O-N 2.69Å; K375-R377 PolarHBondContact O-N 2.86Å; K375-I378 WeakPolarHBondContact O-CA 3.21Å; K375-I378 PolarHBondContact O-N 3.23Å; K375-V379 HydrophobicContact CG-CG2 4.27Å; K375-V379 WeakPolarHBondContact O-CG2 3.26Å; K375-V379 PolarHBondContact O-N 2.93Å; K375-A407 WeakPolarHBondContact CD-O 3.25Å; K375-L408 HydrophobicContact CD-CD2 4.24Å; K375-L408 HydrophobicContact CG-CD2 4.06Å; K375-D412 IonicContact NZ-OD1 2.77Å; K375-D412 PolarHBondContact NZ-OD1 3.16Å; K375-D412 IonicContact NZ-OD2 3.39Å; K375-D412 PolarHBondContact NZ-OD2 3.15Å
376	D	96.3	Very high	95.5	Very high	112 Å²	112	61.3 Å²	61.3	60%	0.599	29%	0.292	S	S	*	.	H	α-helix	trans	-56	-38.1	-178.9	-52.6	-22.2	0	0	0	112.1	F374 S380	F374-D376 PolarHBondContact O-N 3.27Å; D376-S380 WeakPolarHBondContact O-CB 3.34Å; D376-S380 PolarHBondContact O-N 3.18Å; D376-S380 PolarHBondContact O-OG 3.28Å
377	R	97.7	Very high	95.8	Very high	57 Å²	57	61 Å²	61	22%	0.215	29%	0.29	C	S	.	.	H	α-helix	trans	-69.2	-44.4	175.6	177.9	61.5	-168.4	132.9	3.7	111.3	L339 H340 F374 K375 S380 M381 D384	L339-R377 HydrophobicContact CB-CG 4.1Å; L339-R377 PolarHBondContact O-NE 3.43Å; L339-R377 PolarHBondContact O-NH2 2.97Å; H340-R377 WeakPolarHBondContact NE2-CG 3.4Å; F374-R377 WeakPolarHBondContact O-CB 3.35Å; F374-R377 PolarHBondContact O-N 3.27Å; K375-R377 PolarHBondContact O-N 2.86Å; R377-S380 WeakPolarHBondContact CA-OG 3.44Å; R377-S380 PolarHBondContact NH1-OG 3.2Å; R377-S380 PolarHBondContact O-N 3.33Å; R377-S380 PolarHBondContact O-OG 2.89Å; R377-M381 HydrophobicContact CG-SD 4.15Å; R377-M381 VanDerWaalsContact CZ-SD 3.54Å; R377-M381 VanDerWaalsContact NH1-CG 3.31Å; R377-M381 VanDerWaalsContact NH2-CG 3.34Å; R377-M381 PolarHBondContact NH2-SD 2.9Å; R377-M381 VanDerWaalsContact O-CG 3.29Å; R377-M381 WeakPolarHBondContact O-CG 3.31Å; R377-M381 PolarHBondContact O-N 3.19Å; R377-M381 VanDerWaalsContact O-N 3.16Å; R377-D384 IonicContact NH2-OD2 2.77Å
378	I	97.9	Very high	96	Very high	1 Å²	1	66.4 Å²	66.4	1%	0.005	32%	0.318	C	S	.	.	H	α-helix	trans	-63	-43.4	178.9	-65.2	165.8	0	0	0	110.6	L339 L354 F374 K375 M381 L396 V397 I400	L339-I378 HydrophobicContact CD1-CG1 4.05Å; L354-I378 HydrophobicContact CD1-CD1 4.47Å; F374-I378 HydrophobicContact CB-CD1 4.46Å; F374-I378 WeakPolarHBondContact O-CG1 3.06Å; F374-I378 PolarHBondContact O-N 3.29Å; K375-I378 WeakPolarHBondContact O-CA 3.21Å; K375-I378 PolarHBondContact O-N 3.23Å; I378-M381 WeakPolarHBondContact O-CB 3.21Å; I378-M381 PolarHBondContact O-N 2.87Å; I378-M381 VanDerWaalsContact O-N 3.14Å; I378-L396 HydrophobicContact CD1-CD2 4.1Å; I378-L396 HydrophobicContact CG1-CD2 4.33Å; I378-L396 HydrophobicContact CG2-CD2 3.85Å; I378-L396 HydrophobicContact CG2-CG 4.13Å; I378-V397 HydrophobicContact CG2-CG2 3.81Å; I378-I400 HydrophobicContact CD1-CD1 4.4Å
379	V	96.9	Very high	96.4	Very high	13 Å²	13	60.8 Å²	60.8	8%	0.079	29%	0.292	C	S	.	.	H	α-helix	trans	-63.6	-44.6	174.4	176.5	0	0	0	0	110.5	K375 M381 T382 V397 L408 D412	K375-V379 HydrophobicContact CG-CG2 4.27Å; K375-V379 WeakPolarHBondContact O-CG2 3.26Å; K375-V379 PolarHBondContact O-N 2.93Å; V379-M381 PolarHBondContact O-N 3.29Å; V379-T382 WeakPolarHBondContact O-CG2 3.27Å; V379-T382 PolarHBondContact O-N 2.96Å; V379-T382 PolarHBondContact O-OG1 3.17Å; V379-V397 HydrophobicContact CG2-CG2 4.29Å; V379-L408 HydrophobicContact CG2-CD2 4.46Å; V379-D412 HydrophobicContact CG1-CB 4.46Å; V379-D412 HydrophobicContact CG2-CB 4.19Å
380	S	97.4	Very high	96.8	Very high	56 Å²	56	55.5 Å²	55.5	39%	0.392	26%	0.264	S	S	.	.	H	α-helix	trans	-60.3	-17.4	174.7	78.8	0	0	0	0	114.6	D376 R377	D376-S380 WeakPolarHBondContact O-CB 3.34Å; D376-S380 PolarHBondContact O-N 3.18Å; D376-S380 PolarHBondContact O-OG 3.28Å; R377-S380 WeakPolarHBondContact CA-OG 3.44Å; R377-S380 PolarHBondContact NH1-OG 3.2Å; R377-S380 PolarHBondContact O-N 3.33Å; R377-S380 PolarHBondContact O-OG 2.89Å
381	M	98.4	Very high	96.9	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-85.8	-7.3	177.7	-70.7	170.7	64.7	0	0	113.3	L339 R347 L351 R377 I378 V379 L383 D384 V389 A390 A393	L339-M381 HydrophobicContact CB-SD 4.16Å; L339-M381 HydrophobicContact CD2-CE 3.97Å; L339-M381 HydrophobicContact CD2-SD 3.88Å; R347-M381 HydrophobicContact CB-CE 3.82Å; R347-M381 HydrophobicContact CG-CE 4.39Å; L351-M381 HydrophobicContact CD1-CE 3.83Å; L351-M381 HydrophobicContact CD2-CE 4Å; L351-M381 HydrophobicContact CG-CE 3.91Å; R377-M381 HydrophobicContact CG-SD 4.15Å; R377-M381 VanDerWaalsContact CZ-SD 3.54Å; R377-M381 VanDerWaalsContact NH1-CG 3.31Å; R377-M381 VanDerWaalsContact NH2-CG 3.34Å; R377-M381 PolarHBondContact NH2-SD 2.9Å; R377-M381 VanDerWaalsContact O-CG 3.29Å; R377-M381 WeakPolarHBondContact O-CG 3.31Å; R377-M381 PolarHBondContact O-N 3.19Å; R377-M381 VanDerWaalsContact O-N 3.16Å; I378-M381 WeakPolarHBondContact O-CB 3.21Å; I378-M381 PolarHBondContact O-N 2.87Å; I378-M381 VanDerWaalsContact O-N 3.14Å; V379-M381 PolarHBondContact O-N 3.29Å; M381-L383 PolarHBondContact O-N 2.92Å; M381-D384 VanDerWaalsContact O-CB 3.28Å; M381-D384 WeakPolarHBondContact O-CB 3.45Å; M381-D384 PolarHBondContact O-N 3.22Å; M381-V389 HydrophobicContact CE-CG1 3.57Å; M381-A390 VanDerWaalsContact O-CA 3.3Å; M381-A390 WeakPolarHBondContact O-CA 3.32Å; M381-A393 HydrophobicContact CB-CB 3.72Å; M381-A393 WeakPolarHBondContact O-CB 3.49Å
382	T	98.2	Very high	97.1	Very high	5 Å²	5	56.1 Å²	56.1	3%	0.031	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-67.4	-19.8	168	69.9	0	0	0	0	111.6	V379 A390 A393 I394 V397 V416	V379-T382 WeakPolarHBondContact O-CG2 3.27Å; V379-T382 PolarHBondContact O-N 2.96Å; V379-T382 PolarHBondContact O-OG1 3.17Å; T382-A390 WeakPolarHBondContact O-CB 3.49Å; T382-A393 HydrophobicContact CG2-CB 4.37Å; T382-I394 HydrophobicContact CG2-CG1 3.67Å; T382-V397 HydrophobicContact CG2-CG2 4.41Å; T382-V416 HydrophobicContact CG2-CG2 3.99Å
383	L	97.2	Very high	97.5	Very high	96 Å²	96	51.5 Å²	51.5	50%	0.503	24%	0.243	S	C	.	.	G	3₁₀ helix	trans	-109	30.2	172.1	-71.5	170.7	0	0	0	112.7	M381 L419	M381-L383 PolarHBondContact O-N 2.92Å; L383-L419 HydrophobicContact CD2-CD2 3.64Å; L383-L419 HydrophobicContact CG-CD2 4.3Å
384	D	98.3	Very high	97.6	Very high	20 Å²	20	42.8 Å²	42.8	11%	0.107	21%	0.21	C	C	.	.			trans	-64.1	153.7	176.1	-160.5	-70.8	0	0	0	112.1	R347 R377 M381 E386 V389	R347-D384 IonicContact CZ-OD1 2.67Å; R347-D384 IonicContact CZ-OD2 3.18Å; R347-D384 IonicContact NE-OD1 3.03Å; R347-D384 IonicContact NE-OD2 3.24Å; R347-D384 PolarHBondContact NE-OD2 3.42Å; R347-D384 IonicContact NH2-OD1 2.85Å; R347-D384 PolarHBondContact NH2-OD1 3.28Å; R347-D384 IonicContact NH2-OD2 2.86Å; R347-D384 PolarHBondContact NH2-OD2 3.47Å; R377-D384 IonicContact NH2-OD2 2.77Å; M381-D384 VanDerWaalsContact O-CB 3.28Å; M381-D384 WeakPolarHBondContact O-CB 3.45Å; M381-D384 PolarHBondContact O-N 3.22Å; D384-E386 PolarHBondContact O-N 3.26Å; D384-E386 PolarHBondContact OD1-N 2.9Å; D384-V389 HydrophobicContact CB-CB 4.02Å; D384-V389 HydrophobicContact CB-CG1 3.95Å
385	K	96.1	Very high	97.7	Very high	184 Å²	184	46.6 Å²	46.6	80%	0.8	22%	0.224	S	C	*	.	S	Bend	trans	-69.4	-17.6	-177.7	-65.6	-172.2	178	-173.3	0	113.7
386	E	97.2	Very high	97.8	Very high	80 Å²	80	44.7 Å²	44.7	37%	0.374	22%	0.215	S	C	.	.	S	Bend	trans	-114.5	111.1	179.9	-69	165.9	-105.7	0	0	108.5	G344 R347 D384 D388 V389 A390	G344-E386 VanDerWaalsContact CA-CD 3.44Å; G344-E386 WeakPolarHBondContact CA-OE1 3.32Å; G344-E386 WeakPolarHBondContact CA-OE2 3.47Å; G344-E386 PolarHBondContact N-OE1 3.43Å; G344-E386 PolarHBondContact N-OE2 3.25Å; R347-E386 IonicContact CZ-OE1 3.37Å; R347-E386 IonicContact NH1-OE1 2.66Å; R347-E386 IonicContact NH2-OE1 2.71Å; R347-E386 PolarHBondContact NH2-OE1 3.35Å; D384-E386 PolarHBondContact O-N 3.26Å; D384-E386 PolarHBondContact OD1-N 2.9Å; E386-D388 VanDerWaalsContact C-N 3.26Å; E386-D388 PolarHBondContact O-N 3.36Å; E386-D388 VanDerWaalsContact O-N 3.15Å; E386-V389 HydrophobicContact CB-CG2 3.98Å; E386-V389 WeakPolarHBondContact O-CA 3.48Å; E386-V389 VanDerWaalsContact O-CB 3.32Å; E386-V389 WeakPolarHBondContact O-CB 3.49Å; E386-V389 PolarHBondContact O-N 2.86Å; E386-A390 PolarHBondContact O-N 2.99Å
387	Y	97.3	Very high	97.8	Very high	70 Å²	70	39.4 Å²	39.4	28%	0.275	19%	0.187	S	C	.	.	H	α-helix	trans	-59.4	-31.5	-169.5	-63.8	-61.4	0	0	0	114.3	V389 A390 V391 H424 V427	Y387-V389 PolarHBondContact O-N 2.72Å; Y387-A390 WeakPolarHBondContact O-CB 3.36Å; Y387-A390 PolarHBondContact O-N 2.8Å; Y387-A390 VanDerWaalsContact O-N 3.1Å; Y387-V391 WeakPolarHBondContact O-CG2 3.42Å; Y387-V391 PolarHBondContact O-N 3.05Å; Y387-H424 WeakPolarHBondContact CB-CE1 3.3Å; Y387-H424 WeakPolarHBondContact CB-ND1 3.4Å; Y387-H424 HydrophobicContact CD1-CB 3.99Å; Y387-H424 AromaticContact CD1-CG 3.97Å; Y387-H424 AromaticContact CD1-ND1 4Å; Y387-H424 HydrophobicContact CD2-CB 4.24Å; Y387-H424 AromaticContact CD2-CD2 3.64Å; Y387-H424 AromaticContact CD2-CG 3.73Å; Y387-H424 AromaticContact CD2-NE2 3.96Å; Y387-H424 HydrophobicContact CE1-CB 3.95Å; Y387-H424 HydrophobicContact CE2-CB 4.21Å; Y387-H424 HydrophobicContact CG-CB 4.15Å; Y387-H424 AromaticContact CG-CD2 3.97Å; Y387-H424 AromaticContact CG-CE1 3.89Å; Y387-H424 AromaticContact CG-CG 3.65Å; Y387-H424 AromaticContact CG-ND1 3.61Å; Y387-V427 HydrophobicContact CD1-CG2 4.16Å
388	D	97.8	Very high	97.6	Very high	113 Å²	113	36.8 Å²	36.8	60%	0.604	18%	0.178	S	C	*	.	H	α-helix	trans	-58.9	-34.6	173.3	-79	-12.7	0	0	0	112.2	L348 E386 E392	L348-D388 HydrophobicContact CD1-CB 4.2Å; L348-D388 VanDerWaalsContact CD1-O 3.26Å; L348-D388 WeakPolarHBondContact CD1-O 3.38Å; E386-D388 VanDerWaalsContact C-N 3.26Å; E386-D388 PolarHBondContact O-N 3.36Å; E386-D388 VanDerWaalsContact O-N 3.15Å; D388-E392 VanDerWaalsContact O-CG 3.31Å; D388-E392 WeakPolarHBondContact O-CG 3.49Å; D388-E392 PolarHBondContact O-N 2.83Å
389	V	98.6	Very high	97.4	Very high	2 Å²	2	38.9 Å²	38.9	1%	0.012	19%	0.189	C	C	.	.	H	α-helix	trans	-71.2	-41.5	175.2	-175	0	0	0	0	109.9	G344 R347 L348 L351 M381 D384 E386 Y387 E392 A393	G344-V389 WeakPolarHBondContact O-CG2 3.39Å; R347-V389 HydrophobicContact CB-CG1 3.91Å; R347-V389 HydrophobicContact CB-CG2 4.41Å; L348-V389 HydrophobicContact CB-CG2 4.36Å; L351-V389 HydrophobicContact CD1-CG1 3.67Å; L351-V389 WeakPolarHBondContact CD1-O 3.45Å; M381-V389 HydrophobicContact CE-CG1 3.57Å; D384-V389 HydrophobicContact CB-CB 4.02Å; D384-V389 HydrophobicContact CB-CG1 3.95Å; E386-V389 HydrophobicContact CB-CG2 3.98Å; E386-V389 WeakPolarHBondContact O-CA 3.48Å; E386-V389 VanDerWaalsContact O-CB 3.32Å; E386-V389 WeakPolarHBondContact O-CB 3.49Å; E386-V389 PolarHBondContact O-N 2.86Å; Y387-V389 PolarHBondContact O-N 2.72Å; V389-E392 PolarHBondContact O-N 3.17Å; V389-A393 WeakPolarHBondContact O-CB 3.42Å; V389-A393 PolarHBondContact O-N 2.97Å
390	A	98.6	Very high	97.3	Very high	1 Å²	1	38.5 Å²	38.5	1%	0.008	19%	0.186	C	C	.	.	H	α-helix	trans	-61.3	-45.7	177.2	0	0	0	0	0	113.1	M381 T382 E386 Y387 E392 A393 I394 V427	M381-A390 VanDerWaalsContact O-CA 3.3Å; M381-A390 WeakPolarHBondContact O-CA 3.32Å; T382-A390 WeakPolarHBondContact O-CB 3.49Å; E386-A390 PolarHBondContact O-N 2.99Å; Y387-A390 WeakPolarHBondContact O-CB 3.36Å; Y387-A390 PolarHBondContact O-N 2.8Å; Y387-A390 VanDerWaalsContact O-N 3.1Å; A390-E392 VanDerWaalsContact C-N 3.33Å; A390-E392 PolarHBondContact O-N 2.89Å; A390-A393 PolarHBondContact O-N 2.97Å; A390-I394 WeakPolarHBondContact O-CG1 3.24Å; A390-I394 PolarHBondContact O-N 3.26Å; A390-V427 HydrophobicContact CB-CG2 3.91Å
391	V	98.6	Very high	96.9	Very high	8 Å²	8	36.2 Å²	36.2	5%	0.048	17%	0.169	C	C	.	.	H	α-helix	trans	-57.2	-46.4	176.3	172.9	0	0	0	0	111.5	Y387 A393 R395 P426 V427 A430	Y387-V391 WeakPolarHBondContact O-CG2 3.42Å; Y387-V391 PolarHBondContact O-N 3.05Å; V391-A393 VanDerWaalsContact C-N 3.34Å; V391-R395 WeakPolarHBondContact O-CG 3.4Å; V391-R395 PolarHBondContact O-N 3.36Å; V391-R395 VanDerWaalsContact O-N 3.1Å; V391-P426 HydrophobicContact CG2-CB 3.87Å; V391-V427 HydrophobicContact CG2-CG2 3.72Å; V391-A430 HydrophobicContact CG1-CB 4.35Å
392	E	98.4	Very high	96.2	Very high	18 Å²	18	41.2 Å²	41.2	8%	0.084	19%	0.192	C	C	.	.	H	α-helix	trans	-76.8	-23.1	-177.9	-56.2	-67.2	-165.9	0	0	112.7	L348 L351 K352 Q355 D388 V389 A390 R395 L396	L348-E392 HydrophobicContact CD1-CB 4.18Å; L348-E392 HydrophobicContact CD1-CG 3.63Å; L351-E392 HydrophobicContact CB-CB 4.17Å; L351-E392 HydrophobicContact CD1-CB 3.98Å; K352-E392 VanDerWaalsContact CE-CG 3.43Å; K352-E392 WeakPolarHBondContact CE-OE1 3.18Å; K352-E392 IonicContact NZ-OE1 2.8Å; K352-E392 PolarHBondContact NZ-OE1 2.8Å; Q355-E392 PolarHBondContact NE2-O 3.26Å; Q355-E392 PolarHBondContact NE2-OE2 3.41Å; D388-E392 VanDerWaalsContact O-CG 3.31Å; D388-E392 WeakPolarHBondContact O-CG 3.49Å; D388-E392 PolarHBondContact O-N 2.83Å; V389-E392 PolarHBondContact O-N 3.17Å; A390-E392 VanDerWaalsContact C-N 3.33Å; A390-E392 PolarHBondContact O-N 2.89Å; E392-R395 IonicContact OE1-NH1 3.69Å; E392-R395 PolarHBondContact OE1-NH1 2.98Å; E392-R395 WeakPolarHBondContact OE2-CD 3.45Å; E392-R395 IonicContact OE2-CZ 3.88Å; E392-R395 IonicContact OE2-NE 3.78Å; E392-R395 IonicContact OE2-NH1 3.91Å; E392-R395 PolarHBondContact OE2-NH1 3.41Å; E392-L396 WeakPolarHBondContact O-CB 3.41Å; E392-L396 PolarHBondContact O-N 3.33Å; E392-L396 VanDerWaalsContact O-N 3.08Å
393	A	98.6	Very high	95.4	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-70	-48.4	171.1	0	0	0	0	0	110.7	L351 M381 T382 V389 A390 V391 R395 L396 V397	L351-A393 HydrophobicContact CD1-CB 4.01Å; L351-A393 HydrophobicContact CD2-CB 4.21Å; M381-A393 HydrophobicContact CB-CB 3.72Å; M381-A393 WeakPolarHBondContact O-CB 3.49Å; T382-A393 HydrophobicContact CG2-CB 4.37Å; V389-A393 WeakPolarHBondContact O-CB 3.42Å; V389-A393 PolarHBondContact O-N 2.97Å; A390-A393 PolarHBondContact O-N 2.97Å; V391-A393 VanDerWaalsContact C-N 3.34Å; A393-R395 PolarHBondContact O-N 3.17Å; A393-L396 WeakPolarHBondContact O-CB 3.41Å; A393-L396 PolarHBondContact O-N 3.37Å; A393-V397 WeakPolarHBondContact O-CG2 3.31Å; A393-V397 PolarHBondContact O-N 2.98Å
394	I	98.6	Very high	94.7	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-57.9	-48.7	175.7	-63.3	159.9	0	0	0	110.2	T382 A390 L396 V397 T398 V416 L419 V427 A430 F434	T382-I394 HydrophobicContact CG2-CG1 3.67Å; A390-I394 WeakPolarHBondContact O-CG1 3.24Å; A390-I394 PolarHBondContact O-N 3.26Å; I394-L396 VanDerWaalsContact C-N 3.26Å; I394-L396 PolarHBondContact O-N 3.13Å; I394-V397 CarbonylContact O-C 3.6Å; I394-V397 WeakPolarHBondContact O-CB 3.45Å; I394-V397 PolarHBondContact O-N 2.99Å; I394-T398 PolarHBondContact O-N 3.24Å; I394-T398 PolarHBondContact O-OG1 3.28Å; I394-V416 HydrophobicContact CG2-CG1 3.96Å; I394-L419 HydrophobicContact CD1-CD1 3.82Å; I394-L419 HydrophobicContact CG1-CD1 4.15Å; I394-V427 HydrophobicContact CD1-CG1 3.83Å; I394-A430 HydrophobicContact CB-CB 4.14Å; I394-A430 HydrophobicContact CD1-CB 4.33Å; I394-A430 VanDerWaalsContact CG2-C 3.49Å; I394-A430 HydrophobicContact CG2-CB 3.95Å; I394-A430 VanDerWaalsContact CG2-O 3.31Å; I394-A430 WeakPolarHBondContact CG2-O 3.49Å; I394-F434 HydrophobicContact CG2-CB 4.35Å
395	R	97.6	Very high	93.4	Very high	103 Å²	103	44.9 Å²	44.9	39%	0.389	22%	0.221	S	C	.	.	H	α-helix	trans	-57.4	-35.6	175	-74.6	168.5	176.6	162.8	5.4	113.6	V391 E392 A393 T398 L399	V391-R395 WeakPolarHBondContact O-CG 3.4Å; V391-R395 PolarHBondContact O-N 3.36Å; V391-R395 VanDerWaalsContact O-N 3.1Å; E392-R395 IonicContact OE1-NH1 3.69Å; E392-R395 PolarHBondContact OE1-NH1 2.98Å; E392-R395 WeakPolarHBondContact OE2-CD 3.45Å; E392-R395 IonicContact OE2-CZ 3.88Å; E392-R395 IonicContact OE2-NE 3.78Å; E392-R395 IonicContact OE2-NH1 3.91Å; E392-R395 PolarHBondContact OE2-NH1 3.41Å; A393-R395 PolarHBondContact O-N 3.17Å; R395-T398 PolarHBondContact O-N 3.01Å; R395-L399 WeakPolarHBondContact O-CG 3.41Å; R395-L399 PolarHBondContact O-N 3.24Å
396	L	97.3	Very high	92.7	Very high	0 Å²	0	45 Å²	45	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-68.7	-42.4	175.1	-180	58.5	0	0	0	111.4	L351 L354 Q355 Y358 I378 E392 A393 I394 T398 L399 I400	L351-L396 HydrophobicContact CD2-CD2 3.62Å; L354-L396 HydrophobicContact CB-CD1 3.93Å; L354-L396 HydrophobicContact CB-CD2 3.84Å; L354-L396 HydrophobicContact CD1-CD2 3.87Å; Q355-L396 HydrophobicContact CG-CB 4.09Å; Q355-L396 HydrophobicContact CG-CD1 4.19Å; Y358-L396 HydrophobicContact CD2-CD1 3.43Å; Y358-L396 VanDerWaalsContact CD2-CD1 3.43Å; Y358-L396 HydrophobicContact CE2-CD1 3.8Å; Y358-L396 HydrophobicContact CG-CD1 4.28Å; I378-L396 HydrophobicContact CD1-CD2 4.1Å; I378-L396 HydrophobicContact CG1-CD2 4.33Å; I378-L396 HydrophobicContact CG2-CD2 3.85Å; I378-L396 HydrophobicContact CG2-CG 4.13Å; E392-L396 WeakPolarHBondContact O-CB 3.41Å; E392-L396 PolarHBondContact O-N 3.33Å; E392-L396 VanDerWaalsContact O-N 3.08Å; A393-L396 WeakPolarHBondContact O-CB 3.41Å; A393-L396 PolarHBondContact O-N 3.37Å; I394-L396 VanDerWaalsContact C-N 3.26Å; I394-L396 PolarHBondContact O-N 3.13Å; L396-T398 VanDerWaalsContact C-N 3.32Å; L396-T398 PolarHBondContact O-N 3.37Å; L396-L399 PolarHBondContact O-N 2.87Å; L396-I400 HydrophobicContact CD1-CD1 4.4Å; L396-I400 HydrophobicContact CG-CD1 4.11Å; L396-I400 WeakPolarHBondContact O-CG1 3.46Å; L396-I400 PolarHBondContact O-N 3.24Å
397	V	96.4	Very high	92.1	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-61.6	-39.6	173.3	178.9	0	0	0	0	111	I378 V379 T382 A393 I394 L399 I400 L401 L408 V416 F434	I378-V397 HydrophobicContact CG2-CG2 3.81Å; V379-V397 HydrophobicContact CG2-CG2 4.29Å; T382-V397 HydrophobicContact CG2-CG2 4.41Å; A393-V397 WeakPolarHBondContact O-CG2 3.31Å; A393-V397 PolarHBondContact O-N 2.98Å; I394-V397 CarbonylContact O-C 3.6Å; I394-V397 WeakPolarHBondContact O-CB 3.45Å; I394-V397 PolarHBondContact O-N 2.99Å; V397-L399 PolarHBondContact O-N 3.28Å; V397-I400 PolarHBondContact O-N 3.43Å; V397-L401 WeakPolarHBondContact O-CB 3.48Å; V397-L401 PolarHBondContact O-N 2.97Å; V397-L408 HydrophobicContact CG1-CD1 3.53Å; V397-L408 HydrophobicContact CG1-CD2 4.04Å; V397-L408 HydrophobicContact CG1-CG 4.46Å; V397-V416 HydrophobicContact CG1-CG2 4.41Å; V397-F434 HydrophobicContact CG1-CD2 4.31Å; V397-F434 HydrophobicContact CG1-CE2 3.69Å; V397-F434 HydrophobicContact CG1-CZ 4.19Å
398	T	94.9	Very high	91.8	Very high	3 Å²	3	39.1 Å²	39.1	2%	0.018	20%	0.203	C	C	.	.	H	α-helix	trans	-61.8	-37.9	172.7	-53.4	0	0	0	0	113.2	I394 R395 L396 H402 K437	I394-T398 PolarHBondContact O-N 3.24Å; I394-T398 PolarHBondContact O-OG1 3.28Å; R395-T398 PolarHBondContact O-N 3.01Å; L396-T398 VanDerWaalsContact C-N 3.32Å; L396-T398 PolarHBondContact O-N 3.37Å; T398-H402 WeakPolarHBondContact O-CB 3.4Å; T398-H402 PolarHBondContact O-N 3.47Å; T398-K437 HydrophobicContact CG2-CD 3.5Å
399	L	94	Very high	91.5	Very high	45 Å²	45	36.1 Å²	36.1	24%	0.236	19%	0.19	C	C	.	.	H	α-helix	trans	-71.6	-38.4	174.3	-72.6	172.6	0	0	0	112.4	Q355 R395 L396 V397 H402 G403	Q355-L399 HydrophobicContact CB-CD1 3.94Å; Q355-L399 HydrophobicContact CG-CD1 4.11Å; R395-L399 WeakPolarHBondContact O-CG 3.41Å; R395-L399 PolarHBondContact O-N 3.24Å; L396-L399 PolarHBondContact O-N 2.87Å; V397-L399 PolarHBondContact O-N 3.28Å; L399-H402 PolarHBondContact O-N 3.44Å; L399-G403 PolarHBondContact O-N 3.07Å
400	I	93.4	Very high	91.1	Very high	4 Å²	4	41.6 Å²	41.6	2%	0.021	22%	0.219	C	C	.	.	H	α-helix	trans	-60.9	-52.4	175.6	-71.6	162.7	0	0	0	109.9	Y358 T371 I378 L396 V397 H402 G403 S404 A407 L408	Y358-I400 HydrophobicContact CD1-CG1 4.11Å; Y358-I400 HydrophobicContact CE1-CG1 3.86Å; Y358-I400 HydrophobicContact CE2-CG1 4.44Å; Y358-I400 HydrophobicContact CG-CG1 4.49Å; T371-I400 HydrophobicContact CG2-CD1 4.12Å; T371-I400 HydrophobicContact CG2-CG1 4.27Å; T371-I400 HydrophobicContact CG2-CG2 3.9Å; I378-I400 HydrophobicContact CD1-CD1 4.4Å; L396-I400 HydrophobicContact CD1-CD1 4.4Å; L396-I400 HydrophobicContact CG-CD1 4.11Å; L396-I400 WeakPolarHBondContact O-CG1 3.46Å; L396-I400 PolarHBondContact O-N 3.24Å; V397-I400 PolarHBondContact O-N 3.43Å; I400-H402 PolarHBondContact O-N 2.99Å; I400-G403 PolarHBondContact O-N 3.37Å; I400-G403 VanDerWaalsContact O-N 3.13Å; I400-S404 PolarHBondContact O-N 3.49Å; I400-A407 HydrophobicContact CG2-CB 3.77Å; I400-L408 HydrophobicContact CG2-CD2 4.34Å; I400-L408 HydrophobicContact CG2-CG 4.39Å
401	L	90	Very high	90.8	Very high	8 Å²	8	48 Å²	48	4%	0.042	25%	0.249	C	C	.	.	H	α-helix	trans	-50.7	-43.9	176.1	174.8	64.7	0	0	0	112.4	V397 G403 S404 E405 L408 F434 K438	V397-L401 WeakPolarHBondContact O-CB 3.48Å; V397-L401 PolarHBondContact O-N 2.97Å; L401-G403 VanDerWaalsContact C-N 3.27Å; L401-G403 PolarHBondContact O-N 3.04Å; L401-S404 CarbonylContact O-C 3.48Å; L401-E405 HydrophobicContact CD1-CG 4.23Å; L401-E405 PolarHBondContact O-N 2.66Å; L401-L408 HydrophobicContact CB-CD1 3.89Å; L401-L408 HydrophobicContact CD1-CD1 4.41Å; L401-F434 HydrophobicContact CB-CE2 4.17Å; L401-F434 HydrophobicContact CD2-CD2 4.05Å; L401-F434 HydrophobicContact CD2-CE2 3.64Å; L401-F434 HydrophobicContact CD2-CZ 4.23Å; L401-F434 HydrophobicContact CG-CE2 4.46Å; L401-K438 HydrophobicContact CD1-CD 3.62Å; L401-K438 HydrophobicContact CD2-CB 3.89Å; L401-K438 HydrophobicContact CD2-CD 3.82Å; L401-K438 HydrophobicContact CD2-CG 4.35Å; L401-K438 HydrophobicContact CG-CD 4.36Å
402	H	83.9	Confident	90.6	Very high	105 Å²	105	48.1 Å²	48.1	49%	0.486	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76	-9.2	-173.6	-174.7	68.5	0	0	0	114.7	R361 T398 L399 I400	R361-H402 PolarHBondContact NH2-CE1 2.81Å; R361-H402 VanDerWaalsContact NH2-CE1 3.25Å; R361-H402 PolarHBondContact NH2-NE2 2.84Å; R361-H402 PolarHBondContact NH2-O 3.37Å; R361-H402 VanDerWaalsContact NH2-O 3.12Å; T398-H402 WeakPolarHBondContact O-CB 3.4Å; T398-H402 PolarHBondContact O-N 3.47Å; L399-H402 PolarHBondContact O-N 3.44Å; I400-H402 PolarHBondContact O-N 2.99Å
403	G	80.5	Confident	90.3	Very high	36 Å²	36	47.3 Å²	47.3	37%	0.371	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-118.3	-12.6	172.6	0	0	0	0	0	114.9	F364 L399 I400 L401	F364-G403 VanDerWaalsContact CE1-CA 3.41Å; L399-G403 PolarHBondContact O-N 3.07Å; I400-G403 PolarHBondContact O-N 3.37Å; I400-G403 VanDerWaalsContact O-N 3.13Å; L401-G403 VanDerWaalsContact C-N 3.27Å; L401-G403 PolarHBondContact O-N 3.04Å
404	S	82.3	Confident	89.9	Confident	50 Å²	50	51.5 Å²	51.5	35%	0.35	27%	0.265	S	S	.	.			trans	-152.6	110.4	162.1	-178.4	0	0	0	0	110.4	I400 L401 E406 A407	I400-S404 PolarHBondContact O-N 3.49Å; L401-S404 CarbonylContact O-C 3.48Å; S404-E406 PolarHBondContact O-N 3.45Å; S404-A407 PolarHBondContact O-N 3.38Å
405	E	70.7	Confident	89.6	Confident	112 Å²	112	54.6 Å²	54.6	52%	0.523	28%	0.282	S	S	.	.	G	3₁₀ helix	trans	-66.1	-24.6	176.3	-79.5	-166.7	-128.9	0	0	112.8	L401 A407 R442	L401-E405 HydrophobicContact CD1-CG 4.23Å; L401-E405 PolarHBondContact O-N 2.66Å; E405-A407 VanDerWaalsContact C-N 3.35Å; E405-R442 IonicContact OE2-NH2 3.64Å
406	E	81.1	Confident	89.5	Confident	188 Å²	188	49.7 Å²	49.7	88%	0.879	26%	0.264	S	S	*	.	G	3₁₀ helix	trans	-82	-10	-179.8	-60.5	-174.4	172.1	0	0	113.2	S404 L408	S404-E406 PolarHBondContact O-N 3.45Å; E406-L408 VanDerWaalsContact C-N 3.25Å; E406-L408 PolarHBondContact O-N 3.07Å
407	A	85.3	Confident	89.4	Confident	15 Å²	15	51.4 Å²	51.4	12%	0.124	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-76.5	-7.5	-177.7	0	0	0	0	0	114.5	K375 I400 S404 E405	K375-A407 WeakPolarHBondContact CD-O 3.25Å; I400-A407 HydrophobicContact CG2-CB 3.77Å; S404-A407 PolarHBondContact O-N 3.38Å; E405-A407 VanDerWaalsContact C-N 3.35Å
408	L	91.4	Very high	89.2	Confident	11 Å²	11	55.5 Å²	55.5	6%	0.058	29%	0.289	C	S	.	.	S	Bend	trans	-127.5	133.7	178.1	-58.7	175.5	0	0	0	109.6	K375 V379 V397 I400 L401 E406 D412 F434	K375-L408 HydrophobicContact CD-CD2 4.24Å; K375-L408 HydrophobicContact CG-CD2 4.06Å; V379-L408 HydrophobicContact CG2-CD2 4.46Å; V397-L408 HydrophobicContact CG1-CD1 3.53Å; V397-L408 HydrophobicContact CG1-CD2 4.04Å; V397-L408 HydrophobicContact CG1-CG 4.46Å; I400-L408 HydrophobicContact CG2-CD2 4.34Å; I400-L408 HydrophobicContact CG2-CG 4.39Å; L401-L408 HydrophobicContact CB-CD1 3.89Å; L401-L408 HydrophobicContact CD1-CD1 4.41Å; E406-L408 VanDerWaalsContact C-N 3.25Å; E406-L408 PolarHBondContact O-N 3.07Å; L408-D412 HydrophobicContact CB-CB 4.22Å; L408-D412 HydrophobicContact CD2-CB 4.31Å; L408-F434 HydrophobicContact CD1-CE2 3.96Å; L408-F434 HydrophobicContact CD1-CZ 4.11Å
409	S	91.9	Very high	89.3	Confident	49 Å²	49	56.1 Å²	56.1	34%	0.343	29%	0.292	S	S	.	.			trans	-76.7	169.7	169.7	70.1	0	0	0	0	111.5	E411 D412 C413	S409-E411 VanDerWaalsContact C-N 3.32Å; S409-D412 VanDerWaalsContact CB-OD2 3.3Å; S409-D412 WeakPolarHBondContact CB-OD2 3.37Å; S409-D412 PolarHBondContact N-OD2 3.09Å; S409-D412 WeakPolarHBondContact O-CB 3.42Å; S409-D412 PolarHBondContact O-N 3.19Å; S409-D412 PolarHBondContact OG-N 3.42Å; S409-D412 VanDerWaalsContact OG-N 3.11Å; S409-D412 PolarHBondContact OG-OD2 3.19Å; S409-C413 PolarHBondContact O-N 3.33Å; S409-C413 VanDerWaalsContact O-N 3.16Å; S409-C413 PolarHBondContact O-SG 2.8Å; S409-C413 VanDerWaalsContact O-SG 3.41Å
410	N	90.2	Very high	89.4	Confident	117 Å²	117	54 Å²	54	63%	0.626	28%	0.281	S	S	*	.	H	α-helix	trans	-61.6	-42	172.7	-66.3	3.8	0	0	0	111.4	D412 C413 E414	N410-D412 VanDerWaalsContact C-N 3.32Å; N410-D412 PolarHBondContact O-N 3.5Å; N410-C413 CarbonylContact O-C 3.49Å; N410-C413 WeakPolarHBondContact O-CA 3.35Å; N410-C413 WeakPolarHBondContact O-CB 3.39Å; N410-C413 PolarHBondContact O-N 2.84Å; N410-E414 WeakPolarHBondContact CB-OE1 3.16Å; N410-E414 VanDerWaalsContact O-CG 3.32Å; N410-E414 WeakPolarHBondContact O-CG 3.28Å; N410-E414 PolarHBondContact O-N 2.92Å
411	E	91.7	Very high	89.5	Confident	135 Å²	135	54.6 Å²	54.6	63%	0.631	28%	0.283	S	S	*	.	H	α-helix	trans	-59.3	-39.8	175.5	-175.4	-178.2	-179.6	0	0	111.8	S409 C413 N415	S409-E411 VanDerWaalsContact C-N 3.32Å; E411-C413 VanDerWaalsContact C-N 3.29Å; E411-C413 PolarHBondContact O-N 3.41Å; E411-N415 WeakPolarHBondContact O-CB 3.24Å; E411-N415 PolarHBondContact O-N 2.89Å; E411-N415 VanDerWaalsContact O-N 3.12Å; E411-N415 PolarHBondContact O-ND2 3.22Å
412	D	93.8	Very high	89.8	Confident	12 Å²	12	55.5 Å²	55.5	6%	0.064	29%	0.291	C	S	.	.	H	α-helix	trans	-63	-36.4	173.3	-61.5	-63.7	0	0	0	111.9	K375 V379 L408 S409 N410	K375-D412 IonicContact NZ-OD1 2.77Å; K375-D412 PolarHBondContact NZ-OD1 3.16Å; K375-D412 IonicContact NZ-OD2 3.39Å; K375-D412 PolarHBondContact NZ-OD2 3.15Å; V379-D412 HydrophobicContact CG1-CB 4.46Å; V379-D412 HydrophobicContact CG2-CB 4.19Å; L408-D412 HydrophobicContact CB-CB 4.22Å; L408-D412 HydrophobicContact CD2-CB 4.31Å; S409-D412 VanDerWaalsContact CB-OD2 3.3Å; S409-D412 WeakPolarHBondContact CB-OD2 3.37Å; S409-D412 PolarHBondContact N-OD2 3.09Å; S409-D412 WeakPolarHBondContact O-CB 3.42Å; S409-D412 PolarHBondContact O-N 3.19Å; S409-D412 PolarHBondContact OG-N 3.42Å; S409-D412 VanDerWaalsContact OG-N 3.11Å; S409-D412 PolarHBondContact OG-OD2 3.19Å; N410-D412 VanDerWaalsContact C-N 3.32Å; N410-D412 PolarHBondContact O-N 3.5Å
413	C	93.1	Very high	90.1	Very high	1 Å²	1	52.3 Å²	52.3	1%	0.007	28%	0.282	C	S	.	.	H	α-helix	trans	-72.6	-46.5	178	-68.5	0	0	0	0	111.9	S409 N410 E411 N415 V416 Y417 F434	S409-C413 PolarHBondContact O-N 3.33Å; S409-C413 VanDerWaalsContact O-N 3.16Å; S409-C413 PolarHBondContact O-SG 2.8Å; S409-C413 VanDerWaalsContact O-SG 3.41Å; N410-C413 CarbonylContact O-C 3.49Å; N410-C413 WeakPolarHBondContact O-CA 3.35Å; N410-C413 WeakPolarHBondContact O-CB 3.39Å; N410-C413 PolarHBondContact O-N 2.84Å; E411-C413 VanDerWaalsContact C-N 3.29Å; E411-C413 PolarHBondContact O-N 3.41Å; C413-N415 VanDerWaalsContact C-N 3.33Å; C413-N415 PolarHBondContact O-N 3.23Å; C413-V416 CarbonylContact O-C 3.57Å; C413-V416 WeakPolarHBondContact O-CA 3.4Å; C413-V416 PolarHBondContact O-N 3.16Å; C413-Y417 HydrophobicContact CB-CE1 4.07Å; C413-Y417 HydrophobicContact CB-CE2 4.17Å; C413-Y417 VanDerWaalsContact O-CD1 3.25Å; C413-Y417 WeakPolarHBondContact O-CD1 3.49Å; C413-Y417 VanDerWaalsContact O-CG 3.24Å; C413-Y417 PolarHBondContact O-N 3.43Å; C413-F434 HydrophobicContact CB-CE1 4.18Å; C413-F434 HydrophobicContact CB-CZ 4.29Å
414	E	90.6	Very high	90.8	Very high	87 Å²	87	52.9 Å²	52.9	41%	0.407	28%	0.275	S	S	.	.	H	α-helix	trans	-57	-44.5	178.3	-71.9	152.5	-155.2	0	0	111.4	N410 V416 Y417 H418	N410-E414 WeakPolarHBondContact CB-OE1 3.16Å; N410-E414 VanDerWaalsContact O-CG 3.32Å; N410-E414 WeakPolarHBondContact O-CG 3.28Å; N410-E414 PolarHBondContact O-N 2.92Å; E414-V416 PolarHBondContact O-N 3.32Å; E414-V416 VanDerWaalsContact O-N 3.15Å; E414-Y417 HydrophobicContact CG-CD2 4.31Å; E414-Y417 WeakPolarHBondContact O-CB 3.48Å; E414-Y417 PolarHBondContact O-N 2.82Å; E414-Y417 VanDerWaalsContact O-N 3.08Å; E414-H418 PolarHBondContact O-N 3.29Å; E414-H418 VanDerWaalsContact O-N 3.13Å
415	N	91.1	Very high	91.4	Very high	66 Å²	66	52.7 Å²	52.7	35%	0.353	27%	0.267	S	S	.	.	H	α-helix	trans	-60.4	-23.1	173.9	-83	-76.9	0	0	0	114.1	E411 C413	E411-N415 WeakPolarHBondContact O-CB 3.24Å; E411-N415 PolarHBondContact O-N 2.89Å; E411-N415 VanDerWaalsContact O-N 3.12Å; E411-N415 PolarHBondContact O-ND2 3.22Å; C413-N415 VanDerWaalsContact C-N 3.33Å; C413-N415 PolarHBondContact O-N 3.23Å
416	V	95.8	Very high	92.7	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-91.4	-33.9	172.7	-179.3	0	0	0	0	111.4	T382 I394 V397 C413 E414 H418 L419 A431 F434	T382-V416 HydrophobicContact CG2-CG2 3.99Å; I394-V416 HydrophobicContact CG2-CG1 3.96Å; V397-V416 HydrophobicContact CG1-CG2 4.41Å; C413-V416 CarbonylContact O-C 3.57Å; C413-V416 WeakPolarHBondContact O-CA 3.4Å; C413-V416 PolarHBondContact O-N 3.16Å; E414-V416 PolarHBondContact O-N 3.32Å; E414-V416 VanDerWaalsContact O-N 3.15Å; V416-H418 PolarHBondContact O-N 2.93Å; V416-L419 WeakPolarHBondContact O-CB 3.37Å; V416-L419 PolarHBondContact O-N 3.03Å; V416-L419 VanDerWaalsContact O-N 3.12Å; V416-A431 HydrophobicContact CG1-CB 4.39Å; V416-F434 HydrophobicContact CB-CD1 3.83Å; V416-F434 HydrophobicContact CB-CE1 3.79Å; V416-F434 HydrophobicContact CB-CZ 4.46Å; V416-F434 HydrophobicContact CG1-CB 4.02Å; V416-F434 HydrophobicContact CG1-CD1 3.39Å; V416-F434 HydrophobicContact CG1-CD2 4.46Å; V416-F434 HydrophobicContact CG1-CE1 3.89Å; V416-F434 HydrophobicContact CG1-CG 3.71Å; V416-F434 HydrophobicContact CG2-CE1 4.47Å
417	Y	94.9	Very high	93.5	Very high	35 Å²	35	41.7 Å²	41.7	14%	0.137	22%	0.221	C	C	.	.	H	α-helix	trans	-57.7	-45.8	176.7	-65	-16	0	0	0	112	C413 E414 L419 V420 F434 L435 K438 F471	C413-Y417 HydrophobicContact CB-CE1 4.07Å; C413-Y417 HydrophobicContact CB-CE2 4.17Å; C413-Y417 VanDerWaalsContact O-CD1 3.25Å; C413-Y417 WeakPolarHBondContact O-CD1 3.49Å; C413-Y417 VanDerWaalsContact O-CG 3.24Å; C413-Y417 PolarHBondContact O-N 3.43Å; E414-Y417 HydrophobicContact CG-CD2 4.31Å; E414-Y417 WeakPolarHBondContact O-CB 3.48Å; E414-Y417 PolarHBondContact O-N 2.82Å; E414-Y417 VanDerWaalsContact O-N 3.08Å; Y417-L419 PolarHBondContact O-N 2.98Å; Y417-V420 WeakPolarHBondContact O-CG1 3.49Å; Y417-V420 VanDerWaalsContact O-CG2 3.22Å; Y417-V420 WeakPolarHBondContact O-CG2 3.45Å; Y417-V420 PolarHBondContact O-N 3.05Å; Y417-F434 HydrophobicContact CD1-CD1 4.12Å; Y417-F434 HydrophobicContact CD1-CE1 4.01Å; Y417-F434 HydrophobicContact CE1-CD1 4.07Å; Y417-F434 AromaticContact CE1-CE1 3.73Å; Y417-F434 HydrophobicContact CE1-CE1 3.73Å; Y417-L435 HydrophobicContact CD1-CD1 3.59Å; Y417-L435 HydrophobicContact CE1-CD1 3.7Å; Y417-L435 HydrophobicContact CG-CD1 4.15Å; Y417-K438 HydrophobicContact CE1-CB 4.46Å; Y417-K438 HydrophobicContact CE1-CG 4.31Å; Y417-K438 WeakPolarHBondContact OH-CG 3.25Å; Y417-F471 HydrophobicContact CD1-CE2 4.47Å; Y417-F471 AromaticContact CD2-CE2 3.9Å; Y417-F471 HydrophobicContact CD2-CE2 3.9Å; Y417-F471 AromaticContact CG-CE2 3.82Å; Y417-F471 HydrophobicContact CG-CE2 3.82Å; Y417-F471 HydrophobicContact CG-CZ 4.41Å
418	H	92.6	Very high	94.1	Very high	87 Å²	87	41 Å²	41	40%	0.403	22%	0.215	S	C	.	.	G	3₁₀ helix	trans	-55.9	-25.1	178.3	-59.9	160.8	0	0	0	113.2	E414 V416 V420 Y421 L477	E414-H418 PolarHBondContact O-N 3.29Å; E414-H418 VanDerWaalsContact O-N 3.13Å; V416-H418 PolarHBondContact O-N 2.93Å; H418-V420 PolarHBondContact O-N 3.19Å; H418-Y421 PolarHBondContact O-N 2.89Å; H418-L477 HydrophobicContact CB-CD1 3.65Å
419	L	96.9	Very high	94.4	Very high	16 Å²	16	41.7 Å²	41.7	8%	0.084	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-73	-12.5	-178.3	-53.5	178.3	0	0	0	113.5	L383 I394 V416 Y417 Y421 S422 V427 A428 A431	L383-L419 HydrophobicContact CD2-CD2 3.64Å; L383-L419 HydrophobicContact CG-CD2 4.3Å; I394-L419 HydrophobicContact CD1-CD1 3.82Å; I394-L419 HydrophobicContact CG1-CD1 4.15Å; V416-L419 WeakPolarHBondContact O-CB 3.37Å; V416-L419 PolarHBondContact O-N 3.03Å; V416-L419 VanDerWaalsContact O-N 3.12Å; Y417-L419 PolarHBondContact O-N 2.98Å; L419-Y421 PolarHBondContact O-N 2.95Å; L419-S422 WeakPolarHBondContact O-CB 3.43Å; L419-S422 PolarHBondContact O-N 2.88Å; L419-V427 HydrophobicContact CB-CG1 4.19Å; L419-A428 VanDerWaalsContact O-CA 3.31Å; L419-A428 WeakPolarHBondContact O-CA 3.47Å; L419-A431 HydrophobicContact CB-CB 3.76Å
420	V	97.1	Very high	94.7	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-63.5	-16.1	170.2	-54.8	0	0	0	0	112.7	Y417 H418 A431 L435 F471 L484 S487 R545	Y417-V420 WeakPolarHBondContact O-CG1 3.49Å; Y417-V420 VanDerWaalsContact O-CG2 3.22Å; Y417-V420 WeakPolarHBondContact O-CG2 3.45Å; Y417-V420 PolarHBondContact O-N 3.05Å; H418-V420 PolarHBondContact O-N 3.19Å; V420-A431 HydrophobicContact CG1-CB 3.8Å; V420-L435 HydrophobicContact CG1-CD2 4.08Å; V420-F471 HydrophobicContact CG2-CE1 4.11Å; V420-F471 HydrophobicContact CG2-CZ 4.26Å; V420-L484 HydrophobicContact CB-CD1 4.36Å; V420-L484 HydrophobicContact CG2-CD1 3.79Å; V420-S487 PolarHBondContact O-OG 3.45Å; V420-R545 PolarHBondContact O-NH2 3Å
421	Y	95.4	Very high	95.1	Very high	16 Å²	16	34 Å²	34	6%	0.063	18%	0.176	C	C	.	.	G	3₁₀ helix	trans	-93.3	-5.4	174.4	-61.2	-73.1	0	0	0	113.5	H418 L419 A423 S475 L477 H478 L484	H418-Y421 PolarHBondContact O-N 2.89Å; L419-Y421 PolarHBondContact O-N 2.95Å; Y421-A423 PolarHBondContact O-N 3.31Å; Y421-S475 WeakPolarHBondContact OH-CB 3.24Å; Y421-S475 PolarHBondContact OH-OG 3.43Å; Y421-L477 HydrophobicContact CD2-CB 4.21Å; Y421-L477 HydrophobicContact CD2-CD1 4.09Å; Y421-L477 HydrophobicContact CE2-CB 4.49Å; Y421-H478 HydrophobicContact CD1-CB 3.93Å; Y421-H478 AromaticContact CD1-CD2 3.23Å; Y421-H478 WeakPolarHBondContact CD1-CD2 3.09Å; Y421-H478 AromaticContact CD1-CG 3.7Å; Y421-H478 AromaticContact CD1-NE2 3.97Å; Y421-H478 HydrophobicContact CE1-CB 3.84Å; Y421-H478 AromaticContact CG-CD2 3.55Å; Y421-L484 HydrophobicContact CE1-CB 4.01Å
422	S	94.8	Very high	95.4	Very high	28 Å²	28	27.6 Å²	27.6	20%	0.196	15%	0.146	C	C	.	.			trans	-53.3	135.4	-178.8	-174	0	0	0	0	112.8	L419 H424 R545	L419-S422 WeakPolarHBondContact O-CB 3.43Å; L419-S422 PolarHBondContact O-N 2.88Å; S422-H424 VanDerWaalsContact C-N 3.26Å; S422-H424 PolarHBondContact O-N 3.07Å; S422-H424 PolarHBondContact OG-N 3.13Å; S422-R545 PolarHBondContact O-NE 3.26Å; S422-R545 VanDerWaalsContact O-NE 3.16Å; S422-R545 PolarHBondContact O-NH2 3.37Å
423	A	91.3	Very high	95.5	Very high	37 Å²	37	30.3 Å²	30.3	31%	0.306	16%	0.158	S	C	.	.	S	Bend	trans	-59.1	-37.8	173.5	0	0	0	0	0	112	Y421 R425	Y421-A423 PolarHBondContact O-N 3.31Å; A423-R425 PolarHBondContact O-N 3.2Å
424	H	94.9	Very high	95.6	Very high	48 Å²	48	30.3 Å²	30.3	22%	0.222	16%	0.158	C	C	.	.	S	Bend	trans	-77	90.7	-179.6	-174.9	-100.1	0	0	0	111.3	Y387 S422 P426 V427 A428	Y387-H424 WeakPolarHBondContact CB-CE1 3.3Å; Y387-H424 WeakPolarHBondContact CB-ND1 3.4Å; Y387-H424 HydrophobicContact CD1-CB 3.99Å; Y387-H424 AromaticContact CD1-CG 3.97Å; Y387-H424 AromaticContact CD1-ND1 4Å; Y387-H424 HydrophobicContact CD2-CB 4.24Å; Y387-H424 AromaticContact CD2-CD2 3.64Å; Y387-H424 AromaticContact CD2-CG 3.73Å; Y387-H424 AromaticContact CD2-NE2 3.96Å; Y387-H424 HydrophobicContact CE1-CB 3.95Å; Y387-H424 HydrophobicContact CE2-CB 4.21Å; Y387-H424 HydrophobicContact CG-CB 4.15Å; Y387-H424 AromaticContact CG-CD2 3.97Å; Y387-H424 AromaticContact CG-CE1 3.89Å; Y387-H424 AromaticContact CG-CG 3.65Å; Y387-H424 AromaticContact CG-ND1 3.61Å; S422-H424 VanDerWaalsContact C-N 3.26Å; S422-H424 PolarHBondContact O-N 3.07Å; S422-H424 PolarHBondContact OG-N 3.13Å; H424-P426 VanDerWaalsContact C-CD 3.43Å; H424-P426 VanDerWaalsContact C-N 3.33Å; H424-P426 WeakPolarHBondContact O-CD 3.37Å; H424-V427 WeakPolarHBondContact O-CB 3.34Å; H424-V427 PolarHBondContact O-N 3.18Å; H424-A428 PolarHBondContact O-N 2.58Å
425	R	95.7	Very high	95.8	Very high	46 Å²	46	26.1 Å²	26.1	17%	0.174	14%	0.139	C	C	.	.	H	α-helix	trans	-41.4	-43.8	-173.8	-171.9	179	-167	-86.5	-6.8	115.9	A423 V427 A428 V429 D486 E490 R545	A423-R425 PolarHBondContact O-N 3.2Å; R425-V427 VanDerWaalsContact C-N 3.27Å; R425-V427 PolarHBondContact O-N 2.98Å; R425-A428 PolarHBondContact O-N 2.81Å; R425-A428 VanDerWaalsContact O-N 3.11Å; R425-V429 HydrophobicContact CG-CG2 3.91Å; R425-V429 WeakPolarHBondContact O-CG2 3.35Å; R425-V429 PolarHBondContact O-N 2.69Å; R425-D486 WeakPolarHBondContact CD-OD2 3.32Å; R425-D486 WeakPolarHBondContact CG-OD2 3.43Å; R425-D486 IonicContact CZ-OD1 2.86Å; R425-D486 VanDerWaalsContact CZ-OD1 3.25Å; R425-D486 IonicContact CZ-OD2 3.67Å; R425-D486 VanDerWaalsContact NE-CG 3.28Å; R425-D486 IonicContact NE-OD1 3.28Å; R425-D486 PolarHBondContact NE-OD1 3.49Å; R425-D486 IonicContact NE-OD2 3.65Å; R425-D486 PolarHBondContact NE-OD2 3.38Å; R425-D486 PolarHBondContact NH2-O 2.95Å; R425-D486 IonicContact NH2-OD1 3.84Å; R425-D486 PolarHBondContact NH2-OD1 2.95Å; R425-D486 IonicContact NH2-OD2 3.37Å; R425-E490 IonicContact CZ-OE1 2.79Å; R425-E490 IonicContact NH1-OE1 2.78Å; R425-E490 PolarHBondContact NH1-OE1 3.07Å; R425-E490 IonicContact NH2-OE1 2.74Å; R425-E490 PolarHBondContact NH2-OE1 3.09Å; R425-E490 VanDerWaalsContact NH2-OE1 3.17Å; R425-R545 HydrophobicContact CB-CB 4.06Å; R425-R545 HydrophobicContact CB-CG 4.05Å; R425-R545 WeakPolarHBondContact CD-O 3.41Å; R425-R545 HydrophobicContact CG-CB 4.36Å
426	P	97.5	Very high	95.8	Very high	66 Å²	66	25.3 Å²	25.3	43%	0.429	13%	0.133	S	C	.	.	H	α-helix	trans	-58.9	-31.8	177.5	-26.8	35.5	0	0	0	115.1	V391 H424 A430	V391-P426 HydrophobicContact CG2-CB 3.87Å; H424-P426 VanDerWaalsContact C-CD 3.43Å; H424-P426 VanDerWaalsContact C-N 3.33Å; H424-P426 WeakPolarHBondContact O-CD 3.37Å; P426-A430 WeakPolarHBondContact O-CB 3.47Å; P426-A430 PolarHBondContact O-N 2.98Å
427	V	98.3	Very high	95.5	Very high	4 Å²	4	28.8 Å²	28.8	2%	0.024	15%	0.148	C	C	.	.	H	α-helix	trans	-71.9	-45.7	173.3	163.3	0	0	0	0	109.7	Y387 A390 V391 I394 L419 H424 R425 V429 A430 A431	Y387-V427 HydrophobicContact CD1-CG2 4.16Å; A390-V427 HydrophobicContact CB-CG2 3.91Å; V391-V427 HydrophobicContact CG2-CG2 3.72Å; I394-V427 HydrophobicContact CD1-CG1 3.83Å; L419-V427 HydrophobicContact CB-CG1 4.19Å; H424-V427 WeakPolarHBondContact O-CB 3.34Å; H424-V427 PolarHBondContact O-N 3.18Å; R425-V427 VanDerWaalsContact C-N 3.27Å; R425-V427 PolarHBondContact O-N 2.98Å; V427-V429 PolarHBondContact O-N 3.29Å; V427-A430 PolarHBondContact O-N 3.24Å; V427-A431 PolarHBondContact O-N 2.82Å
428	A	97.9	Very high	95.2	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-64.6	-40.9	-177.7	0	0	0	0	0	113.3	L419 H424 R425 A431 G432 S487 R545	L419-A428 VanDerWaalsContact O-CA 3.31Å; L419-A428 WeakPolarHBondContact O-CA 3.47Å; H424-A428 PolarHBondContact O-N 2.58Å; R425-A428 PolarHBondContact O-N 2.81Å; R425-A428 VanDerWaalsContact O-N 3.11Å; A428-A431 PolarHBondContact O-N 3Å; A428-G432 PolarHBondContact O-N 3.15Å; A428-S487 VanDerWaalsContact CB-OG 3.28Å; A428-S487 WeakPolarHBondContact CB-OG 3.41Å; A428-S487 WeakPolarHBondContact O-CB 3.2Å; A428-S487 PolarHBondContact O-OG 3.23Å; A428-R545 VanDerWaalsContact CB-NH2 3.26Å
429	V	97.9	Very high	94.7	Very high	26 Å²	26	26.3 Å²	26.3	16%	0.158	14%	0.138	C	C	.	.	H	α-helix	trans	-69	-35.2	174.7	175.3	0	0	0	0	111.9	R425 V427 A431 G432 E433 E490	R425-V429 HydrophobicContact CG-CG2 3.91Å; R425-V429 WeakPolarHBondContact O-CG2 3.35Å; R425-V429 PolarHBondContact O-N 2.69Å; V427-V429 PolarHBondContact O-N 3.29Å; V429-A431 VanDerWaalsContact C-N 3.33Å; V429-G432 PolarHBondContact O-N 3.45Å; V429-E433 PolarHBondContact O-N 3.15Å; V429-E490 HydrophobicContact CG1-CB 4.34Å
430	A	98.2	Very high	93.9	Very high	5 Å²	5	26.5 Å²	26.5	4%	0.041	14%	0.138	C	C	.	.	H	α-helix	trans	-65.6	-37.6	172.8	0	0	0	0	0	111.9	V391 I394 P426 V427 E433 F434	V391-A430 HydrophobicContact CG1-CB 4.35Å; I394-A430 HydrophobicContact CB-CB 4.14Å; I394-A430 HydrophobicContact CD1-CB 4.33Å; I394-A430 VanDerWaalsContact CG2-C 3.49Å; I394-A430 HydrophobicContact CG2-CB 3.95Å; I394-A430 VanDerWaalsContact CG2-O 3.31Å; I394-A430 WeakPolarHBondContact CG2-O 3.49Å; P426-A430 WeakPolarHBondContact O-CB 3.47Å; P426-A430 PolarHBondContact O-N 2.98Å; V427-A430 PolarHBondContact O-N 3.24Å; A430-E433 PolarHBondContact O-N 3.25Å; A430-F434 PolarHBondContact O-N 3.12Å; A430-F434 VanDerWaalsContact O-N 3.16Å
431	A	98	Very high	92.5	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-68.9	-35.2	172.3	0	0	0	0	0	112.3	V416 L419 V420 V427 A428 V429 F434 L435	V416-A431 HydrophobicContact CG1-CB 4.39Å; L419-A431 HydrophobicContact CB-CB 3.76Å; V420-A431 HydrophobicContact CG1-CB 3.8Å; V427-A431 PolarHBondContact O-N 2.82Å; A428-A431 PolarHBondContact O-N 3Å; V429-A431 VanDerWaalsContact C-N 3.33Å; A431-F434 WeakPolarHBondContact O-CB 3.33Å; A431-F434 PolarHBondContact O-N 3.5Å; A431-L435 WeakPolarHBondContact O-CB 3.47Å; A431-L435 PolarHBondContact O-N 2.97Å
432	G	96.8	Very high	90.7	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-61.7	-41.4	171.2	0	0	0	0	0	112.6	A428 V429 F434 L435 H436 L488	A428-G432 PolarHBondContact O-N 3.15Å; V429-G432 PolarHBondContact O-N 3.45Å; G432-F434 VanDerWaalsContact C-N 3.33Å; G432-F434 PolarHBondContact O-N 3.4Å; G432-L435 PolarHBondContact O-N 3.42Å; G432-H436 VanDerWaalsContact O-CB 3.29Å; G432-H436 WeakPolarHBondContact O-CB 3.34Å; G432-H436 PolarHBondContact O-N 3.46Å; G432-L488 WeakPolarHBondContact O-CD2 3.4Å
433	E	96.1	Very high	88.8	Confident	69 Å²	69	40.8 Å²	40.8	32%	0.322	20%	0.199	S	C	.	.	H	α-helix	trans	-62.9	-38	173.5	-163.2	-163.9	154.5	0	0	112.2	V429 A430 K437	V429-E433 PolarHBondContact O-N 3.15Å; A430-E433 PolarHBondContact O-N 3.25Å; E433-K437 WeakPolarHBondContact O-CG 3.28Å; E433-K437 PolarHBondContact O-N 3.02Å; E433-K437 IonicContact OE1-NZ 2.61Å; E433-K437 PolarHBondContact OE1-NZ 3.28Å
434	F	95.8	Very high	87.1	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-65.2	-51.1	173.4	179.1	-100.5	0	0	0	111.8	I394 V397 L401 L408 C413 V416 Y417 A430 A431 G432 H436 K437 K438	I394-F434 HydrophobicContact CG2-CB 4.35Å; V397-F434 HydrophobicContact CG1-CD2 4.31Å; V397-F434 HydrophobicContact CG1-CE2 3.69Å; V397-F434 HydrophobicContact CG1-CZ 4.19Å; L401-F434 HydrophobicContact CB-CE2 4.17Å; L401-F434 HydrophobicContact CD2-CD2 4.05Å; L401-F434 HydrophobicContact CD2-CE2 3.64Å; L401-F434 HydrophobicContact CD2-CZ 4.23Å; L401-F434 HydrophobicContact CG-CE2 4.46Å; L408-F434 HydrophobicContact CD1-CE2 3.96Å; L408-F434 HydrophobicContact CD1-CZ 4.11Å; C413-F434 HydrophobicContact CB-CE1 4.18Å; C413-F434 HydrophobicContact CB-CZ 4.29Å; V416-F434 HydrophobicContact CB-CD1 3.83Å; V416-F434 HydrophobicContact CB-CE1 3.79Å; V416-F434 HydrophobicContact CB-CZ 4.46Å; V416-F434 HydrophobicContact CG1-CB 4.02Å; V416-F434 HydrophobicContact CG1-CD1 3.39Å; V416-F434 HydrophobicContact CG1-CD2 4.46Å; V416-F434 HydrophobicContact CG1-CE1 3.89Å; V416-F434 HydrophobicContact CG1-CG 3.71Å; V416-F434 HydrophobicContact CG2-CE1 4.47Å; Y417-F434 HydrophobicContact CD1-CD1 4.12Å; Y417-F434 HydrophobicContact CD1-CE1 4.01Å; Y417-F434 HydrophobicContact CE1-CD1 4.07Å; Y417-F434 AromaticContact CE1-CE1 3.73Å; Y417-F434 HydrophobicContact CE1-CE1 3.73Å; A430-F434 PolarHBondContact O-N 3.12Å; A430-F434 VanDerWaalsContact O-N 3.16Å; A431-F434 WeakPolarHBondContact O-CB 3.33Å; A431-F434 PolarHBondContact O-N 3.5Å; G432-F434 VanDerWaalsContact C-N 3.33Å; G432-F434 PolarHBondContact O-N 3.4Å; F434-H436 PolarHBondContact O-N 2.79Å; F434-K437 PolarHBondContact O-N 3.03Å; F434-K438 PolarHBondContact O-N 2.84Å
435	L	94.2	Very high	85.2	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-57.9	-46.8	179.6	-176.6	66.1	0	0	0	111.4	Y417 V420 A431 G432 K437 K438 L439 F471 L484 L488	Y417-L435 HydrophobicContact CD1-CD1 3.59Å; Y417-L435 HydrophobicContact CE1-CD1 3.7Å; Y417-L435 HydrophobicContact CG-CD1 4.15Å; V420-L435 HydrophobicContact CG1-CD2 4.08Å; A431-L435 WeakPolarHBondContact O-CB 3.47Å; A431-L435 PolarHBondContact O-N 2.97Å; G432-L435 PolarHBondContact O-N 3.42Å; L435-K437 VanDerWaalsContact C-N 3.35Å; L435-K437 PolarHBondContact O-N 2.98Å; L435-K438 PolarHBondContact O-N 3.2Å; L435-L439 HydrophobicContact CD1-CD1 3.47Å; L435-L439 VanDerWaalsContact CD1-CD1 3.47Å; L435-L439 HydrophobicContact CD1-CG 3.94Å; L435-L439 HydrophobicContact CG-CD1 4.23Å; L435-L439 PolarHBondContact O-N 3.2Å; L435-F471 HydrophobicContact CD1-CD2 3.79Å; L435-F471 HydrophobicContact CD1-CE1 4.48Å; L435-F471 HydrophobicContact CD1-CE2 3.44Å; L435-F471 VanDerWaalsContact CD1-CE2 3.44Å; L435-F471 HydrophobicContact CD1-CG 4.43Å; L435-F471 HydrophobicContact CD1-CZ 3.84Å; L435-F471 HydrophobicContact CD2-CD1 4Å; L435-F471 HydrophobicContact CD2-CD2 4.46Å; L435-F471 HydrophobicContact CD2-CE1 3.61Å; L435-F471 HydrophobicContact CD2-CE2 4.09Å; L435-F471 HydrophobicContact CD2-CG 4.42Å; L435-F471 HydrophobicContact CD2-CZ 3.65Å; L435-F471 HydrophobicContact CG-CE2 4.44Å; L435-F471 HydrophobicContact CG-CZ 4.43Å; L435-L484 HydrophobicContact CD2-CD1 4.17Å; L435-L488 HydrophobicContact CD2-CD1 4.37Å; L435-L488 HydrophobicContact CD2-CD2 4.32Å
436	H	92.1	Very high	83.2	Confident	49 Å²	49	51.1 Å²	51.1	23%	0.227	25%	0.254	C	S	.	.	I	π-helix	trans	-55	-48.9	175.2	176.2	109.6	0	0	0	111.6	G432 F434 K438 F440 S441 L488 S491 S492	G432-H436 VanDerWaalsContact O-CB 3.29Å; G432-H436 WeakPolarHBondContact O-CB 3.34Å; G432-H436 PolarHBondContact O-N 3.46Å; F434-H436 PolarHBondContact O-N 2.79Å; H436-K438 VanDerWaalsContact C-N 3.34Å; H436-K438 PolarHBondContact O-N 3.41Å; H436-F440 HydrophobicContact CB-CD2 4.18Å; H436-F440 WeakPolarHBondContact O-CA 3.4Å; H436-F440 WeakPolarHBondContact O-CB 3.4Å; H436-F440 PolarHBondContact O-N 3.39Å; H436-S441 PolarHBondContact CD2-OG 3.29Å; H436-S441 VanDerWaalsContact CD2-OG 3.32Å; H436-S441 PolarHBondContact NE2-OG 2.98Å; H436-S441 PolarHBondContact O-N 2.88Å; H436-S441 VanDerWaalsContact O-N 3.12Å; H436-S441 PolarHBondContact O-OG 3.01Å; H436-L488 HydrophobicContact CB-CD2 4.46Å; H436-S491 PolarHBondContact CE1-O 3.14Å; H436-S491 PolarHBondContact ND1-O 3.49Å; H436-S492 PolarHBondContact ND1-OG 2.78Å
437	K	89.6	Confident	81.2	Confident	73 Å²	73	49.8 Å²	49.8	32%	0.317	25%	0.248	S	C	.	.	I	π-helix	trans	-70.3	-28.6	-178.4	-73.2	170.6	-179.8	175.2	0	113.4	T398 E433 F434 L435	T398-K437 HydrophobicContact CG2-CD 3.5Å; E433-K437 WeakPolarHBondContact O-CG 3.28Å; E433-K437 PolarHBondContact O-N 3.02Å; E433-K437 IonicContact OE1-NZ 2.61Å; E433-K437 PolarHBondContact OE1-NZ 3.28Å; F434-K437 PolarHBondContact O-N 3.03Å; L435-K437 VanDerWaalsContact C-N 3.35Å; L435-K437 PolarHBondContact O-N 2.98Å
438	K	87.9	Confident	79.2	Confident	27 Å²	27	54 Å²	54	12%	0.117	27%	0.268	C	S	.	.	I	π-helix	trans	-81.4	-37.5	179.1	-170.6	61.1	173.8	-173.2	0	113.2	L401 Y417 F434 L435 H436	L401-K438 HydrophobicContact CD1-CD 3.62Å; L401-K438 HydrophobicContact CD2-CB 3.89Å; L401-K438 HydrophobicContact CD2-CD 3.82Å; L401-K438 HydrophobicContact CD2-CG 4.35Å; L401-K438 HydrophobicContact CG-CD 4.36Å; Y417-K438 HydrophobicContact CE1-CB 4.46Å; Y417-K438 HydrophobicContact CE1-CG 4.31Å; Y417-K438 WeakPolarHBondContact OH-CG 3.25Å; F434-K438 PolarHBondContact O-N 2.84Å; L435-K438 PolarHBondContact O-N 3.2Å; H436-K438 VanDerWaalsContact C-N 3.34Å; H436-K438 PolarHBondContact O-N 3.41Å
439	L	82.2	Confident	77.2	Confident	43 Å²	43	60.4 Å²	60.4	23%	0.225	30%	0.297	C	S	.	.	I	π-helix	trans	-103.8	-39.9	-174.8	-59.5	-171.4	0	0	0	114.4	L435 F471	L435-L439 HydrophobicContact CD1-CD1 3.47Å; L435-L439 VanDerWaalsContact CD1-CD1 3.47Å; L435-L439 HydrophobicContact CD1-CG 3.94Å; L435-L439 HydrophobicContact CG-CD1 4.23Å; L435-L439 PolarHBondContact O-N 3.2Å; L439-F471 HydrophobicContact CD1-CB 4.49Å; L439-F471 HydrophobicContact CD1-CD2 4.05Å; L439-F471 HydrophobicContact CD1-CG 4.45Å
440	F	79.9	Confident	75.1	Confident	19 Å²	19	61.7 Å²	61.7	8%	0.083	31%	0.311	C	S	.	.	I	π-helix	trans	-100.6	-29.8	-169.3	-49.8	-38.2	0	0	0	113.6	H436 R442 L464 M467 L468 L488 L495	H436-F440 HydrophobicContact CB-CD2 4.18Å; H436-F440 WeakPolarHBondContact O-CA 3.4Å; H436-F440 WeakPolarHBondContact O-CB 3.4Å; H436-F440 PolarHBondContact O-N 3.39Å; F440-R442 PolarHBondContact O-N 3.08Å; F440-R442 VanDerWaalsContact O-N 3.08Å; F440-L464 HydrophobicContact CB-CD2 4.33Å; F440-L464 HydrophobicContact CD1-CB 4.28Å; F440-L464 HydrophobicContact CD1-CD2 4.13Å; F440-M467 HydrophobicContact CD1-CE 4.41Å; F440-M467 HydrophobicContact CE1-CB 4.41Å; F440-L468 HydrophobicContact CZ-CB 4.13Å; F440-L468 HydrophobicContact CZ-CD1 4.21Å; F440-L488 HydrophobicContact CE2-CD1 4.35Å; F440-L488 HydrophobicContact CE2-CD2 4.39Å; F440-L495 HydrophobicContact CD2-CD2 4.1Å; F440-L495 HydrophobicContact CE1-CD2 4.44Å; F440-L495 HydrophobicContact CE2-CD2 4.06Å; F440-L495 HydrophobicContact CG-CD2 4.36Å; F440-L495 HydrophobicContact CZ-CD2 4.24Å
441	S	68.4	Low	73.1	Confident	38 Å²	38	63.6 Å²	63.6	27%	0.266	32%	0.32	S	S	.	.			trans	-80.2	27.8	178.7	-48.1	0	0	0	0	115.1	H436 H443	H436-S441 PolarHBondContact CD2-OG 3.29Å; H436-S441 VanDerWaalsContact CD2-OG 3.32Å; H436-S441 PolarHBondContact NE2-OG 2.98Å; H436-S441 PolarHBondContact O-N 2.88Å; H436-S441 VanDerWaalsContact O-N 3.12Å; H436-S441 PolarHBondContact O-OG 3.01Å; S441-H443 VanDerWaalsContact C-N 3.3Å; S441-H443 PolarHBondContact O-CD2 3.22Å; S441-H443 PolarHBondContact O-N 3.47Å
442	R	57.9	Low	71	Confident	179 Å²	179	67 Å²	67	68%	0.675	35%	0.348	S	S	*	.			trans	-82.3	73.7	175.3	-81.4	-171.6	158.4	178.7	-4.8	111.3	E405 F440 D444	E405-R442 IonicContact OE2-NH2 3.64Å; F440-R442 PolarHBondContact O-N 3.08Å; F440-R442 VanDerWaalsContact O-N 3.08Å; R442-D444 PolarHBondContact O-N 3.36Å
443	H	53.8	Low	69	Low	128 Å²	128	74.2 Å²	74.2	59%	0.593	38%	0.38	S	S	*	.			trans	-70	110.9	-178.9	-60.8	-83.8	0	0	0	112.5	S441 E448	S441-H443 VanDerWaalsContact C-N 3.3Å; S441-H443 PolarHBondContact O-CD2 3.22Å; S441-H443 PolarHBondContact O-N 3.47Å; H443-E448 IonicContact ND1-OE1 3.79Å; H443-E448 IonicContact ND1-OE2 3.83Å
444	D	55.1	Low	67.4	Low	89 Å²	89	77.1 Å²	77.1	48%	0.476	39%	0.388	S	S	.	.			trans	-99.3	105.6	148.6	175.9	-0.7	0	0	0	108.2	R442 Q446 A447 E448	R442-D444 PolarHBondContact O-N 3.36Å; D444-Q446 PolarHBondContact O-N 2.58Å; D444-Q446 VanDerWaalsContact O-N 3.14Å; D444-Q446 WeakPolarHBondContact OD1-CB 3.49Å; D444-Q446 PolarHBondContact OD1-N 3.26Å; D444-A447 HydrophobicContact CB-CB 3.95Å; D444-A447 PolarHBondContact O-N 2.79Å; D444-A447 VanDerWaalsContact O-N 3.14Å; D444-A447 PolarHBondContact OD1-N 2.83Å; D444-E448 PolarHBondContact O-N 2.64Å
445	P	55.7	Low	65.7	Low	91 Å²	91	86.8 Å²	86.8	59%	0.591	42%	0.424	S	S	*	.	H	α-helix	trans	-60.3	-22.8	-179.2	-24.7	35	0	0	0	114.3	E449	P445-E449 PolarHBondContact O-N 3.11Å
446	Q	53.8	Low	64.4	Low	168 Å²	168	86.9 Å²	86.9	79%	0.785	43%	0.425	S	S	*	.	H	α-helix	trans	-80.6	-34.6	178.4	-58.8	-170.7	5.4	0	0	111.7	D444	D444-Q446 PolarHBondContact O-N 2.58Å; D444-Q446 VanDerWaalsContact O-N 3.14Å; D444-Q446 WeakPolarHBondContact OD1-CB 3.49Å; D444-Q446 PolarHBondContact OD1-N 3.26Å
447	A	55.3	Low	63.3	Low	37 Å²	37	85.2 Å²	85.2	31%	0.306	42%	0.417	S	S	.	.	H	α-helix	trans	-66.9	-40.2	168.8	0	0	0	0	0	111.1	D444 A450 L451	D444-A447 HydrophobicContact CB-CB 3.95Å; D444-A447 PolarHBondContact O-N 2.79Å; D444-A447 VanDerWaalsContact O-N 3.14Å; D444-A447 PolarHBondContact OD1-N 2.83Å; A447-A450 PolarHBondContact O-N 3.36Å; A447-A450 VanDerWaalsContact O-N 3.16Å; A447-L451 HydrophobicContact CB-CD1 4.39Å; A447-L451 WeakPolarHBondContact O-CB 3.29Å; A447-L451 WeakPolarHBondContact O-CG 3.09Å; A447-L451 PolarHBondContact O-N 3.42Å
448	E	56	Low	62.2	Low	94 Å²	94	84.3 Å²	84.3	44%	0.439	42%	0.416	S	S	.	.	H	α-helix	trans	-60.5	-48	-177.3	-162.9	163.6	-153.2	0	0	112.3	H443 D444 A450 L451 A452	H443-E448 IonicContact ND1-OE1 3.79Å; H443-E448 IonicContact ND1-OE2 3.83Å; D444-E448 PolarHBondContact O-N 2.64Å; E448-A450 PolarHBondContact O-N 3.16Å; E448-L451 PolarHBondContact O-N 3.23Å; E448-A452 WeakPolarHBondContact O-CB 3.33Å; E448-A452 PolarHBondContact O-N 2.68Å
449	E	56.4	Low	61.5	Low	133 Å²	133	83.6 Å²	83.6	62%	0.621	41%	0.414	S	S	*	.	H	α-helix	trans	-69.8	-17.9	177.9	-147.2	-145.9	127.8	0	0	113.9	P445 K453	P445-E449 PolarHBondContact O-N 3.11Å; E449-K453 PolarHBondContact O-NZ 2.89Å; E449-K453 IonicContact OE1-NZ 3.36Å; E449-K453 PolarHBondContact OE1-NZ 3.2Å
450	A	54.9	Low	60.9	Low	54 Å²	54	83.9 Å²	83.9	45%	0.446	42%	0.419	S	S	.	.	H	α-helix	trans	-89.4	-26.1	175.9	0	0	0	0	0	113.2	A447 E448	A447-A450 PolarHBondContact O-N 3.36Å; A447-A450 VanDerWaalsContact O-N 3.16Å; E448-A450 PolarHBondContact O-N 3.16Å
451	L	54.2	Low	61	Low	45 Å²	45	84.6 Å²	84.6	24%	0.236	42%	0.423	C	S	.	.	H	α-helix	trans	-93.1	-35	178.2	-69.5	169.6	0	0	0	112.5	A447 E448 K453 R454 P460	A447-L451 HydrophobicContact CB-CD1 4.39Å; A447-L451 WeakPolarHBondContact O-CB 3.29Å; A447-L451 WeakPolarHBondContact O-CG 3.09Å; A447-L451 PolarHBondContact O-N 3.42Å; E448-L451 PolarHBondContact O-N 3.23Å; L451-K453 PolarHBondContact O-N 2.82Å; L451-R454 VanDerWaalsContact O-CB 3.32Å; L451-R454 WeakPolarHBondContact O-CB 3.09Å; L451-R454 PolarHBondContact O-N 3Å; L451-P460 HydrophobicContact CB-CB 4.14Å; L451-P460 HydrophobicContact CD1-CB 4.42Å
452	A	55.1	Low	61.8	Low	71 Å²	71	82.9 Å²	82.9	59%	0.587	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-8.1	179.6	0	0	0	0	0	114.8	E448	E448-A452 WeakPolarHBondContact O-CB 3.33Å; E448-A452 PolarHBondContact O-N 2.68Å
453	K	54.3	Low	63	Low	151 Å²	151	79.1 Å²	79.1	66%	0.657	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.9	-1.4	172.1	-67.1	169.2	-172.9	124.2	0	113	E449 L451	E449-K453 PolarHBondContact O-NZ 2.89Å; E449-K453 IonicContact OE1-NZ 3.36Å; E449-K453 PolarHBondContact OE1-NZ 3.2Å; L451-K453 PolarHBondContact O-N 2.82Å
454	R	62.1	Low	64.6	Low	130 Å²	130	74.8 Å²	74.8	49%	0.491	39%	0.385	S	S	.	.			trans	-108.4	159.7	178.5	-50.6	-175.1	-173.3	-158.7	4.8	110	L451 N458	L451-R454 VanDerWaalsContact O-CB 3.32Å; L451-R454 WeakPolarHBondContact O-CB 3.09Å; L451-R454 PolarHBondContact O-N 3Å; R454-N458 HydrophobicContact CB-CB 3.95Å; R454-N458 WeakPolarHBondContact CB-O 3.41Å; R454-N458 WeakPolarHBondContact CD-O 3.49Å
455	R	60.8	Low	66.4	Low	203 Å²	203	70.7 Å²	70.7	77%	0.766	36%	0.364	S	S	*	.			trans	-127.1	170.3	179.3	-67.7	-170.2	178	-160.2	-1.7	111.1	N458 S459	R455-N458 PolarHBondContact O-N 3.3Å; R455-N458 VanDerWaalsContact O-N 3.15Å; R455-S459 PolarHBondContact O-N 2.96Å
456	G	66.5	Low	68	Low	3 Å²	3	68 Å²	68	3%	0.031	34%	0.342	C	S	.	.	G	3₁₀ helix	trans	57.7	-137.1	172.9	0	0	0	0	0	112.6	N458 S459 C501 E504	G456-N458 PolarHBondContact O-N 3.32Å; G456-S459 WeakPolarHBondContact O-CB 3.37Å; G456-S459 PolarHBondContact O-N 3.38Å; G456-S459 PolarHBondContact O-OG 2.8Å; G456-C501 VanDerWaalsContact C-SG 3.6Å; G456-C501 PolarHBondContact O-SG 3Å; G456-E504 WeakPolarHBondContact CA-OE1 3.46Å; G456-E504 WeakPolarHBondContact CA-OE2 3.31Å
457	R	68.8	Low	69.8	Low	14 Å²	14	63.5 Å²	63.5	5%	0.053	32%	0.322	C	S	.	.	G	3₁₀ helix	trans	-51	-30.7	176.7	178.8	179.9	-168.6	111.3	8.2	113.6	E504 L505 E508 E514	R457-E504 HydrophobicContact CB-CB 3.78Å; R457-E504 PolarHBondContact N-OE2 2.83Å; R457-E504 PolarHBondContact NH1-O 3.11Å; R457-L505 HydrophobicContact CG-CD2 4.02Å; R457-L505 HydrophobicContact CG-CG 4.4Å; R457-L505 PolarHBondContact NH1-O 3.48Å; R457-L505 VanDerWaalsContact NH1-O 3.09Å; R457-E508 PolarHBondContact NH1-O 3.17Å; R457-E514 IonicContact CZ-OE1 3.22Å; R457-E514 IonicContact CZ-OE2 3.71Å; R457-E514 IonicContact NE-OE1 3.51Å; R457-E514 PolarHBondContact NE-OE1 2.8Å; R457-E514 IonicContact NE-OE2 3.68Å; R457-E514 PolarHBondContact NE-OE2 3.12Å; R457-E514 VanDerWaalsContact NH2-CD 3.26Å; R457-E514 IonicContact NH2-OE1 2.65Å; R457-E514 PolarHBondContact NH2-OE1 2.78Å; R457-E514 IonicContact NH2-OE2 2.68Å; R457-E514 PolarHBondContact NH2-OE2 3.42Å
458	N	67.3	Low	71.6	Confident	54 Å²	54	62 Å²	62	29%	0.289	31%	0.308	S	S	.	.	G	3₁₀ helix	trans	-88.7	-2.5	-178.4	-83.5	-91.7	0	0	0	114.1	R454 R455 G456	R454-N458 HydrophobicContact CB-CB 3.95Å; R454-N458 WeakPolarHBondContact CB-O 3.41Å; R454-N458 WeakPolarHBondContact CD-O 3.49Å; R455-N458 PolarHBondContact O-N 3.3Å; R455-N458 VanDerWaalsContact O-N 3.15Å; G456-N458 PolarHBondContact O-N 3.32Å
459	S	72.4	Confident	73.5	Confident	12 Å²	12	57.5 Å²	57.5	8%	0.084	29%	0.288	C	S	.	.	S	Bend	trans	-66.4	165.8	175.8	77	0	0	0	0	112	R455 G456 N461 G462	R455-S459 PolarHBondContact O-N 2.96Å; G456-S459 WeakPolarHBondContact O-CB 3.37Å; G456-S459 PolarHBondContact O-N 3.38Å; G456-S459 PolarHBondContact O-OG 2.8Å; S459-N461 PolarHBondContact O-N 3.41Å; S459-N461 WeakPolarHBondContact OG-CB 3.44Å; S459-N461 PolarHBondContact OG-N 3.24Å; S459-G462 PolarHBondContact O-N 3.34Å; S459-G462 PolarHBondContact OG-N 2.81Å
460	P	70.9	Confident	75.2	Confident	49 Å²	49	54.4 Å²	54.4	32%	0.318	28%	0.275	S	S	.	.	H	α-helix	trans	-59.4	-27.6	169.8	24.9	-34.4	0	0	0	113	L451 G462	L451-P460 HydrophobicContact CB-CB 4.14Å; L451-P460 HydrophobicContact CD1-CB 4.42Å; P460-G462 VanDerWaalsContact C-N 3.34Å; P460-G462 PolarHBondContact O-N 3.28Å
461	N	81.9	Confident	77.1	Confident	34 Å²	34	52.5 Å²	52.5	18%	0.182	26%	0.257	C	S	.	.	H	α-helix	trans	-67.4	-29.1	-179.3	-71.3	-17.7	0	0	0	113.2	S459 N463 L464 I465 E494 L495 D498	S459-N461 PolarHBondContact O-N 3.41Å; S459-N461 WeakPolarHBondContact OG-CB 3.44Å; S459-N461 PolarHBondContact OG-N 3.24Å; N461-N463 VanDerWaalsContact C-N 3.29Å; N461-N463 PolarHBondContact O-N 3.14Å; N461-L464 CarbonylContact O-C 3.56Å; N461-L464 WeakPolarHBondContact O-CA 3.4Å; N461-L464 WeakPolarHBondContact O-CB 3.13Å; N461-L464 PolarHBondContact O-N 3.1Å; N461-I465 HydrophobicContact CB-CD1 4.49Å; N461-I465 WeakPolarHBondContact O-CG1 3.48Å; N461-I465 PolarHBondContact O-N 2.86Å; N461-E494 PolarHBondContact ND2-O 2.97Å; N461-L495 HydrophobicContact CB-CD1 3.95Å; N461-D498 WeakPolarHBondContact CB-OD2 3.22Å; N461-D498 PolarHBondContact ND2-OD2 2.72Å
462	G	83.6	Confident	79.1	Confident	1 Å²	1	51 Å²	51	1%	0.01	25%	0.248	C	C	.	.	H	α-helix	trans	-57.5	-39.2	-175.5	0	0	0	0	0	113.9	S459 P460 R466 C501	S459-G462 PolarHBondContact O-N 3.34Å; S459-G462 PolarHBondContact OG-N 2.81Å; P460-G462 VanDerWaalsContact C-N 3.34Å; P460-G462 PolarHBondContact O-N 3.28Å; G462-R466 WeakPolarHBondContact O-CG 3.37Å; G462-R466 PolarHBondContact O-N 3.1Å; G462-R466 VanDerWaalsContact O-N 3.17Å; G462-C501 WeakPolarHBondContact CA-SG 2.84Å
463	N	83.4	Confident	80.9	Confident	100 Å²	100	49 Å²	49	54%	0.535	23%	0.227	S	C	.	.	H	α-helix	trans	-73.4	-34.7	174.1	-73.2	-25.5	0	0	0	112.5	N461 R466 M467	N461-N463 VanDerWaalsContact C-N 3.29Å; N461-N463 PolarHBondContact O-N 3.14Å; N463-R466 PolarHBondContact O-N 3.46Å; N463-M467 WeakPolarHBondContact O-CG 3.46Å; N463-M467 PolarHBondContact O-N 3.23Å
464	L	89.1	Confident	82.7	Confident	37 Å²	37	48.7 Å²	48.7	19%	0.194	23%	0.228	C	C	.	.	H	α-helix	trans	-67.6	-39.6	176.9	-56	-176.6	0	0	0	111.4	F440 N461 M467 L468 L495	F440-L464 HydrophobicContact CB-CD2 4.33Å; F440-L464 HydrophobicContact CD1-CB 4.28Å; F440-L464 HydrophobicContact CD1-CD2 4.13Å; N461-L464 CarbonylContact O-C 3.56Å; N461-L464 WeakPolarHBondContact O-CA 3.4Å; N461-L464 WeakPolarHBondContact O-CB 3.13Å; N461-L464 PolarHBondContact O-N 3.1Å; L464-M467 HydrophobicContact CD2-CE 3.53Å; L464-M467 PolarHBondContact O-N 2.68Å; L464-L468 PolarHBondContact O-N 2.69Å; L464-L495 HydrophobicContact CB-CD1 3.55Å; L464-L495 HydrophobicContact CB-CD2 4Å; L464-L495 HydrophobicContact CB-CG 4.45Å; L464-L495 HydrophobicContact CD1-CD1 4.33Å
465	I	91.7	Very high	83.8	Confident	4 Å²	4	43.2 Å²	43.2	2%	0.021	21%	0.21	C	C	.	.	H	α-helix	trans	-62.2	-47.1	173.5	-66.8	170.3	0	0	0	110	N461 M467 L468 V469 L495 C501 M502 L505 L525	N461-I465 HydrophobicContact CB-CD1 4.49Å; N461-I465 WeakPolarHBondContact O-CG1 3.48Å; N461-I465 PolarHBondContact O-N 2.86Å; I465-M467 VanDerWaalsContact C-N 3.31Å; I465-M467 PolarHBondContact O-N 3.23Å; I465-L468 WeakPolarHBondContact O-CB 3.34Å; I465-L468 PolarHBondContact O-N 2.78Å; I465-L468 VanDerWaalsContact O-N 3.11Å; I465-V469 WeakPolarHBondContact O-CG2 3.44Å; I465-V469 PolarHBondContact O-N 2.94Å; I465-L495 HydrophobicContact CD1-CD1 4.43Å; I465-L495 HydrophobicContact CG1-CD1 3.58Å; I465-L495 HydrophobicContact CG1-CG 4.44Å; I465-C501 HydrophobicContact CD1-CB 3.89Å; I465-M502 HydrophobicContact CD1-CE 4.41Å; I465-M502 HydrophobicContact CD1-CG 3.83Å; I465-M502 HydrophobicContact CG2-CG 4.48Å; I465-L505 HydrophobicContact CB-CD1 4.05Å; I465-L505 HydrophobicContact CD1-CD1 4.31Å; I465-L505 HydrophobicContact CG2-CD1 3.79Å; I465-L525 HydrophobicContact CG2-CD1 3.45Å; I465-L525 VanDerWaalsContact CG2-CD1 3.45Å
466	R	90.2	Very high	85	Confident	34 Å²	34	41 Å²	41	13%	0.128	21%	0.208	C	C	.	.	H	α-helix	trans	-58.4	-39.7	175	-76.2	172.3	166.5	-90.4	11.8	112.6	G462 N463 V469 L470 L505 E514 E515 M517	G462-R466 WeakPolarHBondContact O-CG 3.37Å; G462-R466 PolarHBondContact O-N 3.1Å; G462-R466 VanDerWaalsContact O-N 3.17Å; N463-R466 PolarHBondContact O-N 3.46Å; R466-V469 PolarHBondContact O-N 3.06Å; R466-L470 WeakPolarHBondContact O-CG 3.26Å; R466-L470 PolarHBondContact O-N 2.72Å; R466-L505 HydrophobicContact CG-CD2 4.38Å; R466-E514 IonicContact CZ-OE1 3.73Å; R466-E514 IonicContact NE-OE1 2.74Å; R466-E514 PolarHBondContact NE-OE1 3.24Å; R466-E514 IonicContact NH2-OE1 3.68Å; R466-E514 PolarHBondContact NH2-OE1 2.95Å; R466-E515 PolarHBondContact NH1-O 3.36Å; R466-E515 PolarHBondContact NH2-O 3.45Å; R466-M517 HydrophobicContact CG-SD 4.08Å; R466-M517 PolarHBondContact NH1-SD 3.08Å; R466-M517 VanDerWaalsContact NH1-SD 3.39Å
467	M	90.4	Very high	85.7	Confident	73 Å²	73	45.3 Å²	45.3	36%	0.36	23%	0.23	S	C	.	.	H	α-helix	trans	-68.8	-34.7	174.1	-72	-169.8	-60.9	0	0	113	F440 N463 L464 I465 L470 F471	F440-M467 HydrophobicContact CD1-CE 4.41Å; F440-M467 HydrophobicContact CE1-CB 4.41Å; N463-M467 WeakPolarHBondContact O-CG 3.46Å; N463-M467 PolarHBondContact O-N 3.23Å; L464-M467 HydrophobicContact CD2-CE 3.53Å; L464-M467 PolarHBondContact O-N 2.68Å; I465-M467 VanDerWaalsContact C-N 3.31Å; I465-M467 PolarHBondContact O-N 3.23Å; M467-L470 PolarHBondContact O-N 2.7Å; M467-F471 VanDerWaalsContact O-CB 3.3Å; M467-F471 WeakPolarHBondContact O-CB 3.39Å; M467-F471 PolarHBondContact O-N 2.65Å
468	L	94.2	Very high	86.5	Confident	6 Å²	6	47.5 Å²	47.5	3%	0.031	24%	0.241	C	C	.	.	H	α-helix	trans	-67.5	-38.9	173.9	-179.8	60.6	0	0	0	112	F440 L464 I465 F471 F472 L484 L488 L496 L528	F440-L468 HydrophobicContact CZ-CB 4.13Å; F440-L468 HydrophobicContact CZ-CD1 4.21Å; L464-L468 PolarHBondContact O-N 2.69Å; I465-L468 WeakPolarHBondContact O-CB 3.34Å; I465-L468 PolarHBondContact O-N 2.78Å; I465-L468 VanDerWaalsContact O-N 3.11Å; L468-F471 PolarHBondContact O-N 3.14Å; L468-F472 WeakPolarHBondContact O-CB 3.49Å; L468-F472 PolarHBondContact O-N 3.19Å; L468-L484 HydrophobicContact CD1-CD1 4.3Å; L468-L484 HydrophobicContact CD1-CD2 3.92Å; L468-L484 HydrophobicContact CD1-CG 4.18Å; L468-L488 HydrophobicContact CD1-CD1 3.57Å; L468-L496 HydrophobicContact CD2-CD2 3.88Å; L468-L528 HydrophobicContact CD2-CD2 4.1Å; L468-L528 HydrophobicContact CG-CD1 4.18Å; L468-L528 HydrophobicContact CG-CD2 4.15Å
469	V	95	Very high	87.3	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-62.9	-46.2	173.1	170.1	0	0	0	0	111.1	I465 R466 F472 L473 M517 Q521 A524 L525 L528	I465-V469 WeakPolarHBondContact O-CG2 3.44Å; I465-V469 PolarHBondContact O-N 2.94Å; R466-V469 PolarHBondContact O-N 3.06Å; V469-F472 PolarHBondContact O-N 3.08Å; V469-L473 HydrophobicContact CG1-CD1 4.22Å; V469-L473 WeakPolarHBondContact O-CG 3.42Å; V469-L473 PolarHBondContact O-N 3.18Å; V469-L473 VanDerWaalsContact O-N 3.1Å; V469-M517 HydrophobicContact CG1-CE 4.33Å; V469-Q521 HydrophobicContact CG1-CB 3.82Å; V469-Q521 HydrophobicContact CG1-CG 4Å; V469-A524 HydrophobicContact CG1-CB 3.89Å; V469-L525 HydrophobicContact CG2-CB 3.88Å; V469-L525 HydrophobicContact CG2-CD1 4.03Å; V469-L525 HydrophobicContact CG2-CG 4.47Å; V469-L528 HydrophobicContact CB-CD1 4.42Å; V469-L528 HydrophobicContact CG2-CD1 3.72Å
470	L	93.4	Very high	88.2	Confident	67 Å²	67	57 Å²	57	35%	0.351	28%	0.282	S	S	.	.	H	α-helix	trans	-61.3	-48.5	174.9	-76.4	169.3	0	0	0	111.5	R466 M467 F472 L473 E474	R466-L470 WeakPolarHBondContact O-CG 3.26Å; R466-L470 PolarHBondContact O-N 2.72Å; M467-L470 PolarHBondContact O-N 2.7Å; L470-F472 VanDerWaalsContact C-N 3.3Å; L470-F472 PolarHBondContact O-N 2.97Å; L470-L473 PolarHBondContact O-N 3.5Å; L470-L473 VanDerWaalsContact O-N 3.12Å; L470-E474 WeakPolarHBondContact O-CB 3.32Å; L470-E474 WeakPolarHBondContact O-CG 3.15Å; L470-E474 PolarHBondContact O-N 3.2Å
471	F	94.3	Very high	89.3	Confident	15 Å²	15	54.7 Å²	54.7	7%	0.066	27%	0.267	C	S	.	.	H	α-helix	trans	-55.9	-42.8	177.5	175.1	-90.4	0	0	0	112.7	Y417 V420 L435 L439 M467 L468 S475 L484	Y417-F471 HydrophobicContact CD1-CE2 4.47Å; Y417-F471 AromaticContact CD2-CE2 3.9Å; Y417-F471 HydrophobicContact CD2-CE2 3.9Å; Y417-F471 AromaticContact CG-CE2 3.82Å; Y417-F471 HydrophobicContact CG-CE2 3.82Å; Y417-F471 HydrophobicContact CG-CZ 4.41Å; V420-F471 HydrophobicContact CG2-CE1 4.11Å; V420-F471 HydrophobicContact CG2-CZ 4.26Å; L435-F471 HydrophobicContact CD1-CD2 3.79Å; L435-F471 HydrophobicContact CD1-CE1 4.48Å; L435-F471 HydrophobicContact CD1-CE2 3.44Å; L435-F471 VanDerWaalsContact CD1-CE2 3.44Å; L435-F471 HydrophobicContact CD1-CG 4.43Å; L435-F471 HydrophobicContact CD1-CZ 3.84Å; L435-F471 HydrophobicContact CD2-CD1 4Å; L435-F471 HydrophobicContact CD2-CD2 4.46Å; L435-F471 HydrophobicContact CD2-CE1 3.61Å; L435-F471 HydrophobicContact CD2-CE2 4.09Å; L435-F471 HydrophobicContact CD2-CG 4.42Å; L435-F471 HydrophobicContact CD2-CZ 3.65Å; L435-F471 HydrophobicContact CG-CE2 4.44Å; L435-F471 HydrophobicContact CG-CZ 4.43Å; L439-F471 HydrophobicContact CD1-CB 4.49Å; L439-F471 HydrophobicContact CD1-CD2 4.05Å; L439-F471 HydrophobicContact CD1-CG 4.45Å; M467-F471 VanDerWaalsContact O-CB 3.3Å; M467-F471 WeakPolarHBondContact O-CB 3.39Å; M467-F471 PolarHBondContact O-N 2.65Å; L468-F471 PolarHBondContact O-N 3.14Å; F471-S475 WeakPolarHBondContact O-CB 3.15Å; F471-S475 PolarHBondContact O-N 3.08Å; F471-S475 VanDerWaalsContact O-N 3.07Å; F471-S475 PolarHBondContact O-OG 2.87Å; F471-L484 HydrophobicContact CD1-CD1 4.06Å; F471-L484 HydrophobicContact CD1-CD2 3.98Å; F471-L484 HydrophobicContact CE1-CD1 3.72Å; F471-L484 HydrophobicContact CE1-CD2 4.23Å
472	F	95.3	Very high	90	Very high	13 Å²	13	53.5 Å²	53.5	6%	0.057	26%	0.262	C	S	.	.	H	α-helix	trans	-62.7	-46	176.4	175.2	-124.1	0	0	0	111.6	L468 V469 L470 S475 A481 L484 A524 E527	L468-F472 WeakPolarHBondContact O-CB 3.49Å; L468-F472 PolarHBondContact O-N 3.19Å; V469-F472 PolarHBondContact O-N 3.08Å; L470-F472 VanDerWaalsContact C-N 3.3Å; L470-F472 PolarHBondContact O-N 2.97Å; F472-S475 PolarHBondContact O-N 3.08Å; F472-A481 HydrophobicContact CD2-CB 4.47Å; F472-A481 HydrophobicContact CE1-CB 4.4Å; F472-A481 HydrophobicContact CE2-CB 4.16Å; F472-A481 HydrophobicContact CZ-CB 4.12Å; F472-L484 HydrophobicContact CB-CD2 3.78Å; F472-L484 HydrophobicContact CD2-CD2 4.02Å; F472-L484 HydrophobicContact CG-CD2 4.24Å; F472-A524 HydrophobicContact CD1-CB 3.84Å; F472-A524 HydrophobicContact CE1-CB 4.15Å; F472-E527 HydrophobicContact CE1-CG 4.4Å; F472-E527 HydrophobicContact CZ-CG 4.44Å
473	L	93.6	Very high	90.6	Very high	28 Å²	28	54.8 Å²	54.8	15%	0.147	27%	0.267	C	S	.	.	H	α-helix	trans	-70	-32.6	179.7	-69.7	178.6	0	0	0	114.1	V469 L470 R520 Q521 A524	V469-L473 HydrophobicContact CG1-CD1 4.22Å; V469-L473 WeakPolarHBondContact O-CG 3.42Å; V469-L473 PolarHBondContact O-N 3.18Å; V469-L473 VanDerWaalsContact O-N 3.1Å; L470-L473 PolarHBondContact O-N 3.5Å; L470-L473 VanDerWaalsContact O-N 3.12Å; L473-R520 HydrophobicContact CD1-CG 4.14Å; L473-R520 HydrophobicContact CD2-CG 3.78Å; L473-Q521 HydrophobicContact CD1-CB 4.43Å; L473-Q521 HydrophobicContact CD1-CG 3.72Å; L473-A524 HydrophobicContact CD1-CB 4.12Å; L473-A524 HydrophobicContact CD2-CB 3.84Å; L473-A524 HydrophobicContact CG-CB 3.92Å
474	E	91.6	Very high	91.3	Very high	145 Å²	145	50 Å²	50	68%	0.678	24%	0.241	S	C	*	.	H	α-helix	trans	-81.6	-12.8	177.2	-70.2	173.7	178.6	0	0	112.9	L470	L470-E474 WeakPolarHBondContact O-CB 3.32Å; L470-E474 WeakPolarHBondContact O-CG 3.15Å; L470-E474 PolarHBondContact O-N 3.2Å
475	S	86.6	Confident	91.7	Very high	16 Å²	16	48.3 Å²	48.3	11%	0.112	23%	0.232	C	C	.	.	H	α-helix	trans	-74.4	-33.5	-179.5	-71.4	0	0	0	0	113.5	Y421 F471 F472 L477	Y421-S475 WeakPolarHBondContact OH-CB 3.24Å; Y421-S475 PolarHBondContact OH-OG 3.43Å; F471-S475 WeakPolarHBondContact O-CB 3.15Å; F471-S475 PolarHBondContact O-N 3.08Å; F471-S475 VanDerWaalsContact O-N 3.07Å; F471-S475 PolarHBondContact O-OG 2.87Å; F472-S475 PolarHBondContact O-N 3.08Å; S475-L477 WeakPolarHBondContact O-CG 3.49Å; S475-L477 PolarHBondContact O-N 3.27Å
476	E	85.2	Confident	92	Very high	156 Å²	156	48.1 Å²	48.1	73%	0.729	23%	0.231	S	C	*	.			trans	48.9	11.6	-179.7	-55.4	-165.1	142.4	0	0	116.9
477	L	81.7	Confident	92.4	Very high	94 Å²	94	46.5 Å²	46.5	49%	0.492	23%	0.225	S	C	.	.	S	Bend	trans	-93.7	-16.7	-179.5	-75.1	172.2	0	0	0	114.9	H418 Y421 S475	H418-L477 HydrophobicContact CB-CD1 3.65Å; Y421-L477 HydrophobicContact CD2-CB 4.21Å; Y421-L477 HydrophobicContact CD2-CD1 4.09Å; Y421-L477 HydrophobicContact CE2-CB 4.49Å; S475-L477 WeakPolarHBondContact O-CG 3.49Å; S475-L477 PolarHBondContact O-N 3.27Å
478	H	84.8	Confident	92.7	Very high	60 Å²	60	43 Å²	43	28%	0.278	21%	0.208	S	C	.	.			trans	-150.2	140.5	-179.3	-89.8	-96	0	0	0	110.7	Y421 H480 Y483	Y421-H478 HydrophobicContact CD1-CB 3.93Å; Y421-H478 AromaticContact CD1-CD2 3.23Å; Y421-H478 WeakPolarHBondContact CD1-CD2 3.09Å; Y421-H478 AromaticContact CD1-CG 3.7Å; Y421-H478 AromaticContact CD1-NE2 3.97Å; Y421-H478 HydrophobicContact CE1-CB 3.84Å; Y421-H478 AromaticContact CG-CD2 3.55Å; H478-H480 AromaticContact ND1-CD2 3.97Å; H478-H480 AromaticContact ND1-NE2 3.5Å; H478-Y483 AromaticContact CE1-CD2 3.45Å; H478-Y483 VanDerWaalsContact CE1-CD2 3.45Å; H478-Y483 WeakPolarHBondContact CE1-CD2 3.45Å; H478-Y483 AromaticContact CE1-CE2 3.76Å; H478-Y483 AromaticContact ND1-CD2 3.75Å
479	E	84.6	Confident	92.8	Very high	195 Å²	195	44.1 Å²	44.1	91%	0.911	21%	0.211	S	C	*	.	S	Bend	trans	-82.4	-17.9	177.7	-57.9	178.6	144.3	0	0	113.1
480	H	90.4	Very high	92.6	Very high	71 Å²	71	49.8 Å²	49.8	33%	0.329	24%	0.238	S	C	.	.	S	Bend	trans	-127.5	149.4	-176.1	73	98	0	0	0	111.9	H478 Y483	H478-H480 AromaticContact ND1-CD2 3.97Å; H478-H480 AromaticContact ND1-NE2 3.5Å; H480-Y483 AromaticContact CE1-CD2 3.48Å; H480-Y483 VanDerWaalsContact CE1-CD2 3.48Å; H480-Y483 WeakPolarHBondContact CE1-CD2 3.12Å; H480-Y483 AromaticContact CE1-CE2 3.38Å; H480-Y483 WeakPolarHBondContact CE1-CE2 3.35Å; H480-Y483 AromaticContact NE2-CD2 3.81Å; H480-Y483 AromaticContact NE2-CE2 3.6Å
481	A	95.4	Very high	92.5	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	23%	0.234	C	C	.	.	S	Bend	trans	-89.5	-8.6	-166.9	0	0	0	0	0	114.8	F472 Y483 L484 V485 E527 L528	F472-A481 HydrophobicContact CD2-CB 4.47Å; F472-A481 HydrophobicContact CE1-CB 4.4Å; F472-A481 HydrophobicContact CE2-CB 4.16Å; F472-A481 HydrophobicContact CZ-CB 4.12Å; A481-Y483 VanDerWaalsContact C-N 3.29Å; A481-Y483 PolarHBondContact O-N 3.28Å; A481-Y483 VanDerWaalsContact O-N 3.11Å; A481-L484 WeakPolarHBondContact O-CB 3.39Å; A481-L484 PolarHBondContact O-N 2.84Å; A481-V485 HydrophobicContact CB-CG2 4.39Å; A481-V485 PolarHBondContact O-N 2.85Å; A481-E527 HydrophobicContact CB-CG 3.8Å; A481-E527 PolarHBondContact N-OE1 3.35Å; A481-L528 HydrophobicContact CB-CD2 3.72Å; A481-L528 HydrophobicContact CB-CG 3.85Å
482	A	96	Very high	92.4	Very high	8 Å²	8	48 Å²	48	7%	0.066	23%	0.233	C	C	.	.	H	α-helix	trans	-49.6	-42.7	-171.3	0	0	0	0	0	114.7	D486 C531 P542	A482-D486 PolarHBondContact O-N 3.22Å; A482-D486 VanDerWaalsContact O-N 3.12Å; A482-C531 WeakPolarHBondContact CA-SG 3.25Å; A482-C531 PolarHBondContact N-SG 3.03Å; A482-C531 VanDerWaalsContact N-SG 3.42Å; A482-P542 HydrophobicContact CB-CB 4.38Å
483	Y	96.5	Very high	92.2	Very high	29 Å²	29	51 Å²	51	11%	0.114	25%	0.247	C	C	.	.	H	α-helix	trans	-75.3	-31.7	180	-64.5	-59.3	0	0	0	113.4	H478 H480 A481 S487 P542 R545	H478-Y483 AromaticContact CE1-CD2 3.45Å; H478-Y483 VanDerWaalsContact CE1-CD2 3.45Å; H478-Y483 WeakPolarHBondContact CE1-CD2 3.45Å; H478-Y483 AromaticContact CE1-CE2 3.76Å; H478-Y483 AromaticContact ND1-CD2 3.75Å; H480-Y483 AromaticContact CE1-CD2 3.48Å; H480-Y483 VanDerWaalsContact CE1-CD2 3.48Å; H480-Y483 WeakPolarHBondContact CE1-CD2 3.12Å; H480-Y483 AromaticContact CE1-CE2 3.38Å; H480-Y483 WeakPolarHBondContact CE1-CE2 3.35Å; H480-Y483 AromaticContact NE2-CD2 3.81Å; H480-Y483 AromaticContact NE2-CE2 3.6Å; A481-Y483 VanDerWaalsContact C-N 3.29Å; A481-Y483 PolarHBondContact O-N 3.28Å; A481-Y483 VanDerWaalsContact O-N 3.11Å; Y483-S487 WeakPolarHBondContact O-CB 3.3Å; Y483-S487 PolarHBondContact O-N 3.07Å; Y483-S487 PolarHBondContact O-OG 3.01Å; Y483-P542 HydrophobicContact CD1-CB 4.45Å; Y483-P542 HydrophobicContact CD1-CG 3.79Å; Y483-P542 HydrophobicContact CE1-CB 4.14Å; Y483-P542 HydrophobicContact CE1-CG 3.9Å; Y483-R545 HydrophobicContact CD1-CG 4.32Å; Y483-R545 HydrophobicContact CE1-CG 4.34Å; Y483-R545 PolarHBondContact O-NH1 3.33Å
484	L	97.4	Very high	91.9	Very high	0 Å²	0	58 Å²	58	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-68.8	-44.1	173.4	172.7	58	0	0	0	111	V420 Y421 L435 L468 F471 F472 A481 S487 L488 L528	V420-L484 HydrophobicContact CB-CD1 4.36Å; V420-L484 HydrophobicContact CG2-CD1 3.79Å; Y421-L484 HydrophobicContact CE1-CB 4.01Å; L435-L484 HydrophobicContact CD2-CD1 4.17Å; L468-L484 HydrophobicContact CD1-CD1 4.3Å; L468-L484 HydrophobicContact CD1-CD2 3.92Å; L468-L484 HydrophobicContact CD1-CG 4.18Å; F471-L484 HydrophobicContact CD1-CD1 4.06Å; F471-L484 HydrophobicContact CD1-CD2 3.98Å; F471-L484 HydrophobicContact CE1-CD1 3.72Å; F471-L484 HydrophobicContact CE1-CD2 4.23Å; F472-L484 HydrophobicContact CB-CD2 3.78Å; F472-L484 HydrophobicContact CD2-CD2 4.02Å; F472-L484 HydrophobicContact CG-CD2 4.24Å; A481-L484 WeakPolarHBondContact O-CB 3.39Å; A481-L484 PolarHBondContact O-N 2.84Å; L484-S487 PolarHBondContact O-N 3.4Å; L484-L488 HydrophobicContact CD1-CD1 3.81Å; L484-L488 HydrophobicContact CD1-CG 4.43Å; L484-L488 HydrophobicContact CG-CD1 4.36Å; L484-L488 PolarHBondContact O-N 2.81Å; L484-L528 HydrophobicContact CD2-CD2 4.42Å
485	V	97.8	Very high	91.9	Very high	1 Å²	1	51.6 Å²	51.6	1%	0.006	25%	0.249	C	C	.	.	H	α-helix	trans	-59.8	-48.3	176.4	171.7	0	0	0	0	110.9	A481 S487 L488 W489 L528 C531 T532	A481-V485 HydrophobicContact CB-CG2 4.39Å; A481-V485 PolarHBondContact O-N 2.85Å; V485-S487 VanDerWaalsContact C-N 3.33Å; V485-S487 PolarHBondContact O-N 3.45Å; V485-L488 CarbonylContact O-C 3.6Å; V485-L488 PolarHBondContact O-N 3.4Å; V485-W489 HydrophobicContact CG1-CE3 3.84Å; V485-W489 HydrophobicContact CG1-CZ3 4.05Å; V485-W489 PolarHBondContact O-N 3.07Å; V485-L528 HydrophobicContact CG2-CD2 3.86Å; V485-C531 HydrophobicContact CB-CB 4.31Å; V485-C531 HydrophobicContact CG2-CB 3.83Å; V485-T532 HydrophobicContact CG1-CG2 3.78Å; V485-T532 HydrophobicContact CG2-CG2 4.03Å
486	D	97.8	Very high	92.3	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-62.9	-37.1	179.2	174.5	63.6	0	0	0	113.4	R425 A482 L488 W489 Q535 P542 R545	R425-D486 WeakPolarHBondContact CD-OD2 3.32Å; R425-D486 WeakPolarHBondContact CG-OD2 3.43Å; R425-D486 IonicContact CZ-OD1 2.86Å; R425-D486 VanDerWaalsContact CZ-OD1 3.25Å; R425-D486 IonicContact CZ-OD2 3.67Å; R425-D486 VanDerWaalsContact NE-CG 3.28Å; R425-D486 IonicContact NE-OD1 3.28Å; R425-D486 PolarHBondContact NE-OD1 3.49Å; R425-D486 IonicContact NE-OD2 3.65Å; R425-D486 PolarHBondContact NE-OD2 3.38Å; R425-D486 PolarHBondContact NH2-O 2.95Å; R425-D486 IonicContact NH2-OD1 3.84Å; R425-D486 PolarHBondContact NH2-OD1 2.95Å; R425-D486 IonicContact NH2-OD2 3.37Å; A482-D486 PolarHBondContact O-N 3.22Å; A482-D486 VanDerWaalsContact O-N 3.12Å; D486-L488 VanDerWaalsContact C-N 3.27Å; D486-L488 PolarHBondContact O-N 3.01Å; D486-W489 VanDerWaalsContact O-CB 3.23Å; D486-W489 WeakPolarHBondContact O-CB 3.4Å; D486-W489 PolarHBondContact O-N 3.15Å; D486-Q535 VanDerWaalsContact CA-OE1 3.3Å; D486-Q535 PolarHBondContact OD1-NE2 2.98Å; D486-P542 HydrophobicContact CB-CG 4.1Å; D486-R545 WeakPolarHBondContact OD2-CD 3.32Å; D486-R545 IonicContact OD2-CZ 2.87Å; D486-R545 IonicContact OD2-NE 2.72Å; D486-R545 IonicContact OD2-NH1 3.72Å; D486-R545 PolarHBondContact OD2-NH1 3.01Å
487	S	97.8	Very high	92.8	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-63.4	-34.3	176.4	-66.5	0	0	0	0	112.7	V420 A428 Y483 L484 V485 R545	V420-S487 PolarHBondContact O-OG 3.45Å; A428-S487 VanDerWaalsContact CB-OG 3.28Å; A428-S487 WeakPolarHBondContact CB-OG 3.41Å; A428-S487 WeakPolarHBondContact O-CB 3.2Å; A428-S487 PolarHBondContact O-OG 3.23Å; Y483-S487 WeakPolarHBondContact O-CB 3.3Å; Y483-S487 PolarHBondContact O-N 3.07Å; Y483-S487 PolarHBondContact O-OG 3.01Å; L484-S487 PolarHBondContact O-N 3.4Å; V485-S487 VanDerWaalsContact C-N 3.33Å; V485-S487 PolarHBondContact O-N 3.45Å; S487-R545 PolarHBondContact OG-NH1 2.91Å; S487-R545 PolarHBondContact OG-NH2 3.41Å
488	L	97	Very high	93.4	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-91.8	-3.4	177.8	-67.1	170.7	0	0	0	112.9	G432 L435 H436 F440 L468 L484 V485 D486 E490 S491 S492 L496	G432-L488 WeakPolarHBondContact O-CD2 3.4Å; L435-L488 HydrophobicContact CD2-CD1 4.37Å; L435-L488 HydrophobicContact CD2-CD2 4.32Å; H436-L488 HydrophobicContact CB-CD2 4.46Å; F440-L488 HydrophobicContact CE2-CD1 4.35Å; F440-L488 HydrophobicContact CE2-CD2 4.39Å; L468-L488 HydrophobicContact CD1-CD1 3.57Å; L484-L488 HydrophobicContact CD1-CD1 3.81Å; L484-L488 HydrophobicContact CD1-CG 4.43Å; L484-L488 HydrophobicContact CG-CD1 4.36Å; L484-L488 PolarHBondContact O-N 2.81Å; V485-L488 CarbonylContact O-C 3.6Å; V485-L488 PolarHBondContact O-N 3.4Å; D486-L488 VanDerWaalsContact C-N 3.27Å; D486-L488 PolarHBondContact O-N 3.01Å; L488-E490 PolarHBondContact O-N 2.81Å; L488-E490 VanDerWaalsContact O-N 3.14Å; L488-S491 PolarHBondContact O-N 3.48Å; L488-S491 PolarHBondContact O-OG 3.22Å; L488-S492 WeakPolarHBondContact O-CB 3.38Å; L488-S492 PolarHBondContact O-N 2.93Å; L488-L496 HydrophobicContact CB-CD1 3.86Å; L488-L496 WeakPolarHBondContact O-CD1 3.23Å
489	W	95.9	Very high	93.9	Very high	28 Å²	28	40 Å²	40	11%	0.106	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-17	-171.5	-163.9	-109.5	0	0	0	115	V485 D486 Q493 L496 T532 Q535 A536	V485-W489 HydrophobicContact CG1-CE3 3.84Å; V485-W489 HydrophobicContact CG1-CZ3 4.05Å; V485-W489 PolarHBondContact O-N 3.07Å; D486-W489 VanDerWaalsContact O-CB 3.23Å; D486-W489 WeakPolarHBondContact O-CB 3.4Å; D486-W489 PolarHBondContact O-N 3.15Å; W489-Q493 WeakPolarHBondContact O-CG 3.38Å; W489-Q493 PolarHBondContact O-NE2 2.74Å; W489-L496 HydrophobicContact CE3-CD1 3.95Å; W489-L496 HydrophobicContact CZ3-CB 4.4Å; W489-T532 WeakPolarHBondContact CH2-O 3.41Å; W489-Q535 HydrophobicContact CD2-CB 4.42Å; W489-Q535 HydrophobicContact CD2-CG 3.85Å; W489-Q535 HydrophobicContact CE3-CB 4.28Å; W489-Q535 HydrophobicContact CE3-CG 4.18Å; W489-Q535 HydrophobicContact CG-CG 4.33Å; W489-Q535 HydrophobicContact CH2-CB 3.91Å; W489-Q535 HydrophobicContact CH2-CG 4.22Å; W489-Q535 HydrophobicContact CZ2-CB 4.04Å; W489-Q535 HydrophobicContact CZ2-CG 3.88Å; W489-Q535 WeakPolarHBondContact CZ2-O 3.21Å; W489-Q535 HydrophobicContact CZ3-CB 4.04Å; W489-Q535 HydrophobicContact CZ3-CG 4.37Å; W489-A536 HydrophobicContact CH2-CB 3.95Å; W489-A536 HydrophobicContact CZ2-CB 4.29Å
490	E	91.5	Very high	94.4	Very high	120 Å²	120	35.2 Å²	35.2	56%	0.561	17%	0.168	S	C	*	.	T	Hydrogen-bonded Turn	trans	-103.7	-28.1	176.3	-72.5	174.5	-135.8	0	0	112.8	R425 V429 L488	R425-E490 IonicContact CZ-OE1 2.79Å; R425-E490 IonicContact NH1-OE1 2.78Å; R425-E490 PolarHBondContact NH1-OE1 3.07Å; R425-E490 IonicContact NH2-OE1 2.74Å; R425-E490 PolarHBondContact NH2-OE1 3.09Å; R425-E490 VanDerWaalsContact NH2-OE1 3.17Å; V429-E490 HydrophobicContact CG1-CB 4.34Å; L488-E490 PolarHBondContact O-N 2.81Å; L488-E490 VanDerWaalsContact O-N 3.14Å
491	S	92.1	Very high	94.5	Very high	38 Å²	38	31.8 Å²	31.8	27%	0.266	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.6	-28	-179.5	57.9	0	0	0	0	114.3	H436 L488	H436-S491 PolarHBondContact CE1-O 3.14Å; H436-S491 PolarHBondContact ND1-O 3.49Å; L488-S491 PolarHBondContact O-N 3.48Å; L488-S491 PolarHBondContact O-OG 3.22Å
492	S	92.5	Very high	94.5	Very high	5 Å²	5	32 Å²	32	4%	0.035	15%	0.154	C	C	.	.			trans	-128.7	25.8	-161	-50.1	0	0	0	0	113.7	H436 L488 E494 L495 L496	H436-S492 PolarHBondContact ND1-OG 2.78Å; L488-S492 WeakPolarHBondContact O-CB 3.38Å; L488-S492 PolarHBondContact O-N 2.93Å; S492-E494 VanDerWaalsContact C-N 3.27Å; S492-E494 PolarHBondContact O-N 3.05Å; S492-L495 WeakPolarHBondContact O-CB 3.5Å; S492-L495 PolarHBondContact O-N 3.19Å; S492-L496 WeakPolarHBondContact O-CG 3.3Å; S492-L496 PolarHBondContact O-N 3.42Å
493	Q	89.8	Confident	94.4	Very high	78 Å²	78	31.9 Å²	31.9	36%	0.364	15%	0.152	S	C	.	.	H	α-helix	trans	-57	-35.6	-173.5	-67.8	-165.4	-0.3	0	0	114.4	W489 L495 L496 K497	W489-Q493 WeakPolarHBondContact O-CG 3.38Å; W489-Q493 PolarHBondContact O-NE2 2.74Å; Q493-L495 VanDerWaalsContact C-N 3.27Å; Q493-L495 PolarHBondContact O-N 2.81Å; Q493-L496 PolarHBondContact O-N 3.4Å; Q493-K497 WeakPolarHBondContact O-CB 3.43Å; Q493-K497 WeakPolarHBondContact O-CG 3.43Å; Q493-K497 PolarHBondContact O-N 3.3Å; Q493-K497 VanDerWaalsContact O-N 3.13Å
494	E	88.1	Confident	94.3	Very high	175 Å²	175	32.6 Å²	32.6	82%	0.818	16%	0.156	S	C	*	.	H	α-helix	trans	-69.4	-25.8	179.8	-60.7	-177.1	171.6	0	0	112.5	N461 S492	N461-E494 PolarHBondContact ND2-O 2.97Å; S492-E494 VanDerWaalsContact C-N 3.27Å; S492-E494 PolarHBondContact O-N 3.05Å
495	L	91.3	Very high	94	Very high	10 Å²	10	32.8 Å²	32.8	5%	0.052	16%	0.157	C	C	.	.	H	α-helix	trans	-83.7	-45.9	173.7	179.5	63.5	0	0	0	111.4	F440 N461 L464 I465 S492 Q493 K497 D498	F440-L495 HydrophobicContact CD2-CD2 4.1Å; F440-L495 HydrophobicContact CE1-CD2 4.44Å; F440-L495 HydrophobicContact CE2-CD2 4.06Å; F440-L495 HydrophobicContact CG-CD2 4.36Å; F440-L495 HydrophobicContact CZ-CD2 4.24Å; N461-L495 HydrophobicContact CB-CD1 3.95Å; L464-L495 HydrophobicContact CB-CD1 3.55Å; L464-L495 HydrophobicContact CB-CD2 4Å; L464-L495 HydrophobicContact CB-CG 4.45Å; L464-L495 HydrophobicContact CD1-CD1 4.33Å; I465-L495 HydrophobicContact CD1-CD1 4.43Å; I465-L495 HydrophobicContact CG1-CD1 3.58Å; I465-L495 HydrophobicContact CG1-CG 4.44Å; S492-L495 WeakPolarHBondContact O-CB 3.5Å; S492-L495 PolarHBondContact O-N 3.19Å; Q493-L495 VanDerWaalsContact C-N 3.27Å; Q493-L495 PolarHBondContact O-N 2.81Å; L495-K497 VanDerWaalsContact C-N 3.29Å; L495-K497 PolarHBondContact O-N 3.2Å; L495-D498 PolarHBondContact O-N 2.87Å
496	L	95.3	Very high	93.9	Very high	1 Å²	1	32.8 Å²	32.8	1%	0.005	16%	0.157	C	C	.	.	H	α-helix	trans	-70.7	-21.8	-174.1	-67.8	174.5	0	0	0	113.6	L468 L488 W489 S492 Q493 M502 T532	L468-L496 HydrophobicContact CD2-CD2 3.88Å; L488-L496 HydrophobicContact CB-CD1 3.86Å; L488-L496 WeakPolarHBondContact O-CD1 3.23Å; W489-L496 HydrophobicContact CE3-CD1 3.95Å; W489-L496 HydrophobicContact CZ3-CB 4.4Å; S492-L496 WeakPolarHBondContact O-CG 3.3Å; S492-L496 PolarHBondContact O-N 3.42Å; Q493-L496 PolarHBondContact O-N 3.4Å; L496-M502 WeakPolarHBondContact O-CE 3.31Å; L496-T532 HydrophobicContact CB-CG2 3.94Å; L496-T532 HydrophobicContact CD2-CG2 3.92Å; L496-T532 HydrophobicContact CG-CG2 4.47Å; L496-T532 WeakPolarHBondContact O-CB 3.46Å; L496-T532 VanDerWaalsContact O-CG2 3.26Å; L496-T532 WeakPolarHBondContact O-CG2 3.43Å; L496-T532 PolarHBondContact O-OG1 2.99Å
497	K	95.3	Very high	93.6	Very high	42 Å²	42	35.1 Å²	35.1	18%	0.183	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.6	8.9	179.8	-62.4	-179.7	177.4	-179.1	0	113.8	Q493 L495 W499 D563	Q493-K497 WeakPolarHBondContact O-CB 3.43Å; Q493-K497 WeakPolarHBondContact O-CG 3.43Å; Q493-K497 PolarHBondContact O-N 3.3Å; Q493-K497 VanDerWaalsContact O-N 3.13Å; L495-K497 VanDerWaalsContact C-N 3.29Å; L495-K497 PolarHBondContact O-N 3.2Å; K497-W499 HydrophobicContact CB-CZ2 4.43Å; K497-W499 HydrophobicContact CG-CH2 4.45Å; K497-W499 HydrophobicContact CG-CZ2 4.26Å; K497-W499 PolarHBondContact O-N 2.79Å; K497-D563 IonicContact NZ-OD2 3.51Å; K497-D563 PolarHBondContact NZ-OD2 3.15Å
498	D	94.2	Very high	93.1	Very high	27 Å²	27	40 Å²	40	14%	0.144	19%	0.192	C	C	.	.			trans	-81.3	62.7	175.2	-164.2	-12.6	0	0	0	111.4	N461 L495 E500 C501 M502	N461-D498 WeakPolarHBondContact CB-OD2 3.22Å; N461-D498 PolarHBondContact ND2-OD2 2.72Å; L495-D498 PolarHBondContact O-N 2.87Å; D498-E500 PolarHBondContact O-N 3.33Å; D498-C501 HydrophobicContact CB-CB 4.18Å; D498-C501 PolarHBondContact O-N 3.5Å; D498-C501 WeakPolarHBondContact OD1-CB 3.11Å; D498-C501 PolarHBondContact OD1-N 2.91Å; D498-C501 WeakPolarHBondContact OD2-CB 3.18Å; D498-M502 WeakPolarHBondContact O-CG 3.37Å; D498-M502 PolarHBondContact O-N 3.01Å
499	W	95.9	Very high	92.3	Very high	13 Å²	13	48.5 Å²	48.5	5%	0.049	23%	0.232	C	C	.	.	H	α-helix	trans	-64.6	-25.4	-179.5	-57.9	-53.5	0	0	0	112.9	K497 T503 T532 I533 A536 D563 K566 L567 F571	K497-W499 HydrophobicContact CB-CZ2 4.43Å; K497-W499 HydrophobicContact CG-CH2 4.45Å; K497-W499 HydrophobicContact CG-CZ2 4.26Å; K497-W499 PolarHBondContact O-N 2.79Å; W499-T503 WeakPolarHBondContact O-CG2 3.35Å; W499-T503 PolarHBondContact O-N 3.29Å; W499-T503 PolarHBondContact O-OG1 3.41Å; W499-T532 PolarHBondContact NE1-OG1 3.31Å; W499-I533 HydrophobicContact CZ2-CG1 4.47Å; W499-A536 HydrophobicContact CH2-CB 3.83Å; W499-A536 HydrophobicContact CZ2-CB 3.76Å; W499-D563 HydrophobicContact CH2-CB 4.42Å; W499-K566 HydrophobicContact CZ3-CB 4.39Å; W499-L567 HydrophobicContact CD2-CB 4.43Å; W499-L567 HydrophobicContact CE3-CB 3.89Å; W499-L567 HydrophobicContact CH2-CB 3.9Å; W499-L567 HydrophobicContact CH2-CD2 4.1Å; W499-L567 HydrophobicContact CZ2-CB 4.43Å; W499-L567 HydrophobicContact CZ2-CD2 4.5Å; W499-L567 HydrophobicContact CZ3-CB 3.61Å; W499-F571 HydrophobicContact CB-CE2 3.8Å; W499-F571 HydrophobicContact CB-CZ 3.89Å; W499-F571 HydrophobicContact CD2-CE2 4.33Å; W499-F571 AromaticContact CG-CE2 3.83Å; W499-F571 HydrophobicContact CG-CE2 3.83Å; W499-F571 HydrophobicContact CG-CZ 4.18Å
500	E	93.8	Very high	91.4	Very high	93 Å²	93	50 Å²	50	44%	0.435	25%	0.245	S	C	.	.	H	α-helix	trans	-63.6	-49.1	171.9	-170.7	173.5	-138.1	0	0	110	D498 T503 E504	D498-E500 PolarHBondContact O-N 3.33Å; E500-T503 PolarHBondContact O-OG1 2.91Å; E500-E504 WeakPolarHBondContact O-CG 3.34Å; E500-E504 PolarHBondContact O-N 3.27Å; E500-E504 VanDerWaalsContact O-N 3.08Å
501	C	92.3	Very high	90.5	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-64.7	-42	174.2	-169.5	0	0	0	0	113.3	G456 G462 I465 D498 T503 E504 L505	G456-C501 VanDerWaalsContact C-SG 3.6Å; G456-C501 PolarHBondContact O-SG 3Å; G462-C501 WeakPolarHBondContact CA-SG 2.84Å; I465-C501 HydrophobicContact CD1-CB 3.89Å; D498-C501 HydrophobicContact CB-CB 4.18Å; D498-C501 PolarHBondContact O-N 3.5Å; D498-C501 WeakPolarHBondContact OD1-CB 3.11Å; D498-C501 PolarHBondContact OD1-N 2.91Å; D498-C501 WeakPolarHBondContact OD2-CB 3.18Å; C501-T503 PolarHBondContact O-N 2.67Å; C501-E504 PolarHBondContact O-N 3.3Å; C501-L505 WeakPolarHBondContact O-CB 3.44Å; C501-L505 WeakPolarHBondContact O-CG 3.27Å; C501-L505 PolarHBondContact O-N 3.12Å
502	M	95.6	Very high	89.3	Confident	5 Å²	5	55.3 Å²	55.3	3%	0.025	27%	0.27	C	S	.	.	H	α-helix	trans	-60.6	-43	178.6	-66.5	176.8	-174.5	0	0	112.2	I465 L496 D498 L506 L525 M529	I465-M502 HydrophobicContact CD1-CE 4.41Å; I465-M502 HydrophobicContact CD1-CG 3.83Å; I465-M502 HydrophobicContact CG2-CG 4.48Å; L496-M502 WeakPolarHBondContact O-CE 3.31Å; D498-M502 WeakPolarHBondContact O-CG 3.37Å; D498-M502 PolarHBondContact O-N 3.01Å; M502-L506 WeakPolarHBondContact O-CG 3.31Å; M502-L506 PolarHBondContact O-N 3.23Å; M502-L525 HydrophobicContact CB-CD1 4.31Å; M502-L525 HydrophobicContact CG-CD1 4.12Å; M502-M529 HydrophobicContact CB-CG 4.31Å; M502-M529 HydrophobicContact CB-SD 3.87Å; M502-M529 HydrophobicContact SD-CB 3.84Å; M502-M529 HydrophobicContact SD-CG 3.88Å
503	T	95.4	Very high	88.1	Confident	4 Å²	4	59.4 Å²	59.4	3%	0.025	31%	0.313	C	S	.	.	H	α-helix	trans	-77.1	-34.1	-179.5	55.2	0	0	0	0	113.3	W499 E500 C501 L505 L506 L507 M529 H570 F571 L578	W499-T503 WeakPolarHBondContact O-CG2 3.35Å; W499-T503 PolarHBondContact O-N 3.29Å; W499-T503 PolarHBondContact O-OG1 3.41Å; E500-T503 PolarHBondContact O-OG1 2.91Å; C501-T503 PolarHBondContact O-N 2.67Å; T503-L505 VanDerWaalsContact C-N 3.33Å; T503-L506 CarbonylContact O-C 3.53Å; T503-L506 PolarHBondContact O-N 2.95Å; T503-L507 VanDerWaalsContact O-CB 3.28Å; T503-L507 WeakPolarHBondContact O-CB 3.22Å; T503-L507 WeakPolarHBondContact O-CG 3.29Å; T503-L507 PolarHBondContact O-N 3.09Å; T503-M529 HydrophobicContact CG2-SD 3.76Å; T503-H570 WeakPolarHBondContact CG2-NE2 2.98Å; T503-H570 PolarHBondContact OG1-CE1 2.85Å; T503-H570 PolarHBondContact OG1-NE2 3.16Å; T503-F571 HydrophobicContact CG2-CD1 4.38Å; T503-F571 HydrophobicContact CG2-CE1 3.46Å; T503-F571 VanDerWaalsContact CG2-CE1 3.46Å; T503-F571 HydrophobicContact CG2-CZ 3.94Å; T503-L578 HydrophobicContact CG2-CD1 3.92Å
504	E	93.1	Very high	87.2	Confident	45 Å²	45	58.1 Å²	58.1	21%	0.21	31%	0.307	C	S	.	.	H	α-helix	trans	-66.4	-33.5	171	-73.4	-178.5	-152.8	0	0	112.6	G456 R457 E500 C501 L506 L507 E508	G456-E504 WeakPolarHBondContact CA-OE1 3.46Å; G456-E504 WeakPolarHBondContact CA-OE2 3.31Å; R457-E504 HydrophobicContact CB-CB 3.78Å; R457-E504 PolarHBondContact N-OE2 2.83Å; R457-E504 PolarHBondContact NH1-O 3.11Å; E500-E504 WeakPolarHBondContact O-CG 3.34Å; E500-E504 PolarHBondContact O-N 3.27Å; E500-E504 VanDerWaalsContact O-N 3.08Å; C501-E504 PolarHBondContact O-N 3.3Å; E504-L506 VanDerWaalsContact C-N 3.26Å; E504-L506 PolarHBondContact O-N 2.91Å; E504-L507 PolarHBondContact O-N 3.15Å; E504-E508 HydrophobicContact CB-CG 4.24Å; E504-E508 HydrophobicContact CG-CG 4.41Å; E504-E508 WeakPolarHBondContact O-CB 3.26Å; E504-E508 PolarHBondContact O-N 3.4Å
505	L	91.8	Very high	86.7	Confident	3 Å²	3	56.7 Å²	56.7	2%	0.016	30%	0.301	C	S	.	.	H	α-helix	trans	-61.4	-35	171.6	-81.1	166.4	0	0	0	112.3	R457 I465 R466 C501 T503 L525	R457-L505 HydrophobicContact CG-CD2 4.02Å; R457-L505 HydrophobicContact CG-CG 4.4Å; R457-L505 PolarHBondContact NH1-O 3.48Å; R457-L505 VanDerWaalsContact NH1-O 3.09Å; I465-L505 HydrophobicContact CB-CD1 4.05Å; I465-L505 HydrophobicContact CD1-CD1 4.31Å; I465-L505 HydrophobicContact CG2-CD1 3.79Å; R466-L505 HydrophobicContact CG-CD2 4.38Å; C501-L505 WeakPolarHBondContact O-CB 3.44Å; C501-L505 WeakPolarHBondContact O-CG 3.27Å; C501-L505 PolarHBondContact O-N 3.12Å; T503-L505 VanDerWaalsContact C-N 3.33Å; L505-L525 HydrophobicContact CB-CD2 3.78Å; L505-L525 HydrophobicContact CD1-CD2 4.33Å
506	L	94.6	Very high	86.3	Confident	1 Å²	1	59.4 Å²	59.4	1%	0.005	32%	0.324	C	S	.	.	H	α-helix	trans	-85.2	-25.9	178.1	-67.5	168.8	0	0	0	114	M502 T503 E504 E522 L525 I526 M529 L578 K581 Y582	M502-L506 WeakPolarHBondContact O-CG 3.31Å; M502-L506 PolarHBondContact O-N 3.23Å; T503-L506 CarbonylContact O-C 3.53Å; T503-L506 PolarHBondContact O-N 2.95Å; E504-L506 VanDerWaalsContact C-N 3.26Å; E504-L506 PolarHBondContact O-N 2.91Å; L506-E522 HydrophobicContact CD2-CB 4.1Å; L506-E522 HydrophobicContact CD2-CG 4.34Å; L506-L525 HydrophobicContact CD1-CD2 4.41Å; L506-L525 HydrophobicContact CD1-CG 4.26Å; L506-L525 HydrophobicContact CD2-CB 4.24Å; L506-L525 HydrophobicContact CD2-CD2 3.89Å; L506-L525 HydrophobicContact CD2-CG 4.15Å; L506-L525 HydrophobicContact CG-CD2 3.79Å; L506-L525 HydrophobicContact CG-CG 4.14Å; L506-I526 HydrophobicContact CD1-CG1 3.71Å; L506-I526 HydrophobicContact CD2-CD1 4.36Å; L506-I526 HydrophobicContact CD2-CG1 4.04Å; L506-M529 HydrophobicContact CD1-CE 3.89Å; L506-M529 HydrophobicContact CD1-SD 4.3Å; L506-L578 HydrophobicContact CB-CD2 3.77Å; L506-L578 HydrophobicContact CD1-CD2 4.03Å; L506-K581 WeakPolarHBondContact O-CD 3.31Å; L506-K581 PolarHBondContact O-NZ 3Å; L506-Y582 HydrophobicContact CB-CE2 4.29Å; L506-Y582 HydrophobicContact CD2-CE2 4.38Å; L506-Y582 VanDerWaalsContact CD2-OH 3.29Å; L506-Y582 WeakPolarHBondContact CD2-OH 3.38Å; L506-Y582 PolarHBondContact O-OH 2.82Å; L506-Y582 VanDerWaalsContact O-OH 3.04Å
507	L	92.7	Very high	85.9	Confident	50 Å²	50	60.4 Å²	60.4	26%	0.262	33%	0.329	S	S	.	.	H	α-helix	trans	-106.7	-33	-172.3	-69.3	173.2	0	0	0	114.9	T503 E504 T574 M577 L578	T503-L507 VanDerWaalsContact O-CB 3.28Å; T503-L507 WeakPolarHBondContact O-CB 3.22Å; T503-L507 WeakPolarHBondContact O-CG 3.29Å; T503-L507 PolarHBondContact O-N 3.09Å; E504-L507 PolarHBondContact O-N 3.15Å; L507-T574 HydrophobicContact CD1-CG2 4.47Å; L507-M577 HydrophobicContact CD1-CB 4.24Å; L507-M577 HydrophobicContact CD1-CE 4.34Å; L507-M577 HydrophobicContact CD2-CB 4Å; L507-L578 HydrophobicContact CD1-CD2 4.21Å; L507-L578 HydrophobicContact CD1-CG 4.26Å; L507-L578 HydrophobicContact CD2-CD2 3.79Å; L507-L578 HydrophobicContact CD2-CG 4.16Å; L507-L578 HydrophobicContact CG-CD2 3.77Å; L507-L578 HydrophobicContact CG-CG 4.3Å
508	E	87.3	Confident	85.9	Confident	103 Å²	103	61.2 Å²	61.2	48%	0.481	34%	0.34	S	S	.	.	S	Bend	trans	-87.9	151.6	-176.4	-58.8	-153.7	141	0	0	113.1	R457 E504	R457-E508 PolarHBondContact NH1-O 3.17Å; E504-E508 HydrophobicContact CB-CG 4.24Å; E504-E508 HydrophobicContact CG-CG 4.41Å; E504-E508 WeakPolarHBondContact O-CB 3.26Å; E504-E508 PolarHBondContact O-N 3.4Å
509	E	80.2	Confident	85.9	Confident	177 Å²	177	64.2 Å²	64.2	83%	0.827	36%	0.356	S	S	*	.	P	Polyproline II helix	trans	-68	145.6	169.4	-69.5	-171.8	171.6	0	0	110.9
510	P	76.6	Confident	85.8	Confident	59 Å²	59	70.6 Å²	70.6	38%	0.383	38%	0.38	S	S	.	.	P	Polyproline II helix	trans	-62.7	139.8	179.6	26.3	-34.6	0	0	0	112.3	E514 A516	P510-E514 WeakPolarHBondContact CA-OE2 3.28Å; P510-E514 HydrophobicContact CB-CB 4.22Å; P510-A516 HydrophobicContact CG-CB 4.23Å
511	V	72.4	Confident	85.9	Confident	68 Å²	68	67.9 Å²	67.9	41%	0.412	37%	0.368	S	S	.	.	P	Polyproline II helix	trans	-67.8	151.8	178.7	-173.8	0	0	0	0	109.7	G513 E514	V511-G513 PolarHBondContact O-N 3.08Å; V511-E514 HydrophobicContact CB-CB 4.47Å; V511-E514 PolarHBondContact N-OE2 3.13Å; V511-E514 VanDerWaalsContact O-CB 3.25Å; V511-E514 WeakPolarHBondContact O-CB 3.46Å; V511-E514 PolarHBondContact O-N 3.49Å
512	Q	66.4	Low	86.1	Confident	203 Å²	203	69.1 Å²	69.1	95%	0.949	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	109.3	-179.2	-69.8	-173.2	-7.6	0	0	112.3
513	G	67.6	Low	86.1	Confident	90 Å²	90	69.2 Å²	69.2	93%	0.928	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	103.9	-4.3	-176.7	0	0	0	0	0	115	V511	V511-G513 PolarHBondContact O-N 3.08Å
514	E	72.3	Confident	86.2	Confident	52 Å²	52	69.1 Å²	69.1	24%	0.243	38%	0.375	C	S	.	.	P	Polyproline II helix	trans	-89.3	140.5	171.1	-163.1	-164.1	173.1	0	0	110.3	R457 R466 P510 V511	R457-E514 IonicContact CZ-OE1 3.22Å; R457-E514 IonicContact CZ-OE2 3.71Å; R457-E514 IonicContact NE-OE1 3.51Å; R457-E514 PolarHBondContact NE-OE1 2.8Å; R457-E514 IonicContact NE-OE2 3.68Å; R457-E514 PolarHBondContact NE-OE2 3.12Å; R457-E514 VanDerWaalsContact NH2-CD 3.26Å; R457-E514 IonicContact NH2-OE1 2.65Å; R457-E514 PolarHBondContact NH2-OE1 2.78Å; R457-E514 IonicContact NH2-OE2 2.68Å; R457-E514 PolarHBondContact NH2-OE2 3.42Å; R466-E514 IonicContact CZ-OE1 3.73Å; R466-E514 IonicContact NE-OE1 2.74Å; R466-E514 PolarHBondContact NE-OE1 3.24Å; R466-E514 IonicContact NH2-OE1 3.68Å; R466-E514 PolarHBondContact NH2-OE1 2.95Å; P510-E514 WeakPolarHBondContact CA-OE2 3.28Å; P510-E514 HydrophobicContact CB-CB 4.22Å; V511-E514 HydrophobicContact CB-CB 4.47Å; V511-E514 PolarHBondContact N-OE2 3.13Å; V511-E514 VanDerWaalsContact O-CB 3.25Å; V511-E514 WeakPolarHBondContact O-CB 3.46Å; V511-E514 PolarHBondContact O-N 3.49Å
515	E	76.4	Confident	86.4	Confident	145 Å²	145	67 Å²	67	68%	0.678	37%	0.365	S	S	*	.	P	Polyproline II helix	trans	-79.7	138.1	173.8	-65.1	-172	158.9	0	0	110.9	R466	R466-E515 PolarHBondContact NH1-O 3.36Å; R466-E515 PolarHBondContact NH2-O 3.45Å
516	A	83.1	Confident	86.7	Confident	67 Å²	67	67 Å²	67	55%	0.554	36%	0.364	S	S	*	.	P	Polyproline II helix	trans	-61.9	149.2	174.4	0	0	0	0	0	110.9	P510	P510-A516 HydrophobicContact CG-CB 4.23Å
517	M	88.1	Confident	86.9	Confident	21 Å²	21	67.7 Å²	67.7	10%	0.103	37%	0.368	C	S	.	.	P	Polyproline II helix	trans	-67.4	135.5	166.4	-66.5	-74.1	-84.9	0	0	108.6	R466 V469 Q521 E522 L525	R466-M517 HydrophobicContact CG-SD 4.08Å; R466-M517 PolarHBondContact NH1-SD 3.08Å; R466-M517 VanDerWaalsContact NH1-SD 3.39Å; V469-M517 HydrophobicContact CG1-CE 4.33Å; M517-Q521 HydrophobicContact CE-CB 3.72Å; M517-Q521 WeakPolarHBondContact CE-O 3.49Å; M517-Q521 HydrophobicContact SD-CB 4.15Å; M517-E522 HydrophobicContact CB-CG 3.77Å; M517-L525 HydrophobicContact CE-CB 4.17Å; M517-L525 HydrophobicContact CE-CD2 3.82Å
518	S	93.3	Very high	87.1	Confident	60 Å²	60	65.6 Å²	65.6	42%	0.42	36%	0.357	S	S	.	.	P	Polyproline II helix	trans	-79.3	156.9	167.4	62.2	0	0	0	0	110.6	R520 Q521 E522	S518-R520 VanDerWaalsContact C-N 3.31Å; S518-R520 PolarHBondContact O-N 3.15Å; S518-Q521 CarbonylContact O-C 3.6Å; S518-Q521 WeakPolarHBondContact O-CA 3.27Å; S518-Q521 VanDerWaalsContact O-CB 3.32Å; S518-Q521 WeakPolarHBondContact O-CB 3.42Å; S518-Q521 PolarHBondContact O-N 3.32Å; S518-Q521 VanDerWaalsContact OG-CD 3.24Å; S518-Q521 WeakPolarHBondContact OG-CG 3.34Å; S518-Q521 PolarHBondContact OG-OE1 2.8Å; S518-E522 PolarHBondContact O-N 3.14Å
519	D	94.6	Very high	87.6	Confident	90 Å²	90	60.7 Å²	60.7	48%	0.481	33%	0.334	S	S	.	.	H	α-helix	trans	-55.7	-41	-175.2	-176.8	84.8	0	0	0	113.7	Q521 E522 S523 K588	D519-Q521 VanDerWaalsContact C-N 3.28Å; D519-Q521 PolarHBondContact O-N 2.76Å; D519-E522 WeakPolarHBondContact O-CA 3.36Å; D519-E522 WeakPolarHBondContact O-CB 3.38Å; D519-E522 PolarHBondContact O-N 3.38Å; D519-S523 PolarHBondContact O-N 2.88Å; D519-K588 WeakPolarHBondContact O-CE 3.42Å; D519-K588 WeakPolarHBondContact OD1-CE 3.3Å; D519-K588 IonicContact OD1-NZ 2.8Å; D519-K588 PolarHBondContact OD1-NZ 3.42Å; D519-K588 VanDerWaalsContact OD1-NZ 3.14Å; D519-K588 IonicContact OD2-NZ 2.7Å; D519-K588 PolarHBondContact OD2-NZ 3.25Å
520	R	94.6	Very high	88.5	Confident	147 Å²	147	52.3 Å²	52.3	56%	0.555	30%	0.295	S	S	*	.	H	α-helix	trans	-62.5	-32.4	173.8	-169.9	178.2	-179.8	-157.7	-5.7	112.5	L473 S518 A524	L473-R520 HydrophobicContact CD1-CG 4.14Å; L473-R520 HydrophobicContact CD2-CG 3.78Å; S518-R520 VanDerWaalsContact C-N 3.31Å; S518-R520 PolarHBondContact O-N 3.15Å; R520-A524 WeakPolarHBondContact O-CB 3.47Å; R520-A524 PolarHBondContact O-N 3.4Å; R520-A524 VanDerWaalsContact O-N 3.12Å
521	Q	95.3	Very high	89.5	Confident	35 Å²	35	49.6 Å²	49.6	16%	0.164	28%	0.277	C	S	.	.	H	α-helix	trans	-76.1	-28.4	172.9	-66.8	167	-47.1	0	0	112.3	V469 L473 M517 S518 D519 L525	V469-Q521 HydrophobicContact CG1-CB 3.82Å; V469-Q521 HydrophobicContact CG1-CG 4Å; L473-Q521 HydrophobicContact CD1-CB 4.43Å; L473-Q521 HydrophobicContact CD1-CG 3.72Å; M517-Q521 HydrophobicContact CE-CB 3.72Å; M517-Q521 WeakPolarHBondContact CE-O 3.49Å; M517-Q521 HydrophobicContact SD-CB 4.15Å; S518-Q521 CarbonylContact O-C 3.6Å; S518-Q521 WeakPolarHBondContact O-CA 3.27Å; S518-Q521 VanDerWaalsContact O-CB 3.32Å; S518-Q521 WeakPolarHBondContact O-CB 3.42Å; S518-Q521 PolarHBondContact O-N 3.32Å; S518-Q521 VanDerWaalsContact OG-CD 3.24Å; S518-Q521 WeakPolarHBondContact OG-CG 3.34Å; S518-Q521 PolarHBondContact OG-OE1 2.8Å; D519-Q521 VanDerWaalsContact C-N 3.28Å; D519-Q521 PolarHBondContact O-N 2.76Å; Q521-L525 VanDerWaalsContact O-CB 3.27Å; Q521-L525 WeakPolarHBondContact O-CB 3.4Å; Q521-L525 PolarHBondContact O-N 2.96Å
522	E	96.5	Very high	90.7	Very high	26 Å²	26	46.4 Å²	46.4	12%	0.121	26%	0.258	C	S	.	.	H	α-helix	trans	-71.2	-43.5	172.6	-61.5	-167.3	112.4	0	0	111.4	L506 M517 S518 D519 L525 I526 K581 Y582	L506-E522 HydrophobicContact CD2-CB 4.1Å; L506-E522 HydrophobicContact CD2-CG 4.34Å; M517-E522 HydrophobicContact CB-CG 3.77Å; S518-E522 PolarHBondContact O-N 3.14Å; D519-E522 WeakPolarHBondContact O-CA 3.36Å; D519-E522 WeakPolarHBondContact O-CB 3.38Å; D519-E522 PolarHBondContact O-N 3.38Å; E522-L525 PolarHBondContact O-N 3.1Å; E522-I526 WeakPolarHBondContact O-CG1 3.5Å; E522-I526 PolarHBondContact O-N 2.74Å; E522-K581 IonicContact OE1-NZ 3.89Å; E522-K581 PolarHBondContact OE1-NZ 2.83Å; E522-K581 IonicContact OE2-NZ 2.73Å; E522-Y582 HydrophobicContact CB-CE1 4.15Å; E522-Y582 VanDerWaalsContact CD-OH 3.26Å; E522-Y582 PolarHBondContact OE1-OH 2.64Å
523	S	96.6	Very high	92.2	Very high	7 Å²	7	36.8 Å²	36.8	5%	0.049	21%	0.213	C	C	.	.	H	α-helix	trans	-54.8	-54.8	169.2	-81.6	0	0	0	0	111.3	D519 L525 I526 E527 E587 K588	D519-S523 PolarHBondContact O-N 2.88Å; S523-L525 VanDerWaalsContact C-N 3.31Å; S523-L525 PolarHBondContact O-N 3.38Å; S523-I526 PolarHBondContact O-N 2.9Å; S523-I526 VanDerWaalsContact O-N 3.07Å; S523-E527 PolarHBondContact O-N 3.29Å; S523-E587 VanDerWaalsContact CB-OE1 3.3Å; S523-E587 WeakPolarHBondContact CB-OE1 3.35Å; S523-E587 WeakPolarHBondContact CB-OE2 3.28Å; S523-E587 VanDerWaalsContact OG-CD 3.29Å; S523-E587 PolarHBondContact OG-OE1 3.11Å; S523-E587 PolarHBondContact OG-OE2 3.12Å; S523-K588 VanDerWaalsContact OG-CE 3.31Å; S523-K588 WeakPolarHBondContact OG-CE 3.47Å; S523-K588 WeakPolarHBondContact OG-CG 3.45Å; S523-K588 PolarHBondContact OG-NZ 3.2Å
524	A	97	Very high	93.6	Very high	3 Å²	3	36 Å²	36	3%	0.025	18%	0.182	C	C	.	.	H	α-helix	trans	-59.6	-37	-179.1	0	0	0	0	0	113.8	V469 F472 L473 R520 L528	V469-A524 HydrophobicContact CG1-CB 3.89Å; F472-A524 HydrophobicContact CD1-CB 3.84Å; F472-A524 HydrophobicContact CE1-CB 4.15Å; L473-A524 HydrophobicContact CD1-CB 4.12Å; L473-A524 HydrophobicContact CD2-CB 3.84Å; L473-A524 HydrophobicContact CG-CB 3.92Å; R520-A524 WeakPolarHBondContact O-CB 3.47Å; R520-A524 PolarHBondContact O-N 3.4Å; R520-A524 VanDerWaalsContact O-N 3.12Å; A524-L528 WeakPolarHBondContact O-CB 3.34Å; A524-L528 WeakPolarHBondContact O-CD1 3.45Å; A524-L528 WeakPolarHBondContact O-CG 3.5Å; A524-L528 PolarHBondContact O-N 2.62Å
525	L	97.7	Very high	94.7	Very high	1 Å²	1	34.1 Å²	34.1	1%	0.005	17%	0.173	C	C	.	.	H	α-helix	trans	-70.2	-36.9	175.3	179.9	54.5	0	0	0	112	I465 V469 M502 L505 L506 M517 Q521 E522 S523 M529	I465-L525 HydrophobicContact CG2-CD1 3.45Å; I465-L525 VanDerWaalsContact CG2-CD1 3.45Å; V469-L525 HydrophobicContact CG2-CB 3.88Å; V469-L525 HydrophobicContact CG2-CD1 4.03Å; V469-L525 HydrophobicContact CG2-CG 4.47Å; M502-L525 HydrophobicContact CB-CD1 4.31Å; M502-L525 HydrophobicContact CG-CD1 4.12Å; L505-L525 HydrophobicContact CB-CD2 3.78Å; L505-L525 HydrophobicContact CD1-CD2 4.33Å; L506-L525 HydrophobicContact CD1-CD2 4.41Å; L506-L525 HydrophobicContact CD1-CG 4.26Å; L506-L525 HydrophobicContact CD2-CB 4.24Å; L506-L525 HydrophobicContact CD2-CD2 3.89Å; L506-L525 HydrophobicContact CD2-CG 4.15Å; L506-L525 HydrophobicContact CG-CD2 3.79Å; L506-L525 HydrophobicContact CG-CG 4.14Å; M517-L525 HydrophobicContact CE-CB 4.17Å; M517-L525 HydrophobicContact CE-CD2 3.82Å; Q521-L525 VanDerWaalsContact O-CB 3.27Å; Q521-L525 WeakPolarHBondContact O-CB 3.4Å; Q521-L525 PolarHBondContact O-N 2.96Å; E522-L525 PolarHBondContact O-N 3.1Å; S523-L525 VanDerWaalsContact C-N 3.31Å; S523-L525 PolarHBondContact O-N 3.38Å; L525-M529 WeakPolarHBondContact O-CB 3.5Å; L525-M529 PolarHBondContact O-N 3.11Å
526	I	98.3	Very high	95.7	Very high	1 Å²	1	27.4 Å²	27.4	1%	0.005	14%	0.142	C	C	.	.	H	α-helix	trans	-64.9	-46.8	174.2	-72	167.3	0	0	0	110.6	L506 E522 S523 M529 V530 Y582 K588 N591 L592	L506-I526 HydrophobicContact CD1-CG1 3.71Å; L506-I526 HydrophobicContact CD2-CD1 4.36Å; L506-I526 HydrophobicContact CD2-CG1 4.04Å; E522-I526 WeakPolarHBondContact O-CG1 3.5Å; E522-I526 PolarHBondContact O-N 2.74Å; S523-I526 PolarHBondContact O-N 2.9Å; S523-I526 VanDerWaalsContact O-N 3.07Å; I526-M529 PolarHBondContact O-N 2.82Å; I526-V530 HydrophobicContact CG2-CG2 4.42Å; I526-V530 WeakPolarHBondContact O-CG2 3.22Å; I526-V530 PolarHBondContact O-N 3.37Å; I526-Y582 HydrophobicContact CD1-CD2 3.94Å; I526-Y582 HydrophobicContact CD1-CE2 3.96Å; I526-Y582 HydrophobicContact CD1-CG 4.28Å; I526-K588 HydrophobicContact CD1-CB 3.87Å; I526-K588 HydrophobicContact CD1-CD 4.27Å; I526-K588 HydrophobicContact CD1-CG 3.98Å; I526-N591 HydrophobicContact CG2-CB 3.89Å; I526-L592 HydrophobicContact CD1-CD1 4.19Å; I526-L592 HydrophobicContact CD1-CG 4.43Å; I526-L592 HydrophobicContact CG2-CD2 4.27Å; I526-L592 HydrophobicContact CG2-CG 3.98Å
527	E	97.7	Very high	96.2	Very high	17 Å²	17	24.8 Å²	24.8	8%	0.079	12%	0.121	C	C	.	.	H	α-helix	trans	-60.8	-47.2	176.5	168.2	49.6	-147.8	0	0	112.1	F472 A481 S523 M529 V530 C531 N591	F472-E527 HydrophobicContact CE1-CG 4.4Å; F472-E527 HydrophobicContact CZ-CG 4.44Å; A481-E527 HydrophobicContact CB-CG 3.8Å; A481-E527 PolarHBondContact N-OE1 3.35Å; S523-E527 PolarHBondContact O-N 3.29Å; E527-M529 VanDerWaalsContact C-N 3.35Å; E527-M529 PolarHBondContact O-N 2.74Å; E527-V530 PolarHBondContact O-N 3.29Å; E527-C531 WeakPolarHBondContact O-CB 3.49Å; E527-C531 PolarHBondContact O-N 3.43Å; E527-C531 PolarHBondContact OE1-SG 3.38Å; E527-N591 PolarHBondContact OE2-ND2 2.75Å
528	L	97.8	Very high	96.4	Very high	5 Å²	5	27 Å²	27	3%	0.026	13%	0.131	C	C	.	.	H	α-helix	trans	-56	-48.5	172.7	-84.2	161.3	0	0	0	111.5	L468 V469 A481 L484 V485 A524 C531 T532	L468-L528 HydrophobicContact CD2-CD2 4.1Å; L468-L528 HydrophobicContact CG-CD1 4.18Å; L468-L528 HydrophobicContact CG-CD2 4.15Å; V469-L528 HydrophobicContact CB-CD1 4.42Å; V469-L528 HydrophobicContact CG2-CD1 3.72Å; A481-L528 HydrophobicContact CB-CD2 3.72Å; A481-L528 HydrophobicContact CB-CG 3.85Å; L484-L528 HydrophobicContact CD2-CD2 4.42Å; V485-L528 HydrophobicContact CG2-CD2 3.86Å; A524-L528 WeakPolarHBondContact O-CB 3.34Å; A524-L528 WeakPolarHBondContact O-CD1 3.45Å; A524-L528 WeakPolarHBondContact O-CG 3.5Å; A524-L528 PolarHBondContact O-N 2.62Å; L528-C531 PolarHBondContact O-N 2.97Å; L528-T532 VanDerWaalsContact O-CG2 3.28Å; L528-T532 WeakPolarHBondContact O-CG2 3.44Å; L528-T532 PolarHBondContact O-N 3.07Å
529	M	98.2	Very high	96.4	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-63.8	-44.1	-178.7	-178.9	177.6	69.2	0	0	112.6	M502 T503 L506 L525 I526 E527 C531 T532 I533 F571 L578 L592 I595	M502-M529 HydrophobicContact CB-CG 4.31Å; M502-M529 HydrophobicContact CB-SD 3.87Å; M502-M529 HydrophobicContact SD-CB 3.84Å; M502-M529 HydrophobicContact SD-CG 3.88Å; T503-M529 HydrophobicContact CG2-SD 3.76Å; L506-M529 HydrophobicContact CD1-CE 3.89Å; L506-M529 HydrophobicContact CD1-SD 4.3Å; L525-M529 WeakPolarHBondContact O-CB 3.5Å; L525-M529 PolarHBondContact O-N 3.11Å; I526-M529 PolarHBondContact O-N 2.82Å; E527-M529 VanDerWaalsContact C-N 3.35Å; E527-M529 PolarHBondContact O-N 2.74Å; M529-C531 VanDerWaalsContact C-N 3.33Å; M529-C531 PolarHBondContact O-N 2.68Å; M529-T532 PolarHBondContact O-N 3.12Å; M529-T532 PolarHBondContact O-OG1 3.42Å; M529-I533 HydrophobicContact CG-CD1 3.99Å; M529-I533 WeakPolarHBondContact O-CD1 3.23Å; M529-I533 VanDerWaalsContact O-CG1 3.23Å; M529-I533 WeakPolarHBondContact O-CG1 3.48Å; M529-I533 PolarHBondContact O-N 3.12Å; M529-F571 HydrophobicContact CE-CE1 4.1Å; M529-F571 HydrophobicContact CE-CZ 4.42Å; M529-F571 HydrophobicContact CG-CZ 4.04Å; M529-F571 HydrophobicContact SD-CE1 3.82Å; M529-F571 HydrophobicContact SD-CZ 3.67Å; M529-L578 HydrophobicContact CE-CD1 4.29Å; M529-L592 HydrophobicContact CE-CD2 4.11Å; M529-I595 HydrophobicContact CE-CD1 4.23Å
530	V	98	Very high	96.1	Very high	1 Å²	1	26.3 Å²	26.3	1%	0.006	12%	0.123	C	C	.	.	H	α-helix	trans	-63.8	-40.5	176.1	172.5	0	0	0	0	110.6	I526 E527 T532 I533 R534 N591 Q594 I595	I526-V530 HydrophobicContact CG2-CG2 4.42Å; I526-V530 WeakPolarHBondContact O-CG2 3.22Å; I526-V530 PolarHBondContact O-N 3.37Å; E527-V530 PolarHBondContact O-N 3.29Å; V530-T532 PolarHBondContact O-N 3.1Å; V530-I533 PolarHBondContact O-N 2.92Å; V530-R534 WeakPolarHBondContact O-CB 3.49Å; V530-R534 PolarHBondContact O-N 3.31Å; V530-N591 HydrophobicContact CG2-CB 4.2Å; V530-N591 WeakPolarHBondContact CG2-O 3.43Å; V530-Q594 HydrophobicContact CG1-CB 4.33Å; V530-I595 HydrophobicContact CG2-CD1 4.04Å; V530-I595 HydrophobicContact CG2-CG1 3.97Å
531	C	98.1	Very high	96	Very high	3 Å²	3	20.8 Å²	20.8	2%	0.02	11%	0.107	C	C	.	.	H	α-helix	trans	-63.8	-38	174.1	-84.6	0	0	0	0	113.6	A482 V485 E527 L528 M529 R534 Q535	A482-C531 WeakPolarHBondContact CA-SG 3.25Å; A482-C531 PolarHBondContact N-SG 3.03Å; A482-C531 VanDerWaalsContact N-SG 3.42Å; V485-C531 HydrophobicContact CB-CB 4.31Å; V485-C531 HydrophobicContact CG2-CB 3.83Å; E527-C531 WeakPolarHBondContact O-CB 3.49Å; E527-C531 PolarHBondContact O-N 3.43Å; E527-C531 PolarHBondContact OE1-SG 3.38Å; L528-C531 PolarHBondContact O-N 2.97Å; M529-C531 VanDerWaalsContact C-N 3.33Å; M529-C531 PolarHBondContact O-N 2.68Å; C531-R534 PolarHBondContact SG-NH2 3.21Å; C531-Q535 PolarHBondContact O-N 3.15Å; C531-Q535 VanDerWaalsContact O-N 3.1Å
532	T	98	Very high	95.8	Very high	1 Å²	1	20.5 Å²	20.5	1%	0.006	11%	0.108	C	C	.	.	H	α-helix	trans	-73.2	-32.3	175.6	76.8	0	0	0	0	113.1	V485 W489 L496 W499 L528 M529 V530 A536	V485-T532 HydrophobicContact CG1-CG2 3.78Å; V485-T532 HydrophobicContact CG2-CG2 4.03Å; W489-T532 WeakPolarHBondContact CH2-O 3.41Å; L496-T532 HydrophobicContact CB-CG2 3.94Å; L496-T532 HydrophobicContact CD2-CG2 3.92Å; L496-T532 HydrophobicContact CG-CG2 4.47Å; L496-T532 WeakPolarHBondContact O-CB 3.46Å; L496-T532 VanDerWaalsContact O-CG2 3.26Å; L496-T532 WeakPolarHBondContact O-CG2 3.43Å; L496-T532 PolarHBondContact O-OG1 2.99Å; W499-T532 PolarHBondContact NE1-OG1 3.31Å; L528-T532 VanDerWaalsContact O-CG2 3.28Å; L528-T532 WeakPolarHBondContact O-CG2 3.44Å; L528-T532 PolarHBondContact O-N 3.07Å; M529-T532 PolarHBondContact O-N 3.12Å; M529-T532 PolarHBondContact O-OG1 3.42Å; V530-T532 PolarHBondContact O-N 3.1Å; T532-A536 VanDerWaalsContact O-CB 3.28Å; T532-A536 WeakPolarHBondContact O-CB 3.43Å; T532-A536 PolarHBondContact O-N 2.97Å
533	I	98.1	Very high	95.4	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-62	-53	171.7	-70.5	163.2	0	0	0	110.2	W499 M529 V530 Q535 A536 A537 L567 F571 I595 Y598	W499-I533 HydrophobicContact CZ2-CG1 4.47Å; M529-I533 HydrophobicContact CG-CD1 3.99Å; M529-I533 WeakPolarHBondContact O-CD1 3.23Å; M529-I533 VanDerWaalsContact O-CG1 3.23Å; M529-I533 WeakPolarHBondContact O-CG1 3.48Å; M529-I533 PolarHBondContact O-N 3.12Å; V530-I533 PolarHBondContact O-N 2.92Å; I533-Q535 PolarHBondContact O-N 3.47Å; I533-A536 PolarHBondContact O-N 3.07Å; I533-A537 WeakPolarHBondContact O-CB 3.24Å; I533-A537 PolarHBondContact O-N 3.3Å; I533-L567 HydrophobicContact CG2-CD1 4.13Å; I533-L567 HydrophobicContact CG2-CD2 4.21Å; I533-F571 HydrophobicContact CD1-CD2 4Å; I533-F571 HydrophobicContact CD1-CE1 4.25Å; I533-F571 HydrophobicContact CD1-CE2 3.39Å; I533-F571 HydrophobicContact CD1-CZ 3.55Å; I533-F571 HydrophobicContact CG1-CE2 3.85Å; I533-F571 HydrophobicContact CG1-CZ 4.36Å; I533-I595 HydrophobicContact CD1-CD1 3.76Å; I533-I595 HydrophobicContact CD1-CG1 3.83Å; I533-I595 HydrophobicContact CD1-CG2 4.21Å; I533-Y598 HydrophobicContact CG2-CD2 3.67Å; I533-Y598 HydrophobicContact CG2-CE2 4.44Å; I533-Y598 HydrophobicContact CG2-CG 4.03Å
534	R	96.6	Very high	94.9	Very high	74 Å²	74	25.8 Å²	25.8	28%	0.279	15%	0.149	S	C	.	.	H	α-helix	trans	-54.5	-54.7	178.5	176.5	169.6	51.7	-170.2	-9.4	111.3	V530 C531 A536 A537 E538 Y598	V530-R534 WeakPolarHBondContact O-CB 3.49Å; V530-R534 PolarHBondContact O-N 3.31Å; C531-R534 PolarHBondContact SG-NH2 3.21Å; R534-A536 VanDerWaalsContact C-N 3.27Å; R534-A536 PolarHBondContact O-N 3.37Å; R534-A537 PolarHBondContact O-N 2.94Å; R534-A537 VanDerWaalsContact O-N 3.15Å; R534-E538 HydrophobicContact CG-CG 4.24Å; R534-E538 WeakPolarHBondContact CG-OE1 3.39Å; R534-E538 WeakPolarHBondContact CG-OE2 3.46Å; R534-E538 WeakPolarHBondContact O-CB 3.48Å; R534-E538 WeakPolarHBondContact O-CG 3.2Å; R534-E538 PolarHBondContact O-N 2.82Å; R534-Y598 HydrophobicContact CB-CE1 3.98Å; R534-Y598 HydrophobicContact CB-CE2 4.34Å; R534-Y598 WeakPolarHBondContact CD-OH 3.44Å; R534-Y598 HydrophobicContact CG-CE1 3.87Å
535	Q	95.6	Very high	94.6	Very high	12 Å²	12	26 Å²	26	6%	0.056	15%	0.15	C	C	.	.	H	α-helix	trans	-67.3	-25.1	-177.3	-165.2	168.2	14.5	0	0	113.3	D486 W489 C531 I533 A539	D486-Q535 VanDerWaalsContact CA-OE1 3.3Å; D486-Q535 PolarHBondContact OD1-NE2 2.98Å; W489-Q535 HydrophobicContact CD2-CB 4.42Å; W489-Q535 HydrophobicContact CD2-CG 3.85Å; W489-Q535 HydrophobicContact CE3-CB 4.28Å; W489-Q535 HydrophobicContact CE3-CG 4.18Å; W489-Q535 HydrophobicContact CG-CG 4.33Å; W489-Q535 HydrophobicContact CH2-CB 3.91Å; W489-Q535 HydrophobicContact CH2-CG 4.22Å; W489-Q535 HydrophobicContact CZ2-CB 4.04Å; W489-Q535 HydrophobicContact CZ2-CG 3.88Å; W489-Q535 WeakPolarHBondContact CZ2-O 3.21Å; W489-Q535 HydrophobicContact CZ3-CB 4.04Å; W489-Q535 HydrophobicContact CZ3-CG 4.37Å; C531-Q535 PolarHBondContact O-N 3.15Å; C531-Q535 VanDerWaalsContact O-N 3.1Å; I533-Q535 PolarHBondContact O-N 3.47Å; Q535-A539 WeakPolarHBondContact O-CA 3.33Å; Q535-A539 PolarHBondContact O-N 3.03Å
536	A	96.1	Very high	93.9	Very high	4 Å²	4	27.9 Å²	27.9	3%	0.033	17%	0.169	C	C	.	.	H	α-helix	trans	-71.6	-43.8	170.8	0	0	0	0	0	112.8	W489 W499 T532 I533 R534	W489-A536 HydrophobicContact CH2-CB 3.95Å; W489-A536 HydrophobicContact CZ2-CB 4.29Å; W499-A536 HydrophobicContact CH2-CB 3.83Å; W499-A536 HydrophobicContact CZ2-CB 3.76Å; T532-A536 VanDerWaalsContact O-CB 3.28Å; T532-A536 WeakPolarHBondContact O-CB 3.43Å; T532-A536 PolarHBondContact O-N 2.97Å; I533-A536 PolarHBondContact O-N 3.07Å; R534-A536 VanDerWaalsContact C-N 3.27Å; R534-A536 PolarHBondContact O-N 3.37Å
537	A	95	Very high	92.7	Very high	12 Å²	12	33.6 Å²	33.6	10%	0.099	20%	0.204	C	C	.	.	H	α-helix	trans	-75.6	-44.1	-175.6	0	0	0	0	0	112.8	I533 R534 Q560 L567 Y598	I533-A537 WeakPolarHBondContact O-CB 3.24Å; I533-A537 PolarHBondContact O-N 3.3Å; R534-A537 PolarHBondContact O-N 2.94Å; R534-A537 VanDerWaalsContact O-N 3.15Å; A537-Q560 WeakPolarHBondContact O-CG 3.35Å; A537-Q560 PolarHBondContact O-NE2 3.48Å; A537-L567 HydrophobicContact CB-CD2 4.34Å; A537-Y598 HydrophobicContact CB-CD1 3.81Å; A537-Y598 HydrophobicContact CB-CG 4.07Å
538	E	92	Very high	91.4	Very high	69 Å²	69	35.7 Å²	35.7	32%	0.322	23%	0.231	S	C	.	.	H	α-helix	trans	-77.5	-32.4	-179.7	-67	176	170.9	0	0	112.6	R534 H540 Q560 Y598	R534-E538 HydrophobicContact CG-CG 4.24Å; R534-E538 WeakPolarHBondContact CG-OE1 3.39Å; R534-E538 WeakPolarHBondContact CG-OE2 3.46Å; R534-E538 WeakPolarHBondContact O-CB 3.48Å; R534-E538 WeakPolarHBondContact O-CG 3.2Å; R534-E538 PolarHBondContact O-N 2.82Å; E538-H540 PolarHBondContact O-N 2.95Å; E538-H540 IonicContact OE2-CE1 2.65Å; E538-H540 PolarHBondContact OE2-CE1 3.35Å; E538-H540 IonicContact OE2-ND1 3.73Å; E538-H540 IonicContact OE2-NE2 3.14Å; E538-Q560 PolarHBondContact O-NE2 2.93Å; E538-Y598 HydrophobicContact CG-CE1 4.37Å
539	A	92.2	Very high	90.1	Very high	33 Å²	33	44.5 Å²	44.5	27%	0.273	27%	0.269	S	S	.	.			trans	58.5	24.4	-177.1	0	0	0	0	0	115.5	Q535 L552 Q560	Q535-A539 WeakPolarHBondContact O-CA 3.33Å; Q535-A539 PolarHBondContact O-N 3.03Å; A539-L552 HydrophobicContact CB-CD1 3.94Å; A539-L552 HydrophobicContact CB-CD2 4.18Å; A539-Q560 HydrophobicContact CB-CB 4.2Å; A539-Q560 HydrophobicContact CB-CG 3.98Å
540	H	89.6	Confident	89.3	Confident	101 Å²	101	51.4 Å²	51.4	47%	0.468	30%	0.295	S	S	.	.	S	Bend	trans	-121.5	157.3	165.5	55.7	64.8	0	0	0	112.1	E538	E538-H540 PolarHBondContact O-N 2.95Å; E538-H540 IonicContact OE2-CE1 2.65Å; E538-H540 PolarHBondContact OE2-CE1 3.35Å; E538-H540 IonicContact OE2-ND1 3.73Å; E538-H540 IonicContact OE2-NE2 3.14Å
541	P	91.6	Very high	88.6	Confident	31 Å²	31	57.1 Å²	57.1	20%	0.201	33%	0.329	C	S	.	.	P	Polyproline II helix	trans	-60.8	166.1	168.4	-21.5	34.7	0	0	0	112.4	R545	P541-R545 HydrophobicContact CB-CB 3.78Å
542	P	91.4	Very high	88.1	Confident	30 Å²	30	58.7 Å²	58.7	20%	0.195	34%	0.338	C	S	.	.	P	Polyproline II helix	trans	-62.7	171.7	167.6	27.9	-35.7	0	0	0	112.5	A482 Y483 D486 R545 G546	A482-P542 HydrophobicContact CB-CB 4.38Å; Y483-P542 HydrophobicContact CD1-CB 4.45Å; Y483-P542 HydrophobicContact CD1-CG 3.79Å; Y483-P542 HydrophobicContact CE1-CB 4.14Å; Y483-P542 HydrophobicContact CE1-CG 3.9Å; D486-P542 HydrophobicContact CB-CG 4.1Å; P542-R545 HydrophobicContact CG-CB 4.44Å; P542-R545 PolarHBondContact O-N 2.87Å; P542-R545 VanDerWaalsContact O-N 3.15Å; P542-G546 PolarHBondContact O-N 2.74Å
543	V	88.6	Confident	87.8	Confident	105 Å²	105	62.1 Å²	62.1	64%	0.636	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.6	150.3	175.3	69.6	0	0	0	0	112	R545	V543-R545 PolarHBondContact O-N 2.94Å
544	G	86.3	Confident	87.6	Confident	39 Å²	39	66.4 Å²	66.4	40%	0.402	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.8	-24.2	-172.3	0	0	0	0	0	115.1
545	R	89.1	Confident	87.5	Confident	7 Å²	7	70.9 Å²	70.9	3%	0.026	42%	0.415	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.5	-14.5	-175.6	-70.4	-158.7	176.7	176.7	7.4	115.6	V420 S422 R425 A428 Y483 D486 S487 P541 P542 V543	V420-R545 PolarHBondContact O-NH2 3Å; S422-R545 PolarHBondContact O-NE 3.26Å; S422-R545 VanDerWaalsContact O-NE 3.16Å; S422-R545 PolarHBondContact O-NH2 3.37Å; R425-R545 HydrophobicContact CB-CB 4.06Å; R425-R545 HydrophobicContact CB-CG 4.05Å; R425-R545 WeakPolarHBondContact CD-O 3.41Å; R425-R545 HydrophobicContact CG-CB 4.36Å; A428-R545 VanDerWaalsContact CB-NH2 3.26Å; Y483-R545 HydrophobicContact CD1-CG 4.32Å; Y483-R545 HydrophobicContact CE1-CG 4.34Å; Y483-R545 PolarHBondContact O-NH1 3.33Å; D486-R545 WeakPolarHBondContact OD2-CD 3.32Å; D486-R545 IonicContact OD2-CZ 2.87Å; D486-R545 IonicContact OD2-NE 2.72Å; D486-R545 IonicContact OD2-NH1 3.72Å; D486-R545 PolarHBondContact OD2-NH1 3.01Å; S487-R545 PolarHBondContact OG-NH1 2.91Å; S487-R545 PolarHBondContact OG-NH2 3.41Å; P541-R545 HydrophobicContact CB-CB 3.78Å; P542-R545 HydrophobicContact CG-CB 4.44Å; P542-R545 PolarHBondContact O-N 2.87Å; P542-R545 VanDerWaalsContact O-N 3.15Å; V543-R545 PolarHBondContact O-N 2.94Å
546	G	83.4	Confident	87.3	Confident	41 Å²	41	73.3 Å²	73.3	42%	0.423	43%	0.427	S	S	.	.	S	Bend	trans	-75.3	136	177.1	0	0	0	0	0	113.8	P542 G548	P542-G546 PolarHBondContact O-N 2.74Å; G546-G548 PolarHBondContact O-N 3.34Å
547	T	73.6	Confident	87.2	Confident	120 Å²	120	79.1 Å²	79.1	74%	0.736	45%	0.448	S	S	*	.			trans	-83.5	53.7	177.5	46.9	0	0	0	0	113
548	G	69.6	Low	87.2	Confident	62 Å²	62	84.3 Å²	84.3	64%	0.639	47%	0.468	S	S	*	.	S	Bend	trans	65.1	-162.1	-175.8	0	0	0	0	0	113.3	G546 R550	G546-G548 PolarHBondContact O-N 3.34Å; G548-R550 PolarHBondContact O-N 3.2Å
549	K	71.4	Confident	87.3	Confident	189 Å²	189	83.4 Å²	83.4	82%	0.822	47%	0.467	S	S	*	.	S	Bend	trans	-74.6	64.6	-179.8	-63.1	-169.7	177.1	-173.7	0	111.8
550	R	80.5	Confident	87.5	Confident	145 Å²	145	83.5 Å²	83.5	55%	0.547	46%	0.462	S	S	.	.	P	Polyproline II helix	trans	-68	128.4	176.7	176.2	-177.9	167.4	-158.4	-12.3	110.6	G548 E556	G548-R550 PolarHBondContact O-N 3.2Å; R550-E556 IonicContact CZ-OE1 2.75Å; R550-E556 VanDerWaalsContact NH2-CD 3.3Å; R550-E556 IonicContact NH2-OE1 2.75Å; R550-E556 PolarHBondContact NH2-OE1 3.36Å; R550-E556 IonicContact NH2-OE2 2.69Å; R550-E556 PolarHBondContact NH2-OE2 3.35Å
551	V	84	Confident	87.7	Confident	121 Å²	121	82.4 Å²	82.4	73%	0.733	46%	0.459	S	S	*	.	P	Polyproline II helix	trans	-79.4	125.3	174.1	-176.4	0	0	0	0	110.5
552	L	87.4	Confident	87.9	Confident	37 Å²	37	83.8 Å²	83.8	19%	0.194	47%	0.465	C	S	.	.	P	Polyproline II helix	trans	-63.8	136.9	173.9	-61.9	174.7	0	0	0	111.8	A539 E556	A539-L552 HydrophobicContact CB-CD1 3.94Å; A539-L552 HydrophobicContact CB-CD2 4.18Å; L552-E556 HydrophobicContact CB-CB 4.32Å; L552-E556 HydrophobicContact CD2-CB 4.28Å
553	T	91.4	Very high	88.1	Confident	73 Å²	73	82.9 Å²	82.9	45%	0.448	46%	0.458	S	S	.	.	P	Polyproline II helix	trans	-68.5	162.8	171.8	63.7	0	0	0	0	111.6	K555 E556 R557	T553-K555 PolarHBondContact O-N 3.08Å; T553-E556 VanDerWaalsContact CB-OE2 3.27Å; T553-E556 WeakPolarHBondContact CB-OE2 3.46Å; T553-E556 VanDerWaalsContact CG2-OE2 3.27Å; T553-E556 WeakPolarHBondContact CG2-OE2 3.34Å; T553-E556 PolarHBondContact N-OE2 2.85Å; T553-E556 PolarHBondContact O-N 2.99Å; T553-E556 VanDerWaalsContact OG1-CD 3.24Å; T553-E556 VanDerWaalsContact OG1-CG 3.32Å; T553-E556 WeakPolarHBondContact OG1-CG 3.4Å; T553-E556 PolarHBondContact OG1-N 2.95Å; T553-E556 PolarHBondContact OG1-OE2 3.42Å; T553-R557 WeakPolarHBondContact O-CB 3.24Å; T553-R557 PolarHBondContact O-N 3.42Å
554	A	94.3	Very high	88.5	Confident	90 Å²	90	81.7 Å²	81.7	74%	0.744	44%	0.442	S	S	*	.	H	α-helix	trans	-60.4	-26.6	176.8	0	0	0	0	0	113.7	K558	A554-K558 PolarHBondContact O-N 2.74Å
555	K	94	Very high	88.9	Confident	167 Å²	167	82.3 Å²	82.3	73%	0.726	44%	0.436	S	S	*	.	H	α-helix	trans	-72.5	-51.8	172.6	-173.2	-168.8	173.9	-165.4	0	110.6	T553 R557 K558 T559	T553-K555 PolarHBondContact O-N 3.08Å; K555-R557 VanDerWaalsContact C-N 3.35Å; K555-R557 PolarHBondContact O-N 3.33Å; K555-K558 PolarHBondContact O-N 2.94Å; K555-K558 VanDerWaalsContact O-N 3.1Å; K555-T559 PolarHBondContact O-N 3.01Å; K555-T559 PolarHBondContact O-OG1 2.68Å
556	E	91.9	Very high	89.2	Confident	63 Å²	63	87.1 Å²	87.1	29%	0.294	46%	0.457	S	S	.	.	H	α-helix	trans	-60.2	-44.3	-178.9	-68.9	160.6	142.4	0	0	111.3	R550 L552 T553 K558 T559 Q560	R550-E556 IonicContact CZ-OE1 2.75Å; R550-E556 VanDerWaalsContact NH2-CD 3.3Å; R550-E556 IonicContact NH2-OE1 2.75Å; R550-E556 PolarHBondContact NH2-OE1 3.36Å; R550-E556 IonicContact NH2-OE2 2.69Å; R550-E556 PolarHBondContact NH2-OE2 3.35Å; L552-E556 HydrophobicContact CB-CB 4.32Å; L552-E556 HydrophobicContact CD2-CB 4.28Å; T553-E556 VanDerWaalsContact CB-OE2 3.27Å; T553-E556 WeakPolarHBondContact CB-OE2 3.46Å; T553-E556 VanDerWaalsContact CG2-OE2 3.27Å; T553-E556 WeakPolarHBondContact CG2-OE2 3.34Å; T553-E556 PolarHBondContact N-OE2 2.85Å; T553-E556 PolarHBondContact O-N 2.99Å; T553-E556 VanDerWaalsContact OG1-CD 3.24Å; T553-E556 VanDerWaalsContact OG1-CG 3.32Å; T553-E556 WeakPolarHBondContact OG1-CG 3.4Å; T553-E556 PolarHBondContact OG1-N 2.95Å; T553-E556 PolarHBondContact OG1-OE2 3.42Å; E556-K558 VanDerWaalsContact C-N 3.32Å; E556-K558 PolarHBondContact O-N 2.8Å; E556-T559 PolarHBondContact O-N 3.13Å; E556-Q560 WeakPolarHBondContact O-CB 3.2Å; E556-Q560 PolarHBondContact O-N 2.7Å
557	R	93.6	Very high	89.8	Confident	127 Å²	127	85.1 Å²	85.1	48%	0.479	44%	0.437	S	S	.	.	H	α-helix	trans	-61.2	-36.4	174.1	-175.1	179.6	-62.7	-80.5	-2.4	112.9	T553 K555 I561	T553-R557 WeakPolarHBondContact O-CB 3.24Å; T553-R557 PolarHBondContact O-N 3.42Å; K555-R557 VanDerWaalsContact C-N 3.35Å; K555-R557 PolarHBondContact O-N 3.33Å; R557-I561 HydrophobicContact CG-CD1 4.21Å; R557-I561 WeakPolarHBondContact O-CD1 3.42Å; R557-I561 WeakPolarHBondContact O-CG1 3.36Å; R557-I561 PolarHBondContact O-N 2.75Å
558	K	95.7	Very high	90.9	Very high	121 Å²	121	79.4 Å²	79.4	53%	0.526	40%	0.402	S	S	.	.	H	α-helix	trans	-67.1	-45.9	173.7	-168.9	-174.8	-174.8	-70.6	0	110.6	A554 K555 E556 Q560 I561 D562	A554-K558 PolarHBondContact O-N 2.74Å; K555-K558 PolarHBondContact O-N 2.94Å; K555-K558 VanDerWaalsContact O-N 3.1Å; E556-K558 VanDerWaalsContact C-N 3.32Å; E556-K558 PolarHBondContact O-N 2.8Å; K558-Q560 VanDerWaalsContact C-N 3.33Å; K558-Q560 PolarHBondContact O-N 3.2Å; K558-I561 PolarHBondContact O-N 3.31Å; K558-D562 IonicContact NZ-OD1 3.01Å; K558-D562 PolarHBondContact NZ-OD1 3.15Å; K558-D562 IonicContact NZ-OD2 3.01Å; K558-D562 PolarHBondContact NZ-OD2 3.32Å; K558-D562 WeakPolarHBondContact O-CB 3.45Å; K558-D562 PolarHBondContact O-N 2.74Å
559	T	94.4	Very high	92.2	Very high	49 Å²	49	82 Å²	82	30%	0.301	40%	0.397	S	S	.	.	H	α-helix	trans	-59.7	-42.1	177.2	-63	0	0	0	0	111.9	K555 E556 I561 D562 D563	K555-T559 PolarHBondContact O-N 3.01Å; K555-T559 PolarHBondContact O-OG1 2.68Å; E556-T559 PolarHBondContact O-N 3.13Å; T559-I561 PolarHBondContact O-N 2.93Å; T559-D562 PolarHBondContact O-N 3.05Å; T559-D563 WeakPolarHBondContact CG2-OD2 3.36Å; T559-D563 VanDerWaalsContact O-CB 3.26Å; T559-D563 WeakPolarHBondContact O-CB 3.34Å; T559-D563 PolarHBondContact O-N 2.82Å
560	Q	95.1	Very high	93.4	Very high	36 Å²	36	74.9 Å²	74.9	17%	0.168	37%	0.367	C	S	.	.	H	α-helix	trans	-55.1	-47.9	173.2	-177.8	-176.9	27	0	0	112.1	A537 E538 A539 E556 K558 R564	A537-Q560 WeakPolarHBondContact O-CG 3.35Å; A537-Q560 PolarHBondContact O-NE2 3.48Å; E538-Q560 PolarHBondContact O-NE2 2.93Å; A539-Q560 HydrophobicContact CB-CB 4.2Å; A539-Q560 HydrophobicContact CB-CG 3.98Å; E556-Q560 WeakPolarHBondContact O-CB 3.2Å; E556-Q560 PolarHBondContact O-N 2.7Å; K558-Q560 VanDerWaalsContact C-N 3.33Å; K558-Q560 PolarHBondContact O-N 3.2Å; Q560-R564 VanDerWaalsContact O-CB 3.29Å; Q560-R564 WeakPolarHBondContact O-CB 3.37Å; Q560-R564 PolarHBondContact O-N 3.16Å
561	I	95.5	Very high	94.2	Very high	78 Å²	78	68 Å²	68	40%	0.4	34%	0.341	S	S	.	.	H	α-helix	trans	-69.5	-46	178.3	-64	163.9	0	0	0	111.1	R557 K558 T559 D563 R564 N565	R557-I561 HydrophobicContact CG-CD1 4.21Å; R557-I561 WeakPolarHBondContact O-CD1 3.42Å; R557-I561 WeakPolarHBondContact O-CG1 3.36Å; R557-I561 PolarHBondContact O-N 2.75Å; K558-I561 PolarHBondContact O-N 3.31Å; T559-I561 PolarHBondContact O-N 2.93Å; I561-D563 PolarHBondContact O-N 3.28Å; I561-R564 PolarHBondContact O-N 3.1Å; I561-N565 VanDerWaalsContact O-CG 3.26Å; I561-N565 PolarHBondContact O-N 3.1Å; I561-N565 PolarHBondContact O-OD1 2.88Å
562	D	95.5	Very high	94.8	Very high	59 Å²	59	62.2 Å²	62.2	32%	0.316	31%	0.306	S	S	.	.	H	α-helix	trans	-58.8	-36.2	177.8	-68.9	-20.3	0	0	0	111.2	K558 T559 K566	K558-D562 IonicContact NZ-OD1 3.01Å; K558-D562 PolarHBondContact NZ-OD1 3.15Å; K558-D562 IonicContact NZ-OD2 3.01Å; K558-D562 PolarHBondContact NZ-OD2 3.32Å; K558-D562 WeakPolarHBondContact O-CB 3.45Å; K558-D562 PolarHBondContact O-N 2.74Å; T559-D562 PolarHBondContact O-N 3.05Å; D562-K566 WeakPolarHBondContact O-CD 3.35Å; D562-K566 VanDerWaalsContact O-CE 3.23Å; D562-K566 WeakPolarHBondContact O-CE 3.46Å; D562-K566 VanDerWaalsContact O-CG 3.28Å; D562-K566 WeakPolarHBondContact O-CG 3.44Å; D562-K566 PolarHBondContact O-N 3.32Å
563	D	95.4	Very high	95.3	Very high	11 Å²	11	64 Å²	64	6%	0.059	32%	0.315	C	S	.	.	H	α-helix	trans	-81.9	-37.7	179.2	-68.4	-16.5	0	0	0	112.3	K497 W499 T559 I561 N565 K566 L567	K497-D563 IonicContact NZ-OD2 3.51Å; K497-D563 PolarHBondContact NZ-OD2 3.15Å; W499-D563 HydrophobicContact CH2-CB 4.42Å; T559-D563 WeakPolarHBondContact CG2-OD2 3.36Å; T559-D563 VanDerWaalsContact O-CB 3.26Å; T559-D563 WeakPolarHBondContact O-CB 3.34Å; T559-D563 PolarHBondContact O-N 2.82Å; I561-D563 PolarHBondContact O-N 3.28Å; D563-N565 VanDerWaalsContact C-N 3.28Å; D563-N565 PolarHBondContact O-N 3.08Å; D563-K566 PolarHBondContact O-N 3.01Å; D563-K566 IonicContact OD1-NZ 3.69Å; D563-K566 PolarHBondContact OD1-NZ 2.94Å; D563-L567 PolarHBondContact O-N 3.17Å
564	R	96.4	Very high	95.5	Very high	81 Å²	81	61.3 Å²	61.3	31%	0.306	30%	0.299	S	S	.	.	H	α-helix	trans	-59.8	-38.7	172.5	-169.5	177.7	76.8	166.4	3.4	111.9	Q560 I561 L567 T568 Y598 D600	Q560-R564 VanDerWaalsContact O-CB 3.29Å; Q560-R564 WeakPolarHBondContact O-CB 3.37Å; Q560-R564 PolarHBondContact O-N 3.16Å; I561-R564 PolarHBondContact O-N 3.1Å; R564-L567 WeakPolarHBondContact O-CG 3.48Å; R564-T568 WeakPolarHBondContact O-CB 3.49Å; R564-T568 PolarHBondContact O-N 3.19Å; R564-T568 PolarHBondContact O-OG1 3.39Å; R564-Y598 VanDerWaalsContact CG-O 3.29Å; R564-Y598 WeakPolarHBondContact CG-O 3.28Å; R564-D600 IonicContact CZ-OD2 2.58Å; R564-D600 IonicContact NE-OD2 2.75Å; R564-D600 VanDerWaalsContact NH2-CG 3.27Å; R564-D600 IonicContact NH2-OD1 3.93Å; R564-D600 IonicContact NH2-OD2 3.4Å; R564-D600 PolarHBondContact NH2-OD2 2.85Å
565	N	95.6	Very high	95.7	Very high	51 Å²	51	57.1 Å²	57.1	27%	0.273	26%	0.264	S	S	.	.	H	α-helix	trans	-68.8	-43.5	178.9	-68.1	12.2	0	0	0	110.8	I561 D563 T568 E569 I603	I561-N565 VanDerWaalsContact O-CG 3.26Å; I561-N565 PolarHBondContact O-N 3.1Å; I561-N565 PolarHBondContact O-OD1 2.88Å; D563-N565 VanDerWaalsContact C-N 3.28Å; D563-N565 PolarHBondContact O-N 3.08Å; N565-T568 PolarHBondContact O-N 2.89Å; N565-E569 WeakPolarHBondContact O-CB 3.35Å; N565-E569 WeakPolarHBondContact O-CG 3.32Å; N565-E569 PolarHBondContact O-N 3.11Å; N565-I603 HydrophobicContact CB-CD1 4.17Å
566	K	95.3	Very high	95.9	Very high	108 Å²	108	49.8 Å²	49.8	47%	0.47	23%	0.233	S	C	.	.	H	α-helix	trans	-59.9	-48.5	175.2	-67.1	165.5	-154	159.3	0	112.8	W499 D562 D563 T568 E569 H570	W499-K566 HydrophobicContact CZ3-CB 4.39Å; D562-K566 WeakPolarHBondContact O-CD 3.35Å; D562-K566 VanDerWaalsContact O-CE 3.23Å; D562-K566 WeakPolarHBondContact O-CE 3.46Å; D562-K566 VanDerWaalsContact O-CG 3.28Å; D562-K566 WeakPolarHBondContact O-CG 3.44Å; D562-K566 PolarHBondContact O-N 3.32Å; D563-K566 PolarHBondContact O-N 3.01Å; D563-K566 IonicContact OD1-NZ 3.69Å; D563-K566 PolarHBondContact OD1-NZ 2.94Å; K566-T568 VanDerWaalsContact C-N 3.26Å; K566-T568 PolarHBondContact O-N 3.43Å; K566-E569 PolarHBondContact O-N 2.97Å; K566-H570 WeakPolarHBondContact O-CB 3.27Å; K566-H570 PolarHBondContact O-N 3.07Å
567	L	96.1	Very high	96.2	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-64.1	-37.4	-179.2	77.8	86.3	0	0	0	110.4	W499 I533 A537 D563 R564 F571 F599	W499-L567 HydrophobicContact CD2-CB 4.43Å; W499-L567 HydrophobicContact CE3-CB 3.89Å; W499-L567 HydrophobicContact CH2-CB 3.9Å; W499-L567 HydrophobicContact CH2-CD2 4.1Å; W499-L567 HydrophobicContact CZ2-CB 4.43Å; W499-L567 HydrophobicContact CZ2-CD2 4.5Å; W499-L567 HydrophobicContact CZ3-CB 3.61Å; I533-L567 HydrophobicContact CG2-CD1 4.13Å; I533-L567 HydrophobicContact CG2-CD2 4.21Å; A537-L567 HydrophobicContact CB-CD2 4.34Å; D563-L567 PolarHBondContact O-N 3.17Å; R564-L567 WeakPolarHBondContact O-CG 3.48Å; L567-F571 HydrophobicContact CB-CD2 4.21Å; L567-F571 WeakPolarHBondContact O-CB 3.48Å; L567-F571 VanDerWaalsContact O-CD2 3.28Å; L567-F571 WeakPolarHBondContact O-CD2 3.21Å; L567-F571 PolarHBondContact O-N 3.45Å; L567-F599 HydrophobicContact CD1-CD1 3.83Å; L567-F599 HydrophobicContact CD1-CE1 4.1Å
568	T	96.6	Very high	96.4	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-65.7	-51.6	176.3	-55.2	0	0	0	0	111.5	R564 N565 K566 H570 F571 I572 F599 D600 I603	R564-T568 WeakPolarHBondContact O-CB 3.49Å; R564-T568 PolarHBondContact O-N 3.19Å; R564-T568 PolarHBondContact O-OG1 3.39Å; N565-T568 PolarHBondContact O-N 2.89Å; K566-T568 VanDerWaalsContact C-N 3.26Å; K566-T568 PolarHBondContact O-N 3.43Å; T568-H570 PolarHBondContact O-N 3.48Å; T568-F571 PolarHBondContact O-N 2.88Å; T568-I572 HydrophobicContact CG2-CD1 3.56Å; T568-I572 HydrophobicContact CG2-CG1 4.11Å; T568-I572 VanDerWaalsContact O-CB 3.25Å; T568-I572 WeakPolarHBondContact O-CB 3.16Å; T568-I572 WeakPolarHBondContact O-CG1 3.36Å; T568-I572 PolarHBondContact O-N 3.33Å; T568-F599 HydrophobicContact CG2-CB 3.95Å; T568-F599 HydrophobicContact CG2-CD1 4.34Å; T568-F599 HydrophobicContact CG2-CD2 4.33Å; T568-F599 HydrophobicContact CG2-CG 3.97Å; T568-F599 WeakPolarHBondContact OG1-CA 3.31Å; T568-D600 PolarHBondContact OG1-N 2.96Å; T568-I603 HydrophobicContact CG2-CB 3.92Å; T568-I603 HydrophobicContact CG2-CD1 3.9Å; T568-I603 HydrophobicContact CG2-CG1 4.35Å; T568-I603 HydrophobicContact CG2-CG2 4.19Å
569	E	95.6	Very high	96.5	Very high	116 Å²	116	40 Å²	40	54%	0.542	20%	0.196	S	C	.	.	H	α-helix	trans	-56.8	-38	178.4	-74.8	176.8	179.4	0	0	112.4	N565 K566 I603	N565-E569 WeakPolarHBondContact O-CB 3.35Å; N565-E569 WeakPolarHBondContact O-CG 3.32Å; N565-E569 PolarHBondContact O-N 3.11Å; K566-E569 PolarHBondContact O-N 2.97Å; E569-I603 HydrophobicContact CG-CD1 4.38Å; E569-I603 HydrophobicContact CG-CG2 4.13Å
570	H	96.5	Very high	96.6	Very high	39 Å²	39	40.6 Å²	40.6	18%	0.181	20%	0.202	C	C	.	.	H	α-helix	trans	-74.2	-59.1	176.8	177.5	83.8	0	0	0	112.7	T503 K566 T568 I572 I573 T574	T503-H570 WeakPolarHBondContact CG2-NE2 2.98Å; T503-H570 PolarHBondContact OG1-CE1 2.85Å; T503-H570 PolarHBondContact OG1-NE2 3.16Å; K566-H570 WeakPolarHBondContact O-CB 3.27Å; K566-H570 PolarHBondContact O-N 3.07Å; T568-H570 PolarHBondContact O-N 3.48Å; H570-I572 VanDerWaalsContact C-N 3.33Å; H570-I572 PolarHBondContact O-N 2.87Å; H570-I573 PolarHBondContact O-N 3.45Å; H570-T574 PolarHBondContact CD2-OG1 3.02Å; H570-T574 PolarHBondContact NE2-OG1 3.09Å; H570-T574 VanDerWaalsContact NE2-OG1 3.08Å; H570-T574 PolarHBondContact O-N 3.37Å; H570-T574 PolarHBondContact O-OG1 3.32Å
571	F	98.1	Very high	96.7	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-73.3	-20.9	-170.6	-76	-71.1	0	0	0	113.9	W499 T503 M529 I533 L567 T568 I573 T574 L575 L578 I595 F599	W499-F571 HydrophobicContact CB-CE2 3.8Å; W499-F571 HydrophobicContact CB-CZ 3.89Å; W499-F571 HydrophobicContact CD2-CE2 4.33Å; W499-F571 AromaticContact CG-CE2 3.83Å; W499-F571 HydrophobicContact CG-CE2 3.83Å; W499-F571 HydrophobicContact CG-CZ 4.18Å; T503-F571 HydrophobicContact CG2-CD1 4.38Å; T503-F571 HydrophobicContact CG2-CE1 3.46Å; T503-F571 VanDerWaalsContact CG2-CE1 3.46Å; T503-F571 HydrophobicContact CG2-CZ 3.94Å; M529-F571 HydrophobicContact CE-CE1 4.1Å; M529-F571 HydrophobicContact CE-CZ 4.42Å; M529-F571 HydrophobicContact CG-CZ 4.04Å; M529-F571 HydrophobicContact SD-CE1 3.82Å; M529-F571 HydrophobicContact SD-CZ 3.67Å; I533-F571 HydrophobicContact CD1-CD2 4Å; I533-F571 HydrophobicContact CD1-CE1 4.25Å; I533-F571 HydrophobicContact CD1-CE2 3.39Å; I533-F571 HydrophobicContact CD1-CZ 3.55Å; I533-F571 HydrophobicContact CG1-CE2 3.85Å; I533-F571 HydrophobicContact CG1-CZ 4.36Å; L567-F571 HydrophobicContact CB-CD2 4.21Å; L567-F571 WeakPolarHBondContact O-CB 3.48Å; L567-F571 VanDerWaalsContact O-CD2 3.28Å; L567-F571 WeakPolarHBondContact O-CD2 3.21Å; L567-F571 PolarHBondContact O-N 3.45Å; T568-F571 PolarHBondContact O-N 2.88Å; F571-I573 PolarHBondContact O-N 3.16Å; F571-T574 WeakPolarHBondContact CD1-OG1 3.2Å; F571-T574 PolarHBondContact O-N 2.37Å; F571-L575 WeakPolarHBondContact O-CB 3.34Å; F571-L575 PolarHBondContact O-N 3.45Å; F571-L578 HydrophobicContact CD1-CD1 4.5Å; F571-L578 HydrophobicContact CE1-CD1 4.28Å; F571-I595 HydrophobicContact CB-CG2 3.79Å; F571-I595 HydrophobicContact CD1-CD1 4.29Å; F571-I595 HydrophobicContact CD1-CG2 4.13Å; F571-I595 HydrophobicContact CD2-CG2 4.16Å; F571-I595 HydrophobicContact CE1-CD1 4.23Å; F571-I595 HydrophobicContact CG-CG2 3.76Å; F571-F599 HydrophobicContact CB-CE1 3.67Å; F571-F599 HydrophobicContact CB-CZ 3.63Å
572	I	97.3	Very high	96.8	Very high	1 Å²	1	40.5 Å²	40.5	1%	0.005	20%	0.198	C	C	.	.	H	α-helix	trans	-52.9	-36.4	165.4	-80.3	178.3	0	0	0	111	T568 H570 F599 I603 Y604 M609 H612	T568-I572 HydrophobicContact CG2-CD1 3.56Å; T568-I572 HydrophobicContact CG2-CG1 4.11Å; T568-I572 VanDerWaalsContact O-CB 3.25Å; T568-I572 WeakPolarHBondContact O-CB 3.16Å; T568-I572 WeakPolarHBondContact O-CG1 3.36Å; T568-I572 PolarHBondContact O-N 3.33Å; H570-I572 VanDerWaalsContact C-N 3.33Å; H570-I572 PolarHBondContact O-N 2.87Å; I572-F599 HydrophobicContact CG1-CD2 4.16Å; I572-F599 HydrophobicContact CG1-CE2 3.81Å; I572-F599 HydrophobicContact CG1-CZ 4.4Å; I572-I603 HydrophobicContact CD1-CB 4.41Å; I572-I603 HydrophobicContact CD1-CG2 4.04Å; I572-Y604 HydrophobicContact CB-CE1 4.36Å; I572-Y604 HydrophobicContact CD1-CD1 3.87Å; I572-Y604 HydrophobicContact CD1-CD2 4.21Å; I572-Y604 HydrophobicContact CD1-CE1 3.83Å; I572-Y604 HydrophobicContact CD1-CE2 4.18Å; I572-Y604 HydrophobicContact CD1-CG 4.06Å; I572-Y604 HydrophobicContact CG1-CD1 4.29Å; I572-Y604 HydrophobicContact CG1-CE1 3.72Å; I572-Y604 HydrophobicContact CG1-CE2 4.24Å; I572-Y604 HydrophobicContact CG2-CD1 4.33Å; I572-Y604 HydrophobicContact CG2-CE1 3.88Å; I572-M609 HydrophobicContact CG2-CB 3.67Å; I572-M609 HydrophobicContact CG2-CG 4.03Å; I572-H612 HydrophobicContact CG2-CB 3.74Å; I572-H612 WeakPolarHBondContact O-CB 3.42Å
573	I	96.5	Very high	96.8	Very high	74 Å²	74	38.4 Å²	38.4	38%	0.379	19%	0.188	S	C	.	.	H	α-helix	trans	-87.4	-46.2	-178	-58	177.5	0	0	0	111.4	H570 F571	H570-I573 PolarHBondContact O-N 3.45Å; F571-I573 PolarHBondContact O-N 3.16Å
574	T	97.3	Very high	96.8	Very high	17 Å²	17	41.5 Å²	41.5	10%	0.104	22%	0.215	C	C	.	.	H	α-helix	trans	-86.7	-29.8	-170.7	55.4	0	0	0	0	114.7	L507 H570 F571 M577 L578	L507-T574 HydrophobicContact CD1-CG2 4.47Å; H570-T574 PolarHBondContact CD2-OG1 3.02Å; H570-T574 PolarHBondContact NE2-OG1 3.09Å; H570-T574 VanDerWaalsContact NE2-OG1 3.08Å; H570-T574 PolarHBondContact O-N 3.37Å; H570-T574 PolarHBondContact O-OG1 3.32Å; F571-T574 WeakPolarHBondContact CD1-OG1 3.2Å; F571-T574 PolarHBondContact O-N 2.37Å; T574-M577 WeakPolarHBondContact O-CA 3.19Å; T574-M577 WeakPolarHBondContact O-CB 3.19Å; T574-M577 PolarHBondContact O-N 3.42Å; T574-L578 PolarHBondContact O-N 2.98Å
575	L	97.9	Very high	96.8	Very high	1 Å²	1	39.4 Å²	39.4	1%	0.005	21%	0.21	C	C	.	.	H	α-helix	trans	-59.6	-42.6	-177.1	-179.8	63.5	0	0	0	114	F571 M577 L578 L579 L592 I595 P596 L616	F571-L575 WeakPolarHBondContact O-CB 3.34Å; F571-L575 PolarHBondContact O-N 3.45Å; L575-M577 PolarHBondContact O-N 3.39Å; L575-L578 PolarHBondContact O-N 2.69Å; L575-L579 HydrophobicContact CD1-CD1 4.12Å; L575-L579 HydrophobicContact CD1-CG 3.94Å; L575-L579 HydrophobicContact CG-CD1 3.97Å; L575-L579 HydrophobicContact CG-CG 4.27Å; L575-L579 WeakPolarHBondContact O-CB 3.27Å; L575-L579 WeakPolarHBondContact O-CG 3.46Å; L575-L579 PolarHBondContact O-N 3.16Å; L575-L592 HydrophobicContact CD1-CB 4.02Å; L575-L592 HydrophobicContact CD1-CD2 4.06Å; L575-L592 WeakPolarHBondContact CD1-O 3.35Å; L575-I595 HydrophobicContact CD1-CD1 4.33Å; L575-I595 HydrophobicContact CD2-CB 4.27Å; L575-I595 HydrophobicContact CD2-CG2 4.39Å; L575-P596 HydrophobicContact CD2-CG 3.41Å; L575-P596 VanDerWaalsContact CD2-CG 3.41Å; L575-L616 HydrophobicContact CD2-CD1 3.87Å; L575-L616 HydrophobicContact CG-CD1 4.13Å
576	P	97.8	Very high	96.9	Very high	13 Å²	13	38.3 Å²	38.3	8%	0.084	21%	0.208	C	C	.	.	H	α-helix	trans	-63.2	-21.8	175.3	-22.6	34.8	0	0	0	113.8	S580 A615 L616 Q619	P576-S580 WeakPolarHBondContact O-CB 3.48Å; P576-S580 PolarHBondContact O-N 3Å; P576-A615 HydrophobicContact CB-CB 4.04Å; P576-A615 HydrophobicContact CG-CB 4.33Å; P576-L616 HydrophobicContact CG-CB 4.11Å; P576-Q619 HydrophobicContact CB-CG 4.45Å; P576-Q619 PolarHBondContact O-NE2 2.98Å
577	M	97.5	Very high	96.9	Very high	106 Å²	106	38.2 Å²	38.2	52%	0.522	21%	0.209	S	C	.	.	H	α-helix	trans	-81.8	-44.1	174.7	-62.2	174.8	57.1	0	0	111.1	L507 T574 L575 S580 K581	L507-M577 HydrophobicContact CD1-CB 4.24Å; L507-M577 HydrophobicContact CD1-CE 4.34Å; L507-M577 HydrophobicContact CD2-CB 4Å; T574-M577 WeakPolarHBondContact O-CA 3.19Å; T574-M577 WeakPolarHBondContact O-CB 3.19Å; T574-M577 PolarHBondContact O-N 3.42Å; L575-M577 PolarHBondContact O-N 3.39Å; M577-S580 WeakPolarHBondContact O-CB 3.32Å; M577-S580 PolarHBondContact O-N 3.14Å; M577-S580 VanDerWaalsContact O-N 3.16Å; M577-K581 PolarHBondContact O-N 2.92Å
578	L	97.9	Very high	96.9	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-59.1	-51.1	175.3	-69.2	164.8	0	0	0	111.1	T503 L506 L507 M529 F571 T574 L575 S580 K581 Y582 L592	T503-L578 HydrophobicContact CG2-CD1 3.92Å; L506-L578 HydrophobicContact CB-CD2 3.77Å; L506-L578 HydrophobicContact CD1-CD2 4.03Å; L507-L578 HydrophobicContact CD1-CD2 4.21Å; L507-L578 HydrophobicContact CD1-CG 4.26Å; L507-L578 HydrophobicContact CD2-CD2 3.79Å; L507-L578 HydrophobicContact CD2-CG 4.16Å; L507-L578 HydrophobicContact CG-CD2 3.77Å; L507-L578 HydrophobicContact CG-CG 4.3Å; M529-L578 HydrophobicContact CE-CD1 4.29Å; F571-L578 HydrophobicContact CD1-CD1 4.5Å; F571-L578 HydrophobicContact CE1-CD1 4.28Å; T574-L578 PolarHBondContact O-N 2.98Å; L575-L578 PolarHBondContact O-N 2.69Å; L578-S580 VanDerWaalsContact C-N 3.26Å; L578-S580 PolarHBondContact O-N 3.16Å; L578-K581 PolarHBondContact O-N 3.18Å; L578-K581 VanDerWaalsContact O-N 3.12Å; L578-Y582 HydrophobicContact CD2-CE2 4.05Å; L578-Y582 VanDerWaalsContact O-CD2 3.27Å; L578-Y582 WeakPolarHBondContact O-CD2 3.43Å; L578-Y582 PolarHBondContact O-N 3.17Å; L578-L592 HydrophobicContact CB-CD1 3.95Å; L578-L592 HydrophobicContact CB-CD2 3.91Å; L578-L592 HydrophobicContact CD1-CD2 3.9Å; L578-L592 HydrophobicContact CG-CD2 4.42Å
579	L	98	Very high	97	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-57	-41.2	174.1	-70.4	172	0	0	0	111.1	L575 K581 S583 V589 L592 L593 L616 Q619	L575-L579 HydrophobicContact CD1-CD1 4.12Å; L575-L579 HydrophobicContact CD1-CG 3.94Å; L575-L579 HydrophobicContact CG-CD1 3.97Å; L575-L579 HydrophobicContact CG-CG 4.27Å; L575-L579 WeakPolarHBondContact O-CB 3.27Å; L575-L579 WeakPolarHBondContact O-CG 3.46Å; L575-L579 PolarHBondContact O-N 3.16Å; L579-K581 VanDerWaalsContact C-N 3.35Å; L579-K581 PolarHBondContact O-N 3.05Å; L579-S583 WeakPolarHBondContact O-CA 3.48Å; L579-S583 WeakPolarHBondContact O-CB 3.36Å; L579-S583 PolarHBondContact O-N 3.07Å; L579-V589 HydrophobicContact CD2-CG1 4.15Å; L579-L592 HydrophobicContact CD2-CB 3.81Å; L579-L592 HydrophobicContact CD2-CD1 4.4Å; L579-L593 HydrophobicContact CD1-CD2 4.37Å; L579-L593 HydrophobicContact CD2-CD2 4.27Å; L579-L593 HydrophobicContact CD2-CG 4.19Å; L579-L616 HydrophobicContact CD1-CD1 3.64Å; L579-Q619 HydrophobicContact CB-CB 4.07Å; L579-Q619 HydrophobicContact CB-CG 4.49Å; L579-Q619 HydrophobicContact CD1-CB 4.28Å
580	S	97.1	Very high	97	Very high	62 Å²	62	33.4 Å²	33.4	43%	0.434	19%	0.189	S	C	.	.	H	α-helix	trans	-62.8	-37.9	177.5	-156.5	0	0	0	0	113.5	P576 M577 L578 S583 Q619	P576-S580 WeakPolarHBondContact O-CB 3.48Å; P576-S580 PolarHBondContact O-N 3Å; M577-S580 WeakPolarHBondContact O-CB 3.32Å; M577-S580 PolarHBondContact O-N 3.14Å; M577-S580 VanDerWaalsContact O-N 3.16Å; L578-S580 VanDerWaalsContact C-N 3.26Å; L578-S580 PolarHBondContact O-N 3.16Å; S580-S583 PolarHBondContact O-OG 3.47Å; S580-Q619 PolarHBondContact OG-NE2 3.24Å; S580-Q619 VanDerWaalsContact OG-NE2 3.09Å
581	K	96.8	Very high	97	Very high	100 Å²	100	32.6 Å²	32.6	44%	0.435	19%	0.186	S	C	.	.	H	α-helix	trans	-71.2	-50.6	177.6	178.1	177.7	168.5	-174	0	111.1	L506 E522 M577 L578 L579	L506-K581 WeakPolarHBondContact O-CD 3.31Å; L506-K581 PolarHBondContact O-NZ 3Å; E522-K581 IonicContact OE1-NZ 3.89Å; E522-K581 PolarHBondContact OE1-NZ 2.83Å; E522-K581 IonicContact OE2-NZ 2.73Å; M577-K581 PolarHBondContact O-N 2.92Å; L578-K581 PolarHBondContact O-N 3.18Å; L578-K581 VanDerWaalsContact O-N 3.12Å; L579-K581 VanDerWaalsContact C-N 3.35Å; L579-K581 PolarHBondContact O-N 3.05Å
582	Y	97.1	Very high	97.1	Very high	12 Å²	12	32.6 Å²	32.6	5%	0.047	19%	0.186	C	C	.	.	H	α-helix	trans	-92.9	4	-170.2	-59.3	-69.3	0	0	0	114.6	L506 E522 I526 L578 A584 D585 K588 V589 L592	L506-Y582 HydrophobicContact CB-CE2 4.29Å; L506-Y582 HydrophobicContact CD2-CE2 4.38Å; L506-Y582 VanDerWaalsContact CD2-OH 3.29Å; L506-Y582 WeakPolarHBondContact CD2-OH 3.38Å; L506-Y582 PolarHBondContact O-OH 2.82Å; L506-Y582 VanDerWaalsContact O-OH 3.04Å; E522-Y582 HydrophobicContact CB-CE1 4.15Å; E522-Y582 VanDerWaalsContact CD-OH 3.26Å; E522-Y582 PolarHBondContact OE1-OH 2.64Å; I526-Y582 HydrophobicContact CD1-CD2 3.94Å; I526-Y582 HydrophobicContact CD1-CE2 3.96Å; I526-Y582 HydrophobicContact CD1-CG 4.28Å; L578-Y582 HydrophobicContact CD2-CE2 4.05Å; L578-Y582 VanDerWaalsContact O-CD2 3.27Å; L578-Y582 WeakPolarHBondContact O-CD2 3.43Å; L578-Y582 PolarHBondContact O-N 3.17Å; Y582-A584 PolarHBondContact O-N 2.89Å; Y582-D585 PolarHBondContact O-N 2.87Å; Y582-K588 HydrophobicContact CD1-CD 3.65Å; Y582-K588 HydrophobicContact CE1-CD 4.2Å; Y582-K588 HydrophobicContact CG-CD 4.22Å; Y582-V589 VanDerWaalsContact O-CG2 3.24Å; Y582-V589 WeakPolarHBondContact O-CG2 3.17Å; Y582-L592 HydrophobicContact CD2-CD1 4.02Å
583	S	96.1	Very high	97.1	Very high	15 Å²	15	32.6 Å²	32.6	11%	0.105	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.4	3.7	-179.5	61.5	0	0	0	0	118.1	L579 S580 K626 H627	L579-S583 WeakPolarHBondContact O-CA 3.48Å; L579-S583 WeakPolarHBondContact O-CB 3.36Å; L579-S583 PolarHBondContact O-N 3.07Å; S580-S583 PolarHBondContact O-OG 3.47Å; S583-K626 VanDerWaalsContact O-CD 3.29Å; S583-K626 WeakPolarHBondContact O-CD 3.41Å; S583-K626 VanDerWaalsContact O-CE 3.22Å; S583-K626 WeakPolarHBondContact O-CE 3.41Å; S583-K626 PolarHBondContact O-NZ 3.5Å; S583-H627 PolarHBondContact O-NE2 3.28Å
584	A	95.5	Very high	97.1	Very high	75 Å²	75	31.3 Å²	31.3	62%	0.62	18%	0.178	S	C	*	.	T	Hydrogen-bonded Turn	trans	-107.6	-7.2	174.1	0	0	0	0	0	113.9	Y582	Y582-A584 PolarHBondContact O-N 2.89Å
585	D	97.3	Very high	97.1	Very high	38 Å²	38	30.5 Å²	30.5	20%	0.203	17%	0.173	C	C	.	.			trans	-115.7	117.9	-170.7	-174.6	-62.8	0	0	0	109.9	Y582 E587 K588 V589	Y582-D585 PolarHBondContact O-N 2.87Å; D585-E587 PolarHBondContact OD1-N 2.97Å; D585-E587 VanDerWaalsContact OD1-N 3.1Å; D585-K588 HydrophobicContact CB-CB 4.09Å; D585-K588 HydrophobicContact CB-CD 3.98Å; D585-K588 HydrophobicContact CB-CG 4.24Å; D585-K588 WeakPolarHBondContact OD1-CB 3.46Å; D585-K588 WeakPolarHBondContact OD1-CG 3.46Å; D585-K588 PolarHBondContact OD1-N 3.49Å; D585-K588 IonicContact OD1-NZ 3.33Å; D585-K588 IonicContact OD2-NZ 3.91Å; D585-K588 PolarHBondContact OD2-NZ 3.1Å; D585-V589 WeakPolarHBondContact O-CB 3.44Å; D585-V589 WeakPolarHBondContact O-CG2 3.16Å; D585-V589 PolarHBondContact O-N 2.91Å; D585-V589 VanDerWaalsContact O-N 3.1Å
586	A	96.3	Very high	97	Very high	27 Å²	27	30.6 Å²	30.6	22%	0.223	17%	0.174	C	C	.	.	H	α-helix	trans	-67.3	-41.6	-174.4	0	0	0	0	0	112.6	A590 E629 V632	A586-A590 VanDerWaalsContact O-CB 3.23Å; A586-A590 WeakPolarHBondContact O-CB 3Å; A586-A590 PolarHBondContact O-N 2.64Å; A586-E629 HydrophobicContact CB-CB 4.32Å; A586-E629 HydrophobicContact CB-CG 3.91Å; A586-V632 HydrophobicContact CB-CG2 3.69Å; A586-V632 WeakPolarHBondContact O-CG2 3.3Å
587	E	94.9	Very high	96.9	Very high	107 Å²	107	32.8 Å²	32.8	50%	0.5	18%	0.183	S	C	.	.	H	α-helix	trans	-64.4	-55.4	-178.6	-174.4	-145.3	152.9	0	0	110.5	S523 D585 V589 A590 N591	S523-E587 VanDerWaalsContact CB-OE1 3.3Å; S523-E587 WeakPolarHBondContact CB-OE1 3.35Å; S523-E587 WeakPolarHBondContact CB-OE2 3.28Å; S523-E587 VanDerWaalsContact OG-CD 3.29Å; S523-E587 PolarHBondContact OG-OE1 3.11Å; S523-E587 PolarHBondContact OG-OE2 3.12Å; D585-E587 PolarHBondContact OD1-N 2.97Å; D585-E587 VanDerWaalsContact OD1-N 3.1Å; E587-V589 VanDerWaalsContact C-N 3.28Å; E587-V589 PolarHBondContact O-N 3.18Å; E587-A590 PolarHBondContact O-N 3.09Å; E587-N591 PolarHBondContact O-N 2.83Å; E587-N591 VanDerWaalsContact O-N 3.14Å
588	K	97.5	Very high	96.8	Very high	2 Å²	2	29.1 Å²	29.1	1%	0.009	16%	0.163	C	C	.	.	H	α-helix	trans	-59.7	-39.4	-179.9	-64.5	175.7	-174.4	60.5	0	111.1	D519 S523 I526 Y582 D585 L592	D519-K588 WeakPolarHBondContact O-CE 3.42Å; D519-K588 WeakPolarHBondContact OD1-CE 3.3Å; D519-K588 IonicContact OD1-NZ 2.8Å; D519-K588 PolarHBondContact OD1-NZ 3.42Å; D519-K588 VanDerWaalsContact OD1-NZ 3.14Å; D519-K588 IonicContact OD2-NZ 2.7Å; D519-K588 PolarHBondContact OD2-NZ 3.25Å; S523-K588 VanDerWaalsContact OG-CE 3.31Å; S523-K588 WeakPolarHBondContact OG-CE 3.47Å; S523-K588 WeakPolarHBondContact OG-CG 3.45Å; S523-K588 PolarHBondContact OG-NZ 3.2Å; I526-K588 HydrophobicContact CD1-CB 3.87Å; I526-K588 HydrophobicContact CD1-CD 4.27Å; I526-K588 HydrophobicContact CD1-CG 3.98Å; Y582-K588 HydrophobicContact CD1-CD 3.65Å; Y582-K588 HydrophobicContact CE1-CD 4.2Å; Y582-K588 HydrophobicContact CG-CD 4.22Å; D585-K588 HydrophobicContact CB-CB 4.09Å; D585-K588 HydrophobicContact CB-CD 3.98Å; D585-K588 HydrophobicContact CB-CG 4.24Å; D585-K588 WeakPolarHBondContact OD1-CB 3.46Å; D585-K588 WeakPolarHBondContact OD1-CG 3.46Å; D585-K588 PolarHBondContact OD1-N 3.49Å; D585-K588 IonicContact OD1-NZ 3.33Å; D585-K588 IonicContact OD2-NZ 3.91Å; D585-K588 PolarHBondContact OD2-NZ 3.1Å; K588-L592 WeakPolarHBondContact O-CB 3.29Å; K588-L592 WeakPolarHBondContact O-CD1 3.33Å; K588-L592 WeakPolarHBondContact O-CG 3.42Å; K588-L592 PolarHBondContact O-N 3.44Å
589	V	97.4	Very high	96.7	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-75.2	-42.6	-179.4	171.7	0	0	0	0	112.5	L579 Y582 D585 E587 N591 L592 L593 V623 V632	L579-V589 HydrophobicContact CD2-CG1 4.15Å; Y582-V589 VanDerWaalsContact O-CG2 3.24Å; Y582-V589 WeakPolarHBondContact O-CG2 3.17Å; D585-V589 WeakPolarHBondContact O-CB 3.44Å; D585-V589 WeakPolarHBondContact O-CG2 3.16Å; D585-V589 PolarHBondContact O-N 2.91Å; D585-V589 VanDerWaalsContact O-N 3.1Å; E587-V589 VanDerWaalsContact C-N 3.28Å; E587-V589 PolarHBondContact O-N 3.18Å; V589-N591 VanDerWaalsContact C-N 3.29Å; V589-N591 PolarHBondContact O-N 3.41Å; V589-L592 PolarHBondContact O-N 3.02Å; V589-L593 HydrophobicContact CG1-CD1 3.68Å; V589-L593 HydrophobicContact CG1-CG 4.13Å; V589-L593 WeakPolarHBondContact O-CB 2.53Å; V589-L593 WeakPolarHBondContact O-CD1 3.41Å; V589-L593 WeakPolarHBondContact O-CG 3.47Å; V589-L593 PolarHBondContact O-N 3.02Å; V589-V623 HydrophobicContact CG1-CB 4.34Å; V589-V623 HydrophobicContact CG1-CG1 3.55Å; V589-V623 HydrophobicContact CG1-CG2 3.79Å; V589-V632 HydrophobicContact CG1-CG1 4.18Å
590	A	96.8	Very high	96.6	Very high	13 Å²	13	30.7 Å²	30.7	11%	0.107	17%	0.171	C	C	.	.	H	α-helix	trans	-58.3	-42.3	176.1	0	0	0	0	0	111.4	A586 E587 D631 V632	A586-A590 VanDerWaalsContact O-CB 3.23Å; A586-A590 WeakPolarHBondContact O-CB 3Å; A586-A590 PolarHBondContact O-N 2.64Å; E587-A590 PolarHBondContact O-N 3.09Å; A590-D631 HydrophobicContact CB-CB 4.25Å; A590-V632 HydrophobicContact CB-CG2 4.13Å
591	N	97.2	Very high	96.5	Very high	22 Å²	22	27.9 Å²	27.9	12%	0.118	15%	0.152	C	C	.	.	H	α-helix	trans	-66.7	-48.7	174.7	-103.3	-13.2	0	0	0	112.6	I526 E527 V530 E587 V589 L593 Q594	I526-N591 HydrophobicContact CG2-CB 3.89Å; E527-N591 PolarHBondContact OE2-ND2 2.75Å; V530-N591 HydrophobicContact CG2-CB 4.2Å; V530-N591 WeakPolarHBondContact CG2-O 3.43Å; E587-N591 PolarHBondContact O-N 2.83Å; E587-N591 VanDerWaalsContact O-N 3.14Å; V589-N591 VanDerWaalsContact C-N 3.29Å; V589-N591 PolarHBondContact O-N 3.41Å; N591-L593 PolarHBondContact O-N 2.84Å; N591-Q594 WeakPolarHBondContact O-CB 3.45Å; N591-Q594 PolarHBondContact O-N 3.13Å; N591-Q594 VanDerWaalsContact O-N 3.1Å; N591-Q594 PolarHBondContact OD1-NE2 3Å
592	L	98.3	Very high	96.4	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-58.2	-34.2	176.8	-77.2	169.3	0	0	0	112.9	I526 M529 L575 L578 L579 Y582 K588 V589 Q594 I595	I526-L592 HydrophobicContact CD1-CD1 4.19Å; I526-L592 HydrophobicContact CD1-CG 4.43Å; I526-L592 HydrophobicContact CG2-CD2 4.27Å; I526-L592 HydrophobicContact CG2-CG 3.98Å; M529-L592 HydrophobicContact CE-CD2 4.11Å; L575-L592 HydrophobicContact CD1-CB 4.02Å; L575-L592 HydrophobicContact CD1-CD2 4.06Å; L575-L592 WeakPolarHBondContact CD1-O 3.35Å; L578-L592 HydrophobicContact CB-CD1 3.95Å; L578-L592 HydrophobicContact CB-CD2 3.91Å; L578-L592 HydrophobicContact CD1-CD2 3.9Å; L578-L592 HydrophobicContact CG-CD2 4.42Å; L579-L592 HydrophobicContact CD2-CB 3.81Å; L579-L592 HydrophobicContact CD2-CD1 4.4Å; Y582-L592 HydrophobicContact CD2-CD1 4.02Å; K588-L592 WeakPolarHBondContact O-CB 3.29Å; K588-L592 WeakPolarHBondContact O-CD1 3.33Å; K588-L592 WeakPolarHBondContact O-CG 3.42Å; K588-L592 PolarHBondContact O-N 3.44Å; V589-L592 PolarHBondContact O-N 3.02Å; L592-Q594 VanDerWaalsContact C-N 3.25Å; L592-Q594 PolarHBondContact O-N 2.98Å; L592-I595 HydrophobicContact CD2-CD1 3.96Å; L592-I595 WeakPolarHBondContact O-CB 2.85Å; L592-I595 PolarHBondContact O-N 3.09Å
593	L	97.6	Very high	96.3	Very high	1 Å²	1	29.1 Å²	29.1	1%	0.005	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-16	178.7	-76.5	167.4	0	0	0	114.3	L579 V589 N591 I595 P596 I620 V623 V632 A635 C636 T639	L579-L593 HydrophobicContact CD1-CD2 4.37Å; L579-L593 HydrophobicContact CD2-CD2 4.27Å; L579-L593 HydrophobicContact CD2-CG 4.19Å; V589-L593 HydrophobicContact CG1-CD1 3.68Å; V589-L593 HydrophobicContact CG1-CG 4.13Å; V589-L593 WeakPolarHBondContact O-CB 2.53Å; V589-L593 WeakPolarHBondContact O-CD1 3.41Å; V589-L593 WeakPolarHBondContact O-CG 3.47Å; V589-L593 PolarHBondContact O-N 3.02Å; N591-L593 PolarHBondContact O-N 2.84Å; L593-I595 VanDerWaalsContact C-N 3.33Å; L593-P596 WeakPolarHBondContact O-CD 3.49Å; L593-I620 HydrophobicContact CD2-CD1 4.42Å; L593-I620 HydrophobicContact CD2-CG1 3.88Å; L593-I620 HydrophobicContact CD2-CG2 4.4Å; L593-V623 HydrophobicContact CD1-CG1 4.26Å; L593-V632 HydrophobicContact CD1-CG1 4.35Å; L593-A635 HydrophobicContact CB-CB 3.68Å; L593-A635 HydrophobicContact CD1-CB 4.06Å; L593-C636 WeakPolarHBondContact CD1-SG 3.47Å; L593-T639 PolarHBondContact O-OG1 3.14Å
594	Q	96.6	Very high	96.2	Very high	47 Å²	47	28.5 Å²	28.5	22%	0.22	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-25.8	173.3	-63.1	172.7	37.9	0	0	112.4	V530 N591 L592 Q597 Y598	V530-Q594 HydrophobicContact CG1-CB 4.33Å; N591-Q594 WeakPolarHBondContact O-CB 3.45Å; N591-Q594 PolarHBondContact O-N 3.13Å; N591-Q594 VanDerWaalsContact O-N 3.1Å; N591-Q594 PolarHBondContact OD1-NE2 3Å; L592-Q594 VanDerWaalsContact C-N 3.25Å; L592-Q594 PolarHBondContact O-N 2.98Å; Q594-Q597 VanDerWaalsContact O-CB 3.25Å; Q594-Q597 WeakPolarHBondContact O-CB 3.37Å; Q594-Q597 VanDerWaalsContact O-CG 3.31Å; Q594-Q597 WeakPolarHBondContact O-CG 3.5Å; Q594-Q597 PolarHBondContact O-N 3.38Å; Q594-Y598 HydrophobicContact CB-CE2 4.23Å; Q594-Y598 WeakPolarHBondContact O-CD2 3.5Å; Q594-Y598 WeakPolarHBondContact O-CE2 3.23Å
595	I	97.8	Very high	96.1	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.137	C	C	.	.	G	3₁₀ helix	trans	-55.6	-42.5	-170.2	-65.8	177	0	0	0	114	M529 V530 I533 F571 L575 L592 L593 Q597 Y598 F599	M529-I595 HydrophobicContact CE-CD1 4.23Å; V530-I595 HydrophobicContact CG2-CD1 4.04Å; V530-I595 HydrophobicContact CG2-CG1 3.97Å; I533-I595 HydrophobicContact CD1-CD1 3.76Å; I533-I595 HydrophobicContact CD1-CG1 3.83Å; I533-I595 HydrophobicContact CD1-CG2 4.21Å; F571-I595 HydrophobicContact CB-CG2 3.79Å; F571-I595 HydrophobicContact CD1-CD1 4.29Å; F571-I595 HydrophobicContact CD1-CG2 4.13Å; F571-I595 HydrophobicContact CD2-CG2 4.16Å; F571-I595 HydrophobicContact CE1-CD1 4.23Å; F571-I595 HydrophobicContact CG-CG2 3.76Å; L575-I595 HydrophobicContact CD1-CD1 4.33Å; L575-I595 HydrophobicContact CD2-CB 4.27Å; L575-I595 HydrophobicContact CD2-CG2 4.39Å; L592-I595 HydrophobicContact CD2-CD1 3.96Å; L592-I595 WeakPolarHBondContact O-CB 2.85Å; L592-I595 PolarHBondContact O-N 3.09Å; L593-I595 VanDerWaalsContact C-N 3.33Å; I595-Q597 PolarHBondContact O-N 3.22Å; I595-Y598 PolarHBondContact O-N 3.36Å; I595-F599 HydrophobicContact CG2-CE1 3.65Å; I595-F599 HydrophobicContact CG2-CZ 4.04Å; I595-F599 WeakPolarHBondContact O-CD1 3.37Å
596	P	96.4	Very high	95.9	Very high	3 Å²	3	29.6 Å²	29.6	2%	0.019	16%	0.157	C	C	.	.	G	3₁₀ helix	trans	-64.9	-18.6	178.3	-24.2	36.7	0	0	0	115.1	L575 L593 Y598 F599 L616 T639	L575-P596 HydrophobicContact CD2-CG 3.41Å; L575-P596 VanDerWaalsContact CD2-CG 3.41Å; L593-P596 WeakPolarHBondContact O-CD 3.49Å; P596-Y598 PolarHBondContact O-N 2.78Å; P596-F599 HydrophobicContact CB-CD2 4.09Å; P596-F599 HydrophobicContact CB-CE2 4.08Å; P596-F599 HydrophobicContact CG-CE2 4.33Å; P596-F599 WeakPolarHBondContact O-CB 3.49Å; P596-F599 PolarHBondContact O-N 3.22Å; P596-L616 HydrophobicContact CG-CD2 4.13Å; P596-T639 HydrophobicContact CB-CG2 3.89Å; P596-T639 HydrophobicContact CG-CG2 3.86Å
597	Q	94.3	Very high	95.7	Very high	58 Å²	58	30.1 Å²	30.1	27%	0.271	17%	0.165	S	C	.	.	G	3₁₀ helix	trans	-68.7	-19.4	-179.8	-51.9	-173.8	18.2	0	0	111.6	Q594 I595 T639 I642	Q594-Q597 VanDerWaalsContact O-CB 3.25Å; Q594-Q597 WeakPolarHBondContact O-CB 3.37Å; Q594-Q597 VanDerWaalsContact O-CG 3.31Å; Q594-Q597 WeakPolarHBondContact O-CG 3.5Å; Q594-Q597 PolarHBondContact O-N 3.38Å; I595-Q597 PolarHBondContact O-N 3.22Å; Q597-T639 WeakPolarHBondContact CG-OG1 3.32Å; Q597-T639 PolarHBondContact NE2-OG1 3.09Å; Q597-I642 HydrophobicContact CB-CD1 3.7Å; Q597-I642 HydrophobicContact CG-CD1 3.63Å
598	Y	96.4	Very high	95.6	Very high	30 Å²	30	34.9 Å²	34.9	12%	0.118	18%	0.178	C	C	.	.	G	3₁₀ helix	trans	-97.2	3	178	-52.4	-70.6	0	0	0	113.8	I533 R534 A537 E538 R564 Q594 I595 P596	I533-Y598 HydrophobicContact CG2-CD2 3.67Å; I533-Y598 HydrophobicContact CG2-CE2 4.44Å; I533-Y598 HydrophobicContact CG2-CG 4.03Å; R534-Y598 HydrophobicContact CB-CE1 3.98Å; R534-Y598 HydrophobicContact CB-CE2 4.34Å; R534-Y598 WeakPolarHBondContact CD-OH 3.44Å; R534-Y598 HydrophobicContact CG-CE1 3.87Å; A537-Y598 HydrophobicContact CB-CD1 3.81Å; A537-Y598 HydrophobicContact CB-CG 4.07Å; E538-Y598 HydrophobicContact CG-CE1 4.37Å; R564-Y598 VanDerWaalsContact CG-O 3.29Å; R564-Y598 WeakPolarHBondContact CG-O 3.28Å; Q594-Y598 HydrophobicContact CB-CE2 4.23Å; Q594-Y598 WeakPolarHBondContact O-CD2 3.5Å; Q594-Y598 WeakPolarHBondContact O-CE2 3.23Å; I595-Y598 PolarHBondContact O-N 3.36Å; P596-Y598 PolarHBondContact O-N 2.78Å
599	F	96.1	Very high	95.4	Very high	10 Å²	10	37.4 Å²	37.4	4%	0.044	19%	0.19	C	C	.	.	S	Bend	trans	-76	155.9	-174.3	-75	0.1	0	0	0	114.4	L567 T568 F571 I572 I595 P596 L601 Y604	L567-F599 HydrophobicContact CD1-CD1 3.83Å; L567-F599 HydrophobicContact CD1-CE1 4.1Å; T568-F599 HydrophobicContact CG2-CB 3.95Å; T568-F599 HydrophobicContact CG2-CD1 4.34Å; T568-F599 HydrophobicContact CG2-CD2 4.33Å; T568-F599 HydrophobicContact CG2-CG 3.97Å; T568-F599 WeakPolarHBondContact OG1-CA 3.31Å; F571-F599 HydrophobicContact CB-CE1 3.67Å; F571-F599 HydrophobicContact CB-CZ 3.63Å; I572-F599 HydrophobicContact CG1-CD2 4.16Å; I572-F599 HydrophobicContact CG1-CE2 3.81Å; I572-F599 HydrophobicContact CG1-CZ 4.4Å; I595-F599 HydrophobicContact CG2-CE1 3.65Å; I595-F599 HydrophobicContact CG2-CZ 4.04Å; I595-F599 WeakPolarHBondContact O-CD1 3.37Å; P596-F599 HydrophobicContact CB-CD2 4.09Å; P596-F599 HydrophobicContact CB-CE2 4.08Å; P596-F599 HydrophobicContact CG-CE2 4.33Å; P596-F599 WeakPolarHBondContact O-CB 3.49Å; P596-F599 PolarHBondContact O-N 3.22Å; F599-L601 HydrophobicContact CB-CD2 3.84Å; F599-L601 HydrophobicContact CD2-CD2 4.37Å; F599-Y604 HydrophobicContact CD2-CE2 4.12Å
600	D	95.1	Very high	95.2	Very high	22 Å²	22	40.5 Å²	40.5	12%	0.118	21%	0.205	C	C	.	.			trans	-88.6	95.3	157.7	-162.1	-36.7	0	0	0	110.2	R564 T568 E602 I603	R564-D600 IonicContact CZ-OD2 2.58Å; R564-D600 IonicContact NE-OD2 2.75Å; R564-D600 VanDerWaalsContact NH2-CG 3.27Å; R564-D600 IonicContact NH2-OD1 3.93Å; R564-D600 IonicContact NH2-OD2 3.4Å; R564-D600 PolarHBondContact NH2-OD2 2.85Å; T568-D600 PolarHBondContact OG1-N 2.96Å; D600-E602 PolarHBondContact O-N 3.49Å; D600-E602 VanDerWaalsContact O-N 3.1Å; D600-E602 PolarHBondContact OD1-N 3.33Å; D600-I603 HydrophobicContact CB-CD1 3.89Å; D600-I603 HydrophobicContact CB-CG1 4.13Å; D600-I603 WeakPolarHBondContact O-CB 3.5Å; D600-I603 PolarHBondContact O-N 3.1Å
601	L	95.2	Very high	95.2	Very high	4 Å²	4	47.4 Å²	47.4	2%	0.021	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-12.6	-171.8	-61.6	-179	0	0	0	114.2	F599 I603 Y604 I642 L643 Y648 I650	F599-L601 HydrophobicContact CB-CD2 3.84Å; F599-L601 HydrophobicContact CD2-CD2 4.37Å; L601-I603 PolarHBondContact O-N 2.94Å; L601-Y604 HydrophobicContact CD2-CD2 4Å; L601-Y604 HydrophobicContact CD2-CE2 3.88Å; L601-Y604 PolarHBondContact O-N 2.98Å; L601-I642 HydrophobicContact CD1-CG2 4.01Å; L601-I642 WeakPolarHBondContact CD1-O 3.4Å; L601-L643 HydrophobicContact CD1-CD2 4.45Å; L601-L643 HydrophobicContact CD2-CD2 3.74Å; L601-Y648 HydrophobicContact CB-CD1 3.8Å; L601-Y648 HydrophobicContact CB-CD2 3.85Å; L601-Y648 HydrophobicContact CB-CE1 3.91Å; L601-Y648 HydrophobicContact CB-CE2 3.95Å; L601-Y648 HydrophobicContact CB-CG 3.76Å; L601-Y648 HydrophobicContact CD1-CD2 3.7Å; L601-Y648 HydrophobicContact CD1-CE2 3.78Å; L601-Y648 HydrophobicContact CD1-CG 4.38Å; L601-Y648 HydrophobicContact CG-CD2 4.36Å; L601-Y648 HydrophobicContact CG-CE2 4.28Å; L601-I650 HydrophobicContact CB-CD1 4.34Å; L601-I650 HydrophobicContact CD1-CD1 4.39Å; L601-I650 HydrophobicContact CD2-CD1 4.35Å
602	E	94.1	Very high	95.1	Very high	121 Å²	121	48.6 Å²	48.6	57%	0.565	24%	0.238	S	C	*	.	H	α-helix	trans	-63.9	-26.6	169.8	-64.4	-165.6	-171.3	0	0	112.4	D600 Y604 S605 T606 Y648	D600-E602 PolarHBondContact O-N 3.49Å; D600-E602 VanDerWaalsContact O-N 3.1Å; D600-E602 PolarHBondContact OD1-N 3.33Å; E602-Y604 VanDerWaalsContact C-N 3.26Å; E602-Y604 PolarHBondContact O-N 3.44Å; E602-S605 PolarHBondContact O-N 2.87Å; E602-T606 WeakPolarHBondContact O-CB 3.5Å; E602-T606 WeakPolarHBondContact O-CG2 3.44Å; E602-T606 PolarHBondContact O-N 3.04Å; E602-T606 PolarHBondContact O-OG1 3.43Å; E602-Y648 HydrophobicContact CG-CD1 4.15Å; E602-Y648 HydrophobicContact CG-CE1 3.94Å
603	I	95.4	Very high	95	Very high	17 Å²	17	48.6 Å²	48.6	9%	0.087	24%	0.238	C	C	.	.	H	α-helix	trans	-65.8	-28.2	-177.5	-63.5	-178.3	0	0	0	111.6	N565 T568 E569 I572 D600 L601 S605 T606 G607	N565-I603 HydrophobicContact CB-CD1 4.17Å; T568-I603 HydrophobicContact CG2-CB 3.92Å; T568-I603 HydrophobicContact CG2-CD1 3.9Å; T568-I603 HydrophobicContact CG2-CG1 4.35Å; T568-I603 HydrophobicContact CG2-CG2 4.19Å; E569-I603 HydrophobicContact CG-CD1 4.38Å; E569-I603 HydrophobicContact CG-CG2 4.13Å; I572-I603 HydrophobicContact CD1-CB 4.41Å; I572-I603 HydrophobicContact CD1-CG2 4.04Å; D600-I603 HydrophobicContact CB-CD1 3.89Å; D600-I603 HydrophobicContact CB-CG1 4.13Å; D600-I603 WeakPolarHBondContact O-CB 3.5Å; D600-I603 PolarHBondContact O-N 3.1Å; L601-I603 PolarHBondContact O-N 2.94Å; I603-S605 PolarHBondContact O-N 3.34Å; I603-T606 WeakPolarHBondContact CA-OG1 3.31Å; I603-G607 WeakPolarHBondContact O-CA 3.42Å; I603-G607 PolarHBondContact O-N 3.24Å
604	Y	95.1	Very high	95	Very high	1 Å²	1	52.1 Å²	52.1	0%	0.004	26%	0.256	C	S	.	.	H	α-helix	trans	-59	-44.3	174.2	-85.1	-63.7	0	0	0	112.8	I572 F599 L601 E602 R608 M609 L613 L616 L643 I650	I572-Y604 HydrophobicContact CB-CE1 4.36Å; I572-Y604 HydrophobicContact CD1-CD1 3.87Å; I572-Y604 HydrophobicContact CD1-CD2 4.21Å; I572-Y604 HydrophobicContact CD1-CE1 3.83Å; I572-Y604 HydrophobicContact CD1-CE2 4.18Å; I572-Y604 HydrophobicContact CD1-CG 4.06Å; I572-Y604 HydrophobicContact CG1-CD1 4.29Å; I572-Y604 HydrophobicContact CG1-CE1 3.72Å; I572-Y604 HydrophobicContact CG1-CE2 4.24Å; I572-Y604 HydrophobicContact CG2-CD1 4.33Å; I572-Y604 HydrophobicContact CG2-CE1 3.88Å; F599-Y604 HydrophobicContact CD2-CE2 4.12Å; L601-Y604 HydrophobicContact CD2-CD2 4Å; L601-Y604 HydrophobicContact CD2-CE2 3.88Å; L601-Y604 PolarHBondContact O-N 2.98Å; E602-Y604 VanDerWaalsContact C-N 3.26Å; E602-Y604 PolarHBondContact O-N 3.44Å; Y604-R608 PolarHBondContact O-N 3.45Å; Y604-M609 HydrophobicContact CD1-CB 4.14Å; Y604-M609 PolarHBondContact O-N 3.26Å; Y604-L613 HydrophobicContact CD1-CB 3.84Å; Y604-L613 HydrophobicContact CE1-CB 3.68Å; Y604-L613 HydrophobicContact CE1-CD1 4.32Å; Y604-L613 HydrophobicContact CE2-CD1 4.26Å; Y604-L616 WeakPolarHBondContact OH-CD2 3.46Å; Y604-L643 HydrophobicContact CE2-CD2 4.21Å; Y604-I650 HydrophobicContact CD2-CD1 4.04Å; Y604-I650 HydrophobicContact CG-CG2 4.45Å
605	S	92.1	Very high	95	Very high	35 Å²	35	51.8 Å²	51.8	25%	0.245	26%	0.261	C	S	.	.	H	α-helix	trans	-89.9	-38.8	-177.4	-60.8	0	0	0	0	112.8	E602 I603 R608 T649	E602-S605 PolarHBondContact O-N 2.87Å; I603-S605 PolarHBondContact O-N 3.34Å; S605-R608 PolarHBondContact O-N 2.79Å; S605-T649 WeakPolarHBondContact CB-OG1 3.27Å; S605-T649 PolarHBondContact OG-OG1 2.64Å
606	T	93.3	Very high	95	Very high	102 Å²	102	51.9 Å²	51.9	63%	0.626	26%	0.262	S	S	*	.	H	α-helix	trans	-72.4	-37.4	179.5	56.5	0	0	0	0	112.1	E602 I603	E602-T606 WeakPolarHBondContact O-CB 3.5Å; E602-T606 WeakPolarHBondContact O-CG2 3.44Å; E602-T606 PolarHBondContact O-N 3.04Å; E602-T606 PolarHBondContact O-OG1 3.43Å; I603-T606 WeakPolarHBondContact CA-OG1 3.31Å
607	G	91.6	Very high	95.1	Very high	37 Å²	37	52.1 Å²	52.1	38%	0.381	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-7.1	175.1	0	0	0	0	0	115.2	I603	I603-G607 WeakPolarHBondContact O-CA 3.42Å; I603-G607 PolarHBondContact O-N 3.24Å
608	R	92.8	Very high	95.2	Very high	208 Å²	208	57.1 Å²	57.1	79%	0.785	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.8	45.9	-174.7	-53.2	179.3	-176.6	171.6	1.1	113.5	Y604 S605 E610	Y604-R608 PolarHBondContact O-N 3.45Å; S605-R608 PolarHBondContact O-N 2.79Å; R608-E610 VanDerWaalsContact CA-OE2 3.23Å; R608-E610 WeakPolarHBondContact CA-OE2 3.25Å
609	M	93.6	Very high	95.3	Very high	54 Å²	54	57.4 Å²	57.4	27%	0.266	29%	0.286	S	S	.	.			trans	-100.8	18.2	-177.4	-58.2	-63.2	-176.2	0	0	112.5	I572 Y604 K611 H612 L613	I572-M609 HydrophobicContact CG2-CB 3.67Å; I572-M609 HydrophobicContact CG2-CG 4.03Å; Y604-M609 HydrophobicContact CD1-CB 4.14Å; Y604-M609 PolarHBondContact O-N 3.26Å; M609-K611 PolarHBondContact O-N 3.41Å; M609-K611 VanDerWaalsContact O-N 3.15Å; M609-H612 WeakPolarHBondContact O-CA 3.37Å; M609-H612 WeakPolarHBondContact O-CB 3.4Å; M609-H612 PolarHBondContact O-N 3.16Å; M609-L613 PolarHBondContact O-N 2.94Å
610	E	93.4	Very high	95.3	Very high	66 Å²	66	57 Å²	57	31%	0.308	28%	0.284	S	S	.	.	H	α-helix	trans	-64	-25.7	-173.3	-44.9	91.8	145.3	0	0	112.3	R608 H612 L613 D614 R653	R608-E610 VanDerWaalsContact CA-OE2 3.23Å; R608-E610 WeakPolarHBondContact CA-OE2 3.25Å; E610-H612 VanDerWaalsContact C-N 3.27Å; E610-H612 PolarHBondContact O-N 3.48Å; E610-L613 WeakPolarHBondContact O-CB 3.45Å; E610-L613 PolarHBondContact O-N 2.97Å; E610-D614 PolarHBondContact O-N 3.41Å; E610-R653 PolarHBondContact O-NH1 3.14Å
611	K	95.9	Very high	95.4	Very high	158 Å²	158	58.1 Å²	58.1	69%	0.687	29%	0.289	S	S	*	.	H	α-helix	trans	-60.1	-35	168.9	-178.6	-165	168.2	-157.4	0	112.6	M609 A615	M609-K611 PolarHBondContact O-N 3.41Å; M609-K611 VanDerWaalsContact O-N 3.15Å; K611-A615 PolarHBondContact O-N 2.99Å; K611-A615 VanDerWaalsContact O-N 3.16Å
612	H	96.4	Very high	95.5	Very high	47 Å²	47	62.2 Å²	62.2	22%	0.218	31%	0.306	C	S	.	.	H	α-helix	trans	-78	-30.6	177.7	-70.2	-95.6	0	0	0	111.4	I572 M609 E610 A615 L616	I572-H612 HydrophobicContact CG2-CB 3.74Å; I572-H612 WeakPolarHBondContact O-CB 3.42Å; M609-H612 WeakPolarHBondContact O-CA 3.37Å; M609-H612 WeakPolarHBondContact O-CB 3.4Å; M609-H612 PolarHBondContact O-N 3.16Å; E610-H612 VanDerWaalsContact C-N 3.27Å; E610-H612 PolarHBondContact O-N 3.48Å; H612-A615 PolarHBondContact O-N 3.26Å; H612-L616 WeakPolarHBondContact O-CB 3.37Å; H612-L616 PolarHBondContact O-N 2.92Å
613	L	96.4	Very high	95.6	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-62.1	-45.3	166.4	-177.6	61.4	0	0	0	111.3	Y604 M609 E610 A615 L616 L617 L643 I650 V654	Y604-L613 HydrophobicContact CD1-CB 3.84Å; Y604-L613 HydrophobicContact CE1-CB 3.68Å; Y604-L613 HydrophobicContact CE1-CD1 4.32Å; Y604-L613 HydrophobicContact CE2-CD1 4.26Å; M609-L613 PolarHBondContact O-N 2.94Å; E610-L613 WeakPolarHBondContact O-CB 3.45Å; E610-L613 PolarHBondContact O-N 2.97Å; L613-A615 VanDerWaalsContact C-N 3.25Å; L613-A615 PolarHBondContact O-N 3.02Å; L613-L616 PolarHBondContact O-N 3.24Å; L613-L616 VanDerWaalsContact O-N 3.15Å; L613-L617 HydrophobicContact CD1-CD1 4.23Å; L613-L617 HydrophobicContact CD1-CD2 4.42Å; L613-L617 HydrophobicContact CD1-CG 4.09Å; L613-L617 HydrophobicContact CG-CD1 3.99Å; L613-L617 HydrophobicContact CG-CG 4.31Å; L613-L617 VanDerWaalsContact O-CG 3.29Å; L613-L617 WeakPolarHBondContact O-CG 3.27Å; L613-L617 PolarHBondContact O-N 2.9Å; L613-L643 HydrophobicContact CD1-CD1 4.42Å; L613-L643 HydrophobicContact CD1-CD2 4.21Å; L613-I650 HydrophobicContact CD2-CB 3.71Å; L613-I650 HydrophobicContact CD2-CD1 4.15Å; L613-I650 HydrophobicContact CD2-CG1 4.48Å; L613-I650 HydrophobicContact CD2-CG2 3.84Å; L613-V654 HydrophobicContact CD1-CG2 4.26Å; L613-V654 HydrophobicContact CD2-CG2 3.98Å; L613-V654 HydrophobicContact CG-CG2 4.48Å
614	D	96.3	Very high	95.7	Very high	74 Å²	74	55.7 Å²	55.7	40%	0.396	28%	0.275	S	S	.	.	H	α-helix	trans	-58.2	-39.1	175.2	-63.1	-25.8	0	0	0	112	E610 K618 R653	E610-D614 PolarHBondContact O-N 3.41Å; D614-K618 WeakPolarHBondContact O-CB 3.36Å; D614-K618 PolarHBondContact O-N 2.98Å; D614-R653 WeakPolarHBondContact OD1-CD 3.5Å; D614-R653 IonicContact OD1-CZ 2.7Å; D614-R653 IonicContact OD1-NE 3.53Å; D614-R653 IonicContact OD1-NH1 3.83Å; D614-R653 PolarHBondContact OD1-NH1 3.41Å; D614-R653 IonicContact OD2-CZ 3.51Å; D614-R653 IonicContact OD2-NH1 2.74Å; D614-R653 PolarHBondContact OD2-NH1 3.36Å
615	A	97.8	Very high	95.7	Very high	40 Å²	40	58.8 Å²	58.8	33%	0.331	29%	0.29	S	S	.	.	H	α-helix	trans	-67.9	-42.7	175.7	0	0	0	0	0	112.2	P576 K611 H612 L613 K618 Q619	P576-A615 HydrophobicContact CB-CB 4.04Å; P576-A615 HydrophobicContact CG-CB 4.33Å; K611-A615 PolarHBondContact O-N 2.99Å; K611-A615 VanDerWaalsContact O-N 3.16Å; H612-A615 PolarHBondContact O-N 3.26Å; L613-A615 VanDerWaalsContact C-N 3.25Å; L613-A615 PolarHBondContact O-N 3.02Å; A615-K618 PolarHBondContact O-N 3.19Å; A615-Q619 WeakPolarHBondContact O-CG 3.23Å; A615-Q619 PolarHBondContact O-N 3.13Å; A615-Q619 VanDerWaalsContact O-N 3.13Å
616	L	97.7	Very high	95.8	Very high	2 Å²	2	61.5 Å²	61.5	1%	0.01	30%	0.297	C	S	.	.	H	α-helix	trans	-61.3	-53.2	176.3	-179.8	58.8	0	0	0	111.2	L575 P576 L579 P596 Y604 H612 L613 K618 Q619 I620 L643	L575-L616 HydrophobicContact CD2-CD1 3.87Å; L575-L616 HydrophobicContact CG-CD1 4.13Å; P576-L616 HydrophobicContact CG-CB 4.11Å; L579-L616 HydrophobicContact CD1-CD1 3.64Å; P596-L616 HydrophobicContact CG-CD2 4.13Å; Y604-L616 WeakPolarHBondContact OH-CD2 3.46Å; H612-L616 WeakPolarHBondContact O-CB 3.37Å; H612-L616 PolarHBondContact O-N 2.92Å; L613-L616 PolarHBondContact O-N 3.24Å; L613-L616 VanDerWaalsContact O-N 3.15Å; L616-K618 PolarHBondContact O-N 3.49Å; L616-Q619 PolarHBondContact O-N 2.89Å; L616-I620 HydrophobicContact CD1-CD1 4.02Å; L616-I620 HydrophobicContact CD1-CG1 4.12Å; L616-I620 HydrophobicContact CG-CD1 3.86Å; L616-I620 HydrophobicContact CG-CG1 4.35Å; L616-I620 WeakPolarHBondContact O-CG1 3.45Å; L616-I620 PolarHBondContact O-N 3.46Å; L616-L643 HydrophobicContact CD2-CD1 4.22Å
617	L	97.6	Very high	96	Very high	9 Å²	9	57 Å²	57	5%	0.047	27%	0.269	C	S	.	.	H	α-helix	trans	-57.5	-37.9	180	-64.8	171.9	0	0	0	111.9	L613 I620 K621 Y640 L643 V654 A657	L613-L617 HydrophobicContact CD1-CD1 4.23Å; L613-L617 HydrophobicContact CD1-CD2 4.42Å; L613-L617 HydrophobicContact CD1-CG 4.09Å; L613-L617 HydrophobicContact CG-CD1 3.99Å; L613-L617 HydrophobicContact CG-CG 4.31Å; L613-L617 VanDerWaalsContact O-CG 3.29Å; L613-L617 WeakPolarHBondContact O-CG 3.27Å; L613-L617 PolarHBondContact O-N 2.9Å; L617-I620 PolarHBondContact O-N 3.17Å; L617-K621 PolarHBondContact O-N 2.93Å; L617-Y640 HydrophobicContact CD2-CD1 4.45Å; L617-Y640 HydrophobicContact CD2-CE1 3.82Å; L617-L643 HydrophobicContact CD2-CD1 4.37Å; L617-V654 HydrophobicContact CD1-CG2 4.22Å; L617-V654 HydrophobicContact CD2-CG1 3.92Å; L617-V654 HydrophobicContact CD2-CG2 4.4Å; L617-A657 HydrophobicContact CB-CB 4.48Å; L617-A657 HydrophobicContact CD1-CB 4.1Å
618	K	97.2	Very high	96.1	Very high	162 Å²	162	56.6 Å²	56.6	70%	0.704	26%	0.259	S	S	*	.	H	α-helix	trans	-64.7	-39.8	174.4	-174.8	179.8	176.8	-174.2	0	112.8	D614 A615 L616 F622	D614-K618 WeakPolarHBondContact O-CB 3.36Å; D614-K618 PolarHBondContact O-N 2.98Å; A615-K618 PolarHBondContact O-N 3.19Å; L616-K618 PolarHBondContact O-N 3.49Å; K618-F622 PolarHBondContact O-N 3.47Å; K618-F622 VanDerWaalsContact O-N 3.15Å
619	Q	97.7	Very high	96.3	Very high	37 Å²	37	50.3 Å²	50.3	17%	0.173	24%	0.239	C	C	.	.	H	α-helix	trans	-70.5	-41.2	176.8	-65.6	-67.1	0.7	0	0	111.6	P576 L579 S580 A615 L616 K621 F622 V623	P576-Q619 HydrophobicContact CB-CG 4.45Å; P576-Q619 PolarHBondContact O-NE2 2.98Å; L579-Q619 HydrophobicContact CB-CB 4.07Å; L579-Q619 HydrophobicContact CB-CG 4.49Å; L579-Q619 HydrophobicContact CD1-CB 4.28Å; S580-Q619 PolarHBondContact OG-NE2 3.24Å; S580-Q619 VanDerWaalsContact OG-NE2 3.09Å; A615-Q619 WeakPolarHBondContact O-CG 3.23Å; A615-Q619 PolarHBondContact O-N 3.13Å; A615-Q619 VanDerWaalsContact O-N 3.13Å; L616-Q619 PolarHBondContact O-N 2.89Å; Q619-K621 PolarHBondContact O-N 3.11Å; Q619-F622 PolarHBondContact O-N 2.9Å; Q619-V623 WeakPolarHBondContact O-CG2 3.28Å; Q619-V623 PolarHBondContact O-N 2.62Å
620	I	97.2	Very high	96.3	Very high	0 Å²	0	51 Å²	51	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-61.1	-44.8	175.5	-57.3	171.8	0	0	0	110	L593 L616 L617 F622 V623 V624 C636 T639 Y640 L643	L593-I620 HydrophobicContact CD2-CD1 4.42Å; L593-I620 HydrophobicContact CD2-CG1 3.88Å; L593-I620 HydrophobicContact CD2-CG2 4.4Å; L616-I620 HydrophobicContact CD1-CD1 4.02Å; L616-I620 HydrophobicContact CD1-CG1 4.12Å; L616-I620 HydrophobicContact CG-CD1 3.86Å; L616-I620 HydrophobicContact CG-CG1 4.35Å; L616-I620 WeakPolarHBondContact O-CG1 3.45Å; L616-I620 PolarHBondContact O-N 3.46Å; L617-I620 PolarHBondContact O-N 3.17Å; I620-F622 PolarHBondContact O-N 2.88Å; I620-V623 PolarHBondContact O-N 3.48Å; I620-V624 HydrophobicContact CG2-CG2 4.37Å; I620-V624 WeakPolarHBondContact O-CG2 3.47Å; I620-V624 PolarHBondContact O-N 3Å; I620-C636 HydrophobicContact CG2-CB 3.98Å; I620-T639 HydrophobicContact CD1-CG2 3.98Å; I620-Y640 HydrophobicContact CB-CE2 4.13Å; I620-Y640 HydrophobicContact CG2-CD2 3.79Å; I620-Y640 HydrophobicContact CG2-CE2 3.49Å; I620-Y640 VanDerWaalsContact CG2-CE2 3.49Å; I620-L643 HydrophobicContact CD1-CD1 4.45Å
621	K	96.9	Very high	96.3	Very high	47 Å²	47	53.2 Å²	53.2	20%	0.204	26%	0.263	C	S	.	.	H	α-helix	trans	-54.2	-49.7	173	169.7	158.4	-174.4	168.4	0	112.2	L617 Q619 V623 V624 E625 L661 E664	L617-K621 PolarHBondContact O-N 2.93Å; Q619-K621 PolarHBondContact O-N 3.11Å; K621-V623 VanDerWaalsContact C-N 3.3Å; K621-V623 PolarHBondContact O-N 3.04Å; K621-V624 PolarHBondContact O-N 3.12Å; K621-E625 WeakPolarHBondContact CE-OE1 3.46Å; K621-E625 HydrophobicContact CG-CG 4.35Å; K621-E625 IonicContact NZ-OE1 3.5Å; K621-E625 WeakPolarHBondContact O-CG 3.22Å; K621-E625 PolarHBondContact O-N 3.01Å; K621-L661 HydrophobicContact CB-CD1 4.33Å; K621-L661 HydrophobicContact CD-CD1 3.93Å; K621-L661 HydrophobicContact CG-CD1 3.79Å; K621-E664 IonicContact NZ-OE1 3.88Å; K621-E664 PolarHBondContact NZ-OE1 2.91Å; K621-E664 IonicContact NZ-OE2 3.77Å; K621-E664 PolarHBondContact NZ-OE2 2.83Å
622	F	96.8	Very high	96.3	Very high	90 Å²	90	45.8 Å²	45.8	40%	0.395	23%	0.231	S	C	.	.	H	α-helix	trans	-61.7	-36.5	179.7	179.4	-110.3	0	0	0	112.8	K618 Q619 I620 K626	K618-F622 PolarHBondContact O-N 3.47Å; K618-F622 VanDerWaalsContact O-N 3.15Å; Q619-F622 PolarHBondContact O-N 2.9Å; I620-F622 PolarHBondContact O-N 2.88Å; F622-K626 HydrophobicContact CE1-CD 4.22Å; F622-K626 HydrophobicContact CZ-CD 4.19Å; F622-K626 VanDerWaalsContact O-CB 3.27Å; F622-K626 WeakPolarHBondContact O-CB 3.44Å; F622-K626 PolarHBondContact O-N 3.16Å
623	V	97.2	Very high	96.4	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-63.4	-51.2	173	167.8	0	0	0	0	111	V589 L593 Q619 I620 K621 E625 K626 H627 V632	V589-V623 HydrophobicContact CG1-CB 4.34Å; V589-V623 HydrophobicContact CG1-CG1 3.55Å; V589-V623 HydrophobicContact CG1-CG2 3.79Å; L593-V623 HydrophobicContact CD1-CG1 4.26Å; Q619-V623 WeakPolarHBondContact O-CG2 3.28Å; Q619-V623 PolarHBondContact O-N 2.62Å; I620-V623 PolarHBondContact O-N 3.48Å; K621-V623 VanDerWaalsContact C-N 3.3Å; K621-V623 PolarHBondContact O-N 3.04Å; V623-E625 VanDerWaalsContact C-N 3.31Å; V623-E625 PolarHBondContact O-N 2.98Å; V623-K626 PolarHBondContact O-N 3.32Å; V623-H627 WeakPolarHBondContact O-CB 3.33Å; V623-H627 PolarHBondContact O-N 3.09Å; V623-V632 HydrophobicContact CG1-CG1 3.38Å
624	V	96.6	Very high	96.3	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-62.6	-37.2	-179.2	-178	0	0	0	0	111.9	I620 K621 K626 L633 C636 F665 R697 F701	I620-V624 HydrophobicContact CG2-CG2 4.37Å; I620-V624 WeakPolarHBondContact O-CG2 3.47Å; I620-V624 PolarHBondContact O-N 3Å; K621-V624 PolarHBondContact O-N 3.12Å; V624-K626 VanDerWaalsContact C-N 3.27Å; V624-K626 PolarHBondContact O-N 3.32Å; V624-L633 HydrophobicContact CG1-CD2 3.95Å; V624-C636 HydrophobicContact CG2-CB 3.51Å; V624-C636 WeakPolarHBondContact CG2-SG 3.46Å; V624-F665 HydrophobicContact CB-CE2 4.44Å; V624-F665 HydrophobicContact CB-CZ 4.49Å; V624-F665 HydrophobicContact CG1-CE2 3.49Å; V624-F665 VanDerWaalsContact CG1-CE2 3.49Å; V624-F665 HydrophobicContact CG1-CZ 3.78Å; V624-R697 HydrophobicContact CG1-CB 4.33Å; V624-R697 HydrophobicContact CG1-CG 4.06Å; V624-R697 WeakPolarHBondContact O-CD 3.39Å; V624-R697 PolarHBondContact O-NE 3.21Å; V624-F701 HydrophobicContact CG1-CE2 3.92Å; V624-F701 HydrophobicContact CG2-CE2 3.84Å; V624-F701 HydrophobicContact CG2-CZ 3.95Å
625	E	94.7	Very high	96.3	Very high	66 Å²	66	43 Å²	43	31%	0.308	22%	0.217	S	C	.	.	H	α-helix	trans	-62.7	-33.4	174.6	-75.3	176	156.5	0	0	113.1	K621 V623 F665 R697	K621-E625 WeakPolarHBondContact CE-OE1 3.46Å; K621-E625 HydrophobicContact CG-CG 4.35Å; K621-E625 IonicContact NZ-OE1 3.5Å; K621-E625 WeakPolarHBondContact O-CG 3.22Å; K621-E625 PolarHBondContact O-N 3.01Å; V623-E625 VanDerWaalsContact C-N 3.31Å; V623-E625 PolarHBondContact O-N 2.98Å; E625-F665 HydrophobicContact CG-CE1 4.41Å; E625-F665 HydrophobicContact CG-CZ 4.1Å; E625-R697 PolarHBondContact O-NH2 3.23Å
626	K	95.2	Very high	96.3	Very high	92 Å²	92	41.1 Å²	41.1	40%	0.4	20%	0.201	S	C	.	.	H	α-helix	trans	-92.8	-37.7	-171.7	-177.4	173.5	172.9	-175.4	0	113.7	S583 F622 V623 V624	S583-K626 VanDerWaalsContact O-CD 3.29Å; S583-K626 WeakPolarHBondContact O-CD 3.41Å; S583-K626 VanDerWaalsContact O-CE 3.22Å; S583-K626 WeakPolarHBondContact O-CE 3.41Å; S583-K626 PolarHBondContact O-NZ 3.5Å; F622-K626 HydrophobicContact CE1-CD 4.22Å; F622-K626 HydrophobicContact CZ-CD 4.19Å; F622-K626 VanDerWaalsContact O-CB 3.27Å; F622-K626 WeakPolarHBondContact O-CB 3.44Å; F622-K626 PolarHBondContact O-N 3.16Å; V623-K626 PolarHBondContact O-N 3.32Å; V624-K626 VanDerWaalsContact C-N 3.27Å; V624-K626 PolarHBondContact O-N 3.32Å
627	H	96.4	Very high	96.3	Very high	7 Å²	7	41.1 Å²	41.1	3%	0.032	20%	0.202	C	C	.	.			trans	-92	161.1	-173.8	-78	-80.3	0	0	0	113.3	S583 V623 E629 V632 R697	S583-H627 PolarHBondContact O-NE2 3.28Å; V623-H627 WeakPolarHBondContact O-CB 3.33Å; V623-H627 PolarHBondContact O-N 3.09Å; H627-E629 WeakPolarHBondContact CA-OE2 3.43Å; H627-E629 WeakPolarHBondContact CB-OE2 3.39Å; H627-E629 IonicContact CG-OE2 2.9Å; H627-E629 IonicContact ND1-OE1 3.39Å; H627-E629 IonicContact ND1-OE2 2.98Å; H627-E629 PolarHBondContact ND1-OE2 2.71Å; H627-V632 HydrophobicContact CB-CB 4.23Å; H627-V632 HydrophobicContact CB-CG1 3.71Å; H627-R697 PolarHBondContact O-NE 3.35Å; H627-R697 PolarHBondContact O-NH2 3.39Å
628	V	95.4	Very high	96.2	Very high	30 Å²	30	42.6 Å²	42.6	18%	0.182	21%	0.207	C	C	.	.			trans	-140.8	-1.3	177.9	-62.2	0	0	0	0	113.1	K696	V628-K696 WeakPolarHBondContact O-CD 3.45Å
629	E	95.9	Very high	96.1	Very high	76 Å²	76	34.9 Å²	34.9	36%	0.355	17%	0.174	S	C	.	.			trans	-74.5	139.8	178.8	-58.7	82.2	173.9	0	0	110.4	A586 H627 D631 V632 L633	A586-E629 HydrophobicContact CB-CB 4.32Å; A586-E629 HydrophobicContact CB-CG 3.91Å; H627-E629 WeakPolarHBondContact CA-OE2 3.43Å; H627-E629 WeakPolarHBondContact CB-OE2 3.39Å; H627-E629 IonicContact CG-OE2 2.9Å; H627-E629 IonicContact ND1-OE1 3.39Å; H627-E629 IonicContact ND1-OE2 2.98Å; H627-E629 PolarHBondContact ND1-OE2 2.71Å; E629-D631 PolarHBondContact O-N 3.32Å; E629-V632 HydrophobicContact CB-CG2 4.16Å; E629-V632 PolarHBondContact O-N 3.09Å; E629-L633 WeakPolarHBondContact O-CG 3.4Å; E629-L633 PolarHBondContact O-N 2.66Å
630	S	92.9	Very high	96	Very high	69 Å²	69	33.2 Å²	33.2	48%	0.483	17%	0.166	S	C	.	.	H	α-helix	trans	-61.5	-47.2	-170.6	-159.9	0	0	0	0	111.8	V632 L633 E634	S630-V632 VanDerWaalsContact C-N 3.33Å; S630-V632 PolarHBondContact O-N 2.74Å; S630-L633 PolarHBondContact O-N 2.67Å; S630-E634 WeakPolarHBondContact O-CB 3.5Å; S630-E634 PolarHBondContact O-N 3.13Å
631	D	94	Very high	95.9	Very high	112 Å²	112	34 Å²	34	60%	0.599	17%	0.172	S	C	*	.	H	α-helix	trans	-68.5	-34.8	-171.2	-36.9	-70.3	0	0	0	111.5	A590 E629 A635	A590-D631 HydrophobicContact CB-CB 4.25Å; E629-D631 PolarHBondContact O-N 3.32Å; D631-A635 WeakPolarHBondContact O-CB 3.4Å; D631-A635 PolarHBondContact O-N 2.76Å
632	V	97.2	Very high	95.7	Very high	1 Å²	1	33.8 Å²	33.8	1%	0.006	17%	0.172	C	C	.	.	H	α-helix	trans	-66.7	-47.7	173.9	-179.2	0	0	0	0	110.6	A586 V589 A590 L593 V623 H627 E629 S630 A635 C636	A586-V632 HydrophobicContact CB-CG2 3.69Å; A586-V632 WeakPolarHBondContact O-CG2 3.3Å; V589-V632 HydrophobicContact CG1-CG1 4.18Å; A590-V632 HydrophobicContact CB-CG2 4.13Å; L593-V632 HydrophobicContact CD1-CG1 4.35Å; V623-V632 HydrophobicContact CG1-CG1 3.38Å; H627-V632 HydrophobicContact CB-CB 4.23Å; H627-V632 HydrophobicContact CB-CG1 3.71Å; E629-V632 HydrophobicContact CB-CG2 4.16Å; E629-V632 PolarHBondContact O-N 3.09Å; S630-V632 VanDerWaalsContact C-N 3.33Å; S630-V632 PolarHBondContact O-N 2.74Å; V632-A635 PolarHBondContact O-N 3.48Å; V632-C636 WeakPolarHBondContact O-CB 3.34Å; V632-C636 PolarHBondContact O-N 2.73Å; V632-C636 PolarHBondContact O-SG 3.33Å
633	L	97.1	Very high	95.6	Very high	1 Å²	1	29.5 Å²	29.5	1%	0.005	15%	0.154	C	C	.	.	H	α-helix	trans	-69	-36.9	-178.4	-65.9	177.6	0	0	0	112.1	V624 E629 S630 S637 K696 R697 S700	V624-L633 HydrophobicContact CG1-CD2 3.95Å; E629-L633 WeakPolarHBondContact O-CG 3.4Å; E629-L633 PolarHBondContact O-N 2.66Å; S630-L633 PolarHBondContact O-N 2.67Å; L633-S637 PolarHBondContact O-N 3.34Å; L633-K696 HydrophobicContact CD1-CB 3.95Å; L633-R697 HydrophobicContact CD1-CG 4.14Å; L633-R697 HydrophobicContact CD2-CG 3.79Å; L633-S700 WeakPolarHBondContact CB-OG 3.31Å
634	E	95.7	Very high	95.4	Very high	54 Å²	54	30.1 Å²	30.1	25%	0.252	16%	0.158	S	C	.	.	H	α-helix	trans	-68.8	-45.4	174	-170.5	177.4	143.1	0	0	111.5	S630 C636 S637 K638	S630-E634 WeakPolarHBondContact O-CB 3.5Å; S630-E634 PolarHBondContact O-N 3.13Å; E634-C636 VanDerWaalsContact C-N 3.31Å; E634-C636 PolarHBondContact O-N 3.47Å; E634-S637 PolarHBondContact O-N 2.68Å; E634-S637 VanDerWaalsContact O-N 3.09Å; E634-K638 HydrophobicContact CG-CD 4.1Å; E634-K638 HydrophobicContact CG-CG 4.35Å; E634-K638 WeakPolarHBondContact O-CB 3.33Å; E634-K638 PolarHBondContact O-N 3.1Å; E634-K638 WeakPolarHBondContact OE1-CE 3.21Å; E634-K638 IonicContact OE1-NZ 2.97Å; E634-K638 PolarHBondContact OE1-NZ 2.95Å
635	A	95.9	Very high	95.1	Very high	9 Å²	9	31.8 Å²	31.8	7%	0.074	17%	0.169	C	C	.	.	H	α-helix	trans	-61.9	-38.9	175.3	0	0	0	0	0	111.7	L593 D631 V632 T639	L593-A635 HydrophobicContact CB-CB 3.68Å; L593-A635 HydrophobicContact CD1-CB 4.06Å; D631-A635 WeakPolarHBondContact O-CB 3.4Å; D631-A635 PolarHBondContact O-N 2.76Å; V632-A635 PolarHBondContact O-N 3.48Å; A635-T639 VanDerWaalsContact O-CB 3.22Å; A635-T639 WeakPolarHBondContact O-CB 3.25Å; A635-T639 PolarHBondContact O-N 2.85Å; A635-T639 VanDerWaalsContact O-N 3.11Å; A635-T639 PolarHBondContact O-OG1 2.97Å
636	C	97.3	Very high	94.8	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-58.8	-46.6	169.8	-76.9	0	0	0	0	112.2	L593 I620 V624 V632 E634 Y640 F701	L593-C636 WeakPolarHBondContact CD1-SG 3.47Å; I620-C636 HydrophobicContact CG2-CB 3.98Å; V624-C636 HydrophobicContact CG2-CB 3.51Å; V624-C636 WeakPolarHBondContact CG2-SG 3.46Å; V632-C636 WeakPolarHBondContact O-CB 3.34Å; V632-C636 PolarHBondContact O-N 2.73Å; V632-C636 PolarHBondContact O-SG 3.33Å; E634-C636 VanDerWaalsContact C-N 3.31Å; E634-C636 PolarHBondContact O-N 3.47Å; C636-Y640 WeakPolarHBondContact O-CB 3.3Å; C636-Y640 WeakPolarHBondContact O-CD2 3.5Å; C636-Y640 PolarHBondContact O-N 3.05Å; C636-F701 HydrophobicContact CB-CE2 4.23Å; C636-F701 HydrophobicContact CB-CZ 4.29Å
637	S	96.9	Very high	94.5	Very high	2 Å²	2	40.3 Å²	40.3	1%	0.014	21%	0.211	C	C	.	.	H	α-helix	trans	-70.9	-47.2	-177.5	-178.7	0	0	0	0	113.2	L633 E634 T639 Y640 S641 S700 F701 A704 H705	L633-S637 PolarHBondContact O-N 3.34Å; E634-S637 PolarHBondContact O-N 2.68Å; E634-S637 VanDerWaalsContact O-N 3.09Å; S637-T639 VanDerWaalsContact C-N 3.27Å; S637-T639 PolarHBondContact O-N 2.71Å; S637-Y640 PolarHBondContact O-N 2.75Å; S637-S641 WeakPolarHBondContact O-CB 3.39Å; S637-S641 PolarHBondContact O-N 2.75Å; S637-S700 PolarHBondContact OG-O 3.34Å; S637-F701 WeakPolarHBondContact OG-CA 3.41Å; S637-A704 WeakPolarHBondContact OG-CB 3.46Å; S637-H705 PolarHBondContact O-NE2 3.23Å
638	K	95.3	Very high	94.3	Very high	39 Å²	39	42.6 Å²	42.6	17%	0.17	22%	0.219	C	C	.	.	H	α-helix	trans	-53.5	-45.8	173.6	-79.3	174.7	163.4	163.5	0	111	E634 S641 I642 D1250 F1253	E634-K638 HydrophobicContact CG-CD 4.1Å; E634-K638 HydrophobicContact CG-CG 4.35Å; E634-K638 WeakPolarHBondContact O-CB 3.33Å; E634-K638 PolarHBondContact O-N 3.1Å; E634-K638 WeakPolarHBondContact OE1-CE 3.21Å; E634-K638 IonicContact OE1-NZ 2.97Å; E634-K638 PolarHBondContact OE1-NZ 2.95Å; K638-S641 WeakPolarHBondContact O-CB 3.16Å; K638-S641 PolarHBondContact O-N 3.37Å; K638-S641 VanDerWaalsContact O-N 3.16Å; K638-I642 PolarHBondContact O-N 3.18Å; K638-I642 VanDerWaalsContact O-N 3.09Å; K638-D1250 PolarHBondContact NZ-O 3.07Å; K638-F1253 HydrophobicContact CG-CD2 4.31Å
639	T	95.7	Very high	94.2	Very high	1 Å²	1	46.6 Å²	46.6	1%	0.006	24%	0.244	C	C	.	.	H	α-helix	trans	-70.9	-37.6	179	-72.7	0	0	0	0	113.1	L593 P596 Q597 I620 A635 S637 S641 L643	L593-T639 PolarHBondContact O-OG1 3.14Å; P596-T639 HydrophobicContact CB-CG2 3.89Å; P596-T639 HydrophobicContact CG-CG2 3.86Å; Q597-T639 WeakPolarHBondContact CG-OG1 3.32Å; Q597-T639 PolarHBondContact NE2-OG1 3.09Å; I620-T639 HydrophobicContact CD1-CG2 3.98Å; A635-T639 VanDerWaalsContact O-CB 3.22Å; A635-T639 WeakPolarHBondContact O-CB 3.25Å; A635-T639 PolarHBondContact O-N 2.85Å; A635-T639 VanDerWaalsContact O-N 3.11Å; A635-T639 PolarHBondContact O-OG1 2.97Å; S637-T639 VanDerWaalsContact C-N 3.27Å; S637-T639 PolarHBondContact O-N 2.71Å; T639-S641 PolarHBondContact O-N 2.88Å; T639-L643 HydrophobicContact CG2-CD1 3.94Å; T639-L643 WeakPolarHBondContact O-CB 3.32Å; T639-L643 VanDerWaalsContact O-CG 3.23Å; T639-L643 WeakPolarHBondContact O-CG 3.46Å; T639-L643 PolarHBondContact O-N 3.31Å; T639-L643 VanDerWaalsContact O-N 3.09Å
640	Y	95.8	Very high	94	Very high	2 Å²	2	43.3 Å²	43.3	1%	0.008	23%	0.229	C	C	.	.	H	α-helix	trans	-60.6	-34.9	168.1	-102.8	-73.6	0	0	0	112.1	L617 I620 C636 S637 C644 V654 R658 L661 F701 H705	L617-Y640 HydrophobicContact CD2-CD1 4.45Å; L617-Y640 HydrophobicContact CD2-CE1 3.82Å; I620-Y640 HydrophobicContact CB-CE2 4.13Å; I620-Y640 HydrophobicContact CG2-CD2 3.79Å; I620-Y640 HydrophobicContact CG2-CE2 3.49Å; I620-Y640 VanDerWaalsContact CG2-CE2 3.49Å; C636-Y640 WeakPolarHBondContact O-CB 3.3Å; C636-Y640 WeakPolarHBondContact O-CD2 3.5Å; C636-Y640 PolarHBondContact O-N 3.05Å; S637-Y640 PolarHBondContact O-N 2.75Å; Y640-C644 VanDerWaalsContact O-CB 3.23Å; Y640-C644 WeakPolarHBondContact O-CB 3.38Å; Y640-C644 PolarHBondContact O-N 3.03Å; Y640-V654 HydrophobicContact CD1-CG1 3.88Å; Y640-V654 HydrophobicContact CE1-CG1 4.17Å; Y640-R658 HydrophobicContact CD1-CB 3.97Å; Y640-R658 HydrophobicContact CD1-CG 4.39Å; Y640-R658 HydrophobicContact CE1-CB 3.95Å; Y640-L661 HydrophobicContact CE2-CD2 3.9Å; Y640-F701 AromaticContact CD2-CE1 3.58Å; Y640-F701 HydrophobicContact CD2-CE1 3.58Å; Y640-F701 AromaticContact CD2-CZ 3.64Å; Y640-F701 HydrophobicContact CD2-CZ 3.64Å; Y640-F701 HydrophobicContact CE2-CE1 4.12Å; Y640-F701 HydrophobicContact CE2-CZ 4.06Å; Y640-F701 AromaticContact CG-CE1 3.98Å; Y640-F701 HydrophobicContact CG-CE1 3.98Å; Y640-F701 HydrophobicContact CG-CZ 4.45Å; Y640-H705 WeakPolarHBondContact CB-NE2 3.38Å; Y640-H705 PolarHBondContact O-NE2 3.16Å
641	S	94.6	Very high	94.1	Very high	16 Å²	16	41.5 Å²	41.5	11%	0.112	21%	0.213	C	C	.	.	H	α-helix	trans	-68	-49.5	-177.6	-168.7	0	0	0	0	111.2	S637 K638 T639 L643 C644 S645 H705 F1253	S637-S641 WeakPolarHBondContact O-CB 3.39Å; S637-S641 PolarHBondContact O-N 2.75Å; K638-S641 WeakPolarHBondContact O-CB 3.16Å; K638-S641 PolarHBondContact O-N 3.37Å; K638-S641 VanDerWaalsContact O-N 3.16Å; T639-S641 PolarHBondContact O-N 2.88Å; S641-L643 PolarHBondContact O-N 3.07Å; S641-C644 CarbonylContact O-C 3.55Å; S641-C644 WeakPolarHBondContact O-CA 3.39Å; S641-C644 PolarHBondContact O-N 3.11Å; S641-S645 PolarHBondContact O-N 3.11Å; S641-H705 WeakPolarHBondContact CA-NE2 3.41Å; S641-H705 WeakPolarHBondContact CB-NE2 3.25Å; S641-H705 PolarHBondContact N-NE2 2.96Å; S641-F1253 VanDerWaalsContact CB-CE2 3.47Å; S641-F1253 WeakPolarHBondContact OG-CE1 3.42Å; S641-F1253 WeakPolarHBondContact OG-CE2 3.38Å; S641-F1253 WeakPolarHBondContact OG-CZ 3.39Å
642	I	92.9	Very high	94.1	Very high	43 Å²	43	41.8 Å²	41.8	22%	0.221	21%	0.214	C	C	.	.	H	α-helix	trans	-62.1	-42.2	177.1	-73.2	160.5	0	0	0	111.3	Q597 L601 K638 C644 S645 F1253	Q597-I642 HydrophobicContact CB-CD1 3.7Å; Q597-I642 HydrophobicContact CG-CD1 3.63Å; L601-I642 HydrophobicContact CD1-CG2 4.01Å; L601-I642 WeakPolarHBondContact CD1-O 3.4Å; K638-I642 PolarHBondContact O-N 3.18Å; K638-I642 VanDerWaalsContact O-N 3.09Å; I642-C644 PolarHBondContact O-N 2.96Å; I642-S645 WeakPolarHBondContact O-CB 3.4Å; I642-S645 PolarHBondContact O-N 2.85Å; I642-F1253 HydrophobicContact CD1-CE2 4.34Å; I642-F1253 HydrophobicContact CG1-CE2 4.03Å; I642-F1253 HydrophobicContact CG1-CZ 4.03Å
643	L	94.1	Very high	94	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-67.7	-20.8	174.4	-67.6	173.3	0	0	0	113.5	L601 Y604 L613 L616 L617 I620 T639 S641 I650 V654	L601-L643 HydrophobicContact CD1-CD2 4.45Å; L601-L643 HydrophobicContact CD2-CD2 3.74Å; Y604-L643 HydrophobicContact CE2-CD2 4.21Å; L613-L643 HydrophobicContact CD1-CD1 4.42Å; L613-L643 HydrophobicContact CD1-CD2 4.21Å; L616-L643 HydrophobicContact CD2-CD1 4.22Å; L617-L643 HydrophobicContact CD2-CD1 4.37Å; I620-L643 HydrophobicContact CD1-CD1 4.45Å; T639-L643 HydrophobicContact CG2-CD1 3.94Å; T639-L643 WeakPolarHBondContact O-CB 3.32Å; T639-L643 VanDerWaalsContact O-CG 3.23Å; T639-L643 WeakPolarHBondContact O-CG 3.46Å; T639-L643 PolarHBondContact O-N 3.31Å; T639-L643 VanDerWaalsContact O-N 3.09Å; S641-L643 PolarHBondContact O-N 3.07Å; L643-I650 HydrophobicContact CD2-CD1 4.08Å; L643-V654 HydrophobicContact CB-CB 4.5Å; L643-V654 HydrophobicContact CB-CG1 3.76Å; L643-V654 HydrophobicContact CB-CG2 4.08Å; L643-V654 WeakPolarHBondContact O-CG2 3.44Å
644	C	93.8	Very high	93.9	Very high	12 Å²	12	46.6 Å²	46.6	8%	0.081	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.5	5.7	174.6	-89.3	0	0	0	0	114.6	Y640 S641 I642 E646 Q651 V654	Y640-C644 VanDerWaalsContact O-CB 3.23Å; Y640-C644 WeakPolarHBondContact O-CB 3.38Å; Y640-C644 PolarHBondContact O-N 3.03Å; S641-C644 CarbonylContact O-C 3.55Å; S641-C644 WeakPolarHBondContact O-CA 3.39Å; S641-C644 PolarHBondContact O-N 3.11Å; I642-C644 PolarHBondContact O-N 2.96Å; C644-E646 PolarHBondContact O-N 3.37Å; C644-Q651 WeakPolarHBondContact O-CG 3.42Å; C644-V654 WeakPolarHBondContact SG-CG1 3.29Å
645	S	91.4	Very high	93.9	Very high	35 Å²	35	46.1 Å²	46.1	25%	0.245	23%	0.232	C	C	.	.			trans	-60.3	128.6	179.1	173.7	0	0	0	0	112.3	S641 I642 E647 Y648	S641-S645 PolarHBondContact O-N 3.11Å; I642-S645 WeakPolarHBondContact O-CB 3.4Å; I642-S645 PolarHBondContact O-N 2.85Å; S645-E647 PolarHBondContact O-N 2.79Å; S645-E647 VanDerWaalsContact O-N 3.13Å; S645-E647 PolarHBondContact OG-N 3.15Å; S645-Y648 PolarHBondContact O-N 3.03Å
646	E	87.6	Confident	93.9	Very high	175 Å²	175	50.5 Å²	50.5	82%	0.818	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-15.1	-179.4	-60.5	-167.4	165.3	0	0	114	C644 Y648	C644-E646 PolarHBondContact O-N 3.37Å; E646-Y648 PolarHBondContact O-N 2.98Å
647	E	89.8	Confident	93.9	Very high	163 Å²	163	51.5 Å²	51.5	76%	0.762	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-22.8	176.3	-59.5	-172.4	143.4	0	0	112.7	S645	S645-E647 PolarHBondContact O-N 2.79Å; S645-E647 VanDerWaalsContact O-N 3.13Å; S645-E647 PolarHBondContact OG-N 3.15Å
648	Y	91.4	Very high	93.9	Very high	54 Å²	54	53.7 Å²	53.7	21%	0.212	27%	0.269	C	S	.	.	S	Bend	trans	-112.4	139.6	-171.5	-59.2	-70.3	0	0	0	114	L601 E602 S645 E646 I650 Q651	L601-Y648 HydrophobicContact CB-CD1 3.8Å; L601-Y648 HydrophobicContact CB-CD2 3.85Å; L601-Y648 HydrophobicContact CB-CE1 3.91Å; L601-Y648 HydrophobicContact CB-CE2 3.95Å; L601-Y648 HydrophobicContact CB-CG 3.76Å; L601-Y648 HydrophobicContact CD1-CD2 3.7Å; L601-Y648 HydrophobicContact CD1-CE2 3.78Å; L601-Y648 HydrophobicContact CD1-CG 4.38Å; L601-Y648 HydrophobicContact CG-CD2 4.36Å; L601-Y648 HydrophobicContact CG-CE2 4.28Å; E602-Y648 HydrophobicContact CG-CD1 4.15Å; E602-Y648 HydrophobicContact CG-CE1 3.94Å; S645-Y648 PolarHBondContact O-N 3.03Å; E646-Y648 PolarHBondContact O-N 2.98Å; Y648-I650 PolarHBondContact O-N 2.85Å; Y648-Q651 WeakPolarHBondContact O-CB 3.39Å; Y648-Q651 PolarHBondContact O-N 2.85Å
649	T	92.3	Very high	93.9	Very high	115 Å²	115	53.1 Å²	53.1	71%	0.706	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-12.4	179.3	45.5	0	0	0	0	115	S605	S605-T649 WeakPolarHBondContact CB-OG1 3.27Å; S605-T649 PolarHBondContact OG-OG1 2.64Å
650	I	93.6	Very high	93.9	Very high	7 Å²	7	58.3 Å²	58.3	4%	0.036	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-19.1	174.4	64.1	172	0	0	0	113.8	L601 Y604 L613 L643 Y648 N652 R653 V654	L601-I650 HydrophobicContact CB-CD1 4.34Å; L601-I650 HydrophobicContact CD1-CD1 4.39Å; L601-I650 HydrophobicContact CD2-CD1 4.35Å; Y604-I650 HydrophobicContact CD2-CD1 4.04Å; Y604-I650 HydrophobicContact CG-CG2 4.45Å; L613-I650 HydrophobicContact CD2-CB 3.71Å; L613-I650 HydrophobicContact CD2-CD1 4.15Å; L613-I650 HydrophobicContact CD2-CG1 4.48Å; L613-I650 HydrophobicContact CD2-CG2 3.84Å; L643-I650 HydrophobicContact CD2-CD1 4.08Å; Y648-I650 PolarHBondContact O-N 2.85Å; I650-N652 VanDerWaalsContact C-N 3.31Å; I650-N652 PolarHBondContact O-N 3.09Å; I650-N652 VanDerWaalsContact O-N 3.13Å; I650-R653 WeakPolarHBondContact O-CB 3.4Å; I650-R653 PolarHBondContact O-N 3.2Å; I650-V654 HydrophobicContact CD1-CG2 4.46Å; I650-V654 HydrophobicContact CG1-CG2 4.47Å; I650-V654 PolarHBondContact O-N 2.78Å
651	Q	94.5	Very high	94	Very high	31 Å²	31	58.2 Å²	58.2	15%	0.145	29%	0.294	C	S	.	.	H	α-helix	trans	-49.2	-47.5	-168.8	-179.4	-86.2	-7.1	0	0	113.4	C644 Y648 R653 V654 D655	C644-Q651 WeakPolarHBondContact O-CG 3.42Å; Y648-Q651 WeakPolarHBondContact O-CB 3.39Å; Y648-Q651 PolarHBondContact O-N 2.85Å; Q651-R653 PolarHBondContact O-N 3.19Å; Q651-V654 PolarHBondContact O-N 3.39Å; Q651-V654 VanDerWaalsContact O-N 3.16Å; Q651-D655 WeakPolarHBondContact O-CB 3.39Å; Q651-D655 PolarHBondContact O-N 3.45Å
652	N	93.6	Very high	94.1	Very high	118 Å²	118	57.5 Å²	57.5	63%	0.631	29%	0.289	S	S	*	.	H	α-helix	trans	-63.6	-31	-175.5	-79.5	-105.8	0	0	0	112.1	I650 I656	I650-N652 VanDerWaalsContact C-N 3.31Å; I650-N652 PolarHBondContact O-N 3.09Å; I650-N652 VanDerWaalsContact O-N 3.13Å; N652-I656 WeakPolarHBondContact O-CD1 3.38Å; N652-I656 VanDerWaalsContact O-CG1 3.25Å; N652-I656 WeakPolarHBondContact O-CG1 3.21Å; N652-I656 PolarHBondContact O-N 3.36Å
653	R	94.8	Very high	94.3	Very high	103 Å²	103	58.3 Å²	58.3	39%	0.389	29%	0.294	S	S	.	.	H	α-helix	trans	-75.5	-41	177.7	171.2	178.4	-77.2	-137.6	-5.8	111.2	E610 D614 I650 Q651 A657	E610-R653 PolarHBondContact O-NH1 3.14Å; D614-R653 WeakPolarHBondContact OD1-CD 3.5Å; D614-R653 IonicContact OD1-CZ 2.7Å; D614-R653 IonicContact OD1-NE 3.53Å; D614-R653 IonicContact OD1-NH1 3.83Å; D614-R653 PolarHBondContact OD1-NH1 3.41Å; D614-R653 IonicContact OD2-CZ 3.51Å; D614-R653 IonicContact OD2-NH1 2.74Å; D614-R653 PolarHBondContact OD2-NH1 3.36Å; I650-R653 WeakPolarHBondContact O-CB 3.4Å; I650-R653 PolarHBondContact O-N 3.2Å; Q651-R653 PolarHBondContact O-N 3.19Å; R653-A657 PolarHBondContact O-N 3.16Å
654	V	96.3	Very high	94.4	Very high	0 Å²	0	62.3 Å²	62.3	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-69.5	-42.2	178.4	-176.5	0	0	0	0	110.5	L613 L617 Y640 L643 C644 I650 Q651 I656 A657 R658	L613-V654 HydrophobicContact CD1-CG2 4.26Å; L613-V654 HydrophobicContact CD2-CG2 3.98Å; L613-V654 HydrophobicContact CG-CG2 4.48Å; L617-V654 HydrophobicContact CD1-CG2 4.22Å; L617-V654 HydrophobicContact CD2-CG1 3.92Å; L617-V654 HydrophobicContact CD2-CG2 4.4Å; Y640-V654 HydrophobicContact CD1-CG1 3.88Å; Y640-V654 HydrophobicContact CE1-CG1 4.17Å; L643-V654 HydrophobicContact CB-CB 4.5Å; L643-V654 HydrophobicContact CB-CG1 3.76Å; L643-V654 HydrophobicContact CB-CG2 4.08Å; L643-V654 WeakPolarHBondContact O-CG2 3.44Å; C644-V654 WeakPolarHBondContact SG-CG1 3.29Å; I650-V654 HydrophobicContact CD1-CG2 4.46Å; I650-V654 HydrophobicContact CG1-CG2 4.47Å; I650-V654 PolarHBondContact O-N 2.78Å; Q651-V654 PolarHBondContact O-N 3.39Å; Q651-V654 VanDerWaalsContact O-N 3.16Å; V654-I656 PolarHBondContact O-N 3.43Å; V654-A657 PolarHBondContact O-N 3.08Å; V654-A657 VanDerWaalsContact O-N 3.13Å; V654-R658 WeakPolarHBondContact O-CB 3.44Å; V654-R658 PolarHBondContact O-N 3.35Å
655	D	95.3	Very high	94.6	Very high	44 Å²	44	61.8 Å²	61.8	24%	0.235	31%	0.308	C	S	.	.	H	α-helix	trans	-64.4	-36.3	180	-177.8	47.7	0	0	0	113.3	Q651 A657 R658 S659	Q651-D655 WeakPolarHBondContact O-CB 3.39Å; Q651-D655 PolarHBondContact O-N 3.45Å; D655-A657 VanDerWaalsContact C-N 3.35Å; D655-R658 PolarHBondContact O-N 3.5Å; D655-R658 IonicContact OD1-CZ 3.83Å; D655-R658 IonicContact OD1-NE 3.66Å; D655-R658 PolarHBondContact OD1-NE 3.05Å; D655-R658 VanDerWaalsContact OD1-NE 3.16Å; D655-R658 IonicContact OD1-NH2 2.8Å; D655-R658 PolarHBondContact OD1-NH2 3.5Å; D655-S659 VanDerWaalsContact O-CB 3.24Å; D655-S659 WeakPolarHBondContact O-CB 3.41Å; D655-S659 PolarHBondContact O-N 3.23Å; D655-S659 PolarHBondContact O-OG 3.4Å
656	I	96.1	Very high	94.9	Very high	100 Å²	100	60.3 Å²	60.3	51%	0.513	30%	0.298	S	S	.	.	H	α-helix	trans	-61.5	-44.6	172	-71.1	166.3	0	0	0	110.6	N652 V654 Q660	N652-I656 WeakPolarHBondContact O-CD1 3.38Å; N652-I656 VanDerWaalsContact O-CG1 3.25Å; N652-I656 WeakPolarHBondContact O-CG1 3.21Å; N652-I656 PolarHBondContact O-N 3.36Å; V654-I656 PolarHBondContact O-N 3.43Å; I656-Q660 VanDerWaalsContact O-CG 3.27Å; I656-Q660 WeakPolarHBondContact O-CG 3.37Å; I656-Q660 PolarHBondContact O-N 3.37Å; I656-Q660 VanDerWaalsContact O-N 3.08Å
657	A	96.2	Very high	95.3	Very high	22 Å²	22	56.8 Å²	56.8	18%	0.182	29%	0.285	C	S	.	.	H	α-helix	trans	-68	-39.5	178.3	0	0	0	0	0	112.3	L617 R653 V654 D655 L661	L617-A657 HydrophobicContact CB-CB 4.48Å; L617-A657 HydrophobicContact CD1-CB 4.1Å; R653-A657 PolarHBondContact O-N 3.16Å; V654-A657 PolarHBondContact O-N 3.08Å; V654-A657 VanDerWaalsContact O-N 3.13Å; D655-A657 VanDerWaalsContact C-N 3.35Å; A657-L661 WeakPolarHBondContact O-CB 3.26Å; A657-L661 PolarHBondContact O-N 3.16Å; A657-L661 VanDerWaalsContact O-N 3.1Å
658	R	96.3	Very high	95.6	Very high	47 Å²	47	53.6 Å²	53.6	18%	0.177	27%	0.266	C	S	.	.	H	α-helix	trans	-61	-51	173.2	-179.8	-179.6	68.1	162.6	-0.9	111	Y640 V654 D655 Q660 L661 I662 H705	Y640-R658 HydrophobicContact CD1-CB 3.97Å; Y640-R658 HydrophobicContact CD1-CG 4.39Å; Y640-R658 HydrophobicContact CE1-CB 3.95Å; V654-R658 WeakPolarHBondContact O-CB 3.44Å; V654-R658 PolarHBondContact O-N 3.35Å; D655-R658 PolarHBondContact O-N 3.5Å; D655-R658 IonicContact OD1-CZ 3.83Å; D655-R658 IonicContact OD1-NE 3.66Å; D655-R658 PolarHBondContact OD1-NE 3.05Å; D655-R658 VanDerWaalsContact OD1-NE 3.16Å; D655-R658 IonicContact OD1-NH2 2.8Å; D655-R658 PolarHBondContact OD1-NH2 3.5Å; R658-Q660 VanDerWaalsContact C-N 3.34Å; R658-Q660 PolarHBondContact O-N 3.03Å; R658-L661 WeakPolarHBondContact O-CB 3.09Å; R658-L661 PolarHBondContact O-N 3.06Å; R658-L661 VanDerWaalsContact O-N 3.15Å; R658-I662 WeakPolarHBondContact O-CG1 3.23Å; R658-I662 PolarHBondContact O-N 3.1Å; R658-H705 PolarHBondContact NH1-CE1 3.34Å; R658-H705 PolarHBondContact NH1-ND1 3.31Å
659	S	96.3	Very high	95.9	Very high	27 Å²	27	51 Å²	51	19%	0.189	26%	0.256	C	S	.	.	H	α-helix	trans	-59.2	-44.1	-179.2	-69.8	0	0	0	0	111.8	D655 L661 I662 D663	D655-S659 VanDerWaalsContact O-CB 3.24Å; D655-S659 WeakPolarHBondContact O-CB 3.41Å; D655-S659 PolarHBondContact O-N 3.23Å; D655-S659 PolarHBondContact O-OG 3.4Å; S659-L661 PolarHBondContact O-N 2.91Å; S659-I662 PolarHBondContact O-N 2.95Å; S659-D663 WeakPolarHBondContact O-CB 3.42Å; S659-D663 PolarHBondContact O-N 2.88Å
660	Q	96.3	Very high	96	Very high	110 Å²	110	48 Å²	48	51%	0.514	24%	0.235	S	C	.	.	H	α-helix	trans	-62.1	-41.1	175.4	-72.8	170.3	1.3	0	0	112.6	I656 R658 E664	I656-Q660 VanDerWaalsContact O-CG 3.27Å; I656-Q660 WeakPolarHBondContact O-CG 3.37Å; I656-Q660 PolarHBondContact O-N 3.37Å; I656-Q660 VanDerWaalsContact O-N 3.08Å; R658-Q660 VanDerWaalsContact C-N 3.34Å; R658-Q660 PolarHBondContact O-N 3.03Å; Q660-E664 WeakPolarHBondContact O-CG 3.48Å; Q660-E664 PolarHBondContact O-N 2.96Å; Q660-E664 VanDerWaalsContact O-N 3.14Å
661	L	96.6	Very high	96.1	Very high	1 Å²	1	53.7 Å²	53.7	1%	0.005	26%	0.261	C	S	.	.	H	α-helix	trans	-63.3	-42.1	176.4	-174.2	63.1	0	0	0	112	K621 Y640 A657 R658 S659 F665 F701	K621-L661 HydrophobicContact CB-CD1 4.33Å; K621-L661 HydrophobicContact CD-CD1 3.93Å; K621-L661 HydrophobicContact CG-CD1 3.79Å; Y640-L661 HydrophobicContact CE2-CD2 3.9Å; A657-L661 WeakPolarHBondContact O-CB 3.26Å; A657-L661 PolarHBondContact O-N 3.16Å; A657-L661 VanDerWaalsContact O-N 3.1Å; R658-L661 WeakPolarHBondContact O-CB 3.09Å; R658-L661 PolarHBondContact O-N 3.06Å; R658-L661 VanDerWaalsContact O-N 3.15Å; S659-L661 PolarHBondContact O-N 2.91Å; L661-F665 HydrophobicContact CD1-CD2 4.11Å; L661-F665 HydrophobicContact CD1-CE2 3.34Å; L661-F665 HydrophobicContact CD1-CZ 3.74Å; L661-F665 HydrophobicContact CD2-CE2 4.33Å; L661-F665 HydrophobicContact CG-CD2 4.06Å; L661-F665 HydrophobicContact CG-CE2 3.61Å; L661-F665 HydrophobicContact CG-CZ 4.48Å; L661-F665 WeakPolarHBondContact O-CD2 3.37Å; L661-F665 PolarHBondContact O-N 2.83Å; L661-F701 HydrophobicContact CD2-CE1 4.03Å; L661-F701 HydrophobicContact CD2-CZ 3.86Å
662	I	97.6	Very high	96.1	Very high	0 Å²	0	53 Å²	53	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-71.5	-44.7	177.3	-60.7	-58.8	0	0	0	111.6	R658 S659 E664 F665 V666 F701 L707 W710	R658-I662 WeakPolarHBondContact O-CG1 3.23Å; R658-I662 PolarHBondContact O-N 3.1Å; S659-I662 PolarHBondContact O-N 2.95Å; I662-E664 VanDerWaalsContact C-N 3.26Å; I662-E664 PolarHBondContact O-N 3.27Å; I662-F665 PolarHBondContact O-N 3.33Å; I662-F665 VanDerWaalsContact O-N 3.17Å; I662-V666 HydrophobicContact CG2-CG2 3.73Å; I662-V666 WeakPolarHBondContact O-CB 3.34Å; I662-V666 VanDerWaalsContact O-CG2 3.24Å; I662-V666 WeakPolarHBondContact O-CG2 3.26Å; I662-V666 PolarHBondContact O-N 3.17Å; I662-F701 HydrophobicContact CD1-CB 3.79Å; I662-F701 HydrophobicContact CD1-CD1 3.83Å; I662-F701 HydrophobicContact CD1-CG 3.96Å; I662-L707 HydrophobicContact CD1-CD1 4.1Å; I662-L707 HydrophobicContact CD1-CD2 4.25Å; I662-L707 HydrophobicContact CG1-CD2 4.03Å; I662-L707 HydrophobicContact CG2-CD1 4.27Å; I662-L707 HydrophobicContact CG2-CD2 4.13Å; I662-W710 HydrophobicContact CB-CH2 4.21Å; I662-W710 HydrophobicContact CB-CZ2 3.89Å; I662-W710 HydrophobicContact CG2-CD2 3.68Å; I662-W710 HydrophobicContact CG2-CE3 3.99Å; I662-W710 HydrophobicContact CG2-CG 4.2Å; I662-W710 HydrophobicContact CG2-CH2 4.03Å; I662-W710 HydrophobicContact CG2-CZ2 3.69Å; I662-W710 HydrophobicContact CG2-CZ3 4.17Å
663	D	97.3	Very high	96.2	Very high	61 Å²	61	47.4 Å²	47.4	33%	0.326	23%	0.23	S	C	.	.	H	α-helix	trans	-52.7	-46.4	176.2	-72.3	-37.8	0	0	0	110.3	S659 D667 K709 W710	S659-D663 WeakPolarHBondContact O-CB 3.42Å; S659-D663 PolarHBondContact O-N 2.88Å; D663-D667 PolarHBondContact O-N 3.25Å; D663-K709 IonicContact OD1-NZ 3.09Å; D663-K709 PolarHBondContact OD1-NZ 2.95Å; D663-K709 IonicContact OD2-NZ 2.88Å; D663-W710 PolarHBondContact OD1-NE1 2.82Å
664	E	96.6	Very high	96.2	Very high	83 Å²	83	46.3 Å²	46.3	39%	0.388	23%	0.229	S	C	.	.	H	α-helix	trans	-66.7	-35	178.6	-73.1	175.4	-140.3	0	0	114.8	K621 Q660 I662 R668	K621-E664 IonicContact NZ-OE1 3.88Å; K621-E664 PolarHBondContact NZ-OE1 2.91Å; K621-E664 IonicContact NZ-OE2 3.77Å; K621-E664 PolarHBondContact NZ-OE2 2.83Å; Q660-E664 WeakPolarHBondContact O-CG 3.48Å; Q660-E664 PolarHBondContact O-N 2.96Å; Q660-E664 VanDerWaalsContact O-N 3.14Å; I662-E664 VanDerWaalsContact C-N 3.26Å; I662-E664 PolarHBondContact O-N 3.27Å; E664-R668 WeakPolarHBondContact O-CB 3.18Å; E664-R668 PolarHBondContact O-N 3.33Å
665	F	96.6	Very high	96	Very high	1 Å²	1	49.7 Å²	49.7	0%	0.004	25%	0.248	C	C	.	.	H	α-helix	trans	-80.7	-33.1	176.6	-68.9	-42.5	0	0	0	113.1	V624 E625 L661 I662 R668 F669 T694 R697 L698	V624-F665 HydrophobicContact CB-CE2 4.44Å; V624-F665 HydrophobicContact CB-CZ 4.49Å; V624-F665 HydrophobicContact CG1-CE2 3.49Å; V624-F665 VanDerWaalsContact CG1-CE2 3.49Å; V624-F665 HydrophobicContact CG1-CZ 3.78Å; E625-F665 HydrophobicContact CG-CE1 4.41Å; E625-F665 HydrophobicContact CG-CZ 4.1Å; L661-F665 HydrophobicContact CD1-CD2 4.11Å; L661-F665 HydrophobicContact CD1-CE2 3.34Å; L661-F665 HydrophobicContact CD1-CZ 3.74Å; L661-F665 HydrophobicContact CD2-CE2 4.33Å; L661-F665 HydrophobicContact CG-CD2 4.06Å; L661-F665 HydrophobicContact CG-CE2 3.61Å; L661-F665 HydrophobicContact CG-CZ 4.48Å; L661-F665 WeakPolarHBondContact O-CD2 3.37Å; L661-F665 PolarHBondContact O-N 2.83Å; I662-F665 PolarHBondContact O-N 3.33Å; I662-F665 VanDerWaalsContact O-N 3.17Å; F665-R668 PolarHBondContact O-N 2.87Å; F665-F669 VanDerWaalsContact O-CB 3.31Å; F665-F669 WeakPolarHBondContact O-CB 3.31Å; F665-F669 PolarHBondContact O-N 2.97Å; F665-T694 HydrophobicContact CB-CG2 4.18Å; F665-T694 HydrophobicContact CD1-CG2 4.42Å; F665-T694 VanDerWaalsContact O-CG2 3.3Å; F665-T694 WeakPolarHBondContact O-CG2 3.43Å; F665-R697 HydrophobicContact CD2-CB 4.4Å; F665-R697 HydrophobicContact CE2-CB 4.42Å; F665-L698 HydrophobicContact CB-CD2 3.81Å; F665-L698 HydrophobicContact CB-CG 4.1Å
666	V	97.4	Very high	95.8	Very high	5 Å²	5	48.1 Å²	48.1	3%	0.03	24%	0.239	C	C	.	.	H	α-helix	trans	-65.3	-46.6	174.9	171.3	0	0	0	0	110.1	I662 R668 F669 N670 L698 W710 L712	I662-V666 HydrophobicContact CG2-CG2 3.73Å; I662-V666 WeakPolarHBondContact O-CB 3.34Å; I662-V666 VanDerWaalsContact O-CG2 3.24Å; I662-V666 WeakPolarHBondContact O-CG2 3.26Å; I662-V666 PolarHBondContact O-N 3.17Å; V666-R668 VanDerWaalsContact C-N 3.32Å; V666-R668 PolarHBondContact O-N 3.49Å; V666-F669 PolarHBondContact O-N 3.16Å; V666-N670 WeakPolarHBondContact CG1-ND2 3.27Å; V666-N670 WeakPolarHBondContact O-CB 3.5Å; V666-N670 PolarHBondContact O-N 3.25Å; V666-N670 PolarHBondContact O-ND2 3.21Å; V666-L698 HydrophobicContact CG2-CD2 3.79Å; V666-W710 HydrophobicContact CB-CG 4.49Å; V666-W710 HydrophobicContact CG1-CB 4.15Å; V666-W710 HydrophobicContact CG1-CG 4.38Å; V666-W710 HydrophobicContact CG2-CB 3.88Å; V666-W710 HydrophobicContact CG2-CG 3.84Å; V666-L712 HydrophobicContact CG2-CD2 4.1Å
667	D	96.4	Very high	95.5	Very high	101 Å²	101	45.5 Å²	45.5	54%	0.54	23%	0.226	S	C	.	.	H	α-helix	trans	-58.8	-44.8	175.2	-83.7	-9.6	0	0	0	111.1	D663 N670 H671	D663-D667 PolarHBondContact O-N 3.25Å; D667-N670 PolarHBondContact O-N 3Å; D667-H671 PolarHBondContact O-N 3.06Å; D667-H671 PolarHBondContact O-ND1 2.93Å
668	R	95.9	Very high	95.2	Very high	95 Å²	95	51.4 Å²	51.4	36%	0.358	25%	0.25	S	C	.	.	H	α-helix	trans	-61.4	-49	177.2	-170.1	-175.9	-51.5	179.1	6.3	112.4	E664 F665 V666 N670 H671 S672 T694	E664-R668 WeakPolarHBondContact O-CB 3.18Å; E664-R668 PolarHBondContact O-N 3.33Å; F665-R668 PolarHBondContact O-N 2.87Å; V666-R668 VanDerWaalsContact C-N 3.32Å; V666-R668 PolarHBondContact O-N 3.49Å; R668-N670 VanDerWaalsContact C-N 3.32Å; R668-N670 PolarHBondContact O-N 2.84Å; R668-H671 PolarHBondContact O-N 3.07Å; R668-S672 PolarHBondContact O-N 2.95Å; R668-S672 VanDerWaalsContact O-N 3.08Å; R668-S672 PolarHBondContact O-OG 3.16Å; R668-T694 HydrophobicContact CB-CG2 4.13Å; R668-T694 HydrophobicContact CG-CG2 4.28Å
669	F	97	Very high	94.6	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-60.1	-41.9	178.9	176.2	-115.5	0	0	0	111.8	F665 V666 H671 S672 V673 V691 T694 L695 L698 L712 N715 L719	F665-F669 VanDerWaalsContact O-CB 3.31Å; F665-F669 WeakPolarHBondContact O-CB 3.31Å; F665-F669 PolarHBondContact O-N 2.97Å; V666-F669 PolarHBondContact O-N 3.16Å; F669-H671 VanDerWaalsContact C-N 3.34Å; F669-H671 PolarHBondContact O-N 3.08Å; F669-S672 PolarHBondContact O-N 3.43Å; F669-V673 HydrophobicContact CD2-CG2 3.74Å; F669-V673 HydrophobicContact CE1-CG2 4.3Å; F669-V673 HydrophobicContact CE2-CG2 3.41Å; F669-V673 VanDerWaalsContact CE2-CG2 3.41Å; F669-V673 HydrophobicContact CG-CG2 4.3Å; F669-V673 HydrophobicContact CZ-CG2 3.72Å; F669-V673 WeakPolarHBondContact O-CB 3.43Å; F669-V673 VanDerWaalsContact O-CG2 3.26Å; F669-V673 WeakPolarHBondContact O-CG2 3.23Å; F669-V673 PolarHBondContact O-N 3.43Å; F669-V691 HydrophobicContact CE2-CG1 4.25Å; F669-T694 HydrophobicContact CB-CG2 3.83Å; F669-L695 HydrophobicContact CD2-CB 4.24Å; F669-L695 HydrophobicContact CE2-CB 3.87Å; F669-L695 HydrophobicContact CE2-CD1 3.84Å; F669-L695 HydrophobicContact CE2-CD2 4.35Å; F669-L695 HydrophobicContact CE2-CG 4.21Å; F669-L695 HydrophobicContact CZ-CD1 3.87Å; F669-L698 HydrophobicContact CB-CD1 3.51Å; F669-L698 HydrophobicContact CD1-CD1 3.91Å; F669-L698 HydrophobicContact CD2-CD1 4.37Å; F669-L698 HydrophobicContact CG-CD1 3.69Å; F669-L712 HydrophobicContact CD1-CD2 4.1Å; F669-L712 HydrophobicContact CE1-CD2 4.29Å; F669-N715 HydrophobicContact CE1-CB 3.83Å; F669-N715 HydrophobicContact CZ-CB 4.34Å; F669-L719 HydrophobicContact CE2-CD1 4.11Å; F669-L719 HydrophobicContact CZ-CD1 4.06Å
670	N	96.1	Very high	93.9	Very high	52 Å²	52	54.5 Å²	54.5	28%	0.278	28%	0.276	S	S	.	.	H	α-helix	trans	-63.5	-36.6	179	-71.7	-24	0	0	0	112.9	V666 D667 R668 E674 N715	V666-N670 WeakPolarHBondContact CG1-ND2 3.27Å; V666-N670 WeakPolarHBondContact O-CB 3.5Å; V666-N670 PolarHBondContact O-N 3.25Å; V666-N670 PolarHBondContact O-ND2 3.21Å; D667-N670 PolarHBondContact O-N 3Å; R668-N670 VanDerWaalsContact C-N 3.32Å; R668-N670 PolarHBondContact O-N 2.84Å; N670-E674 WeakPolarHBondContact O-CG 3.34Å; N670-E674 PolarHBondContact O-N 3.49Å; N670-N715 PolarHBondContact OD1-ND2 3Å
671	H	95.1	Very high	92.9	Very high	126 Å²	126	57.3 Å²	57.3	58%	0.583	29%	0.29	S	S	*	.	H	α-helix	trans	-69.6	-56.6	173.9	-69.7	81.2	0	0	0	110.8	D667 R668 F669 V673 E674 D675	D667-H671 PolarHBondContact O-N 3.06Å; D667-H671 PolarHBondContact O-ND1 2.93Å; R668-H671 PolarHBondContact O-N 3.07Å; F669-H671 VanDerWaalsContact C-N 3.34Å; F669-H671 PolarHBondContact O-N 3.08Å; H671-V673 PolarHBondContact O-N 3.24Å; H671-V673 VanDerWaalsContact O-N 3.09Å; H671-E674 PolarHBondContact O-N 2.94Å; H671-D675 PolarHBondContact O-N 3.26Å
672	S	95.2	Very high	92.3	Very high	18 Å²	18	66 Å²	66	13%	0.126	33%	0.33	C	S	.	.	H	α-helix	trans	-60.1	-28.1	-176.4	-55.5	0	0	0	0	113.9	R668 F669 L676 V691	R668-S672 PolarHBondContact O-N 2.95Å; R668-S672 VanDerWaalsContact O-N 3.08Å; R668-S672 PolarHBondContact O-OG 3.16Å; F669-S672 PolarHBondContact O-N 3.43Å; S672-L676 VanDerWaalsContact O-CB 3.27Å; S672-L676 WeakPolarHBondContact O-CB 3.44Å; S672-L676 PolarHBondContact O-N 3.3Å; S672-V691 VanDerWaalsContact C-CG2 3.46Å; S672-V691 WeakPolarHBondContact O-CG2 3.47Å
673	V	94.8	Very high	91.7	Very high	0 Å²	0	67.1 Å²	67.1	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-74.3	-33.3	173.3	170.7	0	0	0	0	112.8	F669 H671 L677 V691 N715 L719	F669-V673 HydrophobicContact CD2-CG2 3.74Å; F669-V673 HydrophobicContact CE1-CG2 4.3Å; F669-V673 HydrophobicContact CE2-CG2 3.41Å; F669-V673 VanDerWaalsContact CE2-CG2 3.41Å; F669-V673 HydrophobicContact CG-CG2 4.3Å; F669-V673 HydrophobicContact CZ-CG2 3.72Å; F669-V673 WeakPolarHBondContact O-CB 3.43Å; F669-V673 VanDerWaalsContact O-CG2 3.26Å; F669-V673 WeakPolarHBondContact O-CG2 3.23Å; F669-V673 PolarHBondContact O-N 3.43Å; H671-V673 PolarHBondContact O-N 3.24Å; H671-V673 VanDerWaalsContact O-N 3.09Å; V673-L677 HydrophobicContact CG1-CD1 3.76Å; V673-L677 HydrophobicContact CG1-CG 4.39Å; V673-L677 WeakPolarHBondContact O-CB 3.2Å; V673-L677 WeakPolarHBondContact O-CD1 3.33Å; V673-L677 WeakPolarHBondContact O-CG 3.4Å; V673-L677 PolarHBondContact O-N 2.83Å; V673-V691 HydrophobicContact CG2-CG1 4.05Å; V673-V691 HydrophobicContact CG2-CG2 4.18Å; V673-N715 HydrophobicContact CG1-CB 4.09Å; V673-L719 HydrophobicContact CG1-CD2 4.14Å; V673-L719 HydrophobicContact CG1-CG 4.2Å; V673-L719 HydrophobicContact CG2-CD1 3.93Å; V673-L719 HydrophobicContact CG2-CD2 4.3Å; V673-L719 HydrophobicContact CG2-CG 4.33Å
674	E	94.1	Very high	91.3	Very high	79 Å²	79	68.3 Å²	68.3	37%	0.369	35%	0.346	S	S	.	.	H	α-helix	trans	-71.5	-36.5	172.2	-66	-68.3	178.1	0	0	111.3	N670 H671 Q678 R718	N670-E674 WeakPolarHBondContact O-CG 3.34Å; N670-E674 PolarHBondContact O-N 3.49Å; H671-E674 PolarHBondContact O-N 2.94Å; E674-Q678 WeakPolarHBondContact O-CB 3.45Å; E674-Q678 VanDerWaalsContact O-CG 3.23Å; E674-Q678 WeakPolarHBondContact O-CG 3.47Å; E674-Q678 PolarHBondContact O-N 3.36Å; E674-Q678 VanDerWaalsContact O-N 3.09Å; E674-Q678 PolarHBondContact O-NE2 3.4Å; E674-R718 VanDerWaalsContact CD-NH2 3.32Å; E674-R718 IonicContact OE1-CZ 2.83Å; E674-R718 IonicContact OE1-NH1 2.69Å; E674-R718 PolarHBondContact OE1-NH1 3.33Å; E674-R718 IonicContact OE1-NH2 3.43Å; E674-R718 PolarHBondContact OE1-NH2 3Å; E674-R718 IonicContact OE2-CZ 2.85Å; E674-R718 IonicContact OE2-NH1 3.1Å; E674-R718 IonicContact OE2-NH2 3.83Å; E674-R718 PolarHBondContact OE2-NH2 2.84Å
675	D	91.9	Very high	91	Very high	71 Å²	71	71 Å²	71	38%	0.38	36%	0.363	S	S	.	.	H	α-helix	trans	-66.6	-56.5	178.3	-58.8	-35.9	0	0	0	110.6	H671 L677 Q678 E679	H671-D675 PolarHBondContact O-N 3.26Å; D675-L677 PolarHBondContact O-N 3.39Å; D675-L677 VanDerWaalsContact O-N 3.12Å; D675-Q678 WeakPolarHBondContact O-CA 3.34Å; D675-Q678 WeakPolarHBondContact O-CB 3.46Å; D675-Q678 PolarHBondContact O-N 3.19Å; D675-E679 PolarHBondContact O-N 2.95Å; D675-E679 VanDerWaalsContact O-N 3.1Å
676	L	91.9	Very high	90.7	Very high	12 Å²	12	76.2 Å²	76.2	6%	0.063	39%	0.391	C	S	.	.	H	α-helix	trans	-54.4	-35.9	176.1	179.7	65.4	0	0	0	113.3	S672 G680 A683 D687 I688 V691 L719 I733	S672-L676 VanDerWaalsContact O-CB 3.27Å; S672-L676 WeakPolarHBondContact O-CB 3.44Å; S672-L676 PolarHBondContact O-N 3.3Å; L676-G680 PolarHBondContact O-N 3.18Å; L676-A683 HydrophobicContact CD1-CB 3.63Å; L676-D687 HydrophobicContact CD1-CB 4.42Å; L676-I688 HydrophobicContact CD1-CG1 4.18Å; L676-V691 HydrophobicContact CB-CG2 4.01Å; L676-V691 HydrophobicContact CD2-CB 4.04Å; L676-V691 HydrophobicContact CD2-CG1 4.17Å; L676-V691 HydrophobicContact CD2-CG2 3.71Å; L676-V691 HydrophobicContact CG-CG2 4.48Å; L676-L719 HydrophobicContact CD2-CD2 4.17Å; L676-I733 HydrophobicContact CD2-CD1 4.39Å
677	L	89.8	Confident	90.4	Very high	45 Å²	45	77.8 Å²	77.8	24%	0.236	40%	0.399	C	S	.	.	H	α-helix	trans	-82.7	-10.9	177.9	-68.9	177.3	0	0	0	114.3	V673 D675 R718 T722	V673-L677 HydrophobicContact CG1-CD1 3.76Å; V673-L677 HydrophobicContact CG1-CG 4.39Å; V673-L677 WeakPolarHBondContact O-CB 3.2Å; V673-L677 WeakPolarHBondContact O-CD1 3.33Å; V673-L677 WeakPolarHBondContact O-CG 3.4Å; V673-L677 PolarHBondContact O-N 2.83Å; D675-L677 PolarHBondContact O-N 3.39Å; D675-L677 VanDerWaalsContact O-N 3.12Å; L677-R718 HydrophobicContact CD1-CB 4.05Å; L677-T722 HydrophobicContact CD2-CG2 3.87Å; L677-T722 WeakPolarHBondContact CD2-OG1 3.11Å
678	Q	88.8	Confident	90.2	Very high	146 Å²	146	75 Å²	75	68%	0.682	38%	0.384	S	S	*	.	H	α-helix	trans	-87.2	-37.5	170.3	-79.9	169.4	99.1	0	0	111.8	E674 D675	E674-Q678 WeakPolarHBondContact O-CB 3.45Å; E674-Q678 VanDerWaalsContact O-CG 3.23Å; E674-Q678 WeakPolarHBondContact O-CG 3.47Å; E674-Q678 PolarHBondContact O-N 3.36Å; E674-Q678 VanDerWaalsContact O-N 3.09Å; E674-Q678 PolarHBondContact O-NE2 3.4Å; D675-Q678 WeakPolarHBondContact O-CA 3.34Å; D675-Q678 WeakPolarHBondContact O-CB 3.46Å; D675-Q678 PolarHBondContact O-N 3.19Å
679	E	84.8	Confident	90.1	Very high	89 Å²	89	76 Å²	76	42%	0.416	39%	0.388	S	S	.	.	H	α-helix	trans	-84	-37.1	-178.2	-70.5	157.3	156.7	0	0	112.2	D675 E681 E682 A683	D675-E679 PolarHBondContact O-N 2.95Å; D675-E679 VanDerWaalsContact O-N 3.1Å; E679-E681 PolarHBondContact O-N 3.1Å; E679-E682 PolarHBondContact O-N 3.47Å; E679-A683 HydrophobicContact CB-CB 3.83Å
680	G	81.3	Confident	90	Very high	49 Å²	49	79.2 Å²	79.2	51%	0.505	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.1	-96.6	164.9	0	0	0	0	0	114.4	L676	L676-G680 PolarHBondContact O-N 3.18Å
681	E	75.8	Confident	90	Very high	169 Å²	169	76.8 Å²	76.8	79%	0.79	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.5	-9.1	175.7	-70.1	178.5	-158	0	0	112.7	E679	E679-E681 PolarHBondContact O-N 3.1Å
682	E	82.9	Confident	90	Very high	183 Å²	183	71.8 Å²	71.8	86%	0.855	37%	0.37	S	S	*	.	S	Bend	trans	-102.1	-1.9	176.8	-62.3	-168.4	163.3	0	0	113.8	E679	E679-E682 PolarHBondContact O-N 3.47Å
683	A	86	Confident	90	Very high	24 Å²	24	71.2 Å²	71.2	20%	0.198	37%	0.366	C	S	.	.			trans	-67	147.9	178.9	0	0	0	0	0	112.5	L676 E679 D687	L676-A683 HydrophobicContact CD1-CB 3.63Å; E679-A683 HydrophobicContact CB-CB 3.83Å; A683-D687 HydrophobicContact CB-CB 4.39Å
684	D	88.7	Confident	90.1	Very high	87 Å²	87	71.3 Å²	71.3	47%	0.465	37%	0.367	S	S	.	.			trans	-105.6	179.7	-175.6	85.4	28.8	0	0	0	114.9	D686 D687 I688	D684-D686 VanDerWaalsContact C-N 3.28Å; D684-D686 PolarHBondContact O-N 3.15Å; D684-D686 WeakPolarHBondContact OD1-CA 3.49Å; D684-D686 WeakPolarHBondContact OD1-CB 3.18Å; D684-D686 PolarHBondContact OD1-N 2.98Å; D684-D687 PolarHBondContact N-OD2 3.26Å; D684-D687 PolarHBondContact O-N 2.93Å; D684-D687 PolarHBondContact OD1-N 3.21Å; D684-I688 WeakPolarHBondContact O-CG1 3.41Å; D684-I688 PolarHBondContact O-N 3.26Å; D684-I688 VanDerWaalsContact O-N 3.12Å
685	D	89.7	Confident	90.3	Very high	138 Å²	138	67.5 Å²	67.5	74%	0.738	35%	0.349	S	S	*	.	H	α-helix	trans	-63.8	-30.2	-177.2	-71.9	-44.7	0	0	0	112.7	Y689	D685-Y689 WeakPolarHBondContact O-CB 3.42Å; D685-Y689 PolarHBondContact O-N 3.27Å
686	D	91.5	Very high	90.5	Very high	111 Å²	111	66.2 Å²	66.2	59%	0.594	34%	0.34	S	S	*	.	H	α-helix	trans	-72.6	-39.3	176	-79.5	-20.2	0	0	0	110.4	D684 Y689 N690	D684-D686 VanDerWaalsContact C-N 3.28Å; D684-D686 PolarHBondContact O-N 3.15Å; D684-D686 WeakPolarHBondContact OD1-CA 3.49Å; D684-D686 WeakPolarHBondContact OD1-CB 3.18Å; D684-D686 PolarHBondContact OD1-N 2.98Å; D686-Y689 PolarHBondContact O-N 3.2Å; D686-N690 WeakPolarHBondContact O-CB 3.49Å; D686-N690 PolarHBondContact O-N 3.16Å; D686-N690 PolarHBondContact O-ND2 3.23Å
687	D	91.8	Very high	90.8	Very high	38 Å²	38	66.1 Å²	66.1	20%	0.203	34%	0.339	C	S	.	.	H	α-helix	trans	-63.5	-45.7	176.6	-56.3	-48.4	0	0	0	111.5	L676 A683 D684 Y689 N690 V691	L676-D687 HydrophobicContact CD1-CB 4.42Å; A683-D687 HydrophobicContact CB-CB 4.39Å; D684-D687 PolarHBondContact N-OD2 3.26Å; D684-D687 PolarHBondContact O-N 2.93Å; D684-D687 PolarHBondContact OD1-N 3.21Å; D687-Y689 VanDerWaalsContact C-N 3.34Å; D687-Y689 PolarHBondContact O-N 3.21Å; D687-N690 PolarHBondContact O-N 3.24Å; D687-V691 PolarHBondContact O-N 2.96Å; D687-V691 VanDerWaalsContact O-N 3.13Å
688	I	92	Very high	91.2	Very high	43 Å²	43	64 Å²	64	22%	0.221	33%	0.328	C	S	.	.	H	α-helix	trans	-57.3	-46.3	172	-73.5	168	0	0	0	110.6	L676 D684 L692 P730 I733	L676-I688 HydrophobicContact CD1-CG1 4.18Å; D684-I688 WeakPolarHBondContact O-CG1 3.41Å; D684-I688 PolarHBondContact O-N 3.26Å; D684-I688 VanDerWaalsContact O-N 3.12Å; I688-L692 WeakPolarHBondContact O-CB 3.46Å; I688-L692 PolarHBondContact O-N 3.11Å; I688-P730 HydrophobicContact CD1-CG 4.01Å; I688-P730 HydrophobicContact CG1-CG 4.23Å; I688-P730 HydrophobicContact CG2-CB 4.44Å; I688-P730 HydrophobicContact CG2-CG 3.83Å; I688-I733 HydrophobicContact CG2-CD1 4.2Å
689	Y	93.6	Very high	91.5	Very high	115 Å²	115	57.2 Å²	57.2	45%	0.451	30%	0.296	S	S	.	.	H	α-helix	trans	-68.7	-35.6	179.9	-178.8	-100.3	0	0	0	113.2	D685 D686 D687 L692 S693	D685-Y689 WeakPolarHBondContact O-CB 3.42Å; D685-Y689 PolarHBondContact O-N 3.27Å; D686-Y689 PolarHBondContact O-N 3.2Å; D687-Y689 VanDerWaalsContact C-N 3.34Å; D687-Y689 PolarHBondContact O-N 3.21Å; Y689-L692 PolarHBondContact O-N 3.13Å; Y689-S693 WeakPolarHBondContact O-CB 3.15Å; Y689-S693 PolarHBondContact O-N 2.72Å; Y689-S693 PolarHBondContact O-OG 3.47Å
690	N	94	Very high	92.1	Very high	69 Å²	69	53.8 Å²	53.8	37%	0.369	28%	0.282	S	S	.	.	H	α-helix	trans	-63.9	-46.2	177	-78.5	-44.9	0	0	0	111.4	D686 D687 T694	D686-N690 WeakPolarHBondContact O-CB 3.49Å; D686-N690 PolarHBondContact O-N 3.16Å; D686-N690 PolarHBondContact O-ND2 3.23Å; D687-N690 PolarHBondContact O-N 3.24Å; N690-T694 WeakPolarHBondContact O-CB 3.33Å; N690-T694 PolarHBondContact O-N 3.28Å; N690-T694 PolarHBondContact O-OG1 2.93Å
691	V	95.7	Very high	92.8	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-64.6	-52.3	172.8	173.5	0	0	0	0	110.8	F669 S672 V673 L676 D687 S693 T694 L695 L719 I733	F669-V691 HydrophobicContact CE2-CG1 4.25Å; S672-V691 VanDerWaalsContact C-CG2 3.46Å; S672-V691 WeakPolarHBondContact O-CG2 3.47Å; V673-V691 HydrophobicContact CG2-CG1 4.05Å; V673-V691 HydrophobicContact CG2-CG2 4.18Å; L676-V691 HydrophobicContact CB-CG2 4.01Å; L676-V691 HydrophobicContact CD2-CB 4.04Å; L676-V691 HydrophobicContact CD2-CG1 4.17Å; L676-V691 HydrophobicContact CD2-CG2 3.71Å; L676-V691 HydrophobicContact CG-CG2 4.48Å; D687-V691 PolarHBondContact O-N 2.96Å; D687-V691 VanDerWaalsContact O-N 3.13Å; V691-S693 PolarHBondContact O-N 3.13Å; V691-T694 PolarHBondContact O-N 2.83Å; V691-L695 WeakPolarHBondContact O-CB 3.41Å; V691-L695 PolarHBondContact O-N 2.85Å; V691-L719 HydrophobicContact CG1-CD1 4.03Å; V691-L719 HydrophobicContact CG1-CD2 4.46Å; V691-I733 HydrophobicContact CB-CD1 4.4Å; V691-I733 HydrophobicContact CG1-CD1 4.17Å; V691-I733 HydrophobicContact CG1-CG2 4.37Å
692	L	95.6	Very high	93.8	Very high	22 Å²	22	43.4 Å²	43.4	12%	0.115	22%	0.22	C	C	.	.	H	α-helix	trans	-61.7	-47.4	-174.6	179.1	57.8	0	0	0	112.9	I688 Y689 T694 L695 K696 Q732 I733 Q736	I688-L692 WeakPolarHBondContact O-CB 3.46Å; I688-L692 PolarHBondContact O-N 3.11Å; Y689-L692 PolarHBondContact O-N 3.13Å; L692-T694 PolarHBondContact O-N 3.35Å; L692-L695 PolarHBondContact O-N 2.68Å; L692-K696 HydrophobicContact CD1-CD 4.46Å; L692-K696 HydrophobicContact CD1-CG 4.28Å; L692-K696 WeakPolarHBondContact O-CG 3.42Å; L692-K696 PolarHBondContact O-N 3.38Å; L692-Q732 HydrophobicContact CD1-CB 3.69Å; L692-Q732 HydrophobicContact CD2-CB 3.89Å; L692-Q732 HydrophobicContact CG-CB 4.47Å; L692-I733 HydrophobicContact CB-CD1 4.29Å; L692-I733 HydrophobicContact CB-CG1 3.87Å; L692-I733 HydrophobicContact CD1-CG1 3.9Å; L692-I733 HydrophobicContact CG-CG1 4.36Å; L692-Q736 HydrophobicContact CD1-CG 4.4Å
693	S	96.3	Very high	94.4	Very high	6 Å²	6	37 Å²	37	4%	0.042	19%	0.192	C	C	.	.	H	α-helix	trans	-68.3	-34.8	-177.2	69.3	0	0	0	0	112.2	Y689 V691 R697	Y689-S693 WeakPolarHBondContact O-CB 3.15Å; Y689-S693 PolarHBondContact O-N 2.72Å; Y689-S693 PolarHBondContact O-OG 3.47Å; V691-S693 PolarHBondContact O-N 3.13Å; S693-R697 WeakPolarHBondContact O-CD 3.41Å; S693-R697 WeakPolarHBondContact O-CG 3.46Å; S693-R697 PolarHBondContact O-N 3.24Å; S693-R697 PolarHBondContact O-NH1 2.98Å; S693-R697 VanDerWaalsContact O-NH1 3.09Å; S693-R697 PolarHBondContact OG-NH1 3.46Å; S693-R697 VanDerWaalsContact OG-NH1 3.15Å
694	T	96.8	Very high	94.8	Very high	1 Å²	1	36.3 Å²	36.3	1%	0.006	19%	0.186	C	C	.	.	H	α-helix	trans	-75.2	-38.5	175.8	-47	0	0	0	0	111.2	F665 R668 F669 N690 V691 L692 R697 L698	F665-T694 HydrophobicContact CB-CG2 4.18Å; F665-T694 HydrophobicContact CD1-CG2 4.42Å; F665-T694 VanDerWaalsContact O-CG2 3.3Å; F665-T694 WeakPolarHBondContact O-CG2 3.43Å; R668-T694 HydrophobicContact CB-CG2 4.13Å; R668-T694 HydrophobicContact CG-CG2 4.28Å; F669-T694 HydrophobicContact CB-CG2 3.83Å; N690-T694 WeakPolarHBondContact O-CB 3.33Å; N690-T694 PolarHBondContact O-N 3.28Å; N690-T694 PolarHBondContact O-OG1 2.93Å; V691-T694 PolarHBondContact O-N 2.83Å; L692-T694 PolarHBondContact O-N 3.35Å; T694-R697 PolarHBondContact O-N 3.46Å; T694-L698 HydrophobicContact CG2-CD1 4.31Å; T694-L698 WeakPolarHBondContact O-CG 3.48Å; T694-L698 PolarHBondContact O-N 2.91Å
695	L	97.3	Very high	95.1	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-64.7	-39.7	175.4	-178.5	57.2	0	0	0	112.3	F669 V691 L692 R697 L698 T699 L719 I733 Q736 A737 C740	F669-L695 HydrophobicContact CD2-CB 4.24Å; F669-L695 HydrophobicContact CE2-CB 3.87Å; F669-L695 HydrophobicContact CE2-CD1 3.84Å; F669-L695 HydrophobicContact CE2-CD2 4.35Å; F669-L695 HydrophobicContact CE2-CG 4.21Å; F669-L695 HydrophobicContact CZ-CD1 3.87Å; V691-L695 WeakPolarHBondContact O-CB 3.41Å; V691-L695 PolarHBondContact O-N 2.85Å; L692-L695 PolarHBondContact O-N 2.68Å; L695-R697 PolarHBondContact O-N 2.87Å; L695-L698 PolarHBondContact O-N 2.86Å; L695-T699 VanDerWaalsContact O-CB 3.25Å; L695-T699 WeakPolarHBondContact O-CB 3.41Å; L695-T699 PolarHBondContact O-N 3.49Å; L695-T699 PolarHBondContact O-OG1 2.98Å; L695-L719 HydrophobicContact CD2-CD1 4.36Å; L695-I733 HydrophobicContact CD2-CG2 4.15Å; L695-Q736 HydrophobicContact CD2-CB 3.86Å; L695-Q736 HydrophobicContact CG-CB 3.83Å; L695-A737 HydrophobicContact CD2-CB 4.09Å; L695-C740 HydrophobicContact CD1-CB 4.18Å
696	K	97.2	Very high	95.3	Very high	43 Å²	43	29 Å²	29	19%	0.187	15%	0.147	C	C	.	.	H	α-helix	trans	-58	-47.3	173.6	-79.8	-177	178.6	-179.1	0	112.5	V628 L633 L692 T699 S700 Q736	V628-K696 WeakPolarHBondContact O-CD 3.45Å; L633-K696 HydrophobicContact CD1-CB 3.95Å; L692-K696 HydrophobicContact CD1-CD 4.46Å; L692-K696 HydrophobicContact CD1-CG 4.28Å; L692-K696 WeakPolarHBondContact O-CG 3.42Å; L692-K696 PolarHBondContact O-N 3.38Å; K696-T699 PolarHBondContact O-N 3.27Å; K696-S700 WeakPolarHBondContact O-CB 3.33Å; K696-S700 PolarHBondContact O-N 2.87Å; K696-S700 PolarHBondContact O-OG 2.96Å; K696-Q736 HydrophobicContact CG-CG 3.86Å
697	R	97.4	Very high	95.4	Very high	11 Å²	11	23.8 Å²	23.8	4%	0.042	12%	0.119	C	C	.	.	H	α-helix	trans	-58.7	-50	176.6	-67	166.4	-175.4	115.3	5.3	111.3	V624 E625 H627 L633 F665 S693 T694 L695 F701	V624-R697 HydrophobicContact CG1-CB 4.33Å; V624-R697 HydrophobicContact CG1-CG 4.06Å; V624-R697 WeakPolarHBondContact O-CD 3.39Å; V624-R697 PolarHBondContact O-NE 3.21Å; E625-R697 PolarHBondContact O-NH2 3.23Å; H627-R697 PolarHBondContact O-NE 3.35Å; H627-R697 PolarHBondContact O-NH2 3.39Å; L633-R697 HydrophobicContact CD1-CG 4.14Å; L633-R697 HydrophobicContact CD2-CG 3.79Å; F665-R697 HydrophobicContact CD2-CB 4.4Å; F665-R697 HydrophobicContact CE2-CB 4.42Å; S693-R697 WeakPolarHBondContact O-CD 3.41Å; S693-R697 WeakPolarHBondContact O-CG 3.46Å; S693-R697 PolarHBondContact O-N 3.24Å; S693-R697 PolarHBondContact O-NH1 2.98Å; S693-R697 VanDerWaalsContact O-NH1 3.09Å; S693-R697 PolarHBondContact OG-NH1 3.46Å; S693-R697 VanDerWaalsContact OG-NH1 3.15Å; T694-R697 PolarHBondContact O-N 3.46Å; L695-R697 PolarHBondContact O-N 2.87Å; R697-F701 WeakPolarHBondContact O-CD2 3.45Å; R697-F701 PolarHBondContact O-N 3.46Å; R697-F701 VanDerWaalsContact O-N 3.16Å
698	L	97.6	Very high	95.4	Very high	1 Å²	1	23.2 Å²	23.2	1%	0.005	12%	0.117	C	C	.	.	H	α-helix	trans	-63.4	-43	178.5	-71.9	169.2	0	0	0	112.1	F665 V666 F669 T694 L695 F701 H702 L712	F665-L698 HydrophobicContact CB-CD2 3.81Å; F665-L698 HydrophobicContact CB-CG 4.1Å; V666-L698 HydrophobicContact CG2-CD2 3.79Å; F669-L698 HydrophobicContact CB-CD1 3.51Å; F669-L698 HydrophobicContact CD1-CD1 3.91Å; F669-L698 HydrophobicContact CD2-CD1 4.37Å; F669-L698 HydrophobicContact CG-CD1 3.69Å; T694-L698 HydrophobicContact CG2-CD1 4.31Å; T694-L698 WeakPolarHBondContact O-CG 3.48Å; T694-L698 PolarHBondContact O-N 2.91Å; L695-L698 PolarHBondContact O-N 2.86Å; L698-F701 PolarHBondContact O-N 3.24Å; L698-H702 VanDerWaalsContact O-CB 3.25Å; L698-H702 WeakPolarHBondContact O-CB 3.49Å; L698-H702 PolarHBondContact O-N 3.44Å; L698-L712 HydrophobicContact CB-CD1 4.45Å; L698-L712 HydrophobicContact CD1-CD2 3.97Å; L698-L712 HydrophobicContact CD2-CD1 4.49Å
699	T	96.8	Very high	95.5	Very high	2 Å²	2	27.4 Å²	27.4	1%	0.012	13%	0.134	C	C	.	.	H	α-helix	trans	-62.9	-45.1	-179.4	-57.1	0	0	0	0	111.5	L695 K696 H702 N703 Q736 Q739 C740 Y743	L695-T699 VanDerWaalsContact O-CB 3.25Å; L695-T699 WeakPolarHBondContact O-CB 3.41Å; L695-T699 PolarHBondContact O-N 3.49Å; L695-T699 PolarHBondContact O-OG1 2.98Å; K696-T699 PolarHBondContact O-N 3.27Å; T699-H702 PolarHBondContact O-N 3.4Å; T699-N703 PolarHBondContact O-N 2.95Å; T699-Q736 PolarHBondContact OG1-O 3.25Å; T699-Q739 HydrophobicContact CG2-CB 3.57Å; T699-C740 HydrophobicContact CG2-CB 4.26Å; T699-C740 WeakPolarHBondContact OG1-CB 3.34Å; T699-Y743 HydrophobicContact CG2-CD2 4.3Å; T699-Y743 HydrophobicContact CG2-CE2 3.85Å; T699-Y743 WeakPolarHBondContact O-CE2 3.3Å
700	S	96	Very high	95.5	Very high	18 Å²	18	23.9 Å²	23.9	13%	0.126	12%	0.12	C	C	.	.	H	α-helix	trans	-61.3	-45.5	177.2	-53	0	0	0	0	111.5	L633 S637 K696 N703	L633-S700 WeakPolarHBondContact CB-OG 3.31Å; S637-S700 PolarHBondContact OG-O 3.34Å; K696-S700 WeakPolarHBondContact O-CB 3.33Å; K696-S700 PolarHBondContact O-N 2.87Å; K696-S700 PolarHBondContact O-OG 2.96Å; S700-N703 PolarHBondContact O-N 3.21Å
701	F	96.8	Very high	95.4	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-68.8	-32.8	176.4	-87	-107.3	0	0	0	113.2	V624 C636 S637 Y640 L661 I662 R697 L698 N703 A704 H705 L707	V624-F701 HydrophobicContact CG1-CE2 3.92Å; V624-F701 HydrophobicContact CG2-CE2 3.84Å; V624-F701 HydrophobicContact CG2-CZ 3.95Å; C636-F701 HydrophobicContact CB-CE2 4.23Å; C636-F701 HydrophobicContact CB-CZ 4.29Å; S637-F701 WeakPolarHBondContact OG-CA 3.41Å; Y640-F701 AromaticContact CD2-CE1 3.58Å; Y640-F701 HydrophobicContact CD2-CE1 3.58Å; Y640-F701 AromaticContact CD2-CZ 3.64Å; Y640-F701 HydrophobicContact CD2-CZ 3.64Å; Y640-F701 HydrophobicContact CE2-CE1 4.12Å; Y640-F701 HydrophobicContact CE2-CZ 4.06Å; Y640-F701 AromaticContact CG-CE1 3.98Å; Y640-F701 HydrophobicContact CG-CE1 3.98Å; Y640-F701 HydrophobicContact CG-CZ 4.45Å; L661-F701 HydrophobicContact CD2-CE1 4.03Å; L661-F701 HydrophobicContact CD2-CZ 3.86Å; I662-F701 HydrophobicContact CD1-CB 3.79Å; I662-F701 HydrophobicContact CD1-CD1 3.83Å; I662-F701 HydrophobicContact CD1-CG 3.96Å; R697-F701 WeakPolarHBondContact O-CD2 3.45Å; R697-F701 PolarHBondContact O-N 3.46Å; R697-F701 VanDerWaalsContact O-N 3.16Å; L698-F701 PolarHBondContact O-N 3.24Å; F701-N703 VanDerWaalsContact C-N 3.27Å; F701-N703 PolarHBondContact O-N 3.5Å; F701-A704 PolarHBondContact O-N 3.15Å; F701-H705 AromaticContact CD1-CD2 3.47Å; F701-H705 VanDerWaalsContact CD1-CD2 3.47Å; F701-H705 WeakPolarHBondContact CD1-CD2 3.4Å; F701-H705 VanDerWaalsContact O-CB 3.3Å; F701-H705 WeakPolarHBondContact O-CB 3.23Å; F701-H705 PolarHBondContact O-CD2 3.18Å; F701-H705 PolarHBondContact O-N 2.89Å; F701-L707 HydrophobicContact CB-CD1 4.47Å
702	H	96.9	Very high	95.4	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-71.6	-21.8	-179.8	-157.1	174.1	0	0	0	113.1	L698 T699 L707 C740 Y743 S744 W747	L698-H702 VanDerWaalsContact O-CB 3.25Å; L698-H702 WeakPolarHBondContact O-CB 3.49Å; L698-H702 PolarHBondContact O-N 3.44Å; T699-H702 PolarHBondContact O-N 3.4Å; H702-L707 HydrophobicContact CB-CD1 3.84Å; H702-L707 HydrophobicContact CB-CG 4.26Å; H702-C740 PolarHBondContact ND1-O 2.85Å; H702-C740 PolarHBondContact ND1-SG 2.93Å; H702-C740 VanDerWaalsContact ND1-SG 3.44Å; H702-Y743 HydrophobicContact CB-CD2 4.11Å; H702-S744 PolarHBondContact CE1-N 3.06Å; H702-S744 PolarHBondContact CE1-OG 3.26Å; H702-S744 VanDerWaalsContact CE1-OG 3.28Å; H702-W747 AromaticContact CD2-CD1 3.58Å; H702-W747 AromaticContact NE2-CD1 3.85Å; H702-W747 PolarHBondContact O-NE1 3.39Å
703	N	95.4	Very high	95.4	Very high	47 Å²	47	25.6 Å²	25.6	25%	0.251	13%	0.128	S	C	.	.	H	α-helix	trans	-61.9	-53.8	172.9	-166.2	9.6	0	0	0	110.7	T699 S700 F701 Y743	T699-N703 PolarHBondContact O-N 2.95Å; S700-N703 PolarHBondContact O-N 3.21Å; F701-N703 VanDerWaalsContact C-N 3.27Å; F701-N703 PolarHBondContact O-N 3.5Å; N703-Y743 HydrophobicContact CB-CD2 4.26Å; N703-Y743 HydrophobicContact CB-CE1 4.1Å; N703-Y743 HydrophobicContact CB-CE2 3.8Å; N703-Y743 WeakPolarHBondContact OD1-CE1 3.25Å
704	A	93.9	Very high	95.3	Very high	10 Å²	10	26.9 Å²	26.9	8%	0.083	14%	0.142	C	C	.	.	H	α-helix	trans	-94.9	2.1	-175.6	0	0	0	0	0	115.5	S637 F701 F1253	S637-A704 WeakPolarHBondContact OG-CB 3.46Å; F701-A704 PolarHBondContact O-N 3.15Å; A704-F1253 HydrophobicContact CB-CB 4.24Å; A704-F1253 HydrophobicContact CB-CD2 4.24Å; A704-F1253 HydrophobicContact CB-CG 4.24Å
705	H	94.2	Very high	95.2	Very high	7 Å²	7	28 Å²	28	3%	0.032	15%	0.147	C	C	.	.	S	Bend	trans	-140.5	139.2	-177.8	-49.9	-50.3	0	0	0	114.1	S637 Y640 S641 R658 F701 L707 W747	S637-H705 PolarHBondContact O-NE2 3.23Å; Y640-H705 WeakPolarHBondContact CB-NE2 3.38Å; Y640-H705 PolarHBondContact O-NE2 3.16Å; S641-H705 WeakPolarHBondContact CA-NE2 3.41Å; S641-H705 WeakPolarHBondContact CB-NE2 3.25Å; S641-H705 PolarHBondContact N-NE2 2.96Å; R658-H705 PolarHBondContact NH1-CE1 3.34Å; R658-H705 PolarHBondContact NH1-ND1 3.31Å; F701-H705 AromaticContact CD1-CD2 3.47Å; F701-H705 VanDerWaalsContact CD1-CD2 3.47Å; F701-H705 WeakPolarHBondContact CD1-CD2 3.4Å; F701-H705 VanDerWaalsContact O-CB 3.3Å; F701-H705 WeakPolarHBondContact O-CB 3.23Å; F701-H705 PolarHBondContact O-CD2 3.18Å; F701-H705 PolarHBondContact O-N 2.89Å; H705-L707 HydrophobicContact CB-CD2 3.95Å; H705-L707 PolarHBondContact O-N 3.32Å; H705-W747 VanDerWaalsContact C-CE2 3.42Å; H705-W747 VanDerWaalsContact C-CZ2 3.47Å; H705-W747 PolarHBondContact O-NE1 3.35Å
706	D	93.6	Very high	95.2	Very high	64 Å²	64	28 Å²	28	34%	0.342	15%	0.147	S	C	.	.			trans	-63.6	102	168.5	-179.7	3.9	0	0	0	110.8	T708 W747	D706-T708 WeakPolarHBondContact OD1-CA 3.32Å; D706-T708 WeakPolarHBondContact OD1-CB 3.46Å; D706-T708 WeakPolarHBondContact OD1-CG2 3.34Å; D706-T708 PolarHBondContact OD1-N 3.34Å; D706-T708 PolarHBondContact OD1-OG1 3.3Å; D706-T708 PolarHBondContact OD2-OG1 3Å; D706-W747 HydrophobicContact CB-CD2 3.93Å; D706-W747 HydrophobicContact CB-CE3 3.6Å; D706-W747 HydrophobicContact CB-CG 4.42Å; D706-W747 HydrophobicContact CB-CZ3 3.98Å
707	L	95.7	Very high	95.1	Very high	3 Å²	3	29.2 Å²	29.2	2%	0.016	15%	0.151	C	C	.	.			trans	-100.7	17.8	172.4	-49.8	-169.8	0	0	0	113	I662 F701 H702 H705 K709 W710 L712	I662-L707 HydrophobicContact CD1-CD1 4.1Å; I662-L707 HydrophobicContact CD1-CD2 4.25Å; I662-L707 HydrophobicContact CG1-CD2 4.03Å; I662-L707 HydrophobicContact CG2-CD1 4.27Å; I662-L707 HydrophobicContact CG2-CD2 4.13Å; F701-L707 HydrophobicContact CB-CD1 4.47Å; H702-L707 HydrophobicContact CB-CD1 3.84Å; H702-L707 HydrophobicContact CB-CG 4.26Å; H705-L707 HydrophobicContact CB-CD2 3.95Å; H705-L707 PolarHBondContact O-N 3.32Å; L707-K709 PolarHBondContact O-N 3.37Å; L707-K709 VanDerWaalsContact O-N 3.08Å; L707-W710 HydrophobicContact CB-CE3 4.01Å; L707-W710 HydrophobicContact CB-CZ3 4.5Å; L707-W710 HydrophobicContact CD2-CE3 4.2Å; L707-W710 HydrophobicContact CD2-CZ3 3.91Å; L707-W710 PolarHBondContact O-N 3.17Å; L707-L712 HydrophobicContact CB-CD1 4.14Å; L707-L712 HydrophobicContact CD1-CD1 3.88Å
708	T	91.6	Very high	94.9	Very high	25 Å²	25	32.6 Å²	32.6	15%	0.153	16%	0.164	C	C	.	.	G	3₁₀ helix	trans	-63.1	-17.9	-178.1	61.1	0	0	0	0	114.2	D706 W710 W747 Q748 K751	D706-T708 WeakPolarHBondContact OD1-CA 3.32Å; D706-T708 WeakPolarHBondContact OD1-CB 3.46Å; D706-T708 WeakPolarHBondContact OD1-CG2 3.34Å; D706-T708 PolarHBondContact OD1-N 3.34Å; D706-T708 PolarHBondContact OD1-OG1 3.3Å; D706-T708 PolarHBondContact OD2-OG1 3Å; T708-W710 PolarHBondContact O-N 3.43Å; T708-W747 HydrophobicContact CG2-CB 3.62Å; T708-Q748 HydrophobicContact CG2-CG 3.95Å; T708-K751 PolarHBondContact OG1-NZ 3.13Å
709	K	92.4	Very high	94.8	Very high	132 Å²	132	32.6 Å²	32.6	57%	0.574	16%	0.164	S	C	*	.	G	3₁₀ helix	trans	-58.7	-26.7	169.8	163.2	-177.2	169.1	-113.5	0	112.8	D663 L707	D663-K709 IonicContact OD1-NZ 3.09Å; D663-K709 PolarHBondContact OD1-NZ 2.95Å; D663-K709 IonicContact OD2-NZ 2.88Å; L707-K709 PolarHBondContact O-N 3.37Å; L707-K709 VanDerWaalsContact O-N 3.08Å
710	W	95	Very high	94.7	Very high	41 Å²	41	32.6 Å²	32.6	16%	0.155	16%	0.164	C	C	.	.	G	3₁₀ helix	trans	-107.8	-0.2	-167.1	-68.8	-87.7	0	0	0	115.3	I662 D663 V666 L707 T708 L712	I662-W710 HydrophobicContact CB-CH2 4.21Å; I662-W710 HydrophobicContact CB-CZ2 3.89Å; I662-W710 HydrophobicContact CG2-CD2 3.68Å; I662-W710 HydrophobicContact CG2-CE3 3.99Å; I662-W710 HydrophobicContact CG2-CG 4.2Å; I662-W710 HydrophobicContact CG2-CH2 4.03Å; I662-W710 HydrophobicContact CG2-CZ2 3.69Å; I662-W710 HydrophobicContact CG2-CZ3 4.17Å; D663-W710 PolarHBondContact OD1-NE1 2.82Å; V666-W710 HydrophobicContact CB-CG 4.49Å; V666-W710 HydrophobicContact CG1-CB 4.15Å; V666-W710 HydrophobicContact CG1-CG 4.38Å; V666-W710 HydrophobicContact CG2-CB 3.88Å; V666-W710 HydrophobicContact CG2-CG 3.84Å; L707-W710 HydrophobicContact CB-CE3 4.01Å; L707-W710 HydrophobicContact CB-CZ3 4.5Å; L707-W710 HydrophobicContact CD2-CE3 4.2Å; L707-W710 HydrophobicContact CD2-CZ3 3.91Å; L707-W710 PolarHBondContact O-N 3.17Å; T708-W710 PolarHBondContact O-N 3.43Å; W710-L712 PolarHBondContact O-N 2.99Å
711	D	92.1	Very high	94.5	Very high	104 Å²	104	36 Å²	36	56%	0.556	18%	0.176	S	C	*	.			trans	45.7	45.8	176.8	-162.2	22.4	0	0	0	116.4	F713 G714	D711-F713 PolarHBondContact O-N 3.08Å; D711-F713 VanDerWaalsContact O-N 3.07Å; D711-G714 PolarHBondContact O-N 3.2Å
712	L	95.2	Very high	94.2	Very high	2 Å²	2	38 Å²	38	1%	0.01	19%	0.189	C	C	.	.	H	α-helix	trans	-56.2	-25.3	179.2	-71	174.4	0	0	0	114.4	V666 F669 L698 L707 W710 G714 C716	V666-L712 HydrophobicContact CG2-CD2 4.1Å; F669-L712 HydrophobicContact CD1-CD2 4.1Å; F669-L712 HydrophobicContact CE1-CD2 4.29Å; L698-L712 HydrophobicContact CB-CD1 4.45Å; L698-L712 HydrophobicContact CD1-CD2 3.97Å; L698-L712 HydrophobicContact CD2-CD1 4.49Å; L707-L712 HydrophobicContact CB-CD1 4.14Å; L707-L712 HydrophobicContact CD1-CD1 3.88Å; W710-L712 PolarHBondContact O-N 2.99Å; L712-G714 VanDerWaalsContact C-N 3.3Å; L712-G714 PolarHBondContact O-N 3.01Å; L712-C716 PolarHBondContact O-N 3.48Å; L712-C716 PolarHBondContact O-SG 3.45Å
713	F	95.2	Very high	93.8	Very high	21 Å²	21	38.5 Å²	38.5	9%	0.092	20%	0.195	C	C	.	.	H	α-helix	trans	-58.2	-39.9	-179.4	-173.9	-88.5	0	0	0	112.3	D711 N715 C716 Y717 S744 I745 T768 F772	D711-F713 PolarHBondContact O-N 3.08Å; D711-F713 VanDerWaalsContact O-N 3.07Å; F713-N715 PolarHBondContact O-N 3.33Å; F713-C716 PolarHBondContact O-N 2.85Å; F713-Y717 AromaticContact CE1-CD2 3.86Å; F713-Y717 HydrophobicContact CE1-CD2 3.86Å; F713-Y717 AromaticContact CE1-CG 3.85Å; F713-Y717 HydrophobicContact CE1-CG 3.85Å; F713-Y717 AromaticContact CZ-CD2 3.72Å; F713-Y717 HydrophobicContact CZ-CD2 3.72Å; F713-Y717 HydrophobicContact CZ-CG 4.15Å; F713-Y717 WeakPolarHBondContact O-CB 3.47Å; F713-Y717 PolarHBondContact O-N 3.41Å; F713-S744 PolarHBondContact N-OG 3.35Å; F713-I745 HydrophobicContact CE2-CD1 4.02Å; F713-I745 HydrophobicContact CE2-CG1 4.34Å; F713-T768 HydrophobicContact CD1-CG2 3.96Å; F713-T768 HydrophobicContact CD2-CG2 3.83Å; F713-T768 HydrophobicContact CE1-CG2 3.72Å; F713-T768 HydrophobicContact CE2-CG2 3.56Å; F713-T768 HydrophobicContact CG-CG2 4.03Å; F713-T768 HydrophobicContact CZ-CG2 3.51Å; F713-F772 HydrophobicContact CE2-CB 4.1Å; F713-F772 HydrophobicContact CE2-CD2 4.16Å; F713-F772 HydrophobicContact CE2-CG 4.26Å; F713-F772 HydrophobicContact CZ-CB 4.16Å
714	G	94.1	Very high	93.4	Very high	32 Å²	32	39.3 Å²	39.3	33%	0.33	20%	0.198	S	C	.	.	H	α-helix	trans	-58	-46.7	-174.7	0	0	0	0	0	113.1	D711 L712 R718	D711-G714 PolarHBondContact O-N 3.2Å; L712-G714 VanDerWaalsContact C-N 3.3Å; L712-G714 PolarHBondContact O-N 3.01Å; G714-R718 WeakPolarHBondContact O-CG 3.37Å; G714-R718 PolarHBondContact O-N 2.98Å
715	N	95.4	Very high	93	Very high	24 Å²	24	44.5 Å²	44.5	13%	0.128	22%	0.221	C	C	.	.	H	α-helix	trans	-81	-34.3	179.9	-82.3	-17	0	0	0	112.8	F669 N670 V673 F713 Y717 R718 L719	F669-N715 HydrophobicContact CE1-CB 3.83Å; F669-N715 HydrophobicContact CZ-CB 4.34Å; N670-N715 PolarHBondContact OD1-ND2 3Å; V673-N715 HydrophobicContact CG1-CB 4.09Å; F713-N715 PolarHBondContact O-N 3.33Å; N715-Y717 PolarHBondContact O-N 3.22Å; N715-R718 WeakPolarHBondContact O-CB 3.41Å; N715-R718 PolarHBondContact O-N 2.9Å; N715-R718 WeakPolarHBondContact OD1-CD 3.41Å; N715-R718 PolarHBondContact OD1-NH1 3.27Å; N715-L719 PolarHBondContact O-N 2.94Å; N715-L719 VanDerWaalsContact O-N 3.09Å
716	C	96.5	Very high	92.3	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-62.7	-43.3	172.3	-61.8	0	0	0	0	111.8	L712 F713 R718 L719 L720 A737 S741	L712-C716 PolarHBondContact O-N 3.48Å; L712-C716 PolarHBondContact O-SG 3.45Å; F713-C716 PolarHBondContact O-N 2.85Å; C716-R718 VanDerWaalsContact C-N 3.32Å; C716-R718 PolarHBondContact O-N 2.95Å; C716-L719 PolarHBondContact O-N 3.43Å; C716-L720 VanDerWaalsContact O-CG 3.31Å; C716-L720 WeakPolarHBondContact O-CG 3.29Å; C716-L720 PolarHBondContact O-N 3.5Å; C716-A737 HydrophobicContact CB-CB 4.21Å; C716-S741 WeakPolarHBondContact CB-OG 3.37Å
717	Y	95.1	Very high	91.3	Very high	69 Å²	69	49.8 Å²	49.8	27%	0.271	26%	0.261	S	S	.	.	H	α-helix	trans	-64.4	-33.4	176.5	-176	-94.7	0	0	0	112.7	F713 N715 K721 V775	F713-Y717 AromaticContact CE1-CD2 3.86Å; F713-Y717 HydrophobicContact CE1-CD2 3.86Å; F713-Y717 AromaticContact CE1-CG 3.85Å; F713-Y717 HydrophobicContact CE1-CG 3.85Å; F713-Y717 AromaticContact CZ-CD2 3.72Å; F713-Y717 HydrophobicContact CZ-CD2 3.72Å; F713-Y717 HydrophobicContact CZ-CG 4.15Å; F713-Y717 WeakPolarHBondContact O-CB 3.47Å; F713-Y717 PolarHBondContact O-N 3.41Å; N715-Y717 PolarHBondContact O-N 3.22Å; Y717-K721 HydrophobicContact CE1-CD 4.38Å; Y717-K721 VanDerWaalsContact O-CB 3.27Å; Y717-K721 WeakPolarHBondContact O-CB 3.26Å; Y717-K721 PolarHBondContact O-N 3.14Å; Y717-V775 HydrophobicContact CD2-CG2 4.4Å; Y717-V775 HydrophobicContact CE2-CG2 3.79Å
718	R	94.1	Very high	90.3	Very high	83 Å²	83	53.1 Å²	53.1	31%	0.313	29%	0.289	S	S	.	.	H	α-helix	trans	-62.8	-52.3	171.5	-75.7	168	64.6	-178.2	9.4	111.6	E674 L677 G714 N715 C716 L720 K721 T722	E674-R718 VanDerWaalsContact CD-NH2 3.32Å; E674-R718 IonicContact OE1-CZ 2.83Å; E674-R718 IonicContact OE1-NH1 2.69Å; E674-R718 PolarHBondContact OE1-NH1 3.33Å; E674-R718 IonicContact OE1-NH2 3.43Å; E674-R718 PolarHBondContact OE1-NH2 3Å; E674-R718 IonicContact OE2-CZ 2.85Å; E674-R718 IonicContact OE2-NH1 3.1Å; E674-R718 IonicContact OE2-NH2 3.83Å; E674-R718 PolarHBondContact OE2-NH2 2.84Å; L677-R718 HydrophobicContact CD1-CB 4.05Å; G714-R718 WeakPolarHBondContact O-CG 3.37Å; G714-R718 PolarHBondContact O-N 2.98Å; N715-R718 WeakPolarHBondContact O-CB 3.41Å; N715-R718 PolarHBondContact O-N 2.9Å; N715-R718 WeakPolarHBondContact OD1-CD 3.41Å; N715-R718 PolarHBondContact OD1-NH1 3.27Å; C716-R718 VanDerWaalsContact C-N 3.32Å; C716-R718 PolarHBondContact O-N 2.95Å; R718-L720 VanDerWaalsContact C-N 3.33Å; R718-L720 PolarHBondContact O-N 3.04Å; R718-K721 PolarHBondContact O-N 2.73Å; R718-T722 PolarHBondContact O-N 3.22Å; R718-T722 PolarHBondContact O-OG1 2.97Å; R718-T722 VanDerWaalsContact O-OG1 3.12Å
719	L	94.6	Very high	90.1	Very high	1 Å²	1	53.3 Å²	53.3	1%	0.005	29%	0.288	C	S	.	.	H	α-helix	trans	-55.4	-47.6	178.5	-69.1	171.3	0	0	0	111.7	F669 V673 L676 V691 L695 N715 C716 K721 T722 G723 M729 I733	F669-L719 HydrophobicContact CE2-CD1 4.11Å; F669-L719 HydrophobicContact CZ-CD1 4.06Å; V673-L719 HydrophobicContact CG1-CD2 4.14Å; V673-L719 HydrophobicContact CG1-CG 4.2Å; V673-L719 HydrophobicContact CG2-CD1 3.93Å; V673-L719 HydrophobicContact CG2-CD2 4.3Å; V673-L719 HydrophobicContact CG2-CG 4.33Å; L676-L719 HydrophobicContact CD2-CD2 4.17Å; V691-L719 HydrophobicContact CG1-CD1 4.03Å; V691-L719 HydrophobicContact CG1-CD2 4.46Å; L695-L719 HydrophobicContact CD2-CD1 4.36Å; N715-L719 PolarHBondContact O-N 2.94Å; N715-L719 VanDerWaalsContact O-N 3.09Å; C716-L719 PolarHBondContact O-N 3.43Å; L719-K721 PolarHBondContact O-N 2.72Å; L719-T722 PolarHBondContact O-N 2.96Å; L719-G723 PolarHBondContact O-N 3.39Å; L719-M729 HydrophobicContact CB-CE 4.49Å; L719-M729 HydrophobicContact CD2-CE 3.91Å; L719-M729 HydrophobicContact CD2-SD 4.48Å; L719-I733 HydrophobicContact CD1-CG2 4.02Å
720	L	94.8	Very high	90	Very high	2 Å²	2	49 Å²	49	1%	0.01	27%	0.274	C	S	.	.	H	α-helix	trans	-61.4	-44.8	178.3	-67.9	170.2	0	0	0	112.2	C716 R718 G723 I724 V734 A737 L738 F772 V775	C716-L720 VanDerWaalsContact O-CG 3.31Å; C716-L720 WeakPolarHBondContact O-CG 3.29Å; C716-L720 PolarHBondContact O-N 3.5Å; R718-L720 VanDerWaalsContact C-N 3.33Å; R718-L720 PolarHBondContact O-N 3.04Å; L720-G723 PolarHBondContact O-N 3.21Å; L720-I724 WeakPolarHBondContact O-CG1 3.23Å; L720-I724 PolarHBondContact O-N 3.08Å; L720-V734 HydrophobicContact CD2-CB 4.49Å; L720-V734 HydrophobicContact CD2-CG1 3.86Å; L720-A737 HydrophobicContact CD1-CB 4.24Å; L720-A737 HydrophobicContact CD2-CB 3.84Å; L720-A737 HydrophobicContact CG-CB 3.8Å; L720-L738 HydrophobicContact CD1-CD2 4.07Å; L720-L738 HydrophobicContact CD1-CG 4.49Å; L720-L738 HydrophobicContact CD2-CD2 3.99Å; L720-L738 HydrophobicContact CD2-CG 3.81Å; L720-F772 HydrophobicContact CD1-CD2 4.47Å; L720-F772 HydrophobicContact CD1-CE2 3.92Å; L720-V775 HydrophobicContact CB-CG1 3.87Å; L720-V775 HydrophobicContact CD1-CG1 4.03Å; L720-V775 HydrophobicContact CG-CG1 4.4Å
721	K	92	Very high	89.9	Confident	88 Å²	88	50.4 Å²	50.4	38%	0.383	28%	0.282	S	S	.	.	H	α-helix	trans	-65.3	-44.9	179.4	-175.2	176	178	-69.6	0	112	Y717 R718 L719 G723 I724 E725	Y717-K721 HydrophobicContact CE1-CD 4.38Å; Y717-K721 VanDerWaalsContact O-CB 3.27Å; Y717-K721 WeakPolarHBondContact O-CB 3.26Å; Y717-K721 PolarHBondContact O-N 3.14Å; R718-K721 PolarHBondContact O-N 2.73Å; L719-K721 PolarHBondContact O-N 2.72Å; K721-G723 VanDerWaalsContact C-N 3.32Å; K721-G723 PolarHBondContact O-N 2.97Å; K721-I724 PolarHBondContact O-N 3.48Å; K721-E725 WeakPolarHBondContact CE-OE1 3.29Å; K721-E725 IonicContact NZ-OE1 3.93Å; K721-E725 PolarHBondContact NZ-OE1 2.95Å; K721-E725 IonicContact NZ-OE2 3.56Å; K721-E725 PolarHBondContact NZ-OE2 2.82Å; K721-E725 WeakPolarHBondContact O-CG 3.4Å; K721-E725 PolarHBondContact O-N 3.02Å
722	T	90.1	Very high	89.9	Confident	42 Å²	42	49.8 Å²	49.8	26%	0.258	28%	0.276	S	S	.	.	H	α-helix	trans	-60.8	-42.2	174.6	-56.4	0	0	0	0	111.1	L677 R718 L719 I724 E725 H726	L677-T722 HydrophobicContact CD2-CG2 3.87Å; L677-T722 WeakPolarHBondContact CD2-OG1 3.11Å; R718-T722 PolarHBondContact O-N 3.22Å; R718-T722 PolarHBondContact O-OG1 2.97Å; R718-T722 VanDerWaalsContact O-OG1 3.12Å; L719-T722 PolarHBondContact O-N 2.96Å; T722-I724 VanDerWaalsContact C-N 3.31Å; T722-I724 PolarHBondContact O-N 3.49Å; T722-E725 PolarHBondContact O-N 2.77Å; T722-H726 WeakPolarHBondContact O-CB 3.28Å; T722-H726 PolarHBondContact O-N 3.36Å
723	G	88.2	Confident	89.9	Confident	12 Å²	12	49.7 Å²	49.7	12%	0.124	28%	0.275	C	S	.	.	H	α-helix	trans	-61.1	-35.7	176.6	0	0	0	0	0	114.1	L719 L720 K721 G727 M729	L719-G723 PolarHBondContact O-N 3.39Å; L720-G723 PolarHBondContact O-N 3.21Å; K721-G723 VanDerWaalsContact C-N 3.32Å; K721-G723 PolarHBondContact O-N 2.97Å; G723-G727 VanDerWaalsContact O-CA 3.23Å; G723-G727 WeakPolarHBondContact O-CA 3.42Å; G723-G727 PolarHBondContact O-N 3.48Å; G723-M729 VanDerWaalsContact CA-CB 3.45Å
724	I	87.4	Confident	90	Very high	64 Å²	64	49.1 Å²	49.1	33%	0.328	27%	0.274	S	S	.	.	H	α-helix	trans	-75.3	-38.7	174.8	-68.4	165.3	0	0	0	111.8	L720 K721 T722 V775 Q778	L720-I724 WeakPolarHBondContact O-CG1 3.23Å; L720-I724 PolarHBondContact O-N 3.08Å; K721-I724 PolarHBondContact O-N 3.48Å; T722-I724 VanDerWaalsContact C-N 3.31Å; T722-I724 PolarHBondContact O-N 3.49Å; I724-V775 HydrophobicContact CD1-CB 4.41Å; I724-V775 HydrophobicContact CD1-CG1 3.93Å; I724-V775 HydrophobicContact CD1-CG2 4.39Å; I724-Q778 HydrophobicContact CD1-CB 4.02Å
725	E	85.3	Confident	90	Very high	118 Å²	118	48.7 Å²	48.7	55%	0.551	26%	0.264	S	S	*	.	H	α-helix	trans	-77	-28.6	-177	-74.1	176.6	149.6	0	0	113.8	K721 T722	K721-E725 WeakPolarHBondContact CE-OE1 3.29Å; K721-E725 IonicContact NZ-OE1 3.93Å; K721-E725 PolarHBondContact NZ-OE1 2.95Å; K721-E725 IonicContact NZ-OE2 3.56Å; K721-E725 PolarHBondContact NZ-OE2 2.82Å; K721-E725 WeakPolarHBondContact O-CG 3.4Å; K721-E725 PolarHBondContact O-N 3.02Å; T722-E725 PolarHBondContact O-N 2.77Å
726	H	80.1	Confident	90.1	Very high	118 Å²	118	48.7 Å²	48.7	55%	0.546	26%	0.264	S	S	.	.	H	α-helix	trans	-114.7	-17.7	-176.8	-66.6	-98.2	0	0	0	114.5	T722 A728	T722-H726 WeakPolarHBondContact O-CB 3.28Å; T722-H726 PolarHBondContact O-N 3.36Å; H726-A728 PolarHBondContact O-N 2.98Å; H726-A728 VanDerWaalsContact O-N 3.08Å
727	G	73.5	Confident	90.1	Very high	65 Å²	65	48.7 Å²	48.7	67%	0.67	26%	0.264	S	S	*	.	S	Bend	trans	71.5	-6	178.3	0	0	0	0	0	116.3	G723	G723-G727 VanDerWaalsContact O-CA 3.23Å; G723-G727 WeakPolarHBondContact O-CA 3.42Å; G723-G727 PolarHBondContact O-N 3.48Å
728	A	73	Confident	90.2	Very high	73 Å²	73	45.4 Å²	45.4	60%	0.603	25%	0.251	S	S	*	.			trans	-91	-2.1	-172.8	0	0	0	0	0	115.4	H726 P730	H726-A728 PolarHBondContact O-N 2.98Å; H726-A728 VanDerWaalsContact O-N 3.08Å; A728-P730 WeakPolarHBondContact O-CD 3.35Å
729	M	88.4	Confident	90.4	Very high	29 Å²	29	43.2 Å²	43.2	14%	0.143	24%	0.244	C	C	.	.	S	Bend	trans	-74.4	126	-175.6	-173.1	63.6	62.8	0	0	111.7	L719 G723 I733 V734	L719-M729 HydrophobicContact CB-CE 4.49Å; L719-M729 HydrophobicContact CD2-CE 3.91Å; L719-M729 HydrophobicContact CD2-SD 4.48Å; G723-M729 VanDerWaalsContact CA-CB 3.45Å; M729-I733 HydrophobicContact CG-CB 4.31Å; M729-I733 HydrophobicContact CG-CG2 4.22Å; M729-I733 HydrophobicContact SD-CB 4.03Å; M729-I733 HydrophobicContact SD-CD1 4.11Å; M729-I733 HydrophobicContact SD-CG2 3.68Å; M729-V734 HydrophobicContact CB-CG2 4.07Å; M729-V734 HydrophobicContact CG-CG2 3.7Å
730	P	91	Very high	90.5	Very high	42 Å²	42	43.2 Å²	43.2	27%	0.273	24%	0.244	S	C	.	.			trans	-56.2	136.6	178.1	-28.8	36.6	0	0	0	113.5	I688 A728 Q732 I733 V734	I688-P730 HydrophobicContact CD1-CG 4.01Å; I688-P730 HydrophobicContact CG1-CG 4.23Å; I688-P730 HydrophobicContact CG2-CB 4.44Å; I688-P730 HydrophobicContact CG2-CG 3.83Å; A728-P730 WeakPolarHBondContact O-CD 3.35Å; P730-Q732 VanDerWaalsContact C-N 3.29Å; P730-Q732 PolarHBondContact O-N 2.72Å; P730-I733 HydrophobicContact CB-CD1 4.48Å; P730-I733 HydrophobicContact CG-CD1 4.37Å; P730-I733 PolarHBondContact O-N 3.35Å; P730-V734 PolarHBondContact O-N 3.33Å
731	E	91.9	Very high	90.6	Very high	69 Å²	69	43.1 Å²	43.1	32%	0.322	24%	0.243	S	C	.	.	H	α-helix	trans	-58.1	-35.9	-172.3	51.9	158.5	-149.8	0	0	114.1	I733 V734 V735 N784 V787	E731-I733 VanDerWaalsContact C-N 3.31Å; E731-I733 PolarHBondContact O-N 3.2Å; E731-V734 PolarHBondContact O-N 3.03Å; E731-V734 VanDerWaalsContact O-N 3.16Å; E731-V735 WeakPolarHBondContact O-CG2 3.47Å; E731-V735 PolarHBondContact O-N 3.41Å; E731-N784 HydrophobicContact CB-CB 4.35Å; E731-N784 WeakPolarHBondContact OE2-CB 3.32Å; E731-V787 HydrophobicContact CB-CG2 3.75Å
732	Q	93.1	Very high	90.8	Very high	91 Å²	91	39.5 Å²	39.5	43%	0.425	23%	0.228	S	C	.	.	H	α-helix	trans	-67.3	-32	178.1	-60.3	-166.4	20.3	0	0	112.2	L692 P730 Q736	L692-Q732 HydrophobicContact CD1-CB 3.69Å; L692-Q732 HydrophobicContact CD2-CB 3.89Å; L692-Q732 HydrophobicContact CG-CB 4.47Å; P730-Q732 VanDerWaalsContact C-N 3.29Å; P730-Q732 PolarHBondContact O-N 2.72Å; Q732-Q736 WeakPolarHBondContact O-CB 3.5Å; Q732-Q736 WeakPolarHBondContact O-CG 3.38Å; Q732-Q736 PolarHBondContact O-N 3.28Å
733	I	95.1	Very high	91.2	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-68.6	-41.3	172.8	-63.2	179	0	0	0	109.5	L676 I688 V691 L692 L695 L719 M729 P730 E731 A737	L676-I733 HydrophobicContact CD2-CD1 4.39Å; I688-I733 HydrophobicContact CG2-CD1 4.2Å; V691-I733 HydrophobicContact CB-CD1 4.4Å; V691-I733 HydrophobicContact CG1-CD1 4.17Å; V691-I733 HydrophobicContact CG1-CG2 4.37Å; L692-I733 HydrophobicContact CB-CD1 4.29Å; L692-I733 HydrophobicContact CB-CG1 3.87Å; L692-I733 HydrophobicContact CD1-CG1 3.9Å; L692-I733 HydrophobicContact CG-CG1 4.36Å; L695-I733 HydrophobicContact CD2-CG2 4.15Å; L719-I733 HydrophobicContact CD1-CG2 4.02Å; M729-I733 HydrophobicContact CG-CB 4.31Å; M729-I733 HydrophobicContact CG-CG2 4.22Å; M729-I733 HydrophobicContact SD-CB 4.03Å; M729-I733 HydrophobicContact SD-CD1 4.11Å; M729-I733 HydrophobicContact SD-CG2 3.68Å; P730-I733 HydrophobicContact CB-CD1 4.48Å; P730-I733 HydrophobicContact CG-CD1 4.37Å; P730-I733 PolarHBondContact O-N 3.35Å; E731-I733 VanDerWaalsContact C-N 3.31Å; E731-I733 PolarHBondContact O-N 3.2Å; I733-A737 WeakPolarHBondContact O-CB 3.39Å; I733-A737 PolarHBondContact O-N 3.15Å
734	V	95.5	Very high	91.5	Very high	10 Å²	10	38.9 Å²	38.9	6%	0.061	22%	0.218	C	C	.	.	H	α-helix	trans	-62.3	-49.5	176.5	-178.9	0	0	0	0	111.3	L720 M729 P730 E731 Q736 A737 L738 V787	L720-V734 HydrophobicContact CD2-CB 4.49Å; L720-V734 HydrophobicContact CD2-CG1 3.86Å; M729-V734 HydrophobicContact CB-CG2 4.07Å; M729-V734 HydrophobicContact CG-CG2 3.7Å; P730-V734 PolarHBondContact O-N 3.33Å; E731-V734 PolarHBondContact O-N 3.03Å; E731-V734 VanDerWaalsContact O-N 3.16Å; V734-Q736 PolarHBondContact O-N 3.21Å; V734-A737 PolarHBondContact O-N 3.41Å; V734-L738 HydrophobicContact CG1-CD1 4.18Å; V734-L738 HydrophobicContact CG1-CG 4.45Å; V734-L738 WeakPolarHBondContact O-CB 3.47Å; V734-L738 VanDerWaalsContact O-CG 3.26Å; V734-L738 WeakPolarHBondContact O-CG 3.44Å; V734-L738 PolarHBondContact O-N 3.29Å; V734-V787 HydrophobicContact CB-CG2 4.24Å; V734-V787 HydrophobicContact CG1-CG1 3.71Å; V734-V787 HydrophobicContact CG1-CG2 4.17Å
735	V	95.6	Very high	91.9	Very high	23 Å²	23	35.9 Å²	35.9	14%	0.139	20%	0.202	C	C	.	.	H	α-helix	trans	-58.2	-48.7	178.2	167.1	0	0	0	0	111.3	E731 L738 Q739 P786 V787 Q790	E731-V735 WeakPolarHBondContact O-CG2 3.47Å; E731-V735 PolarHBondContact O-N 3.41Å; V735-L738 WeakPolarHBondContact O-CB 3.07Å; V735-L738 PolarHBondContact O-N 3.27Å; V735-Q739 WeakPolarHBondContact O-CG 3.4Å; V735-Q739 PolarHBondContact O-N 3.46Å; V735-P786 HydrophobicContact CG2-CB 4.47Å; V735-V787 HydrophobicContact CG2-CG2 4.23Å; V735-Q790 HydrophobicContact CG1-CB 4.45Å; V735-Q790 HydrophobicContact CG1-CG 4.11Å; V735-Q790 HydrophobicContact CG2-CB 4.3Å
736	Q	96.8	Very high	92.4	Very high	23 Å²	23	32.4 Å²	32.4	11%	0.107	19%	0.188	C	C	.	.	H	α-helix	trans	-69.9	-37.3	-179.4	-66.1	-69	-62.3	0	0	112.4	L692 L695 K696 T699 Q732 V734 L738 Q739 C740	L692-Q736 HydrophobicContact CD1-CG 4.4Å; L695-Q736 HydrophobicContact CD2-CB 3.86Å; L695-Q736 HydrophobicContact CG-CB 3.83Å; K696-Q736 HydrophobicContact CG-CG 3.86Å; T699-Q736 PolarHBondContact OG1-O 3.25Å; Q732-Q736 WeakPolarHBondContact O-CB 3.5Å; Q732-Q736 WeakPolarHBondContact O-CG 3.38Å; Q732-Q736 PolarHBondContact O-N 3.28Å; V734-Q736 PolarHBondContact O-N 3.21Å; Q736-L738 VanDerWaalsContact C-N 3.35Å; Q736-L738 PolarHBondContact O-N 3.08Å; Q736-Q739 PolarHBondContact O-N 3.13Å; Q736-C740 WeakPolarHBondContact O-CB 3.45Å; Q736-C740 PolarHBondContact O-N 3.4Å
737	A	97.3	Very high	93.1	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-68.3	-33.6	175.8	0	0	0	0	0	112.1	L695 C716 L720 I733 V734 S741	L695-A737 HydrophobicContact CD2-CB 4.09Å; C716-A737 HydrophobicContact CB-CB 4.21Å; L720-A737 HydrophobicContact CD1-CB 4.24Å; L720-A737 HydrophobicContact CD2-CB 3.84Å; L720-A737 HydrophobicContact CG-CB 3.8Å; I733-A737 WeakPolarHBondContact O-CB 3.39Å; I733-A737 PolarHBondContact O-N 3.15Å; V734-A737 PolarHBondContact O-N 3.41Å; A737-S741 WeakPolarHBondContact O-CB 3.36Å; A737-S741 PolarHBondContact O-N 3.33Å; A737-S741 PolarHBondContact O-OG 2.95Å
738	L	97.3	Very high	94	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-62.3	-52.5	170	-75.6	173.1	0	0	0	110.7	L720 V734 V735 Q736 S741 H742 F772 V775 Q790 A791 L794	L720-L738 HydrophobicContact CD1-CD2 4.07Å; L720-L738 HydrophobicContact CD1-CG 4.49Å; L720-L738 HydrophobicContact CD2-CD2 3.99Å; L720-L738 HydrophobicContact CD2-CG 3.81Å; V734-L738 HydrophobicContact CG1-CD1 4.18Å; V734-L738 HydrophobicContact CG1-CG 4.45Å; V734-L738 WeakPolarHBondContact O-CB 3.47Å; V734-L738 VanDerWaalsContact O-CG 3.26Å; V734-L738 WeakPolarHBondContact O-CG 3.44Å; V734-L738 PolarHBondContact O-N 3.29Å; V735-L738 WeakPolarHBondContact O-CB 3.07Å; V735-L738 PolarHBondContact O-N 3.27Å; Q736-L738 VanDerWaalsContact C-N 3.35Å; Q736-L738 PolarHBondContact O-N 3.08Å; L738-S741 PolarHBondContact O-N 2.74Å; L738-H742 PolarHBondContact O-N 3.05Å; L738-F772 HydrophobicContact CD2-CE2 3.87Å; L738-F772 HydrophobicContact CD2-CZ 3.94Å; L738-F772 VanDerWaalsContact O-CZ 3.27Å; L738-F772 WeakPolarHBondContact O-CZ 3.4Å; L738-V775 HydrophobicContact CD2-CG1 4.37Å; L738-Q790 HydrophobicContact CB-CG 4.33Å; L738-Q790 HydrophobicContact CD1-CB 4.5Å; L738-Q790 HydrophobicContact CD1-CG 4.26Å; L738-A791 HydrophobicContact CD1-CB 4.2Å; L738-L794 HydrophobicContact CB-CD1 3.79Å
739	Q	96.7	Very high	94.9	Very high	38 Å²	38	24 Å²	24	18%	0.178	12%	0.117	C	C	.	.	H	α-helix	trans	-57.6	-51.3	178	-71.3	176.5	-6.6	0	0	112	T699 V735 Q736 S741 H742 Y743 Q790	T699-Q739 HydrophobicContact CG2-CB 3.57Å; V735-Q739 WeakPolarHBondContact O-CG 3.4Å; V735-Q739 PolarHBondContact O-N 3.46Å; Q736-Q739 PolarHBondContact O-N 3.13Å; Q739-S741 VanDerWaalsContact C-N 3.34Å; Q739-S741 PolarHBondContact O-N 3.22Å; Q739-H742 WeakPolarHBondContact O-CB 3.49Å; Q739-H742 PolarHBondContact O-N 2.89Å; Q739-H742 VanDerWaalsContact O-N 3.13Å; Q739-Y743 HydrophobicContact CB-CE2 4.08Å; Q739-Y743 VanDerWaalsContact O-CD2 3.24Å; Q739-Y743 WeakPolarHBondContact O-CD2 3.4Å; Q739-Y743 PolarHBondContact O-N 2.66Å; Q739-Q790 HydrophobicContact CG-CG 4.34Å
740	C	97.3	Very high	95	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-62.5	-38.4	-179.6	-166.7	0	0	0	0	112.9	L695 T699 H702 Q736 H742 Y743 S744	L695-C740 HydrophobicContact CD1-CB 4.18Å; T699-C740 HydrophobicContact CG2-CB 4.26Å; T699-C740 WeakPolarHBondContact OG1-CB 3.34Å; H702-C740 PolarHBondContact ND1-O 2.85Å; H702-C740 PolarHBondContact ND1-SG 2.93Å; H702-C740 VanDerWaalsContact ND1-SG 3.44Å; Q736-C740 WeakPolarHBondContact O-CB 3.45Å; Q736-C740 PolarHBondContact O-N 3.4Å; C740-H742 VanDerWaalsContact C-N 3.34Å; C740-Y743 PolarHBondContact O-N 3.04Å; C740-S744 PolarHBondContact O-N 2.9Å
741	S	97.5	Very high	94.9	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-67.1	-34.1	175.1	-61.1	0	0	0	0	112.6	C716 A737 L738 Q739 S744 I745	C716-S741 WeakPolarHBondContact CB-OG 3.37Å; A737-S741 WeakPolarHBondContact O-CB 3.36Å; A737-S741 PolarHBondContact O-N 3.33Å; A737-S741 PolarHBondContact O-OG 2.95Å; L738-S741 PolarHBondContact O-N 2.74Å; Q739-S741 VanDerWaalsContact C-N 3.34Å; Q739-S741 PolarHBondContact O-N 3.22Å; S741-S744 WeakPolarHBondContact O-CB 3.28Å; S741-I745 WeakPolarHBondContact O-CG1 3.5Å; S741-I745 PolarHBondContact O-N 2.94Å
742	H	96.6	Very high	94.7	Very high	12 Å²	12	24.6 Å²	24.6	6%	0.056	12%	0.115	C	C	.	.	H	α-helix	trans	-67	-47.5	173	173.8	95.6	0	0	0	111.2	L738 Q739 C740 S744 I745 L746 F772 L794 L798	L738-H742 PolarHBondContact O-N 3.05Å; Q739-H742 WeakPolarHBondContact O-CB 3.49Å; Q739-H742 PolarHBondContact O-N 2.89Å; Q739-H742 VanDerWaalsContact O-N 3.13Å; C740-H742 VanDerWaalsContact C-N 3.34Å; H742-S744 VanDerWaalsContact C-N 3.32Å; H742-S744 PolarHBondContact O-N 3.37Å; H742-I745 WeakPolarHBondContact O-CA 3.44Å; H742-I745 WeakPolarHBondContact O-CB 3.39Å; H742-I745 PolarHBondContact O-N 2.75Å; H742-L746 WeakPolarHBondContact NE2-CD1 3.41Å; H742-L746 PolarHBondContact O-N 3.44Å; H742-F772 HydrophobicContact CB-CE1 4.1Å; H742-F772 HydrophobicContact CB-CZ 4.39Å; H742-L794 HydrophobicContact CB-CD1 4.28Å; H742-L794 HydrophobicContact CB-CD2 3.93Å; H742-L798 WeakPolarHBondContact ND1-CG 3.35Å
743	Y	96.8	Very high	94.3	Very high	39 Å²	39	22 Å²	22	15%	0.153	11%	0.106	C	C	.	.	H	α-helix	trans	-59.8	-40.2	175.5	-56.8	-41.1	0	0	0	112.1	T699 H702 N703 Q739 C740 I745 L746 W747	T699-Y743 HydrophobicContact CG2-CD2 4.3Å; T699-Y743 HydrophobicContact CG2-CE2 3.85Å; T699-Y743 WeakPolarHBondContact O-CE2 3.3Å; H702-Y743 HydrophobicContact CB-CD2 4.11Å; N703-Y743 HydrophobicContact CB-CD2 4.26Å; N703-Y743 HydrophobicContact CB-CE1 4.1Å; N703-Y743 HydrophobicContact CB-CE2 3.8Å; N703-Y743 WeakPolarHBondContact OD1-CE1 3.25Å; Q739-Y743 HydrophobicContact CB-CE2 4.08Å; Q739-Y743 VanDerWaalsContact O-CD2 3.24Å; Q739-Y743 WeakPolarHBondContact O-CD2 3.4Å; Q739-Y743 PolarHBondContact O-N 2.66Å; C740-Y743 PolarHBondContact O-N 3.04Å; Y743-I745 VanDerWaalsContact C-N 3.26Å; Y743-I745 PolarHBondContact O-N 3.48Å; Y743-L746 PolarHBondContact O-N 3.19Å; Y743-W747 VanDerWaalsContact O-CD1 3.26Å; Y743-W747 PolarHBondContact O-N 3.18Å
744	S	95.6	Very high	93.6	Very high	3 Å²	3	26.9 Å²	26.9	2%	0.021	13%	0.132	C	C	.	.	H	α-helix	trans	-51.9	-43.5	169.7	-96.4	0	0	0	0	113	H702 F713 C740 S741 H742 Q748	H702-S744 PolarHBondContact CE1-N 3.06Å; H702-S744 PolarHBondContact CE1-OG 3.26Å; H702-S744 VanDerWaalsContact CE1-OG 3.28Å; F713-S744 PolarHBondContact N-OG 3.35Å; C740-S744 PolarHBondContact O-N 2.9Å; S741-S744 WeakPolarHBondContact O-CB 3.28Å; H742-S744 VanDerWaalsContact C-N 3.32Å; H742-S744 PolarHBondContact O-N 3.37Å; S744-Q748 WeakPolarHBondContact O-CB 3.47Å; S744-Q748 WeakPolarHBondContact O-CG 3.48Å; S744-Q748 PolarHBondContact O-N 3.15Å; S744-Q748 VanDerWaalsContact O-N 3.17Å
745	I	95.8	Very high	92.6	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-71.4	-40	-179.4	-75.3	166.1	0	0	0	111.3	F713 S741 H742 Y743 L749 L765 T768 V769 F772 L798 F802	F713-I745 HydrophobicContact CE2-CD1 4.02Å; F713-I745 HydrophobicContact CE2-CG1 4.34Å; S741-I745 WeakPolarHBondContact O-CG1 3.5Å; S741-I745 PolarHBondContact O-N 2.94Å; H742-I745 WeakPolarHBondContact O-CA 3.44Å; H742-I745 WeakPolarHBondContact O-CB 3.39Å; H742-I745 PolarHBondContact O-N 2.75Å; Y743-I745 VanDerWaalsContact C-N 3.26Å; Y743-I745 PolarHBondContact O-N 3.48Å; I745-L749 PolarHBondContact O-N 3Å; I745-L765 HydrophobicContact CG2-CD1 4.33Å; I745-T768 HydrophobicContact CD1-CG2 4.22Å; I745-T768 HydrophobicContact CG1-CG2 3.85Å; I745-V769 HydrophobicContact CD1-CG2 4.49Å; I745-V769 HydrophobicContact CG1-CG2 4.48Å; I745-V769 HydrophobicContact CG2-CG2 3.71Å; I745-F772 HydrophobicContact CD1-CB 3.64Å; I745-F772 HydrophobicContact CD1-CD1 3.52Å; I745-F772 HydrophobicContact CD1-CE1 4.41Å; I745-F772 HydrophobicContact CD1-CG 3.72Å; I745-L798 HydrophobicContact CG2-CD2 3.87Å; I745-F802 HydrophobicContact CG2-CE2 3.63Å; I745-F802 HydrophobicContact CG2-CZ 3.72Å
746	L	95.7	Very high	91.5	Very high	46 Å²	46	33.2 Å²	33.2	24%	0.241	19%	0.185	C	C	.	.	H	α-helix	trans	-67.3	-47.2	179.1	-63.3	-162.3	0	0	0	112.1	H742 Y743 Q748 L749 V750 L798 I801	H742-L746 WeakPolarHBondContact NE2-CD1 3.41Å; H742-L746 PolarHBondContact O-N 3.44Å; Y743-L746 PolarHBondContact O-N 3.19Å; L746-Q748 VanDerWaalsContact C-N 3.32Å; L746-Q748 PolarHBondContact O-N 2.97Å; L746-L749 WeakPolarHBondContact O-CA 3.4Å; L746-L749 WeakPolarHBondContact O-CB 3.36Å; L746-L749 PolarHBondContact O-N 2.71Å; L746-V750 PolarHBondContact O-N 3.37Å; L746-L798 HydrophobicContact CD2-CD2 4.24Å; L746-I801 HydrophobicContact CD2-CD1 3.7Å; L746-I801 HydrophobicContact CD2-CG2 4.47Å
747	W	94.4	Very high	90.5	Very high	37 Å²	37	34.5 Å²	34.5	14%	0.14	20%	0.195	C	C	.	.	H	α-helix	trans	-66.3	-33.8	177.3	-71.8	110.5	0	0	0	112.6	H702 H705 D706 T708 Y743 L749 V750 K751 M1255	H702-W747 AromaticContact CD2-CD1 3.58Å; H702-W747 AromaticContact NE2-CD1 3.85Å; H702-W747 PolarHBondContact O-NE1 3.39Å; H705-W747 VanDerWaalsContact C-CE2 3.42Å; H705-W747 VanDerWaalsContact C-CZ2 3.47Å; H705-W747 PolarHBondContact O-NE1 3.35Å; D706-W747 HydrophobicContact CB-CD2 3.93Å; D706-W747 HydrophobicContact CB-CE3 3.6Å; D706-W747 HydrophobicContact CB-CG 4.42Å; D706-W747 HydrophobicContact CB-CZ3 3.98Å; T708-W747 HydrophobicContact CG2-CB 3.62Å; Y743-W747 VanDerWaalsContact O-CD1 3.26Å; Y743-W747 PolarHBondContact O-N 3.18Å; W747-L749 VanDerWaalsContact C-N 3.3Å; W747-L749 PolarHBondContact O-N 2.66Å; W747-V750 PolarHBondContact O-N 3.12Å; W747-K751 VanDerWaalsContact O-CB 3.32Å; W747-K751 WeakPolarHBondContact O-CB 3.42Å; W747-K751 PolarHBondContact O-N 3.02Å; W747-K751 VanDerWaalsContact O-N 3.07Å; W747-M1255 HydrophobicContact CH2-CE 3.73Å; W747-M1255 HydrophobicContact CZ3-CE 3.56Å
748	Q	92.1	Very high	89.7	Confident	39 Å²	39	36.9 Å²	36.9	18%	0.182	21%	0.212	C	C	.	.	H	α-helix	trans	-63.4	-34.2	169.2	-75.6	175.4	19.9	0	0	112.4	T708 S744 L746 I752 L765	T708-Q748 HydrophobicContact CG2-CG 3.95Å; S744-Q748 WeakPolarHBondContact O-CB 3.47Å; S744-Q748 WeakPolarHBondContact O-CG 3.48Å; S744-Q748 PolarHBondContact O-N 3.15Å; S744-Q748 VanDerWaalsContact O-N 3.17Å; L746-Q748 VanDerWaalsContact C-N 3.32Å; L746-Q748 PolarHBondContact O-N 2.97Å; Q748-I752 WeakPolarHBondContact O-CB 3.4Å; Q748-I752 WeakPolarHBondContact O-CG1 3.44Å; Q748-I752 PolarHBondContact O-N 3.49Å; Q748-L765 HydrophobicContact CB-CD1 3.9Å
749	L	92.7	Very high	89.1	Confident	2 Å²	2	45.5 Å²	45.5	1%	0.01	25%	0.249	C	C	.	.	H	α-helix	trans	-69.9	-47.1	175.2	-178.3	61.5	0	0	0	112	I745 L746 W747 K751 I752 T753 L765 I801 F802 L806 L817 F1258	I745-L749 PolarHBondContact O-N 3Å; L746-L749 WeakPolarHBondContact O-CA 3.4Å; L746-L749 WeakPolarHBondContact O-CB 3.36Å; L746-L749 PolarHBondContact O-N 2.71Å; W747-L749 VanDerWaalsContact C-N 3.3Å; W747-L749 PolarHBondContact O-N 2.66Å; L749-K751 VanDerWaalsContact C-N 3.32Å; L749-K751 PolarHBondContact O-N 3.48Å; L749-I752 CarbonylContact O-C 3.39Å; L749-I752 WeakPolarHBondContact O-CA 3.41Å; L749-I752 WeakPolarHBondContact O-CB 3.39Å; L749-I752 PolarHBondContact O-N 2.98Å; L749-T753 HydrophobicContact CD1-CG2 4.49Å; L749-T753 PolarHBondContact O-N 3.34Å; L749-L765 HydrophobicContact CB-CD2 4.25Å; L749-L765 HydrophobicContact CD1-CD2 4.25Å; L749-I801 HydrophobicContact CD2-CG2 3.46Å; L749-I801 VanDerWaalsContact CD2-CG2 3.46Å; L749-F802 HydrophobicContact CB-CZ 4.34Å; L749-F802 HydrophobicContact CD1-CE1 4.19Å; L749-F802 HydrophobicContact CD1-CZ 4.41Å; L749-F802 HydrophobicContact CD2-CE1 4.22Å; L749-F802 HydrophobicContact CD2-CE2 4.31Å; L749-F802 HydrophobicContact CD2-CZ 3.85Å; L749-F802 HydrophobicContact CG-CZ 4.44Å; L749-L806 HydrophobicContact CD1-CD1 4.38Å; L749-L806 HydrophobicContact CD2-CD1 4.46Å; L749-L817 HydrophobicContact CD1-CD1 3.81Å; L749-F1258 HydrophobicContact CD2-CE2 3.76Å; L749-F1258 HydrophobicContact CD2-CZ 3.7Å; L749-F1258 HydrophobicContact CG-CE2 4.25Å; L749-F1258 HydrophobicContact CG-CZ 4.06Å
750	V	91.3	Very high	88.6	Confident	19 Å²	19	50.7 Å²	50.7	12%	0.115	27%	0.273	C	S	.	.	H	α-helix	trans	-56.1	-46.8	176.5	173.1	0	0	0	0	110.9	L746 W747 I752 T753 D754 M1255	L746-V750 PolarHBondContact O-N 3.37Å; W747-V750 PolarHBondContact O-N 3.12Å; V750-I752 PolarHBondContact O-N 3.47Å; V750-I752 VanDerWaalsContact O-N 3.15Å; V750-T753 WeakPolarHBondContact CA-OG1 3.26Å; V750-T753 PolarHBondContact O-N 3.19Å; V750-T753 VanDerWaalsContact O-N 3.08Å; V750-T753 PolarHBondContact O-OG1 3.45Å; V750-D754 WeakPolarHBondContact O-CB 3.3Å; V750-D754 VanDerWaalsContact O-CG 3.28Å; V750-D754 PolarHBondContact O-N 3.46Å; V750-M1255 HydrophobicContact CG1-CE 4.36Å
751	K	87.3	Confident	88.1	Confident	118 Å²	118	54.3 Å²	54.3	51%	0.513	29%	0.293	S	S	.	.	H	α-helix	trans	-60.7	-25.9	176.1	-166.5	168.2	-168	147.7	0	113.8	T708 W747 L749 G755	T708-K751 PolarHBondContact OG1-NZ 3.13Å; W747-K751 VanDerWaalsContact O-CB 3.32Å; W747-K751 WeakPolarHBondContact O-CB 3.42Å; W747-K751 PolarHBondContact O-N 3.02Å; W747-K751 VanDerWaalsContact O-N 3.07Å; L749-K751 VanDerWaalsContact C-N 3.32Å; L749-K751 PolarHBondContact O-N 3.48Å; K751-G755 PolarHBondContact O-N 2.67Å
752	I	87.7	Confident	87.7	Confident	16 Å²	16	55.2 Å²	55.2	8%	0.082	30%	0.298	C	S	.	.	H	α-helix	trans	-88.4	-27.1	176.5	-79.2	177.9	0	0	0	112.4	Q748 L749 V750 P757 D761 L762 L765 L814 L817	Q748-I752 WeakPolarHBondContact O-CB 3.4Å; Q748-I752 WeakPolarHBondContact O-CG1 3.44Å; Q748-I752 PolarHBondContact O-N 3.49Å; L749-I752 CarbonylContact O-C 3.39Å; L749-I752 WeakPolarHBondContact O-CA 3.41Å; L749-I752 WeakPolarHBondContact O-CB 3.39Å; L749-I752 PolarHBondContact O-N 2.98Å; V750-I752 PolarHBondContact O-N 3.47Å; V750-I752 VanDerWaalsContact O-N 3.15Å; I752-P757 HydrophobicContact CB-CB 4.32Å; I752-P757 HydrophobicContact CG1-CB 4.1Å; I752-P757 HydrophobicContact CG2-CB 3.95Å; I752-P757 HydrophobicContact CG2-CG 4.07Å; I752-P757 WeakPolarHBondContact O-CD 3.25Å; I752-P757 WeakPolarHBondContact O-CG 3.31Å; I752-D761 HydrophobicContact CD1-CB 4.08Å; I752-D761 HydrophobicContact CG1-CB 4.48Å; I752-L762 HydrophobicContact CG2-CD2 3.68Å; I752-L765 HydrophobicContact CD1-CB 4.03Å; I752-L765 HydrophobicContact CD1-CD2 3.8Å; I752-L814 HydrophobicContact CG2-CD2 3.81Å; I752-L817 HydrophobicContact CG2-CD1 4.26Å
753	T	84.4	Confident	87.4	Confident	37 Å²	37	60.1 Å²	60.1	23%	0.227	32%	0.324	C	S	.	.	H	α-helix	trans	-75.3	-36.9	173	52.8	0	0	0	0	112.5	L749 V750 L814 F1258	L749-T753 HydrophobicContact CD1-CG2 4.49Å; L749-T753 PolarHBondContact O-N 3.34Å; V750-T753 WeakPolarHBondContact CA-OG1 3.26Å; V750-T753 PolarHBondContact O-N 3.19Å; V750-T753 VanDerWaalsContact O-N 3.08Å; V750-T753 PolarHBondContact O-OG1 3.45Å; T753-L814 HydrophobicContact CG2-CD1 3.95Å; T753-F1258 HydrophobicContact CG2-CZ 3.95Å
754	D	80.8	Confident	87.1	Confident	103 Å²	103	62.2 Å²	62.2	55%	0.551	34%	0.34	S	S	*	.	H	α-helix	trans	-93.2	-24.4	-169.6	-58.9	3.1	0	0	0	111.8	V750 M1257	V750-D754 WeakPolarHBondContact O-CB 3.3Å; V750-D754 VanDerWaalsContact O-CG 3.28Å; V750-D754 PolarHBondContact O-N 3.46Å; D754-M1257 WeakPolarHBondContact OD1-CE 3.48Å
755	G	75.2	Confident	87	Confident	45 Å²	45	62.1 Å²	62.1	46%	0.464	34%	0.339	S	S	.	.	S	Bend	trans	-85.1	-171.7	175.8	0	0	0	0	0	114.1	K751 P757	K751-G755 PolarHBondContact O-N 2.67Å; G755-P757 VanDerWaalsContact O-CD 3.28Å; G755-P757 WeakPolarHBondContact O-CD 3.35Å
756	S	73.4	Confident	86.9	Confident	121 Å²	121	66.4 Å²	66.4	85%	0.846	36%	0.356	S	S	*	.			trans	-107.3	82.7	164.4	59.6	0	0	0	0	108.8
757	P	74.3	Confident	86.8	Confident	49 Å²	49	71.6 Å²	71.6	32%	0.318	38%	0.376	S	S	.	.			trans	-65.3	138.4	-167.3	28	-37.9	0	0	0	111.7	I752 G755 L762	I752-P757 HydrophobicContact CB-CB 4.32Å; I752-P757 HydrophobicContact CG1-CB 4.1Å; I752-P757 HydrophobicContact CG2-CB 3.95Å; I752-P757 HydrophobicContact CG2-CG 4.07Å; I752-P757 WeakPolarHBondContact O-CD 3.25Å; I752-P757 WeakPolarHBondContact O-CG 3.31Å; G755-P757 VanDerWaalsContact O-CD 3.28Å; G755-P757 WeakPolarHBondContact O-CD 3.35Å; P757-L762 HydrophobicContact CB-CD2 4.42Å; P757-L762 HydrophobicContact CB-CG 4.25Å
758	S	81.8	Confident	86.8	Confident	50 Å²	50	70.7 Å²	70.7	35%	0.35	38%	0.375	S	S	.	.			trans	-74.4	164.2	171.9	81.7	0	0	0	0	110.7	E760 D761 L762	S758-E760 PolarHBondContact O-N 2.91Å; S758-E760 PolarHBondContact OG-N 3.47Å; S758-E760 VanDerWaalsContact OG-N 3.15Å; S758-D761 WeakPolarHBondContact CA-OD2 3.27Å; S758-D761 WeakPolarHBondContact CB-OD2 3.48Å; S758-D761 PolarHBondContact N-OD2 2.85Å; S758-D761 PolarHBondContact O-N 3.42Å; S758-D761 PolarHBondContact OG-N 2.88Å; S758-D761 VanDerWaalsContact OG-N 3.15Å; S758-D761 PolarHBondContact OG-OD2 3.03Å; S758-L762 PolarHBondContact O-N 2.69Å
759	K	83.7	Confident	87	Confident	181 Å²	181	69 Å²	69	79%	0.787	37%	0.367	S	S	*	.	H	α-helix	trans	-65.9	-17.3	171.6	-67.8	-173.1	176.8	-175.9	0	112.8	L763	K759-L763 WeakPolarHBondContact O-CD1 3.3Å; K759-L763 WeakPolarHBondContact O-CG 3.21Å; K759-L763 PolarHBondContact O-N 3.3Å
760	E	87.2	Confident	87.1	Confident	147 Å²	147	73.8 Å²	73.8	69%	0.687	39%	0.388	S	S	*	.	H	α-helix	trans	-81.3	-46.1	178.5	-164.3	156.1	-170.3	0	0	110.1	S758 L762 L763 V764	S758-E760 PolarHBondContact O-N 2.91Å; S758-E760 PolarHBondContact OG-N 3.47Å; S758-E760 VanDerWaalsContact OG-N 3.15Å; E760-L762 VanDerWaalsContact C-N 3.33Å; E760-L762 PolarHBondContact O-N 3.07Å; E760-L763 WeakPolarHBondContact O-CA 3.37Å; E760-L763 WeakPolarHBondContact O-CB 3.28Å; E760-L763 PolarHBondContact O-N 3.24Å; E760-V764 WeakPolarHBondContact O-CG2 3.37Å; E760-V764 PolarHBondContact O-N 3.28Å
761	D	86.1	Confident	87.3	Confident	77 Å²	77	74.6 Å²	74.6	41%	0.412	39%	0.394	S	S	.	.	H	α-helix	trans	-56.4	-45.8	175.1	-49	-52.7	0	0	0	111.6	I752 S758 L763 V764 L765	I752-D761 HydrophobicContact CD1-CB 4.08Å; I752-D761 HydrophobicContact CG1-CB 4.48Å; S758-D761 WeakPolarHBondContact CA-OD2 3.27Å; S758-D761 WeakPolarHBondContact CB-OD2 3.48Å; S758-D761 PolarHBondContact N-OD2 2.85Å; S758-D761 PolarHBondContact O-N 3.42Å; S758-D761 PolarHBondContact OG-N 2.88Å; S758-D761 VanDerWaalsContact OG-N 3.15Å; S758-D761 PolarHBondContact OG-OD2 3.03Å; D761-L763 VanDerWaalsContact C-N 3.29Å; D761-L763 PolarHBondContact O-N 2.86Å; D761-V764 PolarHBondContact O-N 2.83Å; D761-L765 PolarHBondContact O-N 3.19Å
762	L	89.3	Confident	87.7	Confident	18 Å²	18	69 Å²	69	9%	0.094	37%	0.37	C	S	.	.	H	α-helix	trans	-63.3	-31.3	176.2	-68.7	171.3	0	0	0	113	I752 P757 S758 E760 R766 L814 L817	I752-L762 HydrophobicContact CG2-CD2 3.68Å; P757-L762 HydrophobicContact CB-CD2 4.42Å; P757-L762 HydrophobicContact CB-CG 4.25Å; S758-L762 PolarHBondContact O-N 2.69Å; E760-L762 VanDerWaalsContact C-N 3.33Å; E760-L762 PolarHBondContact O-N 3.07Å; L762-R766 VanDerWaalsContact O-CB 3.24Å; L762-R766 WeakPolarHBondContact O-CB 3.44Å; L762-R766 PolarHBondContact O-N 2.8Å; L762-L814 HydrophobicContact CD2-CD2 4.26Å; L762-L817 HydrophobicContact CD2-CD1 3.9Å; L762-L817 HydrophobicContact CD2-CD2 4.2Å; L762-L817 HydrophobicContact CD2-CG 3.98Å; L762-L817 WeakPolarHBondContact O-CD2 3.44Å
763	L	89.9	Confident	88.1	Confident	116 Å²	116	68.4 Å²	68.4	61%	0.607	37%	0.367	S	S	*	.	H	α-helix	trans	-78.7	-35.5	176	-76.6	171.2	0	0	0	112	K759 E760 D761 K767	K759-L763 WeakPolarHBondContact O-CD1 3.3Å; K759-L763 WeakPolarHBondContact O-CG 3.21Å; K759-L763 PolarHBondContact O-N 3.3Å; E760-L763 WeakPolarHBondContact O-CA 3.37Å; E760-L763 WeakPolarHBondContact O-CB 3.28Å; E760-L763 PolarHBondContact O-N 3.24Å; D761-L763 VanDerWaalsContact C-N 3.29Å; D761-L763 PolarHBondContact O-N 2.86Å; L763-K767 WeakPolarHBondContact O-CB 3.43Å; L763-K767 PolarHBondContact O-N 3.04Å; L763-K767 VanDerWaalsContact O-N 3.13Å
764	V	91.2	Very high	88.6	Confident	82 Å²	82	68.6 Å²	68.6	50%	0.497	37%	0.372	S	S	.	.	H	α-helix	trans	-64	-57.8	173.7	172.5	0	0	0	0	109.8	E760 D761 R766 K767 T768	E760-V764 WeakPolarHBondContact O-CG2 3.37Å; E760-V764 PolarHBondContact O-N 3.28Å; D761-V764 PolarHBondContact O-N 2.83Å; V764-R766 VanDerWaalsContact C-N 3.3Å; V764-R766 PolarHBondContact O-N 2.92Å; V764-K767 WeakPolarHBondContact O-CA 3.41Å; V764-K767 WeakPolarHBondContact O-CB 3.42Å; V764-K767 PolarHBondContact O-N 2.63Å; V764-T768 PolarHBondContact O-N 3.05Å; V764-T768 PolarHBondContact O-OG1 2.87Å; V764-T768 VanDerWaalsContact O-OG1 3.08Å
765	L	92.6	Very high	89.3	Confident	1 Å²	1	64 Å²	64	1%	0.005	35%	0.348	C	S	.	.	H	α-helix	trans	-58.1	-41.5	-180	179.9	60.2	0	0	0	111.6	I745 Q748 L749 I752 D761 K767 T768 V769 F802 L817	I745-L765 HydrophobicContact CG2-CD1 4.33Å; Q748-L765 HydrophobicContact CB-CD1 3.9Å; L749-L765 HydrophobicContact CB-CD2 4.25Å; L749-L765 HydrophobicContact CD1-CD2 4.25Å; I752-L765 HydrophobicContact CD1-CB 4.03Å; I752-L765 HydrophobicContact CD1-CD2 3.8Å; D761-L765 PolarHBondContact O-N 3.19Å; L765-K767 VanDerWaalsContact C-N 3.27Å; L765-K767 PolarHBondContact O-N 3.12Å; L765-T768 WeakPolarHBondContact O-CB 3.38Å; L765-T768 PolarHBondContact O-N 2.94Å; L765-V769 HydrophobicContact CD1-CG2 3.81Å; L765-V769 HydrophobicContact CG-CG2 4.1Å; L765-V769 WeakPolarHBondContact O-CB 3.39Å; L765-V769 VanDerWaalsContact O-CG2 3.31Å; L765-V769 WeakPolarHBondContact O-CG2 3.39Å; L765-V769 PolarHBondContact O-N 3.05Å; L765-F802 HydrophobicContact CD2-CE1 4.34Å; L765-F802 HydrophobicContact CD2-CZ 4.49Å; L765-L817 HydrophobicContact CB-CD2 4.06Å; L765-L817 HydrophobicContact CD2-CD1 3.97Å; L765-L817 HydrophobicContact CD2-CD2 4.08Å; L765-L817 HydrophobicContact CG-CD2 4.06Å
766	R	94.3	Very high	90.3	Very high	90 Å²	90	61.8 Å²	61.8	34%	0.34	33%	0.326	S	S	.	.	H	α-helix	trans	-58.5	-38.6	175.2	-166.2	-170.3	-161.1	164.6	20.9	112.5	L762 V764 K770 P816 L817	L762-R766 VanDerWaalsContact O-CB 3.24Å; L762-R766 WeakPolarHBondContact O-CB 3.44Å; L762-R766 PolarHBondContact O-N 2.8Å; V764-R766 VanDerWaalsContact C-N 3.3Å; V764-R766 PolarHBondContact O-N 2.92Å; R766-K770 WeakPolarHBondContact O-CB 3.34Å; R766-K770 WeakPolarHBondContact O-CG 3.37Å; R766-K770 PolarHBondContact O-N 3.03Å; R766-K770 VanDerWaalsContact O-N 3.14Å; R766-P816 WeakPolarHBondContact CD-O 3.41Å; R766-P816 PolarHBondContact NE-O 2.99Å; R766-P816 PolarHBondContact NH2-O 3.26Å; R766-L817 HydrophobicContact CB-CD2 4.17Å
767	K	94	Very high	91.4	Very high	156 Å²	156	58.5 Å²	58.5	68%	0.678	30%	0.297	S	S	*	.	H	α-helix	trans	-69.7	-44	176.8	-173.6	-168.5	171.7	-161.5	0	110.7	L763 V764 L765 K770 S771	L763-K767 WeakPolarHBondContact O-CB 3.43Å; L763-K767 PolarHBondContact O-N 3.04Å; L763-K767 VanDerWaalsContact O-N 3.13Å; V764-K767 WeakPolarHBondContact O-CA 3.41Å; V764-K767 WeakPolarHBondContact O-CB 3.42Å; V764-K767 PolarHBondContact O-N 2.63Å; L765-K767 VanDerWaalsContact C-N 3.27Å; L765-K767 PolarHBondContact O-N 3.12Å; K767-K770 PolarHBondContact O-N 3.12Å; K767-S771 WeakPolarHBondContact O-CB 3.44Å; K767-S771 PolarHBondContact O-N 3.47Å; K767-S771 PolarHBondContact O-OG 3.06Å
768	T	94.7	Very high	92.3	Very high	18 Å²	18	61 Å²	61	11%	0.11	30%	0.304	C	S	.	.	H	α-helix	trans	-56	-57.5	175.7	-53.7	0	0	0	0	110.8	F713 I745 V764 L765 K770 S771 F772	F713-T768 HydrophobicContact CD1-CG2 3.96Å; F713-T768 HydrophobicContact CD2-CG2 3.83Å; F713-T768 HydrophobicContact CE1-CG2 3.72Å; F713-T768 HydrophobicContact CE2-CG2 3.56Å; F713-T768 HydrophobicContact CG-CG2 4.03Å; F713-T768 HydrophobicContact CZ-CG2 3.51Å; I745-T768 HydrophobicContact CD1-CG2 4.22Å; I745-T768 HydrophobicContact CG1-CG2 3.85Å; V764-T768 PolarHBondContact O-N 3.05Å; V764-T768 PolarHBondContact O-OG1 2.87Å; V764-T768 VanDerWaalsContact O-OG1 3.08Å; L765-T768 WeakPolarHBondContact O-CB 3.38Å; L765-T768 PolarHBondContact O-N 2.94Å; T768-K770 PolarHBondContact O-N 3.04Å; T768-S771 PolarHBondContact O-N 3.14Å; T768-S771 VanDerWaalsContact O-N 3.1Å; T768-F772 PolarHBondContact O-N 2.96Å
769	V	95.3	Very high	92.9	Very high	3 Å²	3	58.8 Å²	58.8	2%	0.018	29%	0.289	C	S	.	.	H	α-helix	trans	-54.3	-50.1	178.6	171.7	0	0	0	0	111.6	I745 L765 S771 F772 L773 F802	I745-V769 HydrophobicContact CD1-CG2 4.49Å; I745-V769 HydrophobicContact CG1-CG2 4.48Å; I745-V769 HydrophobicContact CG2-CG2 3.71Å; L765-V769 HydrophobicContact CD1-CG2 3.81Å; L765-V769 HydrophobicContact CG-CG2 4.1Å; L765-V769 WeakPolarHBondContact O-CB 3.39Å; L765-V769 VanDerWaalsContact O-CG2 3.31Å; L765-V769 WeakPolarHBondContact O-CG2 3.39Å; L765-V769 PolarHBondContact O-N 3.05Å; V769-S771 VanDerWaalsContact C-N 3.31Å; V769-S771 PolarHBondContact O-N 2.79Å; V769-F772 PolarHBondContact O-N 2.68Å; V769-L773 HydrophobicContact CG1-CD1 3.7Å; V769-L773 HydrophobicContact CG1-CG 4.25Å; V769-L773 WeakPolarHBondContact O-CB 2.94Å; V769-L773 VanDerWaalsContact O-CG 3.29Å; V769-L773 WeakPolarHBondContact O-CG 3.36Å; V769-L773 PolarHBondContact O-N 3.37Å; V769-F802 HydrophobicContact CG1-CD1 4.35Å; V769-F802 HydrophobicContact CG1-CD2 4.25Å; V769-F802 HydrophobicContact CG1-CG 4.18Å; V769-F802 HydrophobicContact CG2-CD1 4.31Å; V769-F802 HydrophobicContact CG2-CD2 4.5Å; V769-F802 HydrophobicContact CG2-CE1 3.75Å; V769-F802 HydrophobicContact CG2-CE2 3.98Å; V769-F802 HydrophobicContact CG2-CZ 3.57Å
770	K	94.8	Very high	93.3	Very high	103 Å²	103	51.1 Å²	51.1	45%	0.448	26%	0.256	S	S	.	.	H	α-helix	trans	-63.3	-34.1	179.1	-77.5	-170	172	-153.3	0	114	R766 K767 T768 A774 F819	R766-K770 WeakPolarHBondContact O-CB 3.34Å; R766-K770 WeakPolarHBondContact O-CG 3.37Å; R766-K770 PolarHBondContact O-N 3.03Å; R766-K770 VanDerWaalsContact O-N 3.14Å; K767-K770 PolarHBondContact O-N 3.12Å; T768-K770 PolarHBondContact O-N 3.04Å; K770-A774 PolarHBondContact O-N 3.41Å; K770-F819 HydrophobicContact CG-CD2 4.04Å; K770-F819 HydrophobicContact CG-CE2 4.13Å
771	S	94.8	Very high	93.5	Very high	35 Å²	35	49 Å²	49	25%	0.245	26%	0.258	C	S	.	.	H	α-helix	trans	-74.6	-38.7	179	-51.1	0	0	0	0	110.7	K767 T768 V769 V775	K767-S771 WeakPolarHBondContact O-CB 3.44Å; K767-S771 PolarHBondContact O-N 3.47Å; K767-S771 PolarHBondContact O-OG 3.06Å; T768-S771 PolarHBondContact O-N 3.14Å; T768-S771 VanDerWaalsContact O-N 3.1Å; V769-S771 VanDerWaalsContact C-N 3.31Å; V769-S771 PolarHBondContact O-N 2.79Å; S771-V775 PolarHBondContact O-N 3.19Å
772	F	96.6	Very high	93.6	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-71.5	-43.2	178.1	-172.6	-113.9	0	0	0	112.9	F713 L720 L738 H742 I745 T768 V769 A774 V775 C776 L798	F713-F772 HydrophobicContact CE2-CB 4.1Å; F713-F772 HydrophobicContact CE2-CD2 4.16Å; F713-F772 HydrophobicContact CE2-CG 4.26Å; F713-F772 HydrophobicContact CZ-CB 4.16Å; L720-F772 HydrophobicContact CD1-CD2 4.47Å; L720-F772 HydrophobicContact CD1-CE2 3.92Å; L738-F772 HydrophobicContact CD2-CE2 3.87Å; L738-F772 HydrophobicContact CD2-CZ 3.94Å; L738-F772 VanDerWaalsContact O-CZ 3.27Å; L738-F772 WeakPolarHBondContact O-CZ 3.4Å; H742-F772 HydrophobicContact CB-CE1 4.1Å; H742-F772 HydrophobicContact CB-CZ 4.39Å; I745-F772 HydrophobicContact CD1-CB 3.64Å; I745-F772 HydrophobicContact CD1-CD1 3.52Å; I745-F772 HydrophobicContact CD1-CE1 4.41Å; I745-F772 HydrophobicContact CD1-CG 3.72Å; T768-F772 PolarHBondContact O-N 2.96Å; V769-F772 PolarHBondContact O-N 2.68Å; F772-A774 VanDerWaalsContact C-N 3.26Å; F772-A774 PolarHBondContact O-N 3.37Å; F772-V775 WeakPolarHBondContact O-CA 3.49Å; F772-V775 WeakPolarHBondContact O-CB 3.4Å; F772-V775 PolarHBondContact O-N 3.28Å; F772-C776 WeakPolarHBondContact CE1-SG 3.18Å; F772-C776 WeakPolarHBondContact CZ-SG 3.38Å; F772-C776 PolarHBondContact O-N 3.44Å; F772-C776 PolarHBondContact O-SG 3.34Å; F772-C776 VanDerWaalsContact O-SG 3.38Å; F772-L798 HydrophobicContact CD1-CD1 3.55Å; F772-L798 HydrophobicContact CE1-CD1 3.64Å
773	L	96.1	Very high	93.6	Very high	4 Å²	4	53 Å²	53	2%	0.021	28%	0.283	C	S	.	.	H	α-helix	trans	-56.8	-39.3	174.7	-73.1	170.5	0	0	0	112.1	V769 C776 Q777 L795 L798 F819	V769-L773 HydrophobicContact CG1-CD1 3.7Å; V769-L773 HydrophobicContact CG1-CG 4.25Å; V769-L773 WeakPolarHBondContact O-CB 2.94Å; V769-L773 VanDerWaalsContact O-CG 3.29Å; V769-L773 WeakPolarHBondContact O-CG 3.36Å; V769-L773 PolarHBondContact O-N 3.37Å; L773-C776 PolarHBondContact O-N 2.94Å; L773-Q777 WeakPolarHBondContact O-CB 3.29Å; L773-Q777 PolarHBondContact O-N 2.6Å; L773-L795 HydrophobicContact CD2-CD2 3.81Å; L773-L798 HydrophobicContact CD2-CB 3.81Å; L773-L798 HydrophobicContact CD2-CD1 4.15Å; L773-F819 HydrophobicContact CD1-CB 4.39Å; L773-F819 HydrophobicContact CD1-CD1 3.78Å; L773-F819 HydrophobicContact CD1-CD2 3.63Å; L773-F819 HydrophobicContact CD1-CE1 3.87Å; L773-F819 HydrophobicContact CD1-CE2 3.72Å; L773-F819 HydrophobicContact CD1-CG 3.67Å; L773-F819 HydrophobicContact CD1-CZ 3.84Å
774	A	94.9	Very high	93.6	Very high	41 Å²	41	50.3 Å²	50.3	34%	0.339	27%	0.27	S	S	.	.	H	α-helix	trans	-67.5	-34.3	175.7	0	0	0	0	0	113	K770 F772 Q778	K770-A774 PolarHBondContact O-N 3.41Å; F772-A774 VanDerWaalsContact C-N 3.26Å; F772-A774 PolarHBondContact O-N 3.37Å; A774-Q778 VanDerWaalsContact O-CG 3.28Å; A774-Q778 WeakPolarHBondContact O-CG 3.34Å; A774-Q778 PolarHBondContact O-N 3.19Å; A774-Q778 VanDerWaalsContact O-N 3.11Å
775	V	95.5	Very high	93.6	Very high	6 Å²	6	49.4 Å²	49.4	4%	0.036	27%	0.265	C	S	.	.	H	α-helix	trans	-66.9	-47.6	172.6	163.2	0	0	0	0	110.7	Y717 L720 I724 L738 S771 F772 Q777 Q778 C779	Y717-V775 HydrophobicContact CD2-CG2 4.4Å; Y717-V775 HydrophobicContact CE2-CG2 3.79Å; L720-V775 HydrophobicContact CB-CG1 3.87Å; L720-V775 HydrophobicContact CD1-CG1 4.03Å; L720-V775 HydrophobicContact CG-CG1 4.4Å; I724-V775 HydrophobicContact CD1-CB 4.41Å; I724-V775 HydrophobicContact CD1-CG1 3.93Å; I724-V775 HydrophobicContact CD1-CG2 4.39Å; L738-V775 HydrophobicContact CD2-CG1 4.37Å; S771-V775 PolarHBondContact O-N 3.19Å; F772-V775 WeakPolarHBondContact O-CA 3.49Å; F772-V775 WeakPolarHBondContact O-CB 3.4Å; F772-V775 PolarHBondContact O-N 3.28Å; V775-Q777 VanDerWaalsContact C-N 3.33Å; V775-Q777 PolarHBondContact O-N 3.24Å; V775-Q778 PolarHBondContact O-N 2.97Å; V775-C779 PolarHBondContact O-N 2.87Å; V775-C779 PolarHBondContact O-SG 3.29Å; V775-C779 VanDerWaalsContact O-SG 3.37Å
776	C	96	Very high	93.6	Very high	0 Å²	0	52 Å²	52	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-61.5	-40.5	176.4	-59	0	0	0	0	112.1	F772 L773 Q778 C779 L780 A791 L795	F772-C776 WeakPolarHBondContact CE1-SG 3.18Å; F772-C776 WeakPolarHBondContact CZ-SG 3.38Å; F772-C776 PolarHBondContact O-N 3.44Å; F772-C776 PolarHBondContact O-SG 3.34Å; F772-C776 VanDerWaalsContact O-SG 3.38Å; L773-C776 PolarHBondContact O-N 2.94Å; C776-Q778 VanDerWaalsContact C-N 3.33Å; C776-Q778 PolarHBondContact O-N 3.02Å; C776-C779 WeakPolarHBondContact O-CB 3.34Å; C776-C779 PolarHBondContact O-N 3.18Å; C776-C779 VanDerWaalsContact O-N 3.14Å; C776-L780 PolarHBondContact O-N 3.26Å; C776-A791 HydrophobicContact CB-CB 4.36Å; C776-A791 WeakPolarHBondContact O-CB 3.37Å; C776-L795 HydrophobicContact CB-CD1 4.01Å; C776-L795 HydrophobicContact CB-CD2 3.84Å; C776-L795 HydrophobicContact CB-CG 3.62Å
777	Q	95.6	Very high	93.6	Very high	52 Å²	52	47.8 Å²	47.8	24%	0.243	27%	0.266	C	S	.	.	H	α-helix	trans	-60.2	-42.6	175.3	-174.9	175.2	6.5	0	0	111.6	L773 V775 C779 L780 L825 E828	L773-Q777 WeakPolarHBondContact O-CB 3.29Å; L773-Q777 PolarHBondContact O-N 2.6Å; V775-Q777 VanDerWaalsContact C-N 3.33Å; V775-Q777 PolarHBondContact O-N 3.24Å; Q777-C779 VanDerWaalsContact C-N 3.33Å; Q777-C779 PolarHBondContact O-N 3.36Å; Q777-L780 WeakPolarHBondContact O-CB 3.43Å; Q777-L780 PolarHBondContact O-N 2.93Å; Q777-L825 HydrophobicContact CB-CD1 4.3Å; Q777-L825 HydrophobicContact CG-CD1 3.92Å; Q777-E828 WeakPolarHBondContact CG-OE2 3.3Å; Q777-E828 PolarHBondContact NE2-OE2 3.41Å
778	Q	94	Very high	93.6	Very high	101 Å²	101	42.7 Å²	42.7	47%	0.472	24%	0.244	S	C	.	.	H	α-helix	trans	-63.1	-39.4	174.4	-72.2	165.5	6.2	0	0	111.5	I724 A774 V775 C776 L780 S781	I724-Q778 HydrophobicContact CD1-CB 4.02Å; A774-Q778 VanDerWaalsContact O-CG 3.28Å; A774-Q778 WeakPolarHBondContact O-CG 3.34Å; A774-Q778 PolarHBondContact O-N 3.19Å; A774-Q778 VanDerWaalsContact O-N 3.11Å; V775-Q778 PolarHBondContact O-N 2.97Å; C776-Q778 VanDerWaalsContact C-N 3.33Å; C776-Q778 PolarHBondContact O-N 3.02Å; Q778-L780 VanDerWaalsContact C-N 3.28Å; Q778-L780 PolarHBondContact O-N 3.27Å; Q778-S781 PolarHBondContact O-N 3.5Å; Q778-S781 VanDerWaalsContact O-N 3.11Å; Q778-S781 PolarHBondContact O-OG 3.41Å
779	C	94.2	Very high	93.6	Very high	3 Å²	3	43.2 Å²	43.2	2%	0.02	25%	0.245	C	C	.	.	H	α-helix	trans	-63.5	-22	175.6	-69.6	0	0	0	0	114.9	V775 C776 Q777 S781 N782 V787 A791	V775-C779 PolarHBondContact O-N 2.87Å; V775-C779 PolarHBondContact O-SG 3.29Å; V775-C779 VanDerWaalsContact O-SG 3.37Å; C776-C779 WeakPolarHBondContact O-CB 3.34Å; C776-C779 PolarHBondContact O-N 3.18Å; C776-C779 VanDerWaalsContact O-N 3.14Å; Q777-C779 VanDerWaalsContact C-N 3.33Å; Q777-C779 PolarHBondContact O-N 3.36Å; C779-S781 PolarHBondContact O-N 3.01Å; C779-N782 WeakPolarHBondContact O-CB 3.14Å; C779-N782 PolarHBondContact O-N 3.32Å; C779-N782 VanDerWaalsContact O-N 3.1Å; C779-V787 HydrophobicContact CB-CG1 3.99Å; C779-A791 HydrophobicContact CB-CB 3.56Å
780	L	93	Very high	93.7	Very high	20 Å²	20	44.9 Å²	44.9	11%	0.105	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-27.3	171.7	-66.3	-179.7	0	0	0	112.8	C776 Q777 Q778 K788 A791 F792 L795 E828 L829	C776-L780 PolarHBondContact O-N 3.26Å; Q777-L780 WeakPolarHBondContact O-CB 3.43Å; Q777-L780 PolarHBondContact O-N 2.93Å; Q778-L780 VanDerWaalsContact C-N 3.28Å; Q778-L780 PolarHBondContact O-N 3.27Å; L780-K788 WeakPolarHBondContact O-CD 3.43Å; L780-K788 WeakPolarHBondContact O-CG 3.23Å; L780-A791 HydrophobicContact CD2-CB 4.4Å; L780-F792 HydrophobicContact CD2-CB 3.76Å; L780-F792 HydrophobicContact CD2-CD2 4.45Å; L780-L795 HydrophobicContact CD1-CD1 3.67Å; L780-L795 HydrophobicContact CD2-CD1 4.04Å; L780-L795 HydrophobicContact CG-CD1 3.8Å; L780-E828 HydrophobicContact CD1-CB 4.26Å; L780-L829 HydrophobicContact CD1-CD2 4.11Å
781	S	89.8	Confident	93.8	Very high	104 Å²	104	40 Å²	40	73%	0.727	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91	5.9	178.1	69.5	0	0	0	0	114.2	Q778 C779	Q778-S781 PolarHBondContact O-N 3.5Å; Q778-S781 VanDerWaalsContact O-N 3.11Å; Q778-S781 PolarHBondContact O-OG 3.41Å; C779-S781 PolarHBondContact O-N 3.01Å
782	N	89.7	Confident	93.9	Very high	48 Å²	48	38.3 Å²	38.3	26%	0.257	22%	0.219	S	C	.	.			trans	-65.9	154.2	177.2	-163.3	-77.2	0	0	0	111.6	C779 N784 V787 K788	C779-N782 WeakPolarHBondContact O-CB 3.14Å; C779-N782 PolarHBondContact O-N 3.32Å; C779-N782 VanDerWaalsContact O-N 3.1Å; N782-N784 VanDerWaalsContact C-N 3.35Å; N782-N784 WeakPolarHBondContact OD1-CB 3.39Å; N782-N784 PolarHBondContact OD1-N 2.85Å; N782-V787 HydrophobicContact CB-CB 4.25Å; N782-V787 HydrophobicContact CB-CG1 3.83Å; N782-K788 WeakPolarHBondContact O-CE 3Å
783	V	88.4	Confident	93.9	Very high	129 Å²	129	39.9 Å²	39.9	78%	0.782	23%	0.227	S	C	*	.	S	Bend	trans	-72.9	-26.6	177.3	-65.3	0	0	0	0	113.1
784	N	90.1	Very high	93.9	Very high	61 Å²	61	40.1 Å²	40.1	33%	0.326	23%	0.228	S	C	.	.			trans	-90.4	118.6	-174.5	-62	-33.4	0	0	0	111.2	E731 N782 V787 K788	E731-N784 HydrophobicContact CB-CB 4.35Å; E731-N784 WeakPolarHBondContact OE2-CB 3.32Å; N782-N784 VanDerWaalsContact C-N 3.35Å; N782-N784 WeakPolarHBondContact OD1-CB 3.39Å; N782-N784 PolarHBondContact OD1-N 2.85Å; N784-V787 HydrophobicContact CB-CB 4.35Å; N784-V787 HydrophobicContact CB-CG2 4.02Å; N784-V787 WeakPolarHBondContact O-CB 3.41Å; N784-V787 PolarHBondContact O-N 2.71Å; N784-V787 VanDerWaalsContact O-N 3.13Å; N784-K788 PolarHBondContact O-N 2.71Å
785	T	91.4	Very high	94	Very high	63 Å²	63	38.2 Å²	38.2	39%	0.387	21%	0.212	S	C	.	.	H	α-helix	trans	-54.1	-44.2	-179.7	-57.7	0	0	0	0	113.9	V787 K788 E789	T785-V787 VanDerWaalsContact C-N 3.27Å; T785-V787 PolarHBondContact O-N 3Å; T785-K788 WeakPolarHBondContact O-CB 3.45Å; T785-K788 PolarHBondContact O-N 2.97Å; T785-K788 VanDerWaalsContact O-N 3.09Å; T785-E789 HydrophobicContact CG2-CG 4.03Å; T785-E789 WeakPolarHBondContact O-CG 3.47Å; T785-E789 PolarHBondContact O-N 2.94Å
786	P	92.3	Very high	94.1	Very high	55 Å²	55	38 Å²	38	36%	0.357	21%	0.211	S	C	.	.	H	α-helix	trans	-59.7	-35.3	178.2	-24.8	35.6	0	0	0	113.5	V735 Q790	V735-P786 HydrophobicContact CG2-CB 4.47Å; P786-Q790 VanDerWaalsContact O-CB 3.29Å; P786-Q790 WeakPolarHBondContact O-CB 3.38Å; P786-Q790 PolarHBondContact O-N 3.13Å
787	V	94.6	Very high	94.1	Very high	1 Å²	1	40.4 Å²	40.4	1%	0.006	22%	0.224	C	C	.	.	H	α-helix	trans	-67.6	-42.5	176.2	176.3	0	0	0	0	110.9	E731 V734 V735 C779 N782 N784 T785 A791	E731-V787 HydrophobicContact CB-CG2 3.75Å; V734-V787 HydrophobicContact CB-CG2 4.24Å; V734-V787 HydrophobicContact CG1-CG1 3.71Å; V734-V787 HydrophobicContact CG1-CG2 4.17Å; V735-V787 HydrophobicContact CG2-CG2 4.23Å; C779-V787 HydrophobicContact CB-CG1 3.99Å; N782-V787 HydrophobicContact CB-CB 4.25Å; N782-V787 HydrophobicContact CB-CG1 3.83Å; N784-V787 HydrophobicContact CB-CB 4.35Å; N784-V787 HydrophobicContact CB-CG2 4.02Å; N784-V787 WeakPolarHBondContact O-CB 3.41Å; N784-V787 PolarHBondContact O-N 2.71Å; N784-V787 VanDerWaalsContact O-N 3.13Å; T785-V787 VanDerWaalsContact C-N 3.27Å; T785-V787 PolarHBondContact O-N 3Å; V787-A791 VanDerWaalsContact O-CB 3.24Å; V787-A791 WeakPolarHBondContact O-CB 3.29Å; V787-A791 PolarHBondContact O-N 3.33Å
788	K	94.6	Very high	94.1	Very high	50 Å²	50	38 Å²	38	22%	0.217	21%	0.213	C	C	.	.	H	α-helix	trans	-63.6	-49.6	175.9	-59.4	-171.3	-176.1	-178.1	0	111.9	L780 N782 N784 T785 Q790 A791 F792 F832 H836	L780-K788 WeakPolarHBondContact O-CD 3.43Å; L780-K788 WeakPolarHBondContact O-CG 3.23Å; N782-K788 WeakPolarHBondContact O-CE 3Å; N784-K788 PolarHBondContact O-N 2.71Å; T785-K788 WeakPolarHBondContact O-CB 3.45Å; T785-K788 PolarHBondContact O-N 2.97Å; T785-K788 VanDerWaalsContact O-N 3.09Å; K788-Q790 PolarHBondContact O-N 2.88Å; K788-A791 PolarHBondContact O-N 3.32Å; K788-F792 VanDerWaalsContact O-CB 3.26Å; K788-F792 WeakPolarHBondContact O-CB 3.45Å; K788-F792 PolarHBondContact O-N 3.21Å; K788-F832 HydrophobicContact CB-CD2 4.29Å; K788-F832 HydrophobicContact CB-CE2 3.72Å; K788-F832 HydrophobicContact CD-CD2 4.49Å; K788-F832 HydrophobicContact CD-CE2 4.34Å; K788-H836 PolarHBondContact NZ-NE2 3.17Å
789	E	94.6	Very high	94.2	Very high	28 Å²	28	33.1 Å²	33.1	13%	0.131	19%	0.19	C	C	.	.	H	α-helix	trans	-60	-45.6	-178.4	-70	170.7	132.1	0	0	111.1	T785 F792 M793 F832 K864	T785-E789 HydrophobicContact CG2-CG 4.03Å; T785-E789 WeakPolarHBondContact O-CG 3.47Å; T785-E789 PolarHBondContact O-N 2.94Å; E789-F792 PolarHBondContact O-N 3.49Å; E789-M793 PolarHBondContact O-N 3.48Å; E789-F832 HydrophobicContact CB-CZ 4.49Å; E789-F832 HydrophobicContact CG-CZ 3.95Å; E789-K864 WeakPolarHBondContact OE1-CE 3.46Å; E789-K864 IonicContact OE1-NZ 3.76Å; E789-K864 PolarHBondContact OE1-NZ 2.85Å; E789-K864 WeakPolarHBondContact OE2-CE 3.28Å; E789-K864 IonicContact OE2-NZ 3.83Å; E789-K864 PolarHBondContact OE2-NZ 3.43Å
790	Q	95.8	Very high	94.3	Very high	38 Å²	38	35 Å²	35	18%	0.178	20%	0.199	C	C	.	.	H	α-helix	trans	-63.8	-44.6	176.9	-174.2	62.6	83.4	0	0	111.7	V735 L738 Q739 P786 K788 F792 L794	V735-Q790 HydrophobicContact CG1-CB 4.45Å; V735-Q790 HydrophobicContact CG1-CG 4.11Å; V735-Q790 HydrophobicContact CG2-CB 4.3Å; L738-Q790 HydrophobicContact CB-CG 4.33Å; L738-Q790 HydrophobicContact CD1-CB 4.5Å; L738-Q790 HydrophobicContact CD1-CG 4.26Å; Q739-Q790 HydrophobicContact CG-CG 4.34Å; P786-Q790 VanDerWaalsContact O-CB 3.29Å; P786-Q790 WeakPolarHBondContact O-CB 3.38Å; P786-Q790 PolarHBondContact O-N 3.13Å; K788-Q790 PolarHBondContact O-N 2.88Å; Q790-F792 VanDerWaalsContact C-N 3.34Å; Q790-L794 HydrophobicContact CG-CD1 4Å; Q790-L794 VanDerWaalsContact O-CG 3.24Å; Q790-L794 WeakPolarHBondContact O-CG 3.42Å; Q790-L794 PolarHBondContact O-N 3.41Å; Q790-L794 VanDerWaalsContact O-N 3.15Å
791	A	96.9	Very high	94.3	Very high	0 Å²	0	36 Å²	36	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-64.6	-38.4	178	0	0	0	0	0	112.2	L738 C776 C779 L780 V787 K788 L795	L738-A791 HydrophobicContact CD1-CB 4.2Å; C776-A791 HydrophobicContact CB-CB 4.36Å; C776-A791 WeakPolarHBondContact O-CB 3.37Å; C779-A791 HydrophobicContact CB-CB 3.56Å; L780-A791 HydrophobicContact CD2-CB 4.4Å; V787-A791 VanDerWaalsContact O-CB 3.24Å; V787-A791 WeakPolarHBondContact O-CB 3.29Å; V787-A791 PolarHBondContact O-N 3.33Å; K788-A791 PolarHBondContact O-N 3.32Å; A791-L795 WeakPolarHBondContact O-CB 3.37Å; A791-L795 WeakPolarHBondContact O-CD1 3.49Å; A791-L795 WeakPolarHBondContact O-CG 3.48Å; A791-L795 PolarHBondContact O-N 3.01Å
792	F	97.8	Very high	94.6	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-64.1	-47.2	177.1	174.3	-91.3	0	0	0	112.7	L780 K788 E789 Q790 L795 C796 L829 F832 V833 L868 F872	L780-F792 HydrophobicContact CD2-CB 3.76Å; L780-F792 HydrophobicContact CD2-CD2 4.45Å; K788-F792 VanDerWaalsContact O-CB 3.26Å; K788-F792 WeakPolarHBondContact O-CB 3.45Å; K788-F792 PolarHBondContact O-N 3.21Å; E789-F792 PolarHBondContact O-N 3.49Å; Q790-F792 VanDerWaalsContact C-N 3.34Å; F792-L795 PolarHBondContact O-N 3.49Å; F792-C796 PolarHBondContact O-N 3.32Å; F792-C796 PolarHBondContact O-SG 3.37Å; F792-L829 HydrophobicContact CD2-CD2 3.52Å; F792-L829 HydrophobicContact CE2-CB 4.29Å; F792-L829 HydrophobicContact CE2-CD2 3.78Å; F792-L829 HydrophobicContact CG-CD2 4.49Å; F792-F832 HydrophobicContact CB-CD1 4.07Å; F792-F832 HydrophobicContact CB-CD2 4.5Å; F792-F832 HydrophobicContact CB-CE1 3.91Å; F792-F832 HydrophobicContact CB-CE2 4.37Å; F792-F832 HydrophobicContact CB-CG 4.36Å; F792-F832 HydrophobicContact CB-CZ 4.07Å; F792-F832 AromaticContact CD1-CD1 3.86Å; F792-F832 HydrophobicContact CD1-CD1 3.86Å; F792-F832 AromaticContact CD1-CE1 3.6Å; F792-F832 HydrophobicContact CD1-CE1 3.6Å; F792-F832 HydrophobicContact CD1-CZ 4.44Å; F792-F832 HydrophobicContact CD2-CB 3.93Å; F792-F832 AromaticContact CD2-CD1 3.14Å; F792-F832 HydrophobicContact CD2-CD1 3.14Å; F792-F832 HydrophobicContact CD2-CD2 4.47Å; F792-F832 AromaticContact CD2-CE1 3.75Å; F792-F832 HydrophobicContact CD2-CE1 3.75Å; F792-F832 AromaticContact CD2-CG 3.58Å; F792-F832 HydrophobicContact CD2-CG 3.58Å; F792-F832 HydrophobicContact CE1-CD1 4.03Å; F792-F832 AromaticContact CE1-CE1 3.97Å; F792-F832 HydrophobicContact CE1-CE1 3.97Å; F792-F832 HydrophobicContact CE2-CB 4.13Å; F792-F832 AromaticContact CE2-CD1 3.35Å; F792-F832 HydrophobicContact CE2-CD1 3.35Å; F792-F832 HydrophobicContact CE2-CE1 4.11Å; F792-F832 HydrophobicContact CE2-CG 4.03Å; F792-F832 AromaticContact CG-CD1 3.41Å; F792-F832 HydrophobicContact CG-CD1 3.41Å; F792-F832 VanDerWaalsContact CG-CD1 3.41Å; F792-F832 AromaticContact CG-CE1 3.46Å; F792-F832 HydrophobicContact CG-CE1 3.46Å; F792-F832 VanDerWaalsContact CG-CE1 3.46Å; F792-F832 HydrophobicContact CG-CG 4.04Å; F792-F832 HydrophobicContact CG-CZ 4.14Å; F792-F832 AromaticContact CZ-CD1 3.77Å; F792-F832 HydrophobicContact CZ-CD1 3.77Å; F792-F832 HydrophobicContact CZ-CE1 4.18Å; F792-V833 HydrophobicContact CE2-CG2 3.95Å; F792-V833 HydrophobicContact CZ-CG2 3.6Å; F792-L868 HydrophobicContact CD1-CD2 3.63Å; F792-L868 HydrophobicContact CE1-CB 4.08Å; F792-L868 HydrophobicContact CE1-CD2 3.94Å; F792-L868 WeakPolarHBondContact CE1-O 3.39Å; F792-F872 HydrophobicContact CZ-CB 4.02Å
793	M	96.5	Very high	94.8	Very high	33 Å²	33	28.9 Å²	28.9	16%	0.163	16%	0.158	C	C	.	.	H	α-helix	trans	-60.8	-51.5	176.8	-73.9	-61.2	-64	0	0	110.8	E789 L795 C796 D797 L868 A871	E789-M793 PolarHBondContact O-N 3.48Å; M793-L795 PolarHBondContact O-N 3.12Å; M793-C796 WeakPolarHBondContact O-CA 3.41Å; M793-C796 WeakPolarHBondContact O-CB 3.42Å; M793-C796 PolarHBondContact O-N 2.85Å; M793-D797 PolarHBondContact O-N 3.36Å; M793-D797 VanDerWaalsContact O-OD2 3.13Å; M793-L868 HydrophobicContact CG-CD2 3.92Å; M793-L868 HydrophobicContact SD-CD2 3.83Å; M793-A871 HydrophobicContact CE-CB 4.11Å; M793-A871 HydrophobicContact SD-CB 3.77Å
794	L	96.3	Very high	95	Very high	10 Å²	10	25.8 Å²	25.8	5%	0.052	14%	0.135	C	C	.	.	H	α-helix	trans	-64.6	-28.2	-179.7	-59.3	173.7	0	0	0	112.9	L738 H742 Q790 L798	L738-L794 HydrophobicContact CB-CD1 3.79Å; H742-L794 HydrophobicContact CB-CD1 4.28Å; H742-L794 HydrophobicContact CB-CD2 3.93Å; Q790-L794 HydrophobicContact CG-CD1 4Å; Q790-L794 VanDerWaalsContact O-CG 3.24Å; Q790-L794 WeakPolarHBondContact O-CG 3.42Å; Q790-L794 PolarHBondContact O-N 3.41Å; Q790-L794 VanDerWaalsContact O-N 3.15Å; L794-L798 VanDerWaalsContact O-CB 3.22Å; L794-L798 WeakPolarHBondContact O-CB 3.4Å; L794-L798 WeakPolarHBondContact O-CD1 3.43Å; L794-L798 WeakPolarHBondContact O-CG 3.41Å; L794-L798 PolarHBondContact O-N 2.97Å
795	L	97.4	Very high	94.9	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-66.2	-48.3	168.3	-81	165.5	0	0	0	111.2	L773 C776 L780 A791 F792 M793 D797 L799 L825 L829	L773-L795 HydrophobicContact CD2-CD2 3.81Å; C776-L795 HydrophobicContact CB-CD1 4.01Å; C776-L795 HydrophobicContact CB-CD2 3.84Å; C776-L795 HydrophobicContact CB-CG 3.62Å; L780-L795 HydrophobicContact CD1-CD1 3.67Å; L780-L795 HydrophobicContact CD2-CD1 4.04Å; L780-L795 HydrophobicContact CG-CD1 3.8Å; A791-L795 WeakPolarHBondContact O-CB 3.37Å; A791-L795 WeakPolarHBondContact O-CD1 3.49Å; A791-L795 WeakPolarHBondContact O-CG 3.48Å; A791-L795 PolarHBondContact O-N 3.01Å; F792-L795 PolarHBondContact O-N 3.49Å; M793-L795 PolarHBondContact O-N 3.12Å; L795-D797 PolarHBondContact O-N 3.08Å; L795-L799 WeakPolarHBondContact O-CB 3.38Å; L795-L799 WeakPolarHBondContact O-CG 3.35Å; L795-L799 PolarHBondContact O-N 3.38Å; L795-L825 HydrophobicContact CD1-CD1 4.21Å; L795-L825 HydrophobicContact CD2-CD1 4.29Å; L795-L825 HydrophobicContact CD2-CD2 4.49Å; L795-L829 HydrophobicContact CB-CD2 4.12Å; L795-L829 HydrophobicContact CD1-CD2 4.11Å
796	C	97.1	Very high	94.9	Very high	2 Å²	2	22.8 Å²	22.8	1%	0.014	11%	0.114	C	C	.	.	H	α-helix	trans	-59.4	-47	177.8	-65	0	0	0	0	111.4	F792 M793 L799 M800 A871 L875	F792-C796 PolarHBondContact O-N 3.32Å; F792-C796 PolarHBondContact O-SG 3.37Å; M793-C796 WeakPolarHBondContact O-CA 3.41Å; M793-C796 WeakPolarHBondContact O-CB 3.42Å; M793-C796 PolarHBondContact O-N 2.85Å; C796-L799 PolarHBondContact O-N 3.18Å; C796-M800 WeakPolarHBondContact O-CB 3.41Å; C796-M800 PolarHBondContact O-N 2.99Å; C796-A871 HydrophobicContact CB-CB 3.87Å; C796-L875 HydrophobicContact CB-CD1 4.34Å
797	D	95.5	Very high	94.6	Very high	51 Å²	51	22.7 Å²	22.7	27%	0.273	11%	0.11	S	C	.	.	H	α-helix	trans	-67.2	-44.1	-178.2	-60.3	-37.6	0	0	0	111.9	M793 L795 M800 I801	M793-D797 PolarHBondContact O-N 3.36Å; M793-D797 VanDerWaalsContact O-OD2 3.13Å; L795-D797 PolarHBondContact O-N 3.08Å; D797-M800 WeakPolarHBondContact O-CB 3.4Å; D797-M800 PolarHBondContact O-N 3.36Å; D797-I801 WeakPolarHBondContact O-CB 3.25Å; D797-I801 WeakPolarHBondContact O-CD1 3.28Å; D797-I801 VanDerWaalsContact O-CG1 3.24Å; D797-I801 WeakPolarHBondContact O-CG1 3.17Å; D797-I801 PolarHBondContact O-N 3.27Å
798	L	96.1	Very high	94.2	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-70	-35.3	176.7	-70.3	172.7	0	0	0	112.9	H742 I745 L746 F772 L773 L794 M800 F802	H742-L798 WeakPolarHBondContact ND1-CG 3.35Å; I745-L798 HydrophobicContact CG2-CD2 3.87Å; L746-L798 HydrophobicContact CD2-CD2 4.24Å; F772-L798 HydrophobicContact CD1-CD1 3.55Å; F772-L798 HydrophobicContact CE1-CD1 3.64Å; L773-L798 HydrophobicContact CD2-CB 3.81Å; L773-L798 HydrophobicContact CD2-CD1 4.15Å; L794-L798 VanDerWaalsContact O-CB 3.22Å; L794-L798 WeakPolarHBondContact O-CB 3.4Å; L794-L798 WeakPolarHBondContact O-CD1 3.43Å; L794-L798 WeakPolarHBondContact O-CG 3.41Å; L794-L798 PolarHBondContact O-N 2.97Å; L798-M800 VanDerWaalsContact C-N 3.3Å; L798-F802 HydrophobicContact CD2-CD2 4.01Å; L798-F802 HydrophobicContact CD2-CE2 3.75Å; L798-F802 WeakPolarHBondContact O-CB 3.36Å; L798-F802 WeakPolarHBondContact O-CD2 3.34Å; L798-F802 PolarHBondContact O-N 3.24Å
799	L	96.4	Very high	93.6	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-66.2	-34.2	173	-71.7	175.2	0	0	0	111.5	L795 C796 S803 F819 P821 L825 L829 L875 I880	L795-L799 WeakPolarHBondContact O-CB 3.38Å; L795-L799 WeakPolarHBondContact O-CG 3.35Å; L795-L799 PolarHBondContact O-N 3.38Å; C796-L799 PolarHBondContact O-N 3.18Å; L799-S803 VanDerWaalsContact O-CB 3.26Å; L799-S803 WeakPolarHBondContact O-CB 3.44Å; L799-S803 PolarHBondContact O-N 2.83Å; L799-F819 HydrophobicContact CD2-CD1 3.55Å; L799-F819 HydrophobicContact CD2-CE1 3.68Å; L799-P821 HydrophobicContact CD1-CB 4.1Å; L799-P821 HydrophobicContact CD1-CG 4.32Å; L799-P821 HydrophobicContact CD2-CB 3.91Å; L799-P821 HydrophobicContact CD2-CG 4.19Å; L799-L825 HydrophobicContact CD1-CD2 4.23Å; L799-L825 HydrophobicContact CD2-CD2 4.36Å; L799-L829 HydrophobicContact CD1-CD1 3.64Å; L799-L875 HydrophobicContact CB-CD2 3.99Å; L799-L875 HydrophobicContact CD1-CD1 4.32Å; L799-I880 HydrophobicContact CB-CG2 4.3Å
800	M	95.3	Very high	92.9	Very high	42 Å²	42	29.2 Å²	29.2	21%	0.207	19%	0.186	C	C	.	.	H	α-helix	trans	-67.7	-53.5	173.1	-171.6	65.2	-106.8	0	0	111.4	C796 D797 L798 S803 Q805 L875 Y878 I880	C796-M800 WeakPolarHBondContact O-CB 3.41Å; C796-M800 PolarHBondContact O-N 2.99Å; D797-M800 WeakPolarHBondContact O-CB 3.4Å; D797-M800 PolarHBondContact O-N 3.36Å; L798-M800 VanDerWaalsContact C-N 3.3Å; M800-S803 WeakPolarHBondContact O-CB 3.44Å; M800-S803 PolarHBondContact O-N 3.41Å; M800-S803 PolarHBondContact O-OG 3.11Å; M800-Q805 HydrophobicContact CE-CB 4.32Å; M800-Q805 HydrophobicContact CE-CG 3.92Å; M800-L875 HydrophobicContact CB-CD2 4.4Å; M800-Y878 HydrophobicContact CE-CD1 4.11Å; M800-Y878 HydrophobicContact CE-CD2 4.05Å; M800-Y878 HydrophobicContact CE-CG 3.7Å; M800-Y878 HydrophobicContact SD-CD2 3.63Å; M800-Y878 HydrophobicContact SD-CE2 4.37Å; M800-Y878 HydrophobicContact SD-CG 3.87Å; M800-I880 HydrophobicContact CB-CD1 4.47Å; M800-I880 HydrophobicContact CE-CD1 3.79Å; M800-I880 HydrophobicContact SD-CD1 3.68Å
801	I	94.6	Very high	92.4	Very high	42 Å²	42	30.4 Å²	30.4	22%	0.215	19%	0.189	C	C	.	.	H	α-helix	trans	-65.4	-42	-176.4	-68.2	165.6	0	0	0	112	L746 L749 D797 S803	L746-I801 HydrophobicContact CD2-CD1 3.7Å; L746-I801 HydrophobicContact CD2-CG2 4.47Å; L749-I801 HydrophobicContact CD2-CG2 3.46Å; L749-I801 VanDerWaalsContact CD2-CG2 3.46Å; D797-I801 WeakPolarHBondContact O-CB 3.25Å; D797-I801 WeakPolarHBondContact O-CD1 3.28Å; D797-I801 VanDerWaalsContact O-CG1 3.24Å; D797-I801 WeakPolarHBondContact O-CG1 3.17Å; D797-I801 PolarHBondContact O-N 3.27Å; I801-S803 VanDerWaalsContact C-N 3.33Å
802	F	95.2	Very high	91.8	Very high	1 Å²	1	37.8 Å²	37.8	0%	0.004	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.5	14.1	178.4	-67.7	-88.3	0	0	0	113.8	I745 L749 L765 V769 L798 L806 L817 V818 F819	I745-F802 HydrophobicContact CG2-CE2 3.63Å; I745-F802 HydrophobicContact CG2-CZ 3.72Å; L749-F802 HydrophobicContact CB-CZ 4.34Å; L749-F802 HydrophobicContact CD1-CE1 4.19Å; L749-F802 HydrophobicContact CD1-CZ 4.41Å; L749-F802 HydrophobicContact CD2-CE1 4.22Å; L749-F802 HydrophobicContact CD2-CE2 4.31Å; L749-F802 HydrophobicContact CD2-CZ 3.85Å; L749-F802 HydrophobicContact CG-CZ 4.44Å; L765-F802 HydrophobicContact CD2-CE1 4.34Å; L765-F802 HydrophobicContact CD2-CZ 4.49Å; V769-F802 HydrophobicContact CG1-CD1 4.35Å; V769-F802 HydrophobicContact CG1-CD2 4.25Å; V769-F802 HydrophobicContact CG1-CG 4.18Å; V769-F802 HydrophobicContact CG2-CD1 4.31Å; V769-F802 HydrophobicContact CG2-CD2 4.5Å; V769-F802 HydrophobicContact CG2-CE1 3.75Å; V769-F802 HydrophobicContact CG2-CE2 3.98Å; V769-F802 HydrophobicContact CG2-CZ 3.57Å; L798-F802 HydrophobicContact CD2-CD2 4.01Å; L798-F802 HydrophobicContact CD2-CE2 3.75Å; L798-F802 WeakPolarHBondContact O-CB 3.36Å; L798-F802 WeakPolarHBondContact O-CD2 3.34Å; L798-F802 PolarHBondContact O-N 3.24Å; F802-L806 HydrophobicContact CD1-CD2 4.08Å; F802-L817 HydrophobicContact CD1-CB 4.05Å; F802-L817 HydrophobicContact CE1-CB 4.22Å; F802-L817 HydrophobicContact CE1-CD1 4.43Å; F802-V818 CarbonylContact O-C 3.59Å; F802-V818 WeakPolarHBondContact O-CA 3.41Å; F802-F819 HydrophobicContact CB-CB 4.34Å; F802-F819 PolarHBondContact O-N 2.74Å
803	S	94.5	Very high	91.2	Very high	1 Å²	1	40.5 Å²	40.5	1%	0.007	25%	0.251	C	S	.	.	S	Bend	trans	-66.3	179.7	173.6	69.3	0	0	0	0	112.9	L799 M800 I801 Q805 L806	L799-S803 VanDerWaalsContact O-CB 3.26Å; L799-S803 WeakPolarHBondContact O-CB 3.44Å; L799-S803 PolarHBondContact O-N 2.83Å; M800-S803 WeakPolarHBondContact O-CB 3.44Å; M800-S803 PolarHBondContact O-N 3.41Å; M800-S803 PolarHBondContact O-OG 3.11Å; I801-S803 VanDerWaalsContact C-N 3.33Å; S803-Q805 PolarHBondContact O-N 3.15Å; S803-Q805 VanDerWaalsContact O-N 3.15Å; S803-Q805 VanDerWaalsContact OG-CB 3.3Å; S803-Q805 WeakPolarHBondContact OG-CB 3.39Å; S803-Q805 WeakPolarHBondContact OG-CG 3.41Å; S803-Q805 PolarHBondContact OG-N 3.03Å; S803-Q805 VanDerWaalsContact OG-N 3.1Å; S803-L806 VanDerWaalsContact O-CB 3.25Å; S803-L806 WeakPolarHBondContact O-CB 3.49Å; S803-L806 PolarHBondContact O-N 3.08Å; S803-L806 VanDerWaalsContact O-N 3.16Å
804	H	91.4	Very high	90.8	Very high	64 Å²	64	39.4 Å²	39.4	30%	0.296	25%	0.246	S	C	.	.	G	3₁₀ helix	trans	-60.4	-19.1	169.7	68.7	-101.2	0	0	0	113.6	L806 M807 Y878 D879	H804-L806 PolarHBondContact O-N 3.22Å; H804-M807 HydrophobicContact CB-CE 4.09Å; H804-M807 WeakPolarHBondContact O-CE 3.48Å; H804-M807 PolarHBondContact O-N 3Å; H804-Y878 PolarHBondContact CE1-O 3.1Å; H804-D879 PolarHBondContact CE1-O 2.76Å; H804-D879 VanDerWaalsContact CE1-O 3.31Å
805	Q	89.7	Confident	90.6	Very high	58 Å²	58	45.1 Å²	45.1	27%	0.271	27%	0.272	S	S	.	.	G	3₁₀ helix	trans	-65.5	-23.3	176.5	-57.2	-66.4	-16.2	0	0	112.3	M800 S803 M807 T808 Y878	M800-Q805 HydrophobicContact CE-CB 4.32Å; M800-Q805 HydrophobicContact CE-CG 3.92Å; S803-Q805 PolarHBondContact O-N 3.15Å; S803-Q805 VanDerWaalsContact O-N 3.15Å; S803-Q805 VanDerWaalsContact OG-CB 3.3Å; S803-Q805 WeakPolarHBondContact OG-CB 3.39Å; S803-Q805 WeakPolarHBondContact OG-CG 3.41Å; S803-Q805 PolarHBondContact OG-N 3.03Å; S803-Q805 VanDerWaalsContact OG-N 3.1Å; Q805-M807 PolarHBondContact O-N 2.99Å; Q805-M807 VanDerWaalsContact O-N 3.09Å; Q805-T808 VanDerWaalsContact O-CB 3.31Å; Q805-T808 WeakPolarHBondContact O-CB 3.18Å; Q805-T808 VanDerWaalsContact O-CG2 3.31Å; Q805-T808 WeakPolarHBondContact O-CG2 3.12Å; Q805-T808 PolarHBondContact O-N 3.19Å; Q805-T808 PolarHBondContact O-OG1 3.33Å; Q805-Y878 HydrophobicContact CG-CD1 4.34Å
806	L	89.4	Confident	90.3	Very high	2 Å²	2	47.5 Å²	47.5	1%	0.01	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-54.7	-28.6	176.1	-177.8	56.1	0	0	0	113.4	L749 F802 S803 H804 T808 R811 L814 L817 F1258	L749-L806 HydrophobicContact CD1-CD1 4.38Å; L749-L806 HydrophobicContact CD2-CD1 4.46Å; F802-L806 HydrophobicContact CD1-CD2 4.08Å; S803-L806 VanDerWaalsContact O-CB 3.25Å; S803-L806 WeakPolarHBondContact O-CB 3.49Å; S803-L806 PolarHBondContact O-N 3.08Å; S803-L806 VanDerWaalsContact O-N 3.16Å; H804-L806 PolarHBondContact O-N 3.22Å; L806-T808 VanDerWaalsContact C-N 3.35Å; L806-R811 WeakPolarHBondContact O-CB 3.4Å; L806-L814 HydrophobicContact CD1-CD1 3.75Å; L806-L814 HydrophobicContact CD2-CB 4.2Å; L806-L814 HydrophobicContact CG-CB 3.98Å; L806-L814 HydrophobicContact CG-CD1 4.09Å; L806-L817 HydrophobicContact CD2-CB 3.88Å; L806-L817 HydrophobicContact CD2-CD1 4.49Å; L806-F1258 HydrophobicContact CD1-CE1 3.49Å; L806-F1258 VanDerWaalsContact CD1-CE1 3.49Å; L806-F1258 HydrophobicContact CD1-CZ 3.83Å
807	M	87.9	Confident	90	Very high	53 Å²	53	47.6 Å²	47.6	26%	0.261	29%	0.288	S	S	.	.	G	3₁₀ helix	trans	-83.1	-8.6	179.8	-60.9	178.7	-68.3	0	0	113.6	H804 Q805 R811 Q815 V818	H804-M807 HydrophobicContact CB-CE 4.09Å; H804-M807 WeakPolarHBondContact O-CE 3.48Å; H804-M807 PolarHBondContact O-N 3Å; Q805-M807 PolarHBondContact O-N 2.99Å; Q805-M807 VanDerWaalsContact O-N 3.09Å; M807-R811 PolarHBondContact O-N 3.12Å; M807-Q815 HydrophobicContact CG-CB 4.36Å; M807-Q815 HydrophobicContact SD-CB 3.63Å; M807-Q815 HydrophobicContact SD-CG 3.75Å; M807-V818 HydrophobicContact CE-CG2 4.23Å; M807-V818 HydrophobicContact CG-CG2 4Å; M807-V818 HydrophobicContact SD-CG2 4.1Å
808	T	85.6	Confident	90	Very high	65 Å²	65	46.3 Å²	46.3	40%	0.399	28%	0.282	S	S	.	.	G	3₁₀ helix	trans	-68.2	162.6	179.9	65.5	0	0	0	0	111.9	Q805 L806 G810 R811	Q805-T808 VanDerWaalsContact O-CB 3.31Å; Q805-T808 WeakPolarHBondContact O-CB 3.18Å; Q805-T808 VanDerWaalsContact O-CG2 3.31Å; Q805-T808 WeakPolarHBondContact O-CG2 3.12Å; Q805-T808 PolarHBondContact O-N 3.19Å; Q805-T808 PolarHBondContact O-OG1 3.33Å; L806-T808 VanDerWaalsContact C-N 3.35Å; T808-G810 PolarHBondContact O-N 2.88Å; T808-R811 PolarHBondContact O-N 3.26Å; T808-R811 PolarHBondContact O-NE 3.27Å
809	G	81.6	Confident	89.9	Confident	84 Å²	84	48.2 Å²	48.2	87%	0.866	29%	0.291	S	S	*	.	G	3₁₀ helix	trans	73.1	8.5	-173	0	0	0	0	0	114.6
810	G	79.6	Confident	89.7	Confident	67 Å²	67	53.7 Å²	53.7	69%	0.691	32%	0.32	S	S	*	.	G	3₁₀ helix	trans	92.4	11.3	-177.1	0	0	0	0	0	114.3	T808 E812	T808-G810 PolarHBondContact O-N 2.88Å; G810-E812 PolarHBondContact O-N 3.42Å
811	R	85.3	Confident	89.7	Confident	64 Å²	64	52.1 Å²	52.1	24%	0.242	31%	0.313	C	S	.	.			trans	-78.1	36.8	-178.4	-65.6	-174.6	-83.4	-158.1	-0.7	113.4	L806 M807 T808 G813 L814 M1257 F1258	L806-R811 WeakPolarHBondContact O-CB 3.4Å; M807-R811 PolarHBondContact O-N 3.12Å; T808-R811 PolarHBondContact O-N 3.26Å; T808-R811 PolarHBondContact O-NE 3.27Å; R811-G813 PolarHBondContact O-N 3.2Å; R811-G813 VanDerWaalsContact O-N 3.08Å; R811-L814 HydrophobicContact CB-CD1 3.94Å; R811-L814 HydrophobicContact CB-CG 4.29Å; R811-L814 HydrophobicContact CG-CD1 4.43Å; R811-L814 WeakPolarHBondContact O-CB 3.21Å; R811-L814 PolarHBondContact O-N 3.26Å; R811-M1257 PolarHBondContact NH1-O 2.7Å; R811-M1257 VanDerWaalsContact NH1-O 3.08Å; R811-F1258 VanDerWaalsContact NH1-CE1 3.26Å
812	E	84.8	Confident	89.7	Confident	155 Å²	155	54.9 Å²	54.9	72%	0.724	33%	0.328	S	S	*	.	G	3₁₀ helix	trans	-56	-30.3	-176.3	-67	-173.3	178.5	0	0	113.6	G810 L814 Q815	G810-E812 PolarHBondContact O-N 3.42Å; E812-L814 PolarHBondContact O-N 3.48Å; E812-L814 VanDerWaalsContact O-N 3.13Å; E812-Q815 VanDerWaalsContact O-CB 3.29Å; E812-Q815 WeakPolarHBondContact O-CB 2.79Å; E812-Q815 PolarHBondContact O-N 3.34Å; E812-Q815 VanDerWaalsContact O-N 3.07Å
813	G	84.8	Confident	89.6	Confident	56 Å²	56	60.3 Å²	60.3	58%	0.577	36%	0.361	S	S	*	.	G	3₁₀ helix	trans	-60.3	-19.7	176.3	0	0	0	0	0	114.6	R811 P816	R811-G813 PolarHBondContact O-N 3.2Å; R811-G813 VanDerWaalsContact O-N 3.08Å; G813-P816 WeakPolarHBondContact O-CD 3.15Å
814	L	89.4	Confident	89.6	Confident	11 Å²	11	61.6 Å²	61.6	6%	0.058	38%	0.375	C	S	.	.	G	3₁₀ helix	trans	-85.9	-2.6	177.8	-53.8	-177.7	0	0	0	113.4	I752 T753 L762 L806 R811 E812 P816 L817	I752-L814 HydrophobicContact CG2-CD2 3.81Å; T753-L814 HydrophobicContact CG2-CD1 3.95Å; L762-L814 HydrophobicContact CD2-CD2 4.26Å; L806-L814 HydrophobicContact CD1-CD1 3.75Å; L806-L814 HydrophobicContact CD2-CB 4.2Å; L806-L814 HydrophobicContact CG-CB 3.98Å; L806-L814 HydrophobicContact CG-CD1 4.09Å; R811-L814 HydrophobicContact CB-CD1 3.94Å; R811-L814 HydrophobicContact CB-CG 4.29Å; R811-L814 HydrophobicContact CG-CD1 4.43Å; R811-L814 WeakPolarHBondContact O-CB 3.21Å; R811-L814 PolarHBondContact O-N 3.26Å; E812-L814 PolarHBondContact O-N 3.48Å; E812-L814 VanDerWaalsContact O-N 3.13Å; L814-P816 WeakPolarHBondContact O-CD 3.48Å; L814-L817 HydrophobicContact CD2-CD1 4.22Å; L814-L817 WeakPolarHBondContact O-CB 3.15Å; L814-L817 PolarHBondContact O-N 2.83Å
815	Q	90.2	Very high	89.8	Confident	129 Å²	129	58.7 Å²	58.7	60%	0.603	36%	0.361	S	S	*	.	G	3₁₀ helix	trans	-45.7	-36.7	174.7	-178.1	177.6	72.1	0	0	114.7	M807 E812 L817 V818	M807-Q815 HydrophobicContact CG-CB 4.36Å; M807-Q815 HydrophobicContact SD-CB 3.63Å; M807-Q815 HydrophobicContact SD-CG 3.75Å; E812-Q815 VanDerWaalsContact O-CB 3.29Å; E812-Q815 WeakPolarHBondContact O-CB 2.79Å; E812-Q815 PolarHBondContact O-N 3.34Å; E812-Q815 VanDerWaalsContact O-N 3.07Å; Q815-L817 PolarHBondContact O-N 3.06Å; Q815-V818 PolarHBondContact O-N 3.15Å
816	P	91.1	Very high	90.1	Very high	51 Å²	51	57.8 Å²	57.8	33%	0.331	36%	0.357	S	S	.	.	G	3₁₀ helix	trans	-62.1	-25.7	175.9	-24.6	36.4	0	0	0	114.4	R766 G813 L814	R766-P816 WeakPolarHBondContact CD-O 3.41Å; R766-P816 PolarHBondContact NE-O 2.99Å; R766-P816 PolarHBondContact NH2-O 3.26Å; G813-P816 WeakPolarHBondContact O-CD 3.15Å; L814-P816 WeakPolarHBondContact O-CD 3.48Å
817	L	92.7	Very high	90.3	Very high	4 Å²	4	61.3 Å²	61.3	2%	0.021	38%	0.382	C	S	.	.	G	3₁₀ helix	trans	-79.9	-22.1	-179.7	-60.4	177.7	0	0	0	112.8	L749 I752 L762 L765 R766 F802 L806 L814 Q815 F819	L749-L817 HydrophobicContact CD1-CD1 3.81Å; I752-L817 HydrophobicContact CG2-CD1 4.26Å; L762-L817 HydrophobicContact CD2-CD1 3.9Å; L762-L817 HydrophobicContact CD2-CD2 4.2Å; L762-L817 HydrophobicContact CD2-CG 3.98Å; L762-L817 WeakPolarHBondContact O-CD2 3.44Å; L765-L817 HydrophobicContact CB-CD2 4.06Å; L765-L817 HydrophobicContact CD2-CD1 3.97Å; L765-L817 HydrophobicContact CD2-CD2 4.08Å; L765-L817 HydrophobicContact CG-CD2 4.06Å; R766-L817 HydrophobicContact CB-CD2 4.17Å; F802-L817 HydrophobicContact CD1-CB 4.05Å; F802-L817 HydrophobicContact CE1-CB 4.22Å; F802-L817 HydrophobicContact CE1-CD1 4.43Å; L806-L817 HydrophobicContact CD2-CB 3.88Å; L806-L817 HydrophobicContact CD2-CD1 4.49Å; L814-L817 HydrophobicContact CD2-CD1 4.22Å; L814-L817 WeakPolarHBondContact O-CB 3.15Å; L814-L817 PolarHBondContact O-N 2.83Å; Q815-L817 PolarHBondContact O-N 3.06Å; L817-F819 PolarHBondContact O-N 2.94Å
818	V	94.1	Very high	90.7	Very high	23 Å²	23	62.8 Å²	62.8	14%	0.139	39%	0.388	C	S	.	.			trans	-55.8	132	-174.3	178.2	0	0	0	0	111.7	F802 M807 Q815	F802-V818 CarbonylContact O-C 3.59Å; F802-V818 WeakPolarHBondContact O-CA 3.41Å; M807-V818 HydrophobicContact CE-CG2 4.23Å; M807-V818 HydrophobicContact CG-CG2 4Å; M807-V818 HydrophobicContact SD-CG2 4.1Å; Q815-V818 PolarHBondContact O-N 3.15Å
819	F	94.8	Very high	91.3	Very high	41 Å²	41	59.7 Å²	59.7	18%	0.18	37%	0.369	C	S	.	.			trans	-125.2	131.3	178.7	-172.5	-80.5	0	0	0	109.3	K770 L773 L799 F802 L817 L825	K770-F819 HydrophobicContact CG-CD2 4.04Å; K770-F819 HydrophobicContact CG-CE2 4.13Å; L773-F819 HydrophobicContact CD1-CB 4.39Å; L773-F819 HydrophobicContact CD1-CD1 3.78Å; L773-F819 HydrophobicContact CD1-CD2 3.63Å; L773-F819 HydrophobicContact CD1-CE1 3.87Å; L773-F819 HydrophobicContact CD1-CE2 3.72Å; L773-F819 HydrophobicContact CD1-CG 3.67Å; L773-F819 HydrophobicContact CD1-CZ 3.84Å; L799-F819 HydrophobicContact CD2-CD1 3.55Å; L799-F819 HydrophobicContact CD2-CE1 3.68Å; F802-F819 HydrophobicContact CB-CB 4.34Å; F802-F819 PolarHBondContact O-N 2.74Å; L817-F819 PolarHBondContact O-N 2.94Å; F819-L825 HydrophobicContact CE1-CD2 4.42Å
820	N	92.8	Very high	92	Very high	115 Å²	115	57.1 Å²	57.1	62%	0.615	34%	0.335	S	S	*	.			trans	-115.5	131.2	172.7	-60.3	-19	0	0	0	107.5
821	P	95.1	Very high	92.7	Very high	8 Å²	8	56.7 Å²	56.7	5%	0.052	32%	0.322	C	S	.	.			trans	-69.6	139.1	179	29.6	-32.8	0	0	0	110.4	L799 L825 Q826 I880	L799-P821 HydrophobicContact CD1-CB 4.1Å; L799-P821 HydrophobicContact CD1-CG 4.32Å; L799-P821 HydrophobicContact CD2-CB 3.91Å; L799-P821 HydrophobicContact CD2-CG 4.19Å; P821-L825 HydrophobicContact CB-CB 4.37Å; P821-L825 HydrophobicContact CB-CD2 3.87Å; P821-L825 HydrophobicContact CB-CG 4.14Å; P821-Q826 HydrophobicContact CB-CG 3.94Å; P821-Q826 HydrophobicContact CG-CG 3.83Å; P821-Q826 PolarHBondContact O-NE2 3.34Å; P821-I880 HydrophobicContact CG-CG2 3.98Å; P821-I880 WeakPolarHBondContact CG-O 3.26Å
822	D	93.6	Very high	93.2	Very high	101 Å²	101	54 Å²	54	54%	0.54	31%	0.312	S	S	.	.			trans	-76.9	170.7	173.8	74.9	23.6	0	0	0	112	G824 L825 Q826	D822-G824 PolarHBondContact O-N 3.38Å; D822-G824 WeakPolarHBondContact OD1-CA 3.13Å; D822-G824 PolarHBondContact OD1-N 2.93Å; D822-L825 PolarHBondContact O-N 2.86Å; D822-L825 PolarHBondContact OD1-N 3.42Å; D822-Q826 VanDerWaalsContact O-CG 3.32Å; D822-Q826 WeakPolarHBondContact O-CG 3.22Å; D822-Q826 PolarHBondContact O-N 3.28Å
823	T	93.3	Very high	93.8	Very high	115 Å²	115	46.7 Å²	46.7	71%	0.706	28%	0.277	S	S	*	.	H	α-helix	trans	-65.2	-17.6	-177.8	52.3	0	0	0	0	113.7	S827	T823-S827 WeakPolarHBondContact O-CB 3.43Å; T823-S827 PolarHBondContact O-N 3.19Å; T823-S827 PolarHBondContact O-OG 2.81Å
824	G	94.8	Very high	94.3	Very high	28 Å²	28	46 Å²	46	29%	0.289	26%	0.26	S	S	.	.	H	α-helix	trans	-72.8	-58.7	172.7	0	0	0	0	0	110	D822 Q826 S827 E828	D822-G824 PolarHBondContact O-N 3.38Å; D822-G824 WeakPolarHBondContact OD1-CA 3.13Å; D822-G824 PolarHBondContact OD1-N 2.93Å; G824-Q826 VanDerWaalsContact C-N 3.3Å; G824-Q826 PolarHBondContact O-N 2.97Å; G824-S827 WeakPolarHBondContact O-CA 3.32Å; G824-S827 WeakPolarHBondContact O-CB 3.48Å; G824-S827 PolarHBondContact O-N 3.29Å; G824-E828 WeakPolarHBondContact O-CG 3.41Å; G824-E828 PolarHBondContact O-N 3.35Å
825	L	95.1	Very high	94.5	Very high	2 Å²	2	50.2 Å²	50.2	1%	0.01	28%	0.283	C	S	.	.	H	α-helix	trans	-58.4	-39.7	178.5	178.6	57.3	0	0	0	112.4	Q777 L795 L799 F819 P821 D822 S827 E828 L829	Q777-L825 HydrophobicContact CB-CD1 4.3Å; Q777-L825 HydrophobicContact CG-CD1 3.92Å; L795-L825 HydrophobicContact CD1-CD1 4.21Å; L795-L825 HydrophobicContact CD2-CD1 4.29Å; L795-L825 HydrophobicContact CD2-CD2 4.49Å; L799-L825 HydrophobicContact CD1-CD2 4.23Å; L799-L825 HydrophobicContact CD2-CD2 4.36Å; F819-L825 HydrophobicContact CE1-CD2 4.42Å; P821-L825 HydrophobicContact CB-CB 4.37Å; P821-L825 HydrophobicContact CB-CD2 3.87Å; P821-L825 HydrophobicContact CB-CG 4.14Å; D822-L825 PolarHBondContact O-N 2.86Å; D822-L825 PolarHBondContact OD1-N 3.42Å; L825-S827 VanDerWaalsContact C-N 3.28Å; L825-S827 PolarHBondContact O-N 2.68Å; L825-E828 PolarHBondContact O-N 2.98Å; L825-L829 HydrophobicContact CD1-CD1 4.08Å; L825-L829 HydrophobicContact CD1-CG 4.02Å; L825-L829 HydrophobicContact CG-CD1 4.13Å; L825-L829 WeakPolarHBondContact O-CB 3.48Å; L825-L829 VanDerWaalsContact O-CG 3.28Å; L825-L829 WeakPolarHBondContact O-CG 3.46Å; L825-L829 PolarHBondContact O-N 3.48Å
826	Q	95.9	Very high	94.5	Very high	39 Å²	39	45.5 Å²	45.5	18%	0.182	26%	0.26	C	S	.	.	H	α-helix	trans	-61.7	-34.9	174.3	-67.8	-174	42.6	0	0	112.7	P821 D822 G824 L830 V881 D882	P821-Q826 HydrophobicContact CB-CG 3.94Å; P821-Q826 HydrophobicContact CG-CG 3.83Å; P821-Q826 PolarHBondContact O-NE2 3.34Å; D822-Q826 VanDerWaalsContact O-CG 3.32Å; D822-Q826 WeakPolarHBondContact O-CG 3.22Å; D822-Q826 PolarHBondContact O-N 3.28Å; G824-Q826 VanDerWaalsContact C-N 3.3Å; G824-Q826 PolarHBondContact O-N 2.97Å; Q826-L830 WeakPolarHBondContact O-CB 3.28Å; Q826-L830 PolarHBondContact O-N 2.89Å; Q826-V881 HydrophobicContact CG-CG1 4.5Å; Q826-V881 HydrophobicContact CG-CG2 4.18Å; Q826-D882 VanDerWaalsContact OE1-N 3.11Å
827	S	94.9	Very high	94.6	Very high	76 Å²	76	43.1 Å²	43.1	53%	0.531	25%	0.245	S	C	.	.	H	α-helix	trans	-77.1	-37.6	177.9	-57.1	0	0	0	0	112.3	T823 G824 L825 L830 S831	T823-S827 WeakPolarHBondContact O-CB 3.43Å; T823-S827 PolarHBondContact O-N 3.19Å; T823-S827 PolarHBondContact O-OG 2.81Å; G824-S827 WeakPolarHBondContact O-CA 3.32Å; G824-S827 WeakPolarHBondContact O-CB 3.48Å; G824-S827 PolarHBondContact O-N 3.29Å; L825-S827 VanDerWaalsContact C-N 3.28Å; L825-S827 PolarHBondContact O-N 2.68Å; S827-L830 PolarHBondContact O-N 2.83Å; S827-S831 PolarHBondContact O-N 2.87Å
828	E	96.3	Very high	94.7	Very high	85 Å²	85	43.7 Å²	43.7	40%	0.397	25%	0.247	S	C	.	.	H	α-helix	trans	-66.4	-42.6	177.4	-72	163.7	-164.6	0	0	111.6	Q777 L780 G824 L825 S831 F832	Q777-E828 WeakPolarHBondContact CG-OE2 3.3Å; Q777-E828 PolarHBondContact NE2-OE2 3.41Å; L780-E828 HydrophobicContact CD1-CB 4.26Å; G824-E828 WeakPolarHBondContact O-CG 3.41Å; G824-E828 PolarHBondContact O-N 3.35Å; L825-E828 PolarHBondContact O-N 2.98Å; E828-S831 PolarHBondContact O-N 2.84Å; E828-F832 PolarHBondContact O-N 3Å
829	L	97	Very high	94.4	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-63.1	-39.9	172.5	-68.7	171.4	0	0	0	111.9	L780 F792 L795 L799 L825 F832 V833 F872 L875	L780-L829 HydrophobicContact CD1-CD2 4.11Å; F792-L829 HydrophobicContact CD2-CD2 3.52Å; F792-L829 HydrophobicContact CE2-CB 4.29Å; F792-L829 HydrophobicContact CE2-CD2 3.78Å; F792-L829 HydrophobicContact CG-CD2 4.49Å; L795-L829 HydrophobicContact CB-CD2 4.12Å; L795-L829 HydrophobicContact CD1-CD2 4.11Å; L799-L829 HydrophobicContact CD1-CD1 3.64Å; L825-L829 HydrophobicContact CD1-CD1 4.08Å; L825-L829 HydrophobicContact CD1-CG 4.02Å; L825-L829 HydrophobicContact CG-CD1 4.13Å; L825-L829 WeakPolarHBondContact O-CB 3.48Å; L825-L829 VanDerWaalsContact O-CG 3.28Å; L825-L829 WeakPolarHBondContact O-CG 3.46Å; L825-L829 PolarHBondContact O-N 3.48Å; L829-F832 PolarHBondContact O-N 2.95Å; L829-V833 WeakPolarHBondContact O-CG2 3.13Å; L829-V833 PolarHBondContact O-N 3.29Å; L829-F872 HydrophobicContact CB-CD2 3.92Å; L829-F872 HydrophobicContact CB-CE2 3.67Å; L829-L875 HydrophobicContact CD1-CD1 4.24Å
830	L	96.1	Very high	93.4	Very high	30 Å²	30	47 Å²	47	16%	0.157	27%	0.266	C	S	.	.	H	α-helix	trans	-66.4	-41.2	175.7	-175.1	64.3	0	0	0	111.9	Q826 S827 V833 M834 F872 A885	Q826-L830 WeakPolarHBondContact O-CB 3.28Å; Q826-L830 PolarHBondContact O-N 2.89Å; S827-L830 PolarHBondContact O-N 2.83Å; L830-V833 PolarHBondContact O-N 3.41Å; L830-M834 HydrophobicContact CD1-CE 3.83Å; L830-M834 WeakPolarHBondContact O-CG 3.23Å; L830-M834 PolarHBondContact O-N 3.12Å; L830-M834 VanDerWaalsContact O-N 3.1Å; L830-F872 HydrophobicContact CB-CE2 4.45Å; L830-F872 HydrophobicContact CB-CZ 3.93Å; L830-F872 HydrophobicContact CD1-CE1 3.7Å; L830-F872 HydrophobicContact CD1-CZ 3.79Å; L830-F872 HydrophobicContact CG-CZ 4.45Å; L830-A885 HydrophobicContact CD1-CB 4.47Å; L830-A885 HydrophobicContact CD2-CB 4.15Å
831	S	95.8	Very high	92	Very high	57 Å²	57	45.9 Å²	45.9	40%	0.399	26%	0.257	S	S	.	.	H	α-helix	trans	-58.1	-50	174.6	-163.6	0	0	0	0	110.4	S827 E828 V833 M834 D835	S827-S831 PolarHBondContact O-N 2.87Å; E828-S831 PolarHBondContact O-N 2.84Å; S831-V833 VanDerWaalsContact C-N 3.25Å; S831-V833 PolarHBondContact O-N 3.48Å; S831-M834 WeakPolarHBondContact O-CA 3.38Å; S831-M834 WeakPolarHBondContact O-CB 3.32Å; S831-M834 PolarHBondContact O-N 2.92Å; S831-D835 VanDerWaalsContact C-OD2 3.3Å; S831-D835 WeakPolarHBondContact O-CB 3.43Å; S831-D835 PolarHBondContact O-N 3.07Å; S831-D835 PolarHBondContact OG-OD2 3.49Å
832	F	96	Very high	90.2	Very high	9 Å²	9	51.3 Å²	51.3	4%	0.039	29%	0.285	C	S	.	.	H	α-helix	trans	-54.5	-41.1	178.2	178.9	-83.3	0	0	0	112.4	K788 E789 F792 E828 L829 D835 H836 L868	K788-F832 HydrophobicContact CB-CD2 4.29Å; K788-F832 HydrophobicContact CB-CE2 3.72Å; K788-F832 HydrophobicContact CD-CD2 4.49Å; K788-F832 HydrophobicContact CD-CE2 4.34Å; E789-F832 HydrophobicContact CB-CZ 4.49Å; E789-F832 HydrophobicContact CG-CZ 3.95Å; F792-F832 HydrophobicContact CB-CD1 4.07Å; F792-F832 HydrophobicContact CB-CD2 4.5Å; F792-F832 HydrophobicContact CB-CE1 3.91Å; F792-F832 HydrophobicContact CB-CE2 4.37Å; F792-F832 HydrophobicContact CB-CG 4.36Å; F792-F832 HydrophobicContact CB-CZ 4.07Å; F792-F832 AromaticContact CD1-CD1 3.86Å; F792-F832 HydrophobicContact CD1-CD1 3.86Å; F792-F832 AromaticContact CD1-CE1 3.6Å; F792-F832 HydrophobicContact CD1-CE1 3.6Å; F792-F832 HydrophobicContact CD1-CZ 4.44Å; F792-F832 HydrophobicContact CD2-CB 3.93Å; F792-F832 AromaticContact CD2-CD1 3.14Å; F792-F832 HydrophobicContact CD2-CD1 3.14Å; F792-F832 HydrophobicContact CD2-CD2 4.47Å; F792-F832 AromaticContact CD2-CE1 3.75Å; F792-F832 HydrophobicContact CD2-CE1 3.75Å; F792-F832 AromaticContact CD2-CG 3.58Å; F792-F832 HydrophobicContact CD2-CG 3.58Å; F792-F832 HydrophobicContact CE1-CD1 4.03Å; F792-F832 AromaticContact CE1-CE1 3.97Å; F792-F832 HydrophobicContact CE1-CE1 3.97Å; F792-F832 HydrophobicContact CE2-CB 4.13Å; F792-F832 AromaticContact CE2-CD1 3.35Å; F792-F832 HydrophobicContact CE2-CD1 3.35Å; F792-F832 HydrophobicContact CE2-CE1 4.11Å; F792-F832 HydrophobicContact CE2-CG 4.03Å; F792-F832 AromaticContact CG-CD1 3.41Å; F792-F832 HydrophobicContact CG-CD1 3.41Å; F792-F832 VanDerWaalsContact CG-CD1 3.41Å; F792-F832 AromaticContact CG-CE1 3.46Å; F792-F832 HydrophobicContact CG-CE1 3.46Å; F792-F832 VanDerWaalsContact CG-CE1 3.46Å; F792-F832 HydrophobicContact CG-CG 4.04Å; F792-F832 HydrophobicContact CG-CZ 4.14Å; F792-F832 AromaticContact CZ-CD1 3.77Å; F792-F832 HydrophobicContact CZ-CD1 3.77Å; F792-F832 HydrophobicContact CZ-CE1 4.18Å; E828-F832 PolarHBondContact O-N 3Å; L829-F832 PolarHBondContact O-N 2.95Å; F832-D835 PolarHBondContact O-N 3.28Å; F832-H836 HydrophobicContact CD1-CB 4.47Å; F832-H836 AromaticContact CD2-CD2 3.39Å; F832-H836 WeakPolarHBondContact CD2-CD2 3.38Å; F832-H836 AromaticContact CD2-NE2 3.92Å; F832-H836 HydrophobicContact CE1-CB 4.04Å; F832-H836 HydrophobicContact CE2-CB 4.2Å; F832-H836 AromaticContact CE2-CD2 3.32Å; F832-H836 WeakPolarHBondContact CE2-CD2 3.45Å; F832-H836 AromaticContact CE2-CG 3.67Å; F832-H836 AromaticContact CE2-NE2 3.72Å; F832-H836 HydrophobicContact CZ-CB 3.89Å; F832-H836 AromaticContact CZ-CD2 3.94Å; F832-H836 AromaticContact CZ-CG 3.84Å; F832-H836 WeakPolarHBondContact O-CB 3.34Å; F832-H836 PolarHBondContact O-N 3.21Å; F832-L868 HydrophobicContact CE1-CD1 4.06Å; F832-L868 HydrophobicContact CE1-CD2 4.06Å; F832-L868 HydrophobicContact CE1-CG 4.48Å; F832-L868 HydrophobicContact CZ-CD1 4.28Å; F832-L868 HydrophobicContact CZ-CD2 4.42Å
833	V	96.7	Very high	88.4	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-63.7	-42.4	175	174.6	0	0	0	0	111.7	F792 L829 L830 S831 V837 F838 L869 F872	F792-V833 HydrophobicContact CE2-CG2 3.95Å; F792-V833 HydrophobicContact CZ-CG2 3.6Å; L829-V833 WeakPolarHBondContact O-CG2 3.13Å; L829-V833 PolarHBondContact O-N 3.29Å; L830-V833 PolarHBondContact O-N 3.41Å; S831-V833 VanDerWaalsContact C-N 3.25Å; S831-V833 PolarHBondContact O-N 3.48Å; V833-V837 HydrophobicContact CG1-CB 4.3Å; V833-V837 HydrophobicContact CG1-CG2 4.16Å; V833-V837 WeakPolarHBondContact O-CB 3.24Å; V833-V837 PolarHBondContact O-N 2.82Å; V833-F838 HydrophobicContact CG1-CD2 4.28Å; V833-F838 HydrophobicContact CG1-CE2 3.83Å; V833-L869 HydrophobicContact CG1-CD1 3.81Å; V833-F872 HydrophobicContact CG2-CB 3.77Å; V833-F872 HydrophobicContact CG2-CD1 4.17Å; V833-F872 HydrophobicContact CG2-CD2 4.28Å; V833-F872 HydrophobicContact CG2-CG 3.83Å
834	M	94.8	Very high	86.5	Confident	43 Å²	43	50.3 Å²	50.3	21%	0.212	27%	0.269	C	S	.	.	H	α-helix	trans	-63.4	-46.4	175.5	-60.9	-59.4	125.1	0	0	111.6	L830 S831 F838 D888 I889	L830-M834 HydrophobicContact CD1-CE 3.83Å; L830-M834 WeakPolarHBondContact O-CG 3.23Å; L830-M834 PolarHBondContact O-N 3.12Å; L830-M834 VanDerWaalsContact O-N 3.1Å; S831-M834 WeakPolarHBondContact O-CA 3.38Å; S831-M834 WeakPolarHBondContact O-CB 3.32Å; S831-M834 PolarHBondContact O-N 2.92Å; M834-F838 HydrophobicContact CE-CD2 3.89Å; M834-F838 HydrophobicContact CE-CE2 3.8Å; M834-F838 HydrophobicContact SD-CD2 3.88Å; M834-F838 HydrophobicContact SD-CE2 4.36Å; M834-D888 HydrophobicContact CE-CB 3.78Å; M834-D888 HydrophobicContact SD-CB 4.17Å; M834-I889 HydrophobicContact CE-CG1 4.06Å
835	D	92.9	Very high	84.4	Confident	99 Å²	99	53.4 Å²	53.4	53%	0.529	28%	0.279	S	S	.	.	H	α-helix	trans	-72.4	-31.7	-173.5	-60.2	-40.1	0	0	0	113.3	S831 F832	S831-D835 VanDerWaalsContact C-OD2 3.3Å; S831-D835 WeakPolarHBondContact O-CB 3.43Å; S831-D835 PolarHBondContact O-N 3.07Å; S831-D835 PolarHBondContact OG-OD2 3.49Å; F832-D835 PolarHBondContact O-N 3.28Å
836	H	91.4	Very high	82.3	Confident	30 Å²	30	59.7 Å²	59.7	14%	0.139	31%	0.308	C	S	.	.	H	α-helix	trans	-115.8	-11.6	-172.8	-70.1	-90.2	0	0	0	115.4	K788 F832 R865	K788-H836 PolarHBondContact NZ-NE2 3.17Å; F832-H836 HydrophobicContact CD1-CB 4.47Å; F832-H836 AromaticContact CD2-CD2 3.39Å; F832-H836 WeakPolarHBondContact CD2-CD2 3.38Å; F832-H836 AromaticContact CD2-NE2 3.92Å; F832-H836 HydrophobicContact CE1-CB 4.04Å; F832-H836 HydrophobicContact CE2-CB 4.2Å; F832-H836 AromaticContact CE2-CD2 3.32Å; F832-H836 WeakPolarHBondContact CE2-CD2 3.45Å; F832-H836 AromaticContact CE2-CG 3.67Å; F832-H836 AromaticContact CE2-NE2 3.72Å; F832-H836 HydrophobicContact CZ-CB 3.89Å; F832-H836 AromaticContact CZ-CD2 3.94Å; F832-H836 AromaticContact CZ-CG 3.84Å; F832-H836 WeakPolarHBondContact O-CB 3.34Å; F832-H836 PolarHBondContact O-N 3.21Å; H836-R865 WeakPolarHBondContact O-CD 3.19Å; H836-R865 WeakPolarHBondContact O-CG 3.46Å
837	V	93.7	Very high	80.1	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.7	-49.8	176.2	-178.3	0	0	0	0	111.9	V833 I839 L868 L869 Y900	V833-V837 HydrophobicContact CG1-CB 4.3Å; V833-V837 HydrophobicContact CG1-CG2 4.16Å; V833-V837 WeakPolarHBondContact O-CB 3.24Å; V833-V837 PolarHBondContact O-N 2.82Å; V837-I839 VanDerWaalsContact C-N 3.3Å; V837-I839 PolarHBondContact O-N 2.88Å; V837-I839 VanDerWaalsContact O-N 3.13Å; V837-L868 HydrophobicContact CG2-CB 4.07Å; V837-L869 HydrophobicContact CG1-CB 4.06Å; V837-L869 HydrophobicContact CG1-CD1 4.49Å; V837-L869 HydrophobicContact CG1-CD2 4.31Å; V837-L869 HydrophobicContact CG2-CB 4.43Å; V837-Y900 HydrophobicContact CG1-CD1 4.45Å; V837-Y900 HydrophobicContact CG1-CD2 4.11Å; V837-Y900 HydrophobicContact CG1-CE1 3.94Å; V837-Y900 HydrophobicContact CG1-CE2 3.55Å; V837-Y900 VanDerWaalsContact CG1-CZ 3.47Å; V837-Y900 PolarHBondContact O-OH 2.9Å; V837-Y900 VanDerWaalsContact O-OH 3.09Å
838	F	93	Very high	78	Confident	16 Å²	16	64 Å²	64	7%	0.07	33%	0.332	C	S	.	.	S	Bend	trans	-92.2	49.3	-170	-62.3	-63.5	0	0	0	113.7	V833 M834 L869 I889 H892 Y896 Y900 I904	V833-F838 HydrophobicContact CG1-CD2 4.28Å; V833-F838 HydrophobicContact CG1-CE2 3.83Å; M834-F838 HydrophobicContact CE-CD2 3.89Å; M834-F838 HydrophobicContact CE-CE2 3.8Å; M834-F838 HydrophobicContact SD-CD2 3.88Å; M834-F838 HydrophobicContact SD-CE2 4.36Å; F838-L869 HydrophobicContact CE2-CD1 4.17Å; F838-L869 HydrophobicContact CZ-CD1 3.86Å; F838-L869 HydrophobicContact CZ-CD2 4.22Å; F838-I889 HydrophobicContact CE2-CG1 4.27Å; F838-I889 HydrophobicContact CZ-CG2 4.36Å; F838-H892 HydrophobicContact CD1-CB 3.76Å; F838-H892 AromaticContact CD1-CD2 3.88Å; F838-H892 AromaticContact CD1-CG 3.8Å; F838-H892 AromaticContact CD2-CD2 3.55Å; F838-H892 HydrophobicContact CE1-CB 3.54Å; F838-H892 AromaticContact CE2-CD2 3.79Å; F838-H892 HydrophobicContact CG-CB 4.39Å; F838-H892 AromaticContact CG-CD2 3.6Å; F838-H892 AromaticContact CG-CG 3.95Å; F838-H892 HydrophobicContact CZ-CB 4.01Å; F838-Y896 HydrophobicContact CB-CE2 4.06Å; F838-Y896 AromaticContact CD1-CD2 3.62Å; F838-Y896 HydrophobicContact CD1-CD2 3.62Å; F838-Y896 AromaticContact CD1-CE2 3.79Å; F838-Y896 HydrophobicContact CD1-CE2 3.79Å; F838-Y896 HydrophobicContact CD1-CG 4.17Å; F838-Y896 HydrophobicContact CE1-CD2 4.25Å; F838-Y896 HydrophobicContact CG-CE2 4.38Å; F838-Y896 PolarHBondContact O-OH 3.38Å; F838-Y896 VanDerWaalsContact O-OH 3.05Å; F838-Y900 AromaticContact CD1-CD2 3.95Å; F838-Y900 HydrophobicContact CD1-CD2 3.95Å; F838-Y900 HydrophobicContact CD1-CE2 4.06Å; F838-Y900 AromaticContact CE1-CD2 3.64Å; F838-Y900 HydrophobicContact CE1-CD2 3.64Å; F838-Y900 HydrophobicContact CE1-CE2 4.17Å; F838-Y900 HydrophobicContact CE1-CG 4.49Å; F838-I904 HydrophobicContact CE1-CD1 4.22Å; F838-I904 HydrophobicContact CZ-CD1 4.36Å
839	I	87.8	Confident	75.4	Confident	61 Å²	61	68.2 Å²	68.2	31%	0.313	35%	0.351	S	S	.	.			trans	-73.3	151.3	179.7	-55	170	0	0	0	110.6	V837 Y896	V837-I839 VanDerWaalsContact C-N 3.3Å; V837-I839 PolarHBondContact O-N 2.88Å; V837-I839 VanDerWaalsContact O-N 3.13Å; I839-Y896 WeakPolarHBondContact O-CE1 3.33Å; I839-Y896 VanDerWaalsContact O-CZ 3.31Å; I839-Y896 PolarHBondContact O-OH 2.87Å
840	D	75.4	Confident	73	Confident	74 Å²	74	71.1 Å²	71.1	40%	0.396	38%	0.382	S	S	.	.			trans	-82	135.1	178.6	-102.5	-52.2	0	0	0	113.6	D842 E843 E844 K895	D840-D842 PolarHBondContact O-N 2.89Å; D840-E843 HydrophobicContact CB-CG 4.39Å; D840-E843 PolarHBondContact O-N 3.41Å; D840-E844 PolarHBondContact O-N 3.37Å; D840-E844 VanDerWaalsContact O-N 3.16Å; D840-K895 WeakPolarHBondContact OD1-CE 3.23Å; D840-K895 IonicContact OD1-NZ 2.84Å; D840-K895 PolarHBondContact OD1-NZ 3Å; D840-K895 IonicContact OD2-NZ 3.86Å; D840-K895 PolarHBondContact OD2-NZ 2.68Å
841	Q	63.6	Low	70.5	Confident	91 Å²	91	75.5 Å²	75.5	43%	0.425	41%	0.405	S	S	.	.	H	α-helix	trans	-64.9	-25.1	-171.7	-69.2	178	-13.9	0	0	113	N845 D899	Q841-N845 PolarHBondContact O-N 2.89Å; Q841-N845 PolarHBondContact O-ND2 3.34Å; Q841-D899 PolarHBondContact NE2-OD2 3.24Å
842	D	57.3	Low	68.3	Low	122 Å²	122	82.6 Å²	82.6	65%	0.652	43%	0.432	S	S	*	.	H	α-helix	trans	-76.7	-27.1	176	-66.1	-39.1	0	0	0	112.7	D840 Q846	D840-D842 PolarHBondContact O-N 2.89Å; D842-Q846 WeakPolarHBondContact O-CG 3.39Å; D842-Q846 PolarHBondContact O-N 2.95Å; D842-Q846 PolarHBondContact O-NE2 3.25Å
843	E	54.2	Low	66	Low	127 Å²	127	90.7 Å²	90.7	59%	0.593	47%	0.47	S	S	*	.	H	α-helix	trans	-76.6	-37.9	173	-58.8	-171.3	138.2	0	0	110.8	D840 N845 Q846 S847	D840-E843 HydrophobicContact CB-CG 4.39Å; D840-E843 PolarHBondContact O-N 3.41Å; E843-N845 VanDerWaalsContact C-N 3.33Å; E843-N845 PolarHBondContact O-N 3.42Å; E843-Q846 PolarHBondContact O-N 3.41Å; E843-S847 PolarHBondContact O-N 3.14Å
844	E	53	Low	64.4	Low	68 Å²	68	92.8 Å²	92.8	32%	0.318	48%	0.481	S	S	.	.	H	α-helix	trans	-57	-46	175	-165.5	170.6	-108.1	0	0	111	D840 S847 R865	D840-E844 PolarHBondContact O-N 3.37Å; D840-E844 VanDerWaalsContact O-N 3.16Å; E844-S847 PolarHBondContact O-N 2.9Å; E844-S847 PolarHBondContact O-OG 2.68Å; E844-R865 IonicContact OE1-CZ 2.74Å; E844-R865 IonicContact OE1-NH1 2.74Å; E844-R865 PolarHBondContact OE1-NH1 3.19Å; E844-R865 IonicContact OE1-NH2 2.7Å; E844-R865 PolarHBondContact OE1-NH2 3.44Å
845	N	51.7	Low	63.2	Low	92 Å²	92	95.1 Å²	95.1	49%	0.492	49%	0.491	S	S	.	.	H	α-helix	trans	-66.5	-41	175.3	-72.4	-60.3	0	0	0	113.1	Q841 E843 S847 M848 E849	Q841-N845 PolarHBondContact O-N 2.89Å; Q841-N845 PolarHBondContact O-ND2 3.34Å; E843-N845 VanDerWaalsContact C-N 3.33Å; E843-N845 PolarHBondContact O-N 3.42Å; N845-S847 VanDerWaalsContact C-N 3.29Å; N845-S847 PolarHBondContact O-N 3.37Å; N845-M848 CarbonylContact O-C 3.42Å; N845-M848 PolarHBondContact O-N 2.82Å; N845-M848 VanDerWaalsContact O-N 3.15Å; N845-E849 PolarHBondContact O-N 3.39Å
846	Q	50.3	Low	62.2	Low	134 Å²	134	93.6 Å²	93.6	63%	0.626	49%	0.493	S	S	*	.	H	α-helix	trans	-66	-27.9	179.6	-80.3	169.1	84.8	0	0	113.6	D842 E843 M848	D842-Q846 WeakPolarHBondContact O-CG 3.39Å; D842-Q846 PolarHBondContact O-N 2.95Å; D842-Q846 PolarHBondContact O-NE2 3.25Å; E843-Q846 PolarHBondContact O-N 3.41Å; Q846-M848 PolarHBondContact O-N 2.95Å
847	S	50.8	Low	61.4	Low	93 Å²	93	96.1 Å²	96.1	65%	0.65	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-11.6	175.7	65.1	0	0	0	0	114.2	E843 E844 N845	E843-S847 PolarHBondContact O-N 3.14Å; E844-S847 PolarHBondContact O-N 2.9Å; E844-S847 PolarHBondContact O-OG 2.68Å; N845-S847 VanDerWaalsContact C-N 3.29Å; N845-S847 PolarHBondContact O-N 3.37Å
848	M	51.2	Low	60.7	Low	114 Å²	114	100.5 Å²	100.5	56%	0.562	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-128.1	30.4	-174.8	-71.3	-72.1	-163	0	0	112.5	N845 Q846 G850	N845-M848 CarbonylContact O-C 3.42Å; N845-M848 PolarHBondContact O-N 2.82Å; N845-M848 VanDerWaalsContact O-N 3.15Å; Q846-M848 PolarHBondContact O-N 2.95Å; M848-G850 PolarHBondContact O-N 3.09Å
849	E	41.8	Very low	60	Low	172 Å²	172	102.6 Å²	102.6	80%	0.804	54%	0.538	S	S	*	.			trans	-72.6	71	170.4	-71.8	-166.3	164.3	0	0	111.4	N845	N845-E849 PolarHBondContact O-N 3.39Å
850	G	45.1	Very low	59.5	Low	62 Å²	62	105.7 Å²	105.7	64%	0.639	55%	0.551	S	S	*	*	S	Bend	trans	-135.6	-74.3	175.4	0	0	0	0	0	111.4	M848	M848-G850 PolarHBondContact O-N 3.09Å
851	D	43.8	Very low	59.9	Low	122 Å²	122	104.3 Å²	104.3	65%	0.652	55%	0.549	S	S	*	.			trans	-124.6	141.5	-162.7	-56.8	-70.2	0	0	0	113.1	E853	D851-E853 PolarHBondContact O-N 3.43Å
852	E	49.3	Very low	61	Low	206 Å²	206	100.8 Å²	100.8	96%	0.963	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-5.7	175.5	-66.1	-171.2	137.3	0	0	112.8	D854	E852-D854 VanDerWaalsContact C-N 3.26Å; E852-D854 PolarHBondContact O-N 3.23Å
853	E	48.8	Very low	62.3	Low	179 Å²	179	98.3 Å²	98.3	84%	0.836	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-13.2	-167.8	-59.3	-169.3	139	0	0	114.3	D851	D851-E853 PolarHBondContact O-N 3.43Å
854	D	62.7	Low	63.9	Low	43 Å²	43	97 Å²	97	23%	0.23	51%	0.51	C	S	.	.			trans	-115.2	63.9	-155.2	-147.1	165.1	0	0	0	115.8	E852 A856 N857 K858	E852-D854 VanDerWaalsContact C-N 3.26Å; E852-D854 PolarHBondContact O-N 3.23Å; D854-A856 VanDerWaalsContact C-N 3.27Å; D854-N857 WeakPolarHBondContact OD1-CB 3.33Å; D854-N857 PolarHBondContact OD1-ND2 2.96Å; D854-N857 WeakPolarHBondContact OD2-CA 3.49Å; D854-N857 WeakPolarHBondContact OD2-CB 3.29Å; D854-N857 VanDerWaalsContact OD2-CG 3.29Å; D854-N857 PolarHBondContact OD2-N 3.27Å; D854-N857 PolarHBondContact OD2-ND2 3.4Å; D854-K858 WeakPolarHBondContact O-CD 3.28Å; D854-K858 WeakPolarHBondContact O-CE 3.24Å; D854-K858 VanDerWaalsContact O-CG 3.24Å; D854-K858 WeakPolarHBondContact O-CG 3.43Å
855	E	70	Confident	65.8	Low	92 Å²	92	95.1 Å²	95.1	43%	0.43	50%	0.5	S	S	.	.	S	Bend	trans	-73.1	-21	158	-87.6	-145.2	-144.4	0	0	111.8	I859 N1229 R1233	E855-I859 WeakPolarHBondContact O-CD1 3.47Å; E855-I859 VanDerWaalsContact O-CG1 3.28Å; E855-I859 WeakPolarHBondContact O-CG1 3.3Å; E855-I859 PolarHBondContact O-N 3.46Å; E855-I859 VanDerWaalsContact O-N 3.09Å; E855-N1229 PolarHBondContact OE1-ND2 2.87Å; E855-N1229 VanDerWaalsContact OE1-ND2 3.16Å; E855-R1233 IonicContact OE2-CZ 2.7Å; E855-R1233 IonicContact OE2-NE 3.16Å; E855-R1233 IonicContact OE2-NH2 3.36Å; E855-R1233 PolarHBondContact OE2-NH2 3.34Å
856	A	71.1	Confident	67.8	Low	68 Å²	68	90.9 Å²	90.9	56%	0.562	48%	0.477	S	S	*	.	H	α-helix	trans	-69.8	-59.3	-175.3	0	0	0	0	0	112.9	D854 K858 I859 E860	D854-A856 VanDerWaalsContact C-N 3.27Å; A856-K858 PolarHBondContact O-N 3.39Å; A856-I859 CarbonylContact O-C 3.58Å; A856-I859 WeakPolarHBondContact O-CA 3.3Å; A856-I859 WeakPolarHBondContact O-CB 3.3Å; A856-I859 PolarHBondContact O-N 2.9Å; A856-E860 PolarHBondContact O-N 2.9Å
857	N	74.9	Confident	69.8	Low	83 Å²	83	86.7 Å²	86.7	44%	0.444	46%	0.459	S	S	.	.	H	α-helix	trans	-68.2	-24.2	179	-59.7	-33.5	0	0	0	111.4	D854 E860 A861	D854-N857 WeakPolarHBondContact OD1-CB 3.33Å; D854-N857 PolarHBondContact OD1-ND2 2.96Å; D854-N857 WeakPolarHBondContact OD2-CA 3.49Å; D854-N857 WeakPolarHBondContact OD2-CB 3.29Å; D854-N857 VanDerWaalsContact OD2-CG 3.29Å; D854-N857 PolarHBondContact OD2-N 3.27Å; D854-N857 PolarHBondContact OD2-ND2 3.4Å; N857-E860 PolarHBondContact O-N 3.02Å; N857-A861 WeakPolarHBondContact O-CB 3.42Å; N857-A861 PolarHBondContact O-N 3.35Å
858	K	79.3	Confident	71.9	Confident	92 Å²	92	82.5 Å²	82.5	40%	0.4	43%	0.429	S	S	.	.	H	α-helix	trans	-65.8	-35.7	168.3	-71.6	176.3	-167.5	163.6	0	112.2	D854 A856 L862	D854-K858 WeakPolarHBondContact O-CD 3.28Å; D854-K858 WeakPolarHBondContact O-CE 3.24Å; D854-K858 VanDerWaalsContact O-CG 3.24Å; D854-K858 WeakPolarHBondContact O-CG 3.43Å; A856-K858 PolarHBondContact O-N 3.39Å; K858-L862 VanDerWaalsContact O-CB 3.29Å; K858-L862 WeakPolarHBondContact O-CB 3.27Å; K858-L862 PolarHBondContact O-N 3.25Å
859	I	77.4	Confident	74.1	Confident	60 Å²	60	77 Å²	77	31%	0.308	40%	0.403	S	S	.	.	H	α-helix	trans	-72.1	-42.3	171.9	-71.9	165.9	0	0	0	110.8	E855 A856 L862 H863	E855-I859 WeakPolarHBondContact O-CD1 3.47Å; E855-I859 VanDerWaalsContact O-CG1 3.28Å; E855-I859 WeakPolarHBondContact O-CG1 3.3Å; E855-I859 PolarHBondContact O-N 3.46Å; E855-I859 VanDerWaalsContact O-N 3.09Å; A856-I859 CarbonylContact O-C 3.58Å; A856-I859 WeakPolarHBondContact O-CA 3.3Å; A856-I859 WeakPolarHBondContact O-CB 3.3Å; A856-I859 PolarHBondContact O-N 2.9Å; I859-L862 WeakPolarHBondContact O-CB 3.27Å; I859-L862 PolarHBondContact O-N 3.18Å; I859-H863 PolarHBondContact O-CD2 3.06Å; I859-H863 VanDerWaalsContact O-CD2 3.24Å; I859-H863 PolarHBondContact O-N 2.65Å
860	E	77.9	Confident	76.7	Confident	126 Å²	126	68.9 Å²	68.9	59%	0.589	36%	0.364	S	S	*	.	H	α-helix	trans	-62.8	-50.5	177.6	-161.8	-155.3	137.7	0	0	112	A856 N857 L862 H863 K864	A856-E860 PolarHBondContact O-N 2.9Å; N857-E860 PolarHBondContact O-N 3.02Å; E860-L862 PolarHBondContact O-N 3.32Å; E860-H863 WeakPolarHBondContact O-CA 3.25Å; E860-H863 WeakPolarHBondContact O-CB 3.36Å; E860-H863 PolarHBondContact O-N 3.04Å; E860-K864 PolarHBondContact O-N 3.35Å
861	A	84.6	Confident	79.1	Confident	44 Å²	44	66 Å²	66	36%	0.364	34%	0.335	S	S	.	.	H	α-helix	trans	-61.8	-28.4	176.7	0	0	0	0	0	112.7	N857 R865	N857-A861 WeakPolarHBondContact O-CB 3.42Å; N857-A861 PolarHBondContact O-N 3.35Å; A861-R865 WeakPolarHBondContact O-CG 3.34Å; A861-R865 PolarHBondContact O-N 3.18Å; A861-R865 PolarHBondContact O-NE 3.2Å
862	L	85.6	Confident	81.6	Confident	17 Å²	17	60.2 Å²	60.2	9%	0.089	30%	0.304	C	S	.	.	H	α-helix	trans	-71.6	-46.2	168.9	174.1	58.2	0	0	0	111.6	K858 I859 E860 K864 R865 R866 D899 Y900	K858-L862 VanDerWaalsContact O-CB 3.29Å; K858-L862 WeakPolarHBondContact O-CB 3.27Å; K858-L862 PolarHBondContact O-N 3.25Å; I859-L862 WeakPolarHBondContact O-CB 3.27Å; I859-L862 PolarHBondContact O-N 3.18Å; E860-L862 PolarHBondContact O-N 3.32Å; L862-K864 VanDerWaalsContact C-N 3.33Å; L862-K864 PolarHBondContact O-N 2.87Å; L862-R865 PolarHBondContact O-N 3.22Å; L862-R866 HydrophobicContact CD1-CG 4.04Å; L862-R866 HydrophobicContact CG-CG 4.41Å; L862-R866 WeakPolarHBondContact O-CB 3.41Å; L862-R866 VanDerWaalsContact O-CG 3.28Å; L862-R866 WeakPolarHBondContact O-CG 3.33Å; L862-R866 PolarHBondContact O-N 2.65Å; L862-D899 HydrophobicContact CD1-CB 3.75Å; L862-Y900 HydrophobicContact CD1-CE1 3.8Å
863	H	85	Confident	83.9	Confident	71 Å²	71	50.4 Å²	50.4	33%	0.329	26%	0.258	S	S	.	.	H	α-helix	trans	-59	-43.3	177.2	-84.6	-136.2	0	0	0	111.8	I859 E860 R866 N867	I859-H863 PolarHBondContact O-CD2 3.06Å; I859-H863 VanDerWaalsContact O-CD2 3.24Å; I859-H863 PolarHBondContact O-N 2.65Å; E860-H863 WeakPolarHBondContact O-CA 3.25Å; E860-H863 WeakPolarHBondContact O-CB 3.36Å; E860-H863 PolarHBondContact O-N 3.04Å; H863-R866 WeakPolarHBondContact O-CB 3.45Å; H863-R866 PolarHBondContact O-N 2.67Å; H863-N867 PolarHBondContact O-N 3.22Å
864	K	88.1	Confident	86.2	Confident	98 Å²	98	44.1 Å²	44.1	43%	0.426	23%	0.228	S	C	.	.	H	α-helix	trans	-56.7	-51.7	174.3	-166.3	-177.6	-174.1	-160.8	0	112	E789 E860 L862 R866 N867 L868	E789-K864 WeakPolarHBondContact OE1-CE 3.46Å; E789-K864 IonicContact OE1-NZ 3.76Å; E789-K864 PolarHBondContact OE1-NZ 2.85Å; E789-K864 WeakPolarHBondContact OE2-CE 3.28Å; E789-K864 IonicContact OE2-NZ 3.83Å; E789-K864 PolarHBondContact OE2-NZ 3.43Å; E860-K864 PolarHBondContact O-N 3.35Å; L862-K864 VanDerWaalsContact C-N 3.33Å; L862-K864 PolarHBondContact O-N 2.87Å; K864-R866 VanDerWaalsContact C-N 3.34Å; K864-R866 PolarHBondContact O-N 3.03Å; K864-N867 WeakPolarHBondContact O-CB 3.42Å; K864-N867 PolarHBondContact O-N 2.71Å; K864-N867 VanDerWaalsContact O-N 3.15Å; K864-L868 WeakPolarHBondContact O-CG 3.48Å; K864-L868 PolarHBondContact O-N 3.15Å; K864-L868 VanDerWaalsContact O-N 3.07Å
865	R	92.3	Very high	87.8	Confident	29 Å²	29	42 Å²	42	11%	0.109	22%	0.217	C	C	.	.	H	α-helix	trans	-65.3	-33.8	177	-72.4	177.7	-67.8	172.9	-8.4	113.5	H836 E844 A861 L862 N867 L868 L869 Y900	H836-R865 WeakPolarHBondContact O-CD 3.19Å; H836-R865 WeakPolarHBondContact O-CG 3.46Å; E844-R865 IonicContact OE1-CZ 2.74Å; E844-R865 IonicContact OE1-NH1 2.74Å; E844-R865 PolarHBondContact OE1-NH1 3.19Å; E844-R865 IonicContact OE1-NH2 2.7Å; E844-R865 PolarHBondContact OE1-NH2 3.44Å; A861-R865 WeakPolarHBondContact O-CG 3.34Å; A861-R865 PolarHBondContact O-N 3.18Å; A861-R865 PolarHBondContact O-NE 3.2Å; L862-R865 PolarHBondContact O-N 3.22Å; R865-N867 VanDerWaalsContact C-N 3.33Å; R865-L868 PolarHBondContact O-N 3.39Å; R865-L869 PolarHBondContact O-N 2.95Å; R865-Y900 HydrophobicContact CB-CE1 4.25Å; R865-Y900 WeakPolarHBondContact CB-OH 3.43Å
866	R	94.2	Very high	89.1	Confident	4 Å²	4	37.8 Å²	37.8	2%	0.015	20%	0.197	C	C	.	.	H	α-helix	trans	-61.7	-40.6	171.7	-76.3	179.4	67.2	140.9	16.4	111.5	L862 H863 K864 L869 A870 D899 Y900 D902 I903	L862-R866 HydrophobicContact CD1-CG 4.04Å; L862-R866 HydrophobicContact CG-CG 4.41Å; L862-R866 WeakPolarHBondContact O-CB 3.41Å; L862-R866 VanDerWaalsContact O-CG 3.28Å; L862-R866 WeakPolarHBondContact O-CG 3.33Å; L862-R866 PolarHBondContact O-N 2.65Å; H863-R866 WeakPolarHBondContact O-CB 3.45Å; H863-R866 PolarHBondContact O-N 2.67Å; K864-R866 VanDerWaalsContact C-N 3.34Å; K864-R866 PolarHBondContact O-N 3.03Å; R866-L869 PolarHBondContact O-N 3.21Å; R866-A870 WeakPolarHBondContact O-CB 3.41Å; R866-A870 PolarHBondContact O-N 3.32Å; R866-D899 WeakPolarHBondContact CD-O 3.32Å; R866-Y900 HydrophobicContact CG-CD1 3.85Å; R866-Y900 HydrophobicContact CG-CE1 3.87Å; R866-D902 IonicContact CZ-OD1 3.27Å; R866-D902 IonicContact CZ-OD2 2.83Å; R866-D902 IonicContact NH1-OD2 2.83Å; R866-D902 IonicContact NH2-OD1 3.58Å; R866-D902 PolarHBondContact NH2-OD1 3.16Å; R866-D902 IonicContact NH2-OD2 3.25Å; R866-D902 PolarHBondContact NH2-OD2 2.85Å; R866-I903 HydrophobicContact CB-CD1 3.82Å; R866-I903 HydrophobicContact CG-CD1 4.01Å
867	N	92	Very high	90.2	Very high	45 Å²	45	35.4 Å²	35.4	24%	0.241	18%	0.175	C	C	.	.	H	α-helix	trans	-65.9	-46.7	175.5	-161	-3.4	0	0	0	111.4	H863 K864 R865 L869 A870 A871	H863-N867 PolarHBondContact O-N 3.22Å; K864-N867 WeakPolarHBondContact O-CB 3.42Å; K864-N867 PolarHBondContact O-N 2.71Å; K864-N867 VanDerWaalsContact O-N 3.15Å; R865-N867 VanDerWaalsContact C-N 3.33Å; N867-L869 VanDerWaalsContact C-N 3.3Å; N867-L869 PolarHBondContact O-N 2.78Å; N867-A870 PolarHBondContact O-N 2.71Å; N867-A870 VanDerWaalsContact O-N 3.07Å; N867-A871 WeakPolarHBondContact O-CB 3.39Å; N867-A871 PolarHBondContact O-N 2.96Å
868	L	95.5	Very high	91.1	Very high	5 Å²	5	35.4 Å²	35.4	3%	0.026	17%	0.169	C	C	.	.	H	α-helix	trans	-53.9	-45.1	174.5	-62.4	172.5	0	0	0	112.1	F792 M793 F832 V837 K864 R865 F872	F792-L868 HydrophobicContact CD1-CD2 3.63Å; F792-L868 HydrophobicContact CE1-CB 4.08Å; F792-L868 HydrophobicContact CE1-CD2 3.94Å; F792-L868 WeakPolarHBondContact CE1-O 3.39Å; M793-L868 HydrophobicContact CG-CD2 3.92Å; M793-L868 HydrophobicContact SD-CD2 3.83Å; F832-L868 HydrophobicContact CE1-CD1 4.06Å; F832-L868 HydrophobicContact CE1-CD2 4.06Å; F832-L868 HydrophobicContact CE1-CG 4.48Å; F832-L868 HydrophobicContact CZ-CD1 4.28Å; F832-L868 HydrophobicContact CZ-CD2 4.42Å; V837-L868 HydrophobicContact CG2-CB 4.07Å; K864-L868 WeakPolarHBondContact O-CG 3.48Å; K864-L868 PolarHBondContact O-N 3.15Å; K864-L868 VanDerWaalsContact O-N 3.07Å; R865-L868 PolarHBondContact O-N 3.39Å; L868-F872 PolarHBondContact O-N 3.39Å
869	L	97	Very high	91.8	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-67.6	-39.7	176.7	-174.9	62.1	0	0	0	112.7	V833 V837 F838 R865 R866 N867 S873 I889 Y900 I903 I904	V833-L869 HydrophobicContact CG1-CD1 3.81Å; V837-L869 HydrophobicContact CG1-CB 4.06Å; V837-L869 HydrophobicContact CG1-CD1 4.49Å; V837-L869 HydrophobicContact CG1-CD2 4.31Å; V837-L869 HydrophobicContact CG2-CB 4.43Å; F838-L869 HydrophobicContact CE2-CD1 4.17Å; F838-L869 HydrophobicContact CZ-CD1 3.86Å; F838-L869 HydrophobicContact CZ-CD2 4.22Å; R865-L869 PolarHBondContact O-N 2.95Å; R866-L869 PolarHBondContact O-N 3.21Å; N867-L869 VanDerWaalsContact C-N 3.3Å; N867-L869 PolarHBondContact O-N 2.78Å; L869-S873 WeakPolarHBondContact O-CB 3.29Å; L869-S873 PolarHBondContact O-N 2.84Å; L869-S873 PolarHBondContact O-OG 3.29Å; L869-I889 HydrophobicContact CD1-CD1 4.22Å; L869-I889 HydrophobicContact CD1-CG1 4.4Å; L869-I889 HydrophobicContact CD1-CG2 4.25Å; L869-Y900 HydrophobicContact CD2-CD1 3.91Å; L869-Y900 HydrophobicContact CD2-CD2 4.33Å; L869-Y900 HydrophobicContact CD2-CG 3.69Å; L869-I903 HydrophobicContact CD2-CB 4.46Å; L869-I903 HydrophobicContact CD2-CG2 4.07Å; L869-I903 HydrophobicContact CG-CG2 4.06Å; L869-I904 HydrophobicContact CD2-CG1 4.21Å
870	A	95.7	Very high	92.7	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-65.1	-41.6	177.4	0	0	0	0	0	111.5	R866 N867 S873 K874 F1240	R866-A870 WeakPolarHBondContact O-CB 3.41Å; R866-A870 PolarHBondContact O-N 3.32Å; N867-A870 PolarHBondContact O-N 2.71Å; N867-A870 VanDerWaalsContact O-N 3.07Å; A870-S873 WeakPolarHBondContact O-CB 3.32Å; A870-S873 PolarHBondContact O-N 3.34Å; A870-K874 VanDerWaalsContact O-CG 3.31Å; A870-K874 WeakPolarHBondContact O-CG 3.34Å; A870-K874 PolarHBondContact O-N 2.99Å; A870-F1240 HydrophobicContact CB-CB 4.22Å; A870-F1240 HydrophobicContact CB-CD1 4.46Å; A870-F1240 HydrophobicContact CB-CG 4.4Å
871	A	95.4	Very high	93.5	Very high	2 Å²	2	28.2 Å²	28.2	2%	0.017	14%	0.139	C	C	.	.	H	α-helix	trans	-56.8	-51.6	177.2	0	0	0	0	0	112	M793 C796 N867 S873 K874	M793-A871 HydrophobicContact CE-CB 4.11Å; M793-A871 HydrophobicContact SD-CB 3.77Å; C796-A871 HydrophobicContact CB-CB 3.87Å; N867-A871 WeakPolarHBondContact O-CB 3.39Å; N867-A871 PolarHBondContact O-N 2.96Å; A871-S873 PolarHBondContact O-N 2.87Å; A871-K874 WeakPolarHBondContact O-CB 3.47Å; A871-K874 PolarHBondContact O-N 3.4Å
872	F	97.9	Very high	93.9	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-68.6	-34.6	175.6	-173.2	-96.6	0	0	0	112.9	F792 L829 L830 V833 L868 K874 L875 I876 V881 A885 I889	F792-F872 HydrophobicContact CZ-CB 4.02Å; L829-F872 HydrophobicContact CB-CD2 3.92Å; L829-F872 HydrophobicContact CB-CE2 3.67Å; L830-F872 HydrophobicContact CB-CE2 4.45Å; L830-F872 HydrophobicContact CB-CZ 3.93Å; L830-F872 HydrophobicContact CD1-CE1 3.7Å; L830-F872 HydrophobicContact CD1-CZ 3.79Å; L830-F872 HydrophobicContact CG-CZ 4.45Å; V833-F872 HydrophobicContact CG2-CB 3.77Å; V833-F872 HydrophobicContact CG2-CD1 4.17Å; V833-F872 HydrophobicContact CG2-CD2 4.28Å; V833-F872 HydrophobicContact CG2-CG 3.83Å; L868-F872 PolarHBondContact O-N 3.39Å; F872-K874 VanDerWaalsContact C-N 3.29Å; F872-K874 PolarHBondContact O-N 2.69Å; F872-L875 HydrophobicContact CD2-CD1 4.22Å; F872-L875 WeakPolarHBondContact O-CB 3.26Å; F872-L875 PolarHBondContact O-N 3.36Å; F872-L875 VanDerWaalsContact O-N 3.1Å; F872-I876 HydrophobicContact CD1-CD1 3.78Å; F872-I876 HydrophobicContact CE1-CD1 3.55Å; F872-I876 HydrophobicContact CE1-CG1 4.32Å; F872-I876 PolarHBondContact O-N 3.06Å; F872-V881 HydrophobicContact CE2-CG1 4.32Å; F872-V881 HydrophobicContact CE2-CG2 4.28Å; F872-V881 HydrophobicContact CZ-CG1 3.93Å; F872-A885 HydrophobicContact CZ-CB 4.36Å; F872-I889 HydrophobicContact CD1-CD1 3.59Å; F872-I889 HydrophobicContact CE1-CD1 3.73Å
873	S	97.2	Very high	94.4	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-62.5	-34.8	175.3	-64.8	0	0	0	0	112.5	L869 A870 A871 L875 I876 I877 T907	L869-S873 WeakPolarHBondContact O-CB 3.29Å; L869-S873 PolarHBondContact O-N 2.84Å; L869-S873 PolarHBondContact O-OG 3.29Å; A870-S873 WeakPolarHBondContact O-CB 3.32Å; A870-S873 PolarHBondContact O-N 3.34Å; A871-S873 PolarHBondContact O-N 2.87Å; S873-L875 VanDerWaalsContact C-N 3.34Å; S873-I876 PolarHBondContact O-N 3.01Å; S873-I877 VanDerWaalsContact O-CD1 3.31Å; S873-I877 WeakPolarHBondContact O-CD1 3.45Å; S873-I877 WeakPolarHBondContact O-CG1 3.44Å; S873-I877 PolarHBondContact O-N 2.78Å; S873-I877 VanDerWaalsContact O-N 3.09Å; S873-T907 WeakPolarHBondContact CB-OG1 3.34Å; S873-T907 PolarHBondContact OG-OG1 3.19Å
874	K	95.9	Very high	94.8	Very high	47 Å²	47	30 Å²	30	20%	0.204	14%	0.142	C	C	.	.	H	α-helix	trans	-59.1	-44.1	171.6	-68.4	163.1	-172.6	176	0	110.5	A870 A871 F872 I876 I877 Y878	A870-K874 VanDerWaalsContact O-CG 3.31Å; A870-K874 WeakPolarHBondContact O-CG 3.34Å; A870-K874 PolarHBondContact O-N 2.99Å; A871-K874 WeakPolarHBondContact O-CB 3.47Å; A871-K874 PolarHBondContact O-N 3.4Å; F872-K874 VanDerWaalsContact C-N 3.29Å; F872-K874 PolarHBondContact O-N 2.69Å; K874-I876 VanDerWaalsContact C-N 3.3Å; K874-I876 PolarHBondContact O-N 3.36Å; K874-I877 PolarHBondContact O-N 3.24Å; K874-Y878 HydrophobicContact CB-CD2 4.47Å; K874-Y878 WeakPolarHBondContact O-CD2 3.42Å; K874-Y878 PolarHBondContact O-N 3.32Å
875	L	96.9	Very high	95.1	Very high	0 Å²	0	26 Å²	26	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-60.2	-35.2	179.5	-56.9	-178.7	0	0	0	113.9	C796 L799 M800 L829 F872 S873 I880 V881	C796-L875 HydrophobicContact CB-CD1 4.34Å; L799-L875 HydrophobicContact CB-CD2 3.99Å; L799-L875 HydrophobicContact CD1-CD1 4.32Å; M800-L875 HydrophobicContact CB-CD2 4.4Å; L829-L875 HydrophobicContact CD1-CD1 4.24Å; F872-L875 HydrophobicContact CD2-CD1 4.22Å; F872-L875 WeakPolarHBondContact O-CB 3.26Å; F872-L875 PolarHBondContact O-N 3.36Å; F872-L875 VanDerWaalsContact O-N 3.1Å; S873-L875 VanDerWaalsContact C-N 3.34Å; L875-I880 HydrophobicContact CB-CB 4.36Å; L875-I880 HydrophobicContact CD2-CB 4.41Å; L875-I880 HydrophobicContact CD2-CD1 3.91Å; L875-I880 HydrophobicContact CD2-CG2 4.3Å; L875-I880 WeakPolarHBondContact O-CB 3.34Å; L875-I880 PolarHBondContact O-N 3.06Å; L875-V881 HydrophobicContact CB-CB 4.18Å; L875-V881 HydrophobicContact CB-CG2 3.65Å; L875-V881 HydrophobicContact CD1-CG2 3.93Å; L875-V881 HydrophobicContact CG-CG2 4.44Å; L875-V881 PolarHBondContact O-N 3.18Å; L875-V881 VanDerWaalsContact O-N 3.12Å
876	I	96.3	Very high	95.2	Very high	3 Å²	3	24.7 Å²	24.7	2%	0.015	12%	0.123	C	C	.	.	H	α-helix	trans	-70	-43.6	173.1	-73.2	155.5	0	0	0	111.1	F872 S873 K874 Y878 D879 V881 A886 I889 T907 T911	F872-I876 HydrophobicContact CD1-CD1 3.78Å; F872-I876 HydrophobicContact CE1-CD1 3.55Å; F872-I876 HydrophobicContact CE1-CG1 4.32Å; F872-I876 PolarHBondContact O-N 3.06Å; S873-I876 PolarHBondContact O-N 3.01Å; K874-I876 VanDerWaalsContact C-N 3.3Å; K874-I876 PolarHBondContact O-N 3.36Å; I876-Y878 VanDerWaalsContact C-N 3.33Å; I876-Y878 PolarHBondContact O-N 3.1Å; I876-D879 PolarHBondContact O-N 2.91Å; I876-V881 HydrophobicContact CG1-CB 4.36Å; I876-V881 HydrophobicContact CG1-CG1 4.3Å; I876-A886 HydrophobicContact CD1-CB 3.85Å; I876-A886 HydrophobicContact CG1-CB 4.45Å; I876-A886 HydrophobicContact CG2-CB 3.98Å; I876-I889 HydrophobicContact CD1-CD1 3.91Å; I876-T907 HydrophobicContact CG2-CG2 4.32Å; I876-T911 HydrophobicContact CG2-CG2 3.65Å
877	I	95.6	Very high	95.4	Very high	18 Å²	18	24.5 Å²	24.5	9%	0.092	12%	0.122	C	C	.	.	H	α-helix	trans	-70.3	-30.3	-174.9	-68	164	0	0	0	111.7	S873 K874 T907 K910 I914 F1241	S873-I877 VanDerWaalsContact O-CD1 3.31Å; S873-I877 WeakPolarHBondContact O-CD1 3.45Å; S873-I877 WeakPolarHBondContact O-CG1 3.44Å; S873-I877 PolarHBondContact O-N 2.78Å; S873-I877 VanDerWaalsContact O-N 3.09Å; K874-I877 PolarHBondContact O-N 3.24Å; I877-T907 HydrophobicContact CD1-CG2 4.21Å; I877-T907 HydrophobicContact CG1-CG2 4.18Å; I877-K910 HydrophobicContact CD1-CB 4.26Å; I877-K910 HydrophobicContact CD1-CG 4.2Å; I877-K910 HydrophobicContact CG1-CB 4.02Å; I877-K910 HydrophobicContact CG1-CG 4.49Å; I877-K910 HydrophobicContact CG2-CB 3.86Å; I877-K910 HydrophobicContact CG2-CG 4.19Å; I877-I914 HydrophobicContact CG2-CD1 4.44Å; I877-I914 WeakPolarHBondContact O-CD1 3.38Å; I877-F1241 HydrophobicContact CD1-CD1 3.96Å; I877-F1241 HydrophobicContact CD1-CE1 3.48Å; I877-F1241 VanDerWaalsContact CD1-CE1 3.48Å; I877-F1241 HydrophobicContact CD1-CZ 4.4Å
878	Y	93.6	Very high	95.5	Very high	83 Å²	83	23.9 Å²	23.9	33%	0.325	12%	0.119	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.9	15.4	179.1	-71.1	-80.1	0	0	0	114.4	M800 H804 Q805 K874 I876	M800-Y878 HydrophobicContact CE-CD1 4.11Å; M800-Y878 HydrophobicContact CE-CD2 4.05Å; M800-Y878 HydrophobicContact CE-CG 3.7Å; M800-Y878 HydrophobicContact SD-CD2 3.63Å; M800-Y878 HydrophobicContact SD-CE2 4.37Å; M800-Y878 HydrophobicContact SD-CG 3.87Å; H804-Y878 PolarHBondContact CE1-O 3.1Å; Q805-Y878 HydrophobicContact CG-CD1 4.34Å; K874-Y878 HydrophobicContact CB-CD2 4.47Å; K874-Y878 WeakPolarHBondContact O-CD2 3.42Å; K874-Y878 PolarHBondContact O-N 3.32Å; I876-Y878 VanDerWaalsContact C-N 3.33Å; I876-Y878 PolarHBondContact O-N 3.1Å
879	D	93.8	Very high	95.6	Very high	111 Å²	111	23.6 Å²	23.6	59%	0.594	12%	0.118	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.4	48.8	175.4	-163.6	43.8	0	0	0	113.3	H804 I876	H804-D879 PolarHBondContact CE1-O 2.76Å; H804-D879 VanDerWaalsContact CE1-O 3.31Å; I876-D879 PolarHBondContact O-N 2.91Å
880	I	95.4	Very high	95.6	Very high	13 Å²	13	23.6 Å²	23.6	7%	0.067	12%	0.118	C	C	.	.	S	Bend	trans	-109.8	-38.3	177.9	-54.1	167.2	0	0	0	110.5	L799 M800 P821 L875	L799-I880 HydrophobicContact CB-CG2 4.3Å; M800-I880 HydrophobicContact CB-CD1 4.47Å; M800-I880 HydrophobicContact CE-CD1 3.79Å; M800-I880 HydrophobicContact SD-CD1 3.68Å; P821-I880 HydrophobicContact CG-CG2 3.98Å; P821-I880 WeakPolarHBondContact CG-O 3.26Å; L875-I880 HydrophobicContact CB-CB 4.36Å; L875-I880 HydrophobicContact CD2-CB 4.41Å; L875-I880 HydrophobicContact CD2-CD1 3.91Å; L875-I880 HydrophobicContact CD2-CG2 4.3Å; L875-I880 WeakPolarHBondContact O-CB 3.34Å; L875-I880 PolarHBondContact O-N 3.06Å
881	V	95.7	Very high	95.5	Very high	2 Å²	2	24.7 Å²	24.7	1%	0.012	12%	0.122	C	C	.	.	S	Bend	trans	-109.2	140	169.7	173.1	0	0	0	0	108	Q826 F872 L875 I876 M883 A885	Q826-V881 HydrophobicContact CG-CG1 4.5Å; Q826-V881 HydrophobicContact CG-CG2 4.18Å; F872-V881 HydrophobicContact CE2-CG1 4.32Å; F872-V881 HydrophobicContact CE2-CG2 4.28Å; F872-V881 HydrophobicContact CZ-CG1 3.93Å; L875-V881 HydrophobicContact CB-CB 4.18Å; L875-V881 HydrophobicContact CB-CG2 3.65Å; L875-V881 HydrophobicContact CD1-CG2 3.93Å; L875-V881 HydrophobicContact CG-CG2 4.44Å; L875-V881 PolarHBondContact O-N 3.18Å; L875-V881 VanDerWaalsContact O-N 3.12Å; I876-V881 HydrophobicContact CG1-CB 4.36Å; I876-V881 HydrophobicContact CG1-CG1 4.3Å; V881-M883 PolarHBondContact O-N 2.93Å; V881-A885 HydrophobicContact CG1-CB 3.73Å
882	D	93.6	Very high	95.5	Very high	76 Å²	76	26 Å²	26	41%	0.406	13%	0.128	S	C	.	.			trans	-57	130.6	-179.8	-174.6	-20.8	0	0	0	111.5	Q826 H884 A885	Q826-D882 VanDerWaalsContact OE1-N 3.11Å; D882-H884 PolarHBondContact O-N 3.13Å; D882-H884 IonicContact OD1-CE1 2.67Å; D882-H884 IonicContact OD1-CG 2.36Å; D882-H884 PolarHBondContact OD1-N 3.49Å; D882-H884 IonicContact OD1-ND1 3.89Å; D882-H884 PolarHBondContact OD1-ND1 2.98Å; D882-H884 IonicContact OD2-CE1 2.61Å; D882-H884 IonicContact OD2-CG 3.82Å; D882-H884 IonicContact OD2-ND1 3.56Å; D882-H884 PolarHBondContact OD2-ND1 3.3Å; D882-A885 VanDerWaalsContact O-CB 3.27Å; D882-A885 WeakPolarHBondContact O-CB 3.5Å; D882-A885 PolarHBondContact O-N 3.47Å
883	M	94.8	Very high	95.3	Very high	14 Å²	14	27.3 Å²	27.3	7%	0.069	13%	0.133	C	C	.	.	G	3₁₀ helix	trans	-54.4	-18.6	175.5	-165.1	-175	-62.1	0	0	113.8	V881 A885 A886 T911 I914 D915 Q918 C919 T922	V881-M883 PolarHBondContact O-N 2.93Å; M883-A885 VanDerWaalsContact C-N 3.29Å; M883-A885 PolarHBondContact O-N 3.41Å; M883-A886 PolarHBondContact O-N 3.08Å; M883-T911 HydrophobicContact CE-CG2 4.21Å; M883-T911 HydrophobicContact CG-CG2 3.93Å; M883-T911 HydrophobicContact SD-CG2 4.16Å; M883-I914 HydrophobicContact CE-CG2 4.41Å; M883-D915 HydrophobicContact CE-CB 4.44Å; M883-Q918 HydrophobicContact CB-CG 4.2Å; M883-Q918 HydrophobicContact CG-CG 4.42Å; M883-Q918 HydrophobicContact SD-CB 3.98Å; M883-Q918 HydrophobicContact SD-CG 3.77Å; M883-C919 HydrophobicContact SD-CB 4.16Å; M883-T922 WeakPolarHBondContact O-CG2 3.41Å; M883-T922 PolarHBondContact O-OG1 3.46Å
884	H	93.8	Very high	95	Very high	79 Å²	79	30.3 Å²	30.3	37%	0.366	15%	0.148	S	C	.	.	G	3₁₀ helix	trans	-60.7	-34.1	168.4	-65.7	111.3	0	0	0	112.9	D882 A886 A887 Q918	D882-H884 PolarHBondContact O-N 3.13Å; D882-H884 IonicContact OD1-CE1 2.67Å; D882-H884 IonicContact OD1-CG 2.36Å; D882-H884 PolarHBondContact OD1-N 3.49Å; D882-H884 IonicContact OD1-ND1 3.89Å; D882-H884 PolarHBondContact OD1-ND1 2.98Å; D882-H884 IonicContact OD2-CE1 2.61Å; D882-H884 IonicContact OD2-CG 3.82Å; D882-H884 IonicContact OD2-ND1 3.56Å; D882-H884 PolarHBondContact OD2-ND1 3.3Å; H884-A886 PolarHBondContact O-N 3.43Å; H884-A887 WeakPolarHBondContact O-CB 3.18Å; H884-A887 PolarHBondContact O-N 2.67Å; H884-Q918 PolarHBondContact CD2-NE2 3.22Å; H884-Q918 PolarHBondContact CE1-NE2 2.79Å; H884-Q918 PolarHBondContact ND1-NE2 2.87Å; H884-Q918 PolarHBondContact NE2-NE2 3.47Å
885	A	94	Very high	94.7	Very high	16 Å²	16	32.9 Å²	32.9	13%	0.132	16%	0.159	C	C	.	.	G	3₁₀ helix	trans	-63.7	-23.9	179.7	0	0	0	0	0	113	L830 F872 V881 D882 M883 A887	L830-A885 HydrophobicContact CD1-CB 4.47Å; L830-A885 HydrophobicContact CD2-CB 4.15Å; F872-A885 HydrophobicContact CZ-CB 4.36Å; V881-A885 HydrophobicContact CG1-CB 3.73Å; D882-A885 VanDerWaalsContact O-CB 3.27Å; D882-A885 WeakPolarHBondContact O-CB 3.5Å; D882-A885 PolarHBondContact O-N 3.47Å; M883-A885 VanDerWaalsContact C-N 3.29Å; M883-A885 PolarHBondContact O-N 3.41Å; A885-A887 PolarHBondContact O-N 2.89Å
886	A	95.8	Very high	94.4	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	16%	0.16	C	C	.	.	G	3₁₀ helix	trans	-68.7	-9.6	173.5	0	0	0	0	0	113.2	I876 M883 H884 I889 F890 T922	I876-A886 HydrophobicContact CD1-CB 3.85Å; I876-A886 HydrophobicContact CG1-CB 4.45Å; I876-A886 HydrophobicContact CG2-CB 3.98Å; M883-A886 PolarHBondContact O-N 3.08Å; H884-A886 PolarHBondContact O-N 3.43Å; A886-I889 PolarHBondContact O-N 3.48Å; A886-F890 HydrophobicContact CB-CD2 4.47Å; A886-F890 HydrophobicContact CB-CE1 4.1Å; A886-F890 HydrophobicContact CB-CE2 4.04Å; A886-F890 HydrophobicContact CB-CZ 3.83Å; A886-F890 WeakPolarHBondContact O-CB 3.28Å; A886-F890 WeakPolarHBondContact O-CG 3.45Å; A886-F890 PolarHBondContact O-N 3.49Å; A886-T922 HydrophobicContact CB-CG2 3.99Å
887	A	96.6	Very high	94.1	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-62.9	-44	177.9	0	0	0	0	0	111.6	H884 A885 I889 F890 K891 T922 L925 S926 Q929	H884-A887 WeakPolarHBondContact O-CB 3.18Å; H884-A887 PolarHBondContact O-N 2.67Å; A885-A887 PolarHBondContact O-N 2.89Å; A887-I889 PolarHBondContact O-N 3.01Å; A887-F890 PolarHBondContact O-N 3.42Å; A887-K891 PolarHBondContact O-N 3.03Å; A887-K891 VanDerWaalsContact O-N 3.12Å; A887-T922 HydrophobicContact CB-CG2 3.86Å; A887-T922 VanDerWaalsContact N-CG2 3.29Å; A887-L925 HydrophobicContact CB-CB 3.99Å; A887-L925 HydrophobicContact CB-CD2 3.8Å; A887-L925 HydrophobicContact CB-CG 3.74Å; A887-S926 VanDerWaalsContact CA-OG 3.23Å; A887-S926 WeakPolarHBondContact CA-OG 3.24Å; A887-S926 WeakPolarHBondContact O-CB 3.45Å; A887-S926 PolarHBondContact O-OG 3.07Å; A887-Q929 VanDerWaalsContact CB-OE1 3.28Å
888	D	95.4	Very high	93.7	Very high	32 Å²	32	40.1 Å²	40.1	17%	0.171	19%	0.192	C	C	.	.	H	α-helix	trans	-70.9	-15.5	176.4	-68.4	-79.2	0	0	0	113.4	M834 K891 H892 Q929	M834-D888 HydrophobicContact CE-CB 3.78Å; M834-D888 HydrophobicContact SD-CB 4.17Å; D888-K891 WeakPolarHBondContact O-CE 3.48Å; D888-K891 VanDerWaalsContact O-CG 3.27Å; D888-K891 WeakPolarHBondContact O-CG 3.37Å; D888-K891 WeakPolarHBondContact OD1-CE 3.48Å; D888-K891 IonicContact OD1-NZ 2.77Å; D888-K891 PolarHBondContact OD1-NZ 3.24Å; D888-H892 PolarHBondContact O-CD2 3.25Å; D888-Q929 PolarHBondContact OD1-NE2 3.04Å; D888-Q929 VanDerWaalsContact OD1-NE2 3.12Å; D888-Q929 PolarHBondContact OD2-NE2 3.18Å
889	I	96.8	Very high	93.4	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-88.1	-46.5	171.1	-68	171.3	0	0	0	110.7	M834 F838 L869 F872 I876 A886 A887 K891 H892 I904	M834-I889 HydrophobicContact CE-CG1 4.06Å; F838-I889 HydrophobicContact CE2-CG1 4.27Å; F838-I889 HydrophobicContact CZ-CG2 4.36Å; L869-I889 HydrophobicContact CD1-CD1 4.22Å; L869-I889 HydrophobicContact CD1-CG1 4.4Å; L869-I889 HydrophobicContact CD1-CG2 4.25Å; F872-I889 HydrophobicContact CD1-CD1 3.59Å; F872-I889 HydrophobicContact CE1-CD1 3.73Å; I876-I889 HydrophobicContact CD1-CD1 3.91Å; A886-I889 PolarHBondContact O-N 3.48Å; A887-I889 PolarHBondContact O-N 3.01Å; I889-K891 VanDerWaalsContact C-N 3.27Å; I889-K891 PolarHBondContact O-N 3.43Å; I889-H892 PolarHBondContact O-N 3.12Å; I889-H892 VanDerWaalsContact O-N 3.08Å; I889-I904 HydrophobicContact CG2-CD1 4.43Å; I889-I904 HydrophobicContact CG2-CG1 3.9Å; I889-I904 HydrophobicContact CG2-CG2 4.4Å
890	F	96.9	Very high	93.4	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-62.8	-32.4	-178.2	-67.1	-13.7	0	0	0	112.2	A886 A887 H892 Y893 I904 T907 L908 T922 L923 S926 F959	A886-F890 HydrophobicContact CB-CD2 4.47Å; A886-F890 HydrophobicContact CB-CE1 4.1Å; A886-F890 HydrophobicContact CB-CE2 4.04Å; A886-F890 HydrophobicContact CB-CZ 3.83Å; A886-F890 WeakPolarHBondContact O-CB 3.28Å; A886-F890 WeakPolarHBondContact O-CG 3.45Å; A886-F890 PolarHBondContact O-N 3.49Å; A887-F890 PolarHBondContact O-N 3.42Å; F890-H892 PolarHBondContact O-N 2.86Å; F890-Y893 WeakPolarHBondContact O-CB 3.23Å; F890-Y893 PolarHBondContact O-N 2.92Å; F890-Y893 VanDerWaalsContact O-N 3.12Å; F890-I904 HydrophobicContact CD1-CG2 4.05Å; F890-T907 HydrophobicContact CE1-CG2 4.05Å; F890-L908 HydrophobicContact CD1-CB 4.43Å; F890-L908 HydrophobicContact CE1-CB 3.88Å; F890-L908 HydrophobicContact CZ-CB 4.01Å; F890-L908 HydrophobicContact CZ-CG 4.39Å; F890-T922 HydrophobicContact CD2-CG2 3.72Å; F890-T922 HydrophobicContact CE2-CG2 3.68Å; F890-L923 HydrophobicContact CB-CD2 4.42Å; F890-L923 HydrophobicContact CD2-CD2 3.6Å; F890-L923 HydrophobicContact CD2-CG 4.22Å; F890-L923 HydrophobicContact CE2-CD2 4.14Å; F890-L923 HydrophobicContact CE2-CG 4.46Å; F890-L923 HydrophobicContact CG-CD2 4.21Å; F890-S926 WeakPolarHBondContact CB-OG 3.48Å; F890-F959 HydrophobicContact CB-CZ 4Å; F890-F959 WeakPolarHBondContact O-CZ 3.44Å
891	K	94.6	Very high	93.2	Very high	23 Å²	23	31.6 Å²	31.6	10%	0.1	15%	0.152	C	C	.	.	G	3₁₀ helix	trans	-57.7	-29.9	174.7	66.9	-178.3	-171.7	-171.5	0	113.4	A887 D888 I889 Q929 L930 E933	A887-K891 PolarHBondContact O-N 3.03Å; A887-K891 VanDerWaalsContact O-N 3.12Å; D888-K891 WeakPolarHBondContact O-CE 3.48Å; D888-K891 VanDerWaalsContact O-CG 3.27Å; D888-K891 WeakPolarHBondContact O-CG 3.37Å; D888-K891 WeakPolarHBondContact OD1-CE 3.48Å; D888-K891 IonicContact OD1-NZ 2.77Å; D888-K891 PolarHBondContact OD1-NZ 3.24Å; I889-K891 VanDerWaalsContact C-N 3.27Å; I889-K891 PolarHBondContact O-N 3.43Å; K891-Q929 HydrophobicContact CD-CB 4.34Å; K891-L930 HydrophobicContact CB-CD1 3.77Å; K891-L930 HydrophobicContact CB-CD2 4.01Å; K891-L930 HydrophobicContact CB-CG 3.69Å; K891-L930 HydrophobicContact CD-CD2 4.49Å; K891-E933 IonicContact NZ-OE1 3.47Å; K891-E933 PolarHBondContact NZ-OE1 3.31Å
892	H	94.4	Very high	93	Very high	30 Å²	30	34 Å²	34	14%	0.139	17%	0.165	C	C	.	.	G	3₁₀ helix	trans	-83.2	-5.3	-179.5	-69.2	-51.6	0	0	0	114.7	F838 D888 I889 F890 M894 K895 Y896	F838-H892 HydrophobicContact CD1-CB 3.76Å; F838-H892 AromaticContact CD1-CD2 3.88Å; F838-H892 AromaticContact CD1-CG 3.8Å; F838-H892 AromaticContact CD2-CD2 3.55Å; F838-H892 HydrophobicContact CE1-CB 3.54Å; F838-H892 AromaticContact CE2-CD2 3.79Å; F838-H892 HydrophobicContact CG-CB 4.39Å; F838-H892 AromaticContact CG-CD2 3.6Å; F838-H892 AromaticContact CG-CG 3.95Å; F838-H892 HydrophobicContact CZ-CB 4.01Å; D888-H892 PolarHBondContact O-CD2 3.25Å; I889-H892 PolarHBondContact O-N 3.12Å; I889-H892 VanDerWaalsContact O-N 3.08Å; F890-H892 PolarHBondContact O-N 2.86Å; H892-M894 PolarHBondContact O-N 3.44Å; H892-K895 PolarHBondContact O-N 3.14Å; H892-K895 VanDerWaalsContact O-N 3.1Å; H892-Y896 HydrophobicContact CB-CD2 3.98Å; H892-Y896 HydrophobicContact CB-CE2 4.48Å; H892-Y896 AromaticContact ND1-CE2 3.98Å; H892-Y896 PolarHBondContact O-N 2.98Å; H892-Y896 VanDerWaalsContact O-N 3.13Å
893	Y	94.3	Very high	92.9	Very high	27 Å²	27	30.5 Å²	30.5	11%	0.106	15%	0.146	C	C	.	.	G	3₁₀ helix	trans	-50.6	-33.4	-175.8	177.5	-128.5	0	0	0	115.1	F890 Y897 G901 I904 K905 L955 R958 F959	F890-Y893 WeakPolarHBondContact O-CB 3.23Å; F890-Y893 PolarHBondContact O-N 2.92Å; F890-Y893 VanDerWaalsContact O-N 3.12Å; Y893-Y897 HydrophobicContact CD2-CD2 4.44Å; Y893-Y897 AromaticContact CE2-CD2 3.94Å; Y893-Y897 HydrophobicContact CE2-CD2 3.94Å; Y893-Y897 AromaticContact CE2-CE2 3.9Å; Y893-Y897 HydrophobicContact CE2-CE2 3.9Å; Y893-Y897 AromaticContact CZ-CE2 3.9Å; Y893-G901 WeakPolarHBondContact CE2-O 3.38Å; Y893-I904 HydrophobicContact CD2-CB 4.16Å; Y893-I904 HydrophobicContact CD2-CG2 3.87Å; Y893-I904 HydrophobicContact CG-CG2 4.2Å; Y893-K905 HydrophobicContact CE2-CB 4Å; Y893-L955 HydrophobicContact CD1-CD1 3.83Å; Y893-L955 HydrophobicContact CG-CD1 4.46Å; Y893-R958 HydrophobicContact CE1-CB 4.41Å; Y893-F959 AromaticContact CD1-CE1 3.95Å; Y893-F959 HydrophobicContact CD1-CE1 3.95Å
894	M	90.8	Very high	93	Very high	62 Å²	62	29.8 Å²	29.8	31%	0.305	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.3	-36.3	176.9	-88	-172.3	66.3	0	0	114.6	H892 Y896 E954 L955	H892-M894 PolarHBondContact O-N 3.44Å; M894-Y896 VanDerWaalsContact C-N 3.34Å; M894-Y896 PolarHBondContact O-N 2.78Å; M894-E954 HydrophobicContact CE-CB 4.15Å; M894-E954 HydrophobicContact CE-CG 3.49Å; M894-E954 VanDerWaalsContact CE-CG 3.49Å; M894-E954 HydrophobicContact SD-CB 4.22Å; M894-E954 HydrophobicContact SD-CG 3.69Å; M894-L955 HydrophobicContact CB-CD1 4.35Å; M894-L955 HydrophobicContact CG-CD1 3.94Å; M894-L955 VanDerWaalsContact SD-CA 3.59Å; M894-L955 HydrophobicContact SD-CB 3.83Å; M894-L955 HydrophobicContact SD-CD1 4.27Å; M894-L955 PolarHBondContact SD-N 3.44Å
895	K	90.2	Very high	93	Very high	102 Å²	102	31.7 Å²	31.7	44%	0.443	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-42.4	-179.3	-173.2	177.7	174	-160.2	0	110.6	D840 H892	D840-K895 WeakPolarHBondContact OD1-CE 3.23Å; D840-K895 IonicContact OD1-NZ 2.84Å; D840-K895 PolarHBondContact OD1-NZ 3Å; D840-K895 IonicContact OD2-NZ 3.86Å; D840-K895 PolarHBondContact OD2-NZ 2.68Å; H892-K895 PolarHBondContact O-N 3.14Å; H892-K895 VanDerWaalsContact O-N 3.1Å
896	Y	91.3	Very high	93	Very high	5 Å²	5	33.5 Å²	33.5	2%	0.02	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.4	37.3	-177.2	-58.3	-86.9	0	0	0	113	F838 I839 H892 M894 N898 D899 Y900 G901	F838-Y896 HydrophobicContact CB-CE2 4.06Å; F838-Y896 AromaticContact CD1-CD2 3.62Å; F838-Y896 HydrophobicContact CD1-CD2 3.62Å; F838-Y896 AromaticContact CD1-CE2 3.79Å; F838-Y896 HydrophobicContact CD1-CE2 3.79Å; F838-Y896 HydrophobicContact CD1-CG 4.17Å; F838-Y896 HydrophobicContact CE1-CD2 4.25Å; F838-Y896 HydrophobicContact CG-CE2 4.38Å; F838-Y896 PolarHBondContact O-OH 3.38Å; F838-Y896 VanDerWaalsContact O-OH 3.05Å; I839-Y896 WeakPolarHBondContact O-CE1 3.33Å; I839-Y896 VanDerWaalsContact O-CZ 3.31Å; I839-Y896 PolarHBondContact O-OH 2.87Å; H892-Y896 HydrophobicContact CB-CD2 3.98Å; H892-Y896 HydrophobicContact CB-CE2 4.48Å; H892-Y896 AromaticContact ND1-CE2 3.98Å; H892-Y896 PolarHBondContact O-N 2.98Å; H892-Y896 VanDerWaalsContact O-N 3.13Å; M894-Y896 VanDerWaalsContact C-N 3.34Å; M894-Y896 PolarHBondContact O-N 2.78Å; Y896-N898 VanDerWaalsContact C-N 3.32Å; Y896-N898 PolarHBondContact O-N 2.99Å; Y896-D899 PolarHBondContact O-N 3.48Å; Y896-Y900 VanDerWaalsContact CB-CD2 3.46Å; Y896-Y900 HydrophobicContact CD1-CD2 4.25Å; Y896-Y900 AromaticContact CD1-CE2 3.99Å; Y896-Y900 HydrophobicContact CD1-CE2 3.99Å; Y896-Y900 AromaticContact CG-CD2 3.9Å; Y896-Y900 HydrophobicContact CG-CD2 3.9Å; Y896-Y900 HydrophobicContact CG-CE2 4.09Å; Y896-Y900 PolarHBondContact O-N 3.14Å; Y896-G901 PolarHBondContact O-N 3.16Å
897	Y	88.8	Confident	92.9	Very high	86 Å²	86	33.5 Å²	33.5	34%	0.337	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-34.9	-171.9	-178.1	-89.2	0	0	0	114	Y893 D899 G901	Y893-Y897 HydrophobicContact CD2-CD2 4.44Å; Y893-Y897 AromaticContact CE2-CD2 3.94Å; Y893-Y897 HydrophobicContact CE2-CD2 3.94Å; Y893-Y897 AromaticContact CE2-CE2 3.9Å; Y893-Y897 HydrophobicContact CE2-CE2 3.9Å; Y893-Y897 AromaticContact CZ-CE2 3.9Å; Y897-D899 VanDerWaalsContact C-N 3.34Å; Y897-G901 VanDerWaalsContact O-CA 3.27Å; Y897-G901 WeakPolarHBondContact O-CA 3.32Å; Y897-G901 PolarHBondContact O-N 3.44Å
898	N	87.1	Confident	92.8	Very high	82 Å²	82	33.8 Å²	33.8	44%	0.439	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75	-28.4	-179.5	-66.1	-42.7	0	0	0	112.5	Y896 R1230 R1237	Y896-N898 VanDerWaalsContact C-N 3.32Å; Y896-N898 PolarHBondContact O-N 2.99Å; N898-R1230 PolarHBondContact OD1-NH2 2.89Å; N898-R1237 PolarHBondContact O-NH1 2.94Å; N898-R1237 PolarHBondContact O-NH2 3.1Å
899	D	88.1	Confident	92.6	Very high	24 Å²	24	33.2 Å²	33.2	13%	0.128	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.6	-45.6	-164.8	-46.7	-42.6	0	0	0	110.6	Q841 L862 R866 Y896 Y897	Q841-D899 PolarHBondContact NE2-OD2 3.24Å; L862-D899 HydrophobicContact CD1-CB 3.75Å; R866-D899 WeakPolarHBondContact CD-O 3.32Å; Y896-D899 PolarHBondContact O-N 3.48Å; Y897-D899 VanDerWaalsContact C-N 3.34Å
900	Y	93.9	Very high	92.5	Very high	2 Å²	2	36.1 Å²	36.1	1%	0.008	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-126.2	-2.6	-174.8	-51.6	-44	0	0	0	113.7	V837 F838 L862 R865 R866 L869 Y896 D902 I903 I904	V837-Y900 HydrophobicContact CG1-CD1 4.45Å; V837-Y900 HydrophobicContact CG1-CD2 4.11Å; V837-Y900 HydrophobicContact CG1-CE1 3.94Å; V837-Y900 HydrophobicContact CG1-CE2 3.55Å; V837-Y900 VanDerWaalsContact CG1-CZ 3.47Å; V837-Y900 PolarHBondContact O-OH 2.9Å; V837-Y900 VanDerWaalsContact O-OH 3.09Å; F838-Y900 AromaticContact CD1-CD2 3.95Å; F838-Y900 HydrophobicContact CD1-CD2 3.95Å; F838-Y900 HydrophobicContact CD1-CE2 4.06Å; F838-Y900 AromaticContact CE1-CD2 3.64Å; F838-Y900 HydrophobicContact CE1-CD2 3.64Å; F838-Y900 HydrophobicContact CE1-CE2 4.17Å; F838-Y900 HydrophobicContact CE1-CG 4.49Å; L862-Y900 HydrophobicContact CD1-CE1 3.8Å; R865-Y900 HydrophobicContact CB-CE1 4.25Å; R865-Y900 WeakPolarHBondContact CB-OH 3.43Å; R866-Y900 HydrophobicContact CG-CD1 3.85Å; R866-Y900 HydrophobicContact CG-CE1 3.87Å; L869-Y900 HydrophobicContact CD2-CD1 3.91Å; L869-Y900 HydrophobicContact CD2-CD2 4.33Å; L869-Y900 HydrophobicContact CD2-CG 3.69Å; Y896-Y900 VanDerWaalsContact CB-CD2 3.46Å; Y896-Y900 HydrophobicContact CD1-CD2 4.25Å; Y896-Y900 AromaticContact CD1-CE2 3.99Å; Y896-Y900 HydrophobicContact CD1-CE2 3.99Å; Y896-Y900 AromaticContact CG-CD2 3.9Å; Y896-Y900 HydrophobicContact CG-CD2 3.9Å; Y896-Y900 HydrophobicContact CG-CE2 4.09Å; Y896-Y900 PolarHBondContact O-N 3.14Å; Y900-D902 VanDerWaalsContact C-N 3.26Å; Y900-D902 PolarHBondContact O-N 3.42Å; Y900-I903 PolarHBondContact O-N 3.22Å; Y900-I904 WeakPolarHBondContact O-CG1 3.21Å; Y900-I904 PolarHBondContact O-N 2.85Å
901	G	91.4	Very high	92.3	Very high	2 Å²	2	36.1 Å²	36.1	2%	0.021	17%	0.169	C	C	.	.	H	α-helix	trans	-67.3	-17.4	-170.3	0	0	0	0	0	115.6	Y893 Y896 Y897 K905	Y893-G901 WeakPolarHBondContact CE2-O 3.38Å; Y896-G901 PolarHBondContact O-N 3.16Å; Y897-G901 VanDerWaalsContact O-CA 3.27Å; Y897-G901 WeakPolarHBondContact O-CA 3.32Å; Y897-G901 PolarHBondContact O-N 3.44Å; G901-K905 WeakPolarHBondContact O-CB 3.17Å; G901-K905 PolarHBondContact O-N 3.44Å
902	D	89.9	Confident	92.2	Very high	51 Å²	51	38 Å²	38	27%	0.273	18%	0.175	S	C	.	.	H	α-helix	trans	-78.4	-49.7	168.9	45.1	12.7	0	0	0	111.4	R866 Y900 K905 E906 R1237	R866-D902 IonicContact CZ-OD1 3.27Å; R866-D902 IonicContact CZ-OD2 2.83Å; R866-D902 IonicContact NH1-OD2 2.83Å; R866-D902 IonicContact NH2-OD1 3.58Å; R866-D902 PolarHBondContact NH2-OD1 3.16Å; R866-D902 IonicContact NH2-OD2 3.25Å; R866-D902 PolarHBondContact NH2-OD2 2.85Å; Y900-D902 VanDerWaalsContact C-N 3.26Å; Y900-D902 PolarHBondContact O-N 3.42Å; D902-K905 PolarHBondContact O-N 2.79Å; D902-E906 PolarHBondContact O-N 3.14Å; D902-R1237 IonicContact OD1-NH1 3.56Å; D902-R1237 WeakPolarHBondContact OD2-CD 3.4Å; D902-R1237 IonicContact OD2-CZ 3.17Å; D902-R1237 IonicContact OD2-NE 3.38Å; D902-R1237 IonicContact OD2-NH1 2.7Å; D902-R1237 PolarHBondContact OD2-NH1 2.98Å
903	I	93.1	Very high	92.1	Very high	3 Å²	3	42.6 Å²	42.6	2%	0.015	20%	0.197	C	C	.	.	H	α-helix	trans	-56	-54.3	176.8	-61.8	172.7	0	0	0	110.4	R866 L869 Y900 K905 E906 T907 F1240 F1241	R866-I903 HydrophobicContact CB-CD1 3.82Å; R866-I903 HydrophobicContact CG-CD1 4.01Å; L869-I903 HydrophobicContact CD2-CB 4.46Å; L869-I903 HydrophobicContact CD2-CG2 4.07Å; L869-I903 HydrophobicContact CG-CG2 4.06Å; Y900-I903 PolarHBondContact O-N 3.22Å; I903-K905 VanDerWaalsContact C-N 3.28Å; I903-K905 PolarHBondContact O-N 3.35Å; I903-E906 PolarHBondContact O-N 3.2Å; I903-T907 PolarHBondContact O-N 2.83Å; I903-T907 PolarHBondContact O-OG1 3.49Å; I903-F1240 HydrophobicContact CD1-CD2 4.48Å; I903-F1241 HydrophobicContact CB-CE2 4.4Å; I903-F1241 HydrophobicContact CG1-CE2 4.45Å; I903-F1241 HydrophobicContact CG2-CE2 4.13Å; I903-F1241 HydrophobicContact CG2-CZ 3.97Å
904	I	96	Very high	91.9	Very high	0 Å²	0	46 Å²	46	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-60.9	-37.7	-179.3	-62.7	170.9	0	0	0	111.4	F838 L869 I889 F890 Y893 Y900 L908	F838-I904 HydrophobicContact CE1-CD1 4.22Å; F838-I904 HydrophobicContact CZ-CD1 4.36Å; L869-I904 HydrophobicContact CD2-CG1 4.21Å; I889-I904 HydrophobicContact CG2-CD1 4.43Å; I889-I904 HydrophobicContact CG2-CG1 3.9Å; I889-I904 HydrophobicContact CG2-CG2 4.4Å; F890-I904 HydrophobicContact CD1-CG2 4.05Å; Y893-I904 HydrophobicContact CD2-CB 4.16Å; Y893-I904 HydrophobicContact CD2-CG2 3.87Å; Y893-I904 HydrophobicContact CG-CG2 4.2Å; Y900-I904 WeakPolarHBondContact O-CG1 3.21Å; Y900-I904 PolarHBondContact O-N 2.85Å; I904-L908 WeakPolarHBondContact O-CB 3.27Å; I904-L908 PolarHBondContact O-N 3.48Å
905	K	93.3	Very high	92	Very high	118 Å²	118	46.3 Å²	46.3	51%	0.513	22%	0.218	S	C	.	.	H	α-helix	trans	-67.8	-39.9	178.6	174.2	-171.5	172	-163.2	0	112.2	Y893 G901 D902 I903 S909	Y893-K905 HydrophobicContact CE2-CB 4Å; G901-K905 WeakPolarHBondContact O-CB 3.17Å; G901-K905 PolarHBondContact O-N 3.44Å; D902-K905 PolarHBondContact O-N 2.79Å; I903-K905 VanDerWaalsContact C-N 3.28Å; I903-K905 PolarHBondContact O-N 3.35Å; K905-S909 WeakPolarHBondContact O-CB 3.47Å; K905-S909 PolarHBondContact O-N 2.85Å
906	E	93.6	Very high	92.1	Very high	55 Å²	55	45.3 Å²	45.3	26%	0.257	21%	0.214	S	C	.	.	H	α-helix	trans	-77	-34.5	177.5	-168.3	53.3	-154.2	0	0	111.7	D902 I903 L908 S909 K910 F1241	D902-E906 PolarHBondContact O-N 3.14Å; I903-E906 PolarHBondContact O-N 3.2Å; E906-L908 VanDerWaalsContact C-N 3.33Å; E906-L908 PolarHBondContact O-N 3.36Å; E906-S909 CarbonylContact O-C 3.56Å; E906-S909 WeakPolarHBondContact O-CA 3.38Å; E906-S909 VanDerWaalsContact O-CB 3.27Å; E906-S909 WeakPolarHBondContact O-CB 3.34Å; E906-S909 PolarHBondContact O-N 3.36Å; E906-S909 WeakPolarHBondContact OE2-CB 3.33Å; E906-S909 PolarHBondContact OE2-OG 2.84Å; E906-K910 HydrophobicContact CG-CG 4.15Å; E906-K910 VanDerWaalsContact O-CG 3.26Å; E906-K910 WeakPolarHBondContact O-CG 3.43Å; E906-K910 PolarHBondContact O-N 3.44Å; E906-K910 WeakPolarHBondContact OE1-CD 3.44Å; E906-K910 WeakPolarHBondContact OE1-CE 3.49Å; E906-K910 WeakPolarHBondContact OE1-CG 3.26Å; E906-K910 IonicContact OE1-NZ 3.53Å; E906-F1241 HydrophobicContact CB-CD2 4.09Å; E906-F1241 HydrophobicContact CB-CE2 4.31Å; E906-F1241 HydrophobicContact CG-CB 4.25Å; E906-F1241 HydrophobicContact CG-CD2 4.1Å; E906-F1241 HydrophobicContact CG-CG 4.12Å
907	T	94.8	Very high	92.3	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-57.3	-44.5	168.5	-51.3	0	0	0	0	111.9	S873 I876 I877 F890 I903 S909 T911	S873-T907 WeakPolarHBondContact CB-OG1 3.34Å; S873-T907 PolarHBondContact OG-OG1 3.19Å; I876-T907 HydrophobicContact CG2-CG2 4.32Å; I877-T907 HydrophobicContact CD1-CG2 4.21Å; I877-T907 HydrophobicContact CG1-CG2 4.18Å; F890-T907 HydrophobicContact CE1-CG2 4.05Å; I903-T907 PolarHBondContact O-N 2.83Å; I903-T907 PolarHBondContact O-OG1 3.49Å; T907-S909 VanDerWaalsContact C-N 3.33Å; T907-T911 WeakPolarHBondContact O-CB 3.48Å; T907-T911 VanDerWaalsContact O-CG2 3.31Å; T907-T911 WeakPolarHBondContact O-CG2 3.45Å; T907-T911 PolarHBondContact O-N 3.31Å; T907-T911 PolarHBondContact O-OG1 3.11Å
908	L	93.9	Very high	92.5	Very high	5 Å²	5	45.1 Å²	45.1	3%	0.026	22%	0.218	C	C	.	.	H	α-helix	trans	-61.2	-42.4	170.9	-168.6	167	0	0	0	111	F890 I904 E906 T911 R912 L923 F959 T962	F890-L908 HydrophobicContact CD1-CB 4.43Å; F890-L908 HydrophobicContact CE1-CB 3.88Å; F890-L908 HydrophobicContact CZ-CB 4.01Å; F890-L908 HydrophobicContact CZ-CG 4.39Å; I904-L908 WeakPolarHBondContact O-CB 3.27Å; I904-L908 PolarHBondContact O-N 3.48Å; E906-L908 VanDerWaalsContact C-N 3.33Å; E906-L908 PolarHBondContact O-N 3.36Å; L908-T911 WeakPolarHBondContact CA-OG1 3.29Å; L908-T911 PolarHBondContact O-OG1 3.23Å; L908-T911 VanDerWaalsContact O-OG1 3.08Å; L908-R912 WeakPolarHBondContact O-CB 3.48Å; L908-R912 PolarHBondContact O-N 3.07Å; L908-R912 VanDerWaalsContact O-N 3.1Å; L908-L923 HydrophobicContact CD1-CD2 3.63Å; L908-L923 HydrophobicContact CG-CD2 4.03Å; L908-F959 HydrophobicContact CD1-CD1 4.07Å; L908-F959 HydrophobicContact CD1-CE1 3.99Å; L908-T962 HydrophobicContact CD1-CG2 4.18Å; L908-T962 HydrophobicContact CD2-CG2 3.75Å
909	S	92.3	Very high	92.9	Very high	20 Å²	20	41.3 Å²	41.3	14%	0.14	20%	0.197	C	C	.	.	H	α-helix	trans	-62.2	-44.7	179.9	-169.4	0	0	0	0	113.2	K905 E906 T907 R912 Q913	K905-S909 WeakPolarHBondContact O-CB 3.47Å; K905-S909 PolarHBondContact O-N 2.85Å; E906-S909 CarbonylContact O-C 3.56Å; E906-S909 WeakPolarHBondContact O-CA 3.38Å; E906-S909 VanDerWaalsContact O-CB 3.27Å; E906-S909 WeakPolarHBondContact O-CB 3.34Å; E906-S909 PolarHBondContact O-N 3.36Å; E906-S909 WeakPolarHBondContact OE2-CB 3.33Å; E906-S909 PolarHBondContact OE2-OG 2.84Å; T907-S909 VanDerWaalsContact C-N 3.33Å; S909-R912 PolarHBondContact O-NH2 3.4Å; S909-R912 PolarHBondContact OG-NH2 2.91Å; S909-Q913 VanDerWaalsContact O-CG 3.28Å; S909-Q913 WeakPolarHBondContact O-CG 3.28Å; S909-Q913 PolarHBondContact O-N 3.45Å; S909-Q913 PolarHBondContact O-NE2 2.89Å; S909-Q913 PolarHBondContact OG-NE2 2.8Å
910	K	93.4	Very high	93.2	Very high	62 Å²	62	40.1 Å²	40.1	27%	0.27	19%	0.191	S	C	.	.	H	α-helix	trans	-73.7	-47.9	-179.9	-58.5	-81.3	-163.5	-171.9	0	111.4	I877 E906 R912 Q913 I914	I877-K910 HydrophobicContact CD1-CB 4.26Å; I877-K910 HydrophobicContact CD1-CG 4.2Å; I877-K910 HydrophobicContact CG1-CB 4.02Å; I877-K910 HydrophobicContact CG1-CG 4.49Å; I877-K910 HydrophobicContact CG2-CB 3.86Å; I877-K910 HydrophobicContact CG2-CG 4.19Å; E906-K910 HydrophobicContact CG-CG 4.15Å; E906-K910 VanDerWaalsContact O-CG 3.26Å; E906-K910 WeakPolarHBondContact O-CG 3.43Å; E906-K910 PolarHBondContact O-N 3.44Å; E906-K910 WeakPolarHBondContact OE1-CD 3.44Å; E906-K910 WeakPolarHBondContact OE1-CE 3.49Å; E906-K910 WeakPolarHBondContact OE1-CG 3.26Å; E906-K910 IonicContact OE1-NZ 3.53Å; K910-R912 VanDerWaalsContact C-N 3.28Å; K910-R912 PolarHBondContact O-N 3.37Å; K910-Q913 WeakPolarHBondContact O-CA 3.08Å; K910-Q913 WeakPolarHBondContact O-CB 3.39Å; K910-Q913 PolarHBondContact O-N 3.44Å; K910-I914 WeakPolarHBondContact O-CG1 3.42Å; K910-I914 PolarHBondContact O-N 3.16Å
911	T	94	Very high	93.3	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-55.9	-42.3	176.1	49.6	0	0	0	0	111.9	I876 M883 T907 L908 Q913 I914 D915	I876-T911 HydrophobicContact CG2-CG2 3.65Å; M883-T911 HydrophobicContact CE-CG2 4.21Å; M883-T911 HydrophobicContact CG-CG2 3.93Å; M883-T911 HydrophobicContact SD-CG2 4.16Å; T907-T911 WeakPolarHBondContact O-CB 3.48Å; T907-T911 VanDerWaalsContact O-CG2 3.31Å; T907-T911 WeakPolarHBondContact O-CG2 3.45Å; T907-T911 PolarHBondContact O-N 3.31Å; T907-T911 PolarHBondContact O-OG1 3.11Å; L908-T911 WeakPolarHBondContact CA-OG1 3.29Å; L908-T911 PolarHBondContact O-OG1 3.23Å; L908-T911 VanDerWaalsContact O-OG1 3.08Å; T911-Q913 VanDerWaalsContact C-N 3.3Å; T911-Q913 PolarHBondContact O-N 3.35Å; T911-I914 PolarHBondContact O-N 2.98Å; T911-D915 CarbonylContact O-C 3.57Å; T911-D915 PolarHBondContact O-N 3.31Å
912	R	91.9	Very high	93.6	Very high	62 Å²	62	43.3 Å²	43.3	23%	0.234	20%	0.204	C	C	.	.	H	α-helix	trans	-66.5	-24	173.2	-173	-162.1	59.8	-151.9	-22.7	114	L908 S909 K910 K916 C919 T962	L908-R912 WeakPolarHBondContact O-CB 3.48Å; L908-R912 PolarHBondContact O-N 3.07Å; L908-R912 VanDerWaalsContact O-N 3.1Å; S909-R912 PolarHBondContact O-NH2 3.4Å; S909-R912 PolarHBondContact OG-NH2 2.91Å; K910-R912 VanDerWaalsContact C-N 3.28Å; K910-R912 PolarHBondContact O-N 3.37Å; R912-K916 HydrophobicContact CG-CG 4.45Å; R912-K916 WeakPolarHBondContact O-CG 3.34Å; R912-C919 HydrophobicContact CB-CB 4.21Å; R912-T962 WeakPolarHBondContact CD-O 3.31Å; R912-T962 PolarHBondContact NH1-O 2.9Å
913	Q	91.3	Very high	93.9	Very high	127 Å²	127	40.9 Å²	40.9	59%	0.593	19%	0.191	S	C	*	.	H	α-helix	trans	-77.4	-35.6	172.8	-75.8	167.8	74.7	0	0	111.5	S909 K910 T911	S909-Q913 VanDerWaalsContact O-CG 3.28Å; S909-Q913 WeakPolarHBondContact O-CG 3.28Å; S909-Q913 PolarHBondContact O-N 3.45Å; S909-Q913 PolarHBondContact O-NE2 2.89Å; S909-Q913 PolarHBondContact OG-NE2 2.8Å; K910-Q913 WeakPolarHBondContact O-CA 3.08Å; K910-Q913 WeakPolarHBondContact O-CB 3.39Å; K910-Q913 PolarHBondContact O-N 3.44Å; T911-Q913 VanDerWaalsContact C-N 3.3Å; T911-Q913 PolarHBondContact O-N 3.35Å
914	I	91.6	Very high	94	Very high	99 Å²	99	40.9 Å²	40.9	51%	0.508	19%	0.191	S	C	.	.	H	α-helix	trans	-72.8	-61.9	178.4	-63.1	156.7	0	0	0	110.5	I877 M883 K910 T911	I877-I914 HydrophobicContact CG2-CD1 4.44Å; I877-I914 WeakPolarHBondContact O-CD1 3.38Å; M883-I914 HydrophobicContact CE-CG2 4.41Å; K910-I914 WeakPolarHBondContact O-CG1 3.42Å; K910-I914 PolarHBondContact O-N 3.16Å; T911-I914 PolarHBondContact O-N 2.98Å
915	D	93.1	Very high	94	Very high	68 Å²	68	43.3 Å²	43.3	36%	0.364	20%	0.204	S	C	.	.			trans	-139.5	112	173.3	-173.4	-17.7	0	0	0	111.1	M883 T911 I917 Q918 C919	M883-D915 HydrophobicContact CE-CB 4.44Å; T911-D915 CarbonylContact O-C 3.57Å; T911-D915 PolarHBondContact O-N 3.31Å; D915-I917 WeakPolarHBondContact OD1-CA 3.41Å; D915-I917 WeakPolarHBondContact OD1-CB 3.44Å; D915-I917 PolarHBondContact OD1-N 3.48Å; D915-Q918 HydrophobicContact CB-CB 3.94Å; D915-Q918 PolarHBondContact OD1-N 3.28Å; D915-Q918 WeakPolarHBondContact OD2-CB 3.26Å; D915-C919 WeakPolarHBondContact O-CB 3.5Å; D915-C919 PolarHBondContact O-N 2.83Å
916	K	92.4	Very high	94.2	Very high	80 Å²	80	37.7 Å²	37.7	35%	0.348	18%	0.18	S	C	.	.	H	α-helix	trans	-67.2	-35.9	177.4	-64.2	170.7	-177.4	168.4	0	113.4	R912 A920 K969 A973	R912-K916 HydrophobicContact CG-CG 4.45Å; R912-K916 WeakPolarHBondContact O-CG 3.34Å; K916-A920 VanDerWaalsContact O-CB 3.25Å; K916-A920 WeakPolarHBondContact O-CB 3.32Å; K916-A920 PolarHBondContact O-N 3.23Å; K916-A920 VanDerWaalsContact O-N 3.08Å; K916-K969 WeakPolarHBondContact CD-O 3.37Å; K916-K969 PolarHBondContact NZ-O 3.29Å; K916-A973 HydrophobicContact CB-CB 4.08Å; K916-A973 VanDerWaalsContact O-CB 3.24Å; K916-A973 WeakPolarHBondContact O-CB 3.26Å
917	I	93.9	Very high	94.4	Very high	53 Å²	53	35.1 Å²	35.1	27%	0.272	17%	0.167	S	C	.	.	H	α-helix	trans	-74.5	-48.9	-177.1	-59.5	173.6	0	0	0	108.3	D915 A920 K921 E972 A973 T976	D915-I917 WeakPolarHBondContact OD1-CA 3.41Å; D915-I917 WeakPolarHBondContact OD1-CB 3.44Å; D915-I917 PolarHBondContact OD1-N 3.48Å; I917-A920 PolarHBondContact O-N 3.24Å; I917-K921 PolarHBondContact O-N 2.8Å; I917-E972 HydrophobicContact CD1-CB 4.45Å; I917-E972 HydrophobicContact CD1-CG 3.83Å; I917-E972 HydrophobicContact CG1-CG 4.4Å; I917-A973 HydrophobicContact CG1-CB 4.31Å; I917-T976 HydrophobicContact CG2-CG2 4.15Å
918	Q	94.6	Very high	94.4	Very high	35 Å²	35	36.5 Å²	36.5	16%	0.164	17%	0.174	C	C	.	.	H	α-helix	trans	-65.6	-42.8	178.1	-171.5	59.2	14	0	0	111.8	M883 H884 D915 A920 K921 T922	M883-Q918 HydrophobicContact CB-CG 4.2Å; M883-Q918 HydrophobicContact CG-CG 4.42Å; M883-Q918 HydrophobicContact SD-CB 3.98Å; M883-Q918 HydrophobicContact SD-CG 3.77Å; H884-Q918 PolarHBondContact CD2-NE2 3.22Å; H884-Q918 PolarHBondContact CE1-NE2 2.79Å; H884-Q918 PolarHBondContact ND1-NE2 2.87Å; H884-Q918 PolarHBondContact NE2-NE2 3.47Å; D915-Q918 HydrophobicContact CB-CB 3.94Å; D915-Q918 PolarHBondContact OD1-N 3.28Å; D915-Q918 WeakPolarHBondContact OD2-CB 3.26Å; Q918-A920 VanDerWaalsContact C-N 3.3Å; Q918-A920 PolarHBondContact O-N 3.13Å; Q918-K921 WeakPolarHBondContact O-CA 3.43Å; Q918-K921 WeakPolarHBondContact O-CB 3.43Å; Q918-K921 PolarHBondContact O-N 3.45Å; Q918-T922 PolarHBondContact O-N 3.4Å; Q918-T922 PolarHBondContact O-OG1 2.92Å
919	C	94.6	Very high	94.5	Very high	1 Å²	1	37.9 Å²	37.9	1%	0.007	18%	0.18	C	C	.	.	H	α-helix	trans	-57.1	-41.7	171.8	-178.9	0	0	0	0	112	M883 R912 D915 K921 T922 L923	M883-C919 HydrophobicContact SD-CB 4.16Å; R912-C919 HydrophobicContact CB-CB 4.21Å; D915-C919 WeakPolarHBondContact O-CB 3.5Å; D915-C919 PolarHBondContact O-N 2.83Å; C919-K921 VanDerWaalsContact C-N 3.3Å; C919-K921 PolarHBondContact O-N 3.3Å; C919-T922 PolarHBondContact O-N 3.07Å; C919-L923 VanDerWaalsContact O-CG 3.28Å; C919-L923 WeakPolarHBondContact O-CG 3.41Å; C919-L923 PolarHBondContact O-N 3.13Å
920	A	94.8	Very high	94.5	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-66.5	-28.9	176.3	0	0	0	0	0	113.6	K916 I917 Q918 I924 F963 A973 L977	K916-A920 VanDerWaalsContact O-CB 3.25Å; K916-A920 WeakPolarHBondContact O-CB 3.32Å; K916-A920 PolarHBondContact O-N 3.23Å; K916-A920 VanDerWaalsContact O-N 3.08Å; I917-A920 PolarHBondContact O-N 3.24Å; Q918-A920 VanDerWaalsContact C-N 3.3Å; Q918-A920 PolarHBondContact O-N 3.13Å; A920-I924 PolarHBondContact O-N 2.93Å; A920-F963 HydrophobicContact CB-CE1 3.92Å; A920-F963 HydrophobicContact CB-CZ 3.75Å; A920-A973 HydrophobicContact CB-CB 3.88Å; A920-L977 HydrophobicContact CB-CB 4.3Å; A920-L977 HydrophobicContact CB-CD1 4.45Å
921	K	95.9	Very high	94.5	Very high	71 Å²	71	35.8 Å²	35.8	31%	0.309	17%	0.17	S	C	.	.	H	α-helix	trans	-70.3	-46	170	-69.2	-172.1	175.6	178	0	112.1	I917 Q918 C919 L923 I924 L925 T976 D980	I917-K921 PolarHBondContact O-N 2.8Å; Q918-K921 WeakPolarHBondContact O-CA 3.43Å; Q918-K921 WeakPolarHBondContact O-CB 3.43Å; Q918-K921 PolarHBondContact O-N 3.45Å; C919-K921 VanDerWaalsContact C-N 3.3Å; C919-K921 PolarHBondContact O-N 3.3Å; K921-L923 VanDerWaalsContact C-N 3.31Å; K921-L923 PolarHBondContact O-N 2.9Å; K921-I924 VanDerWaalsContact O-CG2 3.3Å; K921-I924 WeakPolarHBondContact O-CG2 3.38Å; K921-I924 PolarHBondContact O-N 2.97Å; K921-L925 WeakPolarHBondContact O-CB 3.29Å; K921-L925 PolarHBondContact O-N 2.87Å; K921-T976 HydrophobicContact CG-CG2 4.31Å; K921-D980 WeakPolarHBondContact CG-OD2 3.28Å
922	T	96.4	Very high	94.4	Very high	0 Å²	0	39 Å²	39	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-58.1	-44.1	174.6	-58.5	0	0	0	0	111	M883 A886 A887 F890 Q918 C919 I924 L925 S926	M883-T922 WeakPolarHBondContact O-CG2 3.41Å; M883-T922 PolarHBondContact O-OG1 3.46Å; A886-T922 HydrophobicContact CB-CG2 3.99Å; A887-T922 HydrophobicContact CB-CG2 3.86Å; A887-T922 VanDerWaalsContact N-CG2 3.29Å; F890-T922 HydrophobicContact CD2-CG2 3.72Å; F890-T922 HydrophobicContact CE2-CG2 3.68Å; Q918-T922 PolarHBondContact O-N 3.4Å; Q918-T922 PolarHBondContact O-OG1 2.92Å; C919-T922 PolarHBondContact O-N 3.07Å; T922-I924 PolarHBondContact O-N 2.78Å; T922-L925 WeakPolarHBondContact O-CB 3.32Å; T922-L925 PolarHBondContact O-N 3.48Å; T922-S926 PolarHBondContact O-N 2.94Å; T922-S926 PolarHBondContact O-OG 3.21Å; T922-S926 VanDerWaalsContact O-OG 3.05Å
923	L	96.2	Very high	94.4	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-63.4	-36.9	178.4	-71.5	170	0	0	0	113.7	F890 L908 C919 K921 F959 F963	F890-L923 HydrophobicContact CB-CD2 4.42Å; F890-L923 HydrophobicContact CD2-CD2 3.6Å; F890-L923 HydrophobicContact CD2-CG 4.22Å; F890-L923 HydrophobicContact CE2-CD2 4.14Å; F890-L923 HydrophobicContact CE2-CG 4.46Å; F890-L923 HydrophobicContact CG-CD2 4.21Å; L908-L923 HydrophobicContact CD1-CD2 3.63Å; L908-L923 HydrophobicContact CG-CD2 4.03Å; C919-L923 VanDerWaalsContact O-CG 3.28Å; C919-L923 WeakPolarHBondContact O-CG 3.41Å; C919-L923 PolarHBondContact O-N 3.13Å; K921-L923 VanDerWaalsContact C-N 3.31Å; K921-L923 PolarHBondContact O-N 2.9Å; L923-F959 HydrophobicContact CB-CD2 4.21Å; L923-F959 HydrophobicContact CD2-CD1 3.88Å; L923-F959 HydrophobicContact CD2-CD2 3.76Å; L923-F959 HydrophobicContact CD2-CE1 3.85Å; L923-F959 HydrophobicContact CD2-CE2 3.75Å; L923-F959 HydrophobicContact CD2-CG 3.83Å; L923-F959 HydrophobicContact CD2-CZ 3.79Å; L923-F963 HydrophobicContact CD1-CZ 4.35Å
924	I	96.4	Very high	94.3	Very high	2 Å²	2	33.6 Å²	33.6	1%	0.01	17%	0.165	C	C	.	.	H	α-helix	trans	-76.9	-31.9	174.3	-159.6	65.5	0	0	0	111.6	A920 K921 T922 L927 Q928 L977 D980 F1003 L1007 F1010	A920-I924 PolarHBondContact O-N 2.93Å; K921-I924 VanDerWaalsContact O-CG2 3.3Å; K921-I924 WeakPolarHBondContact O-CG2 3.38Å; K921-I924 PolarHBondContact O-N 2.97Å; T922-I924 PolarHBondContact O-N 2.78Å; I924-L927 HydrophobicContact CD1-CD1 4.13Å; I924-L927 PolarHBondContact O-N 2.61Å; I924-Q928 VanDerWaalsContact O-CG 3.23Å; I924-Q928 WeakPolarHBondContact O-CG 3.32Å; I924-Q928 PolarHBondContact O-N 3.42Å; I924-L977 HydrophobicContact CB-CD1 4.39Å; I924-L977 HydrophobicContact CB-CG 4.05Å; I924-L977 HydrophobicContact CD1-CD2 4.38Å; I924-L977 HydrophobicContact CD1-CG 4.23Å; I924-L977 HydrophobicContact CG1-CG 4.34Å; I924-D980 HydrophobicContact CG2-CB 4.1Å; I924-F1003 HydrophobicContact CD1-CE1 3.82Å; I924-F1003 HydrophobicContact CD1-CZ 3.63Å; I924-F1003 HydrophobicContact CG1-CE1 4.17Å; I924-F1003 HydrophobicContact CG1-CZ 4.1Å; I924-L1007 HydrophobicContact CD1-CD1 3.86Å; I924-F1010 HydrophobicContact CD1-CE2 4.48Å
925	L	96.7	Very high	94.1	Very high	52 Å²	52	30.3 Å²	30.3	27%	0.272	15%	0.149	S	C	.	.	H	α-helix	trans	-61	-42.6	172.4	-178.1	59	0	0	0	111.6	A887 K921 T922 L927 Q928 Q929	A887-L925 HydrophobicContact CB-CB 3.99Å; A887-L925 HydrophobicContact CB-CD2 3.8Å; A887-L925 HydrophobicContact CB-CG 3.74Å; K921-L925 WeakPolarHBondContact O-CB 3.29Å; K921-L925 PolarHBondContact O-N 2.87Å; T922-L925 WeakPolarHBondContact O-CB 3.32Å; T922-L925 PolarHBondContact O-N 3.48Å; L925-L927 VanDerWaalsContact C-N 3.31Å; L925-L927 PolarHBondContact O-N 2.9Å; L925-Q928 CarbonylContact O-C 3.59Å; L925-Q928 WeakPolarHBondContact O-CB 3.41Å; L925-Q928 PolarHBondContact O-N 2.84Å; L925-Q928 VanDerWaalsContact O-N 3.11Å; L925-Q929 WeakPolarHBondContact O-CG 3.31Å; L925-Q929 PolarHBondContact O-N 2.83Å
926	S	97.1	Very high	93.9	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-53.9	-45.6	172.6	-55.9	0	0	0	0	112.9	A887 F890 T922 Q929 L930	A887-S926 VanDerWaalsContact CA-OG 3.23Å; A887-S926 WeakPolarHBondContact CA-OG 3.24Å; A887-S926 WeakPolarHBondContact O-CB 3.45Å; A887-S926 PolarHBondContact O-OG 3.07Å; F890-S926 WeakPolarHBondContact CB-OG 3.48Å; T922-S926 PolarHBondContact O-N 2.94Å; T922-S926 PolarHBondContact O-OG 3.21Å; T922-S926 VanDerWaalsContact O-OG 3.05Å; S926-Q929 PolarHBondContact O-N 2.92Å; S926-L930 PolarHBondContact O-N 3.44Å; S926-L930 VanDerWaalsContact O-N 3.12Å
927	L	96.7	Very high	93.6	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-71.7	-33.6	179.6	-66.2	169.6	0	0	0	111.4	I924 L925 F931 I952 L955 A956 F959 F1003 V1006 F1010	I924-L927 HydrophobicContact CD1-CD1 4.13Å; I924-L927 PolarHBondContact O-N 2.61Å; L925-L927 VanDerWaalsContact C-N 3.31Å; L925-L927 PolarHBondContact O-N 2.9Å; L927-F931 VanDerWaalsContact O-CB 3.26Å; L927-F931 WeakPolarHBondContact O-CB 3.45Å; L927-F931 PolarHBondContact O-N 2.67Å; L927-I952 HydrophobicContact CD2-CG2 3.94Å; L927-L955 HydrophobicContact CD2-CB 4.37Å; L927-L955 HydrophobicContact CD2-CD2 3.99Å; L927-L955 HydrophobicContact CD2-CG 4.09Å; L927-A956 HydrophobicContact CD1-CB 3.77Å; L927-A956 HydrophobicContact CD2-CB 4.11Å; L927-F959 HydrophobicContact CD1-CD2 4Å; L927-F959 HydrophobicContact CD2-CD2 4.35Å; L927-F959 HydrophobicContact CD2-CE2 4.29Å; L927-F959 HydrophobicContact CG-CD2 4.12Å; L927-F959 HydrophobicContact CG-CE2 4.15Å; L927-F1003 HydrophobicContact CB-CE2 3.92Å; L927-F1003 HydrophobicContact CB-CZ 3.98Å; L927-F1003 WeakPolarHBondContact O-CE2 3.43Å; L927-V1006 HydrophobicContact CB-CG1 4.38Å; L927-V1006 HydrophobicContact CD1-CG1 4.13Å; L927-V1006 HydrophobicContact CD2-CG1 4.23Å; L927-V1006 HydrophobicContact CG-CG1 4.5Å; L927-F1010 HydrophobicContact CD1-CE2 3.62Å; L927-F1010 HydrophobicContact CD1-CZ 3.69Å
928	Q	95.6	Very high	93.1	Very high	29 Å²	29	39.6 Å²	39.6	14%	0.136	19%	0.191	C	C	.	.	H	α-helix	trans	-67.2	-39.1	173.1	-70.2	175.6	29.7	0	0	111.7	I924 L925 F931 N932 D980 F984 F1003	I924-Q928 VanDerWaalsContact O-CG 3.23Å; I924-Q928 WeakPolarHBondContact O-CG 3.32Å; I924-Q928 PolarHBondContact O-N 3.42Å; L925-Q928 CarbonylContact O-C 3.59Å; L925-Q928 WeakPolarHBondContact O-CB 3.41Å; L925-Q928 PolarHBondContact O-N 2.84Å; L925-Q928 VanDerWaalsContact O-N 3.11Å; Q928-F931 PolarHBondContact O-N 3.32Å; Q928-N932 PolarHBondContact O-N 2.89Å; Q928-N932 PolarHBondContact O-ND2 2.98Å; Q928-D980 PolarHBondContact NE2-O 3.07Å; Q928-F984 HydrophobicContact CB-CD2 3.94Å; Q928-F984 HydrophobicContact CB-CE1 4.35Å; Q928-F984 HydrophobicContact CB-CE2 3.75Å; Q928-F984 HydrophobicContact CB-CG 4.33Å; Q928-F984 HydrophobicContact CB-CZ 3.93Å; Q928-F984 HydrophobicContact CG-CB 4.05Å; Q928-F984 HydrophobicContact CG-CD1 3.79Å; Q928-F984 HydrophobicContact CG-CD2 3.6Å; Q928-F984 HydrophobicContact CG-CE1 4.04Å; Q928-F984 HydrophobicContact CG-CE2 3.88Å; Q928-F984 HydrophobicContact CG-CG 3.53Å; Q928-F984 HydrophobicContact CG-CZ 4.07Å; Q928-F984 VanDerWaalsContact OE1-CD2 3.24Å; Q928-F1003 HydrophobicContact CG-CE1 4.06Å; Q928-F1003 HydrophobicContact CG-CE2 4.21Å; Q928-F1003 HydrophobicContact CG-CZ 3.67Å
929	Q	94.8	Very high	92.4	Very high	34 Å²	34	39 Å²	39	16%	0.159	19%	0.193	C	C	.	.	H	α-helix	trans	-60.1	-57.8	174.5	-74.6	167.3	-39.8	0	0	110.7	A887 D888 K891 L925 S926 F931 N932 E933	A887-Q929 VanDerWaalsContact CB-OE1 3.28Å; D888-Q929 PolarHBondContact OD1-NE2 3.04Å; D888-Q929 VanDerWaalsContact OD1-NE2 3.12Å; D888-Q929 PolarHBondContact OD2-NE2 3.18Å; K891-Q929 HydrophobicContact CD-CB 4.34Å; L925-Q929 WeakPolarHBondContact O-CG 3.31Å; L925-Q929 PolarHBondContact O-N 2.83Å; S926-Q929 PolarHBondContact O-N 2.92Å; Q929-F931 PolarHBondContact O-N 3.19Å; Q929-N932 PolarHBondContact O-N 3.18Å; Q929-E933 WeakPolarHBondContact O-CG 3.47Å; Q929-E933 PolarHBondContact O-N 3.21Å
930	L	93.3	Very high	91.3	Very high	32 Å²	32	42.7 Å²	42.7	17%	0.168	22%	0.217	C	C	.	.	H	α-helix	trans	-53.1	-39.2	175.3	-71.5	168	0	0	0	113.2	K891 S926 E933 L934 I952 L955	K891-L930 HydrophobicContact CB-CD1 3.77Å; K891-L930 HydrophobicContact CB-CD2 4.01Å; K891-L930 HydrophobicContact CB-CG 3.69Å; K891-L930 HydrophobicContact CD-CD2 4.49Å; S926-L930 PolarHBondContact O-N 3.44Å; S926-L930 VanDerWaalsContact O-N 3.12Å; L930-E933 WeakPolarHBondContact CA-OE2 3.45Å; L930-L934 VanDerWaalsContact O-CB 3.29Å; L930-L934 WeakPolarHBondContact O-CB 3.28Å; L930-L934 PolarHBondContact O-N 2.87Å; L930-I952 HydrophobicContact CB-CD1 3.91Å; L930-I952 HydrophobicContact CB-CG1 4.1Å; L930-L955 HydrophobicContact CD1-CD2 3.45Å; L930-L955 VanDerWaalsContact CD1-CD2 3.45Å
931	F	92.5	Very high	90.4	Very high	6 Å²	6	49.7 Å²	49.7	3%	0.026	26%	0.255	C	S	.	.	H	α-helix	trans	-70.2	-36.8	178.1	-172.7	-86	0	0	0	112.3	L927 Q928 Q929 V935 L942 F984 N1000 A1002 F1003	L927-F931 VanDerWaalsContact O-CB 3.26Å; L927-F931 WeakPolarHBondContact O-CB 3.45Å; L927-F931 PolarHBondContact O-N 2.67Å; Q928-F931 PolarHBondContact O-N 3.32Å; Q929-F931 PolarHBondContact O-N 3.19Å; F931-V935 HydrophobicContact CD1-CG2 4.04Å; F931-V935 HydrophobicContact CE1-CG2 3.62Å; F931-V935 HydrophobicContact CZ-CG2 4.02Å; F931-V935 WeakPolarHBondContact O-CB 3.43Å; F931-V935 VanDerWaalsContact O-CG2 3.25Å; F931-V935 WeakPolarHBondContact O-CG2 3.42Å; F931-V935 PolarHBondContact O-N 3.28Å; F931-L942 HydrophobicContact CD2-CD1 4.39Å; F931-L942 HydrophobicContact CE2-CD1 3.73Å; F931-L942 HydrophobicContact CZ-CD1 3.94Å; F931-F984 HydrophobicContact CB-CE1 4.45Å; F931-F984 AromaticContact CD1-CE1 3.68Å; F931-F984 HydrophobicContact CD1-CE1 3.68Å; F931-F984 AromaticContact CD1-CZ 3.88Å; F931-F984 HydrophobicContact CD1-CZ 3.88Å; F931-F984 HydrophobicContact CE1-CE1 4.3Å; F931-F984 HydrophobicContact CG-CE1 4.26Å; F931-N1000 HydrophobicContact CE1-CB 4.27Å; F931-A1002 HydrophobicContact CE2-CB 4.07Å; F931-A1002 HydrophobicContact CZ-CB 4.04Å; F931-F1003 HydrophobicContact CB-CD2 3.84Å; F931-F1003 HydrophobicContact CB-CE2 4.18Å; F931-F1003 HydrophobicContact CD1-CD2 4.39Å; F931-F1003 HydrophobicContact CD2-CB 4.28Å; F931-F1003 AromaticContact CD2-CD2 3.86Å; F931-F1003 HydrophobicContact CD2-CD2 3.86Å; F931-F1003 HydrophobicContact CE1-CB 4.42Å; F931-F1003 HydrophobicContact CE2-CB 4.18Å; F931-F1003 HydrophobicContact CG-CB 4.44Å; F931-F1003 AromaticContact CG-CD2 3.76Å; F931-F1003 HydrophobicContact CG-CD2 3.76Å; F931-F1003 HydrophobicContact CZ-CB 4.26Å
932	N	93.1	Very high	89.5	Confident	67 Å²	67	47.4 Å²	47.4	36%	0.358	25%	0.246	S	C	.	.	H	α-helix	trans	-69.3	-42.3	174.2	-66.2	-45.4	0	0	0	111.5	Q928 Q929 V935 Q936 F984	Q928-N932 PolarHBondContact O-N 2.89Å; Q928-N932 PolarHBondContact O-ND2 2.98Å; Q929-N932 PolarHBondContact O-N 3.18Å; N932-V935 PolarHBondContact O-N 3.36Å; N932-Q936 WeakPolarHBondContact O-CB 3.2Å; N932-Q936 PolarHBondContact O-N 3.44Å; N932-F984 WeakPolarHBondContact OD1-CE2 3.46Å; N932-F984 WeakPolarHBondContact OD1-CZ 3.45Å
933	E	91.2	Very high	88.8	Confident	69 Å²	69	51.6 Å²	51.6	32%	0.322	27%	0.268	S	S	.	.	H	α-helix	trans	-55.3	-52.3	174.9	-69.6	159.3	-168.5	0	0	109.7	K891 Q929 L930 V935 Q936 E937	K891-E933 IonicContact NZ-OE1 3.47Å; K891-E933 PolarHBondContact NZ-OE1 3.31Å; Q929-E933 WeakPolarHBondContact O-CG 3.47Å; Q929-E933 PolarHBondContact O-N 3.21Å; L930-E933 WeakPolarHBondContact CA-OE2 3.45Å; E933-V935 PolarHBondContact O-N 2.95Å; E933-Q936 WeakPolarHBondContact O-CB 3.48Å; E933-Q936 PolarHBondContact O-N 3.37Å; E933-Q936 VanDerWaalsContact O-N 3.07Å; E933-E937 PolarHBondContact O-N 2.81Å
934	L	89.1	Confident	87.7	Confident	8 Å²	8	55.2 Å²	55.2	4%	0.042	28%	0.282	C	S	.	.	H	α-helix	trans	-61.5	-38.7	177	-175.9	60.5	0	0	0	113.7	L930 Q936 Q938 L942 H948 V949 I952	L930-L934 VanDerWaalsContact O-CB 3.29Å; L930-L934 WeakPolarHBondContact O-CB 3.28Å; L930-L934 PolarHBondContact O-N 2.87Å; L934-Q936 VanDerWaalsContact C-N 3.33Å; L934-Q938 VanDerWaalsContact CD1-CD 3.45Å; L934-Q938 HydrophobicContact CD1-CG 4.01Å; L934-Q938 WeakPolarHBondContact O-CB 3.49Å; L934-Q938 PolarHBondContact O-N 3.16Å; L934-L942 HydrophobicContact CD2-CD1 4.04Å; L934-L942 HydrophobicContact CD2-CD2 4.41Å; L934-L942 HydrophobicContact CG-CD1 4.26Å; L934-L942 HydrophobicContact CG-CD2 3.91Å; L934-H948 HydrophobicContact CD1-CB 3.56Å; L934-H948 HydrophobicContact CD2-CB 3.98Å; L934-H948 HydrophobicContact CG-CB 4.45Å; L934-V949 HydrophobicContact CD2-CG2 3.76Å; L934-I952 HydrophobicContact CB-CD1 4.4Å; L934-I952 HydrophobicContact CD2-CD1 3.75Å
935	V	87.8	Confident	86.8	Confident	29 Å²	29	61 Å²	61	18%	0.176	32%	0.317	C	S	.	.	H	α-helix	trans	-71.5	-26.4	175.1	166.8	0	0	0	0	112.3	F931 N932 E933 G939 L942	F931-V935 HydrophobicContact CD1-CG2 4.04Å; F931-V935 HydrophobicContact CE1-CG2 3.62Å; F931-V935 HydrophobicContact CZ-CG2 4.02Å; F931-V935 WeakPolarHBondContact O-CB 3.43Å; F931-V935 VanDerWaalsContact O-CG2 3.25Å; F931-V935 WeakPolarHBondContact O-CG2 3.42Å; F931-V935 PolarHBondContact O-N 3.28Å; N932-V935 PolarHBondContact O-N 3.36Å; E933-V935 PolarHBondContact O-N 2.95Å; V935-G939 CarbonylContact O-C 3.56Å; V935-G939 WeakPolarHBondContact O-CA 3.21Å; V935-G939 PolarHBondContact O-N 3.1Å; V935-L942 HydrophobicContact CG2-CD1 3.83Å; V935-L942 HydrophobicContact CG2-CD2 4.24Å; V935-L942 HydrophobicContact CG2-CG 4.08Å
936	Q	88.6	Confident	86.2	Confident	175 Å²	175	59.3 Å²	59.3	82%	0.818	31%	0.31	S	S	*	.	H	α-helix	trans	-74.5	-38.2	175.1	-179.3	171.7	-42.7	0	0	111.5	N932 E933 L934	N932-Q936 WeakPolarHBondContact O-CB 3.2Å; N932-Q936 PolarHBondContact O-N 3.44Å; E933-Q936 WeakPolarHBondContact O-CB 3.48Å; E933-Q936 PolarHBondContact O-N 3.37Å; E933-Q936 VanDerWaalsContact O-N 3.07Å; L934-Q936 VanDerWaalsContact C-N 3.33Å
937	E	85.9	Confident	85.6	Confident	142 Å²	142	63.2 Å²	63.2	66%	0.664	34%	0.343	S	S	*	.	H	α-helix	trans	-72.5	-52.6	175.1	-69.1	174	-177.6	0	0	113	E933	E933-E937 PolarHBondContact O-N 2.81Å
938	Q	84.3	Confident	85	Confident	80 Å²	80	68.2 Å²	68.2	37%	0.374	37%	0.366	S	S	.	.	H	α-helix	trans	-101.5	-7.2	-167.9	-56.5	-172.9	6.5	0	0	113.4	L934 L942	L934-Q938 VanDerWaalsContact CD1-CD 3.45Å; L934-Q938 HydrophobicContact CD1-CG 4.01Å; L934-Q938 WeakPolarHBondContact O-CB 3.49Å; L934-Q938 PolarHBondContact O-N 3.16Å; Q938-L942 HydrophobicContact CB-CD2 3.88Å
939	G	78.7	Confident	84.4	Confident	21 Å²	21	67.4 Å²	67.4	22%	0.216	36%	0.363	C	S	.	.			trans	80.1	175.8	-175.1	0	0	0	0	0	113.9	V935 N941 L942	V935-G939 CarbonylContact O-C 3.56Å; V935-G939 WeakPolarHBondContact O-CA 3.21Å; V935-G939 PolarHBondContact O-N 3.1Å; G939-N941 PolarHBondContact O-N 2.96Å; G939-N941 VanDerWaalsContact O-N 3.15Å; G939-L942 WeakPolarHBondContact O-CD2 3.44Å
940	P	72.9	Confident	84.1	Confident	79 Å²	79	69.4 Å²	69.4	51%	0.513	38%	0.38	S	S	.	.	S	Bend	trans	-75.1	-1.6	-172.7	31.1	-37.5	0	0	0	115	P999	P940-P999 HydrophobicContact CB-CB 4.08Å
941	N	75	Confident	83.9	Confident	148 Å²	148	69.3 Å²	69.3	79%	0.791	39%	0.387	S	S	*	.	S	Bend	trans	-104.5	54.5	-179.9	-70.1	-15.3	0	0	0	110.6	G939 D943	G939-N941 PolarHBondContact O-N 2.96Å; G939-N941 VanDerWaalsContact O-N 3.15Å; N941-D943 PolarHBondContact O-N 3.19Å
942	L	78.1	Confident	83.9	Confident	22 Å²	22	69.7 Å²	69.7	12%	0.115	39%	0.39	C	S	.	.			trans	-57	135.9	-176.4	-61.7	-177.9	0	0	0	112.7	F931 L934 V935 Q938 G939 R944 V949	F931-L942 HydrophobicContact CD2-CD1 4.39Å; F931-L942 HydrophobicContact CE2-CD1 3.73Å; F931-L942 HydrophobicContact CZ-CD1 3.94Å; L934-L942 HydrophobicContact CD2-CD1 4.04Å; L934-L942 HydrophobicContact CD2-CD2 4.41Å; L934-L942 HydrophobicContact CG-CD1 4.26Å; L934-L942 HydrophobicContact CG-CD2 3.91Å; V935-L942 HydrophobicContact CG2-CD1 3.83Å; V935-L942 HydrophobicContact CG2-CD2 4.24Å; V935-L942 HydrophobicContact CG2-CG 4.08Å; Q938-L942 HydrophobicContact CB-CD2 3.88Å; G939-L942 WeakPolarHBondContact O-CD2 3.44Å; L942-R944 PolarHBondContact O-N 3.4Å; L942-V949 HydrophobicContact CB-CG2 4.32Å; L942-V949 HydrophobicContact CD1-CG2 4.19Å
943	D	80.1	Confident	83.9	Confident	88 Å²	88	68.9 Å²	68.9	47%	0.471	38%	0.383	S	S	.	.			trans	-72.2	113.1	163.5	-178.7	0.5	0	0	0	109.3	N941 T945 S946 V949	N941-D943 PolarHBondContact O-N 3.19Å; D943-T945 VanDerWaalsContact CG-OG1 3.32Å; D943-T945 PolarHBondContact O-N 3.27Å; D943-T945 WeakPolarHBondContact OD1-CB 3.44Å; D943-T945 PolarHBondContact OD1-N 2.66Å; D943-T945 PolarHBondContact OD1-OG1 2.92Å; D943-T945 PolarHBondContact OD2-OG1 3Å; D943-S946 VanDerWaalsContact O-CB 3.26Å; D943-S946 WeakPolarHBondContact O-CB 3.15Å; D943-S946 PolarHBondContact O-N 2.66Å; D943-S946 VanDerWaalsContact O-N 3.12Å; D943-S946 PolarHBondContact O-OG 2.8Å; D943-V949 WeakPolarHBondContact O-CG2 3.34Å
944	R	74.3	Confident	83.9	Confident	76 Å²	76	67.7 Å²	67.7	29%	0.287	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-9.8	-179.3	-63.6	173.7	-68	133.4	-1.4	113.4	L942 E1005 D1040	L942-R944 PolarHBondContact O-N 3.4Å; R944-E1005 WeakPolarHBondContact CD-OE1 3.39Å; R944-E1005 IonicContact NH1-OE1 3.29Å; R944-E1005 PolarHBondContact NH1-OE1 3.25Å; R944-D1040 PolarHBondContact NH1-O 3.31Å; R944-D1040 PolarHBondContact NH2-O 3.03Å; R944-D1040 VanDerWaalsContact NH2-O 3.11Å
945	T	77.6	Confident	84.2	Confident	123 Å²	123	67.5 Å²	67.5	76%	0.755	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.1	-3.7	171.6	66.8	0	0	0	0	113.4	D943	D943-T945 VanDerWaalsContact CG-OG1 3.32Å; D943-T945 PolarHBondContact O-N 3.27Å; D943-T945 WeakPolarHBondContact OD1-CB 3.44Å; D943-T945 PolarHBondContact OD1-N 2.66Å; D943-T945 PolarHBondContact OD1-OG1 2.92Å; D943-T945 PolarHBondContact OD2-OG1 3Å
946	S	84.4	Confident	84.5	Confident	18 Å²	18	66.1 Å²	66.1	13%	0.126	37%	0.368	C	S	.	.	S	Bend	trans	-65.1	148	177.6	68.2	0	0	0	0	113	D943 H948 V949 S950	D943-S946 VanDerWaalsContact O-CB 3.26Å; D943-S946 WeakPolarHBondContact O-CB 3.15Å; D943-S946 PolarHBondContact O-N 2.66Å; D943-S946 VanDerWaalsContact O-N 3.12Å; D943-S946 PolarHBondContact O-OG 2.8Å; S946-H948 PolarHBondContact O-N 3.34Å; S946-V949 PolarHBondContact O-N 2.83Å; S946-V949 WeakPolarHBondContact OG-CG2 3.11Å; S946-V949 PolarHBondContact OG-N 3.15Å; S946-S950 PolarHBondContact O-N 2.85Å
947	A	83.9	Confident	84.8	Confident	82 Å²	82	63 Å²	63	68%	0.678	35%	0.349	S	S	*	.	H	α-helix	trans	-57.5	-34.9	176.7	0	0	0	0	0	112.6	S950 G951	A947-S950 PolarHBondContact O-N 2.93Å; A947-G951 PolarHBondContact O-N 2.79Å
948	H	83.3	Confident	85	Confident	105 Å²	105	59.9 Å²	59.9	49%	0.486	33%	0.331	S	S	.	.	H	α-helix	trans	-64.5	-48.9	178.6	-56.7	-100	0	0	0	111.9	L934 S946 S950 G951 I952	L934-H948 HydrophobicContact CD1-CB 3.56Å; L934-H948 HydrophobicContact CD2-CB 3.98Å; L934-H948 HydrophobicContact CG-CB 4.45Å; S946-H948 PolarHBondContact O-N 3.34Å; H948-S950 VanDerWaalsContact C-N 3.31Å; H948-S950 PolarHBondContact O-N 2.89Å; H948-G951 PolarHBondContact O-N 3.44Å; H948-I952 PolarHBondContact O-N 2.99Å; H948-I952 VanDerWaalsContact O-N 3.14Å
949	V	84.5	Confident	85.5	Confident	12 Å²	12	56 Å²	56	7%	0.073	31%	0.313	C	S	.	.	H	α-helix	trans	-62.9	-39.7	175.3	174.9	0	0	0	0	110.8	L934 L942 D943 S946 G951 I952 K953	L934-V949 HydrophobicContact CD2-CG2 3.76Å; L942-V949 HydrophobicContact CB-CG2 4.32Å; L942-V949 HydrophobicContact CD1-CG2 4.19Å; D943-V949 WeakPolarHBondContact O-CG2 3.34Å; S946-V949 PolarHBondContact O-N 2.83Å; S946-V949 WeakPolarHBondContact OG-CG2 3.11Å; S946-V949 PolarHBondContact OG-N 3.15Å; V949-G951 VanDerWaalsContact C-N 3.34Å; V949-G951 PolarHBondContact O-N 2.79Å; V949-I952 PolarHBondContact O-N 3.09Å; V949-K953 HydrophobicContact CG1-CD 4.1Å; V949-K953 WeakPolarHBondContact O-CG 3.35Å; V949-K953 PolarHBondContact O-N 3.04Å; V949-K953 VanDerWaalsContact O-N 3.14Å
950	S	87.4	Confident	86.2	Confident	75 Å²	75	55.2 Å²	55.2	52%	0.524	30%	0.304	S	S	.	.	H	α-helix	trans	-64.5	-36.1	175.8	-164.3	0	0	0	0	112.8	S946 A947 H948 K953 E954	S946-S950 PolarHBondContact O-N 2.85Å; A947-S950 PolarHBondContact O-N 2.93Å; H948-S950 VanDerWaalsContact C-N 3.31Å; H948-S950 PolarHBondContact O-N 2.89Å; S950-K953 PolarHBondContact O-N 2.97Å; S950-E954 PolarHBondContact O-N 3.09Å
951	G	89.2	Confident	87	Confident	31 Å²	31	56.2 Å²	56.2	32%	0.32	30%	0.304	S	S	.	.	H	α-helix	trans	-64.5	-45.3	176.5	0	0	0	0	0	112.7	A947 H948 V949 K953 E954 L955	A947-G951 PolarHBondContact O-N 2.79Å; H948-G951 PolarHBondContact O-N 3.44Å; V949-G951 VanDerWaalsContact C-N 3.34Å; V949-G951 PolarHBondContact O-N 2.79Å; G951-K953 VanDerWaalsContact C-N 3.28Å; G951-K953 PolarHBondContact O-N 2.81Å; G951-E954 PolarHBondContact O-N 3.14Å; G951-L955 PolarHBondContact O-N 2.82Å
952	I	92.5	Very high	87.5	Confident	14 Å²	14	50.5 Å²	50.5	7%	0.072	28%	0.275	C	S	.	.	H	α-helix	trans	-62.7	-36.7	175.2	-59.6	173.5	0	0	0	110.8	L927 L930 L934 H948 V949 L955 A956 V1006	L927-I952 HydrophobicContact CD2-CG2 3.94Å; L930-I952 HydrophobicContact CB-CD1 3.91Å; L930-I952 HydrophobicContact CB-CG1 4.1Å; L934-I952 HydrophobicContact CB-CD1 4.4Å; L934-I952 HydrophobicContact CD2-CD1 3.75Å; H948-I952 PolarHBondContact O-N 2.99Å; H948-I952 VanDerWaalsContact O-N 3.14Å; V949-I952 PolarHBondContact O-N 3.09Å; I952-L955 PolarHBondContact O-N 3.33Å; I952-A956 WeakPolarHBondContact O-CB 3.47Å; I952-A956 PolarHBondContact O-N 3.46Å; I952-V1006 HydrophobicContact CG2-CG1 3.82Å; I952-V1006 HydrophobicContact CG2-CG2 3.84Å
953	K	92.4	Very high	87.8	Confident	49 Å²	49	49.9 Å²	49.9	21%	0.213	27%	0.271	C	S	.	.	H	α-helix	trans	-68.3	-42.4	175.5	-70.4	171.4	69.4	174.7	0	112.6	V949 S950 G951 A956 R957 E1005 V1006	V949-K953 HydrophobicContact CG1-CD 4.1Å; V949-K953 WeakPolarHBondContact O-CG 3.35Å; V949-K953 PolarHBondContact O-N 3.04Å; V949-K953 VanDerWaalsContact O-N 3.14Å; S950-K953 PolarHBondContact O-N 2.97Å; G951-K953 VanDerWaalsContact C-N 3.28Å; G951-K953 PolarHBondContact O-N 2.81Å; K953-A956 PolarHBondContact O-N 2.9Å; K953-R957 WeakPolarHBondContact O-CB 3.36Å; K953-R957 PolarHBondContact O-N 3.43Å; K953-E1005 HydrophobicContact CD-CB 4.29Å; K953-E1005 IonicContact NZ-OE2 3.56Å; K953-E1005 PolarHBondContact NZ-OE2 3.43Å; K953-V1006 HydrophobicContact CG-CG2 4Å
954	E	92.1	Very high	87.7	Confident	44 Å²	44	47.3 Å²	47.3	21%	0.206	27%	0.265	C	S	.	.	H	α-helix	trans	-64.6	-38.2	174	171.5	59.2	-170.7	0	0	111.9	M894 S950 G951 R957 R958	M894-E954 HydrophobicContact CE-CB 4.15Å; M894-E954 HydrophobicContact CE-CG 3.49Å; M894-E954 VanDerWaalsContact CE-CG 3.49Å; M894-E954 HydrophobicContact SD-CB 4.22Å; M894-E954 HydrophobicContact SD-CG 3.69Å; S950-E954 PolarHBondContact O-N 3.09Å; G951-E954 PolarHBondContact O-N 3.14Å; E954-R957 PolarHBondContact O-N 3.5Å; E954-R957 IonicContact OE1-CZ 2.66Å; E954-R957 IonicContact OE1-NH2 3.57Å; E954-R957 PolarHBondContact OE1-NH2 3.15Å; E954-R957 IonicContact OE2-CZ 2.7Å; E954-R957 IonicContact OE2-NE 2.74Å; E954-R957 PolarHBondContact OE2-NE 2.77Å; E954-R957 IonicContact OE2-NH2 3.48Å; E954-R957 PolarHBondContact OE2-NH2 2.86Å; E954-R958 WeakPolarHBondContact O-CG 3.4Å; E954-R958 PolarHBondContact O-N 3.16Å; E954-R958 IonicContact OE1-CZ 3.75Å; E954-R958 IonicContact OE1-NE 3.86Å; E954-R958 PolarHBondContact OE1-NE 3.35Å; E954-R958 IonicContact OE1-NH2 2.75Å; E954-R958 PolarHBondContact OE1-NH2 2.87Å; E954-R958 VanDerWaalsContact OE1-NH2 3.09Å
955	L	94.5	Very high	87.8	Confident	4 Å²	4	51.5 Å²	51.5	2%	0.021	29%	0.293	C	S	.	.	H	α-helix	trans	-62.2	-46	173.1	-179.1	62.4	0	0	0	111.3	Y893 M894 L927 L930 G951 I952 R957 R958 F959	Y893-L955 HydrophobicContact CD1-CD1 3.83Å; Y893-L955 HydrophobicContact CG-CD1 4.46Å; M894-L955 HydrophobicContact CB-CD1 4.35Å; M894-L955 HydrophobicContact CG-CD1 3.94Å; M894-L955 VanDerWaalsContact SD-CA 3.59Å; M894-L955 HydrophobicContact SD-CB 3.83Å; M894-L955 HydrophobicContact SD-CD1 4.27Å; M894-L955 PolarHBondContact SD-N 3.44Å; L927-L955 HydrophobicContact CD2-CB 4.37Å; L927-L955 HydrophobicContact CD2-CD2 3.99Å; L927-L955 HydrophobicContact CD2-CG 4.09Å; L930-L955 HydrophobicContact CD1-CD2 3.45Å; L930-L955 VanDerWaalsContact CD1-CD2 3.45Å; G951-L955 PolarHBondContact O-N 2.82Å; I952-L955 PolarHBondContact O-N 3.33Å; L955-R957 VanDerWaalsContact C-N 3.34Å; L955-R957 PolarHBondContact O-N 2.76Å; L955-R958 PolarHBondContact O-N 3.17Å; L955-F959 HydrophobicContact CD1-CD1 4.17Å; L955-F959 HydrophobicContact CD1-CE1 3.62Å; L955-F959 HydrophobicContact CD1-CE2 4.23Å; L955-F959 HydrophobicContact CD1-CZ 3.65Å; L955-F959 HydrophobicContact CD2-CE2 4.24Å; L955-F959 HydrophobicContact CD2-CZ 4.17Å; L955-F959 HydrophobicContact CG-CD2 4.39Å; L955-F959 HydrophobicContact CG-CE1 4.25Å; L955-F959 HydrophobicContact CG-CE2 3.97Å; L955-F959 HydrophobicContact CG-CZ 3.89Å; L955-F959 WeakPolarHBondContact O-CG 3.38Å; L955-F959 PolarHBondContact O-N 3.07Å
956	A	95.3	Very high	87.9	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-60.7	-40.5	174.6	0	0	0	0	0	112.7	L927 I952 K953 F959 A960 V1006 E1009 F1010	L927-A956 HydrophobicContact CD1-CB 3.77Å; L927-A956 HydrophobicContact CD2-CB 4.11Å; I952-A956 WeakPolarHBondContact O-CB 3.47Å; I952-A956 PolarHBondContact O-N 3.46Å; K953-A956 PolarHBondContact O-N 2.9Å; A956-F959 PolarHBondContact O-N 3.4Å; A956-A960 WeakPolarHBondContact O-CB 3.37Å; A956-A960 PolarHBondContact O-N 3.39Å; A956-V1006 HydrophobicContact CB-CG1 3.56Å; A956-E1009 HydrophobicContact CB-CB 4.35Å; A956-E1009 HydrophobicContact CB-CG 4.26Å; A956-F1010 HydrophobicContact CB-CE2 3.7Å; A956-F1010 HydrophobicContact CB-CZ 4.17Å; A956-F1010 WeakPolarHBondContact O-CZ 3.42Å
957	R	93.7	Very high	87.7	Confident	111 Å²	111	51 Å²	51	42%	0.419	28%	0.282	S	S	.	.	H	α-helix	trans	-62.3	-42.2	174.1	-165.8	-173.2	67.7	92.8	5.3	111.5	K953 E954 L955 A960 L961 E1009	K953-R957 WeakPolarHBondContact O-CB 3.36Å; K953-R957 PolarHBondContact O-N 3.43Å; E954-R957 PolarHBondContact O-N 3.5Å; E954-R957 IonicContact OE1-CZ 2.66Å; E954-R957 IonicContact OE1-NH2 3.57Å; E954-R957 PolarHBondContact OE1-NH2 3.15Å; E954-R957 IonicContact OE2-CZ 2.7Å; E954-R957 IonicContact OE2-NE 2.74Å; E954-R957 PolarHBondContact OE2-NE 2.77Å; E954-R957 IonicContact OE2-NH2 3.48Å; E954-R957 PolarHBondContact OE2-NH2 2.86Å; L955-R957 VanDerWaalsContact C-N 3.34Å; L955-R957 PolarHBondContact O-N 2.76Å; R957-A960 WeakPolarHBondContact O-CB 3.5Å; R957-A960 PolarHBondContact O-N 3.49Å; R957-L961 PolarHBondContact O-N 3.35Å; R957-E1009 HydrophobicContact CB-CB 4.39Å; R957-E1009 HydrophobicContact CB-CG 4.28Å
958	R	91.8	Very high	87.7	Confident	75 Å²	75	53.4 Å²	53.4	28%	0.283	28%	0.282	S	S	.	.	H	α-helix	trans	-63.5	-45.4	173.7	-71.9	179	-175.4	-142.1	-2.3	112	Y893 E954 L955 A960 L961	Y893-R958 HydrophobicContact CE1-CB 4.41Å; E954-R958 WeakPolarHBondContact O-CG 3.4Å; E954-R958 PolarHBondContact O-N 3.16Å; E954-R958 IonicContact OE1-CZ 3.75Å; E954-R958 IonicContact OE1-NE 3.86Å; E954-R958 PolarHBondContact OE1-NE 3.35Å; E954-R958 IonicContact OE1-NH2 2.75Å; E954-R958 PolarHBondContact OE1-NH2 2.87Å; E954-R958 VanDerWaalsContact OE1-NH2 3.09Å; L955-R958 PolarHBondContact O-N 3.17Å; R958-A960 VanDerWaalsContact C-N 3.32Å; R958-A960 PolarHBondContact O-N 2.85Å; R958-L961 WeakPolarHBondContact O-CB 3.48Å; R958-L961 PolarHBondContact O-N 3.21Å; R958-L961 VanDerWaalsContact O-N 3.16Å
959	F	94.6	Very high	87.7	Confident	0 Å²	0	55 Å²	55	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-60.3	-39.6	173.8	-71.5	-9.7	0	0	0	112.1	F890 Y893 L908 L923 L927 L955 A956 L961 T962 F1010	F890-F959 HydrophobicContact CB-CZ 4Å; F890-F959 WeakPolarHBondContact O-CZ 3.44Å; Y893-F959 AromaticContact CD1-CE1 3.95Å; Y893-F959 HydrophobicContact CD1-CE1 3.95Å; L908-F959 HydrophobicContact CD1-CD1 4.07Å; L908-F959 HydrophobicContact CD1-CE1 3.99Å; L923-F959 HydrophobicContact CB-CD2 4.21Å; L923-F959 HydrophobicContact CD2-CD1 3.88Å; L923-F959 HydrophobicContact CD2-CD2 3.76Å; L923-F959 HydrophobicContact CD2-CE1 3.85Å; L923-F959 HydrophobicContact CD2-CE2 3.75Å; L923-F959 HydrophobicContact CD2-CG 3.83Å; L923-F959 HydrophobicContact CD2-CZ 3.79Å; L927-F959 HydrophobicContact CD1-CD2 4Å; L927-F959 HydrophobicContact CD2-CD2 4.35Å; L927-F959 HydrophobicContact CD2-CE2 4.29Å; L927-F959 HydrophobicContact CG-CD2 4.12Å; L927-F959 HydrophobicContact CG-CE2 4.15Å; L955-F959 HydrophobicContact CD1-CD1 4.17Å; L955-F959 HydrophobicContact CD1-CE1 3.62Å; L955-F959 HydrophobicContact CD1-CE2 4.23Å; L955-F959 HydrophobicContact CD1-CZ 3.65Å; L955-F959 HydrophobicContact CD2-CE2 4.24Å; L955-F959 HydrophobicContact CD2-CZ 4.17Å; L955-F959 HydrophobicContact CG-CD2 4.39Å; L955-F959 HydrophobicContact CG-CE1 4.25Å; L955-F959 HydrophobicContact CG-CE2 3.97Å; L955-F959 HydrophobicContact CG-CZ 3.89Å; L955-F959 WeakPolarHBondContact O-CG 3.38Å; L955-F959 PolarHBondContact O-N 3.07Å; A956-F959 PolarHBondContact O-N 3.4Å; F959-L961 VanDerWaalsContact C-N 3.27Å; F959-L961 PolarHBondContact O-N 3.37Å; F959-T962 WeakPolarHBondContact O-CB 3.31Å; F959-T962 WeakPolarHBondContact O-CG2 3.41Å; F959-T962 PolarHBondContact O-N 3.31Å; F959-T962 PolarHBondContact O-OG1 3.4Å; F959-F1010 HydrophobicContact CB-CE1 3.85Å; F959-F1010 HydrophobicContact CB-CZ 3.79Å
960	A	91.9	Very high	87.7	Confident	3 Å²	3	55.1 Å²	55.1	3%	0.025	29%	0.288	C	S	.	.	H	α-helix	trans	-59.8	-36	176.1	0	0	0	0	0	112.3	A956 R957 R958 T962 F963 F1010 K1013	A956-A960 WeakPolarHBondContact O-CB 3.37Å; A956-A960 PolarHBondContact O-N 3.39Å; R957-A960 WeakPolarHBondContact O-CB 3.5Å; R957-A960 PolarHBondContact O-N 3.49Å; R958-A960 VanDerWaalsContact C-N 3.32Å; R958-A960 PolarHBondContact O-N 2.85Å; A960-T962 PolarHBondContact O-N 3.2Å; A960-F963 PolarHBondContact O-N 3.39Å; A960-F1010 HydrophobicContact CB-CD1 3.67Å; A960-F1010 HydrophobicContact CB-CE1 4.01Å; A960-F1010 HydrophobicContact CB-CG 4.21Å; A960-K1013 HydrophobicContact CB-CG 4.44Å; A960-K1013 WeakPolarHBondContact O-CE 3.39Å
961	L	90.5	Very high	87.9	Confident	100 Å²	100	55.6 Å²	55.6	52%	0.524	28%	0.278	S	S	.	.	H	α-helix	trans	-63.2	-27.9	175.2	-63.9	175.5	0	0	0	113	R957 R958 F959 F963 G964	R957-L961 PolarHBondContact O-N 3.35Å; R958-L961 WeakPolarHBondContact O-CB 3.48Å; R958-L961 PolarHBondContact O-N 3.21Å; R958-L961 VanDerWaalsContact O-N 3.16Å; F959-L961 VanDerWaalsContact C-N 3.27Å; F959-L961 PolarHBondContact O-N 3.37Å; L961-F963 PolarHBondContact O-N 3.16Å; L961-F963 VanDerWaalsContact O-N 3.16Å; L961-G964 PolarHBondContact O-N 3.3Å
962	T	86.3	Confident	88	Confident	29 Å²	29	60.3 Å²	60.3	18%	0.178	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-18	-178.2	74.5	0	0	0	0	114.1	L908 R912 F959 A960 G964	L908-T962 HydrophobicContact CD1-CG2 4.18Å; L908-T962 HydrophobicContact CD2-CG2 3.75Å; R912-T962 WeakPolarHBondContact CD-O 3.31Å; R912-T962 PolarHBondContact NH1-O 2.9Å; F959-T962 WeakPolarHBondContact O-CB 3.31Å; F959-T962 WeakPolarHBondContact O-CG2 3.41Å; F959-T962 PolarHBondContact O-N 3.31Å; F959-T962 PolarHBondContact O-OG1 3.4Å; A960-T962 PolarHBondContact O-N 3.2Å; T962-G964 PolarHBondContact O-N 2.98Å
963	F	84.3	Confident	88	Confident	8 Å²	8	59.8 Å²	59.8	4%	0.035	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-1.7	172.8	-63.1	-72.5	0	0	0	113.8	A920 L923 A960 L961 T970 A973 V974 L977 F1010	A920-F963 HydrophobicContact CB-CE1 3.92Å; A920-F963 HydrophobicContact CB-CZ 3.75Å; L923-F963 HydrophobicContact CD1-CZ 4.35Å; A960-F963 PolarHBondContact O-N 3.39Å; L961-F963 PolarHBondContact O-N 3.16Å; L961-F963 VanDerWaalsContact O-N 3.16Å; F963-T970 HydrophobicContact CB-CG2 4.16Å; F963-T970 HydrophobicContact CD1-CG2 4Å; F963-T970 WeakPolarHBondContact O-CG2 3.49Å; F963-T970 PolarHBondContact O-OG1 3.16Å; F963-A973 HydrophobicContact CE1-CB 4.16Å; F963-V974 HydrophobicContact CB-CG2 4.15Å; F963-V974 HydrophobicContact CD1-CG2 3.72Å; F963-V974 HydrophobicContact CD2-CG2 3.94Å; F963-V974 HydrophobicContact CE1-CG2 4.08Å; F963-V974 HydrophobicContact CE2-CG2 4.27Å; F963-V974 HydrophobicContact CG-CG2 3.65Å; F963-V974 HydrophobicContact CZ-CG2 4.34Å; F963-L977 HydrophobicContact CE2-CD1 4.09Å; F963-L977 HydrophobicContact CZ-CD1 4.07Å; F963-F1010 HydrophobicContact CE2-CD1 4.04Å; F963-F1010 HydrophobicContact CE2-CE1 4.03Å
964	G	77.6	Confident	88.1	Confident	34 Å²	34	57.5 Å²	57.5	35%	0.351	28%	0.28	S	S	.	.			trans	71.9	-152.7	171.9	0	0	0	0	0	114.8	L961 T962 K1013	L961-G964 PolarHBondContact O-N 3.3Å; T962-G964 PolarHBondContact O-N 2.98Å; G964-K1013 PolarHBondContact O-NZ 3.41Å
965	L	75.3	Confident	88.2	Confident	165 Å²	165	56 Å²	56	86%	0.864	28%	0.275	S	S	*	.	S	Bend	trans	-105.4	-24.5	176.2	-62.6	177.9	0	0	0	113.1	Q967	L965-Q967 VanDerWaalsContact C-N 3.29Å; L965-Q967 PolarHBondContact O-N 3.4Å
966	D	80.3	Confident	88.2	Confident	62 Å²	62	56.6 Å²	56.6	33%	0.332	28%	0.279	S	S	.	.			trans	-78.5	78.5	177.2	-171.3	-22	0	0	0	110.5	I968 K969 T970	D966-I968 PolarHBondContact O-N 3.2Å; D966-I968 VanDerWaalsContact O-N 3.16Å; D966-I968 WeakPolarHBondContact OD1-CB 3.43Å; D966-I968 PolarHBondContact OD1-N 3.44Å; D966-K969 HydrophobicContact CB-CB 4.38Å; D966-K969 PolarHBondContact O-N 2.89Å; D966-K969 PolarHBondContact OD1-N 3.04Å; D966-K969 VanDerWaalsContact OD2-CD 3.26Å; D966-K969 WeakPolarHBondContact OD2-CD 3.47Å; D966-K969 WeakPolarHBondContact OD2-CE 3.42Å; D966-K969 VanDerWaalsContact OD2-CG 3.31Å; D966-K969 WeakPolarHBondContact OD2-CG 3.48Å; D966-K969 IonicContact OD2-NZ 3.14Å; D966-K969 PolarHBondContact OD2-NZ 3.37Å; D966-T970 PolarHBondContact O-OG1 3.26Å
967	Q	80.6	Confident	88.2	Confident	67 Å²	67	56.6 Å²	56.6	31%	0.313	28%	0.279	S	S	.	.	S	Bend	trans	-57.3	-26.3	178.1	-64.7	-174.6	-12.6	0	0	112.5	L965 T970 R971 S1012 L1015	L965-Q967 VanDerWaalsContact C-N 3.29Å; L965-Q967 PolarHBondContact O-N 3.4Å; Q967-T970 PolarHBondContact O-N 3.21Å; Q967-R971 WeakPolarHBondContact O-CA 3.44Å; Q967-R971 WeakPolarHBondContact O-CB 3.16Å; Q967-R971 PolarHBondContact O-N 3.19Å; Q967-S1012 PolarHBondContact NE2-O 3.3Å; Q967-L1015 HydrophobicContact CB-CD1 3.77Å; Q967-L1015 HydrophobicContact CB-CG 4.01Å; Q967-L1015 WeakPolarHBondContact O-CD1 3.36Å
968	I	82.8	Confident	88.4	Confident	134 Å²	134	51.3 Å²	51.3	69%	0.687	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-43.6	-179.6	-61.2	169.2	0	0	0	109.8	D966 T970 L1015	D966-I968 PolarHBondContact O-N 3.2Å; D966-I968 VanDerWaalsContact O-N 3.16Å; D966-I968 WeakPolarHBondContact OD1-CB 3.43Å; D966-I968 PolarHBondContact OD1-N 3.44Å; I968-T970 PolarHBondContact O-N 2.86Å; I968-L1015 HydrophobicContact CG1-CD2 4.43Å
969	K	83.3	Confident	88.6	Confident	138 Å²	138	51 Å²	51	60%	0.6	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-9.7	178.8	-75.7	-170.4	-171	106.5	0	115.1	K916 D966	K916-K969 WeakPolarHBondContact CD-O 3.37Å; K916-K969 PolarHBondContact NZ-O 3.29Å; D966-K969 HydrophobicContact CB-CB 4.38Å; D966-K969 PolarHBondContact O-N 2.89Å; D966-K969 PolarHBondContact OD1-N 3.04Å; D966-K969 VanDerWaalsContact OD2-CD 3.26Å; D966-K969 WeakPolarHBondContact OD2-CD 3.47Å; D966-K969 WeakPolarHBondContact OD2-CE 3.42Å; D966-K969 VanDerWaalsContact OD2-CG 3.31Å; D966-K969 WeakPolarHBondContact OD2-CG 3.48Å; D966-K969 IonicContact OD2-NZ 3.14Å; D966-K969 PolarHBondContact OD2-NZ 3.37Å
970	T	86.3	Confident	88.6	Confident	14 Å²	14	53 Å²	53	9%	0.086	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-124.7	-3.1	-178.6	50.8	0	0	0	0	114.1	F963 D966 Q967 I968 E972 A973 V974	F963-T970 HydrophobicContact CB-CG2 4.16Å; F963-T970 HydrophobicContact CD1-CG2 4Å; F963-T970 WeakPolarHBondContact O-CG2 3.49Å; F963-T970 PolarHBondContact O-OG1 3.16Å; D966-T970 PolarHBondContact O-OG1 3.26Å; Q967-T970 PolarHBondContact O-N 3.21Å; I968-T970 PolarHBondContact O-N 2.86Å; T970-E972 PolarHBondContact O-N 3.25Å; T970-A973 WeakPolarHBondContact O-CB 3.49Å; T970-A973 PolarHBondContact O-N 3.33Å; T970-A973 VanDerWaalsContact O-N 3.12Å; T970-V974 PolarHBondContact O-N 2.88Å
971	R	90.9	Very high	88.8	Confident	85 Å²	85	52.9 Å²	52.9	32%	0.321	27%	0.27	S	S	.	.	H	α-helix	trans	-39	-56.4	-178.8	177.1	174.1	-175	161.9	12.8	114.7	Q967 A975 L1015 D1018	Q967-R971 WeakPolarHBondContact O-CA 3.44Å; Q967-R971 WeakPolarHBondContact O-CB 3.16Å; Q967-R971 PolarHBondContact O-N 3.19Å; R971-A975 WeakPolarHBondContact O-CB 3.37Å; R971-A975 PolarHBondContact O-N 2.9Å; R971-L1015 HydrophobicContact CB-CD1 3.88Å; R971-L1015 HydrophobicContact CG-CD1 3.87Å; R971-D1018 IonicContact CZ-OD1 3.98Å; R971-D1018 VanDerWaalsContact CZ-OD1 3.24Å; R971-D1018 IonicContact CZ-OD2 3.08Å; R971-D1018 VanDerWaalsContact CZ-OD2 3.25Å; R971-D1018 IonicContact NE-OD1 2.91Å; R971-D1018 PolarHBondContact NE-OD1 2.84Å; R971-D1018 IonicContact NE-OD2 3.86Å; R971-D1018 PolarHBondContact NE-OD2 3.2Å; R971-D1018 VanDerWaalsContact NH2-CG 3.34Å; R971-D1018 IonicContact NH2-OD1 2.96Å; R971-D1018 PolarHBondContact NH2-OD1 3.38Å; R971-D1018 IonicContact NH2-OD2 3.68Å; R971-D1018 PolarHBondContact NH2-OD2 2.9Å
972	E	91.4	Very high	89.1	Confident	131 Å²	131	48.1 Å²	48.1	61%	0.612	25%	0.245	S	C	*	.	H	α-helix	trans	-73.1	-34.2	-173	-174.8	162.6	-152	0	0	112.9	I917 T970 T976	I917-E972 HydrophobicContact CD1-CB 4.45Å; I917-E972 HydrophobicContact CD1-CG 3.83Å; I917-E972 HydrophobicContact CG1-CG 4.4Å; T970-E972 PolarHBondContact O-N 3.25Å; E972-T976 WeakPolarHBondContact O-CB 3.45Å; E972-T976 PolarHBondContact O-N 3.36Å; E972-T976 PolarHBondContact O-OG1 2.75Å
973	A	92.9	Very high	89.5	Confident	2 Å²	2	50.6 Å²	50.6	2%	0.017	25%	0.254	C	S	.	.	H	α-helix	trans	-64.6	-50.5	174.6	0	0	0	0	0	111.1	K916 I917 A920 F963 T970 A975 T976 L977	K916-A973 HydrophobicContact CB-CB 4.08Å; K916-A973 VanDerWaalsContact O-CB 3.24Å; K916-A973 WeakPolarHBondContact O-CB 3.26Å; I917-A973 HydrophobicContact CG1-CB 4.31Å; A920-A973 HydrophobicContact CB-CB 3.88Å; F963-A973 HydrophobicContact CE1-CB 4.16Å; T970-A973 WeakPolarHBondContact O-CB 3.49Å; T970-A973 PolarHBondContact O-N 3.33Å; T970-A973 VanDerWaalsContact O-N 3.12Å; A973-A975 PolarHBondContact O-N 3.01Å; A973-T976 PolarHBondContact O-N 3.45Å; A973-T976 VanDerWaalsContact O-N 3.13Å; A973-L977 WeakPolarHBondContact O-CB 3.35Å; A973-L977 PolarHBondContact O-N 3.13Å
974	V	93.6	Very high	90.1	Very high	1 Å²	1	50.6 Å²	50.6	1%	0.006	25%	0.254	C	S	.	.	H	α-helix	trans	-64.5	-39.5	177.2	-178.8	0	0	0	0	111.2	F963 T970 T976 H978 K1013 L1014	F963-V974 HydrophobicContact CB-CG2 4.15Å; F963-V974 HydrophobicContact CD1-CG2 3.72Å; F963-V974 HydrophobicContact CD2-CG2 3.94Å; F963-V974 HydrophobicContact CE1-CG2 4.08Å; F963-V974 HydrophobicContact CE2-CG2 4.27Å; F963-V974 HydrophobicContact CG-CG2 3.65Å; F963-V974 HydrophobicContact CZ-CG2 4.34Å; T970-V974 PolarHBondContact O-N 2.88Å; V974-T976 VanDerWaalsContact C-N 3.26Å; V974-T976 PolarHBondContact O-N 2.75Å; V974-H978 PolarHBondContact O-CD2 3.18Å; V974-H978 PolarHBondContact O-N 2.63Å; V974-H978 VanDerWaalsContact O-N 3.15Å; V974-K1013 HydrophobicContact CG1-CB 4.11Å; V974-K1013 HydrophobicContact CG2-CB 4.32Å; V974-L1014 HydrophobicContact CG1-CD2 3.87Å; V974-L1014 HydrophobicContact CG1-CG 4.01Å
975	A	94.1	Very high	90.8	Very high	13 Å²	13	49 Å²	49	11%	0.107	24%	0.237	C	C	.	.	H	α-helix	trans	-68.5	-21.8	175.4	0	0	0	0	0	113.8	R971 A973 K979 L1014	R971-A975 WeakPolarHBondContact O-CB 3.37Å; R971-A975 PolarHBondContact O-N 2.9Å; A973-A975 PolarHBondContact O-N 3.01Å; A975-K979 WeakPolarHBondContact O-CE 3.3Å; A975-K979 WeakPolarHBondContact O-CG 3.39Å; A975-L1014 HydrophobicContact CB-CD2 4.28Å
976	T	94.6	Very high	91.6	Very high	16 Å²	16	42.4 Å²	42.4	10%	0.098	20%	0.202	C	C	.	.	H	α-helix	trans	-83.9	-48	174.3	-59.3	0	0	0	0	110.6	I917 K921 E972 A973 V974 H978 K979 D980	I917-T976 HydrophobicContact CG2-CG2 4.15Å; K921-T976 HydrophobicContact CG-CG2 4.31Å; E972-T976 WeakPolarHBondContact O-CB 3.45Å; E972-T976 PolarHBondContact O-N 3.36Å; E972-T976 PolarHBondContact O-OG1 2.75Å; A973-T976 PolarHBondContact O-N 3.45Å; A973-T976 VanDerWaalsContact O-N 3.13Å; V974-T976 VanDerWaalsContact C-N 3.26Å; V974-T976 PolarHBondContact O-N 2.75Å; T976-H978 PolarHBondContact O-N 3.23Å; T976-K979 WeakPolarHBondContact O-CB 3.45Å; T976-K979 PolarHBondContact O-N 3.17Å; T976-D980 PolarHBondContact O-N 3.19Å; T976-D980 VanDerWaalsContact O-N 3.07Å; T976-D980 VanDerWaalsContact O-OD1 3.06Å
977	L	96.1	Very high	92.1	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-46.3	-40.4	170.7	174.6	149.7	0	0	0	112.7	A920 I924 F963 A973 G981 L1007 F1010	A920-L977 HydrophobicContact CB-CB 4.3Å; A920-L977 HydrophobicContact CB-CD1 4.45Å; I924-L977 HydrophobicContact CB-CD1 4.39Å; I924-L977 HydrophobicContact CB-CG 4.05Å; I924-L977 HydrophobicContact CD1-CD2 4.38Å; I924-L977 HydrophobicContact CD1-CG 4.23Å; I924-L977 HydrophobicContact CG1-CG 4.34Å; F963-L977 HydrophobicContact CE2-CD1 4.09Å; F963-L977 HydrophobicContact CZ-CD1 4.07Å; A973-L977 WeakPolarHBondContact O-CB 3.35Å; A973-L977 PolarHBondContact O-N 3.13Å; L977-G981 PolarHBondContact O-N 3.35Å; L977-L1007 HydrophobicContact CD2-CD1 3.87Å; L977-F1010 HydrophobicContact CD1-CD1 3.79Å; L977-F1010 HydrophobicContact CD1-CE1 3.68Å; L977-F1010 HydrophobicContact CD1-CG 4.31Å; L977-F1010 HydrophobicContact CD1-CZ 4.09Å; L977-F1010 HydrophobicContact CD2-CB 3.74Å; L977-F1010 HydrophobicContact CD2-CD1 3.83Å; L977-F1010 HydrophobicContact CD2-CD2 3.83Å; L977-F1010 HydrophobicContact CD2-CE1 4.38Å; L977-F1010 HydrophobicContact CD2-CE2 4.36Å; L977-F1010 HydrophobicContact CD2-CG 3.52Å
978	H	96.4	Very high	92.3	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-72	-31.6	175.6	-78.7	-62.5	0	0	0	115.4	V974 T976 I982 L1007 L1014 V1022 Y1048	V974-H978 PolarHBondContact O-CD2 3.18Å; V974-H978 PolarHBondContact O-N 2.63Å; V974-H978 VanDerWaalsContact O-N 3.15Å; T976-H978 PolarHBondContact O-N 3.23Å; H978-I982 WeakPolarHBondContact O-CB 3.43Å; H978-I982 VanDerWaalsContact O-CD1 3.28Å; H978-I982 WeakPolarHBondContact O-CD1 3.35Å; H978-I982 WeakPolarHBondContact O-CG1 3.47Å; H978-I982 PolarHBondContact O-N 2.93Å; H978-I982 VanDerWaalsContact O-N 3.07Å; H978-L1007 PolarHBondContact CE1-O 3.28Å; H978-L1007 VanDerWaalsContact CE1-O 3.24Å; H978-L1007 WeakPolarHBondContact ND1-CG 3.45Å; H978-L1014 VanDerWaalsContact CD2-CD1 3.4Å; H978-L1014 WeakPolarHBondContact CD2-CD1 3.27Å; H978-V1022 HydrophobicContact CB-CG1 3.78Å; H978-V1022 HydrophobicContact CB-CG2 4.08Å; H978-Y1048 AromaticContact CE1-CE2 3.96Å; H978-Y1048 AromaticContact ND1-CE2 3.79Å; H978-Y1048 AromaticContact ND1-CZ 3.83Å; H978-Y1048 PolarHBondContact ND1-OH 3.22Å
979	K	96	Very high	92.3	Very high	69 Å²	69	48.9 Å²	48.9	30%	0.3	22%	0.221	S	C	.	.	H	α-helix	trans	-68	-51.6	174.4	-65.4	165.5	-163.9	159.2	0	109.9	A975 T976 G981 I982 E983 Y1025	A975-K979 WeakPolarHBondContact O-CE 3.3Å; A975-K979 WeakPolarHBondContact O-CG 3.39Å; T976-K979 WeakPolarHBondContact O-CB 3.45Å; T976-K979 PolarHBondContact O-N 3.17Å; K979-G981 VanDerWaalsContact C-N 3.27Å; K979-G981 PolarHBondContact O-N 2.69Å; K979-I982 WeakPolarHBondContact O-CB 3.26Å; K979-I982 PolarHBondContact O-N 2.75Å; K979-E983 PolarHBondContact O-N 3.44Å; K979-Y1025 HydrophobicContact CB-CD1 4.15Å; K979-Y1025 HydrophobicContact CB-CE1 3.76Å; K979-Y1025 HydrophobicContact CG-CD1 3.91Å; K979-Y1025 HydrophobicContact CG-CE1 3.85Å; K979-Y1025 HydrophobicContact CG-CG 4.28Å
980	D	96.1	Very high	92.1	Very high	43 Å²	43	44.4 Å²	44.4	23%	0.23	20%	0.204	C	C	.	.	H	α-helix	trans	-62.4	-37.4	-176.6	-60.4	28.1	0	0	0	110.3	K921 I924 Q928 T976 F984	K921-D980 WeakPolarHBondContact CG-OD2 3.28Å; I924-D980 HydrophobicContact CG2-CB 4.1Å; Q928-D980 PolarHBondContact NE2-O 3.07Å; T976-D980 PolarHBondContact O-N 3.19Å; T976-D980 VanDerWaalsContact O-N 3.07Å; T976-D980 VanDerWaalsContact O-OD1 3.06Å; D980-F984 WeakPolarHBondContact O-CB 3.49Å; D980-F984 PolarHBondContact O-N 3Å
981	G	96.1	Very high	91.6	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-69.9	-34.3	171.8	0	0	0	0	0	115.2	L977 K979 A985	L977-G981 PolarHBondContact O-N 3.35Å; K979-G981 VanDerWaalsContact C-N 3.27Å; K979-G981 PolarHBondContact O-N 2.69Å; G981-A985 PolarHBondContact O-N 3.42Å; G981-A985 VanDerWaalsContact O-N 3.12Å
982	I	96.1	Very high	90.8	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-67	-46.7	171.6	-73.9	163.7	0	0	0	109.8	H978 K979 F984 A985 F986 L1007 V1022 Y1025 L1026 F1029 Y1048	H978-I982 WeakPolarHBondContact O-CB 3.43Å; H978-I982 VanDerWaalsContact O-CD1 3.28Å; H978-I982 WeakPolarHBondContact O-CD1 3.35Å; H978-I982 WeakPolarHBondContact O-CG1 3.47Å; H978-I982 PolarHBondContact O-N 2.93Å; H978-I982 VanDerWaalsContact O-N 3.07Å; K979-I982 WeakPolarHBondContact O-CB 3.26Å; K979-I982 PolarHBondContact O-N 2.75Å; I982-F984 VanDerWaalsContact C-N 3.29Å; I982-F984 PolarHBondContact O-N 3.15Å; I982-A985 PolarHBondContact O-N 3.1Å; I982-A985 VanDerWaalsContact O-N 3.11Å; I982-F986 HydrophobicContact CG2-CD2 3.98Å; I982-F986 HydrophobicContact CG2-CE2 4.23Å; I982-F986 VanDerWaalsContact O-CD2 3.27Å; I982-F986 WeakPolarHBondContact O-CD2 3.4Å; I982-F986 PolarHBondContact O-N 2.98Å; I982-F986 VanDerWaalsContact O-N 3.14Å; I982-L1007 HydrophobicContact CG1-CD2 4.1Å; I982-V1022 HydrophobicContact CD1-CG1 3.89Å; I982-Y1025 HydrophobicContact CD1-CD1 4.43Å; I982-Y1025 HydrophobicContact CG2-CD1 4.47Å; I982-L1026 HydrophobicContact CD1-CB 3.98Å; I982-L1026 HydrophobicContact CD1-CD1 4.45Å; I982-L1026 HydrophobicContact CG1-CD1 4.29Å; I982-L1026 HydrophobicContact CG2-CD1 4.21Å; I982-F1029 HydrophobicContact CG2-CD2 3.61Å; I982-F1029 HydrophobicContact CG2-CE2 3.73Å; I982-F1029 HydrophobicContact CG2-CG 4.22Å; I982-F1029 HydrophobicContact CG2-CZ 4.41Å; I982-Y1048 HydrophobicContact CD1-CE1 4.05Å; I982-Y1048 HydrophobicContact CG1-CE1 3.95Å
983	E	95.9	Very high	89.8	Confident	81 Å²	81	51.9 Å²	51.9	38%	0.379	25%	0.248	S	C	.	.	H	α-helix	trans	-60.4	-39.1	179.1	-76.6	172.7	-145.1	0	0	111.7	K979 K987 Y1025 F1029	K979-E983 PolarHBondContact O-N 3.44Å; E983-K987 WeakPolarHBondContact O-CA 3.47Å; E983-K987 WeakPolarHBondContact O-CB 3.41Å; E983-K987 PolarHBondContact O-N 3.19Å; E983-Y1025 HydrophobicContact CG-CE1 4.33Å; E983-Y1025 WeakPolarHBondContact OE1-CE1 3.44Å; E983-Y1025 VanDerWaalsContact OE1-CZ 3.32Å; E983-Y1025 PolarHBondContact OE1-OH 2.95Å; E983-F1029 HydrophobicContact CG-CE1 4.21Å; E983-F1029 HydrophobicContact CG-CZ 3.68Å
984	F	95.1	Very high	88.5	Confident	7 Å²	7	58 Å²	58	3%	0.031	28%	0.276	C	S	.	.	H	α-helix	trans	-62.8	-46	171	178.8	-98.5	0	0	0	113.3	Q928 F931 N932 D980 I982 F986 K987 N1000 F1003	Q928-F984 HydrophobicContact CB-CD2 3.94Å; Q928-F984 HydrophobicContact CB-CE1 4.35Å; Q928-F984 HydrophobicContact CB-CE2 3.75Å; Q928-F984 HydrophobicContact CB-CG 4.33Å; Q928-F984 HydrophobicContact CB-CZ 3.93Å; Q928-F984 HydrophobicContact CG-CB 4.05Å; Q928-F984 HydrophobicContact CG-CD1 3.79Å; Q928-F984 HydrophobicContact CG-CD2 3.6Å; Q928-F984 HydrophobicContact CG-CE1 4.04Å; Q928-F984 HydrophobicContact CG-CE2 3.88Å; Q928-F984 HydrophobicContact CG-CG 3.53Å; Q928-F984 HydrophobicContact CG-CZ 4.07Å; Q928-F984 VanDerWaalsContact OE1-CD2 3.24Å; F931-F984 HydrophobicContact CB-CE1 4.45Å; F931-F984 AromaticContact CD1-CE1 3.68Å; F931-F984 HydrophobicContact CD1-CE1 3.68Å; F931-F984 AromaticContact CD1-CZ 3.88Å; F931-F984 HydrophobicContact CD1-CZ 3.88Å; F931-F984 HydrophobicContact CE1-CE1 4.3Å; F931-F984 HydrophobicContact CG-CE1 4.26Å; N932-F984 WeakPolarHBondContact OD1-CE2 3.46Å; N932-F984 WeakPolarHBondContact OD1-CZ 3.45Å; D980-F984 WeakPolarHBondContact O-CB 3.49Å; D980-F984 PolarHBondContact O-N 3Å; I982-F984 VanDerWaalsContact C-N 3.29Å; I982-F984 PolarHBondContact O-N 3.15Å; F984-F986 PolarHBondContact O-N 3.02Å; F984-K987 VanDerWaalsContact O-CB 3.3Å; F984-K987 WeakPolarHBondContact O-CB 3.49Å; F984-K987 PolarHBondContact O-N 2.89Å; F984-N1000 HydrophobicContact CD1-CB 4.32Å; F984-N1000 HydrophobicContact CE1-CB 4.14Å; F984-N1000 VanDerWaalsContact CE1-ND2 3.34Å; F984-N1000 WeakPolarHBondContact CE1-ND2 3.43Å; F984-N1000 WeakPolarHBondContact CE2-ND2 3.49Å; F984-N1000 WeakPolarHBondContact CZ-ND2 3.25Å; F984-N1000 WeakPolarHBondContact O-CB 3.42Å; F984-F1003 HydrophobicContact CD1-CB 4.03Å; F984-F1003 AromaticContact CD1-CD1 3.54Å; F984-F1003 HydrophobicContact CD1-CD1 3.54Å; F984-F1003 HydrophobicContact CD1-CD2 4.13Å; F984-F1003 AromaticContact CD1-CE1 3.96Å; F984-F1003 HydrophobicContact CD1-CE1 3.96Å; F984-F1003 AromaticContact CD1-CG 3.62Å; F984-F1003 HydrophobicContact CD1-CG 3.62Å; F984-F1003 HydrophobicContact CD1-CZ 4.43Å; F984-F1003 HydrophobicContact CE1-CB 3.99Å; F984-F1003 HydrophobicContact CE1-CD1 4.1Å; F984-F1003 AromaticContact CE1-CD2 3.84Å; F984-F1003 HydrophobicContact CE1-CD2 3.84Å; F984-F1003 HydrophobicContact CE1-CE2 4.32Å; F984-F1003 AromaticContact CE1-CG 3.7Å; F984-F1003 HydrophobicContact CE1-CG 3.7Å
985	A	93.1	Very high	87.2	Confident	0 Å²	0	63.6 Å²	63.6	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-62.1	-27.7	-178.8	0	0	0	0	0	113.5	G981 I982 L1004	G981-A985 PolarHBondContact O-N 3.42Å; G981-A985 VanDerWaalsContact O-N 3.12Å; I982-A985 PolarHBondContact O-N 3.1Å; I982-A985 VanDerWaalsContact O-N 3.11Å; A985-L1004 HydrophobicContact CB-CD2 3.6Å; A985-L1004 HydrophobicContact CB-CG 3.82Å
986	F	92.1	Very high	86.4	Confident	27 Å²	27	68.6 Å²	68.6	12%	0.118	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.8	8.6	178.3	-62.7	-73	0	0	0	114.3	I982 F984 Y988 P998 L1001 L1004 L1026 F1029 L1030 M1034 L1045	I982-F986 HydrophobicContact CG2-CD2 3.98Å; I982-F986 HydrophobicContact CG2-CE2 4.23Å; I982-F986 VanDerWaalsContact O-CD2 3.27Å; I982-F986 WeakPolarHBondContact O-CD2 3.4Å; I982-F986 PolarHBondContact O-N 2.98Å; I982-F986 VanDerWaalsContact O-N 3.14Å; F984-F986 PolarHBondContact O-N 3.02Å; F986-Y988 PolarHBondContact O-N 2.84Å; F986-Y988 VanDerWaalsContact O-N 3.17Å; F986-P998 HydrophobicContact CD1-CG 3.82Å; F986-P998 HydrophobicContact CE1-CG 4.05Å; F986-L1001 HydrophobicContact CE1-CD1 3.69Å; F986-L1001 HydrophobicContact CZ-CD1 3.77Å; F986-L1004 HydrophobicContact CE2-CD1 4.27Å; F986-L1004 HydrophobicContact CZ-CD1 4.13Å; F986-L1026 HydrophobicContact CE2-CD1 3.62Å; F986-L1026 HydrophobicContact CZ-CD1 4.15Å; F986-F1029 HydrophobicContact CB-CB 4.2Å; F986-F1029 HydrophobicContact CB-CD1 3.76Å; F986-F1029 HydrophobicContact CB-CG 4.28Å; F986-F1029 HydrophobicContact CD1-CB 4.29Å; F986-F1029 HydrophobicContact CD2-CB 3.62Å; F986-F1029 HydrophobicContact CD2-CD1 4.28Å; F986-F1029 AromaticContact CD2-CG 3.98Å; F986-F1029 HydrophobicContact CD2-CG 3.98Å; F986-F1029 HydrophobicContact CE2-CB 4.1Å; F986-F1029 HydrophobicContact CG-CB 3.76Å; F986-F1029 HydrophobicContact CG-CD1 4.23Å; F986-F1029 HydrophobicContact CG-CG 4.24Å; F986-L1030 HydrophobicContact CE1-CD2 4.14Å; F986-L1030 HydrophobicContact CE2-CD2 4.5Å; F986-L1030 HydrophobicContact CZ-CD2 3.74Å; F986-M1034 HydrophobicContact CD1-CE 4.18Å; F986-M1034 HydrophobicContact CE1-CE 3.58Å; F986-M1034 HydrophobicContact CZ-CE 4.5Å; F986-L1045 HydrophobicContact CZ-CD1 4.35Å
987	K	90.2	Very high	85.8	Confident	125 Å²	125	69 Å²	69	54%	0.543	32%	0.322	S	S	.	.	S	Bend	trans	-56.5	-33.3	-175	-174.1	175.7	179.4	179.4	0	114.1	E983 F984	E983-K987 WeakPolarHBondContact O-CA 3.47Å; E983-K987 WeakPolarHBondContact O-CB 3.41Å; E983-K987 PolarHBondContact O-N 3.19Å; F984-K987 VanDerWaalsContact O-CB 3.3Å; F984-K987 WeakPolarHBondContact O-CB 3.49Å; F984-K987 PolarHBondContact O-N 2.89Å
988	Y	85.7	Confident	85.3	Confident	118 Å²	118	69.8 Å²	69.8	46%	0.463	33%	0.327	S	S	.	.	S	Bend	trans	-124.8	137.4	-179	-54.6	-61.4	0	0	0	110.8	F986 P999	F986-Y988 PolarHBondContact O-N 2.84Å; F986-Y988 VanDerWaalsContact O-N 3.17Å; Y988-P999 WeakPolarHBondContact O-CD 3.47Å
989	Q	81.6	Confident	84.7	Confident	156 Å²	156	71.5 Å²	71.5	73%	0.729	34%	0.338	S	S	*	.			trans	-84.4	149.4	171.5	-63.9	-173.6	3.4	0	0	110.4	Q991	Q989-Q991 PolarHBondContact O-N 2.9Å
990	N	79.4	Confident	84.4	Confident	44 Å²	44	68.5 Å²	68.5	24%	0.235	33%	0.325	C	S	.	.			trans	-70.8	127.5	178.6	-163.7	-52.1	0	0	0	110.9	K992 G993 Y996 P997	N990-K992 PolarHBondContact O-N 2.79Å; N990-K992 VanDerWaalsContact O-N 3.12Å; N990-K992 WeakPolarHBondContact OD1-CB 3.44Å; N990-K992 PolarHBondContact OD1-N 3.41Å; N990-G993 PolarHBondContact O-N 3.1Å; N990-Y996 WeakPolarHBondContact ND2-CB 3.38Å; N990-P997 PolarHBondContact ND2-O 2.58Å
991	Q	76.4	Confident	84.1	Confident	203 Å²	203	66.6 Å²	66.6	95%	0.949	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-21.7	-179.5	-62.6	-179.6	5	0	0	113.6	Q989 G993	Q989-Q991 PolarHBondContact O-N 2.9Å; Q991-G993 PolarHBondContact O-N 3.15Å
992	K	73.8	Confident	83.8	Confident	151 Å²	151	67.8 Å²	67.8	66%	0.657	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.7	-0.1	176.1	-60.3	178.8	-178.2	174.9	0	113.5	N990 Y996	N990-K992 PolarHBondContact O-N 2.79Å; N990-K992 VanDerWaalsContact O-N 3.12Å; N990-K992 WeakPolarHBondContact OD1-CB 3.44Å; N990-K992 PolarHBondContact OD1-N 3.41Å; K992-Y996 HydrophobicContact CB-CD2 3.35Å; K992-Y996 HydrophobicContact CB-CE2 3.6Å; K992-Y996 HydrophobicContact CB-CG 3.87Å; K992-Y996 HydrophobicContact CD-CD1 4.44Å; K992-Y996 HydrophobicContact CD-CE1 4.44Å; K992-Y996 WeakPolarHBondContact O-CD2 3.45Å; K992-Y996 WeakPolarHBondContact O-CE2 3.38Å
993	G	70.9	Confident	83.6	Confident	33 Å²	33	67.8 Å²	67.8	34%	0.34	33%	0.325	S	S	.	.			trans	105.1	169.7	179.5	0	0	0	0	0	113.7	N990 Q991 E995 Y996	N990-G993 PolarHBondContact O-N 3.1Å; Q991-G993 PolarHBondContact O-N 3.15Å; G993-E995 PolarHBondContact O-N 3.34Å; G993-Y996 PolarHBondContact O-N 2.89Å; G993-Y996 VanDerWaalsContact O-N 3.12Å
994	Q	66.1	Low	83.5	Confident	130 Å²	130	63.9 Å²	63.9	61%	0.607	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-10.5	-174.9	-64.8	179.4	-6.7	0	0	114.4	Y996	Q994-Y996 VanDerWaalsContact C-N 3.28Å
995	E	66.6	Low	83.3	Confident	120 Å²	120	64.5 Å²	64.5	56%	0.561	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.5	-13.8	174.7	-67	-169.7	-165.1	0	0	113.9	G993 R1037	G993-E995 PolarHBondContact O-N 3.34Å; E995-R1037 VanDerWaalsContact CB-NH2 3.35Å; E995-R1037 PolarHBondContact O-NH1 2.95Å; E995-R1037 PolarHBondContact O-NH2 3.01Å
996	Y	75.9	Confident	83.3	Confident	117 Å²	117	64.7 Å²	64.7	46%	0.459	31%	0.311	S	S	.	.	S	Bend	trans	-107.3	146.6	-179.7	-65.7	-88.8	0	0	0	111.4	N990 K992 G993 Q994	N990-Y996 WeakPolarHBondContact ND2-CB 3.38Å; K992-Y996 HydrophobicContact CB-CD2 3.35Å; K992-Y996 HydrophobicContact CB-CE2 3.6Å; K992-Y996 HydrophobicContact CB-CG 3.87Å; K992-Y996 HydrophobicContact CD-CD1 4.44Å; K992-Y996 HydrophobicContact CD-CE1 4.44Å; K992-Y996 WeakPolarHBondContact O-CD2 3.45Å; K992-Y996 WeakPolarHBondContact O-CE2 3.38Å; G993-Y996 PolarHBondContact O-N 2.89Å; G993-Y996 VanDerWaalsContact O-N 3.12Å; Q994-Y996 VanDerWaalsContact C-N 3.28Å
997	P	81.7	Confident	83.4	Confident	25 Å²	25	63.4 Å²	63.4	16%	0.162	31%	0.305	C	S	.	.			trans	-61.6	143.7	-179.5	25.8	-35.2	0	0	0	111.6	N990 L1001 V1041 W1042	N990-P997 PolarHBondContact ND2-O 2.58Å; P997-L1001 HydrophobicContact CB-CB 4.47Å; P997-L1001 HydrophobicContact CB-CD2 3.63Å; P997-V1041 HydrophobicContact CG-CB 4.22Å; P997-V1041 HydrophobicContact CG-CG2 4.07Å; P997-W1042 HydrophobicContact CB-CD2 4.31Å; P997-W1042 HydrophobicContact CB-CE3 4.37Å; P997-W1042 HydrophobicContact CB-CH2 4.19Å; P997-W1042 HydrophobicContact CB-CZ2 4.11Å; P997-W1042 HydrophobicContact CB-CZ3 4.3Å
998	P	86.1	Confident	83.6	Confident	16 Å²	16	58.7 Å²	58.7	10%	0.104	29%	0.288	C	S	.	.			trans	-51.7	143.5	168.3	-26.1	34.2	0	0	0	111.5	F986 N1000 L1001	F986-P998 HydrophobicContact CD1-CG 3.82Å; F986-P998 HydrophobicContact CE1-CG 4.05Å; P998-N1000 PolarHBondContact O-N 3.34Å; P998-L1001 HydrophobicContact CB-CB 4.39Å; P998-L1001 HydrophobicContact CG-CD1 4.43Å; P998-L1001 VanDerWaalsContact O-CB 3.23Å; P998-L1001 WeakPolarHBondContact O-CB 3.48Å; P998-L1001 PolarHBondContact O-N 3.43Å
999	P	83.9	Confident	84.1	Confident	36 Å²	36	55.7 Å²	55.7	23%	0.234	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-32.3	-177.8	24.4	-33.8	0	0	0	112.6	P940 Y988 L1001	P940-P999 HydrophobicContact CB-CB 4.08Å; Y988-P999 WeakPolarHBondContact O-CD 3.47Å; P999-L1001 VanDerWaalsContact C-N 3.34Å; P999-L1001 PolarHBondContact O-N 2.88Å
1000	N	89.8	Confident	84.7	Confident	6 Å²	6	48.2 Å²	48.2	3%	0.032	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.5	7.3	-178.1	-62.4	34.6	0	0	0	113	F931 F984 P998 A1002 F1003	F931-N1000 HydrophobicContact CE1-CB 4.27Å; F984-N1000 HydrophobicContact CD1-CB 4.32Å; F984-N1000 HydrophobicContact CE1-CB 4.14Å; F984-N1000 VanDerWaalsContact CE1-ND2 3.34Å; F984-N1000 WeakPolarHBondContact CE1-ND2 3.43Å; F984-N1000 WeakPolarHBondContact CE2-ND2 3.49Å; F984-N1000 WeakPolarHBondContact CZ-ND2 3.25Å; F984-N1000 WeakPolarHBondContact O-CB 3.42Å; P998-N1000 PolarHBondContact O-N 3.34Å; N1000-A1002 VanDerWaalsContact C-N 3.25Å; N1000-A1002 PolarHBondContact O-N 3.45Å; N1000-F1003 WeakPolarHBondContact O-CB 3.47Å; N1000-F1003 PolarHBondContact O-N 3.15Å
1001	L	89.8	Confident	85.3	Confident	4 Å²	4	46.6 Å²	46.6	2%	0.021	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-31.6	-173.6	-166.7	71.6	0	0	0	113.1	F986 P997 P998 P999 F1003 L1004 W1042 P1044 L1045	F986-L1001 HydrophobicContact CE1-CD1 3.69Å; F986-L1001 HydrophobicContact CZ-CD1 3.77Å; P997-L1001 HydrophobicContact CB-CB 4.47Å; P997-L1001 HydrophobicContact CB-CD2 3.63Å; P998-L1001 HydrophobicContact CB-CB 4.39Å; P998-L1001 HydrophobicContact CG-CD1 4.43Å; P998-L1001 VanDerWaalsContact O-CB 3.23Å; P998-L1001 WeakPolarHBondContact O-CB 3.48Å; P998-L1001 PolarHBondContact O-N 3.43Å; P999-L1001 VanDerWaalsContact C-N 3.34Å; P999-L1001 PolarHBondContact O-N 2.88Å; L1001-F1003 PolarHBondContact O-N 3.24Å; L1001-L1004 HydrophobicContact CD1-CD1 3.79Å; L1001-L1004 WeakPolarHBondContact O-CB 3.42Å; L1001-L1004 WeakPolarHBondContact O-CG 3.32Å; L1001-L1004 PolarHBondContact O-N 3.24Å; L1001-L1004 VanDerWaalsContact O-N 3.14Å; L1001-W1042 HydrophobicContact CD2-CD2 4.36Å; L1001-W1042 HydrophobicContact CD2-CE3 3.68Å; L1001-W1042 HydrophobicContact CD2-CZ3 4.11Å; L1001-P1044 VanDerWaalsContact O-CB 3.28Å; L1001-P1044 WeakPolarHBondContact O-CB 3.43Å; L1001-L1045 HydrophobicContact CD1-CB 4.21Å; L1001-L1045 HydrophobicContact CD2-CB 4.41Å
1002	A	89	Confident	85.9	Confident	24 Å²	24	40.2 Å²	40.2	20%	0.198	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-22.2	177.5	0	0	0	0	0	113.4	F931 N1000 L1004 E1005 P1044	F931-A1002 HydrophobicContact CE2-CB 4.07Å; F931-A1002 HydrophobicContact CZ-CB 4.04Å; N1000-A1002 VanDerWaalsContact C-N 3.25Å; N1000-A1002 PolarHBondContact O-N 3.45Å; A1002-L1004 PolarHBondContact O-N 3.21Å; A1002-L1004 VanDerWaalsContact O-N 3.13Å; A1002-E1005 PolarHBondContact O-N 2.79Å; A1002-P1044 HydrophobicContact CB-CG 4.44Å
1003	F	92.6	Very high	86.7	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-60.3	-21.8	174.1	-168.4	-105.3	0	0	0	113	I924 L927 Q928 F931 F984 N1000 L1001 E1005 V1006 L1007	I924-F1003 HydrophobicContact CD1-CE1 3.82Å; I924-F1003 HydrophobicContact CD1-CZ 3.63Å; I924-F1003 HydrophobicContact CG1-CE1 4.17Å; I924-F1003 HydrophobicContact CG1-CZ 4.1Å; L927-F1003 HydrophobicContact CB-CE2 3.92Å; L927-F1003 HydrophobicContact CB-CZ 3.98Å; L927-F1003 WeakPolarHBondContact O-CE2 3.43Å; Q928-F1003 HydrophobicContact CG-CE1 4.06Å; Q928-F1003 HydrophobicContact CG-CE2 4.21Å; Q928-F1003 HydrophobicContact CG-CZ 3.67Å; F931-F1003 HydrophobicContact CB-CD2 3.84Å; F931-F1003 HydrophobicContact CB-CE2 4.18Å; F931-F1003 HydrophobicContact CD1-CD2 4.39Å; F931-F1003 HydrophobicContact CD2-CB 4.28Å; F931-F1003 AromaticContact CD2-CD2 3.86Å; F931-F1003 HydrophobicContact CD2-CD2 3.86Å; F931-F1003 HydrophobicContact CE1-CB 4.42Å; F931-F1003 HydrophobicContact CE2-CB 4.18Å; F931-F1003 HydrophobicContact CG-CB 4.44Å; F931-F1003 AromaticContact CG-CD2 3.76Å; F931-F1003 HydrophobicContact CG-CD2 3.76Å; F931-F1003 HydrophobicContact CZ-CB 4.26Å; F984-F1003 HydrophobicContact CD1-CB 4.03Å; F984-F1003 AromaticContact CD1-CD1 3.54Å; F984-F1003 HydrophobicContact CD1-CD1 3.54Å; F984-F1003 HydrophobicContact CD1-CD2 4.13Å; F984-F1003 AromaticContact CD1-CE1 3.96Å; F984-F1003 HydrophobicContact CD1-CE1 3.96Å; F984-F1003 AromaticContact CD1-CG 3.62Å; F984-F1003 HydrophobicContact CD1-CG 3.62Å; F984-F1003 HydrophobicContact CD1-CZ 4.43Å; F984-F1003 HydrophobicContact CE1-CB 3.99Å; F984-F1003 HydrophobicContact CE1-CD1 4.1Å; F984-F1003 AromaticContact CE1-CD2 3.84Å; F984-F1003 HydrophobicContact CE1-CD2 3.84Å; F984-F1003 HydrophobicContact CE1-CE2 4.32Å; F984-F1003 AromaticContact CE1-CG 3.7Å; F984-F1003 HydrophobicContact CE1-CG 3.7Å; N1000-F1003 WeakPolarHBondContact O-CB 3.47Å; N1000-F1003 PolarHBondContact O-N 3.15Å; L1001-F1003 PolarHBondContact O-N 3.24Å; F1003-E1005 PolarHBondContact O-N 3.1Å; F1003-V1006 HydrophobicContact CD2-CB 4.21Å; F1003-V1006 HydrophobicContact CD2-CG2 4.36Å; F1003-V1006 HydrophobicContact CE2-CB 4.29Å; F1003-V1006 HydrophobicContact CE2-CG1 4.18Å; F1003-V1006 WeakPolarHBondContact O-CB 3.43Å; F1003-V1006 PolarHBondContact O-N 3.16Å; F1003-V1006 VanDerWaalsContact O-N 3.14Å; F1003-L1007 WeakPolarHBondContact O-CB 3.4Å; F1003-L1007 PolarHBondContact O-N 3.33Å
1004	L	93.6	Very high	87.7	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-64.2	-22	174	-63.2	-178.1	0	0	0	113.3	A985 F986 L1001 A1002 L1007 S1008 P1044 L1045 Y1048	A985-L1004 HydrophobicContact CB-CD2 3.6Å; A985-L1004 HydrophobicContact CB-CG 3.82Å; F986-L1004 HydrophobicContact CE2-CD1 4.27Å; F986-L1004 HydrophobicContact CZ-CD1 4.13Å; L1001-L1004 HydrophobicContact CD1-CD1 3.79Å; L1001-L1004 WeakPolarHBondContact O-CB 3.42Å; L1001-L1004 WeakPolarHBondContact O-CG 3.32Å; L1001-L1004 PolarHBondContact O-N 3.24Å; L1001-L1004 VanDerWaalsContact O-N 3.14Å; A1002-L1004 PolarHBondContact O-N 3.21Å; A1002-L1004 VanDerWaalsContact O-N 3.13Å; L1004-L1007 HydrophobicContact CD2-CD2 3.98Å; L1004-S1008 WeakPolarHBondContact O-CB 3.45Å; L1004-S1008 PolarHBondContact O-N 3.05Å; L1004-S1008 VanDerWaalsContact O-N 3.09Å; L1004-P1044 HydrophobicContact CB-CB 4.25Å; L1004-L1045 HydrophobicContact CD1-CB 4.13Å; L1004-L1045 HydrophobicContact CD1-CD1 3.91Å; L1004-Y1048 HydrophobicContact CB-CD1 4.44Å; L1004-Y1048 HydrophobicContact CB-CG 4.22Å; L1004-Y1048 HydrophobicContact CD1-CD1 4.41Å; L1004-Y1048 HydrophobicContact CD2-CD1 3.9Å; L1004-Y1048 HydrophobicContact CD2-CE1 4.2Å; L1004-Y1048 HydrophobicContact CD2-CG 4.4Å; L1004-Y1048 HydrophobicContact CG-CD1 4.48Å
1005	E	90.4	Very high	88.7	Confident	20 Å²	20	28.5 Å²	28.5	9%	0.093	15%	0.153	C	C	.	.	H	α-helix	trans	-70.3	-45.9	169.9	-66.2	-163.4	-160.5	0	0	111.4	R944 K953 A1002 F1003 L1007 S1008 P1044	R944-E1005 WeakPolarHBondContact CD-OE1 3.39Å; R944-E1005 IonicContact NH1-OE1 3.29Å; R944-E1005 PolarHBondContact NH1-OE1 3.25Å; K953-E1005 HydrophobicContact CD-CB 4.29Å; K953-E1005 IonicContact NZ-OE2 3.56Å; K953-E1005 PolarHBondContact NZ-OE2 3.43Å; A1002-E1005 PolarHBondContact O-N 2.79Å; F1003-E1005 PolarHBondContact O-N 3.1Å; E1005-L1007 VanDerWaalsContact C-N 3.28Å; E1005-L1007 PolarHBondContact O-N 3.04Å; E1005-S1008 WeakPolarHBondContact O-CB 3.37Å; E1005-S1008 PolarHBondContact O-N 3.15Å; E1005-S1008 PolarHBondContact O-OG 3.17Å; E1005-P1044 HydrophobicContact CG-CB 3.82Å; E1005-P1044 HydrophobicContact CG-CG 4.01Å
1006	V	93.2	Very high	89.6	Confident	3 Å²	3	29.1 Å²	29.1	2%	0.018	15%	0.15	C	C	.	.	H	α-helix	trans	-59	-42.9	174.1	-176.4	0	0	0	0	110.5	L927 I952 K953 A956 F1003 S1008	L927-V1006 HydrophobicContact CB-CG1 4.38Å; L927-V1006 HydrophobicContact CD1-CG1 4.13Å; L927-V1006 HydrophobicContact CD2-CG1 4.23Å; L927-V1006 HydrophobicContact CG-CG1 4.5Å; I952-V1006 HydrophobicContact CG2-CG1 3.82Å; I952-V1006 HydrophobicContact CG2-CG2 3.84Å; K953-V1006 HydrophobicContact CG-CG2 4Å; A956-V1006 HydrophobicContact CB-CG1 3.56Å; F1003-V1006 HydrophobicContact CD2-CB 4.21Å; F1003-V1006 HydrophobicContact CD2-CG2 4.36Å; F1003-V1006 HydrophobicContact CE2-CB 4.29Å; F1003-V1006 HydrophobicContact CE2-CG1 4.18Å; F1003-V1006 WeakPolarHBondContact O-CB 3.43Å; F1003-V1006 PolarHBondContact O-N 3.16Å; F1003-V1006 VanDerWaalsContact O-N 3.14Å; V1006-S1008 PolarHBondContact O-N 3.01Å
1007	L	95.6	Very high	90.2	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-66.9	-21.2	177	-165.5	61.1	0	0	0	113.1	I924 L977 H978 I982 F1003 L1004 E1005 E1009 Y1048	I924-L1007 HydrophobicContact CD1-CD1 3.86Å; L977-L1007 HydrophobicContact CD2-CD1 3.87Å; H978-L1007 PolarHBondContact CE1-O 3.28Å; H978-L1007 VanDerWaalsContact CE1-O 3.24Å; H978-L1007 WeakPolarHBondContact ND1-CG 3.45Å; I982-L1007 HydrophobicContact CG1-CD2 4.1Å; F1003-L1007 WeakPolarHBondContact O-CB 3.4Å; F1003-L1007 PolarHBondContact O-N 3.33Å; L1004-L1007 HydrophobicContact CD2-CD2 3.98Å; E1005-L1007 VanDerWaalsContact C-N 3.28Å; E1005-L1007 PolarHBondContact O-N 3.04Å; L1007-E1009 PolarHBondContact O-N 3.37Å; L1007-Y1048 HydrophobicContact CB-CE2 4.3Å; L1007-Y1048 HydrophobicContact CD2-CE1 4.21Å; L1007-Y1048 HydrophobicContact CD2-CE2 4.01Å; L1007-Y1048 HydrophobicContact CG-CE2 3.86Å
1008	S	94.6	Very high	90.6	Very high	27 Å²	27	28.9 Å²	28.9	19%	0.189	15%	0.151	C	C	.	.	H	α-helix	trans	-70.9	-27.6	-177.2	78.4	0	0	0	0	113.5	L1004 E1005 V1006 F1010 S1011	L1004-S1008 WeakPolarHBondContact O-CB 3.45Å; L1004-S1008 PolarHBondContact O-N 3.05Å; L1004-S1008 VanDerWaalsContact O-N 3.09Å; E1005-S1008 WeakPolarHBondContact O-CB 3.37Å; E1005-S1008 PolarHBondContact O-N 3.15Å; E1005-S1008 PolarHBondContact O-OG 3.17Å; V1006-S1008 PolarHBondContact O-N 3.01Å; S1008-F1010 VanDerWaalsContact C-N 3.3Å; S1008-F1010 PolarHBondContact O-N 3.04Å; S1008-S1011 VanDerWaalsContact O-CB 3.24Å; S1008-S1011 WeakPolarHBondContact O-CB 3.31Å; S1008-S1011 PolarHBondContact O-N 3.37Å; S1008-S1011 PolarHBondContact O-OG 2.9Å
1009	E	94.6	Very high	90.9	Very high	54 Å²	54	29.7 Å²	29.7	25%	0.252	15%	0.153	S	C	.	.	H	α-helix	trans	-57.3	-42.5	177.2	-58.8	-58.3	148.6	0	0	112	A956 R957 L1007 S1011 S1012	A956-E1009 HydrophobicContact CB-CB 4.35Å; A956-E1009 HydrophobicContact CB-CG 4.26Å; R957-E1009 HydrophobicContact CB-CB 4.39Å; R957-E1009 HydrophobicContact CB-CG 4.28Å; L1007-E1009 PolarHBondContact O-N 3.37Å; E1009-S1011 VanDerWaalsContact C-N 3.25Å; E1009-S1011 PolarHBondContact O-N 2.76Å; E1009-S1012 PolarHBondContact O-OG 3.01Å
1010	F	94.5	Very high	91.2	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-68.3	-20.6	177.8	-62	-85.5	0	0	0	113.6	I924 L927 A956 F959 A960 F963 L977 S1008 S1012 K1013	I924-F1010 HydrophobicContact CD1-CE2 4.48Å; L927-F1010 HydrophobicContact CD1-CE2 3.62Å; L927-F1010 HydrophobicContact CD1-CZ 3.69Å; A956-F1010 HydrophobicContact CB-CE2 3.7Å; A956-F1010 HydrophobicContact CB-CZ 4.17Å; A956-F1010 WeakPolarHBondContact O-CZ 3.42Å; F959-F1010 HydrophobicContact CB-CE1 3.85Å; F959-F1010 HydrophobicContact CB-CZ 3.79Å; A960-F1010 HydrophobicContact CB-CD1 3.67Å; A960-F1010 HydrophobicContact CB-CE1 4.01Å; A960-F1010 HydrophobicContact CB-CG 4.21Å; F963-F1010 HydrophobicContact CE2-CD1 4.04Å; F963-F1010 HydrophobicContact CE2-CE1 4.03Å; L977-F1010 HydrophobicContact CD1-CD1 3.79Å; L977-F1010 HydrophobicContact CD1-CE1 3.68Å; L977-F1010 HydrophobicContact CD1-CG 4.31Å; L977-F1010 HydrophobicContact CD1-CZ 4.09Å; L977-F1010 HydrophobicContact CD2-CB 3.74Å; L977-F1010 HydrophobicContact CD2-CD1 3.83Å; L977-F1010 HydrophobicContact CD2-CD2 3.83Å; L977-F1010 HydrophobicContact CD2-CE1 4.38Å; L977-F1010 HydrophobicContact CD2-CE2 4.36Å; L977-F1010 HydrophobicContact CD2-CG 3.52Å; S1008-F1010 VanDerWaalsContact C-N 3.3Å; S1008-F1010 PolarHBondContact O-N 3.04Å; F1010-S1012 PolarHBondContact O-N 2.58Å; F1010-K1013 WeakPolarHBondContact O-CB 3.34Å; F1010-K1013 PolarHBondContact O-N 3.49Å
1011	S	92.5	Very high	91.3	Very high	9 Å²	9	38.5 Å²	38.5	6%	0.063	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-13.8	-177.6	75.6	0	0	0	0	113.4	S1008 E1009 K1013 K1019 S1051	S1008-S1011 VanDerWaalsContact O-CB 3.24Å; S1008-S1011 WeakPolarHBondContact O-CB 3.31Å; S1008-S1011 PolarHBondContact O-N 3.37Å; S1008-S1011 PolarHBondContact O-OG 2.9Å; E1009-S1011 VanDerWaalsContact C-N 3.25Å; E1009-S1011 PolarHBondContact O-N 2.76Å; S1011-K1013 VanDerWaalsContact C-N 3.28Å; S1011-K1019 WeakPolarHBondContact O-CE 3.5Å; S1011-K1019 PolarHBondContact O-NZ 2.99Å; S1011-S1051 WeakPolarHBondContact CB-OG 3.2Å; S1011-S1051 VanDerWaalsContact OG-CB 3.28Å; S1011-S1051 WeakPolarHBondContact OG-CB 3.39Å; S1011-S1051 PolarHBondContact OG-OG 2.96Å
1012	S	89.4	Confident	91.5	Very high	70 Å²	70	38.5 Å²	38.5	49%	0.49	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-23.3	168.8	62.3	0	0	0	0	113.7	Q967 E1009 F1010	Q967-S1012 PolarHBondContact NE2-O 3.3Å; E1009-S1012 PolarHBondContact O-OG 3.01Å; F1010-S1012 PolarHBondContact O-N 2.58Å
1013	K	91.1	Very high	91.7	Very high	28 Å²	28	39 Å²	39	12%	0.122	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.4	-12.3	-175.8	-59	-63.5	-179.1	169.9	0	114.3	A960 G964 V974 F1010 S1011	A960-K1013 HydrophobicContact CB-CG 4.44Å; A960-K1013 WeakPolarHBondContact O-CE 3.39Å; G964-K1013 PolarHBondContact O-NZ 3.41Å; V974-K1013 HydrophobicContact CG1-CB 4.11Å; V974-K1013 HydrophobicContact CG2-CB 4.32Å; F1010-K1013 WeakPolarHBondContact O-CB 3.34Å; F1010-K1013 PolarHBondContact O-N 3.49Å; S1011-K1013 VanDerWaalsContact C-N 3.28Å
1014	L	90.1	Very high	91.7	Very high	8 Å²	8	42.2 Å²	42.2	4%	0.042	22%	0.216	C	C	.	.	S	Bend	trans	-70.5	132.7	171.6	-77.1	175.6	0	0	0	111.8	V974 A975 H978 D1018 K1019 V1022 L1052	V974-L1014 HydrophobicContact CG1-CD2 3.87Å; V974-L1014 HydrophobicContact CG1-CG 4.01Å; A975-L1014 HydrophobicContact CB-CD2 4.28Å; H978-L1014 VanDerWaalsContact CD2-CD1 3.4Å; H978-L1014 WeakPolarHBondContact CD2-CD1 3.27Å; L1014-D1018 HydrophobicContact CD2-CB 3.94Å; L1014-K1019 HydrophobicContact CB-CG 3.63Å; L1014-K1019 HydrophobicContact CD1-CG 4.08Å; L1014-V1022 HydrophobicContact CD1-CB 4.22Å; L1014-V1022 HydrophobicContact CD1-CG1 4.37Å; L1014-V1022 HydrophobicContact CD1-CG2 3.99Å; L1014-V1022 HydrophobicContact CD2-CG2 4.2Å; L1014-L1052 HydrophobicContact CD1-CD2 3.6Å
1015	L	87.3	Confident	91.7	Very high	32 Å²	32	44.9 Å²	44.9	17%	0.168	23%	0.226	C	C	.	.			trans	-65.6	154	168.2	-58.3	76.4	0	0	0	110.2	Q967 I968 R971 Q1017 D1018 K1019	Q967-L1015 HydrophobicContact CB-CD1 3.77Å; Q967-L1015 HydrophobicContact CB-CG 4.01Å; Q967-L1015 WeakPolarHBondContact O-CD1 3.36Å; I968-L1015 HydrophobicContact CG1-CD2 4.43Å; R971-L1015 HydrophobicContact CB-CD1 3.88Å; R971-L1015 HydrophobicContact CG-CD1 3.87Å; L1015-Q1017 PolarHBondContact O-N 2.88Å; L1015-D1018 WeakPolarHBondContact CB-OD2 3.38Å; L1015-D1018 PolarHBondContact O-N 3.27Å; L1015-K1019 PolarHBondContact O-N 3Å
1016	R	85.7	Confident	91.9	Very high	133 Å²	133	43.9 Å²	43.9	50%	0.502	22%	0.221	S	C	.	.	H	α-helix	trans	-53.3	-25.9	177.7	-168.7	179.2	-173.2	174.8	7.3	114.8	G1055 G1056	R1016-G1055 VanDerWaalsContact CZ-O 3.24Å; R1016-G1055 PolarHBondContact NE-O 3.49Å; R1016-G1055 PolarHBondContact NH2-O 2.92Å; R1016-G1056 VanDerWaalsContact NH2-C 3.29Å; R1016-G1056 PolarHBondContact NH2-O 2.66Å
1017	Q	87.8	Confident	91.7	Very high	123 Å²	123	47.4 Å²	47.4	58%	0.575	24%	0.238	S	C	*	.	H	α-helix	trans	-73.1	-51.3	173.4	-68.4	-176.7	-3.8	0	0	111.1	L1015 K1019 K1020 T1021	L1015-Q1017 PolarHBondContact O-N 2.88Å; Q1017-K1019 VanDerWaalsContact C-N 3.33Å; Q1017-K1019 PolarHBondContact O-N 2.98Å; Q1017-K1020 WeakPolarHBondContact O-CB 3.31Å; Q1017-K1020 PolarHBondContact O-N 3.13Å; Q1017-K1020 VanDerWaalsContact O-N 3.07Å; Q1017-T1021 PolarHBondContact O-N 3.46Å
1018	D	90.6	Very high	91.6	Very high	14 Å²	14	54.6 Å²	54.6	8%	0.075	27%	0.269	C	S	.	.	H	α-helix	trans	-73.4	-26.1	-173.7	-50.6	-69.9	0	0	0	112.4	R971 L1014 L1015 K1020 T1021 V1022	R971-D1018 IonicContact CZ-OD1 3.98Å; R971-D1018 VanDerWaalsContact CZ-OD1 3.24Å; R971-D1018 IonicContact CZ-OD2 3.08Å; R971-D1018 VanDerWaalsContact CZ-OD2 3.25Å; R971-D1018 IonicContact NE-OD1 2.91Å; R971-D1018 PolarHBondContact NE-OD1 2.84Å; R971-D1018 IonicContact NE-OD2 3.86Å; R971-D1018 PolarHBondContact NE-OD2 3.2Å; R971-D1018 VanDerWaalsContact NH2-CG 3.34Å; R971-D1018 IonicContact NH2-OD1 2.96Å; R971-D1018 PolarHBondContact NH2-OD1 3.38Å; R971-D1018 IonicContact NH2-OD2 3.68Å; R971-D1018 PolarHBondContact NH2-OD2 2.9Å; L1014-D1018 HydrophobicContact CD2-CB 3.94Å; L1015-D1018 WeakPolarHBondContact CB-OD2 3.38Å; L1015-D1018 PolarHBondContact O-N 3.27Å; D1018-K1020 PolarHBondContact O-N 2.85Å; D1018-T1021 WeakPolarHBondContact O-CB 3.41Å; D1018-T1021 PolarHBondContact O-N 2.96Å; D1018-V1022 WeakPolarHBondContact O-CB 3.45Å; D1018-V1022 WeakPolarHBondContact O-CG2 3.19Å; D1018-V1022 PolarHBondContact O-N 3.14Å
1019	K	92.2	Very high	91.3	Very high	32 Å²	32	56.5 Å²	56.5	14%	0.139	27%	0.274	C	S	.	.	H	α-helix	trans	-52.4	-40	165.7	-72.5	-165	174.2	-153.8	0	112.5	S1011 L1014 L1015 Q1017 H1023 S1051 L1052	S1011-K1019 WeakPolarHBondContact O-CE 3.5Å; S1011-K1019 PolarHBondContact O-NZ 2.99Å; L1014-K1019 HydrophobicContact CB-CG 3.63Å; L1014-K1019 HydrophobicContact CD1-CG 4.08Å; L1015-K1019 PolarHBondContact O-N 3Å; Q1017-K1019 VanDerWaalsContact C-N 3.33Å; Q1017-K1019 PolarHBondContact O-N 2.98Å; K1019-H1023 WeakPolarHBondContact O-CB 3.3Å; K1019-H1023 PolarHBondContact O-N 3.25Å; K1019-S1051 PolarHBondContact NZ-O 3.47Å; K1019-L1052 HydrophobicContact CB-CD2 4.41Å; K1019-L1052 WeakPolarHBondContact CB-O 3.5Å; K1019-L1052 HydrophobicContact CG-CD2 4.3Å
1020	K	90.3	Very high	90.9	Very high	140 Å²	140	54.8 Å²	54.8	61%	0.609	27%	0.267	S	S	*	.	H	α-helix	trans	-70	-40.5	174.7	-61.3	-172.4	177.3	-172	0	112	Q1017 D1018 H1023 S1024	Q1017-K1020 WeakPolarHBondContact O-CB 3.31Å; Q1017-K1020 PolarHBondContact O-N 3.13Å; Q1017-K1020 VanDerWaalsContact O-N 3.07Å; D1018-K1020 PolarHBondContact O-N 2.85Å; K1020-H1023 PolarHBondContact O-N 2.94Å; K1020-S1024 WeakPolarHBondContact O-CB 3.5Å; K1020-S1024 PolarHBondContact O-N 3.45Å; K1020-S1024 PolarHBondContact O-OG 3.4Å
1021	T	92.2	Very high	90.4	Very high	87 Å²	87	57.3 Å²	57.3	53%	0.534	28%	0.282	S	S	.	.	H	α-helix	trans	-63.1	-44.6	177.5	-50	0	0	0	0	112.1	Q1017 D1018 S1024 Y1025	Q1017-T1021 PolarHBondContact O-N 3.46Å; D1018-T1021 WeakPolarHBondContact O-CB 3.41Å; D1018-T1021 PolarHBondContact O-N 2.96Å; T1021-S1024 CarbonylContact O-C 3.52Å; T1021-S1024 PolarHBondContact O-N 3.02Å; T1021-Y1025 PolarHBondContact O-N 2.75Å
1022	V	94.4	Very high	89.5	Confident	4 Å²	4	64.5 Å²	64.5	2%	0.024	31%	0.314	C	S	.	.	H	α-helix	trans	-69.9	-39.6	177.8	172.7	0	0	0	0	110.9	H978 I982 L1014 D1018 Y1025 L1026 Y1048 L1052	H978-V1022 HydrophobicContact CB-CG1 3.78Å; H978-V1022 HydrophobicContact CB-CG2 4.08Å; I982-V1022 HydrophobicContact CD1-CG1 3.89Å; L1014-V1022 HydrophobicContact CD1-CB 4.22Å; L1014-V1022 HydrophobicContact CD1-CG1 4.37Å; L1014-V1022 HydrophobicContact CD1-CG2 3.99Å; L1014-V1022 HydrophobicContact CD2-CG2 4.2Å; D1018-V1022 WeakPolarHBondContact O-CB 3.45Å; D1018-V1022 WeakPolarHBondContact O-CG2 3.19Å; D1018-V1022 PolarHBondContact O-N 3.14Å; V1022-Y1025 WeakPolarHBondContact O-CA 3.33Å; V1022-Y1025 VanDerWaalsContact O-CB 3.31Å; V1022-Y1025 WeakPolarHBondContact O-CB 3.43Å; V1022-Y1025 PolarHBondContact O-N 3.1Å; V1022-L1026 PolarHBondContact O-N 2.88Å; V1022-Y1048 VanDerWaalsContact CG1-OH 3.31Å; V1022-Y1048 WeakPolarHBondContact CG1-OH 3.47Å; V1022-L1052 HydrophobicContact CB-CD2 4.26Å; V1022-L1052 HydrophobicContact CG1-CD1 3.92Å; V1022-L1052 HydrophobicContact CG1-CD2 3.94Å
1023	H	92.9	Very high	88.8	Confident	36 Å²	36	66 Å²	66	17%	0.167	31%	0.314	C	S	.	.	H	α-helix	trans	-61.4	-44.6	172.4	-178.1	-91.7	0	0	0	112.1	K1019 K1020 Y1025 L1026 E1027 R1049 L1052 V1053	K1019-H1023 WeakPolarHBondContact O-CB 3.3Å; K1019-H1023 PolarHBondContact O-N 3.25Å; K1020-H1023 PolarHBondContact O-N 2.94Å; H1023-Y1025 PolarHBondContact O-N 2.88Å; H1023-L1026 WeakPolarHBondContact O-CB 3.44Å; H1023-L1026 PolarHBondContact O-N 3.44Å; H1023-E1027 IonicContact CE1-OE1 2.71Å; H1023-E1027 PolarHBondContact CE1-OE1 3.22Å; H1023-E1027 IonicContact CE1-OE2 2.68Å; H1023-E1027 IonicContact ND1-OE1 3.58Å; H1023-E1027 WeakPolarHBondContact O-CG 3.42Å; H1023-E1027 PolarHBondContact O-N 2.77Å; H1023-R1049 VanDerWaalsContact NE2-CD 3.33Å; H1023-R1049 WeakPolarHBondContact NE2-CD 3.45Å; H1023-R1049 WeakPolarHBondContact NE2-CG 3.31Å; H1023-R1049 PolarHBondContact NE2-NE 3Å; H1023-R1049 PolarHBondContact NE2-NH2 2.7Å; H1023-L1052 HydrophobicContact CB-CB 4.2Å; H1023-L1052 HydrophobicContact CB-CD1 4.21Å; H1023-V1053 WeakPolarHBondContact NE2-CG2 3.41Å
1024	S	92.2	Very high	88.4	Confident	67 Å²	67	65.7 Å²	65.7	47%	0.469	31%	0.313	S	S	.	.	H	α-helix	trans	-69.2	-11.4	173.1	-52.4	0	0	0	0	113.7	K1020 T1021	K1020-S1024 WeakPolarHBondContact O-CB 3.5Å; K1020-S1024 PolarHBondContact O-N 3.45Å; K1020-S1024 PolarHBondContact O-OG 3.4Å; T1021-S1024 CarbonylContact O-C 3.52Å; T1021-S1024 PolarHBondContact O-N 3.02Å
1025	Y	94.4	Very high	87.7	Confident	55 Å²	55	68.1 Å²	68.1	22%	0.216	33%	0.325	C	S	.	.	H	α-helix	trans	-85.7	-48.3	169.9	-159.4	-104	0	0	0	110.4	K979 I982 E983 T1021 V1022 H1023 E1027 K1028 F1029	K979-Y1025 HydrophobicContact CB-CD1 4.15Å; K979-Y1025 HydrophobicContact CB-CE1 3.76Å; K979-Y1025 HydrophobicContact CG-CD1 3.91Å; K979-Y1025 HydrophobicContact CG-CE1 3.85Å; K979-Y1025 HydrophobicContact CG-CG 4.28Å; I982-Y1025 HydrophobicContact CD1-CD1 4.43Å; I982-Y1025 HydrophobicContact CG2-CD1 4.47Å; E983-Y1025 HydrophobicContact CG-CE1 4.33Å; E983-Y1025 WeakPolarHBondContact OE1-CE1 3.44Å; E983-Y1025 VanDerWaalsContact OE1-CZ 3.32Å; E983-Y1025 PolarHBondContact OE1-OH 2.95Å; T1021-Y1025 PolarHBondContact O-N 2.75Å; V1022-Y1025 WeakPolarHBondContact O-CA 3.33Å; V1022-Y1025 VanDerWaalsContact O-CB 3.31Å; V1022-Y1025 WeakPolarHBondContact O-CB 3.43Å; V1022-Y1025 PolarHBondContact O-N 3.1Å; H1023-Y1025 PolarHBondContact O-N 2.88Å; Y1025-E1027 VanDerWaalsContact C-N 3.31Å; Y1025-E1027 PolarHBondContact O-N 3.24Å; Y1025-K1028 HydrophobicContact CD2-CD 4.3Å; Y1025-K1028 VanDerWaalsContact O-CB 3.31Å; Y1025-K1028 WeakPolarHBondContact O-CB 3.5Å; Y1025-K1028 WeakPolarHBondContact O-CG 3.49Å; Y1025-K1028 PolarHBondContact O-N 3.14Å; Y1025-K1028 VanDerWaalsContact O-N 3.12Å; Y1025-F1029 AromaticContact CD1-CE2 3.97Å; Y1025-F1029 HydrophobicContact CD1-CE2 3.97Å; Y1025-F1029 AromaticContact CE1-CE2 3.8Å; Y1025-F1029 HydrophobicContact CE1-CE2 3.8Å; Y1025-F1029 HydrophobicContact CE1-CZ 4.19Å; Y1025-F1029 WeakPolarHBondContact O-CD2 3.45Å
1026	L	93.6	Very high	87.2	Confident	0 Å²	0	74 Å²	74	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-53	-45.7	174.4	177	63.6	0	0	0	111.7	I982 F986 V1022 H1023 K1028 F1029 L1030 L1045 Y1048 R1049 L1052	I982-L1026 HydrophobicContact CD1-CB 3.98Å; I982-L1026 HydrophobicContact CD1-CD1 4.45Å; I982-L1026 HydrophobicContact CG1-CD1 4.29Å; I982-L1026 HydrophobicContact CG2-CD1 4.21Å; F986-L1026 HydrophobicContact CE2-CD1 3.62Å; F986-L1026 HydrophobicContact CZ-CD1 4.15Å; V1022-L1026 PolarHBondContact O-N 2.88Å; H1023-L1026 WeakPolarHBondContact O-CB 3.44Å; H1023-L1026 PolarHBondContact O-N 3.44Å; L1026-K1028 PolarHBondContact O-N 3.41Å; L1026-F1029 PolarHBondContact O-N 2.83Å; L1026-L1030 HydrophobicContact CD1-CD2 4.39Å; L1026-L1030 HydrophobicContact CG-CD1 4.21Å; L1026-L1030 HydrophobicContact CG-CG 4.45Å; L1026-L1045 HydrophobicContact CD1-CD1 4.13Å; L1026-L1045 HydrophobicContact CD2-CD1 4.18Å; L1026-Y1048 HydrophobicContact CD2-CD1 3.95Å; L1026-Y1048 HydrophobicContact CD2-CE1 4.08Å; L1026-R1049 HydrophobicContact CD2-CB 4.34Å; L1026-L1052 HydrophobicContact CD2-CD1 4.34Å
1027	E	90.5	Very high	86.9	Confident	77 Å²	77	70.3 Å²	70.3	36%	0.36	34%	0.338	S	S	.	.	G	3₁₀ helix	trans	-58	-20.8	-179.6	-74.8	-174.9	151.4	0	0	114.1	H1023 Y1025 F1029 L1030 R1049	H1023-E1027 IonicContact CE1-OE1 2.71Å; H1023-E1027 PolarHBondContact CE1-OE1 3.22Å; H1023-E1027 IonicContact CE1-OE2 2.68Å; H1023-E1027 IonicContact ND1-OE1 3.58Å; H1023-E1027 WeakPolarHBondContact O-CG 3.42Å; H1023-E1027 PolarHBondContact O-N 2.77Å; Y1025-E1027 VanDerWaalsContact C-N 3.31Å; Y1025-E1027 PolarHBondContact O-N 3.24Å; E1027-F1029 PolarHBondContact O-N 3.48Å; E1027-L1030 PolarHBondContact O-N 2.89Å; E1027-R1049 IonicContact OE1-NH2 3.42Å
1028	K	91.8	Very high	86.3	Confident	150 Å²	150	72.2 Å²	72.2	65%	0.652	34%	0.339	S	S	*	.	G	3₁₀ helix	trans	-69.2	-21.3	174.5	-57.6	177	-176.1	176.6	0	113.8	Y1025 L1026	Y1025-K1028 HydrophobicContact CD2-CD 4.3Å; Y1025-K1028 VanDerWaalsContact O-CB 3.31Å; Y1025-K1028 WeakPolarHBondContact O-CB 3.5Å; Y1025-K1028 WeakPolarHBondContact O-CG 3.49Å; Y1025-K1028 PolarHBondContact O-N 3.14Å; Y1025-K1028 VanDerWaalsContact O-N 3.12Å; L1026-K1028 PolarHBondContact O-N 3.41Å
1029	F	88.7	Confident	85.8	Confident	67 Å²	67	76.2 Å²	76.2	29%	0.294	36%	0.358	S	S	.	.	G	3₁₀ helix	trans	-100.2	-4.5	-179.1	-60.2	-94.6	0	0	0	112.4	I982 E983 F986 Y1025 L1026 E1027	I982-F1029 HydrophobicContact CG2-CD2 3.61Å; I982-F1029 HydrophobicContact CG2-CE2 3.73Å; I982-F1029 HydrophobicContact CG2-CG 4.22Å; I982-F1029 HydrophobicContact CG2-CZ 4.41Å; E983-F1029 HydrophobicContact CG-CE1 4.21Å; E983-F1029 HydrophobicContact CG-CZ 3.68Å; F986-F1029 HydrophobicContact CB-CB 4.2Å; F986-F1029 HydrophobicContact CB-CD1 3.76Å; F986-F1029 HydrophobicContact CB-CG 4.28Å; F986-F1029 HydrophobicContact CD1-CB 4.29Å; F986-F1029 HydrophobicContact CD2-CB 3.62Å; F986-F1029 HydrophobicContact CD2-CD1 4.28Å; F986-F1029 AromaticContact CD2-CG 3.98Å; F986-F1029 HydrophobicContact CD2-CG 3.98Å; F986-F1029 HydrophobicContact CE2-CB 4.1Å; F986-F1029 HydrophobicContact CG-CB 3.76Å; F986-F1029 HydrophobicContact CG-CD1 4.23Å; F986-F1029 HydrophobicContact CG-CG 4.24Å; Y1025-F1029 AromaticContact CD1-CE2 3.97Å; Y1025-F1029 HydrophobicContact CD1-CE2 3.97Å; Y1025-F1029 AromaticContact CE1-CE2 3.8Å; Y1025-F1029 HydrophobicContact CE1-CE2 3.8Å; Y1025-F1029 HydrophobicContact CE1-CZ 4.19Å; Y1025-F1029 WeakPolarHBondContact O-CD2 3.45Å; L1026-F1029 PolarHBondContact O-N 2.83Å; E1027-F1029 PolarHBondContact O-N 3.48Å
1030	L	86.3	Confident	85.1	Confident	19 Å²	19	80.3 Å²	80.3	10%	0.099	38%	0.381	C	S	.	.			trans	-99.8	134.6	-176.5	-55.5	-173.2	0	0	0	111.7	F986 L1026 E1027 M1034 M1035 L1045	F986-L1030 HydrophobicContact CE1-CD2 4.14Å; F986-L1030 HydrophobicContact CE2-CD2 4.5Å; F986-L1030 HydrophobicContact CZ-CD2 3.74Å; L1026-L1030 HydrophobicContact CD1-CD2 4.39Å; L1026-L1030 HydrophobicContact CG-CD1 4.21Å; L1026-L1030 HydrophobicContact CG-CG 4.45Å; E1027-L1030 PolarHBondContact O-N 2.89Å; L1030-M1034 HydrophobicContact CD2-CE 3.91Å; L1030-M1035 HydrophobicContact CB-CG 4.04Å; L1030-M1035 HydrophobicContact CB-SD 4.37Å; L1030-M1035 HydrophobicContact CD1-CG 3.96Å; L1030-M1035 HydrophobicContact CD1-SD 4.33Å; L1030-L1045 HydrophobicContact CD1-CD1 4.25Å; L1030-L1045 HydrophobicContact CD2-CD1 3.84Å; L1030-L1045 HydrophobicContact CD2-CD2 3.77Å; L1030-L1045 HydrophobicContact CD2-CG 4.47Å
1031	T	83.6	Confident	84.5	Confident	53 Å²	53	77.5 Å²	77.5	33%	0.325	38%	0.376	S	S	.	.			trans	-89.1	161.2	164.5	68.4	0	0	0	0	110.6	Q1033 M1034 M1035	T1031-Q1033 PolarHBondContact O-N 3.07Å; T1031-M1034 HydrophobicContact CG2-SD 3.93Å; T1031-M1034 PolarHBondContact N-SD 3.36Å; T1031-M1034 PolarHBondContact O-N 3.47Å; T1031-M1034 VanDerWaalsContact O-N 3.1Å; T1031-M1034 VanDerWaalsContact OG1-CG 3.23Å; T1031-M1034 WeakPolarHBondContact OG1-CG 3.42Å; T1031-M1034 PolarHBondContact OG1-N 2.85Å; T1031-M1034 PolarHBondContact OG1-SD 3.28Å; T1031-M1035 PolarHBondContact O-N 3.09Å
1032	E	75.1	Confident	84.3	Confident	159 Å²	159	73.5 Å²	73.5	74%	0.743	35%	0.351	S	S	*	.	H	α-helix	trans	-55	-42.4	175.2	-63.2	-175.9	140.9	0	0	111.6	M1034 M1035 E1036	E1032-M1034 VanDerWaalsContact C-N 3.33Å; E1032-M1034 PolarHBondContact O-N 3.34Å; E1032-M1035 HydrophobicContact CG-CE 4.48Å; E1032-M1035 PolarHBondContact O-N 3.29Å; E1032-M1035 VanDerWaalsContact O-N 3.09Å; E1032-E1036 PolarHBondContact O-N 3.15Å
1033	Q	74.5	Confident	83.9	Confident	103 Å²	103	76.5 Å²	76.5	48%	0.481	37%	0.366	S	S	.	.	H	α-helix	trans	-61.4	-37.4	177.6	-61.9	-176.1	0.1	0	0	113	T1031 M1035 E1036 R1037	T1031-Q1033 PolarHBondContact O-N 3.07Å; Q1033-M1035 VanDerWaalsContact C-N 3.31Å; Q1033-M1035 PolarHBondContact O-N 3.46Å; Q1033-E1036 PolarHBondContact O-N 3.2Å; Q1033-R1037 WeakPolarHBondContact O-CG 3.47Å; Q1033-R1037 PolarHBondContact O-N 3.18Å
1034	M	81.4	Confident	83.8	Confident	20 Å²	20	74.9 Å²	74.9	10%	0.099	36%	0.359	C	S	.	.	H	α-helix	trans	-68.9	-30.6	176.6	-66	159.8	70.4	0	0	111.9	F986 L1030 T1031 E1032 W1042	F986-M1034 HydrophobicContact CD1-CE 4.18Å; F986-M1034 HydrophobicContact CE1-CE 3.58Å; F986-M1034 HydrophobicContact CZ-CE 4.5Å; L1030-M1034 HydrophobicContact CD2-CE 3.91Å; T1031-M1034 HydrophobicContact CG2-SD 3.93Å; T1031-M1034 PolarHBondContact N-SD 3.36Å; T1031-M1034 PolarHBondContact O-N 3.47Å; T1031-M1034 VanDerWaalsContact O-N 3.1Å; T1031-M1034 VanDerWaalsContact OG1-CG 3.23Å; T1031-M1034 WeakPolarHBondContact OG1-CG 3.42Å; T1031-M1034 PolarHBondContact OG1-N 2.85Å; T1031-M1034 PolarHBondContact OG1-SD 3.28Å; E1032-M1034 VanDerWaalsContact C-N 3.33Å; E1032-M1034 PolarHBondContact O-N 3.34Å; M1034-W1042 HydrophobicContact CB-CZ3 4.08Å; M1034-W1042 HydrophobicContact CE-CZ3 4.16Å; M1034-W1042 HydrophobicContact CG-CH2 3.8Å; M1034-W1042 HydrophobicContact CG-CZ3 3.71Å
1035	M	75.4	Confident	83.7	Confident	60 Å²	60	72 Å²	72	30%	0.296	34%	0.338	S	S	.	.	H	α-helix	trans	-77.8	-21.7	178.7	-67.2	-170.2	-74.9	0	0	113.6	L1030 T1031 E1032 Q1033 R1038	L1030-M1035 HydrophobicContact CB-CG 4.04Å; L1030-M1035 HydrophobicContact CB-SD 4.37Å; L1030-M1035 HydrophobicContact CD1-CG 3.96Å; L1030-M1035 HydrophobicContact CD1-SD 4.33Å; T1031-M1035 PolarHBondContact O-N 3.09Å; E1032-M1035 HydrophobicContact CG-CE 4.48Å; E1032-M1035 PolarHBondContact O-N 3.29Å; E1032-M1035 VanDerWaalsContact O-N 3.09Å; Q1033-M1035 VanDerWaalsContact C-N 3.31Å; Q1033-M1035 PolarHBondContact O-N 3.46Å; M1035-R1038 PolarHBondContact O-NH1 3.1Å; M1035-R1038 PolarHBondContact O-NH2 2.87Å
1036	E	77.4	Confident	83.4	Confident	156 Å²	156	71.2 Å²	71.2	73%	0.729	34%	0.337	S	S	*	.	H	α-helix	trans	-89.5	-28	178.9	-67.6	-168.5	149.6	0	0	114	E1032 Q1033 R1038	E1032-E1036 PolarHBondContact O-N 3.15Å; Q1033-E1036 PolarHBondContact O-N 3.2Å; E1036-R1038 PolarHBondContact O-NH1 3.18Å
1037	R	78.6	Confident	83.2	Confident	54 Å²	54	73.4 Å²	73.4	20%	0.204	35%	0.353	C	S	.	.			trans	-63.7	143.9	-178.6	-75.6	174.7	-176.3	-100.9	4.6	113.6	E995 Q1033 E1039 W1042	E995-R1037 VanDerWaalsContact CB-NH2 3.35Å; E995-R1037 PolarHBondContact O-NH1 2.95Å; E995-R1037 PolarHBondContact O-NH2 3.01Å; Q1033-R1037 WeakPolarHBondContact O-CG 3.47Å; Q1033-R1037 PolarHBondContact O-N 3.18Å; R1037-E1039 IonicContact NH1-OE1 2.73Å; R1037-E1039 IonicContact NH1-OE2 2.97Å; R1037-E1039 PolarHBondContact NH1-OE2 2.79Å; R1037-W1042 HydrophobicContact CB-CD2 4.36Å; R1037-W1042 HydrophobicContact CB-CG 4.12Å; R1037-W1042 VanDerWaalsContact CD-CE2 3.49Å
1038	R	75.8	Confident	83.4	Confident	163 Å²	163	69.8 Å²	69.8	62%	0.615	34%	0.336	S	S	*	.			trans	-135.8	14	-176.3	-61.3	-65.8	175.8	-93.8	-7.7	113.7	M1035 E1036	M1035-R1038 PolarHBondContact O-NH1 3.1Å; M1035-R1038 PolarHBondContact O-NH2 2.87Å; E1036-R1038 PolarHBondContact O-NH1 3.18Å
1039	E	80.8	Confident	83.3	Confident	98 Å²	98	66.2 Å²	66.2	46%	0.458	32%	0.318	S	S	.	.	S	Bend	trans	-71.8	150.6	176.9	-51.6	149.3	156.3	0	0	109.6	R1037 V1041 W1042	R1037-E1039 IonicContact NH1-OE1 2.73Å; R1037-E1039 IonicContact NH1-OE2 2.97Å; R1037-E1039 PolarHBondContact NH1-OE2 2.79Å; E1039-V1041 HydrophobicContact CB-CG2 4.28Å; E1039-V1041 PolarHBondContact O-N 2.78Å; E1039-W1042 PolarHBondContact O-N 3.38Å; E1039-W1042 PolarHBondContact OE2-NE1 2.89Å; E1039-W1042 VanDerWaalsContact OE2-NE1 3.13Å
1040	D	76.4	Confident	83.4	Confident	119 Å²	119	66.8 Å²	66.8	64%	0.636	33%	0.325	S	S	*	.	G	3₁₀ helix	trans	-58.2	-26.7	-172.6	-59.4	-54.9	0	0	0	114.1	R944 W1042 L1043	R944-D1040 PolarHBondContact NH1-O 3.31Å; R944-D1040 PolarHBondContact NH2-O 3.03Å; R944-D1040 VanDerWaalsContact NH2-O 3.11Å; D1040-W1042 PolarHBondContact O-N 3.46Å; D1040-L1043 WeakPolarHBondContact O-CB 3.47Å; D1040-L1043 PolarHBondContact O-N 2.89Å; D1040-L1043 VanDerWaalsContact O-N 3.14Å
1041	V	79.4	Confident	83.7	Confident	81 Å²	81	67.1 Å²	67.1	49%	0.491	33%	0.328	S	S	.	.	G	3₁₀ helix	trans	-68.6	-14.6	176.3	-57	0	0	0	0	113.7	P997 E1039	P997-V1041 HydrophobicContact CG-CB 4.22Å; P997-V1041 HydrophobicContact CG-CG2 4.07Å; E1039-V1041 HydrophobicContact CB-CG2 4.28Å; E1039-V1041 PolarHBondContact O-N 2.78Å
1042	W	86.3	Confident	83.9	Confident	2 Å²	2	64.9 Å²	64.9	1%	0.008	32%	0.315	C	S	.	.	G	3₁₀ helix	trans	-100.8	-1.3	173.3	-61.7	90.4	0	0	0	113.1	P997 L1001 M1034 R1037 E1039 D1040 P1044 L1045 I1046	P997-W1042 HydrophobicContact CB-CD2 4.31Å; P997-W1042 HydrophobicContact CB-CE3 4.37Å; P997-W1042 HydrophobicContact CB-CH2 4.19Å; P997-W1042 HydrophobicContact CB-CZ2 4.11Å; P997-W1042 HydrophobicContact CB-CZ3 4.3Å; L1001-W1042 HydrophobicContact CD2-CD2 4.36Å; L1001-W1042 HydrophobicContact CD2-CE3 3.68Å; L1001-W1042 HydrophobicContact CD2-CZ3 4.11Å; M1034-W1042 HydrophobicContact CB-CZ3 4.08Å; M1034-W1042 HydrophobicContact CE-CZ3 4.16Å; M1034-W1042 HydrophobicContact CG-CH2 3.8Å; M1034-W1042 HydrophobicContact CG-CZ3 3.71Å; R1037-W1042 HydrophobicContact CB-CD2 4.36Å; R1037-W1042 HydrophobicContact CB-CG 4.12Å; R1037-W1042 VanDerWaalsContact CD-CE2 3.49Å; E1039-W1042 PolarHBondContact O-N 3.38Å; E1039-W1042 PolarHBondContact OE2-NE1 2.89Å; E1039-W1042 VanDerWaalsContact OE2-NE1 3.13Å; D1040-W1042 PolarHBondContact O-N 3.46Å; W1042-P1044 VanDerWaalsContact C-N 3.34Å; W1042-L1045 HydrophobicContact CE3-CD2 4.3Å; W1042-L1045 PolarHBondContact O-N 3.37Å; W1042-L1045 VanDerWaalsContact O-N 3.12Å; W1042-I1046 PolarHBondContact O-N 3.38Å
1043	L	87.7	Confident	84.2	Confident	67 Å²	67	60.9 Å²	60.9	35%	0.351	30%	0.301	S	S	.	.	H	α-helix	trans	-54.6	-37.8	-179.8	-170.8	65.4	0	0	0	114.3	D1040 L1045 I1046 S1047	D1040-L1043 WeakPolarHBondContact O-CB 3.47Å; D1040-L1043 PolarHBondContact O-N 2.89Å; D1040-L1043 VanDerWaalsContact O-N 3.14Å; L1043-L1045 VanDerWaalsContact C-N 3.29Å; L1043-L1045 PolarHBondContact O-N 3.16Å; L1043-I1046 HydrophobicContact CD1-CB 4.49Å; L1043-I1046 PolarHBondContact O-N 2.96Å; L1043-I1046 VanDerWaalsContact O-N 3.09Å; L1043-S1047 WeakPolarHBondContact O-CB 3.36Å; L1043-S1047 PolarHBondContact O-N 3.27Å; L1043-S1047 PolarHBondContact O-OG 2.77Å
1044	P	89.3	Confident	83.5	Confident	3 Å²	3	61 Å²	61	2%	0.019	31%	0.309	C	S	.	.	H	α-helix	trans	-51.9	-45.1	174.3	-30.2	36.3	0	0	0	113.7	L1001 A1002 L1004 E1005 W1042 Y1048	L1001-P1044 VanDerWaalsContact O-CB 3.28Å; L1001-P1044 WeakPolarHBondContact O-CB 3.43Å; A1002-P1044 HydrophobicContact CB-CG 4.44Å; L1004-P1044 HydrophobicContact CB-CB 4.25Å; E1005-P1044 HydrophobicContact CG-CB 3.82Å; E1005-P1044 HydrophobicContact CG-CG 4.01Å; W1042-P1044 VanDerWaalsContact C-N 3.34Å; P1044-Y1048 VanDerWaalsContact O-CB 3.31Å; P1044-Y1048 WeakPolarHBondContact O-CB 3.44Å; P1044-Y1048 PolarHBondContact O-N 2.94Å
1045	L	90.4	Very high	82.1	Confident	6 Å²	6	61.4 Å²	61.4	3%	0.031	32%	0.318	C	S	.	.	H	α-helix	trans	-68.8	-40.2	177.8	174.5	59.2	0	0	0	111.9	F986 L1001 L1004 L1026 L1030 W1042 L1043 R1049	F986-L1045 HydrophobicContact CZ-CD1 4.35Å; L1001-L1045 HydrophobicContact CD1-CB 4.21Å; L1001-L1045 HydrophobicContact CD2-CB 4.41Å; L1004-L1045 HydrophobicContact CD1-CB 4.13Å; L1004-L1045 HydrophobicContact CD1-CD1 3.91Å; L1026-L1045 HydrophobicContact CD1-CD1 4.13Å; L1026-L1045 HydrophobicContact CD2-CD1 4.18Å; L1030-L1045 HydrophobicContact CD1-CD1 4.25Å; L1030-L1045 HydrophobicContact CD2-CD1 3.84Å; L1030-L1045 HydrophobicContact CD2-CD2 3.77Å; L1030-L1045 HydrophobicContact CD2-CG 4.47Å; W1042-L1045 HydrophobicContact CE3-CD2 4.3Å; W1042-L1045 PolarHBondContact O-N 3.37Å; W1042-L1045 VanDerWaalsContact O-N 3.12Å; L1043-L1045 VanDerWaalsContact C-N 3.29Å; L1043-L1045 PolarHBondContact O-N 3.16Å; L1045-R1049 WeakPolarHBondContact O-CB 3.33Å; L1045-R1049 PolarHBondContact O-N 3.33Å
1046	I	88.6	Confident	80.2	Confident	38 Å²	38	60.7 Å²	60.7	20%	0.195	33%	0.325	C	S	.	.	H	α-helix	trans	-64.8	-48.3	179.5	-63.3	168.3	0	0	0	110	W1042 L1043 R1049 N1050	W1042-I1046 PolarHBondContact O-N 3.38Å; L1043-I1046 HydrophobicContact CD1-CB 4.49Å; L1043-I1046 PolarHBondContact O-N 2.96Å; L1043-I1046 VanDerWaalsContact O-N 3.09Å; I1046-R1049 PolarHBondContact O-N 2.98Å; I1046-N1050 WeakPolarHBondContact O-CB 3.28Å; I1046-N1050 PolarHBondContact O-N 2.92Å; I1046-N1050 PolarHBondContact O-ND2 3.45Å; I1046-N1050 PolarHBondContact O-OD1 3.42Å
1047	S	89.1	Confident	78.2	Confident	47 Å²	47	62 Å²	62	33%	0.329	33%	0.332	S	S	.	.	H	α-helix	trans	-62.8	-48.2	178.8	-64.2	0	0	0	0	112.3	L1043 N1050 S1051	L1043-S1047 WeakPolarHBondContact O-CB 3.36Å; L1043-S1047 PolarHBondContact O-N 3.27Å; L1043-S1047 PolarHBondContact O-OG 2.77Å; S1047-N1050 PolarHBondContact O-N 2.76Å; S1047-S1051 PolarHBondContact O-N 2.94Å
1048	Y	93.9	Very high	76	Confident	0 Å²	0	66.9 Å²	66.9	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-64.1	-41.8	177.5	-178.3	-113.3	0	0	0	112.6	H978 I982 L1004 L1007 V1022 L1026 P1044 N1050 S1051 L1052	H978-Y1048 AromaticContact CE1-CE2 3.96Å; H978-Y1048 AromaticContact ND1-CE2 3.79Å; H978-Y1048 AromaticContact ND1-CZ 3.83Å; H978-Y1048 PolarHBondContact ND1-OH 3.22Å; I982-Y1048 HydrophobicContact CD1-CE1 4.05Å; I982-Y1048 HydrophobicContact CG1-CE1 3.95Å; L1004-Y1048 HydrophobicContact CB-CD1 4.44Å; L1004-Y1048 HydrophobicContact CB-CG 4.22Å; L1004-Y1048 HydrophobicContact CD1-CD1 4.41Å; L1004-Y1048 HydrophobicContact CD2-CD1 3.9Å; L1004-Y1048 HydrophobicContact CD2-CE1 4.2Å; L1004-Y1048 HydrophobicContact CD2-CG 4.4Å; L1004-Y1048 HydrophobicContact CG-CD1 4.48Å; L1007-Y1048 HydrophobicContact CB-CE2 4.3Å; L1007-Y1048 HydrophobicContact CD2-CE1 4.21Å; L1007-Y1048 HydrophobicContact CD2-CE2 4.01Å; L1007-Y1048 HydrophobicContact CG-CE2 3.86Å; V1022-Y1048 VanDerWaalsContact CG1-OH 3.31Å; V1022-Y1048 WeakPolarHBondContact CG1-OH 3.47Å; L1026-Y1048 HydrophobicContact CD2-CD1 3.95Å; L1026-Y1048 HydrophobicContact CD2-CE1 4.08Å; P1044-Y1048 VanDerWaalsContact O-CB 3.31Å; P1044-Y1048 WeakPolarHBondContact O-CB 3.44Å; P1044-Y1048 PolarHBondContact O-N 2.94Å; Y1048-N1050 VanDerWaalsContact C-N 3.32Å; Y1048-N1050 PolarHBondContact O-N 3.4Å; Y1048-S1051 PolarHBondContact O-N 3.09Å; Y1048-S1051 PolarHBondContact O-OG 3.05Å; Y1048-L1052 HydrophobicContact CD1-CD1 4.31Å; Y1048-L1052 HydrophobicContact CE1-CD1 3.79Å; Y1048-L1052 HydrophobicContact CE2-CD1 4.48Å; Y1048-L1052 WeakPolarHBondContact O-CG 3.37Å; Y1048-L1052 PolarHBondContact O-N 2.76Å
1049	R	91.5	Very high	73.9	Confident	75 Å²	75	66.3 Å²	66.3	28%	0.283	37%	0.371	S	S	.	.	H	α-helix	trans	-63.2	-39.1	174.6	-173.9	173.8	-177	-101.1	4.6	111.5	H1023 L1026 E1027 L1045 I1046 L1052 V1053	H1023-R1049 VanDerWaalsContact NE2-CD 3.33Å; H1023-R1049 WeakPolarHBondContact NE2-CD 3.45Å; H1023-R1049 WeakPolarHBondContact NE2-CG 3.31Å; H1023-R1049 PolarHBondContact NE2-NE 3Å; H1023-R1049 PolarHBondContact NE2-NH2 2.7Å; L1026-R1049 HydrophobicContact CD2-CB 4.34Å; E1027-R1049 IonicContact OE1-NH2 3.42Å; L1045-R1049 WeakPolarHBondContact O-CB 3.33Å; L1045-R1049 PolarHBondContact O-N 3.33Å; I1046-R1049 PolarHBondContact O-N 2.98Å; R1049-L1052 PolarHBondContact O-N 2.8Å; R1049-V1053 VanDerWaalsContact O-CG2 3.27Å; R1049-V1053 WeakPolarHBondContact O-CG2 3.26Å; R1049-V1053 PolarHBondContact O-N 2.89Å
1050	N	90.1	Very high	71.7	Confident	80 Å²	80	72.5 Å²	72.5	43%	0.428	39%	0.39	S	S	.	.	H	α-helix	trans	-64.5	-44.6	177.6	-73	-15.9	0	0	0	111.7	I1046 S1047 Y1048 L1052 V1053 T1054	I1046-N1050 WeakPolarHBondContact O-CB 3.28Å; I1046-N1050 PolarHBondContact O-N 2.92Å; I1046-N1050 PolarHBondContact O-ND2 3.45Å; I1046-N1050 PolarHBondContact O-OD1 3.42Å; S1047-N1050 PolarHBondContact O-N 2.76Å; Y1048-N1050 VanDerWaalsContact C-N 3.32Å; Y1048-N1050 PolarHBondContact O-N 3.4Å; N1050-L1052 PolarHBondContact O-N 2.73Å; N1050-V1053 PolarHBondContact O-N 3.13Å; N1050-T1054 WeakPolarHBondContact O-CG2 3.28Å; N1050-T1054 PolarHBondContact O-N 2.95Å; N1050-T1054 PolarHBondContact O-OG1 3.01Å
1051	S	92.1	Very high	69.6	Low	25 Å²	25	76 Å²	76	18%	0.175	41%	0.405	C	S	.	.	H	α-helix	trans	-67.3	-19.9	-178.8	78.2	0	0	0	0	114.1	S1011 K1019 S1047 Y1048	S1011-S1051 WeakPolarHBondContact CB-OG 3.2Å; S1011-S1051 VanDerWaalsContact OG-CB 3.28Å; S1011-S1051 WeakPolarHBondContact OG-CB 3.39Å; S1011-S1051 PolarHBondContact OG-OG 2.96Å; K1019-S1051 PolarHBondContact NZ-O 3.47Å; S1047-S1051 PolarHBondContact O-N 2.94Å; Y1048-S1051 PolarHBondContact O-N 3.09Å; Y1048-S1051 PolarHBondContact O-OG 3.05Å
1052	L	88.4	Confident	67.2	Low	7 Å²	7	77 Å²	77	4%	0.037	42%	0.415	C	S	.	.	H	α-helix	trans	-80.3	-31.4	167.8	-62.8	173.6	0	0	0	112.9	L1014 K1019 V1022 H1023 L1026 Y1048 R1049 N1050	L1014-L1052 HydrophobicContact CD1-CD2 3.6Å; K1019-L1052 HydrophobicContact CB-CD2 4.41Å; K1019-L1052 WeakPolarHBondContact CB-O 3.5Å; K1019-L1052 HydrophobicContact CG-CD2 4.3Å; V1022-L1052 HydrophobicContact CB-CD2 4.26Å; V1022-L1052 HydrophobicContact CG1-CD1 3.92Å; V1022-L1052 HydrophobicContact CG1-CD2 3.94Å; H1023-L1052 HydrophobicContact CB-CB 4.2Å; H1023-L1052 HydrophobicContact CB-CD1 4.21Å; L1026-L1052 HydrophobicContact CD2-CD1 4.34Å; Y1048-L1052 HydrophobicContact CD1-CD1 4.31Å; Y1048-L1052 HydrophobicContact CE1-CD1 3.79Å; Y1048-L1052 HydrophobicContact CE2-CD1 4.48Å; Y1048-L1052 WeakPolarHBondContact O-CG 3.37Å; Y1048-L1052 PolarHBondContact O-N 2.76Å; R1049-L1052 PolarHBondContact O-N 2.8Å; N1050-L1052 PolarHBondContact O-N 2.73Å
1053	V	81.1	Confident	64.6	Low	75 Å²	75	83.6 Å²	83.6	46%	0.455	46%	0.456	S	S	.	.	H	α-helix	trans	-89.5	-24.9	-174.7	172.4	0	0	0	0	113.5	H1023 R1049 N1050 G1055 G1056	H1023-V1053 WeakPolarHBondContact NE2-CG2 3.41Å; R1049-V1053 VanDerWaalsContact O-CG2 3.27Å; R1049-V1053 WeakPolarHBondContact O-CG2 3.26Å; R1049-V1053 PolarHBondContact O-N 2.89Å; N1050-V1053 PolarHBondContact O-N 3.13Å; V1053-G1055 PolarHBondContact O-N 3.34Å; V1053-G1056 PolarHBondContact O-N 2.99Å
1054	T	58.9	Low	61.8	Low	106 Å²	106	86.6 Å²	86.6	65%	0.65	47%	0.472	S	S	*	.			trans	-67.6	19.4	-179.3	47.4	0	0	0	0	115.6	N1050	N1050-T1054 WeakPolarHBondContact O-CG2 3.28Å; N1050-T1054 PolarHBondContact O-N 2.95Å; N1050-T1054 PolarHBondContact O-OG1 3.01Å
1055	G	52.3	Low	59.1	Low	28 Å²	28	91.9 Å²	91.9	29%	0.289	51%	0.509	S	S	.	.			trans	-95.7	34.2	161.6	0	0	0	0	0	113.3	R1016 V1053	R1016-G1055 VanDerWaalsContact CZ-O 3.24Å; R1016-G1055 PolarHBondContact NE-O 3.49Å; R1016-G1055 PolarHBondContact NH2-O 2.92Å; V1053-G1055 PolarHBondContact O-N 3.34Å
1056	G	35.8	Very low	56.1	Low	44 Å²	44	95.2 Å²	95.2	45%	0.454	55%	0.545	S	S	.	.			trans	-68.3	165.3	179.7	0	0	0	0	0	114.1	R1016 V1053 D1058	R1016-G1056 VanDerWaalsContact NH2-C 3.29Å; R1016-G1056 PolarHBondContact NH2-O 2.66Å; V1053-G1056 PolarHBondContact O-N 2.99Å; G1056-D1058 VanDerWaalsContact C-N 3.34Å; G1056-D1058 PolarHBondContact O-N 2.93Å
1057	E	35.3	Very low	53.2	Low	184 Å²	184	99 Å²	99	86%	0.86	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.9	-8.6	-159.1	-67.3	-174.5	124.2	0	0	117.8
1058	D	33.1	Very low	50.3	Low	157 Å²	157	102.7 Å²	102.7	84%	0.84	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.8	-7.6	-165.3	-75	-45	0	0	0	117.4	G1056 R1060	G1056-D1058 VanDerWaalsContact C-N 3.34Å; G1056-D1058 PolarHBondContact O-N 2.93Å; D1058-R1060 PolarHBondContact O-N 3.42Å
1059	D	32.5	Very low	47.2	Very low	150 Å²	150	107.8 Å²	107.8	80%	0.802	64%	0.636	S	S	*	*			trans	-76.5	67.4	175.7	-82.7	-41.9	0	0	0	113.4
1060	R	33.4	Very low	44.2	Very low	228 Å²	228	109 Å²	109	86%	0.86	66%	0.656	S	S	*	*	S	Bend	trans	-135.5	118.9	152.9	-87.2	-173.5	162.6	-169.8	-6.3	107.8	D1058	D1058-R1060 PolarHBondContact O-N 3.42Å
1061	M	32	Very low	41.4	Very low	192 Å²	192	113.8 Å²	113.8	95%	0.946	67%	0.673	S	S	*	*	S	Bend	trans	88.5	67.5	-175.5	-50.9	-74.1	-73.3	0	0	115.9
1062	S	28.9	Very low	38.2	Very low	102 Å²	102	118.4 Å²	118.4	71%	0.713	70%	0.7	S	S	*	*			trans	-159.6	109.6	132.8	-166.8	0	0	0	0	112.4
1063	V	33	Very low	35.2	Very low	141 Å²	141	123.3 Å²	123.3	86%	0.855	74%	0.735	S	S	*	*			trans	-118.3	99.3	145.9	176.9	0	0	0	0	104.6
1064	N	29.3	Very low	32.6	Very low	131 Å²	131	124.8 Å²	124.8	70%	0.701	75%	0.749	S	S	*	*			trans	170.1	129.6	148.3	-87.8	-4.8	0	0	0	111.6
1065	S	32	Very low	31.1	Very low	114 Å²	114	126.4 Å²	126.4	80%	0.797	76%	0.758	S	S	*	*			trans	53.6	99.5	140.9	-48.7	0	0	0	0	120.8
1066	G	26.8	Very low	29.9	Very low	75 Å²	75	136.4 Å²	136.4	77%	0.773	79%	0.787	S	S	*	*				69	125.8	108.4	0	0	0	0	0	122
1067	S	27.9	Very low	29.5	Very low	117 Å²	117	139.1 Å²	139.1	82%	0.818	80%	0.799	S	S	*	*			trans	61.4	110.2	148.7	-168.1	0	0	0	0	120.6
1068	S	29.1	Very low	29.3	Very low	125 Å²	125	139 Å²	139	87%	0.874	80%	0.796	S	S	*	*				177.2	169.5	125.5	-83.9	0	0	0	0	112.3
1069	S	28.8	Very low	29.2	Very low	108 Å²	108	141.3 Å²	141.3	76%	0.755	80%	0.799	S	S	*	*			trans	-120	148.6	-156.3	62.7	0	0	0	0	117.7
1070	S	28.4	Very low	28.8	Very low	99 Å²	99	138 Å²	138	69%	0.692	80%	0.8	S	S	*	*			trans	89.8	142.1	142.3	87.1	0	0	0	0	122.3
1071	K	30.1	Very low	28.5	Very low	182 Å²	182	138.9 Å²	138.9	79%	0.791	80%	0.803	S	S	*	*			trans	78.5	111.1	145.2	-75.5	170.4	179.6	171.9	0	122.5
1072	T	25.4	Very low	29.1	Very low	121 Å²	121	134.9 Å²	134.9	74%	0.742	79%	0.791	S	S	*	*				76.2	107.3	128.8	57.3	0	0	0	0	122.8
1073	S	25.6	Very low	30	Very low	110 Å²	110	134.7 Å²	134.7	77%	0.769	79%	0.788	S	S	*	*				87.1	129.8	118.6	78.2	0	0	0	0	123
1074	S	26.5	Very low	30.1	Very low	107 Å²	107	135 Å²	135	75%	0.748	78%	0.784	S	S	*	*				94.9	108.8	128.6	-154.8	0	0	0	0	122.5
1075	V	27.7	Very low	30	Very low	139 Å²	139	135.8 Å²	135.8	84%	0.842	78%	0.783	S	S	*	*			trans	90.7	140.3	137.5	166	0	0	0	0	121.8
1076	R	25.5	Very low	29.9	Very low	238 Å²	238	140.5 Å²	140.5	90%	0.898	78%	0.783	S	S	*	*			trans	-82.3	159.5	-176.6	-58.5	160.3	159.5	164.1	-8.1	113
1077	S	28.8	Very low	30.1	Very low	101 Å²	101	144 Å²	144	71%	0.706	78%	0.778	S	S	*	*				169.3	112.6	105.3	-177.9	0	0	0	0	118
1078	K	31.1	Very low	30.3	Very low	183 Å²	183	146.9 Å²	146.9	80%	0.796	77%	0.77	S	S	*	*			trans	53.3	125.6	135.4	-64.5	176.5	176.9	171.5	0	124.2
1079	K	30	Very low	30.5	Very low	205 Å²	205	145.7 Å²	145.7	89%	0.891	76%	0.758	S	S	*	*			trans	74.6	127.1	132.4	-73.4	-172.6	172.3	-168.9	0	121.9
1080	G	24.1	Very low	30.7	Very low	80 Å²	80	146 Å²	146	83%	0.825	75%	0.747	S	S	*	*			trans	171.3	126.1	154.7	0	0	0	0	0	115.4
1081	R	28.3	Very low	30.7	Very low	246 Å²	246	147.9 Å²	147.9	93%	0.928	75%	0.749	S	S	*	*			trans	-167.4	168	174.1	-115.4	-171	-174.1	-168.7	4.7	107.8
1082	P	44.6	Very low	30.8	Very low	108 Å²	108	146.9 Å²	146.9	70%	0.701	75%	0.748	S	S	*	*			cis	-128	-128.9	-10.3	35.1	-10.6	0	0	0	109
1083	P	48	Very low	31.1	Very low	99 Å²	99	144.8 Å²	144.8	64%	0.643	74%	0.738	S	S	*	*			cis	-140.4	172.5	-29.3	36.6	-16.5	0	0	0	118.8
1084	L	33.4	Very low	31.2	Very low	148 Å²	148	146.9 Å²	146.9	78%	0.775	74%	0.739	S	S	*	*			trans	92.1	142.4	134.4	-86.7	160.9	0	0	0	126.5
1085	H	28.5	Very low	31.4	Very low	146 Å²	146	147.7 Å²	147.7	68%	0.676	74%	0.736	S	S	*	*			trans	76.5	128.4	161.8	-78.4	4.8	0	0	0	119.7
1086	R	29.3	Very low	31.4	Very low	213 Å²	213	146.8 Å²	146.8	80%	0.804	73%	0.726	S	S	*	*				80.8	141.9	50.1	-85.4	-177.6	167.9	-178.7	-1.2	112.2
1087	K	31.5	Very low	31.5	Very low	150 Å²	150	140 Å²	140	65%	0.652	71%	0.711	S	S	*	*			cis	-166.1	150.4	28.5	-138.9	-161.2	179.3	-178.7	0	111.8
1088	R	31.7	Very low	31.3	Very low	177 Å²	177	145.9 Å²	145.9	67%	0.668	72%	0.718	S	S	*	*			trans	70.3	155.1	140.2	-88.8	-159.5	176.5	-166.2	-2.8	120.1	E1090	R1088-E1090 WeakPolarHBondContact CD-OE1 3.37Å; R1088-E1090 IonicContact CZ-OE1 3.9Å; R1088-E1090 IonicContact NE-OE1 3.78Å; R1088-E1090 PolarHBondContact NE-OE1 2.77Å; R1088-E1090 IonicContact NH1-OE1 2.6Å; R1088-E1090 PolarHBondContact NH1-OE1 2.94Å; R1088-E1090 IonicContact NH1-OE2 3.05Å; R1088-E1090 IonicContact NH2-OE1 2.69Å
1089	V	33.3	Very low	31.2	Very low	100 Å²	100	142.6 Å²	142.6	61%	0.606	71%	0.709	S	S	*	*			cis	168.6	-157.6	-4.4	63.4	0	0	0	0	109.8
1090	E	32.8	Very low	31	Very low	114 Å²	114	139.7 Å²	139.7	53%	0.533	70%	0.703	S	S	.	*			cis	-149.1	157.9	-3.7	-124.9	106.9	-122.6	0	0	104.1	R1088	R1088-E1090 WeakPolarHBondContact CD-OE1 3.37Å; R1088-E1090 IonicContact CZ-OE1 3.9Å; R1088-E1090 IonicContact NE-OE1 3.78Å; R1088-E1090 PolarHBondContact NE-OE1 2.77Å; R1088-E1090 IonicContact NH1-OE1 2.6Å; R1088-E1090 PolarHBondContact NH1-OE1 2.94Å; R1088-E1090 IonicContact NH1-OE2 3.05Å; R1088-E1090 IonicContact NH2-OE1 2.69Å
1091	D	28.9	Very low	31.1	Very low	138 Å²	138	145.8 Å²	145.8	74%	0.738	70%	0.701	S	S	*	*			cis	-151.1	-147.5	-2.4	-135.2	-1.2	0	0	0	107.6
1092	E	31.2	Very low	31	Very low	162 Å²	162	139.4 Å²	139.4	76%	0.757	69%	0.689	S	S	*	*			cis	-149.3	-122	8.7	-157.7	-137.7	-112.7	0	0	112.3
1093	S	32.5	Very low	30.1	Very low	77 Å²	77	140.7 Å²	140.7	54%	0.538	69%	0.69	S	S	.	*			trans	-123.6	-174.9	-171.5	76.7	0	0	0	0	113.3
1094	L	27.5	Very low	29.1	Very low	153 Å²	153	141.7 Å²	141.7	80%	0.801	69%	0.694	S	S	*	*			cis	-123.7	166.9	14.6	-71	168.4	0	0	0	111.7
1095	D	30.3	Very low	28.7	Very low	125 Å²	125	143.2 Å²	143.2	67%	0.668	70%	0.7	S	S	*	*			cis	94.4	138.1	20.7	-92.4	33.2	0	0	0	116.5
1096	N	27.6	Very low	28.8	Very low	120 Å²	120	143.9 Å²	143.9	64%	0.642	71%	0.707	S	S	*	*			cis	-170.8	170.6	-13.4	-135	-25.1	0	0	0	108.5
1097	T	27.6	Very low	28.6	Very low	95 Å²	95	142.2 Å²	142.2	58%	0.583	71%	0.708	S	S	*	*			cis	-161	-168	0.4	-19.1	0	0	0	0	108.9
1098	W	24.1	Very low	28.6	Very low	224 Å²	224	141.4 Å²	141.4	85%	0.848	72%	0.716	S	S	*	*			trans	84.7	158.1	159.7	-55.9	89.9	0	0	0	120
1099	L	29.4	Very low	28.5	Very low	115 Å²	115	139 Å²	139	60%	0.602	72%	0.723	S	S	*	*				-179.5	133.9	-57.3	-106.7	167	0	0	0	112.3
1100	N	27	Very low	28.2	Very low	143 Å²	143	137.8 Å²	137.8	77%	0.765	73%	0.731	S	S	*	*			trans	59.9	175.8	156.6	-72.8	-16.5	0	0	0	119.4
1101	R	25.4	Very low	28.3	Very low	209 Å²	209	138.2 Å²	138.2	79%	0.789	74%	0.744	S	S	*	*			cis	-179	136.8	-42.8	-168.7	-172.6	-159.8	-168.2	6.2	108.8
1102	T	26.1	Very low	28.2	Very low	112 Å²	112	139.5 Å²	139.5	69%	0.687	75%	0.75	S	S	*	*			trans	54.5	132.6	162.7	42.7	0	0	0	0	118.7
1103	D	26.7	Very low	28.3	Very low	135 Å²	135	137.3 Å²	137.3	72%	0.722	75%	0.75	S	S	*	*				-179.2	155.5	60.3	-108.3	-34.7	0	0	0	115
1104	T	26.1	Very low	28.3	Very low	119 Å²	119	139.7 Å²	139.7	73%	0.73	76%	0.761	S	S	*	*			trans	51.4	139.3	149.4	60.6	0	0	0	0	127
1105	M	25.5	Very low	28.3	Very low	180 Å²	180	138.6 Å²	138.6	89%	0.887	76%	0.763	S	S	*	*			trans	104.4	148.2	131.6	-101.5	-175.6	-173.4	0	0	123.3
1106	I	29.9	Very low	28	Very low	161 Å²	161	140.9 Å²	140.9	83%	0.826	77%	0.769	S	S	*	*			trans	90.9	156.3	170.8	-59.9	169.6	0	0	0	116.8
1107	Q	25.5	Very low	28	Very low	177 Å²	177	142.1 Å²	142.1	83%	0.827	78%	0.775	S	S	*	*			trans	-100.8	165.7	-149.9	-64.2	158.7	-57.9	0	0	115.6
1108	T	32	Very low	27.9	Very low	134 Å²	134	145 Å²	145	82%	0.822	79%	0.793	S	S	*	*			trans	-55.6	148.9	166.3	43.8	0	0	0	0	113.5
1109	P	29.5	Very low	28	Very low	126 Å²	126	139.3 Å²	139.3	82%	0.818	79%	0.788	S	S	*	*				-151.9	163.5	93.7	40.2	-23.8	0	0	0	117.4
1110	G	25.7	Very low	27.8	Very low	74 Å²	74	140.3 Å²	140.3	76%	0.763	80%	0.798	S	S	*	*			trans	85.7	126.4	139.6	0	0	0	0	0	120.2
1111	P	35	Very low	27.7	Very low	124 Å²	124	139.3 Å²	139.3	81%	0.805	80%	0.797	S	S	*	*			trans	-98.7	-175.8	167.2	39.1	-34	0	0	0	113.7
1112	L	27.9	Very low	27.6	Very low	165 Å²	165	136.5 Å²	136.5	86%	0.864	80%	0.797	S	S	*	*			trans	92.9	154.9	175.4	-58.4	173.3	0	0	0	116.7
1113	P	32.7	Very low	27.5	Very low	116 Å²	116	143.1 Å²	143.1	75%	0.753	81%	0.809	S	S	*	*			cis	-123.5	168.7	-4.8	39.1	-25.4	0	0	0	115.4
1114	T	33.2	Very low	27.4	Very low	127 Å²	127	145.3 Å²	145.3	78%	0.779	82%	0.815	S	S	*	*			trans	-92.3	143.9	165.7	47.9	0	0	0	0	112.4
1115	P	27.5	Very low	27.2	Very low	129 Å²	129	147.6 Å²	147.6	84%	0.838	82%	0.823	S	S	*	*			trans	-88.4	159.6	169.5	35.4	-33.6	0	0	0	113.2
1116	Q	24.7	Very low	27.1	Very low	173 Å²	173	143.5 Å²	143.5	81%	0.808	81%	0.812	S	S	*	*			trans	-113.5	156.6	-178.1	-77.6	-172.3	-20.3	0	0	114.3
1117	L	26.6	Very low	26.8	Very low	146 Å²	146	147.1 Å²	147.1	76%	0.764	82%	0.815	S	S	*	*			trans	33.4	138.3	139.8	-60.4	169	0	0	0	121.9
1118	T	25	Very low	27.4	Very low	157 Å²	157	144.9 Å²	144.9	96%	0.963	82%	0.817	S	S	*	*				-163.9	173.7	125.8	7.1	0	0	0	0	113.4
1119	S	25.9	Very low	26.9	Very low	104 Å²	104	147.7 Å²	147.7	73%	0.727	82%	0.823	S	S	*	*			trans	-122.4	161.7	-163.7	172.3	0	0	0	0	113.7
1120	T	25.1	Very low	26.6	Very low	135 Å²	135	144.8 Å²	144.8	83%	0.828	82%	0.815	S	S	*	*			trans	165.1	156	152.4	30	0	0	0	0	111.5
1121	V	25.1	Very low	26.6	Very low	122 Å²	122	150.6 Å²	150.6	74%	0.739	82%	0.822	S	S	*	*			cis	-162.2	164.7	-40.1	103.4	0	0	0	0	112
1122	L	24.1	Very low	26.1	Very low	151 Å²	151	153.2 Å²	153.2	79%	0.791	82%	0.824	S	S	*	*			trans	-17.9	150.3	170.5	-61.8	165.4	0	0	0	122
1123	R	24.7	Very low	25.9	Very low	250 Å²	250	152.9 Å²	152.9	94%	0.943	82%	0.822	S	S	*	*				-159.8	140	124	-124.9	178.7	-175.8	-175	0.7	116.1
1124	E	23.9	Very low	25.5	Very low	181 Å²	181	155.9 Å²	155.9	85%	0.846	83%	0.826	S	S	*	*			trans	-94.6	169.8	168.8	-58.1	172.4	100.4	0	0	112.3
1125	N	22.2	Very low	25.2	Very low	167 Å²	167	158 Å²	158	89%	0.893	83%	0.827	S	S	*	*			trans	-157.2	159.2	146	-131.3	-5.6	0	0	0	111.3
1126	S	22.5	Very low	25.3	Very low	94 Å²	94	157.8 Å²	157.8	66%	0.657	83%	0.825	S	S	*	*			trans	-152.1	171.4	-166.1	65.1	0	0	0	0	116.3
1127	R	24.2	Very low	25.2	Very low	237 Å²	237	157.6 Å²	157.6	89%	0.894	82%	0.824	S	S	*	*			trans	75.6	162.6	165.2	-65.9	-179	-178.5	-156.5	-0.9	116.6
1128	P	36.9	Very low	25	Very low	131 Å²	131	156 Å²	156	85%	0.851	83%	0.825	S	S	*	*			cis	-124.9	-167.6	10.5	40.8	-23.6	0	0	0	116.5
1129	M	23.3	Very low	24.9	Very low	193 Å²	193	156 Å²	156	95%	0.951	81%	0.814	S	S	*	*			trans	-125.5	161.7	-161.3	-165.8	-177.4	87.1	0	0	111.8
1130	G	23.2	Very low	24.8	Very low	64 Å²	64	158.9 Å²	158.9	66%	0.66	82%	0.816	S	S	*	*			trans	157.6	144.6	165.5	0	0	0	0	0	112.4
1131	E	24.5	Very low	24.7	Very low	196 Å²	196	156.2 Å²	156.2	92%	0.916	82%	0.815	S	S	*	*			cis	-154.8	175.9	-9.9	-154.7	164.4	-137.8	0	0	109.5
1132	Q	24.8	Very low	24.7	Very low	180 Å²	180	155.6 Å²	155.6	84%	0.841	82%	0.816	S	S	*	*			trans	-83.7	158.3	-169	-57.6	169.5	-59	0	0	114.7
1133	I	24.4	Very low	24.7	Very low	158 Å²	158	156.8 Å²	156.8	81%	0.81	82%	0.818	S	S	*	*			trans	-178.6	110.2	142.8	-95.5	148.6	0	0	0	105.8
1134	Q	22.7	Very low	25.3	Very low	179 Å²	179	149.9 Å²	149.9	84%	0.836	81%	0.806	S	S	*	*				96.2	120	59.8	176.7	169.2	92.4	0	0	111.6
1135	E	27.7	Very low	25.4	Very low	171 Å²	171	148.1 Å²	148.1	80%	0.799	80%	0.802	S	S	*	*			trans	-69	171.8	178.9	-60.5	170.7	131.4	0	0	112.5
1136	P	29.7	Very low	25.4	Very low	124 Å²	124	148.1 Å²	148.1	81%	0.805	79%	0.794	S	S	*	*				-138.2	162.2	107.3	39.1	-29.5	0	0	0	116.2
1137	E	22.5	Very low	25.4	Very low	170 Å²	170	150 Å²	150	79%	0.794	80%	0.796	S	S	*	*			trans	-72.1	-168.9	178.6	-50.8	148.2	113.3	0	0	113.9
1138	S	22.6	Very low	25.5	Very low	111 Å²	111	147.2 Å²	147.2	78%	0.776	79%	0.793	S	S	*	*			trans	83.1	141.2	157.4	78	0	0	0	0	119
1139	E	23.5	Very low	25.2	Very low	158 Å²	158	146.7 Å²	146.7	74%	0.738	78%	0.783	S	S	*	*			cis	-168.8	166.3	-29.8	-128.3	174.4	-158.1	0	0	110
1140	H	23.8	Very low	25.8	Very low	164 Å²	164	142 Å²	142	76%	0.759	77%	0.767	S	S	*	*			trans	30	130.1	154.2	-58.4	-40.5	0	0	0	122.5
1141	G	22.9	Very low	25.9	Very low	79 Å²	79	146.2 Å²	146.2	81%	0.814	77%	0.77	S	S	*	*			trans	-162.7	17.5	177.3	0	0	0	0	0	120.6
1142	S	23.9	Very low	26	Very low	110 Å²	110	143.7 Å²	143.7	77%	0.769	76%	0.759	S	S	*	*			trans	35.8	127.8	158.9	-56.2	0	0	0	0	123.9
1143	E	24.5	Very low	26.1	Very low	176 Å²	176	142.9 Å²	142.9	82%	0.822	76%	0.755	S	S	*	*				11.4	164.9	124.9	-58.4	-176.7	136.8	0	0	121.7
1144	P	37	Very low	26.4	Very low	105 Å²	105	142.2 Å²	142.2	68%	0.682	75%	0.752	S	S	*	*			cis	-122	-159.2	7	44.8	-29.4	0	0	0	112.1
1145	D	26	Very low	26.5	Very low	144 Å²	144	138.5 Å²	138.5	77%	0.77	75%	0.746	S	S	*	*			cis	-130.1	160.1	4.6	-80.5	-61	0	0	0	109.5
1146	F	22.9	Very low	26.5	Very low	167 Å²	167	141 Å²	141	73%	0.732	75%	0.748	S	S	*	*			cis	96.2	89.2	35.1	-106.7	-90.4	0	0	0	118
1147	L	23.1	Very low	26.5	Very low	133 Å²	133	143.1 Å²	143.1	70%	0.696	75%	0.752	S	S	*	*			trans	38.2	119.8	143.6	-56.8	-179.1	0	0	0	122
1148	H	26.1	Very low	26.8	Very low	178 Å²	178	138.9 Å²	138.9	82%	0.824	75%	0.754	S	S	*	*				-152	107.5	106.8	-125.8	66.8	0	0	0	114.4
1149	N	30.1	Very low	26.9	Very low	120 Å²	120	142.4 Å²	142.4	64%	0.642	76%	0.758	S	S	*	*			trans	-85.7	146.8	151.3	-167.3	9.2	0	0	0	106.9
1150	P	35.8	Very low	27.5	Very low	95 Å²	95	140.6 Å²	140.6	62%	0.617	76%	0.76	S	S	*	*				-148.3	165.4	99.2	35.2	-18.2	0	0	0	114.9
1151	Q	26.7	Very low	27.8	Very low	153 Å²	153	142 Å²	142	72%	0.715	76%	0.764	S	S	*	*			cis	-177.3	163.3	-15.4	-95.1	179.9	-43.4	0	0	104.1
1152	M	26.2	Very low	27.9	Very low	142 Å²	142	144.1 Å²	144.1	70%	0.7	76%	0.756	S	S	*	*			cis	-168.6	158.7	-13	-97.4	176.7	126.9	0	0	105.6
1153	Q	25.3	Very low	28.1	Very low	163 Å²	163	146.3 Å²	146.3	76%	0.762	76%	0.755	S	S	*	*			cis	57.1	87.7	3.8	-79.4	-175.6	-89.7	0	0	115.1
1154	I	30.7	Very low	28.2	Very low	144 Å²	144	144 Å²	144	74%	0.738	75%	0.748	S	S	*	*				166.9	172.8	77.9	-82.7	142.1	0	0	0	106.2
1155	S	26.8	Very low	27.8	Very low	102 Å²	102	145 Å²	145	71%	0.713	75%	0.746	S	S	*	*				138.5	149	124.9	-158.6	0	0	0	0	118.2
1156	W	26.9	Very low	27.9	Very low	222 Å²	222	143.3 Å²	143.3	84%	0.841	74%	0.737	S	S	*	*			trans	-63.9	177	149.6	-86	66	0	0	0	111.9
1157	L	28.6	Very low	28.1	Very low	169 Å²	169	144.8 Å²	144.8	89%	0.885	74%	0.738	S	S	*	*	S	Bend	trans	71.2	110.5	-164.9	-65.3	164.6	0	0	0	112.3
1158	G	30.3	Very low	28.4	Very low	82 Å²	82	145.9 Å²	145.9	85%	0.845	74%	0.738	S	S	*	*			trans	-77.4	158.2	-167.2	0	0	0	0	0	115.5
1159	Q	25.1	Very low	28.4	Very low	184 Å²	184	142.3 Å²	142.3	86%	0.86	73%	0.725	S	S	*	*			trans	-136.7	150.2	170.1	-70.4	-166.9	-10	0	0	111.6
1160	P	35.8	Very low	28.3	Very low	120 Å²	120	146.2 Å²	146.2	78%	0.779	73%	0.73	S	S	*	*			trans	-81.2	154.6	173	33.9	-34.6	0	0	0	112.9
1161	K	29.1	Very low	27.9	Very low	194 Å²	194	148 Å²	148	84%	0.843	74%	0.739	S	S	*	*			trans	-3.5	147	157.5	-55.8	-179.3	180	179.6	0	117.5
1162	L	26	Very low	27.8	Very low	123 Å²	123	144.3 Å²	144.3	64%	0.644	74%	0.743	S	S	*	*				-176	147.6	52.7	-167.2	74	0	0	0	111.7
1163	E	27.6	Very low	27.7	Very low	157 Å²	157	145.6 Å²	145.6	73%	0.734	75%	0.749	S	S	*	*			trans	59.5	147.9	151.3	-84.4	156.2	-142.9	0	0	120.6
1164	D	27.1	Very low	27.8	Very low	127 Å²	127	144.2 Å²	144.2	68%	0.679	75%	0.747	S	S	*	*			cis	-159.5	169.2	-6.8	-148.9	-2.7	0	0	0	114.4
1165	L	26.8	Very low	27.5	Very low	125 Å²	125	146.4 Å²	146.4	65%	0.654	75%	0.747	S	S	*	*			trans	58.7	122.2	149.6	-74.9	160.6	0	0	0	124.3
1166	N	28.3	Very low	27.5	Very low	109 Å²	109	148 Å²	148	58%	0.583	75%	0.745	S	S	*	*				98.7	104.5	125	-83.4	-29.8	0	0	0	123.8
1167	R	28.8	Very low	27.5	Very low	198 Å²	198	145.3 Å²	145.3	75%	0.747	74%	0.74	S	S	*	*				81.5	120.1	116	-76.8	173.8	177.4	-163.7	-2	123
1168	K	28.8	Very low	27.4	Very low	157 Å²	157	142.9 Å²	142.9	68%	0.683	73%	0.732	S	S	*	*				74.8	154.1	126	-71.5	176	156.8	-77.3	0	118.5
1169	D	26.2	Very low	27.2	Very low	103 Å²	103	150.3 Å²	150.3	55%	0.551	73%	0.734	S	S	*	*			cis	-153.9	142.7	-6.1	-120	-29.7	0	0	0	111.5
1170	R	28	Very low	27.2	Very low	201 Å²	201	145.8 Å²	145.8	76%	0.758	73%	0.728	S	S	*	*			trans	48.2	126.3	139.3	-71.7	172.6	64.7	167.6	4.6	124
1171	T	26.4	Very low	26.6	Very low	132 Å²	132	143.7 Å²	143.7	81%	0.81	73%	0.729	S	S	*	*			trans	70.6	150.8	132.2	59.4	0	0	0	0	121.3
1172	G	24.8	Very low	26.5	Very low	77 Å²	77	141.4 Å²	141.4	79%	0.794	73%	0.73	S	S	*	*			trans	-173.7	-25.5	169.1	0	0	0	0	0	122.5
1173	M	25.4	Very low	26.5	Very low	168 Å²	168	146.3 Å²	146.3	83%	0.828	74%	0.74	S	S	*	*			trans	28.8	119.6	165.2	-157.9	131.6	68.8	0	0	122.6
1174	N	26.5	Very low	26.5	Very low	135 Å²	135	147.5 Å²	147.5	72%	0.722	75%	0.746	S	S	*	*			trans	81.1	156.7	141.5	-82.2	-14.7	0	0	0	125.4
1175	Y	24.8	Very low	26.4	Very low	189 Å²	189	145.2 Å²	145.2	74%	0.741	74%	0.744	S	S	*	*			trans	91.8	94.8	151.7	-81.4	-68.9	0	0	0	123.6
1176	M	25.3	Very low	26.4	Very low	135 Å²	135	146 Å²	146	67%	0.665	75%	0.754	S	S	*	*				65.4	130.5	122	-84.3	-164.6	-178.1	0	0	125.6
1177	K	27.3	Very low	26.3	Very low	167 Å²	167	151.9 Å²	151.9	73%	0.726	77%	0.768	S	S	*	*				85.8	119.3	125.2	-79.2	-175.8	175.9	169.5	0	123.8
1178	V	26.5	Very low	26.1	Very low	118 Å²	118	145.4 Å²	145.4	72%	0.715	76%	0.763	S	S	*	*				95.1	143.2	117.2	164.7	0	0	0	0	122
1179	R	26.1	Very low	26	Very low	237 Å²	237	144.3 Å²	144.3	89%	0.894	76%	0.763	S	S	*	*			trans	80.6	156.2	166	-83.6	164.9	177.5	179.4	-1.2	118.6
1180	A	24.8	Very low	26.2	Very low	89 Å²	89	146.3 Å²	146.3	74%	0.736	77%	0.771	S	S	*	*			cis	177.4	136.3	-40.1	0	0	0	0	0	111.4
1181	G	24.7	Very low	26.2	Very low	77 Å²	77	143 Å²	143	79%	0.794	76%	0.764	S	S	*	*			trans	78.4	168.8	169.1	0	0	0	0	0	115.3
1182	V	26.5	Very low	26.3	Very low	145 Å²	145	145.3 Å²	145.3	88%	0.879	77%	0.766	S	S	*	*			cis	-141.2	157.2	5.7	174.6	0	0	0	0	110.6
1183	R	26.4	Very low	26.5	Very low	226 Å²	226	149.9 Å²	149.9	85%	0.853	77%	0.772	S	S	*	*			trans	-70.8	156.8	-177.5	-53.5	167.2	177.1	164.6	-4.8	114.6
1184	H	26.8	Very low	26.6	Very low	183 Å²	183	146.4 Å²	146.4	85%	0.847	77%	0.77	S	S	*	*				166.6	157.9	124	-93.3	69.1	0	0	0	109.8
1185	A	25.5	Very low	26.8	Very low	78 Å²	78	148.7 Å²	148.7	65%	0.645	78%	0.777	S	S	*	*			cis	-176.1	174.9	-28.1	0	0	0	0	0	108.6
1186	V	26.1	Very low	27	Very low	141 Å²	141	145.1 Å²	145.1	86%	0.855	78%	0.777	S	S	*	*			trans	88.3	109.1	-175.9	-174.9	0	0	0	0	112.7
1187	R	26.7	Very low	27.1	Very low	233 Å²	233	146.2 Å²	146.2	88%	0.879	78%	0.783	S	S	*	*			cis	82	128.6	19.7	-156.8	-170.1	-166.3	-163.1	4.9	114.9
1188	G	24	Very low	27	Very low	62 Å²	62	147.1 Å²	147.1	64%	0.639	79%	0.788	S	S	*	*			cis	-125.7	-145.8	-15.7	0	0	0	0	0	108.5
1189	L	27.3	Very low	27.3	Very low	134 Å²	134	150.8 Å²	150.8	70%	0.702	80%	0.797	S	S	*	*			cis	-156.9	151.2	6.4	-78.6	174.4	0	0	0	104.6
1190	M	30	Very low	27.4	Very low	145 Å²	145	146.3 Å²	146.3	71%	0.714	79%	0.791	S	S	*	*			cis	-141.1	177.6	6.4	-100.5	143.2	59.6	0	0	106.9
1191	E	28.8	Very low	27.7	Very low	132 Å²	132	148.7 Å²	148.7	62%	0.617	80%	0.796	S	S	*	*			cis	74.6	113.9	32.4	-50.8	130	-120.5	0	0	114.2
1192	E	29.3	Very low	27.9	Very low	180 Å²	180	153.4 Å²	153.4	84%	0.841	80%	0.799	S	S	*	*			cis	-171.8	141.3	-10.5	-142.2	164.6	-138	0	0	109.1
1193	D	27.7	Very low	28.1	Very low	173 Å²	173	155.5 Å²	155.5	93%	0.925	80%	0.802	S	S	*	*			trans	-177.2	89.6	156.2	-109.3	-16.3	0	0	0	110.8
1194	A	28.6	Very low	28	Very low	95 Å²	95	150.3 Å²	150.3	79%	0.785	80%	0.8	S	S	*	*			trans	-145.6	96.9	176.4	0	0	0	0	0	110.3
1195	E	29.1	Very low	28	Very low	183 Å²	183	147.3 Å²	147.3	86%	0.855	80%	0.8	S	S	*	*			trans	-67.3	138.7	175.6	-69.7	-164.5	134.2	0	0	111.7	I1197	E1195-I1197 PolarHBondContact O-N 2.88Å; E1195-I1197 VanDerWaalsContact O-N 3.16Å
1196	P	29.3	Very low	28.1	Very low	115 Å²	115	155.2 Å²	155.2	75%	0.747	81%	0.813	S	S	*	*			trans	-79.9	100	-176.2	31.5	-34.6	0	0	0	111.8	F1198	P1196-F1198 PolarHBondContact O-N 3.44Å
1197	I	28.3	Very low	28.1	Very low	157 Å²	157	154 Å²	154	81%	0.805	81%	0.811	S	S	*	*			trans	-73.8	123.6	163	-59.8	178.8	0	0	0	108.2	E1195 E1199	E1195-I1197 PolarHBondContact O-N 2.88Å; E1195-I1197 VanDerWaalsContact O-N 3.16Å; I1197-E1199 PolarHBondContact O-N 3.2Å
1198	F	25.1	Very low	28	Very low	186 Å²	186	152.2 Å²	152.2	82%	0.816	81%	0.813	S	S	*	*			trans	-62.6	114.1	-176.9	-83.1	-112.9	0	0	0	112.6	P1196 D1200	P1196-F1198 PolarHBondContact O-N 3.44Å; F1198-D1200 VanDerWaalsContact C-N 3.27Å; F1198-D1200 PolarHBondContact O-N 2.91Å; F1198-D1200 VanDerWaalsContact O-N 3.14Å
1199	E	32.3	Very low	28.2	Very low	196 Å²	196	157.2 Å²	157.2	92%	0.916	82%	0.824	S	S	*	*			trans	-78	73.5	157.7	-72.9	-168.3	123.2	0	0	110	I1197	I1197-E1199 PolarHBondContact O-N 3.2Å
1200	D	28.7	Very low	28.2	Very low	143 Å²	143	159.7 Å²	159.7	77%	0.765	83%	0.832	S	S	*	*			trans	-160.8	51.1	170.7	-125.3	-13.5	0	0	0	116.5	F1198	F1198-D1200 VanDerWaalsContact C-N 3.27Å; F1198-D1200 PolarHBondContact O-N 2.91Å; F1198-D1200 VanDerWaalsContact O-N 3.14Å
1201	V	30.9	Very low	28	Very low	139 Å²	139	160.3 Å²	160.3	84%	0.842	84%	0.838	S	S	*	*	S	Bend	trans	-150.7	103.9	150.4	-176.8	0	0	0	0	109.6
1202	M	29.1	Very low	27.9	Very low	175 Å²	175	162.5 Å²	162.5	86%	0.862	85%	0.85	S	S	*	*	S	Bend	trans	-173.4	6.1	150.5	-101.5	-48.1	-94.8	0	0	114.2
1203	M	29.7	Very low	27.8	Very low	189 Å²	189	161.1 Å²	161.1	93%	0.931	85%	0.849	S	S	*	*	S	Bend	trans	-125.3	51.8	-172.6	-70.5	-66.5	-74.1	0	0	114.1
1204	S	25.4	Very low	27.8	Very low	117 Å²	117	161.5 Å²	161.5	82%	0.818	85%	0.845	S	S	*	*			trans	-164	110.1	163.6	-174.6	0	0	0	0	113.2
1205	S	25.8	Very low	27.7	Very low	121 Å²	121	166.3 Å²	166.3	85%	0.846	85%	0.851	S	S	*	*			trans	-176.7	67.8	149.6	60.5	0	0	0	0	111.5
1206	R	27.2	Very low	27.5	Very low	243 Å²	243	166 Å²	166	92%	0.917	85%	0.847	S	S	*	*			trans	-97.4	144.2	154.5	-151.7	176.3	-170.4	-176.3	3.4	106.3
1207	S	26.4	Very low	27.3	Very low	115 Å²	115	169.6 Å²	169.6	80%	0.804	85%	0.854	S	S	*	*			trans	60.1	89.5	-169.3	66	0	0	0	0	116.6
1208	Q	25.5	Very low	27.1	Very low	197 Å²	197	169 Å²	169	92%	0.921	85%	0.853	S	S	*	*				-151.4	117.3	122.9	-115	170.8	-14.2	0	0	108.8
1209	L	28.7	Very low	27.4	Very low	166 Å²	166	166.6 Å²	166.6	87%	0.869	85%	0.853	S	S	*	*			trans	-105.7	171.3	162.9	-83.8	163.2	0	0	0	106.9
1210	E	27.6	Very low	27	Very low	186 Å²	186	164.3 Å²	164.3	87%	0.869	85%	0.845	S	S	*	*			trans	80.8	145.1	-179.3	-53.5	175.8	170.8	0	0	114.8
1211	D	25.5	Very low	26.9	Very low	159 Å²	159	164.1 Å²	164.1	85%	0.85	85%	0.848	S	S	*	*			trans	49.1	92.6	178.5	-64.6	-9.3	0	0	0	119.6
1212	M	26.5	Very low	26.7	Very low	177 Å²	177	163.6 Å²	163.6	87%	0.872	84%	0.839	S	S	*	*				-167.1	113.1	107.7	-101.3	-178.4	71.6	0	0	111.9
1213	N	26.1	Very low	26.5	Very low	152 Å²	152	162 Å²	162	81%	0.813	83%	0.834	S	S	*	*			trans	-88.3	179.6	158.1	-92.4	-28	0	0	0	109.2
1214	E	28.7	Very low	26.4	Very low	180 Å²	180	158.5 Å²	158.5	84%	0.841	82%	0.819	S	S	*	*			trans	72	86.9	171.7	-53.2	-176.3	170.5	0	0	116
1215	E	26.3	Very low	26.4	Very low	196 Å²	196	158.5 Å²	158.5	92%	0.916	82%	0.816	S	S	*	*				-174.1	138.9	97.4	-94.7	-176.8	166.4	0	0	110.9
1216	F	24.7	Very low	26.4	Very low	176 Å²	176	157 Å²	157	77%	0.772	80%	0.803	S	S	*	*			trans	-148.6	123.7	179.2	-121.6	-77.5	0	0	0	107.9
1217	E	25.2	Very low	26.3	Very low	192 Å²	192	149 Å²	149	90%	0.897	78%	0.784	S	S	*	*			trans	179.7	102.4	144.1	-106.9	175.6	-158	0	0	110.1
1218	D	24.2	Very low	26.4	Very low	145 Å²	145	153 Å²	153	78%	0.775	78%	0.782	S	S	*	*	S	Bend		-158.8	163.8	124.8	-133.2	-30.2	0	0	0	111.1	M1220	D1218-M1220 PolarHBondContact O-N 3.46Å
1219	T	30.6	Very low	26.7	Very low	134 Å²	134	147.2 Å²	147.2	82%	0.822	76%	0.757	S	S	*	*			trans	-51.2	112	-161.6	56	0	0	0	0	116.6
1220	M	24.4	Very low	26.8	Very low	149 Å²	149	144.1 Å²	144.1	73%	0.734	73%	0.734	S	S	*	*			trans	-130.8	146.5	157.9	-72.2	-161	-68.6	0	0	111.3	D1218 I1222	D1218-M1220 PolarHBondContact O-N 3.46Å; M1220-I1222 PolarHBondContact O-N 2.86Å
1221	V	27.7	Very low	27	Very low	139 Å²	139	141.3 Å²	141.3	84%	0.842	72%	0.716	S	S	*	*			trans	-74.1	107.2	164.7	177.2	0	0	0	0	106.8	D1223	V1221-D1223 PolarHBondContact O-N 3.29Å
1222	I	24.7	Very low	27.2	Very low	127 Å²	127	139.3 Å²	139.3	65%	0.651	70%	0.701	S	S	*	*			trans	-78.1	88.2	-177.7	-54.3	179.8	0	0	0	109.4	M1220	M1220-I1222 PolarHBondContact O-N 2.86Å
1223	D	26.5	Very low	27.5	Very low	141 Å²	141	135.3 Å²	135.3	75%	0.754	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-64.4	126.8	149.6	-89.2	-46.1	0	0	0	108.6	V1221	V1221-D1223 PolarHBondContact O-N 3.29Å
1224	L	27.9	Very low	27.7	Very low	117 Å²	117	130.8 Å²	130.8	61%	0.613	66%	0.66	S	S	*	*	P	Polyproline II helix	trans	-64.5	143.6	171.5	-72.5	166.3	0	0	0	109.5
1225	P	23.8	Very low	28	Very low	116 Å²	116	126.7 Å²	126.7	75%	0.753	64%	0.641	S	S	*	*	P	Polyproline II helix	trans	-57.6	124.8	-176.1	23.3	-33.9	0	0	0	110.6	S1227	P1225-S1227 PolarHBondContact O-N 3.14Å
1226	P	26.5	Very low	28.2	Very low	90 Å²	90	121.6 Å²	121.6	58%	0.584	62%	0.619	S	S	*	*	P	Polyproline II helix	trans	-70.6	120.1	-177.2	26.7	-33.4	0	0	0	110.7
1227	S	25.8	Very low	29	Very low	74 Å²	74	117.4 Å²	117.4	52%	0.517	60%	0.599	S	S	.	*	P	Polyproline II helix	trans	-62.5	151.1	158.6	53.4	0	0	0	0	109.8	P1225 N1229 R1230	P1225-S1227 PolarHBondContact O-N 3.14Å; S1227-N1229 PolarHBondContact O-N 3.26Å; S1227-R1230 WeakPolarHBondContact O-CB 3.47Å; S1227-R1230 PolarHBondContact O-N 3.35Å; S1227-R1230 VanDerWaalsContact O-N 3.17Å
1228	R	28.8	Very low	29.7	Very low	200 Å²	200	111.1 Å²	111.1	76%	0.755	57%	0.574	S	S	*	*	G	3₁₀ helix	trans	-52.1	-52.7	-176.5	-114.2	176.8	167.7	174.6	-7.6	111.6	R1230 R1231	R1228-R1230 PolarHBondContact O-N 2.85Å; R1228-R1231 PolarHBondContact O-N 3.01Å
1229	N	30.8	Very low	30.5	Very low	76 Å²	76	109 Å²	109	41%	0.406	56%	0.563	S	S	.	*	G	3₁₀ helix	trans	-65.4	-9	-174.6	-42.7	42.5	0	0	0	113.6	E855 S1227 R1231	E855-N1229 PolarHBondContact OE1-ND2 2.87Å; E855-N1229 VanDerWaalsContact OE1-ND2 3.16Å; S1227-N1229 PolarHBondContact O-N 3.26Å; N1229-R1231 VanDerWaalsContact C-N 3.33Å; N1229-R1231 PolarHBondContact O-N 3.44Å
1230	R	30.2	Very low	31.2	Very low	100 Å²	100	103.7 Å²	103.7	38%	0.377	53%	0.528	S	S	.	.	G	3₁₀ helix	trans	-76.1	-18.2	-179.4	-150	-173.5	-160.9	-161	8.5	113.5	N898 S1227 R1228	N898-R1230 PolarHBondContact OD1-NH2 2.89Å; S1227-R1230 WeakPolarHBondContact O-CB 3.47Å; S1227-R1230 PolarHBondContact O-N 3.35Å; S1227-R1230 VanDerWaalsContact O-N 3.17Å; R1228-R1230 PolarHBondContact O-N 2.85Å
1231	R	32.3	Very low	32.2	Very low	128 Å²	128	97.9 Å²	97.9	48%	0.483	50%	0.499	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-48.9	179.1	-75.4	-174.4	172.6	176.2	-3	112.2	R1228 N1229 R1233 A1234 E1235	R1228-R1231 PolarHBondContact O-N 3.01Å; N1229-R1231 VanDerWaalsContact C-N 3.33Å; N1229-R1231 PolarHBondContact O-N 3.44Å; R1231-R1233 VanDerWaalsContact C-N 3.33Å; R1231-R1233 PolarHBondContact O-N 3Å; R1231-A1234 WeakPolarHBondContact O-CB 3.21Å; R1231-A1234 PolarHBondContact O-N 2.84Å; R1231-E1235 PolarHBondContact O-N 3.04Å
1232	E	29.4	Very low	32.5	Very low	116 Å²	116	95.1 Å²	95.1	54%	0.542	48%	0.479	S	S	.	.	H	α-helix	trans	-58.7	-45	176.8	-71	133.6	164.1	0	0	111.4	A1234 E1235	E1232-A1234 PolarHBondContact O-N 3.19Å; E1232-E1235 PolarHBondContact O-N 2.98Å
1233	R	33	Very low	32.6	Very low	94 Å²	94	93.1 Å²	93.1	36%	0.355	48%	0.477	S	S	.	.	H	α-helix	trans	-70.9	7.3	174.8	-61.9	-170.5	-174.1	-171	4.7	115.2	E855 R1231 R1237	E855-R1233 IonicContact OE2-CZ 2.7Å; E855-R1233 IonicContact OE2-NE 3.16Å; E855-R1233 IonicContact OE2-NH2 3.36Å; E855-R1233 PolarHBondContact OE2-NH2 3.34Å; R1231-R1233 VanDerWaalsContact C-N 3.33Å; R1231-R1233 PolarHBondContact O-N 3Å; R1233-R1237 PolarHBondContact O-NE 3.46Å; R1233-R1237 PolarHBondContact O-NH2 3.02Å
1234	A	30.8	Very low	32.6	Very low	57 Å²	57	88.3 Å²	88.3	47%	0.471	46%	0.457	S	S	.	.	H	α-helix	trans	-108.8	-28.6	175.3	0	0	0	0	0	113.3	R1231 E1232	R1231-A1234 WeakPolarHBondContact O-CB 3.21Å; R1231-A1234 PolarHBondContact O-N 2.84Å; E1232-A1234 PolarHBondContact O-N 3.19Å
1235	E	33.4	Very low	32.5	Very low	94 Å²	94	84.2 Å²	84.2	44%	0.439	44%	0.44	S	S	.	.	H	α-helix	trans	-91.5	-5.6	-174	-65.3	176.1	175.4	0	0	113.2	R1231 E1232	R1231-E1235 PolarHBondContact O-N 3.04Å; E1232-E1235 PolarHBondContact O-N 2.98Å
1236	L	31.8	Very low	32.7	Very low	88 Å²	88	83.4 Å²	83.4	46%	0.461	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.9	21.9	177.6	-66.1	171.7	0	0	0	113.9	P1238	L1236-P1238 WeakPolarHBondContact O-CD 3.46Å
1237	R	40.9	Very low	32.7	Very low	89 Å²	89	82.8 Å²	82.8	34%	0.336	42%	0.419	S	S	.	.			trans	-96.2	118.6	-177.4	-64.7	-172.4	179.2	-137.6	-6.1	112	N898 D902 R1233	N898-R1237 PolarHBondContact O-NH1 2.94Å; N898-R1237 PolarHBondContact O-NH2 3.1Å; D902-R1237 IonicContact OD1-NH1 3.56Å; D902-R1237 WeakPolarHBondContact OD2-CD 3.4Å; D902-R1237 IonicContact OD2-CZ 3.17Å; D902-R1237 IonicContact OD2-NE 3.38Å; D902-R1237 IonicContact OD2-NH1 2.7Å; D902-R1237 PolarHBondContact OD2-NH1 2.98Å; R1233-R1237 PolarHBondContact O-NE 3.46Å; R1233-R1237 PolarHBondContact O-NH2 3.02Å
1238	P	39.7	Very low	32.6	Very low	59 Å²	59	86.3 Å²	86.3	38%	0.383	43%	0.427	S	S	.	.			trans	-63.1	145.3	167.3	-20.6	33.1	0	0	0	111.8	L1236 F1240	L1236-P1238 WeakPolarHBondContact O-CD 3.46Å; P1238-F1240 HydrophobicContact CB-CE1 4.23Å; P1238-F1240 HydrophobicContact CB-CE2 4.19Å; P1238-F1240 HydrophobicContact CB-CZ 4.04Å; P1238-F1240 HydrophobicContact CG-CE1 4.42Å; P1238-F1240 HydrophobicContact CG-CE2 4.4Å; P1238-F1240 HydrophobicContact CG-CZ 3.99Å; P1238-F1240 VanDerWaalsContact O-CD2 3.26Å; P1238-F1240 WeakPolarHBondContact O-CD2 3.4Å; P1238-F1240 WeakPolarHBondContact O-CE2 3.4Å; P1238-F1240 PolarHBondContact O-N 2.72Å
1239	D	42.6	Very low	32.4	Very low	100 Å²	100	80.5 Å²	80.5	54%	0.535	41%	0.411	S	S	.	.			trans	-86.4	86.7	168	-168.8	-17	0	0	0	109.6	F1241 D1242 A1245	D1239-F1241 PolarHBondContact O-N 2.67Å; D1239-F1241 PolarHBondContact OD1-N 3.37Å; D1239-F1241 VanDerWaalsContact OD1-N 3.12Å; D1239-D1242 HydrophobicContact CB-CB 4.47Å; D1239-D1242 PolarHBondContact O-N 3.1Å; D1239-A1245 VanDerWaalsContact O-CB 3.27Å; D1239-A1245 WeakPolarHBondContact O-CB 3.46Å
1240	F	45.1	Very low	32.3	Very low	23 Å²	23	84.4 Å²	84.4	10%	0.101	43%	0.432	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	0.9	179.4	-59.3	-82	0	0	0	115.1	A870 I903 P1238	A870-F1240 HydrophobicContact CB-CB 4.22Å; A870-F1240 HydrophobicContact CB-CD1 4.46Å; A870-F1240 HydrophobicContact CB-CG 4.4Å; I903-F1240 HydrophobicContact CD1-CD2 4.48Å; P1238-F1240 HydrophobicContact CB-CE1 4.23Å; P1238-F1240 HydrophobicContact CB-CE2 4.19Å; P1238-F1240 HydrophobicContact CB-CZ 4.04Å; P1238-F1240 HydrophobicContact CG-CE1 4.42Å; P1238-F1240 HydrophobicContact CG-CE2 4.4Å; P1238-F1240 HydrophobicContact CG-CZ 3.99Å; P1238-F1240 VanDerWaalsContact O-CD2 3.26Å; P1238-F1240 WeakPolarHBondContact O-CD2 3.4Å; P1238-F1240 WeakPolarHBondContact O-CE2 3.4Å; P1238-F1240 PolarHBondContact O-N 2.72Å
1241	F	44.9	Very low	32.2	Very low	27 Å²	27	82.9 Å²	82.9	12%	0.118	44%	0.437	C	S	.	.	T	Hydrogen-bonded Turn	trans	-128	6.4	-178	-59.4	-79	0	0	0	115.3	I877 I903 E906 D1239	I877-F1241 HydrophobicContact CD1-CD1 3.96Å; I877-F1241 HydrophobicContact CD1-CE1 3.48Å; I877-F1241 VanDerWaalsContact CD1-CE1 3.48Å; I877-F1241 HydrophobicContact CD1-CZ 4.4Å; I903-F1241 HydrophobicContact CB-CE2 4.4Å; I903-F1241 HydrophobicContact CG1-CE2 4.45Å; I903-F1241 HydrophobicContact CG2-CE2 4.13Å; I903-F1241 HydrophobicContact CG2-CZ 3.97Å; E906-F1241 HydrophobicContact CB-CD2 4.09Å; E906-F1241 HydrophobicContact CB-CE2 4.31Å; E906-F1241 HydrophobicContact CG-CB 4.25Å; E906-F1241 HydrophobicContact CG-CD2 4.1Å; E906-F1241 HydrophobicContact CG-CG 4.12Å; D1239-F1241 PolarHBondContact O-N 2.67Å; D1239-F1241 PolarHBondContact OD1-N 3.37Å; D1239-F1241 VanDerWaalsContact OD1-N 3.12Å
1242	D	33.3	Very low	31.9	Very low	81 Å²	81	78.8 Å²	78.8	43%	0.433	43%	0.434	S	S	.	.			trans	-78.8	133.5	165.1	-171.7	1.8	0	0	0	110	D1239 A1244 A1245 I1246	D1239-D1242 HydrophobicContact CB-CB 4.47Å; D1239-D1242 PolarHBondContact O-N 3.1Å; D1242-A1244 PolarHBondContact O-N 2.74Å; D1242-A1244 PolarHBondContact OD1-N 3.26Å; D1242-A1245 HydrophobicContact CB-CB 4.06Å; D1242-A1245 PolarHBondContact O-N 3.43Å; D1242-I1246 PolarHBondContact O-N 3.45Å
1243	S	27.1	Very low	31.8	Very low	85 Å²	85	77.3 Å²	77.3	59%	0.594	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-14.3	177.2	-55	0	0	0	0	113.4
1244	A	26	Very low	31.3	Very low	40 Å²	40	74.6 Å²	74.6	33%	0.331	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.4	-37.1	166.6	0	0	0	0	0	112.7	D1242 I1246 I1247	D1242-A1244 PolarHBondContact O-N 2.74Å; D1242-A1244 PolarHBondContact OD1-N 3.26Å; A1244-I1246 VanDerWaalsContact C-N 3.26Å; A1244-I1246 PolarHBondContact O-N 3.47Å; A1244-I1247 PolarHBondContact O-N 3.13Å
1245	A	26.4	Very low	31	Very low	31 Å²	31	76.5 Å²	76.5	26%	0.256	43%	0.428	S	S	.	.	G	3₁₀ helix	trans	-72.9	-15.9	-178.9	0	0	0	0	0	113.5	D1239 D1242 I1247 E1248	D1239-A1245 VanDerWaalsContact O-CB 3.27Å; D1239-A1245 WeakPolarHBondContact O-CB 3.46Å; D1242-A1245 HydrophobicContact CB-CB 4.06Å; D1242-A1245 PolarHBondContact O-N 3.43Å; A1245-I1247 PolarHBondContact O-N 3.27Å; A1245-I1247 VanDerWaalsContact O-N 3.07Å; A1245-E1248 PolarHBondContact O-N 3.37Å
1246	I	27.9	Very low	30.5	Very low	99 Å²	99	76.9 Å²	76.9	51%	0.508	44%	0.438	S	S	.	.	G	3₁₀ helix	trans	-60.6	-12.8	170.7	-68.8	175.1	0	0	0	112.6	D1242 A1244	D1242-I1246 PolarHBondContact O-N 3.45Å; A1244-I1246 VanDerWaalsContact C-N 3.26Å; A1244-I1246 PolarHBondContact O-N 3.47Å
1247	I	27.1	Very low	30.2	Very low	77 Å²	77	75.8 Å²	75.8	40%	0.395	43%	0.432	S	S	.	.	G	3₁₀ helix	trans	-111.5	-13.5	-178.1	-59.8	169.3	0	0	0	112.2	A1244 A1245 P1256	A1244-I1247 PolarHBondContact O-N 3.13Å; A1245-I1247 PolarHBondContact O-N 3.27Å; A1245-I1247 VanDerWaalsContact O-N 3.07Å; I1247-P1256 HydrophobicContact CD1-CB 4.25Å
1248	E	23.3	Very low	29.5	Very low	148 Å²	148	78.1 Å²	78.1	69%	0.692	44%	0.444	S	S	*	.			trans	-120.5	52.1	-170.1	-66.1	179.2	168.8	0	0	112.5	A1245	A1245-E1248 PolarHBondContact O-N 3.37Å
1249	D	24.3	Very low	29	Very low	79 Å²	79	79.1 Å²	79.1	42%	0.422	45%	0.448	S	S	.	.	S	Bend	trans	-89.3	150.8	151	-95.6	-35.4	0	0	0	108.4	S1251	D1249-S1251 CarbonylContact O-C 3.6Å; D1249-S1251 PolarHBondContact O-N 2.75Å
1250	D	28.1	Very low	28.3	Very low	158 Å²	158	77.9 Å²	77.9	85%	0.845	44%	0.443	S	S	*	.	S	Bend	trans	-60.5	-10.7	-165.2	-87.8	-58.4	0	0	0	116.5	K638 G1252	K638-D1250 PolarHBondContact NZ-O 3.07Å; D1250-G1252 PolarHBondContact O-N 3.26Å
1251	S	28.2	Very low	27.4	Very low	67 Å²	67	81 Å²	81	47%	0.469	46%	0.462	S	S	.	.	S	Bend	trans	-71.4	60	162.5	64.3	0	0	0	0	111.2	D1249 F1253	D1249-S1251 CarbonylContact O-C 3.6Å; D1249-S1251 PolarHBondContact O-N 2.75Å; S1251-F1253 VanDerWaalsContact C-N 3.29Å; S1251-F1253 PolarHBondContact O-N 3.29Å
1252	G	26.7	Very low	26.3	Very low	42 Å²	42	84.2 Å²	84.2	43%	0.433	48%	0.482	S	S	.	.			trans	-63.7	75.5	-174.2	0	0	0	0	0	114.9	D1250	D1250-G1252 PolarHBondContact O-N 3.26Å
1253	F	26.7	Very low	25.9	Very low	86 Å²	86	84.4 Å²	84.4	38%	0.377	49%	0.485	S	S	.	.			trans	-156	40.2	153	-108.7	-67.9	0	0	0	111.2	K638 S641 I642 A704 S1251 M1255	K638-F1253 HydrophobicContact CG-CD2 4.31Å; S641-F1253 VanDerWaalsContact CB-CE2 3.47Å; S641-F1253 WeakPolarHBondContact OG-CE1 3.42Å; S641-F1253 WeakPolarHBondContact OG-CE2 3.38Å; S641-F1253 WeakPolarHBondContact OG-CZ 3.39Å; I642-F1253 HydrophobicContact CD1-CE2 4.34Å; I642-F1253 HydrophobicContact CG1-CE2 4.03Å; I642-F1253 HydrophobicContact CG1-CZ 4.03Å; A704-F1253 HydrophobicContact CB-CB 4.24Å; A704-F1253 HydrophobicContact CB-CD2 4.24Å; A704-F1253 HydrophobicContact CB-CG 4.24Å; S1251-F1253 VanDerWaalsContact C-N 3.29Å; S1251-F1253 PolarHBondContact O-N 3.29Å; F1253-M1255 PolarHBondContact O-N 2.81Å
1254	G	23.7	Very low	25.8	Very low	37 Å²	37	84.3 Å²	84.3	38%	0.381	48%	0.478	S	S	.	.			trans	-61.3	104.7	169.8	0	0	0	0	0	111.3	P1256	G1254-P1256 WeakPolarHBondContact O-CD 3.32Å
1255	M	24.2	Very low	25.8	Very low	96 Å²	96	87.5 Å²	87.5	47%	0.473	49%	0.488	S	S	.	.			trans	-54.8	117	177.1	-105.8	-78	-162.2	0	0	111.1	W747 V750 F1253 M1257	W747-M1255 HydrophobicContact CH2-CE 3.73Å; W747-M1255 HydrophobicContact CZ3-CE 3.56Å; V750-M1255 HydrophobicContact CG1-CE 4.36Å; F1253-M1255 PolarHBondContact O-N 2.81Å; M1255-M1257 PolarHBondContact O-N 3.1Å; M1255-M1257 HydrophobicContact SD-CG 3.91Å
1256	P	22.8	Very low	25.7	Very low	102 Å²	102	91.8 Å²	91.8	66%	0.662	51%	0.506	S	S	*	.	S	Bend	trans	-79.9	63.2	-178.5	33.8	-36.4	0	0	0	111.5	I1247 G1254	I1247-P1256 HydrophobicContact CD1-CB 4.25Å; G1254-P1256 WeakPolarHBondContact O-CD 3.32Å
1257	M	25.2	Very low	25.6	Very low	65 Å²	65	91.3 Å²	91.3	32%	0.32	51%	0.506	S	S	.	.			trans	-127.5	4.6	-169.3	-80.1	-67.3	-78.4	0	0	115.8	D754 R811 M1255	D754-M1257 WeakPolarHBondContact OD1-CE 3.48Å; R811-M1257 PolarHBondContact NH1-O 2.7Å; R811-M1257 VanDerWaalsContact NH1-O 3.08Å; M1255-M1257 PolarHBondContact O-N 3.1Å; M1255-M1257 HydrophobicContact SD-CG 3.91Å
1258	F	26.3	Very low	25.4	Very low	138 Å²	138	92.5 Å²	92.5	61%	0.605	52%	0.516	S	S	*	.			trans	-129.5	0	172.9	-82.4	-70.8	0	0	0	114.1	L749 T753 L806 R811	L749-F1258 HydrophobicContact CD2-CE2 3.76Å; L749-F1258 HydrophobicContact CD2-CZ 3.7Å; L749-F1258 HydrophobicContact CG-CE2 4.25Å; L749-F1258 HydrophobicContact CG-CZ 4.06Å; T753-F1258 HydrophobicContact CG2-CZ 3.95Å; L806-F1258 HydrophobicContact CD1-CE1 3.49Å; L806-F1258 VanDerWaalsContact CD1-CE1 3.49Å; L806-F1258 HydrophobicContact CD1-CZ 3.83Å; R811-F1258 VanDerWaalsContact NH1-CE1 3.26Å

Retrieved 1,258 of 1,258 residues in 431.5 ms (Link to these results)

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