A0A077ZAB6_TRITR Loading...

Suppressor of Ty 6 homolog

AlphaFold DB , UniProt , Accession A0A077ZAB6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,485 aa.

						>A0A077ZAB6_TRITR|A0A077ZAB6
IGGSENDSSRRVSSRYSKTPYDEYADTESAEGSGTVASKFSFVSGMDDFIQDDEDDEEVARRAARRKAMAKQHLPVSDRHMPQLIIVFSALEEARDLFGVGFQLEDVYEEDEDEEAEEGIEEDEEDYELGLEDDEGRRLKVTGRRKGVGKRSLLEQIEPAELERSFLSDFDKRVQLEDRPERFQQRSVPVSPASNEELIAEARWIYHNLFACNCLSRQIDTSRSLPISAVDKIKDVTQISRCVLSVLNFMRNQEFEVPFIAFYRKEYVQPELTIGDLWNIYYRDEKWCQLKSRKESLHALFKAVQEYQSDLILANPEDPLPSDVRPLVDDDFLAVTRAQSFEELQDLYSFFLLYYSCDVPKALEYKRRKLATNGDHSTSDIENECQQNALKQVASRNRYQLCVDAGLCPLANKLGLTPKEFAENLQVNYMRNEIAQYPQPFSEIAQEHICKQFQDVEAVTKAVKYMVALQLSREPLIRQTVRSEYTNRATISLHPTSLGRKEIDEGHPMYPYKYIKDKPIRELRRDEYLLYVQAEDNRLITVTLKMGRCGEKSYYQEVKEKKLYFHDEYSAVVQDWNRLRDEVLQICFEEMLYPSFEKEIRAKLLEEAQSFVLKRCAARMQDYLRVGPYSLLPGSSQDDDVNDKQLILGISYPMDRDQASFCVLVDKNGEIVDHIRLAHLTRQTKWSGANYAPLKGKDLERLKSFIRRRPPIVIAIAGSSLVSALSKWLQNFYLYRMALELVKDVNKIVSQLVAEDILASSVPVEVVDDELARVYAKSEVANADFSDYPITLRQAISIARRLNDPLLEFAQLCNQDEEILFLKFNALQEYVPKEELFRLITLEFINRTNEVGVDLNRCIEHPYTASVLQFVCGLGPRKAAYLLKMLRQKEGHIESRTQLVTVCKMAPKVFMNCSGFIKIDSQFNAYRTTAHDVLDSSRVHPSTYEWARKMAEDALEYEPDETDSSRLPLDEILESPERLKSLDLDAFAEELMRQGFGNMQITLYDIRAELNQRYKDLREPFRSPSREQMFYMLIKENPHTFGIGKVVLGRVMRIVYRRPQKDKITKTIPVRNAATGMWQCPFCLSGDFSELSEVWTHYDMEACPGQAVGVRLRLEAGLTGFIPVKFLSDSRVSNPGDLIQIGTTLAARIIKIDYNRMSVDLSCRTSDMEDHEHKFRPQRDPYYDHKAEEEDRRTERNLQASRQKEQYVKRVIAHPYFQNCSCKQAEGLLLEMEQGDTIIRPSSKVGPDYLTITWKVADGIYQHISVREENKEHPYSLGKSLLIDDEVYEDLDEILFRRIQPMASSARELLSYKYYREANGGDRVVLEKALLEEKKKSSAKIPYSFSASKEYPGKFILSYLPSSRVRHEYITIVPEGFRFRGRVFANVNALLKWFKEHFRDQQGWSVPLTSSWVLAWIDLQIMILEVNCHIRHPLLQRDGRPGRFRLWAVPGQTQAPQLVATPQLVSMPTLMPPTQPSMASPYATK
					

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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	I	27.1	Very low	27.8	Very low	235 Å²	235	156 Å²	156	100%	1.205	87%	0.871	S	S	*	*				0	126.5	0	-64.4	172.2	0	0	0	107.5
2	G	29.9	Very low	27.7	Very low	85 Å²	85	153.5 Å²	153.5	88%	0.876	86%	0.862	S	S	*	*			trans	108.4	67	168	0	0	0	0	0	115.9
3	G	27	Very low	27.5	Very low	77 Å²	77	149.4 Å²	149.4	79%	0.794	85%	0.849	S	S	*	*			trans	-145.7	110.7	166.2	0	0	0	0	0	108.6
4	S	27.9	Very low	27.3	Very low	113 Å²	113	144.9 Å²	144.9	79%	0.79	83%	0.832	S	S	*	*			trans	-59.9	137.1	-171.1	50	0	0	0	0	114	N6	S4-N6 PolarHBondContact O-N 3.29Å
5	E	25.9	Very low	27.2	Very low	192 Å²	192	150.3 Å²	150.3	90%	0.897	83%	0.833	S	S	*	*			trans	-50.3	114.3	165.6	-65.3	168.7	155.2	0	0	110.7
6	N	31.2	Very low	27.2	Very low	154 Å²	154	154.5 Å²	154.5	82%	0.824	83%	0.834	S	S	*	*			trans	-120.5	93.5	162.5	-118	-3.4	0	0	0	107.9	S4 S8	S4-N6 PolarHBondContact O-N 3.29Å; N6-S8 PolarHBondContact O-N 2.99Å; N6-S8 VanDerWaalsContact O-N 3.09Å
7	D	28.2	Very low	27.2	Very low	166 Å²	166	151.9 Å²	151.9	89%	0.888	83%	0.831	S	S	*	*			trans	-63.7	97.3	172.7	-162.5	6.8	0	0	0	108.8
8	S	30.7	Very low	27.2	Very low	97 Å²	97	154.7 Å²	154.7	68%	0.678	83%	0.833	S	S	*	*			trans	-131.2	99.6	166.4	65	0	0	0	0	109.6	N6 R10	N6-S8 PolarHBondContact O-N 2.99Å; N6-S8 VanDerWaalsContact O-N 3.09Å; S8-R10 VanDerWaalsContact C-N 3.34Å; S8-R10 PolarHBondContact O-N 3.36Å
9	S	25.9	Very low	27	Very low	116 Å²	116	152.3 Å²	152.3	81%	0.811	83%	0.825	S	S	*	*			trans	-54.5	86.2	169.6	56.9	0	0	0	0	111.8
10	R	26.9	Very low	27	Very low	228 Å²	228	151 Å²	151	86%	0.86	83%	0.825	S	S	*	*			trans	-101.6	97	158.4	-91	-176.6	173.1	176.2	-1.2	108.5	S8 V12	S8-R10 VanDerWaalsContact C-N 3.34Å; S8-R10 PolarHBondContact O-N 3.36Å; R10-V12 VanDerWaalsContact C-N 3.28Å; R10-V12 PolarHBondContact O-N 2.88Å
11	R	24.8	Very low	26.9	Very low	253 Å²	253	153.5 Å²	153.5	96%	0.955	82%	0.823	S	S	*	*			trans	-54.3	91.6	160.9	-86.4	177.1	167.3	168.6	-4.3	108.7	S13	R11-S13 PolarHBondContact O-N 3.42Å
12	V	26.8	Very low	26.8	Very low	126 Å²	126	150 Å²	150	76%	0.764	81%	0.807	S	S	*	*			trans	-84.9	97.5	162.6	-179.1	0	0	0	0	105.8	R10 S14	R10-V12 VanDerWaalsContact C-N 3.28Å; R10-V12 PolarHBondContact O-N 2.88Å; V12-S14 PolarHBondContact O-N 2.96Å
13	S	25.8	Very low	26.6	Very low	100 Å²	100	154.4 Å²	154.4	70%	0.699	81%	0.805	S	S	*	*			trans	-61.1	100.1	168.4	171.7	0	0	0	0	108	R11 R15	R11-S13 PolarHBondContact O-N 3.42Å; S13-R15 VanDerWaalsContact C-N 3.3Å; S13-R15 PolarHBondContact O-N 2.9Å
14	S	23.9	Very low	26.7	Very low	86 Å²	86	162.3 Å²	162.3	60%	0.601	81%	0.813	S	S	*	*			trans	-72.4	88.9	170.9	63	0	0	0	0	108.2	V12 Y16	V12-S14 PolarHBondContact O-N 2.96Å; S14-Y16 VanDerWaalsContact C-N 3.31Å; S14-Y16 PolarHBondContact O-N 3.36Å
15	R	26.2	Very low	26.6	Very low	226 Å²	226	161 Å²	161	85%	0.853	81%	0.808	S	S	*	*			trans	-63.2	100.4	157.9	-83.5	-173.4	-110.9	-176.5	-4	106.8	S13 S17	S13-R15 VanDerWaalsContact C-N 3.3Å; S13-R15 PolarHBondContact O-N 2.9Å; R15-S17 VanDerWaalsContact C-N 3.27Å; R15-S17 PolarHBondContact O-N 3.26Å
16	Y	26.6	Very low	26.8	Very low	218 Å²	218	159.2 Å²	159.2	86%	0.855	81%	0.805	S	S	*	*			trans	-61.4	93.1	162.5	-85.8	-94.8	0	0	0	107.6	S14 K18	S14-Y16 VanDerWaalsContact C-N 3.31Å; S14-Y16 PolarHBondContact O-N 3.36Å; Y16-K18 PolarHBondContact O-N 2.96Å
17	S	27.2	Very low	26.8	Very low	110 Å²	110	158.8 Å²	158.8	77%	0.769	81%	0.808	S	S	*	*			trans	-73	114	162.7	53.6	0	0	0	0	107.6	R15	R15-S17 VanDerWaalsContact C-N 3.27Å; R15-S17 PolarHBondContact O-N 3.26Å
18	K	26.9	Very low	26.8	Very low	202 Å²	202	159.7 Å²	159.7	88%	0.878	81%	0.807	S	S	*	*			trans	1.6	115.4	160.2	-66.8	-179	172.2	-170.2	0	115.5	Y16	Y16-K18 PolarHBondContact O-N 2.96Å
19	T	24.7	Very low	26.6	Very low	109 Å²	109	160.2 Å²	160.2	67%	0.669	81%	0.811	S	S	*	*			trans	-57.1	135.3	160.1	45.3	0	0	0	0	110	Y21	T19-Y21 PolarHBondContact O-N 3.33Å; T19-Y21 VanDerWaalsContact O-N 3.08Å
20	P	25.8	Very low	26.8	Very low	127 Å²	127	159.6 Å²	159.6	83%	0.825	81%	0.813	S	S	*	*	S	Bend	trans	-76.8	95.3	177.4	30.8	-30.5	0	0	0	108.9
21	Y	25.9	Very low	26.8	Very low	203 Å²	203	158.1 Å²	158.1	80%	0.796	82%	0.816	S	S	*	*			trans	-135	22.8	175.4	-93.7	-74.3	0	0	0	112.4	T19	T19-Y21 PolarHBondContact O-N 3.33Å; T19-Y21 VanDerWaalsContact O-N 3.08Å
22	D	25.1	Very low	27	Very low	161 Å²	161	149.7 Å²	149.7	86%	0.861	81%	0.808	S	S	*	*			trans	-133.5	62.5	-179.3	-74	-34.8	0	0	0	111.3
23	E	26.1	Very low	26.9	Very low	179 Å²	179	149.8 Å²	149.8	84%	0.836	81%	0.814	S	S	*	*			trans	-143.7	47	165.7	-74.7	-166.7	172.8	0	0	111.9
24	Y	28.2	Very low	27	Very low	243 Å²	243	148.2 Å²	148.2	95%	0.953	81%	0.814	S	S	*	*			trans	-150.1	73.5	162.5	-72.6	-72.7	0	0	0	110.2
25	A	26.1	Very low	27.1	Very low	85 Å²	85	151.1 Å²	151.1	70%	0.702	83%	0.828	S	S	*	*			trans	-130.6	144.6	160	0	0	0	0	0	107
26	D	29.2	Very low	27.2	Very low	154 Å²	154	147 Å²	147	82%	0.824	83%	0.828	S	S	*	*			trans	91.8	70.4	175.4	-49.1	-19	0	0	0	116.6
27	T	32.1	Very low	27.2	Very low	146 Å²	146	141.2 Å²	141.2	90%	0.896	83%	0.825	S	S	*	*			trans	-128.7	98.7	140.4	49	0	0	0	0	108.6
28	E	27.6	Very low	27.1	Very low	184 Å²	184	140.9 Å²	140.9	86%	0.86	82%	0.822	S	S	*	*			trans	-63.6	140.9	177.7	-71.7	177.8	148	0	0	112.1
29	S	26.4	Very low	27.2	Very low	108 Å²	108	141.2 Å²	141.2	76%	0.755	82%	0.824	S	S	*	*			trans	-15.6	122	155.9	50	0	0	0	0	117.5
30	A	30.6	Very low	27.1	Very low	104 Å²	104	146 Å²	146	86%	0.86	84%	0.836	S	S	*	*			trans	-124.3	96.1	150.1	0	0	0	0	0	108.5
31	E	26.4	Very low	27.2	Very low	196 Å²	196	145 Å²	145	92%	0.916	83%	0.832	S	S	*	*			trans	-68	125.8	171.2	-64.8	178.2	154.8	0	0	110
32	G	29.2	Very low	27.1	Very low	77 Å²	77	144.3 Å²	144.3	79%	0.794	83%	0.833	S	S	*	*			trans	-138.1	87.4	174.4	0	0	0	0	0	110	G34	G32-G34 PolarHBondContact O-N 2.97Å
33	S	25.6	Very low	27.4	Very low	127 Å²	127	143.2 Å²	143.2	89%	0.888	83%	0.832	S	S	*	*			trans	-68	112.5	174.9	56.5	0	0	0	0	111.1
34	G	28.2	Very low	27.4	Very low	68 Å²	68	138.8 Å²	138.8	70%	0.701	82%	0.821	S	S	*	*			trans	-126.3	88.3	172.6	0	0	0	0	0	111	G32 V36	G32-G34 PolarHBondContact O-N 2.97Å; G34-V36 PolarHBondContact O-N 3.23Å
35	T	25.8	Very low	27.5	Very low	146 Å²	146	130.6 Å²	130.6	90%	0.896	81%	0.811	S	S	*	*			trans	-67	117.6	168.6	35.3	0	0	0	0	110.7
36	V	26.7	Very low	27.8	Very low	140 Å²	140	135.3 Å²	135.3	85%	0.848	82%	0.82	S	S	*	*			trans	-116.8	98.9	169.1	-178.9	0	0	0	0	108.1	G34 S38	G34-V36 PolarHBondContact O-N 3.23Å; V36-S38 PolarHBondContact O-N 3.45Å
37	A	27.7	Very low	27.9	Very low	97 Å²	97	135.2 Å²	135.2	80%	0.802	82%	0.82	S	S	*	*			trans	-73.7	119	172.5	0	0	0	0	0	109.3
38	S	25.2	Very low	28.2	Very low	102 Å²	102	135.9 Å²	135.9	71%	0.713	82%	0.818	S	S	*	*			trans	-80	123.2	172.4	62.5	0	0	0	0	109.2	V36	V36-S38 PolarHBondContact O-N 3.45Å
39	K	28.2	Very low	28.2	Very low	209 Å²	209	135.5 Å²	135.5	91%	0.909	81%	0.814	S	S	*	*			trans	-118.7	95.6	164.1	-97.6	-175.5	175.4	179.1	0	107.1
40	F	23.8	Very low	28.7	Very low	210 Å²	210	137.4 Å²	137.4	92%	0.921	81%	0.814	S	S	*	*			trans	-72.1	117.1	165.6	-102.5	-103.9	0	0	0	108.3
41	S	28.1	Very low	28.7	Very low	106 Å²	106	139.4 Å²	139.4	74%	0.741	81%	0.805	S	S	*	*			trans	-127.2	119.2	164.4	68	0	0	0	0	109.9
42	F	23.5	Very low	29.3	Very low	188 Å²	188	137.4 Å²	137.4	83%	0.825	80%	0.801	S	S	*	*			trans	-48.3	126.5	174.8	-168.8	-99.3	0	0	0	113.1
43	V	30.4	Very low	29.6	Very low	139 Å²	139	140.6 Å²	140.6	84%	0.842	80%	0.8	S	S	*	*			trans	-126.8	111	163	-178.5	0	0	0	0	107.3
44	S	27.3	Very low	30.2	Very low	86 Å²	86	143.3 Å²	143.3	60%	0.601	80%	0.799	S	S	*	*			trans	-88.8	132.9	172.3	55.8	0	0	0	0	110.7
45	G	29	Very low	31	Very low	71 Å²	71	147.4 Å²	147.4	73%	0.732	81%	0.805	S	S	*	*			trans	78.6	104.9	144.7	0	0	0	0	0	118.3
46	M	33.9	Very low	31.8	Very low	183 Å²	183	147.7 Å²	147.7	90%	0.901	80%	0.801	S	S	*	*				-165.2	117.2	128	-147.1	84.9	81	0	0	109.1
47	D	30.2	Very low	32.7	Very low	153 Å²	153	148.5 Å²	148.5	82%	0.818	80%	0.795	S	S	*	*			trans	-63.8	136.7	160.2	-67.2	-51.9	0	0	0	109.3
48	D	38.6	Very low	33.7	Very low	160 Å²	160	150.1 Å²	150.1	86%	0.856	79%	0.786	S	S	*	*			trans	-167.4	113.5	141.9	-97.7	-20.6	0	0	0	112
49	F	27.5	Very low	35	Very low	176 Å²	176	150.6 Å²	150.6	77%	0.772	78%	0.784	S	S	*	*			trans	-40	117.9	163.5	-150.8	-100	0	0	0	115.2
50	I	37	Very low	36.4	Very low	147 Å²	147	143.4 Å²	143.4	75%	0.754	76%	0.764	S	S	*	*			trans	-141.2	110.7	149.4	-65.6	-173.3	0	0	0	108.4
51	Q	30.3	Very low	38.2	Very low	146 Å²	146	141.2 Å²	141.2	68%	0.682	75%	0.75	S	S	*	*			trans	-73	126.7	156.6	-79.2	173.7	-70.9	0	0	108.1
52	D	38.8	Very low	39.2	Very low	155 Å²	155	145 Å²	145	83%	0.829	75%	0.748	S	S	*	*			trans	-149.4	110.7	150.8	-89.3	-34	0	0	0	107.2
53	D	35.6	Very low	40.7	Very low	144 Å²	144	138.9 Å²	138.9	77%	0.77	73%	0.732	S	S	*	*			trans	-76.1	159.2	170.4	-68.1	-52.2	0	0	0	110.4
54	E	38	Very low	42	Very low	183 Å²	183	135.2 Å²	135.2	86%	0.855	72%	0.716	S	S	*	*			trans	96.6	92.1	171.3	-55.7	-173.6	165.8	0	0	117.5
55	D	45.7	Very low	42.9	Very low	155 Å²	155	140.8 Å²	140.8	83%	0.829	72%	0.724	S	S	*	*				170.4	75.5	128.8	-87.9	-27.3	0	0	0	113.2
56	D	41.9	Very low	43.6	Very low	152 Å²	152	147.8 Å²	147.8	81%	0.813	73%	0.728	S	S	*	*			trans	-93.5	5.5	-177.9	-100.9	-34.9	0	0	0	116.2
57	E	46.2	Very low	43.9	Very low	156 Å²	156	147.4 Å²	147.4	73%	0.729	72%	0.722	S	S	*	*	S	Bend	trans	-103.8	-13.5	-172.1	-74.2	-159.8	159.9	0	0	117	R61	E57-R61 PolarHBondContact O-NE 3.33Å
58	E	49.2	Very low	44.5	Very low	131 Å²	131	143.6 Å²	143.6	61%	0.612	71%	0.712	S	S	*	*	H	α-helix	trans	-93.5	-33.7	-179.7	-159	175.4	162.1	0	0	113.5	R61 R62	E58-R61 PolarHBondContact O-N 3.03Å; E58-R62 PolarHBondContact O-N 3.5Å
59	V	52.8	Low	44.4	Very low	112 Å²	112	144.1 Å²	144.1	68%	0.679	71%	0.711	S	S	*	*	H	α-helix	trans	-72.4	-37.7	179.2	-179.3	0	0	0	0	111.2	R61 R62 A63	V59-R61 VanDerWaalsContact C-N 3.32Å; V59-R61 PolarHBondContact O-N 3.28Å; V59-R62 PolarHBondContact O-N 3.25Å; V59-R62 VanDerWaalsContact O-N 3.14Å; V59-A63 PolarHBondContact O-N 3.24Å
60	A	56.5	Low	44.8	Very low	59 Å²	59	140 Å²	140	49%	0.488	71%	0.709	S	S	.	*	H	α-helix	trans	-59.9	-39.1	174.6	0	0	0	0	0	112.6	R62 A63 A64	A60-R62 VanDerWaalsContact C-N 3.33Å; A60-R62 PolarHBondContact O-N 2.98Å; A60-A63 PolarHBondContact O-N 3.1Å; A60-A64 WeakPolarHBondContact O-CB 3.36Å; A60-A64 PolarHBondContact O-N 3.19Å
61	R	61.1	Low	44.5	Very low	163 Å²	163	142.1 Å²	142.1	62%	0.615	71%	0.713	S	S	*	*	H	α-helix	trans	-64.9	-34.7	176	-78.8	-176.5	-79.3	175.3	-3	112.7	E57 E58 V59 R65	E57-R61 PolarHBondContact O-NE 3.33Å; E58-R61 PolarHBondContact O-N 3.03Å; V59-R61 VanDerWaalsContact C-N 3.32Å; V59-R61 PolarHBondContact O-N 3.28Å; R61-R65 PolarHBondContact O-N 3.4Å
62	R	50.3	Low	44.6	Very low	186 Å²	186	143.1 Å²	143.1	70%	0.702	72%	0.718	S	S	*	*	H	α-helix	trans	-72	-38.8	175.7	-110.8	178.7	172.5	111.8	-5.2	112.2	E58 V59 A60 R65 R66	E58-R62 PolarHBondContact O-N 3.5Å; V59-R62 PolarHBondContact O-N 3.25Å; V59-R62 VanDerWaalsContact O-N 3.14Å; A60-R62 VanDerWaalsContact C-N 3.33Å; A60-R62 PolarHBondContact O-N 2.98Å; R62-R65 PolarHBondContact O-N 2.75Å; R62-R66 PolarHBondContact O-N 2.92Å
63	A	53.6	Low	44.3	Very low	59 Å²	59	144.2 Å²	144.2	49%	0.488	72%	0.718	S	S	.	*	H	α-helix	trans	-66.9	-41	175.2	0	0	0	0	0	112.1	V59 A60 R65 R66 K67	V59-A63 PolarHBondContact O-N 3.24Å; A60-A63 PolarHBondContact O-N 3.1Å; A63-R65 VanDerWaalsContact C-N 3.32Å; A63-R65 PolarHBondContact O-N 2.88Å; A63-R66 PolarHBondContact O-N 3.42Å; A63-K67 PolarHBondContact O-N 3.12Å; A63-K67 VanDerWaalsContact O-N 3.08Å
64	A	58.7	Low	44	Very low	62 Å²	62	145.5 Å²	145.5	51%	0.512	72%	0.724	S	S	.	*	H	α-helix	trans	-61.9	-38.6	175.7	0	0	0	0	0	112.3	A60 R66 K67 A68	A60-A64 WeakPolarHBondContact O-CB 3.36Å; A60-A64 PolarHBondContact O-N 3.19Å; A64-R66 PolarHBondContact O-N 2.72Å; A64-K67 PolarHBondContact O-N 3.13Å; A64-A68 PolarHBondContact O-N 2.92Å
65	R	46.2	Very low	43.6	Very low	203 Å²	203	142.1 Å²	142.1	77%	0.766	72%	0.717	S	S	*	*	H	α-helix	trans	-68.1	-33.4	177.4	-132.8	175	-175.4	170.9	1.1	113	R61 R62 A63	R61-R65 PolarHBondContact O-N 3.4Å; R62-R65 PolarHBondContact O-N 2.75Å; A63-R65 VanDerWaalsContact C-N 3.32Å; A63-R65 PolarHBondContact O-N 2.88Å
66	R	43.3	Very low	42.9	Very low	218 Å²	218	141.2 Å²	141.2	82%	0.823	72%	0.717	S	S	*	*	H	α-helix	trans	-70.6	-38.7	173.9	-102.3	179.6	170.7	171.4	-3.4	112.3	R62 A63 A64 M69	R62-R66 PolarHBondContact O-N 2.92Å; A63-R66 PolarHBondContact O-N 3.42Å; A64-R66 PolarHBondContact O-N 2.72Å; R66-M69 PolarHBondContact O-N 2.76Å
67	K	40.2	Very low	42.2	Very low	175 Å²	175	139.1 Å²	139.1	76%	0.761	71%	0.714	S	S	*	*	H	α-helix	trans	-70.2	-32.3	175.9	-110.3	176.7	177.3	175.8	0	112.8	A63 A64 M69 A70	A63-K67 PolarHBondContact O-N 3.12Å; A63-K67 VanDerWaalsContact O-N 3.08Å; A64-K67 PolarHBondContact O-N 3.13Å; K67-M69 PolarHBondContact O-N 3.31Å; K67-A70 PolarHBondContact O-N 3.24Å
68	A	43.3	Very low	41.3	Very low	74 Å²	74	138.4 Å²	138.4	61%	0.612	72%	0.716	S	S	*	*	H	α-helix	trans	-64.8	-23	176.3	0	0	0	0	0	113.8	A64	A64-A68 PolarHBondContact O-N 2.92Å
69	M	35.4	Very low	40.3	Very low	170 Å²	170	142.9 Å²	142.9	84%	0.837	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.5	-15.2	176.5	-76.8	-173.6	171.4	0	0	114.1	R66 K67 K71	R66-M69 PolarHBondContact O-N 2.76Å; K67-M69 PolarHBondContact O-N 3.31Å; M69-K71 VanDerWaalsContact C-N 3.28Å; M69-K71 PolarHBondContact O-N 2.83Å
70	A	35.9	Very low	39.1	Very low	89 Å²	89	146.6 Å²	146.6	74%	0.736	74%	0.736	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.3	8.4	-176.5	0	0	0	0	0	114.1	K67	K67-A70 PolarHBondContact O-N 3.24Å
71	K	32.5	Very low	37.6	Very low	192 Å²	192	151.4 Å²	151.4	84%	0.835	75%	0.751	S	S	*	*	S	Bend	trans	-115.9	27.7	-165.7	-127.3	-175.3	-170.2	-176.7	0	116.3	M69	M69-K71 VanDerWaalsContact C-N 3.28Å; M69-K71 PolarHBondContact O-N 2.83Å
72	Q	31.8	Very low	36.1	Very low	168 Å²	168	149.2 Å²	149.2	79%	0.785	76%	0.757	S	S	*	*	S	Bend	trans	-126.3	-0.7	-173.8	-86.7	-170.2	2.5	0	0	120.5
73	H	32.7	Very low	35	Very low	178 Å²	178	149.3 Å²	149.3	82%	0.824	77%	0.766	S	S	*	*			trans	-140.1	91.4	-177.9	-73.4	62.1	0	0	0	113
74	L	29.4	Very low	33.9	Very low	171 Å²	171	154.1 Å²	154.1	90%	0.895	78%	0.783	S	S	*	*			trans	-149	137.6	158.4	-93.2	147.8	0	0	0	109.7
75	P	29.5	Very low	32.9	Very low	112 Å²	112	156.2 Å²	156.2	73%	0.727	78%	0.784	S	S	*	*			trans	-77	165.8	-167.3	-12	29.4	0	0	0	115.6	S77	P75-S77 PolarHBondContact O-N 3.29Å
76	V	30.2	Very low	32.3	Very low	135 Å²	135	153.2 Å²	153.2	82%	0.818	78%	0.782	S	S	*	*	G	3₁₀ helix	trans	-84.6	0.8	-159.5	173.7	0	0	0	0	115.8
77	S	26.8	Very low	32.2	Very low	108 Å²	108	145.2 Å²	145.2	76%	0.755	76%	0.757	S	S	*	*	G	3₁₀ helix	trans	-88.1	-2.5	-167.6	50.2	0	0	0	0	117.9	P75	P75-S77 PolarHBondContact O-N 3.29Å
78	D	27.8	Very low	32.4	Very low	142 Å²	142	141.4 Å²	141.4	76%	0.759	74%	0.741	S	S	*	*	G	3₁₀ helix	trans	-106.5	21.6	-173.6	-88.8	-21.2	0	0	0	116.8	H80	D78-H80 PolarHBondContact O-N 3.34Å
79	R	27.8	Very low	33	Very low	225 Å²	225	139.7 Å²	139.7	85%	0.849	72%	0.724	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.5	18.2	-179.5	-77.6	-169	173.1	-170.2	-1.5	116.6
80	H	28.5	Very low	34	Very low	189 Å²	189	131.6 Å²	131.6	88%	0.875	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.7	9	173.8	-72.5	66.1	0	0	0	114.3	D78	D78-H80 PolarHBondContact O-N 3.34Å
81	M	25.4	Very low	35.2	Very low	160 Å²	160	129.4 Å²	129.4	79%	0.788	66%	0.66	S	S	*	*	S	Bend	trans	-87.3	117.2	159	-93.1	-172.7	82.4	0	0	109.4
82	P	29.1	Very low	36.7	Very low	117 Å²	117	124.2 Å²	124.2	76%	0.76	64%	0.639	S	S	*	*	P	Polyproline II helix	trans	-58.6	143.2	170.7	-15.6	29.2	0	0	0	109.5
83	Q	27.7	Very low	38.2	Very low	188 Å²	188	117.6 Å²	117.6	88%	0.879	61%	0.608	S	S	*	*	P	Polyproline II helix	trans	-47	136	-175.4	-70.9	161.3	-22.3	0	0	112.1	I85	Q83-I85 PolarHBondContact O-N 3.46Å
84	L	29.7	Very low	39.5	Very low	161 Å²	161	109.1 Å²	109.1	84%	0.843	57%	0.569	S	S	*	*			trans	-43.3	125.5	177.6	-92.1	82.5	0	0	0	111.1	I86	L84-I86 PolarHBondContact O-N 3.45Å
85	I	37	Very low	41.3	Very low	106 Å²	106	106.5 Å²	106.5	54%	0.544	55%	0.547	S	S	.	.			trans	-65.5	113.4	176.4	-41.5	175	0	0	0	107.4	Q83 V87	Q83-I85 PolarHBondContact O-N 3.46Å; I85-V87 HydrophobicContact CB-CG2 3.66Å; I85-V87 HydrophobicContact CG2-CG2 3.09Å; I85-V87 PolarHBondContact O-N 3.17Å; I85-V87 VanDerWaalsContact O-N 3.12Å
86	I	33.6	Very low	43	Very low	139 Å²	139	106.6 Å²	106.6	71%	0.713	54%	0.541	S	S	*	.			trans	-74.2	98.1	166.6	-58.3	172.4	0	0	0	104.7	L84 F88	L84-I86 PolarHBondContact O-N 3.45Å; I86-F88 HydrophobicContact CG2-CE1 4.37Å; I86-F88 HydrophobicContact CG2-CE2 3.86Å; I86-F88 HydrophobicContact CG2-CZ 3.79Å
87	V	40.8	Very low	44.6	Very low	50 Å²	50	102.7 Å²	102.7	30%	0.303	52%	0.516	S	S	.	.			trans	-116.5	112.6	176.5	-160.6	0	0	0	0	107.7	I85 F249 Q253	I85-V87 HydrophobicContact CB-CG2 3.66Å; I85-V87 HydrophobicContact CG2-CG2 3.09Å; I85-V87 PolarHBondContact O-N 3.17Å; I85-V87 VanDerWaalsContact O-N 3.12Å; V87-F249 HydrophobicContact CG1-CE1 4.39Å; V87-Q253 HydrophobicContact CG1-CG 4.48Å
88	F	45.9	Very low	46.2	Very low	96 Å²	96	99.6 Å²	99.6	42%	0.421	49%	0.488	S	S	.	.			trans	-70.5	146.1	175.6	-63.4	-76.8	0	0	0	109.9	I86 E92 E93	I86-F88 HydrophobicContact CG2-CE1 4.37Å; I86-F88 HydrophobicContact CG2-CE2 3.86Å; I86-F88 HydrophobicContact CG2-CZ 3.79Å; F88-E92 VanDerWaalsContact CA-OE2 3.32Å; F88-E92 WeakPolarHBondContact CA-OE2 3.46Å; F88-E92 HydrophobicContact CB-CB 3.89Å; F88-E92 HydrophobicContact CD1-CB 4.28Å; F88-E93 HydrophobicContact CB-CG 3.88Å
89	S	56.4	Low	47.4	Very low	38 Å²	38	96.3 Å²	96.3	27%	0.266	49%	0.488	S	S	.	.			trans	-60	151.1	168.5	173.6	0	0	0	0	110	L91 E92 E93	S89-L91 PolarHBondContact O-N 3.18Å; S89-L91 PolarHBondContact OG-N 3.48Å; S89-E92 PolarHBondContact N-OE2 3.28Å; S89-E92 CarbonylContact O-C 3.09Å; S89-E92 WeakPolarHBondContact O-CA 3.33Å; S89-E92 WeakPolarHBondContact O-CB 3.41Å; S89-E92 PolarHBondContact O-N 3.18Å; S89-E93 PolarHBondContact O-N 2.99Å
90	A	56.5	Low	48.3	Very low	0 Å²	0	90.1 Å²	90.1	0%	0	48%	0.475	C	S	.	.	H	α-helix	trans	-53.5	-30.4	173.6	0	0	0	0	0	112.6	A94 Q253 F255 K908	A90-A94 VanDerWaalsContact O-CB 3.31Å; A90-A94 WeakPolarHBondContact O-CB 3.21Å; A90-A94 PolarHBondContact O-N 3.06Å; A90-Q253 WeakPolarHBondContact CB-O 3.02Å; A90-F255 HydrophobicContact CB-CD1 4.26Å; A90-F255 HydrophobicContact CB-CE1 3.51Å; A90-F255 HydrophobicContact CB-CZ 4Å; A90-K908 HydrophobicContact CB-CG 4.06Å
91	L	60.2	Low	48.8	Very low	43 Å²	43	83.6 Å²	83.6	23%	0.225	46%	0.459	C	S	.	.	H	α-helix	trans	-75.6	-31.8	175.2	-175.1	137.7	0	0	0	112.7	S89 R95	S89-L91 PolarHBondContact O-N 3.18Å; S89-L91 PolarHBondContact OG-N 3.48Å; L91-R95 VanDerWaalsContact CD2-NE 3.32Å; L91-R95 WeakPolarHBondContact O-CB 3.48Å; L91-R95 WeakPolarHBondContact O-CG 3.4Å; L91-R95 PolarHBondContact O-N 3.4Å
92	E	63.5	Low	49.6	Very low	83 Å²	83	78 Å²	78	39%	0.388	43%	0.43	S	S	.	.	H	α-helix	trans	-71.4	-44.8	171.3	-71.8	170.2	169.7	0	0	110.6	F88 S89 A94 R95 D96	F88-E92 VanDerWaalsContact CA-OE2 3.32Å; F88-E92 WeakPolarHBondContact CA-OE2 3.46Å; F88-E92 HydrophobicContact CB-CB 3.89Å; F88-E92 HydrophobicContact CD1-CB 4.28Å; S89-E92 PolarHBondContact N-OE2 3.28Å; S89-E92 CarbonylContact O-C 3.09Å; S89-E92 WeakPolarHBondContact O-CA 3.33Å; S89-E92 WeakPolarHBondContact O-CB 3.41Å; S89-E92 PolarHBondContact O-N 3.18Å; E92-A94 VanDerWaalsContact C-N 3.26Å; E92-A94 PolarHBondContact O-N 3.37Å; E92-R95 WeakPolarHBondContact O-CB 3.45Å; E92-R95 PolarHBondContact O-N 3.27Å; E92-R95 VanDerWaalsContact O-N 3.07Å; E92-D96 PolarHBondContact O-N 2.89Å
93	E	64.1	Low	50.3	Low	29 Å²	29	78 Å²	78	14%	0.136	42%	0.421	C	S	.	.	H	α-helix	trans	-58.3	-39.4	173.3	-70.4	-170.4	-164.7	0	0	111.6	F88 S89 L97 R264 M911	F88-E93 HydrophobicContact CB-CG 3.88Å; S89-E93 PolarHBondContact O-N 2.99Å; E93-L97 VanDerWaalsContact O-CB 3.32Å; E93-L97 WeakPolarHBondContact O-CB 3.42Å; E93-L97 PolarHBondContact O-N 3.41Å; E93-R264 IonicContact OE1-CZ 2.9Å; E93-R264 IonicContact OE1-NH2 3.29Å; E93-R264 PolarHBondContact OE1-NH2 2.88Å; E93-R264 IonicContact OE2-NH2 2.65Å; E93-R264 PolarHBondContact OE2-NH2 2.85Å; E93-M911 HydrophobicContact CB-CE 3.65Å; E93-M911 WeakPolarHBondContact OE2-CE 3.39Å
94	A	59.2	Low	51	Low	0 Å²	0	74.1 Å²	74.1	0%	0	41%	0.405	C	S	.	.	H	α-helix	trans	-68	-40.5	174.3	0	0	0	0	0	112.4	A90 E92 L97 F98 F102 P907 M911	A90-A94 VanDerWaalsContact O-CB 3.31Å; A90-A94 WeakPolarHBondContact O-CB 3.21Å; A90-A94 PolarHBondContact O-N 3.06Å; E92-A94 VanDerWaalsContact C-N 3.26Å; E92-A94 PolarHBondContact O-N 3.37Å; A94-L97 PolarHBondContact O-N 3.01Å; A94-F98 WeakPolarHBondContact O-CD2 3.48Å; A94-F98 PolarHBondContact O-N 2.91Å; A94-F102 HydrophobicContact CB-CE2 4.34Å; A94-P907 HydrophobicContact CB-CB 3.64Å; A94-M911 HydrophobicContact CB-CG 3.97Å; A94-M911 HydrophobicContact CB-SD 4.28Å
95	R	68.1	Low	51.6	Low	115 Å²	115	73 Å²	73	43%	0.434	40%	0.396	S	S	.	.	H	α-helix	trans	-61.5	-44.4	175.2	-79.9	171.2	176.5	177	-0.3	111.7	L91 E92 L97 G99 F102	L91-R95 VanDerWaalsContact CD2-NE 3.32Å; L91-R95 WeakPolarHBondContact O-CB 3.48Å; L91-R95 WeakPolarHBondContact O-CG 3.4Å; L91-R95 PolarHBondContact O-N 3.4Å; E92-R95 WeakPolarHBondContact O-CB 3.45Å; E92-R95 PolarHBondContact O-N 3.27Å; E92-R95 VanDerWaalsContact O-N 3.07Å; R95-L97 VanDerWaalsContact C-N 3.26Å; R95-L97 PolarHBondContact O-N 3.49Å; R95-G99 PolarHBondContact O-N 3.46Å; R95-F102 HydrophobicContact CG-CD2 3.98Å
96	D	65.7	Low	51.8	Low	114 Å²	114	72.9 Å²	72.9	61%	0.61	40%	0.396	S	S	*	.	H	α-helix	trans	-63.8	-35.3	177.2	-70.2	-13.8	0	0	0	111.2	E92	E92-D96 PolarHBondContact O-N 2.89Å
97	L	62.5	Low	52.2	Low	54 Å²	54	68.5 Å²	68.5	28%	0.283	38%	0.375	S	S	.	.	H	α-helix	trans	-69.9	-44.3	179	-177.4	68.6	0	0	0	113.5	E93 A94 R95 F910 M911 P941	E93-L97 VanDerWaalsContact O-CB 3.32Å; E93-L97 WeakPolarHBondContact O-CB 3.42Å; E93-L97 PolarHBondContact O-N 3.41Å; A94-L97 PolarHBondContact O-N 3.01Å; R95-L97 VanDerWaalsContact C-N 3.26Å; R95-L97 PolarHBondContact O-N 3.49Å; L97-F910 HydrophobicContact CD2-CE1 3.64Å; L97-F910 HydrophobicContact CD2-CZ 4.4Å; L97-M911 HydrophobicContact CD2-SD 4.46Å; L97-P941 HydrophobicContact CD1-CB 3.73Å; L97-P941 WeakPolarHBondContact CD1-O 3.36Å; L97-P941 HydrophobicContact CD2-CB 3.52Å; L97-P941 HydrophobicContact CG-CB 4.24Å
98	F	59.9	Low	52.4	Low	42 Å²	42	70.6 Å²	70.6	18%	0.184	38%	0.379	C	S	.	.	H	α-helix	trans	-97.5	-16.5	-172.7	-70.6	-75.3	0	0	0	114.1	A94 V100 F102 T897 V900 F910	A94-F98 WeakPolarHBondContact O-CD2 3.48Å; A94-F98 PolarHBondContact O-N 2.91Å; F98-V100 HydrophobicContact CB-CG2 4.28Å; F98-V100 VanDerWaalsContact O-CG2 3.25Å; F98-V100 WeakPolarHBondContact O-CG2 3.45Å; F98-V100 PolarHBondContact O-N 2.99Å; F98-F102 HydrophobicContact CB-CE2 3.89Å; F98-F102 HydrophobicContact CB-CZ 3.79Å; F98-F102 AromaticContact CD2-CE2 3.87Å; F98-F102 HydrophobicContact CD2-CE2 3.87Å; F98-F102 AromaticContact CD2-CZ 3.44Å; F98-F102 HydrophobicContact CD2-CZ 3.44Å; F98-F102 VanDerWaalsContact CD2-CZ 3.44Å; F98-F102 HydrophobicContact CE2-CZ 4.21Å; F98-F102 HydrophobicContact CG-CE2 4.24Å; F98-F102 AromaticContact CG-CZ 3.78Å; F98-F102 HydrophobicContact CG-CZ 3.78Å; F98-T897 HydrophobicContact CE1-CG2 4.3Å; F98-V900 HydrophobicContact CE1-CB 4.31Å; F98-V900 HydrophobicContact CE1-CG2 4.02Å; F98-V900 HydrophobicContact CE2-CG2 3.78Å; F98-V900 HydrophobicContact CZ-CB 4.16Å; F98-V900 HydrophobicContact CZ-CG2 3.39Å; F98-F910 AromaticContact CE2-CD1 3.63Å; F98-F910 HydrophobicContact CE2-CD1 3.63Å; F98-F910 AromaticContact CE2-CE1 3.44Å; F98-F910 HydrophobicContact CE2-CE1 3.44Å; F98-F910 VanDerWaalsContact CE2-CE1 3.44Å; F98-F910 HydrophobicContact CE2-CG 4.36Å; F98-F910 HydrophobicContact CE2-CZ 4.01Å; F98-F910 AromaticContact CZ-CD1 3.9Å; F98-F910 HydrophobicContact CZ-CD1 3.9Å; F98-F910 HydrophobicContact CZ-CD2 4.46Å; F98-F910 AromaticContact CZ-CE1 3.4Å; F98-F910 HydrophobicContact CZ-CE1 3.4Å; F98-F910 AromaticContact CZ-CE2 3.99Å; F98-F910 HydrophobicContact CZ-CE2 3.99Å; F98-F910 HydrophobicContact CZ-CG 4.42Å; F98-F910 AromaticContact CZ-CZ 3.44Å; F98-F910 HydrophobicContact CZ-CZ 3.44Å; F98-F910 VanDerWaalsContact CZ-CZ 3.44Å
99	G	54	Low	52.1	Low	73 Å²	73	72.8 Å²	72.8	75%	0.753	39%	0.39	S	S	*	.			trans	64.2	0.5	-179.1	0	0	0	0	0	114.8	R95	R95-G99 PolarHBondContact O-N 3.46Å
100	V	46.7	Very low	51.3	Low	96 Å²	96	77.4 Å²	77.4	58%	0.582	41%	0.408	S	S	*	.	S	Bend	trans	-97.3	130.7	176.1	-150.5	0	0	0	0	108	F98 F102	F98-V100 HydrophobicContact CB-CG2 4.28Å; F98-V100 VanDerWaalsContact O-CG2 3.25Å; F98-V100 WeakPolarHBondContact O-CG2 3.45Å; F98-V100 PolarHBondContact O-N 2.99Å; V100-F102 WeakPolarHBondContact O-CD2 3.5Å; V100-F102 PolarHBondContact O-N 2.68Å
101	G	39.4	Very low	50.6	Low	52 Å²	52	80.6 Å²	80.6	54%	0.536	43%	0.425	S	S	.	.			trans	-62.6	103.4	165.9	0	0	0	0	0	107.8	Q103	G101-Q103 PolarHBondContact O-N 2.68Å
102	F	42.1	Very low	49.6	Very low	41 Å²	41	86.7 Å²	86.7	18%	0.18	45%	0.452	C	S	.	.			trans	-63.1	83.6	169.3	-69.3	-83.3	0	0	0	108.4	A94 R95 F98 V100 L104 V900 P907	A94-F102 HydrophobicContact CB-CE2 4.34Å; R95-F102 HydrophobicContact CG-CD2 3.98Å; F98-F102 HydrophobicContact CB-CE2 3.89Å; F98-F102 HydrophobicContact CB-CZ 3.79Å; F98-F102 AromaticContact CD2-CE2 3.87Å; F98-F102 HydrophobicContact CD2-CE2 3.87Å; F98-F102 AromaticContact CD2-CZ 3.44Å; F98-F102 HydrophobicContact CD2-CZ 3.44Å; F98-F102 VanDerWaalsContact CD2-CZ 3.44Å; F98-F102 HydrophobicContact CE2-CZ 4.21Å; F98-F102 HydrophobicContact CG-CE2 4.24Å; F98-F102 AromaticContact CG-CZ 3.78Å; F98-F102 HydrophobicContact CG-CZ 3.78Å; V100-F102 WeakPolarHBondContact O-CD2 3.5Å; V100-F102 PolarHBondContact O-N 2.68Å; F102-L104 PolarHBondContact O-N 3.48Å; F102-V900 HydrophobicContact CE1-CG1 3.61Å; F102-V900 HydrophobicContact CZ-CG1 4.08Å; F102-P907 HydrophobicContact CB-CG 4.23Å; F102-P907 HydrophobicContact CD1-CG 3.61Å; F102-P907 HydrophobicContact CD2-CG 4.13Å; F102-P907 HydrophobicContact CE1-CG 3.9Å; F102-P907 HydrophobicContact CE2-CG 4.4Å; F102-P907 HydrophobicContact CG-CG 3.72Å; F102-P907 HydrophobicContact CZ-CG 4.29Å
103	Q	43.9	Very low	48.4	Very low	119 Å²	119	88.9 Å²	88.9	56%	0.556	47%	0.466	S	S	*	.			trans	-76.5	113	164	-65.1	-170.5	18.5	0	0	105	G101 E105 D106	G101-Q103 PolarHBondContact O-N 2.68Å; Q103-E105 PolarHBondContact O-N 3.25Å; Q103-E105 VanDerWaalsContact O-N 3.16Å; Q103-D106 PolarHBondContact O-N 3.32Å; Q103-D106 VanDerWaalsContact O-N 3.16Å
104	L	42	Very low	47.2	Very low	105 Å²	105	94.4 Å²	94.4	55%	0.55	49%	0.492	S	S	.	.	H	α-helix	trans	-57.9	-28.2	-178.7	-162.9	74.9	0	0	0	110.6	F102 V107 Y108	F102-L104 PolarHBondContact O-N 3.48Å; L104-V107 PolarHBondContact O-N 3.04Å; L104-Y108 HydrophobicContact CD1-CE2 4.2Å; L104-Y108 HydrophobicContact CD2-CE2 4.42Å; L104-Y108 HydrophobicContact CG-CD2 4.37Å; L104-Y108 HydrophobicContact CG-CE2 3.87Å; L104-Y108 WeakPolarHBondContact O-CD2 3.08Å
105	E	42.2	Very low	46	Very low	139 Å²	139	103 Å²	103	65%	0.65	53%	0.532	S	S	*	.	H	α-helix	trans	-63.4	-40.8	176.9	-75.6	163.7	173.9	0	0	113	Q103 V107 Y108 E109	Q103-E105 PolarHBondContact O-N 3.25Å; Q103-E105 VanDerWaalsContact O-N 3.16Å; E105-V107 PolarHBondContact O-N 2.91Å; E105-V107 VanDerWaalsContact O-N 3.1Å; E105-Y108 PolarHBondContact O-N 3.41Å; E105-E109 PolarHBondContact O-N 3.35Å
106	D	42.1	Very low	44.5	Very low	103 Å²	103	101.4 Å²	101.4	55%	0.551	54%	0.544	S	S	*	.	H	α-helix	trans	-62.2	-22.5	177.8	-63.2	-11.9	0	0	0	112.8	Q103	Q103-D106 PolarHBondContact O-N 3.32Å; Q103-D106 VanDerWaalsContact O-N 3.16Å
107	V	42	Very low	43	Very low	46 Å²	46	104.5 Å²	104.5	28%	0.279	56%	0.555	S	S	.	*	H	α-helix	trans	-76.6	-27	179.3	-174.7	0	0	0	0	111.6	L104 E105 K904	L104-V107 PolarHBondContact O-N 3.04Å; E105-V107 PolarHBondContact O-N 2.91Å; E105-V107 VanDerWaalsContact O-N 3.1Å; V107-K904 HydrophobicContact CG1-CB 4.11Å; V107-K904 HydrophobicContact CG1-CD 4.23Å; V107-K904 HydrophobicContact CG1-CG 4.47Å; V107-K904 PolarHBondContact O-NZ 3.43Å
108	Y	43.6	Very low	41.6	Very low	94 Å²	94	110.1 Å²	110.1	37%	0.369	58%	0.58	S	S	.	*	H	α-helix	trans	-110.9	-19.3	-167.4	-67.6	-68.8	0	0	0	115.3	L104 E105 E110 L176	L104-Y108 HydrophobicContact CD1-CE2 4.2Å; L104-Y108 HydrophobicContact CD2-CE2 4.42Å; L104-Y108 HydrophobicContact CG-CD2 4.37Å; L104-Y108 HydrophobicContact CG-CE2 3.87Å; L104-Y108 WeakPolarHBondContact O-CD2 3.08Å; E105-Y108 PolarHBondContact O-N 3.41Å; Y108-E110 VanDerWaalsContact C-N 3.33Å; Y108-E110 PolarHBondContact O-N 3.47Å; Y108-L176 HydrophobicContact CE1-CD2 4.42Å; Y108-L176 PolarHBondContact OH-O 3.33Å
109	E	40.8	Very low	40.3	Very low	143 Å²	143	110.9 Å²	110.9	67%	0.668	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.6	-25.8	-176.5	-77	-169.3	165.5	0	0	114.2	E105	E105-E109 PolarHBondContact O-N 3.35Å
110	E	39.7	Very low	39.3	Very low	135 Å²	135	114.3 Å²	114.3	63%	0.631	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.3	-20.3	-177.2	-69.9	-178.5	163.5	0	0	114.7	Y108	Y108-E110 VanDerWaalsContact C-N 3.33Å; Y108-E110 PolarHBondContact O-N 3.47Å
111	D	40.7	Very low	38.6	Very low	67 Å²	67	118.1 Å²	118.1	36%	0.358	61%	0.61	S	S	.	*	H	α-helix	trans	-82.9	-19.6	-174.1	-64.1	-7.6	0	0	0	112.5	D113 K904	D111-D113 VanDerWaalsContact C-N 3.33Å; D111-K904 IonicContact OD1-NZ 3.67Å; D111-K904 PolarHBondContact OD1-NZ 2.91Å; D111-K904 IonicContact OD2-NZ 2.99Å
112	E	38.6	Very low	38.4	Very low	171 Å²	171	122.8 Å²	122.8	80%	0.799	62%	0.618	S	S	*	*	H	α-helix	trans	-72.3	-25.3	175.7	-76.2	-165.8	171.9	0	0	112.9
113	D	39.4	Very low	38	Very low	128 Å²	128	127.8 Å²	127.8	68%	0.684	65%	0.647	S	S	*	*	H	α-helix	trans	-86	-31.5	-179.7	-75.1	-28.2	0	0	0	112.9	D111 A116	D111-D113 VanDerWaalsContact C-N 3.33Å; D113-A116 PolarHBondContact O-N 3.23Å
114	E	38.2	Very low	37.6	Very low	146 Å²	146	129.8 Å²	129.8	68%	0.682	66%	0.656	S	S	*	*	H	α-helix	trans	-80.2	-31.5	-178.2	-74.3	-170.1	171.7	0	0	114.1	A116 E117 E118	E114-A116 PolarHBondContact O-N 3.33Å; E114-A116 VanDerWaalsContact O-N 3.13Å; E114-E117 PolarHBondContact O-N 3.24Å; E114-E117 VanDerWaalsContact O-N 3.15Å; E114-E118 PolarHBondContact O-N 3.3Å
115	E	33.9	Very low	37.2	Very low	179 Å²	179	132.2 Å²	132.2	84%	0.836	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.2	-15.9	173.4	-75.6	-164.3	172.5	0	0	112.5
116	A	36.7	Very low	36.7	Very low	83 Å²	83	132.1 Å²	132.1	69%	0.686	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83	-22.2	175.5	0	0	0	0	0	114	D113 E114	D113-A116 PolarHBondContact O-N 3.23Å; E114-A116 PolarHBondContact O-N 3.33Å; E114-A116 VanDerWaalsContact O-N 3.13Å
117	E	35	Very low	36.4	Very low	179 Å²	179	136.9 Å²	136.9	84%	0.836	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.5	-16.1	-175.7	-89.1	-169	170.3	0	0	115.3	E114 G119	E114-E117 PolarHBondContact O-N 3.24Å; E114-E117 VanDerWaalsContact O-N 3.15Å; E117-G119 PolarHBondContact O-N 3.28Å
118	E	32.9	Very low	35.9	Very low	172 Å²	172	143.7 Å²	143.7	80%	0.804	71%	0.709	S	S	*	*			trans	-78	56.2	168.5	-70.3	-161.4	172.1	0	0	112.1	E114 I120	E114-E118 PolarHBondContact O-N 3.3Å; E118-I120 VanDerWaalsContact C-N 3.32Å; E118-I120 PolarHBondContact O-N 2.87Å
119	G	32.2	Very low	35.5	Very low	58 Å²	58	146.9 Å²	146.9	60%	0.598	73%	0.732	S	S	*	*			trans	-64.3	99.3	151.1	0	0	0	0	0	107.5	E117 E121	E117-G119 PolarHBondContact O-N 3.28Å; G119-E121 VanDerWaalsContact C-N 3.31Å; G119-E121 PolarHBondContact O-N 2.91Å
120	I	32.6	Very low	35	Very low	144 Å²	144	143.6 Å²	143.6	74%	0.738	74%	0.736	S	S	*	*			trans	-53.8	101.2	167.3	-58.8	171.1	0	0	0	106.5	E118 E122	E118-I120 VanDerWaalsContact C-N 3.32Å; E118-I120 PolarHBondContact O-N 2.87Å; I120-E122 HydrophobicContact CG2-CG 3.98Å; I120-E122 PolarHBondContact O-N 2.91Å
121	E	33.1	Very low	34.8	Very low	177 Å²	177	145.2 Å²	145.2	83%	0.827	75%	0.748	S	S	*	*			trans	-65	83.6	164.8	-72	-174.9	154.7	0	0	105.9	G119 D123	G119-E121 VanDerWaalsContact C-N 3.31Å; G119-E121 PolarHBondContact O-N 2.91Å; E121-D123 VanDerWaalsContact C-N 3.28Å; E121-D123 PolarHBondContact O-N 3.18Å
122	E	34.2	Very low	34.4	Very low	149 Å²	149	151 Å²	151	70%	0.696	77%	0.773	S	S	*	*			trans	-63.5	99.7	162.3	-75.6	-178.6	160.2	0	0	106	I120 E124	I120-E122 HydrophobicContact CG2-CG 3.98Å; I120-E122 PolarHBondContact O-N 2.91Å; E122-E124 PolarHBondContact O-N 3.46Å
123	D	34.1	Very low	34.4	Very low	147 Å²	147	150.6 Å²	150.6	79%	0.786	78%	0.776	S	S	*	*			trans	-55.2	87.3	162.7	-74.4	-44.3	0	0	0	108	E121 E125	E121-D123 VanDerWaalsContact C-N 3.28Å; E121-D123 PolarHBondContact O-N 3.18Å; D123-E125 PolarHBondContact O-N 2.93Å
124	E	36.1	Very low	34.2	Very low	160 Å²	160	151.6 Å²	151.6	75%	0.748	78%	0.782	S	S	*	*			trans	-65.3	84.7	168	-77.6	-176.2	160.8	0	0	107.6	E122 D126	E122-E124 PolarHBondContact O-N 3.46Å; E124-D126 PolarHBondContact O-N 3.45Å
125	E	32.1	Very low	34.1	Very low	157 Å²	157	152.9 Å²	152.9	73%	0.734	79%	0.788	S	S	*	*			trans	-66.5	89.3	161.6	-76.1	-171.9	165.6	0	0	108.1	D123 Y127	D123-E125 PolarHBondContact O-N 2.93Å; E125-Y127 WeakPolarHBondContact O-CD2 3.46Å; E125-Y127 PolarHBondContact O-N 2.9Å
126	D	32.5	Very low	33.9	Very low	137 Å²	137	148.2 Å²	148.2	73%	0.733	79%	0.788	S	S	*	*			trans	-54.2	100.3	175.7	-79.6	-38.4	0	0	0	111.8	E124 E128	E124-D126 PolarHBondContact O-N 3.45Å; D126-E128 PolarHBondContact O-N 3.33Å; D126-E128 VanDerWaalsContact O-N 3.07Å
127	Y	36.1	Very low	33.9	Very low	202 Å²	202	156.1 Å²	156.1	79%	0.792	80%	0.8	S	S	*	*			trans	-74.7	90.9	161	-74.1	-91	0	0	0	108.9	E125 L129	E125-Y127 WeakPolarHBondContact O-CD2 3.46Å; E125-Y127 PolarHBondContact O-N 2.9Å; Y127-L129 PolarHBondContact O-N 2.85Å
128	E	31.9	Very low	33.7	Very low	189 Å²	189	159.8 Å²	159.8	88%	0.883	81%	0.806	S	S	*	*			trans	-56.5	96.4	167.8	-87.1	-174.3	146.3	0	0	110.9	D126	D126-E128 PolarHBondContact O-N 3.33Å; D126-E128 VanDerWaalsContact O-N 3.07Å
129	L	33.8	Very low	33.5	Very low	162 Å²	162	159.5 Å²	159.5	85%	0.848	81%	0.809	S	S	*	*			trans	-90.5	96.2	159.5	-79.6	169.7	0	0	0	108.5	Y127 L131	Y127-L129 PolarHBondContact O-N 2.85Å; L129-L131 PolarHBondContact O-N 3.38Å
130	G	30.7	Very low	33.5	Very low	73 Å²	73	166.1 Å²	166.1	75%	0.753	82%	0.822	S	S	*	*			trans	-58.1	114.3	173.8	0	0	0	0	0	112.1
131	L	36.6	Very low	33.3	Very low	170 Å²	170	165.9 Å²	165.9	89%	0.89	83%	0.827	S	S	*	*			trans	-124.2	96.6	157.9	-71.5	174.6	0	0	0	107.1	L129	L129-L131 PolarHBondContact O-N 3.38Å
132	E	31.8	Very low	33.3	Very low	188 Å²	188	163.6 Å²	163.6	88%	0.879	83%	0.825	S	S	*	*			trans	-63	126	163	-65.3	175	152.2	0	0	108.6
133	D	38.3	Very low	33.2	Very low	162 Å²	162	159.8 Å²	159.8	87%	0.866	83%	0.825	S	S	*	*			trans	-178	102.1	138.8	-90.4	-21	0	0	0	111.1
134	D	34.4	Very low	33	Very low	150 Å²	150	164.7 Å²	164.7	80%	0.802	83%	0.833	S	S	*	*			trans	53.9	141.1	132.6	-124.3	-9.3	0	0	0	124.6
135	E	36.9	Very low	33	Very low	172 Å²	172	168.8 Å²	168.8	80%	0.804	84%	0.842	S	S	*	*			trans	78.3	82	158.9	-56.1	-132	154.9	0	0	121.6
136	G	30.5	Very low	33.2	Very low	82 Å²	82	170.8 Å²	170.8	85%	0.845	85%	0.848	S	S	*	*				45.1	87.4	118.8	0	0	0	0	0	120.8
137	R	35.3	Very low	33.4	Very low	248 Å²	248	167.6 Å²	167.6	94%	0.936	85%	0.848	S	S	*	*			trans	-135.1	117.9	150.5	-89.2	-175	177.1	179.9	0.7	113.1
138	R	32.3	Very low	33.6	Very low	256 Å²	256	164.4 Å²	164.4	97%	0.966	85%	0.849	S	S	*	*			trans	-42.2	123.4	175.7	-118.8	168.6	172.9	157.6	-2.7	114.1	K140	R138-K140 PolarHBondContact O-N 3.25Å
139	L	28.6	Very low	34.2	Very low	166 Å²	166	158.5 Å²	158.5	87%	0.869	84%	0.839	S	S	*	*			trans	-62.3	119.9	168.7	-70.6	150.5	0	0	0	111.2
140	K	32.3	Very low	34.6	Very low	197 Å²	197	160.2 Å²	160.2	86%	0.857	84%	0.839	S	S	*	*			trans	-107.4	106	158.9	-97.6	-173.7	175.6	-179.3	0	108	R138 T142	R138-K140 PolarHBondContact O-N 3.25Å; K140-T142 PolarHBondContact O-N 2.89Å
141	V	28.7	Very low	35.3	Very low	140 Å²	140	165.8 Å²	165.8	85%	0.848	84%	0.838	S	S	*	*			trans	-75.8	95.3	172.2	178.1	0	0	0	0	108.2
142	T	31.5	Very low	36.5	Very low	129 Å²	129	160.7 Å²	160.7	79%	0.791	82%	0.816	S	S	*	*			trans	-147.3	120.6	164.8	53	0	0	0	0	109.8	K140	K140-T142 PolarHBondContact O-N 2.89Å
143	G	33	Very low	38.2	Very low	68 Å²	68	157.9 Å²	157.9	70%	0.701	81%	0.806	S	S	*	*			trans	119.2	97	168.2	0	0	0	0	0	112.2	R145	G143-R145 PolarHBondContact O-N 3.3Å
144	R	30.1	Very low	39.7	Very low	251 Å²	251	152.7 Å²	152.7	95%	0.947	78%	0.778	S	S	*	*			trans	-40.7	109.4	158.9	-77.2	174.7	169.5	173.5	-5.6	107.8	K146	R144-K146 PolarHBondContact O-N 3.48Å
145	R	36	Very low	41.6	Very low	246 Å²	246	152.2 Å²	152.2	93%	0.928	77%	0.771	S	S	*	*			trans	-61	112.4	170	-76.6	-179.6	174.2	174.7	-2.4	105.5	G143 G147	G143-R145 PolarHBondContact O-N 3.3Å; R145-G147 PolarHBondContact O-N 2.95Å; R145-G147 VanDerWaalsContact O-N 3.07Å
146	K	35.1	Very low	43.6	Very low	198 Å²	198	150.6 Å²	150.6	86%	0.861	76%	0.764	S	S	*	*			trans	-49.6	117.8	159	-74.9	-177.9	173.3	-175.3	0	105.1	R144 V148	R144-K146 PolarHBondContact O-N 3.48Å; K146-V148 PolarHBondContact O-N 3.13Å
147	G	37.8	Very low	46	Very low	71 Å²	71	149.5 Å²	149.5	73%	0.732	74%	0.738	S	S	*	*			trans	-47.6	121.5	173.3	0	0	0	0	0	107.3	R145 G149	R145-G147 PolarHBondContact O-N 2.95Å; R145-G147 VanDerWaalsContact O-N 3.07Å; G147-G149 VanDerWaalsContact C-N 3.3Å; G147-G149 PolarHBondContact O-N 3.21Å
148	V	41.1	Very low	48.3	Very low	135 Å²	135	143.9 Å²	143.9	82%	0.818	72%	0.722	S	S	*	*			trans	-60.2	107	164.8	175.6	0	0	0	0	103.2	K146 K150	K146-V148 PolarHBondContact O-N 3.13Å; V148-K150 PolarHBondContact O-N 3.26Å
149	G	43.4	Very low	50.6	Low	65 Å²	65	136.2 Å²	136.2	67%	0.67	71%	0.706	S	S	*	*			trans	-53.1	109	175.4	0	0	0	0	0	106.7	G147 R151	G147-G149 VanDerWaalsContact C-N 3.3Å; G147-G149 PolarHBondContact O-N 3.21Å; G149-R151 PolarHBondContact O-N 3.46Å
150	K	42	Very low	53.1	Low	198 Å²	198	131.4 Å²	131.4	86%	0.861	69%	0.69	S	S	*	*			trans	-60.4	109.7	172.6	-71.9	-175.8	175.7	-174.4	0	104.3	V148 S152	V148-K150 PolarHBondContact O-N 3.26Å; K150-S152 PolarHBondContact O-N 3.01Å
151	R	45.6	Very low	55.5	Low	190 Å²	190	127.2 Å²	127.2	72%	0.717	67%	0.673	S	S	*	*			trans	-56.3	129.5	171.6	-69.7	-179.2	-177.6	172.6	-1.8	106.8	G149 L153 E155	G149-R151 PolarHBondContact O-N 3.46Å; R151-L153 PolarHBondContact O-N 3.45Å; R151-E155 WeakPolarHBondContact CB-OE2 3.4Å
152	S	61.9	Low	58	Low	62 Å²	62	121.7 Å²	121.7	43%	0.434	64%	0.639	S	S	.	*			trans	-54	142.2	175.9	171.5	0	0	0	0	109.2	K150 L154 E155	K150-S152 PolarHBondContact O-N 3.01Å; S152-L154 PolarHBondContact O-N 2.95Å; S152-L154 VanDerWaalsContact O-N 3.09Å; S152-L154 PolarHBondContact OG-N 3.27Å; S152-E155 WeakPolarHBondContact O-CB 3.38Å; S152-E155 PolarHBondContact O-N 3.31Å
153	L	67.6	Low	60.3	Low	130 Å²	130	121.1 Å²	121.1	68%	0.681	63%	0.627	S	S	*	*	G	3₁₀ helix	trans	-52.5	-32.3	177.2	-172.5	70.5	0	0	0	111.4	R151 E155 Q156	R151-L153 PolarHBondContact O-N 3.45Å; L153-E155 VanDerWaalsContact C-N 3.35Å; L153-E155 PolarHBondContact O-N 3.38Å; L153-Q156 WeakPolarHBondContact O-CB 3.48Å; L153-Q156 PolarHBondContact O-N 2.87Å
154	L	70.1	Confident	62.5	Low	53 Å²	53	124 Å²	124	28%	0.277	62%	0.617	S	S	.	*	G	3₁₀ helix	trans	-66.6	-31.2	178.3	-60.1	177.2	0	0	0	113.1	S152 Q156 I157 L162 L167	S152-L154 PolarHBondContact O-N 2.95Å; S152-L154 VanDerWaalsContact O-N 3.09Å; S152-L154 PolarHBondContact OG-N 3.27Å; L154-Q156 PolarHBondContact O-N 2.83Å; L154-I157 PolarHBondContact O-N 2.91Å; L154-L162 HydrophobicContact CB-CD2 4.39Å; L154-L162 HydrophobicContact CD2-CD2 4.01Å; L154-L167 HydrophobicContact CD2-CD1 4.26Å
155	E	74.2	Confident	64.9	Low	140 Å²	140	115.3 Å²	115.3	65%	0.654	60%	0.595	S	S	*	*	G	3₁₀ helix	trans	-71.4	-13.6	177	-65.8	-178.7	167.2	0	0	112.9	R151 S152 L153	R151-E155 WeakPolarHBondContact CB-OE2 3.4Å; S152-E155 WeakPolarHBondContact O-CB 3.38Å; S152-E155 PolarHBondContact O-N 3.31Å; L153-E155 VanDerWaalsContact C-N 3.35Å; L153-E155 PolarHBondContact O-N 3.38Å
156	Q	79.4	Confident	67.1	Low	137 Å²	137	105.5 Å²	105.5	64%	0.64	56%	0.559	S	S	*	*	G	3₁₀ helix	trans	-90.1	-16.2	179.1	-56	-176.6	16.9	0	0	112.8	L153 L154	L153-Q156 WeakPolarHBondContact O-CB 3.48Å; L153-Q156 PolarHBondContact O-N 2.87Å; L154-Q156 PolarHBondContact O-N 2.83Å
157	I	79.5	Confident	69.2	Low	59 Å²	59	99.5 Å²	99.5	30%	0.303	54%	0.536	S	S	.	.	S	Bend	trans	-86.8	144.3	-178.9	-60.4	174.1	0	0	0	109.4	L154 E161 L162	L154-I157 PolarHBondContact O-N 2.91Å; I157-E161 HydrophobicContact CG2-CB 3.63Å; I157-L162 HydrophobicContact CB-CD2 3.9Å; I157-L162 HydrophobicContact CB-CG 4.08Å; I157-L162 HydrophobicContact CD1-CD2 4.2Å; I157-L162 HydrophobicContact CG2-CD2 3.92Å; I157-L162 HydrophobicContact CG2-CG 3.9Å
158	E	84.4	Confident	71.4	Confident	131 Å²	131	97 Å²	97	61%	0.612	51%	0.507	S	S	*	.			trans	-63	138.7	177	-67.1	-168.5	169.8	0	0	111	A160 E161 L162	E158-A160 PolarHBondContact O-N 3.43Å; E158-A160 VanDerWaalsContact O-N 3.09Å; E158-E161 HydrophobicContact CB-CG 4.38Å; E158-E161 WeakPolarHBondContact O-CA 3.27Å; E158-E161 WeakPolarHBondContact O-CB 3.34Å; E158-E161 PolarHBondContact O-N 3.48Å; E158-L162 PolarHBondContact O-N 3.14Å
159	P	80.1	Confident	73.3	Confident	95 Å²	95	96 Å²	96	62%	0.617	50%	0.497	S	S	*	.	H	α-helix	trans	-53.8	-35.3	-178.7	-29.3	35.2	0	0	0	114.4	L162 E163	P159-L162 WeakPolarHBondContact O-CB 3.28Å; P159-L162 PolarHBondContact O-N 3.49Å; P159-E163 WeakPolarHBondContact O-CG 3.1Å; P159-E163 PolarHBondContact O-N 2.93Å
160	A	82.1	Confident	75.3	Confident	65 Å²	65	97.2 Å²	97.2	54%	0.537	48%	0.484	S	S	.	.	H	α-helix	trans	-66.1	-36.2	176.5	0	0	0	0	0	112.4	E158 R164	E158-A160 PolarHBondContact O-N 3.43Å; E158-A160 VanDerWaalsContact O-N 3.09Å; A160-R164 VanDerWaalsContact O-CB 3.26Å; A160-R164 WeakPolarHBondContact O-CB 3.37Å; A160-R164 PolarHBondContact O-N 3.3Å
161	E	83	Confident	77.4	Confident	109 Å²	109	87.8 Å²	87.8	51%	0.509	44%	0.443	S	S	.	.	H	α-helix	trans	-73.2	-32.8	175.4	-68.6	-171.7	158.2	0	0	112	I157 E158 R164 S165	I157-E161 HydrophobicContact CG2-CB 3.63Å; E158-E161 HydrophobicContact CB-CG 4.38Å; E158-E161 WeakPolarHBondContact O-CA 3.27Å; E158-E161 WeakPolarHBondContact O-CB 3.34Å; E158-E161 PolarHBondContact O-N 3.48Å; E161-R164 PolarHBondContact O-N 2.91Å; E161-S165 WeakPolarHBondContact O-CB 3.41Å; E161-S165 PolarHBondContact O-N 3.47Å; E161-S165 PolarHBondContact O-OG 3.46Å
162	L	79.9	Confident	79.3	Confident	24 Å²	24	82.8 Å²	82.8	13%	0.126	43%	0.427	C	S	.	.	H	α-helix	trans	-63.8	-47.5	171.3	-68.2	174.4	0	0	0	111.5	L154 I157 E158 P159 R164 S165 F166 L167	L154-L162 HydrophobicContact CB-CD2 4.39Å; L154-L162 HydrophobicContact CD2-CD2 4.01Å; I157-L162 HydrophobicContact CB-CD2 3.9Å; I157-L162 HydrophobicContact CB-CG 4.08Å; I157-L162 HydrophobicContact CD1-CD2 4.2Å; I157-L162 HydrophobicContact CG2-CD2 3.92Å; I157-L162 HydrophobicContact CG2-CG 3.9Å; E158-L162 PolarHBondContact O-N 3.14Å; P159-L162 WeakPolarHBondContact O-CB 3.28Å; P159-L162 PolarHBondContact O-N 3.49Å; L162-R164 VanDerWaalsContact C-N 3.31Å; L162-R164 PolarHBondContact O-N 2.92Å; L162-S165 CarbonylContact O-C 3.39Å; L162-S165 PolarHBondContact O-N 3Å; L162-S165 VanDerWaalsContact O-N 3.12Å; L162-F166 PolarHBondContact O-N 3.1Å; L162-F166 VanDerWaalsContact O-N 3.07Å; L162-L167 HydrophobicContact CD2-CB 4.05Å; L162-L167 PolarHBondContact O-N 2.89Å
163	E	79.2	Confident	80.6	Confident	116 Å²	116	86.8 Å²	86.8	54%	0.542	43%	0.432	S	S	.	.	H	α-helix	trans	-61.1	-41.7	174.7	-73.3	175.9	-174.2	0	0	111.3	P159 S165 F166	P159-E163 WeakPolarHBondContact O-CG 3.1Å; P159-E163 PolarHBondContact O-N 2.93Å; E163-S165 PolarHBondContact O-N 3.03Å; E163-F166 WeakPolarHBondContact O-CD1 3.43Å; E163-F166 PolarHBondContact O-N 3.36Å; E163-F166 VanDerWaalsContact O-N 3.16Å
164	R	80.7	Confident	81.7	Confident	128 Å²	128	80.8 Å²	80.8	48%	0.483	40%	0.401	S	S	.	.	H	α-helix	trans	-64.1	-27.3	174.9	-160.9	-173.2	-176.9	-169.6	-1.7	112.5	A160 E161 L162 Q815 D816	A160-R164 VanDerWaalsContact O-CB 3.26Å; A160-R164 WeakPolarHBondContact O-CB 3.37Å; A160-R164 PolarHBondContact O-N 3.3Å; E161-R164 PolarHBondContact O-N 2.91Å; L162-R164 VanDerWaalsContact C-N 3.31Å; L162-R164 PolarHBondContact O-N 2.92Å; R164-Q815 PolarHBondContact O-NE2 3.1Å; R164-Q815 PolarHBondContact O-OE1 2.92Å; R164-D816 IonicContact CZ-OD1 3.2Å; R164-D816 IonicContact CZ-OD2 3.99Å; R164-D816 IonicContact NH2-OD1 2.89Å; R164-D816 PolarHBondContact NH2-OD1 3.28Å; R164-D816 IonicContact NH2-OD2 3.41Å; R164-D816 PolarHBondContact NH2-OD2 3.19Å
165	S	79.2	Confident	82.5	Confident	70 Å²	70	79.7 Å²	79.7	49%	0.49	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.9	2.4	178.3	-54.6	0	0	0	0	112.8	E161 L162 E163 L167	E161-S165 WeakPolarHBondContact O-CB 3.41Å; E161-S165 PolarHBondContact O-N 3.47Å; E161-S165 PolarHBondContact O-OG 3.46Å; L162-S165 CarbonylContact O-C 3.39Å; L162-S165 PolarHBondContact O-N 3Å; L162-S165 VanDerWaalsContact O-N 3.12Å; E163-S165 PolarHBondContact O-N 3.03Å; S165-L167 PolarHBondContact O-N 3.25Å
166	F	82.7	Confident	83.1	Confident	40 Å²	40	76.5 Å²	76.5	18%	0.175	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	57.4	35.4	-172.4	-51.4	-37.9	0	0	0	113.6	L162 E163 D171 Q175 Q815 P876 R877 A880	L162-F166 PolarHBondContact O-N 3.1Å; L162-F166 VanDerWaalsContact O-N 3.07Å; E163-F166 WeakPolarHBondContact O-CD1 3.43Å; E163-F166 PolarHBondContact O-N 3.36Å; E163-F166 VanDerWaalsContact O-N 3.16Å; F166-D171 VanDerWaalsContact C-OD2 3.28Å; F166-D171 VanDerWaalsContact CA-OD2 3.29Å; F166-D171 WeakPolarHBondContact CA-OD2 3.24Å; F166-D171 WeakPolarHBondContact O-CB 3.44Å; F166-Q175 PolarHBondContact O-NE2 2.89Å; F166-Q815 HydrophobicContact CE1-CG 4.31Å; F166-Q815 HydrophobicContact CZ-CG 4.1Å; F166-P876 HydrophobicContact CE2-CB 3.75Å; F166-P876 HydrophobicContact CZ-CB 3.59Å; F166-P876 HydrophobicContact CZ-CG 4.13Å; F166-R877 HydrophobicContact CB-CG 4.25Å; F166-R877 HydrophobicContact CD1-CG 3.96Å; F166-R877 HydrophobicContact CD2-CG 4.48Å; F166-R877 HydrophobicContact CE1-CG 4.27Å; F166-R877 HydrophobicContact CG-CG 4Å; F166-A880 HydrophobicContact CD2-CB 4.34Å
167	L	79.7	Confident	83.6	Confident	72 Å²	72	74 Å²	74	38%	0.377	37%	0.37	S	S	.	.			trans	-112.3	5.8	-175.8	-66.1	176.2	0	0	0	113.8	L154 L162 S165 D171	L154-L167 HydrophobicContact CD2-CD1 4.26Å; L162-L167 HydrophobicContact CD2-CB 4.05Å; L162-L167 PolarHBondContact O-N 2.89Å; S165-L167 PolarHBondContact O-N 3.25Å; L167-D171 PolarHBondContact N-OD2 3.02Å
168	S	82.9	Confident	84.1	Confident	18 Å²	18	72.3 Å²	72.3	13%	0.126	36%	0.361	C	S	.	.	S	Bend	trans	-73.8	161.5	175.9	80.9	0	0	0	0	111.9	F170 D171 K172	S168-F170 PolarHBondContact O-N 3.01Å; S168-F170 PolarHBondContact OG-N 2.81Å; S168-D171 WeakPolarHBondContact CB-OD2 3.26Å; S168-D171 PolarHBondContact N-OD2 3.37Å; S168-D171 WeakPolarHBondContact O-CA 3.46Å; S168-D171 WeakPolarHBondContact O-CB 3.45Å; S168-D171 PolarHBondContact O-N 3.37Å; S168-D171 PolarHBondContact OG-N 3.36Å; S168-D171 PolarHBondContact OG-OD1 3.42Å; S168-D171 PolarHBondContact OG-OD2 2.68Å; S168-K172 PolarHBondContact O-N 3.17Å
169	D	81.8	Confident	84.5	Confident	114 Å²	114	68.1 Å²	68.1	61%	0.61	34%	0.34	S	S	*	.	H	α-helix	trans	-61.7	-31.4	176.6	-65.1	-28	0	0	0	112.6	D171 R173	D169-D171 VanDerWaalsContact C-N 3.28Å; D169-R173 WeakPolarHBondContact O-CG 3.24Å; D169-R173 PolarHBondContact O-N 3.39Å; D169-R173 VanDerWaalsContact O-N 3.17Å; D169-R173 PolarHBondContact O-NH1 3.14Å
170	F	85.8	Confident	85.1	Confident	90 Å²	90	63.6 Å²	63.6	40%	0.395	31%	0.311	S	S	.	.	H	α-helix	trans	-63.8	-39.1	172	173.4	-106.9	0	0	0	110.9	S168 R173 V174	S168-F170 PolarHBondContact O-N 3.01Å; S168-F170 PolarHBondContact OG-N 2.81Å; F170-R173 PolarHBondContact O-N 3.27Å; F170-V174 HydrophobicContact CD1-CG2 4.4Å; F170-V174 HydrophobicContact CD2-CG2 4.45Å; F170-V174 HydrophobicContact CE1-CG2 3.98Å; F170-V174 HydrophobicContact CE2-CG2 4.03Å; F170-V174 HydrophobicContact CZ-CG2 3.78Å; F170-V174 WeakPolarHBondContact O-CG2 3.24Å; F170-V174 PolarHBondContact O-N 3.24Å
171	D	86.3	Confident	85.7	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-70.8	-40.7	-176.8	-50.5	-26.2	0	0	0	111.2	F166 L167 S168 D169 R173 V174 Q175 R877	F166-D171 VanDerWaalsContact C-OD2 3.28Å; F166-D171 VanDerWaalsContact CA-OD2 3.29Å; F166-D171 WeakPolarHBondContact CA-OD2 3.24Å; F166-D171 WeakPolarHBondContact O-CB 3.44Å; L167-D171 PolarHBondContact N-OD2 3.02Å; S168-D171 WeakPolarHBondContact CB-OD2 3.26Å; S168-D171 PolarHBondContact N-OD2 3.37Å; S168-D171 WeakPolarHBondContact O-CA 3.46Å; S168-D171 WeakPolarHBondContact O-CB 3.45Å; S168-D171 PolarHBondContact O-N 3.37Å; S168-D171 PolarHBondContact OG-N 3.36Å; S168-D171 PolarHBondContact OG-OD1 3.42Å; S168-D171 PolarHBondContact OG-OD2 2.68Å; D169-D171 VanDerWaalsContact C-N 3.28Å; D171-R173 VanDerWaalsContact C-N 3.34Å; D171-R173 PolarHBondContact O-N 2.9Å; D171-V174 PolarHBondContact O-N 3.03Å; D171-Q175 WeakPolarHBondContact O-CB 2.97Å; D171-Q175 WeakPolarHBondContact O-CG 3.14Å; D171-Q175 PolarHBondContact O-N 2.85Å; D171-R877 VanDerWaalsContact CG-CZ 3.44Å; D171-R877 IonicContact OD1-CZ 3.26Å; D171-R877 IonicContact OD1-NE 3.32Å; D171-R877 IonicContact OD1-NH1 3.53Å; D171-R877 PolarHBondContact OD1-NH1 3.14Å; D171-R877 IonicContact OD1-NH2 3.37Å; D171-R877 PolarHBondContact OD1-NH2 3.31Å; D171-R877 IonicContact OD2-NH1 2.67Å; D171-R877 PolarHBondContact OD2-NH1 2.71Å; D171-R877 VanDerWaalsContact OD2-NH1 3.17Å
172	K	85.6	Confident	86.2	Confident	85 Å²	85	57.2 Å²	57.2	37%	0.37	27%	0.268	S	S	.	.	H	α-helix	trans	-58.1	-44.9	171.6	-68.8	-177.5	178.9	-176.6	0	111.5	S168 V174 Q175 L176	S168-K172 PolarHBondContact O-N 3.17Å; K172-V174 PolarHBondContact O-N 3.33Å; K172-Q175 PolarHBondContact O-N 3.05Å; K172-L176 WeakPolarHBondContact O-CG 3.36Å; K172-L176 PolarHBondContact O-N 3.31Å
173	R	89.1	Confident	86.8	Confident	147 Å²	147	56.1 Å²	56.1	56%	0.555	26%	0.262	S	S	*	.	H	α-helix	trans	-59.5	-46.1	175	-72.4	-167.9	-56.9	-84.8	6	111.8	D169 F170 D171 Q175 L176 E177	D169-R173 WeakPolarHBondContact O-CG 3.24Å; D169-R173 PolarHBondContact O-N 3.39Å; D169-R173 VanDerWaalsContact O-N 3.17Å; D169-R173 PolarHBondContact O-NH1 3.14Å; F170-R173 PolarHBondContact O-N 3.27Å; D171-R173 VanDerWaalsContact C-N 3.34Å; D171-R173 PolarHBondContact O-N 2.9Å; R173-Q175 VanDerWaalsContact C-N 3.32Å; R173-Q175 PolarHBondContact O-N 2.86Å; R173-L176 PolarHBondContact O-N 2.94Å; R173-E177 WeakPolarHBondContact O-CB 3.49Å; R173-E177 PolarHBondContact O-N 2.91Å
174	V	89.4	Confident	87.4	Confident	3 Å²	3	51.8 Å²	51.8	2%	0.018	24%	0.242	C	C	.	.	H	α-helix	trans	-63.5	-38.6	178.6	172.4	0	0	0	0	111.9	F170 D171 K172 E181 Q184 K878	F170-V174 HydrophobicContact CD1-CG2 4.4Å; F170-V174 HydrophobicContact CD2-CG2 4.45Å; F170-V174 HydrophobicContact CE1-CG2 3.98Å; F170-V174 HydrophobicContact CE2-CG2 4.03Å; F170-V174 HydrophobicContact CZ-CG2 3.78Å; F170-V174 WeakPolarHBondContact O-CG2 3.24Å; F170-V174 PolarHBondContact O-N 3.24Å; D171-V174 PolarHBondContact O-N 3.03Å; K172-V174 PolarHBondContact O-N 3.33Å; V174-E181 HydrophobicContact CG1-CB 4.43Å; V174-E181 HydrophobicContact CG1-CG 3.73Å; V174-Q184 VanDerWaalsContact CA-OE1 3.31Å; V174-Q184 PolarHBondContact O-NE2 3.32Å; V174-K878 WeakPolarHBondContact O-CE 3.39Å; V174-K878 PolarHBondContact O-NZ 2.87Å
175	Q	87.4	Confident	87.6	Confident	31 Å²	31	50 Å²	50	15%	0.145	24%	0.239	C	C	.	.	H	α-helix	trans	-60.8	-44.9	176.4	-73.7	163.5	4.4	0	0	111.2	F166 D171 K172 R173 R877 K878 Y881	F166-Q175 PolarHBondContact O-NE2 2.89Å; D171-Q175 WeakPolarHBondContact O-CB 2.97Å; D171-Q175 WeakPolarHBondContact O-CG 3.14Å; D171-Q175 PolarHBondContact O-N 2.85Å; K172-Q175 PolarHBondContact O-N 3.05Å; R173-Q175 VanDerWaalsContact C-N 3.32Å; R173-Q175 PolarHBondContact O-N 2.86Å; Q175-R877 HydrophobicContact CG-CB 4.01Å; Q175-K878 PolarHBondContact O-NZ 2.74Å; Q175-Y881 HydrophobicContact CB-CG 4.26Å; Q175-Y881 HydrophobicContact CG-CG 4.39Å
176	L	86.7	Confident	88	Confident	72 Å²	72	47.7 Å²	47.7	38%	0.377	22%	0.22	S	C	.	.	H	α-helix	trans	-84.1	-31.7	-173.9	-62.3	173.7	0	0	0	114.7	Y108 K172 R173 D178	Y108-L176 HydrophobicContact CE1-CD2 4.42Å; Y108-L176 PolarHBondContact OH-O 3.33Å; K172-L176 WeakPolarHBondContact O-CG 3.36Å; K172-L176 PolarHBondContact O-N 3.31Å; R173-L176 PolarHBondContact O-N 2.94Å; L176-D178 PolarHBondContact O-N 2.85Å
177	E	90	Very high	88.1	Confident	85 Å²	85	49.9 Å²	49.9	40%	0.397	24%	0.24	S	C	.	.	S	Bend	trans	-63.4	129.8	-176.1	-172.8	173.3	176.5	0	0	112.3	R173 R179 Q184 K878	R173-E177 WeakPolarHBondContact O-CB 3.49Å; R173-E177 PolarHBondContact O-N 2.91Å; E177-R179 HydrophobicContact CG-CB 4.43Å; E177-R179 HydrophobicContact CG-CG 4.07Å; E177-R179 PolarHBondContact O-N 3.17Å; E177-R179 WeakPolarHBondContact OE1-CD 3.42Å; E177-R179 IonicContact OE1-NH1 3.76Å; E177-Q184 PolarHBondContact OE2-OE1 3.32Å; E177-K878 PolarHBondContact O-NZ 3.03Å
178	D	90.7	Very high	88.4	Confident	24 Å²	24	48.4 Å²	48.4	13%	0.128	23%	0.234	C	C	.	.	S	Bend	trans	-75	61	-179.7	-173.3	26.7	0	0	0	112.7	L176 A906 P907 K908 V909	L176-D178 PolarHBondContact O-N 2.85Å; D178-A906 HydrophobicContact CB-CB 3.49Å; D178-A906 VanDerWaalsContact CB-CB 3.49Å; D178-A906 WeakPolarHBondContact OD1-CB 3.15Å; D178-P907 WeakPolarHBondContact OD2-CD 3.44Å; D178-K908 WeakPolarHBondContact OD1-CB 3.49Å; D178-K908 PolarHBondContact OD1-N 3.48Å; D178-K908 WeakPolarHBondContact OD2-CG 3.32Å; D178-K908 PolarHBondContact OD2-N 2.83Å; D178-V909 PolarHBondContact OD1-N 3.39Å
179	R	91.7	Very high	88.6	Confident	43 Å²	43	50.9 Å²	50.9	16%	0.162	25%	0.25	C	C	.	.	S	Bend	trans	-145.6	145.2	176.8	-60.2	-179.6	74	-164.4	-0.9	109	E177 E181 Q184 V190 E254 K878	E177-R179 HydrophobicContact CG-CB 4.43Å; E177-R179 HydrophobicContact CG-CG 4.07Å; E177-R179 PolarHBondContact O-N 3.17Å; E177-R179 WeakPolarHBondContact OE1-CD 3.42Å; E177-R179 IonicContact OE1-NH1 3.76Å; R179-E181 PolarHBondContact O-N 3.47Å; R179-Q184 HydrophobicContact CB-CG 4.03Å; R179-Q184 PolarHBondContact O-NE2 3.27Å; R179-V190 PolarHBondContact NH2-O 3.44Å; R179-E254 IonicContact CZ-OE1 3.22Å; R179-E254 IonicContact NE-OE1 2.63Å; R179-E254 PolarHBondContact NE-OE1 3.4Å; R179-E254 IonicContact NH2-OE1 2.76Å; R179-E254 PolarHBondContact NH2-OE1 3.38Å; R179-E254 VanDerWaalsContact NH2-OE1 3.11Å; R179-K878 WeakPolarHBondContact O-CE 3.36Å
180	P	94.4	Very high	88.9	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	22%	0.222	C	C	.	.			trans	-54.9	131.4	175.5	-25	33.9	0	0	0	112.1	R182 F183 Q184 E254 E256 G873	P180-R182 PolarHBondContact O-N 3.1Å; P180-F183 HydrophobicContact CB-CD2 4.25Å; P180-F183 HydrophobicContact CB-CG 4.25Å; P180-F183 HydrophobicContact CG-CD2 3.99Å; P180-F183 HydrophobicContact CG-CE2 4.28Å; P180-F183 HydrophobicContact CG-CG 4.49Å; P180-F183 WeakPolarHBondContact O-CB 3.18Å; P180-F183 PolarHBondContact O-N 3.28Å; P180-Q184 PolarHBondContact O-N 3Å; P180-E254 WeakPolarHBondContact CG-O 3.15Å; P180-E256 HydrophobicContact CB-CG 3.62Å; P180-E256 VanDerWaalsContact CB-OE1 3.32Å; P180-E256 WeakPolarHBondContact CB-OE1 3.29Å; P180-E256 HydrophobicContact CG-CG 3.89Å; P180-G873 WeakPolarHBondContact CA-O 3.36Å
181	E	93.7	Very high	89	Confident	3 Å²	3	44 Å²	44	1%	0.014	22%	0.221	C	C	.	.	H	α-helix	trans	-56.4	-39.5	-174	177.7	170.4	163.3	0	0	111.8	V174 R179 F183 Q184 Q185 G873 G875 P876 R877 K878	V174-E181 HydrophobicContact CG1-CB 4.43Å; V174-E181 HydrophobicContact CG1-CG 3.73Å; R179-E181 PolarHBondContact O-N 3.47Å; E181-F183 VanDerWaalsContact C-N 3.27Å; E181-F183 PolarHBondContact O-N 2.91Å; E181-Q184 WeakPolarHBondContact O-CB 3.39Å; E181-Q184 PolarHBondContact O-N 3.44Å; E181-Q185 HydrophobicContact CG-CG 4.21Å; E181-Q185 WeakPolarHBondContact O-CG 3.31Å; E181-Q185 PolarHBondContact O-N 2.81Å; E181-G873 PolarHBondContact N-O 2.73Å; E181-G875 VanDerWaalsContact CD-CA 3.4Å; E181-G875 WeakPolarHBondContact OE2-CA 3.37Å; E181-G875 PolarHBondContact OE2-N 3.09Å; E181-P876 WeakPolarHBondContact OE1-CD 2.89Å; E181-P876 WeakPolarHBondContact OE1-CG 3.46Å; E181-R877 VanDerWaalsContact OE1-CB 3.31Å; E181-R877 WeakPolarHBondContact OE1-CB 3.38Å; E181-R877 WeakPolarHBondContact OE1-CG 3.44Å; E181-R877 PolarHBondContact OE1-N 3.21Å; E181-R877 PolarHBondContact OE2-N 2.56Å; E181-R877 VanDerWaalsContact OE2-N 3.16Å; E181-K878 HydrophobicContact CB-CD 3.97Å; E181-K878 HydrophobicContact CB-CG 4.26Å; E181-K878 WeakPolarHBondContact OE2-CB 3.16Å; E181-K878 PolarHBondContact OE2-N 3.21Å
182	R	92.6	Very high	89.3	Confident	36 Å²	36	49 Å²	49	14%	0.136	25%	0.254	C	S	.	.	H	α-helix	trans	-62.7	-29.4	178.3	-75.3	179.4	-73.2	-87.1	-12.4	113.8	P180 E256 Y281 Q869 V871 C872 L874	P180-R182 PolarHBondContact O-N 3.1Å; R182-E256 IonicContact CZ-OE1 2.86Å; R182-E256 IonicContact CZ-OE2 3.11Å; R182-E256 IonicContact NE-OE1 2.91Å; R182-E256 PolarHBondContact NE-OE1 3.15Å; R182-E256 IonicContact NE-OE2 3.87Å; R182-E256 PolarHBondContact NE-OE2 2.86Å; R182-E256 VanDerWaalsContact NH2-CD 3.33Å; R182-E256 IonicContact NH2-OE1 2.93Å; R182-E256 PolarHBondContact NH2-OE1 3.27Å; R182-E256 IonicContact NH2-OE2 2.66Å; R182-E256 PolarHBondContact NH2-OE2 3.32Å; R182-Y281 PolarHBondContact O-OH 2.89Å; R182-Q869 PolarHBondContact NH1-O 3.22Å; R182-V871 PolarHBondContact NH1-O 3.18Å; R182-V871 PolarHBondContact NH2-O 3.49Å; R182-C872 VanDerWaalsContact NH2-CA 3.28Å; R182-L874 PolarHBondContact NH1-O 3.17Å; R182-L874 PolarHBondContact NH2-O 2.65Å
183	F	93.7	Very high	89.6	Confident	1 Å²	1	45.6 Å²	45.6	0%	0.004	24%	0.242	C	C	.	.	H	α-helix	trans	-74.7	-30.3	174.8	-71.1	-0.8	0	0	0	112	P180 E181 V190 M250 E254 F255 E256 Y281	P180-F183 HydrophobicContact CB-CD2 4.25Å; P180-F183 HydrophobicContact CB-CG 4.25Å; P180-F183 HydrophobicContact CG-CD2 3.99Å; P180-F183 HydrophobicContact CG-CE2 4.28Å; P180-F183 HydrophobicContact CG-CG 4.49Å; P180-F183 WeakPolarHBondContact O-CB 3.18Å; P180-F183 PolarHBondContact O-N 3.28Å; E181-F183 VanDerWaalsContact C-N 3.27Å; E181-F183 PolarHBondContact O-N 2.91Å; F183-V190 HydrophobicContact CB-CB 4.46Å; F183-V190 HydrophobicContact CB-CG2 3.91Å; F183-V190 HydrophobicContact CD1-CG2 4.13Å; F183-V190 HydrophobicContact CD2-CB 4.4Å; F183-V190 HydrophobicContact CD2-CG2 4.02Å; F183-V190 HydrophobicContact CG-CG2 3.77Å; F183-M250 HydrophobicContact CZ-CB 4.5Å; F183-E254 HydrophobicContact CD2-CB 4.44Å; F183-E254 HydrophobicContact CE2-CB 4.32Å; F183-F255 WeakPolarHBondContact CZ-O 3.1Å; F183-E256 HydrophobicContact CD1-CG 4.39Å; F183-E256 HydrophobicContact CE1-CG 3.86Å; F183-E256 HydrophobicContact CE2-CG 4.35Å; F183-E256 HydrophobicContact CZ-CB 4.41Å; F183-E256 HydrophobicContact CZ-CG 3.86Å; F183-Y281 AromaticContact CD1-CE2 3.62Å; F183-Y281 HydrophobicContact CD1-CE2 3.62Å; F183-Y281 HydrophobicContact CE1-CD2 4Å; F183-Y281 AromaticContact CE1-CE2 3.41Å; F183-Y281 HydrophobicContact CE1-CE2 3.41Å; F183-Y281 VanDerWaalsContact CE1-CE2 3.41Å; F183-Y281 HydrophobicContact CZ-CE2 4.5Å
184	Q	90.7	Very high	89.9	Confident	25 Å²	25	41.7 Å²	41.7	12%	0.117	24%	0.237	C	C	.	.	H	α-helix	trans	-75.4	-31.6	176.3	-55.6	-179.1	38.8	0	0	112.4	V174 E177 R179 P180 E181 R186	V174-Q184 VanDerWaalsContact CA-OE1 3.31Å; V174-Q184 PolarHBondContact O-NE2 3.32Å; E177-Q184 PolarHBondContact OE2-OE1 3.32Å; R179-Q184 HydrophobicContact CB-CG 4.03Å; R179-Q184 PolarHBondContact O-NE2 3.27Å; P180-Q184 PolarHBondContact O-N 3Å; E181-Q184 WeakPolarHBondContact O-CB 3.39Å; E181-Q184 PolarHBondContact O-N 3.44Å; Q184-R186 VanDerWaalsContact C-N 3.28Å; Q184-R186 PolarHBondContact O-N 3.03Å
185	Q	86	Confident	90	Very high	92 Å²	92	46.3 Å²	46.3	43%	0.43	26%	0.261	S	S	.	.	S	Bend	trans	-79.1	-4.7	179.4	-64.5	-60.5	-46.5	0	0	114.1	E181	E181-Q185 HydrophobicContact CG-CG 4.21Å; E181-Q185 WeakPolarHBondContact O-CG 3.31Å; E181-Q185 PolarHBondContact O-N 2.81Å
186	R	88.3	Confident	90.2	Very high	20 Å²	20	52.5 Å²	52.5	8%	0.075	29%	0.29	C	S	.	.	S	Bend	trans	-66.4	149.8	176.8	-74.6	172.6	61	155.5	-16.7	111.6	Q184 V188 Y281 D284	Q184-R186 VanDerWaalsContact C-N 3.28Å; Q184-R186 PolarHBondContact O-N 3.03Å; R186-V188 WeakPolarHBondContact CB-O 3.49Å; R186-V188 PolarHBondContact NE-O 2.85Å; R186-V188 VanDerWaalsContact NE-O 3.14Å; R186-V188 PolarHBondContact O-N 2.74Å; R186-Y281 WeakPolarHBondContact CD-OH 3.38Å; R186-Y281 WeakPolarHBondContact CG-OH 3.44Å; R186-Y281 VanDerWaalsContact NH1-CE2 3.28Å; R186-D284 IonicContact CZ-OD2 3.77Å; R186-D284 IonicContact NH1-OD2 3.32Å; R186-D284 PolarHBondContact NH1-OD2 2.97Å; R186-D284 IonicContact NH2-OD2 2.72Å; R186-D284 PolarHBondContact NH2-OD2 3.49Å
187	S	83.7	Confident	90.6	Very high	87 Å²	87	50.6 Å²	50.6	61%	0.608	28%	0.279	S	S	*	.	S	Bend	trans	-64.3	-34.9	175.2	71.2	0	0	0	0	111.8	E285 Q289	S187-E285 WeakPolarHBondContact CB-OE1 3.34Å; S187-E285 PolarHBondContact N-OE1 2.87Å; S187-E285 PolarHBondContact OG-OE1 2.9Å; S187-Q289 PolarHBondContact OG-NE2 3.02Å
188	V	87.1	Confident	90.8	Very high	41 Å²	41	46.5 Å²	46.5	25%	0.248	26%	0.26	C	S	.	.	S	Bend	trans	-116.1	112.2	169.5	-177.8	0	0	0	0	108.1	R186 E285 C288 Q289	R186-V188 WeakPolarHBondContact CB-O 3.49Å; R186-V188 PolarHBondContact NE-O 2.85Å; R186-V188 VanDerWaalsContact NE-O 3.14Å; R186-V188 PolarHBondContact O-N 2.74Å; V188-E285 HydrophobicContact CB-CG 4.24Å; V188-E285 PolarHBondContact N-OE1 3.16Å; V188-C288 HydrophobicContact CG1-CB 3.84Å; V188-Q289 HydrophobicContact CG2-CG 3.47Å; V188-Q289 VanDerWaalsContact CG2-CG 3.47Å
189	P	85.3	Confident	90.9	Very high	70 Å²	70	47.6 Å²	47.6	46%	0.455	27%	0.266	S	S	.	.			trans	-56.6	143.3	178.7	-25.4	34	0	0	0	111.6	S191	P189-S191 PolarHBondContact O-N 2.79Å
190	V	89.4	Confident	90.9	Very high	5 Å²	5	47.9 Å²	47.9	3%	0.03	28%	0.277	C	S	.	.			trans	-62.3	133.2	171.4	-178.5	0	0	0	0	108.6	R179 F183 R251	R179-V190 PolarHBondContact NH2-O 3.44Å; F183-V190 HydrophobicContact CB-CB 4.46Å; F183-V190 HydrophobicContact CB-CG2 3.91Å; F183-V190 HydrophobicContact CD1-CG2 4.13Å; F183-V190 HydrophobicContact CD2-CB 4.4Å; F183-V190 HydrophobicContact CD2-CG2 4.02Å; F183-V190 HydrophobicContact CG-CG2 3.77Å; V190-R251 HydrophobicContact CG1-CB 4.44Å; V190-R251 HydrophobicContact CG1-CG 4.26Å
191	S	88.1	Confident	90.9	Very high	54 Å²	54	47.9 Å²	47.9	38%	0.378	28%	0.277	S	S	.	.			trans	-133	147.7	177.9	61.9	0	0	0	0	110.4	P189 R251	P189-S191 PolarHBondContact O-N 2.79Å; S191-R251 PolarHBondContact O-NE 3.08Å; S191-R251 PolarHBondContact O-NH2 3.28Å; S191-R251 VanDerWaalsContact O-NH2 3.14Å; S191-R251 PolarHBondContact OG-NH2 2.75Å
192	P	91.9	Very high	90.9	Very high	106 Å²	106	48 Å²	48	69%	0.688	28%	0.278	S	S	*	.			trans	-62.6	147.7	178.4	26.9	-34.7	0	0	0	110.9	R251 N252	P192-R251 WeakPolarHBondContact CA-O 3.36Å; P192-N252 WeakPolarHBondContact CA-OD1 3.47Å
193	A	92.3	Very high	90.8	Very high	13 Å²	13	54.3 Å²	54.3	11%	0.107	30%	0.302	C	S	.	.			trans	-135.3	148.6	-176.8	0	0	0	0	0	112.7	E197 L198 N252	A193-E197 HydrophobicContact CB-CB 4.24Å; A193-E197 HydrophobicContact CB-CG 3.94Å; A193-L198 HydrophobicContact CB-CD2 3.62Å; A193-L198 HydrophobicContact CB-CG 3.97Å; A193-N252 PolarHBondContact N-OD1 3.3Å; A193-N252 PolarHBondContact O-ND2 3.26Å; A193-N252 VanDerWaalsContact O-ND2 3.09Å; A193-N252 PolarHBondContact O-OD1 3.39Å
194	S	94.4	Very high	90.8	Very high	64 Å²	64	55 Å²	55	45%	0.448	31%	0.305	S	S	.	.			trans	-68.5	156.1	172	74.1	0	0	0	0	110.9	E196 E197 L198	S194-E196 PolarHBondContact O-N 3.13Å; S194-E197 WeakPolarHBondContact O-CB 3.31Å; S194-E197 PolarHBondContact O-N 2.81Å; S194-E197 VanDerWaalsContact O-N 3.15Å; S194-E197 WeakPolarHBondContact OG-CB 3.47Å; S194-E197 PolarHBondContact OG-N 3.5Å; S194-L198 WeakPolarHBondContact O-CG 3.31Å; S194-L198 PolarHBondContact O-N 3.01Å
195	N	91.3	Very high	90.8	Very high	100 Å²	100	53.8 Å²	53.8	54%	0.535	30%	0.299	S	S	.	.	H	α-helix	trans	-61.1	-34.6	179	-172.2	48	0	0	0	112.6	E197 L198 I199	N195-E197 VanDerWaalsContact C-N 3.34Å; N195-E197 PolarHBondContact O-N 2.78Å; N195-L198 PolarHBondContact O-N 3.36Å; N195-I199 WeakPolarHBondContact O-CB 3.4Å; N195-I199 WeakPolarHBondContact O-CD1 3.39Å; N195-I199 WeakPolarHBondContact O-CG1 3.4Å; N195-I199 PolarHBondContact O-N 2.92Å
196	E	93.1	Very high	90.9	Very high	161 Å²	161	51.5 Å²	51.5	75%	0.752	29%	0.287	S	S	*	.	H	α-helix	trans	-63.3	-41.5	176.5	-65.8	176.2	-176.5	0	0	111.9	S194 I199 A200	S194-E196 PolarHBondContact O-N 3.13Å; E196-I199 PolarHBondContact O-N 3.03Å; E196-A200 PolarHBondContact O-N 3.39Å; E196-A200 VanDerWaalsContact O-N 3.09Å
197	E	93.6	Very high	90.8	Very high	32 Å²	32	55.9 Å²	55.9	15%	0.15	31%	0.308	C	S	.	.	H	α-helix	trans	-62.3	-50.3	174.6	175	171.2	161.7	0	0	111.1	A193 S194 N195 I199 A200 E201 R251 W287 K291	A193-E197 HydrophobicContact CB-CB 4.24Å; A193-E197 HydrophobicContact CB-CG 3.94Å; S194-E197 WeakPolarHBondContact O-CB 3.31Å; S194-E197 PolarHBondContact O-N 2.81Å; S194-E197 VanDerWaalsContact O-N 3.15Å; S194-E197 WeakPolarHBondContact OG-CB 3.47Å; S194-E197 PolarHBondContact OG-N 3.5Å; N195-E197 VanDerWaalsContact C-N 3.34Å; N195-E197 PolarHBondContact O-N 2.78Å; E197-I199 VanDerWaalsContact C-N 3.27Å; E197-I199 PolarHBondContact O-N 2.86Å; E197-A200 WeakPolarHBondContact O-CB 3.46Å; E197-A200 PolarHBondContact O-N 3.21Å; E197-A200 VanDerWaalsContact O-N 3.09Å; E197-E201 WeakPolarHBondContact O-CB 3.48Å; E197-E201 PolarHBondContact O-N 3.32Å; E197-R251 IonicContact OE1-CZ 3.51Å; E197-R251 IonicContact OE1-NH1 3.87Å; E197-R251 PolarHBondContact OE1-NH1 2.88Å; E197-R251 IonicContact OE1-NH2 3.96Å; E197-R251 PolarHBondContact OE1-NH2 2.86Å; E197-W287 VanDerWaalsContact CD-CH2 3.43Å; E197-W287 HydrophobicContact CG-CH2 3.25Å; E197-W287 HydrophobicContact CG-CZ2 3.79Å; E197-W287 HydrophobicContact CG-CZ3 4.11Å; E197-W287 WeakPolarHBondContact OE1-CH2 3.48Å; E197-W287 VanDerWaalsContact OE1-CZ3 3.24Å; E197-W287 WeakPolarHBondContact OE1-CZ3 3.26Å; E197-K291 IonicContact OE1-NZ 2.75Å; E197-K291 PolarHBondContact OE1-NZ 2.78Å; E197-K291 IonicContact OE2-NZ 3.5Å; E197-K291 PolarHBondContact OE2-NZ 3.49Å
198	L	94	Very high	90.9	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-60.7	-35.8	179	-64.1	-176	0	0	0	112.3	A193 S194 N195 A202 L244 L247 N248 R251	A193-L198 HydrophobicContact CB-CD2 3.62Å; A193-L198 HydrophobicContact CB-CG 3.97Å; S194-L198 WeakPolarHBondContact O-CG 3.31Å; S194-L198 PolarHBondContact O-N 3.01Å; N195-L198 PolarHBondContact O-N 3.36Å; L198-A202 WeakPolarHBondContact O-CB 3.35Å; L198-A202 PolarHBondContact O-N 2.82Å; L198-L244 HydrophobicContact CB-CD1 3.54Å; L198-L247 HydrophobicContact CD2-CB 4.04Å; L198-N248 HydrophobicContact CD1-CB 3.98Å; L198-R251 HydrophobicContact CD2-CB 4.38Å; L198-R251 HydrophobicContact CD2-CG 4.45Å
199	I	93.9	Very high	90.6	Very high	47 Å²	47	53.5 Å²	53.5	24%	0.241	29%	0.287	C	S	.	.	H	α-helix	trans	-66	-43.5	174.9	-71.3	164.2	0	0	0	111	N195 E196 E197 R203 L244	N195-I199 WeakPolarHBondContact O-CB 3.4Å; N195-I199 WeakPolarHBondContact O-CD1 3.39Å; N195-I199 WeakPolarHBondContact O-CG1 3.4Å; N195-I199 PolarHBondContact O-N 2.92Å; E196-I199 PolarHBondContact O-N 3.03Å; E197-I199 VanDerWaalsContact C-N 3.27Å; E197-I199 PolarHBondContact O-N 2.86Å; I199-R203 VanDerWaalsContact CG2-CZ 3.42Å; I199-R203 VanDerWaalsContact O-CG 3.31Å; I199-R203 WeakPolarHBondContact O-CG 3.27Å; I199-R203 PolarHBondContact O-N 3.08Å; I199-R203 VanDerWaalsContact O-N 3.12Å; I199-L244 HydrophobicContact CG1-CD1 4.03Å; I199-L244 HydrophobicContact CG1-CD2 3.94Å
200	A	91.9	Very high	90.4	Very high	49 Å²	49	53.5 Å²	53.5	41%	0.405	28%	0.28	S	S	.	.	H	α-helix	trans	-65.2	-42.6	177.4	0	0	0	0	0	111.3	E196 E197 R203 W204	E196-A200 PolarHBondContact O-N 3.39Å; E196-A200 VanDerWaalsContact O-N 3.09Å; E197-A200 WeakPolarHBondContact O-CB 3.46Å; E197-A200 PolarHBondContact O-N 3.21Å; E197-A200 VanDerWaalsContact O-N 3.09Å; A200-R203 PolarHBondContact O-N 2.9Å; A200-W204 PolarHBondContact O-N 2.99Å
201	E	94.1	Very high	89.5	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-61.4	-50.9	174.6	-176.3	178.1	170.8	0	0	111.6	E197 R203 W204 I205 L247 R251 D284 W287	E197-E201 WeakPolarHBondContact O-CB 3.48Å; E197-E201 PolarHBondContact O-N 3.32Å; E201-R203 VanDerWaalsContact C-N 3.28Å; E201-R203 PolarHBondContact O-N 3.02Å; E201-W204 CarbonylContact O-C 3.59Å; E201-W204 WeakPolarHBondContact O-CA 3.46Å; E201-W204 WeakPolarHBondContact O-CB 3.48Å; E201-W204 PolarHBondContact O-N 3.36Å; E201-I205 HydrophobicContact CG-CD1 3.93Å; E201-I205 HydrophobicContact CG-CG1 4.22Å; E201-I205 WeakPolarHBondContact O-CG1 3.12Å; E201-I205 PolarHBondContact O-N 3.38Å; E201-L247 HydrophobicContact CB-CD1 3.97Å; E201-L247 HydrophobicContact CG-CD1 3.63Å; E201-L247 HydrophobicContact CG-CD2 4.43Å; E201-L247 WeakPolarHBondContact OE1-CD2 3.45Å; E201-R251 IonicContact OE2-CZ 3.42Å; E201-R251 IonicContact OE2-NH1 2.83Å; E201-R251 PolarHBondContact OE2-NH1 2.85Å; E201-D284 WeakPolarHBondContact OE1-CA 3.25Å; E201-D284 WeakPolarHBondContact OE1-CB 3.48Å; E201-W287 HydrophobicContact CB-CD2 3.85Å; E201-W287 HydrophobicContact CB-CE3 4.37Å; E201-W287 HydrophobicContact CB-CG 4.18Å; E201-W287 HydrophobicContact CB-CZ2 4.11Å; E201-W287 HydrophobicContact CG-CB 4.16Å; E201-W287 HydrophobicContact CG-CD2 3.56Å; E201-W287 HydrophobicContact CG-CE3 3.98Å; E201-W287 HydrophobicContact CG-CG 3.61Å
202	A	93.3	Very high	88.4	Confident	4 Å²	4	55.8 Å²	55.8	3%	0.033	30%	0.297	C	S	.	.	H	α-helix	trans	-56.9	-42	179	0	0	0	0	0	112	L198 I205 Y206 V243 L244 L247	L198-A202 WeakPolarHBondContact O-CB 3.35Å; L198-A202 PolarHBondContact O-N 2.82Å; A202-I205 PolarHBondContact O-N 3.28Å; A202-Y206 VanDerWaalsContact O-CB 3.26Å; A202-Y206 WeakPolarHBondContact O-CB 3.35Å; A202-Y206 PolarHBondContact O-N 2.8Å; A202-V243 HydrophobicContact CB-CB 4.37Å; A202-V243 HydrophobicContact CB-CG1 4Å; A202-L244 HydrophobicContact CB-CB 4.08Å; A202-L247 HydrophobicContact CB-CD1 4.01Å
203	R	91.6	Very high	87.3	Confident	170 Å²	170	57.5 Å²	57.5	64%	0.642	30%	0.301	S	S	*	.	H	α-helix	trans	-63.1	-41.9	174.4	-73	172.8	-177	152.9	2.1	111.9	I199 A200 E201 H207	I199-R203 VanDerWaalsContact CG2-CZ 3.42Å; I199-R203 VanDerWaalsContact O-CG 3.31Å; I199-R203 WeakPolarHBondContact O-CG 3.27Å; I199-R203 PolarHBondContact O-N 3.08Å; I199-R203 VanDerWaalsContact O-N 3.12Å; A200-R203 PolarHBondContact O-N 2.9Å; E201-R203 VanDerWaalsContact C-N 3.28Å; E201-R203 PolarHBondContact O-N 3.02Å; R203-H207 PolarHBondContact O-N 3.28Å
204	W	92	Very high	86.8	Confident	15 Å²	15	60.1 Å²	60.1	6%	0.057	32%	0.317	C	S	.	.	H	α-helix	trans	-65.6	-46.6	177.7	-177.6	88.4	0	0	0	111.8	A200 E201 Y206 H207 N208 R283 K286 W287 L290 Q339	A200-W204 PolarHBondContact O-N 2.99Å; E201-W204 CarbonylContact O-C 3.59Å; E201-W204 WeakPolarHBondContact O-CA 3.46Å; E201-W204 WeakPolarHBondContact O-CB 3.48Å; E201-W204 PolarHBondContact O-N 3.36Å; W204-Y206 VanDerWaalsContact C-N 3.34Å; W204-Y206 PolarHBondContact O-N 2.76Å; W204-H207 PolarHBondContact O-N 3.43Å; W204-N208 PolarHBondContact NE1-ND2 3.46Å; W204-N208 VanDerWaalsContact NE1-ND2 3.18Å; W204-N208 WeakPolarHBondContact O-CB 3.47Å; W204-N208 PolarHBondContact O-N 2.84Å; W204-N208 PolarHBondContact O-ND2 3.34Å; W204-R283 HydrophobicContact CZ3-CB 4.23Å; W204-R283 WeakPolarHBondContact CZ3-O 3.26Å; W204-K286 HydrophobicContact CH2-CB 4.07Å; W204-W287 AromaticContact CD2-CD1 3.89Å; W204-W287 HydrophobicContact CE3-CB 3.84Å; W204-W287 AromaticContact CE3-CD1 3.9Å; W204-W287 HydrophobicContact CE3-CG 4.26Å; W204-W287 AromaticContact CG-CD1 3.94Å; W204-W287 HydrophobicContact CZ3-CB 3.86Å; W204-L290 HydrophobicContact CZ2-CD2 4.26Å; W204-Q339 PolarHBondContact NE1-O 3.17Å
205	I	91.6	Very high	86.5	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-61.2	-46.3	176.8	-65.2	-174.6	0	0	0	109.7	E201 A202 H207 N208 L209 V243 L247 I280 R283	E201-I205 HydrophobicContact CG-CD1 3.93Å; E201-I205 HydrophobicContact CG-CG1 4.22Å; E201-I205 WeakPolarHBondContact O-CG1 3.12Å; E201-I205 PolarHBondContact O-N 3.38Å; A202-I205 PolarHBondContact O-N 3.28Å; I205-H207 VanDerWaalsContact C-N 3.3Å; I205-H207 PolarHBondContact O-N 2.79Å; I205-N208 PolarHBondContact O-N 3.36Å; I205-L209 HydrophobicContact CG2-CB 4.45Å; I205-L209 HydrophobicContact CG2-CD2 4.41Å; I205-L209 WeakPolarHBondContact O-CB 3.45Å; I205-L209 PolarHBondContact O-N 2.79Å; I205-V243 HydrophobicContact CB-CG1 4.18Å; I205-V243 HydrophobicContact CG2-CG1 4.06Å; I205-L247 HydrophobicContact CD1-CD1 4.1Å; I205-L247 HydrophobicContact CD1-CD2 3.86Å; I205-L247 HydrophobicContact CD1-CG 4.4Å; I205-I280 HydrophobicContact CD1-CG2 4.13Å; I205-I280 HydrophobicContact CG2-CG1 4.17Å; I205-R283 HydrophobicContact CB-CB 4.43Å; I205-R283 HydrophobicContact CD1-CB 3.94Å; I205-R283 HydrophobicContact CG1-CB 3.83Å; I205-R283 HydrophobicContact CG2-CB 4Å; I205-R283 HydrophobicContact CG2-CG 4.43Å
206	Y	88.6	Confident	86.3	Confident	44 Å²	44	54.4 Å²	54.4	17%	0.173	28%	0.283	C	S	.	.	H	α-helix	trans	-55.1	-48.5	177.2	174	-94.8	0	0	0	111.6	A202 W204 F210 A211 V236 I239	A202-Y206 VanDerWaalsContact O-CB 3.26Å; A202-Y206 WeakPolarHBondContact O-CB 3.35Å; A202-Y206 PolarHBondContact O-N 2.8Å; W204-Y206 VanDerWaalsContact C-N 3.34Å; W204-Y206 PolarHBondContact O-N 2.76Å; Y206-F210 HydrophobicContact CD2-CB 4.19Å; Y206-F210 AromaticContact CD2-CD2 3.92Å; Y206-F210 HydrophobicContact CD2-CD2 3.92Å; Y206-F210 HydrophobicContact CD2-CG 4.43Å; Y206-F210 HydrophobicContact CE2-CB 3.99Å; Y206-F210 HydrophobicContact CE2-CD2 4.42Å; Y206-F210 PolarHBondContact O-N 3.44Å; Y206-A211 HydrophobicContact CE1-CB 4.31Å; Y206-A211 PolarHBondContact O-N 2.82Å; Y206-V236 HydrophobicContact CE1-CG1 3.74Å; Y206-V236 HydrophobicContact CE2-CG1 4.2Å; Y206-V236 WeakPolarHBondContact OH-CG1 3.42Å; Y206-V236 WeakPolarHBondContact OH-CG2 3.41Å; Y206-I239 HydrophobicContact CD2-CB 4.38Å; Y206-I239 HydrophobicContact CD2-CG2 3.8Å; Y206-I239 HydrophobicContact CE2-CB 4.29Å; Y206-I239 HydrophobicContact CE2-CG2 4.05Å
207	H	85.4	Confident	86	Confident	112 Å²	112	52.2 Å²	52.2	52%	0.519	27%	0.267	S	S	.	.	I	π-helix	trans	-63.5	-45.2	179.2	-170.9	74.2	0	0	0	112	R203 W204 I205 A211 C212	R203-H207 PolarHBondContact O-N 3.28Å; W204-H207 PolarHBondContact O-N 3.43Å; I205-H207 VanDerWaalsContact C-N 3.3Å; I205-H207 PolarHBondContact O-N 2.79Å; H207-A211 CarbonylContact O-C 3.25Å; H207-A211 WeakPolarHBondContact O-CB 3.37Å; H207-A211 PolarHBondContact O-N 3.25Å; H207-C212 VanDerWaalsContact O-CB 3.24Å; H207-C212 WeakPolarHBondContact O-CB 3.45Å; H207-C212 PolarHBondContact O-N 2.86Å
208	N	85.1	Confident	85.3	Confident	38 Å²	38	52.2 Å²	52.2	20%	0.203	27%	0.267	C	S	.	.	I	π-helix	trans	-78.5	-24	-174.6	-78	-87.5	0	0	0	114.3	W204 I205	W204-N208 PolarHBondContact NE1-ND2 3.46Å; W204-N208 VanDerWaalsContact NE1-ND2 3.18Å; W204-N208 WeakPolarHBondContact O-CB 3.47Å; W204-N208 PolarHBondContact O-N 2.84Å; W204-N208 PolarHBondContact O-ND2 3.34Å; I205-N208 PolarHBondContact O-N 3.36Å
209	L	82.3	Confident	84	Confident	40 Å²	40	58.4 Å²	58.4	21%	0.209	30%	0.299	C	S	.	.	I	π-helix	trans	-99.2	-45.1	-177.5	-174.6	58.6	0	0	0	112.5	I205 N279 I280	I205-L209 HydrophobicContact CG2-CB 4.45Å; I205-L209 HydrophobicContact CG2-CD2 4.41Å; I205-L209 WeakPolarHBondContact O-CB 3.45Å; I205-L209 PolarHBondContact O-N 2.79Å; L209-N279 HydrophobicContact CD1-CB 3.81Å; L209-N279 HydrophobicContact CD2-CB 3.61Å; L209-N279 HydrophobicContact CG-CB 4.38Å; L209-I280 HydrophobicContact CD2-CG1 4.39Å
210	F	79.8	Confident	82	Confident	70 Å²	70	59.4 Å²	59.4	31%	0.307	31%	0.305	S	S	.	.	I	π-helix	trans	-107.9	-28.8	-171.3	-58.5	-75.3	0	0	0	113.9	Y206 I239 V243 L272 D276	Y206-F210 HydrophobicContact CD2-CB 4.19Å; Y206-F210 AromaticContact CD2-CD2 3.92Å; Y206-F210 HydrophobicContact CD2-CD2 3.92Å; Y206-F210 HydrophobicContact CD2-CG 4.43Å; Y206-F210 HydrophobicContact CE2-CB 3.99Å; Y206-F210 HydrophobicContact CE2-CD2 4.42Å; Y206-F210 PolarHBondContact O-N 3.44Å; F210-I239 HydrophobicContact CD2-CG2 3.91Å; F210-I239 HydrophobicContact CE2-CG2 3.78Å; F210-I239 HydrophobicContact CG-CG2 4.47Å; F210-I239 HydrophobicContact CZ-CG2 4.24Å; F210-V243 HydrophobicContact CE2-CG2 4.26Å; F210-L272 HydrophobicContact CZ-CD2 3.84Å; F210-D276 HydrophobicContact CZ-CB 4.43Å
211	A	70.6	Confident	79.6	Confident	39 Å²	39	62.7 Å²	62.7	32%	0.322	32%	0.32	S	S	.	.	I	π-helix	trans	-96.9	-29.2	-179.8	0	0	0	0	0	113.8	Y206 H207 N213	Y206-A211 HydrophobicContact CE1-CB 4.31Å; Y206-A211 PolarHBondContact O-N 2.82Å; H207-A211 CarbonylContact O-C 3.25Å; H207-A211 WeakPolarHBondContact O-CB 3.37Å; H207-A211 PolarHBondContact O-N 3.25Å; A211-N213 PolarHBondContact O-N 2.89Å
212	C	65.5	Low	76.9	Confident	67 Å²	67	67.1 Å²	67.1	45%	0.453	35%	0.351	S	S	.	.	P	Polyproline II helix	trans	-71.6	125.4	-176.3	-172	0	0	0	0	110.1	H207	H207-C212 VanDerWaalsContact O-CB 3.24Å; H207-C212 WeakPolarHBondContact O-CB 3.45Å; H207-C212 PolarHBondContact O-N 2.86Å
213	N	68.7	Low	74.2	Confident	142 Å²	142	77.4 Å²	77.4	76%	0.759	39%	0.389	S	S	*	.	P	Polyproline II helix	trans	-86.4	128.3	174.2	-66.3	-49.1	0	0	0	108.9	A211	A211-N213 PolarHBondContact O-N 2.89Å
214	C	82.4	Confident	71.4	Confident	68 Å²	68	72.7 Å²	72.7	46%	0.459	38%	0.382	S	S	.	.	P	Polyproline II helix	trans	-50.7	147.5	164.2	-59.6	0	0	0	0	110.4	S216 Q218 E607	C214-S216 WeakPolarHBondContact CB-O 3.23Å; C214-S216 PolarHBondContact O-N 3.08Å; C214-Q218 HydrophobicContact CB-CG 4.32Å; C214-E607 WeakPolarHBondContact CA-OE1 3.39Å; C214-E607 HydrophobicContact CB-CG 4.49Å
215	L	87.2	Confident	68.5	Low	37 Å²	37	79.1 Å²	79.1	19%	0.194	42%	0.417	C	S	.	.	S	Bend	trans	-61.2	-32.9	173.7	-61.7	-168.5	0	0	0	111.2	T486 I520 R521 I600 K603 L604 E607	L215-T486 HydrophobicContact CD2-CG2 3.45Å; L215-T486 VanDerWaalsContact CD2-CG2 3.45Å; L215-I520 HydrophobicContact CB-CD1 4.5Å; L215-R521 WeakPolarHBondContact O-CA 3.32Å; L215-R521 PolarHBondContact O-N 2.8Å; L215-I600 HydrophobicContact CD1-CG1 4.43Å; L215-K603 HydrophobicContact CD1-CB 3.62Å; L215-K603 HydrophobicContact CD1-CD 3.98Å; L215-K603 HydrophobicContact CD1-CG 4.42Å; L215-L604 HydrophobicContact CB-CD2 4.07Å; L215-E607 PolarHBondContact N-OE1 2.91Å; L215-E607 PolarHBondContact N-OE2 3.46Å
216	S	88.7	Confident	65.6	Low	8 Å²	8	85.3 Å²	85.3	6%	0.056	46%	0.457	C	S	.	.	S	Bend	trans	-114.1	171.4	177.1	68.9	0	0	0	0	112.3	C214 Q218 E607	C214-S216 WeakPolarHBondContact CB-O 3.23Å; C214-S216 PolarHBondContact O-N 3.08Å; S216-Q218 PolarHBondContact O-N 3.2Å; S216-Q218 PolarHBondContact OG-NE2 3.26Å; S216-E607 WeakPolarHBondContact CB-OE2 3.35Å; S216-E607 PolarHBondContact N-OE2 3.44Å; S216-E607 PolarHBondContact OG-OE2 3.05Å
217	R	85.2	Confident	62.9	Low	115 Å²	115	87.4 Å²	87.4	43%	0.434	47%	0.47	S	S	.	.	B	Isolated β-bridge	trans	-87.5	94	177.8	-77	175.6	-178.8	159.4	10.6	111.2	R521 E522 L523 R524 R525	R217-R521 WeakPolarHBondContact CG-O 3.45Å; R217-E522 IonicContact CZ-OE1 2.78Å; R217-E522 IonicContact CZ-OE2 2.72Å; R217-E522 IonicContact NH1-OE1 3.32Å; R217-E522 PolarHBondContact NH1-OE1 3.48Å; R217-E522 IonicContact NH1-OE2 3.03Å; R217-E522 PolarHBondContact NH1-OE2 2.8Å; R217-E522 IonicContact NH2-OE1 2.7Å; R217-E522 PolarHBondContact NH2-OE1 3.04Å; R217-E522 IonicContact NH2-OE2 2.7Å; R217-L523 PolarHBondContact N-O 2.84Å; R217-R524 HydrophobicContact CB-CG 4.26Å; R217-R524 WeakPolarHBondContact O-CA 3.33Å; R217-R525 PolarHBondContact O-N 2.85Å; R217-R525 VanDerWaalsContact O-N 3.13Å
218	Q	79.7	Confident	60.4	Low	31 Å²	31	84.7 Å²	84.7	15%	0.145	46%	0.464	C	S	.	.			trans	-93.5	-13.8	179.2	-64.6	-57.5	-27.5	0	0	114.7	C214 S216 D220 R525 E607 F611	C214-Q218 HydrophobicContact CB-CG 4.32Å; S216-Q218 PolarHBondContact O-N 3.2Å; S216-Q218 PolarHBondContact OG-NE2 3.26Å; Q218-D220 PolarHBondContact O-N 3.35Å; Q218-R525 PolarHBondContact NE2-O 2.68Å; Q218-R525 PolarHBondContact OE1-O 3.09Å; Q218-E607 HydrophobicContact CG-CB 4.02Å; Q218-E607 PolarHBondContact OE1-O 2.88Å; Q218-F611 VanDerWaalsContact OE1-CB 3.23Å
219	I	65.5	Low	58	Low	130 Å²	130	86.6 Å²	86.6	67%	0.667	49%	0.485	S	S	*	.			trans	-75.1	126.8	-176.7	-55.5	172.8	0	0	0	110.5	T221	I219-T221 PolarHBondContact O-N 2.78Å
220	D	52.2	Low	55.7	Low	68 Å²	68	89.7 Å²	89.7	36%	0.364	51%	0.505	S	S	.	.			trans	-80.6	99.5	166.1	-133.8	3.1	0	0	0	107.9	Q218 S222 R223 R525	Q218-D220 PolarHBondContact O-N 3.35Å; D220-S222 PolarHBondContact O-N 2.82Å; D220-R223 PolarHBondContact O-N 3.21Å; D220-R525 IonicContact OD1-CZ 2.83Å; D220-R525 VanDerWaalsContact OD1-CZ 3.26Å; D220-R525 IonicContact OD1-NE 3.35Å; D220-R525 PolarHBondContact OD1-NE 3.02Å; D220-R525 IonicContact OD1-NH2 3.32Å; D220-R525 PolarHBondContact OD1-NH2 3.44Å
221	T	42.2	Very low	54	Low	118 Å²	118	90.5 Å²	90.5	72%	0.724	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-6.2	-177.1	-7.8	0	0	0	0	113.4	I219 R223	I219-T221 PolarHBondContact O-N 2.78Å; T221-R223 VanDerWaalsContact C-N 3.31Å; T221-R223 PolarHBondContact O-N 2.95Å
222	S	38.1	Very low	52.8	Low	94 Å²	94	94.5 Å²	94.5	66%	0.657	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.3	-9.5	177.3	50.8	0	0	0	0	115.1	D220	D220-S222 PolarHBondContact O-N 2.82Å
223	R	35.7	Very low	52	Low	219 Å²	219	97.2 Å²	97.2	83%	0.826	53%	0.532	S	S	*	.	S	Bend	trans	-127.7	4.5	-179.7	-72.4	-170.7	-179.6	177.7	0.9	116.7	D220 T221	D220-R223 PolarHBondContact O-N 3.21Å; T221-R223 VanDerWaalsContact C-N 3.31Å; T221-R223 PolarHBondContact O-N 2.95Å
224	S	33.7	Very low	50.9	Low	71 Å²	71	98 Å²	98	50%	0.497	53%	0.528	S	S	.	.			trans	-101.6	128.1	177	67.6	0	0	0	0	112.7
225	L	30.9	Very low	50	Low	151 Å²	151	97 Å²	97	79%	0.791	52%	0.518	S	S	*	.			trans	-68.4	143.9	168.9	-74.2	163	0	0	0	111.1	I227	L225-I227 PolarHBondContact O-N 3.12Å
226	P	30.6	Very low	49.3	Very low	129 Å²	129	97.5 Å²	97.5	84%	0.838	52%	0.523	S	S	*	.			trans	-78.5	100.6	176.8	30.3	-31.6	0	0	0	110.7
227	I	32.5	Very low	48.8	Very low	89 Å²	89	100.2 Å²	100.2	46%	0.456	54%	0.539	S	S	.	.			trans	-83.3	132.1	179	-57.6	171.4	0	0	0	110.4	L225 D231 K232	L225-I227 PolarHBondContact O-N 3.12Å; I227-D231 HydrophobicContact CG2-CB 3.57Å; I227-K232 HydrophobicContact CG2-CG 4.18Å
228	S	31.1	Very low	48.7	Very low	55 Å²	55	98 Å²	98	39%	0.385	53%	0.534	S	S	.	.			trans	-69.2	158.2	178.3	92.2	0	0	0	0	112.2	V230 D231 K232	S228-V230 VanDerWaalsContact C-N 3.26Å; S228-V230 PolarHBondContact O-N 3Å; S228-D231 VanDerWaalsContact CB-OD2 3.28Å; S228-D231 WeakPolarHBondContact CB-OD2 3.47Å; S228-D231 PolarHBondContact O-N 3.42Å; S228-D231 PolarHBondContact OG-N 3.48Å; S228-D231 PolarHBondContact OG-OD2 3.08Å; S228-K232 WeakPolarHBondContact O-CG 3.37Å; S228-K232 PolarHBondContact O-N 2.88Å; S228-K232 VanDerWaalsContact O-N 3.08Å
229	A	36.7	Very low	48.9	Very low	77 Å²	77	97.2 Å²	97.2	64%	0.636	53%	0.53	S	S	*	.	H	α-helix	trans	-65.8	-25.7	-178.2	0	0	0	0	0	114.2
230	V	33	Very low	49.9	Very low	106 Å²	106	92.4 Å²	92.4	64%	0.642	51%	0.509	S	S	*	.	H	α-helix	trans	-79.8	-36.7	177.7	-177.8	0	0	0	0	110.3	S228 K232 I233	S228-V230 VanDerWaalsContact C-N 3.26Å; S228-V230 PolarHBondContact O-N 3Å; V230-K232 VanDerWaalsContact C-N 3.31Å; V230-K232 PolarHBondContact O-N 2.83Å; V230-I233 PolarHBondContact O-N 2.85Å
231	D	43.7	Very low	51.7	Low	86 Å²	86	95.9 Å²	95.9	46%	0.46	52%	0.516	S	S	.	.	H	α-helix	trans	-61.9	-42.9	173	-61.9	-40.2	0	0	0	109.9	I227 S228 I233 K234 D235	I227-D231 HydrophobicContact CG2-CB 3.57Å; S228-D231 VanDerWaalsContact CB-OD2 3.28Å; S228-D231 WeakPolarHBondContact CB-OD2 3.47Å; S228-D231 PolarHBondContact O-N 3.42Å; S228-D231 PolarHBondContact OG-N 3.48Å; S228-D231 PolarHBondContact OG-OD2 3.08Å; D231-I233 VanDerWaalsContact C-N 3.28Å; D231-I233 PolarHBondContact O-N 3.45Å; D231-I233 VanDerWaalsContact O-N 3.1Å; D231-K234 PolarHBondContact O-N 3.3Å; D231-D235 WeakPolarHBondContact O-CB 3.36Å; D231-D235 PolarHBondContact O-N 2.82Å
232	K	46.1	Very low	54.1	Low	124 Å²	124	90.4 Å²	90.4	54%	0.539	48%	0.483	S	S	.	.	H	α-helix	trans	-50.2	-40.1	177.9	-73.2	-176.3	-177.4	-169.3	0	114.7	I227 S228 V230 D235 V236	I227-K232 HydrophobicContact CG2-CG 4.18Å; S228-K232 WeakPolarHBondContact O-CG 3.37Å; S228-K232 PolarHBondContact O-N 2.88Å; S228-K232 VanDerWaalsContact O-N 3.08Å; V230-K232 VanDerWaalsContact C-N 3.31Å; V230-K232 PolarHBondContact O-N 2.83Å; K232-D235 WeakPolarHBondContact O-CB 3.49Å; K232-V236 WeakPolarHBondContact O-CG2 3.38Å; K232-V236 PolarHBondContact O-N 3.3Å
233	I	47.7	Very low	56.7	Low	124 Å²	124	85.9 Å²	85.9	64%	0.636	45%	0.452	S	S	*	.	H	α-helix	trans	-73.8	-44.2	-175.9	-61.1	175.3	0	0	0	111.2	V230 D231 D235 V236 T237	V230-I233 PolarHBondContact O-N 2.85Å; D231-I233 VanDerWaalsContact C-N 3.28Å; D231-I233 PolarHBondContact O-N 3.45Å; D231-I233 VanDerWaalsContact O-N 3.1Å; I233-D235 PolarHBondContact O-N 2.92Å; I233-V236 PolarHBondContact O-N 3.08Å; I233-T237 PolarHBondContact O-N 2.78Å
234	K	45.6	Very low	59.5	Low	157 Å²	157	77.5 Å²	77.5	68%	0.683	42%	0.423	S	S	*	.	H	α-helix	trans	-61.5	-41	174.1	-74.3	-174.3	175	-176.3	0	110.1	D231 T237 Q238	D231-K234 PolarHBondContact O-N 3.3Å; K234-T237 PolarHBondContact O-N 3.03Å; K234-T237 PolarHBondContact O-OG1 2.79Å; K234-T237 VanDerWaalsContact O-OG1 3.06Å; K234-Q238 WeakPolarHBondContact O-CB 3.35Å; K234-Q238 PolarHBondContact O-N 3.06Å; K234-Q238 VanDerWaalsContact O-N 3.1Å
235	D	65.3	Low	62.4	Low	47 Å²	47	75.3 Å²	75.3	25%	0.251	41%	0.408	S	S	.	.	H	α-helix	trans	-60.9	-44.5	178	-155.2	11.2	0	0	0	111.7	D231 K232 I233 T237 Q238 I239	D231-D235 WeakPolarHBondContact O-CB 3.36Å; D231-D235 PolarHBondContact O-N 2.82Å; K232-D235 WeakPolarHBondContact O-CB 3.49Å; I233-D235 PolarHBondContact O-N 2.92Å; D235-T237 PolarHBondContact O-N 2.82Å; D235-Q238 PolarHBondContact O-N 2.99Å; D235-I239 HydrophobicContact CB-CD1 4.39Å; D235-I239 VanDerWaalsContact O-CB 3.27Å; D235-I239 WeakPolarHBondContact O-CB 2.97Å; D235-I239 WeakPolarHBondContact O-CD1 3.46Å; D235-I239 WeakPolarHBondContact O-CG1 3.41Å; D235-I239 PolarHBondContact O-N 3.3Å; D235-I239 WeakPolarHBondContact OD1-CD1 3.34Å; D235-I239 WeakPolarHBondContact OD1-CG1 3.34Å
236	V	71.7	Confident	65.6	Low	49 Å²	49	68.1 Å²	68.1	30%	0.297	37%	0.37	S	S	.	.	H	α-helix	trans	-55.1	-51.9	176.9	173.7	0	0	0	0	112.2	Y206 K232 I233 Q238 S240	Y206-V236 HydrophobicContact CE1-CG1 3.74Å; Y206-V236 HydrophobicContact CE2-CG1 4.2Å; Y206-V236 WeakPolarHBondContact OH-CG1 3.42Å; Y206-V236 WeakPolarHBondContact OH-CG2 3.41Å; K232-V236 WeakPolarHBondContact O-CG2 3.38Å; K232-V236 PolarHBondContact O-N 3.3Å; I233-V236 PolarHBondContact O-N 3.08Å; V236-Q238 VanDerWaalsContact C-N 3.32Å; V236-S240 WeakPolarHBondContact O-CB 3.37Å; V236-S240 PolarHBondContact O-N 2.79Å; V236-S240 PolarHBondContact O-OG 3.05Å
237	T	77.6	Confident	68.7	Low	65 Å²	65	62 Å²	62	40%	0.399	33%	0.33	S	S	.	.	H	α-helix	trans	-69.1	-35.6	-175.8	61.6	0	0	0	0	111.5	I233 K234 D235 R241	I233-T237 PolarHBondContact O-N 2.78Å; K234-T237 PolarHBondContact O-N 3.03Å; K234-T237 PolarHBondContact O-OG1 2.79Å; K234-T237 VanDerWaalsContact O-OG1 3.06Å; D235-T237 PolarHBondContact O-N 2.82Å; T237-R241 WeakPolarHBondContact O-CG 3.46Å; T237-R241 PolarHBondContact O-N 2.82Å
238	Q	83.7	Confident	71.8	Confident	67 Å²	67	59.9 Å²	59.9	31%	0.313	32%	0.32	S	S	.	.	H	α-helix	trans	-73.9	-48.5	-179.3	-170.5	60.3	15.7	0	0	111.2	K234 D235 V236 S240 R241 C242 E271	K234-Q238 WeakPolarHBondContact O-CB 3.35Å; K234-Q238 PolarHBondContact O-N 3.06Å; K234-Q238 VanDerWaalsContact O-N 3.1Å; D235-Q238 PolarHBondContact O-N 2.99Å; V236-Q238 VanDerWaalsContact C-N 3.32Å; Q238-S240 VanDerWaalsContact C-N 3.26Å; Q238-S240 PolarHBondContact O-N 3Å; Q238-R241 WeakPolarHBondContact O-CA 3.43Å; Q238-R241 WeakPolarHBondContact O-CB 3.34Å; Q238-R241 PolarHBondContact O-N 2.95Å; Q238-C242 PolarHBondContact O-N 3.13Å; Q238-C242 PolarHBondContact O-SG 3.3Å; Q238-C242 VanDerWaalsContact O-SG 3.34Å; Q238-E271 HydrophobicContact CB-CG 4.5Å; Q238-E271 HydrophobicContact CG-CG 3.81Å; Q238-E271 WeakPolarHBondContact CG-OE1 3.03Å
239	I	84.6	Confident	74.9	Confident	15 Å²	15	57.5 Å²	57.5	8%	0.077	30%	0.302	C	S	.	.	H	α-helix	trans	-53.4	-46.8	172.8	-67.6	166.6	0	0	0	110	Y206 F210 D235 R241 C242 V243 E271 L272	Y206-I239 HydrophobicContact CD2-CB 4.38Å; Y206-I239 HydrophobicContact CD2-CG2 3.8Å; Y206-I239 HydrophobicContact CE2-CB 4.29Å; Y206-I239 HydrophobicContact CE2-CG2 4.05Å; F210-I239 HydrophobicContact CD2-CG2 3.91Å; F210-I239 HydrophobicContact CE2-CG2 3.78Å; F210-I239 HydrophobicContact CG-CG2 4.47Å; F210-I239 HydrophobicContact CZ-CG2 4.24Å; D235-I239 HydrophobicContact CB-CD1 4.39Å; D235-I239 VanDerWaalsContact O-CB 3.27Å; D235-I239 WeakPolarHBondContact O-CB 2.97Å; D235-I239 WeakPolarHBondContact O-CD1 3.46Å; D235-I239 WeakPolarHBondContact O-CG1 3.41Å; D235-I239 PolarHBondContact O-N 3.3Å; D235-I239 WeakPolarHBondContact OD1-CD1 3.34Å; D235-I239 WeakPolarHBondContact OD1-CG1 3.34Å; I239-R241 VanDerWaalsContact C-N 3.28Å; I239-R241 PolarHBondContact O-N 2.92Å; I239-C242 WeakPolarHBondContact O-CB 3.19Å; I239-C242 PolarHBondContact O-N 2.79Å; I239-C242 VanDerWaalsContact O-N 3.13Å; I239-V243 HydrophobicContact CG2-CG2 4.25Å; I239-V243 WeakPolarHBondContact O-CG2 3.42Å; I239-V243 PolarHBondContact O-N 3.17Å; I239-E271 HydrophobicContact CG1-CB 4.36Å; I239-L272 HydrophobicContact CG2-CD2 4.3Å
240	S	86.2	Confident	77.7	Confident	30 Å²	30	53.8 Å²	53.8	21%	0.21	27%	0.272	C	S	.	.	H	α-helix	trans	-60.4	-35.9	179.4	-60.9	0	0	0	0	112.8	V236 Q238 L244	V236-S240 WeakPolarHBondContact O-CB 3.37Å; V236-S240 PolarHBondContact O-N 2.79Å; V236-S240 PolarHBondContact O-OG 3.05Å; Q238-S240 VanDerWaalsContact C-N 3.26Å; Q238-S240 PolarHBondContact O-N 3Å; S240-L244 PolarHBondContact O-N 2.95Å; S240-L244 VanDerWaalsContact O-N 3.14Å
241	R	89	Confident	80.5	Confident	140 Å²	140	49 Å²	49	53%	0.528	24%	0.243	S	C	.	.	H	α-helix	trans	-69.3	-43.7	173.5	-70.6	178.1	-160.8	118.4	4	111.5	T237 Q238 I239 V243 L244 S245	T237-R241 WeakPolarHBondContact O-CG 3.46Å; T237-R241 PolarHBondContact O-N 2.82Å; Q238-R241 WeakPolarHBondContact O-CA 3.43Å; Q238-R241 WeakPolarHBondContact O-CB 3.34Å; Q238-R241 PolarHBondContact O-N 2.95Å; I239-R241 VanDerWaalsContact C-N 3.28Å; I239-R241 PolarHBondContact O-N 2.92Å; R241-V243 VanDerWaalsContact C-N 3.34Å; R241-V243 PolarHBondContact O-N 2.98Å; R241-L244 WeakPolarHBondContact O-CB 3.5Å; R241-L244 PolarHBondContact O-N 2.98Å; R241-S245 PolarHBondContact O-N 2.82Å; R241-S245 PolarHBondContact O-OG 2.82Å
242	C	92.6	Very high	83	Confident	3 Å²	3	47.5 Å²	47.5	2%	0.02	23%	0.234	C	C	.	.	H	α-helix	trans	-59.6	-44.7	176.2	-63.4	0	0	0	0	111.1	Q238 I239 L244 S245 V246 Y267 L272	Q238-C242 PolarHBondContact O-N 3.13Å; Q238-C242 PolarHBondContact O-SG 3.3Å; Q238-C242 VanDerWaalsContact O-SG 3.34Å; I239-C242 WeakPolarHBondContact O-CB 3.19Å; I239-C242 PolarHBondContact O-N 2.79Å; I239-C242 VanDerWaalsContact O-N 3.13Å; C242-L244 VanDerWaalsContact C-N 3.34Å; C242-L244 PolarHBondContact O-N 2.83Å; C242-S245 PolarHBondContact O-N 3.41Å; C242-V246 WeakPolarHBondContact O-CB 3.45Å; C242-V246 WeakPolarHBondContact O-CG2 3.33Å; C242-V246 PolarHBondContact O-N 2.8Å; C242-Y267 PolarHBondContact SG-O 3.37Å; C242-L272 HydrophobicContact CB-CD1 3.59Å; C242-L272 HydrophobicContact CB-CG 4.07Å
243	V	92.9	Very high	85.2	Confident	0 Å²	0	42 Å²	42	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-59.3	-44.4	175.1	178.8	0	0	0	0	111.1	A202 I205 F210 I239 R241 S245 V246 L247 I280	A202-V243 HydrophobicContact CB-CB 4.37Å; A202-V243 HydrophobicContact CB-CG1 4Å; I205-V243 HydrophobicContact CB-CG1 4.18Å; I205-V243 HydrophobicContact CG2-CG1 4.06Å; F210-V243 HydrophobicContact CE2-CG2 4.26Å; I239-V243 HydrophobicContact CG2-CG2 4.25Å; I239-V243 WeakPolarHBondContact O-CG2 3.42Å; I239-V243 PolarHBondContact O-N 3.17Å; R241-V243 VanDerWaalsContact C-N 3.34Å; R241-V243 PolarHBondContact O-N 2.98Å; V243-S245 PolarHBondContact O-N 3.49Å; V243-V246 PolarHBondContact O-N 3.45Å; V243-L247 HydrophobicContact CG1-CD1 4.14Å; V243-L247 HydrophobicContact CG1-CG 4.32Å; V243-L247 WeakPolarHBondContact O-CG 3.43Å; V243-L247 PolarHBondContact O-N 2.78Å; V243-I280 HydrophobicContact CB-CD1 4.43Å; V243-I280 HydrophobicContact CG1-CD1 4.35Å; V243-I280 HydrophobicContact CG1-CG1 4.37Å; V243-I280 HydrophobicContact CG1-CG2 4.29Å; V243-I280 HydrophobicContact CG2-CD1 3.87Å; V243-I280 HydrophobicContact CG2-CG1 4.35Å
244	L	95.4	Very high	87.4	Confident	43 Å²	43	37 Å²	37	23%	0.225	18%	0.184	C	C	.	.	H	α-helix	trans	-59.7	-46.8	177.1	176.4	62.5	0	0	0	112.1	L198 I199 A202 S240 R241 C242 V246 L247 N248	L198-L244 HydrophobicContact CB-CD1 3.54Å; I199-L244 HydrophobicContact CG1-CD1 4.03Å; I199-L244 HydrophobicContact CG1-CD2 3.94Å; A202-L244 HydrophobicContact CB-CB 4.08Å; S240-L244 PolarHBondContact O-N 2.95Å; S240-L244 VanDerWaalsContact O-N 3.14Å; R241-L244 WeakPolarHBondContact O-CB 3.5Å; R241-L244 PolarHBondContact O-N 2.98Å; C242-L244 VanDerWaalsContact C-N 3.34Å; C242-L244 PolarHBondContact O-N 2.83Å; L244-V246 VanDerWaalsContact C-N 3.33Å; L244-V246 PolarHBondContact O-N 2.87Å; L244-L247 PolarHBondContact O-N 3.03Å; L244-N248 PolarHBondContact O-N 2.62Å
245	S	94.6	Very high	89.8	Confident	25 Å²	25	29.5 Å²	29.5	18%	0.175	15%	0.152	C	C	.	.	H	α-helix	trans	-59.4	-44.9	176.4	-66.4	0	0	0	0	111.5	R241 C242 V243 L247 N248 F249	R241-S245 PolarHBondContact O-N 2.82Å; R241-S245 PolarHBondContact O-OG 2.82Å; C242-S245 PolarHBondContact O-N 3.41Å; V243-S245 PolarHBondContact O-N 3.49Å; S245-L247 PolarHBondContact O-N 3.36Å; S245-N248 PolarHBondContact O-N 2.91Å; S245-F249 WeakPolarHBondContact O-CD2 3.23Å; S245-F249 WeakPolarHBondContact O-CG 3.34Å; S245-F249 PolarHBondContact O-N 2.91Å
246	V	96.2	Very high	91.2	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-60.5	-45.4	177.3	170.7	0	0	0	0	111.8	C242 V243 L244 N248 F249 M250 I260 V268 L272 L277 I280	C242-V246 WeakPolarHBondContact O-CB 3.45Å; C242-V246 WeakPolarHBondContact O-CG2 3.33Å; C242-V246 PolarHBondContact O-N 2.8Å; V243-V246 PolarHBondContact O-N 3.45Å; L244-V246 VanDerWaalsContact C-N 3.33Å; L244-V246 PolarHBondContact O-N 2.87Å; V246-N248 VanDerWaalsContact C-N 3.33Å; V246-N248 PolarHBondContact O-N 3.12Å; V246-F249 WeakPolarHBondContact O-CB 3.21Å; V246-F249 PolarHBondContact O-N 3.37Å; V246-M250 HydrophobicContact CG1-CE 3.45Å; V246-M250 VanDerWaalsContact CG1-CE 3.45Å; V246-M250 HydrophobicContact CG1-SD 4.44Å; V246-M250 WeakPolarHBondContact O-CG 3.46Å; V246-M250 PolarHBondContact O-N 2.98Å; V246-I260 HydrophobicContact CG1-CD1 4.48Å; V246-I260 HydrophobicContact CG2-CG2 4.37Å; V246-V268 HydrophobicContact CG2-CG1 3.45Å; V246-V268 VanDerWaalsContact CG2-CG1 3.45Å; V246-L272 HydrophobicContact CG2-CD1 4.28Å; V246-L277 HydrophobicContact CB-CD2 4.44Å; V246-L277 HydrophobicContact CG1-CD2 4.01Å; V246-L277 HydrophobicContact CG2-CD2 3.51Å; V246-I280 HydrophobicContact CB-CD1 4.47Å; V246-I280 HydrophobicContact CG1-CB 4.41Å; V246-I280 HydrophobicContact CG1-CD1 4.17Å; V246-I280 HydrophobicContact CG1-CG2 3.87Å
247	L	96.8	Very high	92.4	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-63.8	-38.9	177	-70.3	174.2	0	0	0	112.2	L198 E201 A202 I205 V243 L244 S245 F249 M250 R251 I280 D284	L198-L247 HydrophobicContact CD2-CB 4.04Å; E201-L247 HydrophobicContact CB-CD1 3.97Å; E201-L247 HydrophobicContact CG-CD1 3.63Å; E201-L247 HydrophobicContact CG-CD2 4.43Å; E201-L247 WeakPolarHBondContact OE1-CD2 3.45Å; A202-L247 HydrophobicContact CB-CD1 4.01Å; I205-L247 HydrophobicContact CD1-CD1 4.1Å; I205-L247 HydrophobicContact CD1-CD2 3.86Å; I205-L247 HydrophobicContact CD1-CG 4.4Å; V243-L247 HydrophobicContact CG1-CD1 4.14Å; V243-L247 HydrophobicContact CG1-CG 4.32Å; V243-L247 WeakPolarHBondContact O-CG 3.43Å; V243-L247 PolarHBondContact O-N 2.78Å; L244-L247 PolarHBondContact O-N 3.03Å; S245-L247 PolarHBondContact O-N 3.36Å; L247-F249 VanDerWaalsContact C-N 3.34Å; L247-M250 PolarHBondContact O-N 3.15Å; L247-R251 WeakPolarHBondContact O-CB 3.5Å; L247-R251 PolarHBondContact O-N 2.84Å; L247-I280 HydrophobicContact CD2-CG2 3.85Å; L247-I280 HydrophobicContact CG-CG2 4.27Å; L247-D284 HydrophobicContact CD2-CB 4Å
248	N	96.7	Very high	93.3	Very high	44 Å²	44	21.8 Å²	21.8	24%	0.235	11%	0.107	C	C	.	.	H	α-helix	trans	-63.3	-40.7	174.5	-173	59	0	0	0	111.7	L198 L244 S245 V246 N252 Q253	L198-N248 HydrophobicContact CD1-CB 3.98Å; L244-N248 PolarHBondContact O-N 2.62Å; S245-N248 PolarHBondContact O-N 2.91Å; V246-N248 VanDerWaalsContact C-N 3.33Å; V246-N248 PolarHBondContact O-N 3.12Å; N248-N252 WeakPolarHBondContact O-CB 3.37Å; N248-N252 PolarHBondContact O-N 3Å; N248-N252 VanDerWaalsContact O-N 3.1Å; N248-N252 PolarHBondContact OD1-ND2 3.17Å; N248-Q253 PolarHBondContact ND2-NE2 2.82Å; N248-Q253 VanDerWaalsContact ND2-NE2 3.13Å; N248-Q253 PolarHBondContact O-N 3.22Å
249	F	96.2	Very high	94	Very high	5 Å²	5	18.6 Å²	18.6	2%	0.022	9%	0.092	C	C	.	.	H	α-helix	trans	-61.7	-44.8	174	-68.1	-49	0	0	0	112.1	V87 S245 V246 L247 Q253 E254 F255 I260 R264 Y267	V87-F249 HydrophobicContact CG1-CE1 4.39Å; S245-F249 WeakPolarHBondContact O-CD2 3.23Å; S245-F249 WeakPolarHBondContact O-CG 3.34Å; S245-F249 PolarHBondContact O-N 2.91Å; V246-F249 WeakPolarHBondContact O-CB 3.21Å; V246-F249 PolarHBondContact O-N 3.37Å; L247-F249 VanDerWaalsContact C-N 3.34Å; F249-Q253 VanDerWaalsContact CD1-NE2 3.29Å; F249-Q253 VanDerWaalsContact CD1-OE1 3.27Å; F249-Q253 CarbonylContact O-C 3.43Å; F249-Q253 WeakPolarHBondContact O-CB 3.26Å; F249-Q253 PolarHBondContact O-N 3.41Å; F249-E254 PolarHBondContact O-N 3.08Å; F249-F255 HydrophobicContact CB-CB 4.31Å; F249-F255 HydrophobicContact CB-CD2 4.2Å; F249-F255 AromaticContact CD1-CD2 3.83Å; F249-F255 HydrophobicContact CD1-CD2 3.83Å; F249-F255 HydrophobicContact CD1-CE2 4.23Å; F249-F255 HydrophobicContact CG-CD2 4.34Å; F249-F255 PolarHBondContact O-N 3.39Å; F249-I260 HydrophobicContact CB-CD1 3.61Å; F249-I260 HydrophobicContact CB-CG1 3.88Å; F249-I260 HydrophobicContact CD2-CG1 4.43Å; F249-I260 HydrophobicContact CD2-CG2 4.28Å; F249-I260 HydrophobicContact CG-CG1 4.39Å; F249-R264 HydrophobicContact CE1-CG 4.28Å; F249-R264 HydrophobicContact CE2-CB 4.11Å; F249-R264 HydrophobicContact CE2-CG 4.39Å; F249-R264 HydrophobicContact CZ-CB 4.27Å; F249-R264 HydrophobicContact CZ-CG 4.2Å; F249-Y267 HydrophobicContact CE2-CD1 4.42Å; F249-Y267 AromaticContact CE2-CD2 3.92Å; F249-Y267 HydrophobicContact CE2-CD2 3.92Å; F249-Y267 AromaticContact CE2-CG 3.81Å; F249-Y267 HydrophobicContact CE2-CG 3.81Å; F249-Y267 HydrophobicContact CZ-CD1 4.23Å; F249-Y267 AromaticContact CZ-CD2 3.66Å; F249-Y267 HydrophobicContact CZ-CD2 3.66Å; F249-Y267 HydrophobicContact CZ-CE1 4.45Å; F249-Y267 AromaticContact CZ-CE2 3.91Å; F249-Y267 HydrophobicContact CZ-CE2 3.91Å; F249-Y267 AromaticContact CZ-CG 3.83Å; F249-Y267 HydrophobicContact CZ-CG 3.83Å
250	M	95.3	Very high	94.6	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-72.5	-49.6	-179.1	-65.1	-172.7	-167	0	0	113.1	F183 V246 L247 E254 V257 I260 Y281	F183-M250 HydrophobicContact CZ-CB 4.5Å; V246-M250 HydrophobicContact CG1-CE 3.45Å; V246-M250 VanDerWaalsContact CG1-CE 3.45Å; V246-M250 HydrophobicContact CG1-SD 4.44Å; V246-M250 WeakPolarHBondContact O-CG 3.46Å; V246-M250 PolarHBondContact O-N 2.98Å; L247-M250 PolarHBondContact O-N 3.15Å; M250-E254 WeakPolarHBondContact O-CA 3.5Å; M250-E254 PolarHBondContact O-N 3.48Å; M250-V257 HydrophobicContact CE-CG2 3.42Å; M250-V257 VanDerWaalsContact CE-CG2 3.42Å; M250-I260 HydrophobicContact CE-CD1 4.14Å; M250-I260 HydrophobicContact CG-CD1 3.78Å; M250-Y281 HydrophobicContact SD-CD2 3.96Å; M250-Y281 HydrophobicContact SD-CG 4.46Å
251	R	93.6	Very high	95	Very high	6 Å²	6	17 Å²	17	2%	0.023	8%	0.082	C	C	.	.	H	α-helix	trans	-83.3	-36.3	-169.5	-64.7	-166.2	65.8	-174	-0.2	114	V190 S191 P192 E197 L198 E201 L247 D284	V190-R251 HydrophobicContact CG1-CB 4.44Å; V190-R251 HydrophobicContact CG1-CG 4.26Å; S191-R251 PolarHBondContact O-NE 3.08Å; S191-R251 PolarHBondContact O-NH2 3.28Å; S191-R251 VanDerWaalsContact O-NH2 3.14Å; S191-R251 PolarHBondContact OG-NH2 2.75Å; P192-R251 WeakPolarHBondContact CA-O 3.36Å; E197-R251 IonicContact OE1-CZ 3.51Å; E197-R251 IonicContact OE1-NH1 3.87Å; E197-R251 PolarHBondContact OE1-NH1 2.88Å; E197-R251 IonicContact OE1-NH2 3.96Å; E197-R251 PolarHBondContact OE1-NH2 2.86Å; L198-R251 HydrophobicContact CD2-CB 4.38Å; L198-R251 HydrophobicContact CD2-CG 4.45Å; E201-R251 IonicContact OE2-CZ 3.42Å; E201-R251 IonicContact OE2-NH1 2.83Å; E201-R251 PolarHBondContact OE2-NH1 2.85Å; L247-R251 WeakPolarHBondContact O-CB 3.5Å; L247-R251 PolarHBondContact O-N 2.84Å; R251-D284 WeakPolarHBondContact CD-OD1 3.4Å; R251-D284 IonicContact NE-OD1 3.72Å
252	N	94.5	Very high	95.2	Very high	54 Å²	54	12.7 Å²	12.7	29%	0.289	7%	0.068	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.6	-30.4	-174.1	-67.3	-20.1	0	0	0	113	P192 A193 N248	P192-N252 WeakPolarHBondContact CA-OD1 3.47Å; A193-N252 PolarHBondContact N-OD1 3.3Å; A193-N252 PolarHBondContact O-ND2 3.26Å; A193-N252 VanDerWaalsContact O-ND2 3.09Å; A193-N252 PolarHBondContact O-OD1 3.39Å; N248-N252 WeakPolarHBondContact O-CB 3.37Å; N248-N252 PolarHBondContact O-N 3Å; N248-N252 VanDerWaalsContact O-N 3.1Å; N248-N252 PolarHBondContact OD1-ND2 3.17Å
253	Q	92.3	Very high	95.3	Very high	7 Å²	7	14.1 Å²	14.1	3%	0.033	7%	0.073	C	C	.	.	S	Bend	trans	-103.7	-9.1	177.7	-68.2	161.4	66.2	0	0	113.4	V87 A90 N248 F249 F255	V87-Q253 HydrophobicContact CG1-CG 4.48Å; A90-Q253 WeakPolarHBondContact CB-O 3.02Å; N248-Q253 PolarHBondContact ND2-NE2 2.82Å; N248-Q253 VanDerWaalsContact ND2-NE2 3.13Å; N248-Q253 PolarHBondContact O-N 3.22Å; F249-Q253 VanDerWaalsContact CD1-NE2 3.29Å; F249-Q253 VanDerWaalsContact CD1-OE1 3.27Å; F249-Q253 CarbonylContact O-C 3.43Å; F249-Q253 WeakPolarHBondContact O-CB 3.26Å; F249-Q253 PolarHBondContact O-N 3.41Å; Q253-F255 HydrophobicContact CB-CD2 3.83Å; Q253-F255 HydrophobicContact CB-CE2 3.87Å; Q253-F255 HydrophobicContact CB-CG 4.24Å; Q253-F255 HydrophobicContact CB-CZ 4.3Å; Q253-F255 HydrophobicContact CG-CE2 4.39Å; Q253-F255 PolarHBondContact O-N 3.13Å
254	E	94.2	Very high	95.3	Very high	19 Å²	19	15.5 Å²	15.5	9%	0.089	8%	0.078	C	C	.	.			trans	55.8	35.5	-178.4	-58.5	-169	124	0	0	114.1	R179 P180 F183 F249 M250 K908 N912	R179-E254 IonicContact CZ-OE1 3.22Å; R179-E254 IonicContact NE-OE1 2.63Å; R179-E254 PolarHBondContact NE-OE1 3.4Å; R179-E254 IonicContact NH2-OE1 2.76Å; R179-E254 PolarHBondContact NH2-OE1 3.38Å; R179-E254 VanDerWaalsContact NH2-OE1 3.11Å; P180-E254 WeakPolarHBondContact CG-O 3.15Å; F183-E254 HydrophobicContact CD2-CB 4.44Å; F183-E254 HydrophobicContact CE2-CB 4.32Å; F249-E254 PolarHBondContact O-N 3.08Å; M250-E254 WeakPolarHBondContact O-CA 3.5Å; M250-E254 PolarHBondContact O-N 3.48Å; E254-K908 HydrophobicContact CB-CD 4.38Å; E254-K908 WeakPolarHBondContact OE2-CD 3.13Å; E254-K908 WeakPolarHBondContact OE2-CE 3.29Å; E254-K908 IonicContact OE2-NZ 3.94Å; E254-K908 PolarHBondContact OE2-NZ 3.02Å; E254-N912 PolarHBondContact O-ND2 2.92Å
255	F	96.2	Very high	95.1	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	7%	0.073	C	C	.	.			trans	-83.6	128.8	170.2	-65.1	-32.8	0	0	0	111.2	A90 F183 F249 Q253 F259 I260 M911 N912	A90-F255 HydrophobicContact CB-CD1 4.26Å; A90-F255 HydrophobicContact CB-CE1 3.51Å; A90-F255 HydrophobicContact CB-CZ 4Å; F183-F255 WeakPolarHBondContact CZ-O 3.1Å; F249-F255 HydrophobicContact CB-CB 4.31Å; F249-F255 HydrophobicContact CB-CD2 4.2Å; F249-F255 AromaticContact CD1-CD2 3.83Å; F249-F255 HydrophobicContact CD1-CD2 3.83Å; F249-F255 HydrophobicContact CD1-CE2 4.23Å; F249-F255 HydrophobicContact CG-CD2 4.34Å; F249-F255 PolarHBondContact O-N 3.39Å; Q253-F255 HydrophobicContact CB-CD2 3.83Å; Q253-F255 HydrophobicContact CB-CE2 3.87Å; Q253-F255 HydrophobicContact CB-CG 4.24Å; Q253-F255 HydrophobicContact CB-CZ 4.3Å; Q253-F255 HydrophobicContact CG-CE2 4.39Å; Q253-F255 PolarHBondContact O-N 3.13Å; F255-F259 HydrophobicContact CB-CD1 3.77Å; F255-F259 HydrophobicContact CB-CE1 4.42Å; F255-F259 HydrophobicContact CB-CG 4.48Å; F255-F259 AromaticContact CD1-CD1 3.72Å; F255-F259 HydrophobicContact CD1-CD1 3.72Å; F255-F259 AromaticContact CD1-CE1 3.68Å; F255-F259 HydrophobicContact CD1-CE1 3.68Å; F255-F259 HydrophobicContact CD1-CG 4.38Å; F255-F259 HydrophobicContact CD1-CZ 4.33Å; F255-F259 AromaticContact CD2-CD1 3.93Å; F255-F259 HydrophobicContact CD2-CD1 3.93Å; F255-F259 AromaticContact CD2-CE1 3.75Å; F255-F259 HydrophobicContact CD2-CE1 3.75Å; F255-F259 HydrophobicContact CE1-CD1 4.27Å; F255-F259 AromaticContact CE1-CE1 3.75Å; F255-F259 HydrophobicContact CE1-CE1 3.75Å; F255-F259 HydrophobicContact CE1-CZ 4.1Å; F255-F259 HydrophobicContact CE2-CD1 4.45Å; F255-F259 AromaticContact CE2-CE1 3.8Å; F255-F259 HydrophobicContact CE2-CE1 3.8Å; F255-F259 AromaticContact CG-CD1 3.54Å; F255-F259 HydrophobicContact CG-CD1 3.54Å; F255-F259 AromaticContact CG-CE1 3.7Å; F255-F259 HydrophobicContact CG-CE1 3.7Å; F255-F259 HydrophobicContact CG-CG 4.47Å; F255-F259 AromaticContact CZ-CE1 3.82Å; F255-F259 HydrophobicContact CZ-CE1 3.82Å; F255-F259 HydrophobicContact CZ-CZ 4.28Å; F255-I260 HydrophobicContact CB-CD1 4.34Å; F255-I260 HydrophobicContact CB-CG1 3.95Å; F255-M911 HydrophobicContact CE1-CB 4.41Å; F255-N912 WeakPolarHBondContact CA-OD1 3.4Å
256	E	95.6	Very high	94.9	Very high	0 Å²	0	15 Å²	15	0%	0	7%	0.071	C	C	.	.			trans	-76.2	162.7	175.3	-73.1	-153	-112.9	0	0	112.8	P180 R182 F183 F259 I260 G873 N912	P180-E256 HydrophobicContact CB-CG 3.62Å; P180-E256 VanDerWaalsContact CB-OE1 3.32Å; P180-E256 WeakPolarHBondContact CB-OE1 3.29Å; P180-E256 HydrophobicContact CG-CG 3.89Å; R182-E256 IonicContact CZ-OE1 2.86Å; R182-E256 IonicContact CZ-OE2 3.11Å; R182-E256 IonicContact NE-OE1 2.91Å; R182-E256 PolarHBondContact NE-OE1 3.15Å; R182-E256 IonicContact NE-OE2 3.87Å; R182-E256 PolarHBondContact NE-OE2 2.86Å; R182-E256 VanDerWaalsContact NH2-CD 3.33Å; R182-E256 IonicContact NH2-OE1 2.93Å; R182-E256 PolarHBondContact NH2-OE1 3.27Å; R182-E256 IonicContact NH2-OE2 2.66Å; R182-E256 PolarHBondContact NH2-OE2 3.32Å; F183-E256 HydrophobicContact CD1-CG 4.39Å; F183-E256 HydrophobicContact CE1-CG 3.86Å; F183-E256 HydrophobicContact CE2-CG 4.35Å; F183-E256 HydrophobicContact CZ-CB 4.41Å; F183-E256 HydrophobicContact CZ-CG 3.86Å; E256-F259 WeakPolarHBondContact O-CB 3.31Å; E256-F259 PolarHBondContact O-N 2.84Å; E256-F259 VanDerWaalsContact O-N 3.11Å; E256-I260 WeakPolarHBondContact O-CG1 3.35Å; E256-I260 PolarHBondContact O-N 2.9Å; E256-G873 WeakPolarHBondContact OE1-CA 3.16Å; E256-G873 PolarHBondContact OE1-N 2.81Å; E256-N912 PolarHBondContact N-OD1 3.26Å
257	V	96.7	Very high	94.7	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-55.2	-46.1	-177.9	170.5	0	0	0	0	113.4	M250 F259 I260 A261 I274 L277 W278	M250-V257 HydrophobicContact CE-CG2 3.42Å; M250-V257 VanDerWaalsContact CE-CG2 3.42Å; V257-F259 VanDerWaalsContact C-N 3.34Å; V257-F259 PolarHBondContact O-N 3.16Å; V257-I260 PolarHBondContact O-N 2.92Å; V257-A261 VanDerWaalsContact O-CB 3.29Å; V257-A261 WeakPolarHBondContact O-CB 3.46Å; V257-A261 PolarHBondContact O-N 3.27Å; V257-I274 HydrophobicContact CG1-CG1 4.02Å; V257-L277 HydrophobicContact CG1-CB 3.56Å; V257-L277 HydrophobicContact CG1-CD1 4.3Å; V257-L277 HydrophobicContact CG2-CB 4.28Å; V257-W278 HydrophobicContact CB-CD2 3.73Å; V257-W278 HydrophobicContact CB-CE3 3.86Å; V257-W278 HydrophobicContact CB-CG 4.45Å; V257-W278 HydrophobicContact CB-CH2 3.81Å; V257-W278 HydrophobicContact CB-CZ2 3.68Å; V257-W278 HydrophobicContact CB-CZ3 3.89Å; V257-W278 HydrophobicContact CG1-CD2 3.58Å; V257-W278 HydrophobicContact CG1-CE3 4.23Å; V257-W278 HydrophobicContact CG1-CG 3.84Å; V257-W278 HydrophobicContact CG1-CH2 4.5Å; V257-W278 HydrophobicContact CG1-CZ2 3.91Å; V257-W278 HydrophobicContact CG2-CD2 3.81Å; V257-W278 HydrophobicContact CG2-CE3 3.59Å; V257-W278 HydrophobicContact CG2-CG 4.46Å; V257-W278 HydrophobicContact CG2-CH2 4.28Å; V257-W278 HydrophobicContact CG2-CZ2 4.48Å; V257-W278 HydrophobicContact CG2-CZ3 3.83Å
258	P	97	Very high	94.3	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-60.9	-43.5	177.2	-22.4	34.5	0	0	0	111.7	I260 A261 F262 W278 I845 N849 C872 F916	P258-I260 VanDerWaalsContact C-N 3.34Å; P258-I260 PolarHBondContact O-N 3.07Å; P258-A261 PolarHBondContact O-N 3.07Å; P258-F262 VanDerWaalsContact O-CD2 3.24Å; P258-F262 WeakPolarHBondContact O-CD2 3.41Å; P258-F262 PolarHBondContact O-N 2.97Å; P258-W278 HydrophobicContact CG-CZ2 3.99Å; P258-I845 HydrophobicContact CG-CG2 3.61Å; P258-N849 HydrophobicContact CB-CB 4Å; P258-C872 HydrophobicContact CB-CB 4Å; P258-C872 HydrophobicContact CG-CB 4.34Å; P258-F916 HydrophobicContact CB-CZ 4.16Å
259	F	97.1	Very high	93.8	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-57.5	-47.7	176.9	-174.2	-89.9	0	0	0	111.7	F255 E256 V257 A261 F262 Y263 R264 C872 M911 F916 H940	F255-F259 HydrophobicContact CB-CD1 3.77Å; F255-F259 HydrophobicContact CB-CE1 4.42Å; F255-F259 HydrophobicContact CB-CG 4.48Å; F255-F259 AromaticContact CD1-CD1 3.72Å; F255-F259 HydrophobicContact CD1-CD1 3.72Å; F255-F259 AromaticContact CD1-CE1 3.68Å; F255-F259 HydrophobicContact CD1-CE1 3.68Å; F255-F259 HydrophobicContact CD1-CG 4.38Å; F255-F259 HydrophobicContact CD1-CZ 4.33Å; F255-F259 AromaticContact CD2-CD1 3.93Å; F255-F259 HydrophobicContact CD2-CD1 3.93Å; F255-F259 AromaticContact CD2-CE1 3.75Å; F255-F259 HydrophobicContact CD2-CE1 3.75Å; F255-F259 HydrophobicContact CE1-CD1 4.27Å; F255-F259 AromaticContact CE1-CE1 3.75Å; F255-F259 HydrophobicContact CE1-CE1 3.75Å; F255-F259 HydrophobicContact CE1-CZ 4.1Å; F255-F259 HydrophobicContact CE2-CD1 4.45Å; F255-F259 AromaticContact CE2-CE1 3.8Å; F255-F259 HydrophobicContact CE2-CE1 3.8Å; F255-F259 AromaticContact CG-CD1 3.54Å; F255-F259 HydrophobicContact CG-CD1 3.54Å; F255-F259 AromaticContact CG-CE1 3.7Å; F255-F259 HydrophobicContact CG-CE1 3.7Å; F255-F259 HydrophobicContact CG-CG 4.47Å; F255-F259 AromaticContact CZ-CE1 3.82Å; F255-F259 HydrophobicContact CZ-CE1 3.82Å; F255-F259 HydrophobicContact CZ-CZ 4.28Å; E256-F259 WeakPolarHBondContact O-CB 3.31Å; E256-F259 PolarHBondContact O-N 2.84Å; E256-F259 VanDerWaalsContact O-N 3.11Å; V257-F259 VanDerWaalsContact C-N 3.34Å; V257-F259 PolarHBondContact O-N 3.16Å; F259-A261 VanDerWaalsContact C-N 3.34Å; F259-A261 PolarHBondContact O-N 3.31Å; F259-F262 PolarHBondContact O-N 3.45Å; F259-Y263 AromaticContact CD2-CD2 3.74Å; F259-Y263 HydrophobicContact CD2-CD2 3.74Å; F259-Y263 AromaticContact CE2-CD2 3.89Å; F259-Y263 HydrophobicContact CE2-CD2 3.89Å; F259-Y263 HydrophobicContact CE2-CG 4.34Å; F259-Y263 HydrophobicContact CG-CD2 4.39Å; F259-Y263 WeakPolarHBondContact O-CA 3.4Å; F259-Y263 WeakPolarHBondContact O-CB 3.27Å; F259-Y263 PolarHBondContact O-N 3.02Å; F259-R264 HydrophobicContact CD1-CG 4.43Å; F259-R264 HydrophobicContact CE1-CG 4.15Å; F259-C872 PolarHBondContact N-SG 3.33Å; F259-M911 WeakPolarHBondContact CD2-O 3.34Å; F259-M911 WeakPolarHBondContact CE2-O 3.15Å; F259-F916 HydrophobicContact CB-CE2 4.5Å; F259-H940 AromaticContact CE2-CD2 3.76Å; F259-H940 AromaticContact CE2-NE2 3.55Å
260	I	96.5	Very high	93.2	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-61.4	-44.5	177.6	-61.9	166.5	0	0	0	110.8	V246 F249 M250 F255 E256 V257 P258 F262 R264 V268 L277	V246-I260 HydrophobicContact CG1-CD1 4.48Å; V246-I260 HydrophobicContact CG2-CG2 4.37Å; F249-I260 HydrophobicContact CB-CD1 3.61Å; F249-I260 HydrophobicContact CB-CG1 3.88Å; F249-I260 HydrophobicContact CD2-CG1 4.43Å; F249-I260 HydrophobicContact CD2-CG2 4.28Å; F249-I260 HydrophobicContact CG-CG1 4.39Å; M250-I260 HydrophobicContact CE-CD1 4.14Å; M250-I260 HydrophobicContact CG-CD1 3.78Å; F255-I260 HydrophobicContact CB-CD1 4.34Å; F255-I260 HydrophobicContact CB-CG1 3.95Å; E256-I260 WeakPolarHBondContact O-CG1 3.35Å; E256-I260 PolarHBondContact O-N 2.9Å; V257-I260 PolarHBondContact O-N 2.92Å; P258-I260 VanDerWaalsContact C-N 3.34Å; P258-I260 PolarHBondContact O-N 3.07Å; I260-F262 VanDerWaalsContact C-N 3.32Å; I260-F262 PolarHBondContact O-N 3.02Å; I260-R264 HydrophobicContact CG2-CB 4.3Å; I260-R264 CarbonylContact O-C 3.57Å; I260-R264 WeakPolarHBondContact O-CA 3.17Å; I260-R264 PolarHBondContact O-N 3.38Å; I260-R264 VanDerWaalsContact O-N 3.11Å; I260-V268 HydrophobicContact CG2-CG1 4.06Å; I260-L277 HydrophobicContact CB-CD1 4.47Å; I260-L277 HydrophobicContact CG2-CD1 4.09Å
261	A	94.8	Very high	92.7	Very high	11 Å²	11	29.4 Å²	29.4	9%	0.091	15%	0.145	C	C	.	.	H	α-helix	trans	-66.4	-29.9	-177.6	0	0	0	0	0	113.8	V257 P258 F259 K265 I274 L277	V257-A261 VanDerWaalsContact O-CB 3.29Å; V257-A261 WeakPolarHBondContact O-CB 3.46Å; V257-A261 PolarHBondContact O-N 3.27Å; P258-A261 PolarHBondContact O-N 3.07Å; F259-A261 VanDerWaalsContact C-N 3.34Å; F259-A261 PolarHBondContact O-N 3.31Å; A261-K265 WeakPolarHBondContact O-CE 3.28Å; A261-K265 WeakPolarHBondContact O-CG 3.44Å; A261-I274 HydrophobicContact CB-CB 4.2Å; A261-I274 HydrophobicContact CB-CD1 3.69Å; A261-I274 HydrophobicContact CB-CG1 3.78Å; A261-L277 HydrophobicContact CB-CD1 3.81Å
262	F	94	Very high	92.5	Very high	50 Å²	50	29.4 Å²	29.4	22%	0.219	15%	0.145	C	C	.	.	H	α-helix	trans	-101.9	-35.3	-176.4	-75.6	-83.7	0	0	0	113.5	P258 F259 I260 K265 I274 N849 E850 F916	P258-F262 VanDerWaalsContact O-CD2 3.24Å; P258-F262 WeakPolarHBondContact O-CD2 3.41Å; P258-F262 PolarHBondContact O-N 2.97Å; F259-F262 PolarHBondContact O-N 3.45Å; I260-F262 VanDerWaalsContact C-N 3.32Å; I260-F262 PolarHBondContact O-N 3.02Å; F262-K265 VanDerWaalsContact O-CE 3.26Å; F262-K265 WeakPolarHBondContact O-CE 3.26Å; F262-I274 HydrophobicContact CE2-CD1 4.31Å; F262-N849 HydrophobicContact CE2-CB 4.4Å; F262-E850 HydrophobicContact CE1-CB 4.31Å; F262-E850 HydrophobicContact CE1-CG 4.3Å; F262-E850 HydrophobicContact CZ-CB 3.79Å; F262-E850 HydrophobicContact CZ-CG 4.14Å; F262-F916 HydrophobicContact CB-CE1 3.84Å; F262-F916 HydrophobicContact CB-CZ 3.91Å; F262-F916 AromaticContact CD2-CE1 3.73Å; F262-F916 HydrophobicContact CD2-CE1 3.73Å; F262-F916 HydrophobicContact CD2-CZ 4.04Å; F262-F916 HydrophobicContact CE2-CE1 4.49Å; F262-F916 AromaticContact CG-CE1 3.82Å; F262-F916 HydrophobicContact CG-CE1 3.82Å; F262-F916 HydrophobicContact CG-CZ 4.23Å
263	Y	94.1	Very high	92.3	Very high	33 Å²	33	30.8 Å²	30.8	13%	0.129	16%	0.156	C	C	.	.	H	α-helix	trans	-121.7	3.3	-170.6	-59.6	-62.6	0	0	0	115.1	F259 G915 F916 R938 H940	F259-Y263 AromaticContact CD2-CD2 3.74Å; F259-Y263 HydrophobicContact CD2-CD2 3.74Å; F259-Y263 AromaticContact CE2-CD2 3.89Å; F259-Y263 HydrophobicContact CE2-CD2 3.89Å; F259-Y263 HydrophobicContact CE2-CG 4.34Å; F259-Y263 HydrophobicContact CG-CD2 4.39Å; F259-Y263 WeakPolarHBondContact O-CA 3.4Å; F259-Y263 WeakPolarHBondContact O-CB 3.27Å; F259-Y263 PolarHBondContact O-N 3.02Å; Y263-G915 WeakPolarHBondContact OH-CA 3.19Å; Y263-G915 PolarHBondContact OH-O 2.91Å; Y263-F916 HydrophobicContact CD2-CE2 4.16Å; Y263-F916 AromaticContact CD2-CZ 3.87Å; Y263-F916 HydrophobicContact CD2-CZ 3.87Å; Y263-F916 HydrophobicContact CE2-CD1 4.28Å; Y263-F916 HydrophobicContact CE2-CD2 4.25Å; Y263-F916 AromaticContact CE2-CE1 3.74Å; Y263-F916 HydrophobicContact CE2-CE1 3.74Å; Y263-F916 AromaticContact CE2-CE2 3.72Å; Y263-F916 HydrophobicContact CE2-CE2 3.72Å; Y263-F916 AromaticContact CE2-CZ 3.45Å; Y263-F916 HydrophobicContact CE2-CZ 3.45Å; Y263-F916 VanDerWaalsContact CE2-CZ 3.45Å; Y263-R938 WeakPolarHBondContact CE1-O 3.39Å; Y263-R938 PolarHBondContact OH-O 3.1Å; Y263-H940 HydrophobicContact CD1-CB 3.74Å; Y263-H940 HydrophobicContact CE1-CB 3.74Å; Y263-H940 HydrophobicContact CG-CB 4.23Å
264	R	93.1	Very high	92.3	Very high	29 Å²	29	33 Å²	33	11%	0.109	17%	0.167	C	C	.	.			trans	-132.1	34.9	171.3	-60.9	-67.3	-176.5	-94.5	4	111.5	E93 F249 F259 I260 E266 Y267	E93-R264 IonicContact OE1-CZ 2.9Å; E93-R264 IonicContact OE1-NH2 3.29Å; E93-R264 PolarHBondContact OE1-NH2 2.88Å; E93-R264 IonicContact OE2-NH2 2.65Å; E93-R264 PolarHBondContact OE2-NH2 2.85Å; F249-R264 HydrophobicContact CE1-CG 4.28Å; F249-R264 HydrophobicContact CE2-CB 4.11Å; F249-R264 HydrophobicContact CE2-CG 4.39Å; F249-R264 HydrophobicContact CZ-CB 4.27Å; F249-R264 HydrophobicContact CZ-CG 4.2Å; F259-R264 HydrophobicContact CD1-CG 4.43Å; F259-R264 HydrophobicContact CE1-CG 4.15Å; I260-R264 HydrophobicContact CG2-CB 4.3Å; I260-R264 CarbonylContact O-C 3.57Å; I260-R264 WeakPolarHBondContact O-CA 3.17Å; I260-R264 PolarHBondContact O-N 3.38Å; I260-R264 VanDerWaalsContact O-N 3.11Å; R264-E266 PolarHBondContact O-N 2.86Å; R264-Y267 HydrophobicContact CB-CD2 4.26Å; R264-Y267 PolarHBondContact O-N 2.86Å
265	K	91.2	Very high	92	Very high	29 Å²	29	33.6 Å²	33.6	13%	0.126	18%	0.178	C	C	.	.	G	3₁₀ helix	trans	-59.7	-31.1	-172.5	-73.6	177.9	-172.6	165.9	0	113.5	A261 F262 Y267 V268 Q269 I1001 D1005	A261-K265 WeakPolarHBondContact O-CE 3.28Å; A261-K265 WeakPolarHBondContact O-CG 3.44Å; F262-K265 VanDerWaalsContact O-CE 3.26Å; F262-K265 WeakPolarHBondContact O-CE 3.26Å; K265-Y267 PolarHBondContact O-N 2.94Å; K265-Y267 VanDerWaalsContact O-N 3.17Å; K265-V268 WeakPolarHBondContact O-CG2 3.48Å; K265-V268 PolarHBondContact O-N 3.44Å; K265-V268 VanDerWaalsContact O-N 3.07Å; K265-Q269 PolarHBondContact O-N 2.97Å; K265-I1001 HydrophobicContact CB-CB 4.38Å; K265-I1001 HydrophobicContact CB-CD1 4.27Å; K265-I1001 HydrophobicContact CB-CG2 3.84Å; K265-I1001 HydrophobicContact CD-CG2 3.82Å; K265-D1005 WeakPolarHBondContact CD-OD2 3.45Å; K265-D1005 WeakPolarHBondContact CE-OD2 3.17Å; K265-D1005 IonicContact NZ-OD1 2.69Å; K265-D1005 PolarHBondContact NZ-OD1 3.08Å; K265-D1005 IonicContact NZ-OD2 2.76Å; K265-D1005 PolarHBondContact NZ-OD2 3.27Å
266	E	90.9	Very high	91.8	Very high	29 Å²	29	35.2 Å²	35.2	14%	0.136	19%	0.187	C	C	.	.	G	3₁₀ helix	trans	-61.3	-24.3	-177.7	-63.5	81.5	-174.6	0	0	113.1	R264 N998 I1001 T1002	R264-E266 PolarHBondContact O-N 2.86Å; E266-N998 WeakPolarHBondContact CG-O 3.21Å; E266-I1001 HydrophobicContact CG-CB 4.23Å; E266-I1001 HydrophobicContact CG-CG1 4.4Å; E266-T1002 WeakPolarHBondContact OE1-CB 3.43Å; E266-T1002 PolarHBondContact OE1-N 3.35Å; E266-T1002 PolarHBondContact OE1-OG1 3.19Å
267	Y	91.3	Very high	91.8	Very high	77 Å²	77	35.3 Å²	35.3	30%	0.302	19%	0.187	S	C	.	.	G	3₁₀ helix	trans	-92.2	-10.8	-179.6	-61.9	-87.7	0	0	0	113.2	C242 F249 R264 K265	C242-Y267 PolarHBondContact SG-O 3.37Å; F249-Y267 HydrophobicContact CE2-CD1 4.42Å; F249-Y267 AromaticContact CE2-CD2 3.92Å; F249-Y267 HydrophobicContact CE2-CD2 3.92Å; F249-Y267 AromaticContact CE2-CG 3.81Å; F249-Y267 HydrophobicContact CE2-CG 3.81Å; F249-Y267 HydrophobicContact CZ-CD1 4.23Å; F249-Y267 AromaticContact CZ-CD2 3.66Å; F249-Y267 HydrophobicContact CZ-CD2 3.66Å; F249-Y267 HydrophobicContact CZ-CE1 4.45Å; F249-Y267 AromaticContact CZ-CE2 3.91Å; F249-Y267 HydrophobicContact CZ-CE2 3.91Å; F249-Y267 AromaticContact CZ-CG 3.83Å; F249-Y267 HydrophobicContact CZ-CG 3.83Å; R264-Y267 HydrophobicContact CB-CD2 4.26Å; R264-Y267 PolarHBondContact O-N 2.86Å; K265-Y267 PolarHBondContact O-N 2.94Å; K265-Y267 VanDerWaalsContact O-N 3.17Å
268	V	89	Confident	91.7	Very high	3 Å²	3	35.6 Å²	35.6	2%	0.018	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-127	-30.6	-169	-61	0	0	0	0	114.2	V246 I260 K265 E271 L272 L277	V246-V268 HydrophobicContact CG2-CG1 3.45Å; V246-V268 VanDerWaalsContact CG2-CG1 3.45Å; I260-V268 HydrophobicContact CG2-CG1 4.06Å; K265-V268 WeakPolarHBondContact O-CG2 3.48Å; K265-V268 PolarHBondContact O-N 3.44Å; K265-V268 VanDerWaalsContact O-N 3.07Å; V268-E271 PolarHBondContact O-N 3.38Å; V268-L272 HydrophobicContact CB-CB 4.31Å; V268-L272 PolarHBondContact O-N 3.39Å; V268-L277 HydrophobicContact CB-CD2 4.42Å; V268-L277 HydrophobicContact CG1-CD2 3.96Å
269	Q	85.6	Confident	91.4	Very high	92 Å²	92	38.4 Å²	38.4	43%	0.43	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95	146.3	-179.9	-69	-167.8	8.8	0	0	112.3	K265 I1001	K265-Q269 PolarHBondContact O-N 2.97Å; Q269-I1001 HydrophobicContact CB-CD1 4.2Å
270	P	84.7	Confident	91.3	Very high	118 Å²	118	38.4 Å²	38.4	77%	0.766	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	cis	-86.1	1.3	2.1	35.1	-37.6	0	0	0	115.2
271	E	85.1	Confident	91.2	Very high	60 Å²	60	39 Å²	39	28%	0.28	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-35	-167.4	-66.6	79.6	-173.8	0	0	114.5	Q238 I239 V268	Q238-E271 HydrophobicContact CB-CG 4.5Å; Q238-E271 HydrophobicContact CG-CG 3.81Å; Q238-E271 WeakPolarHBondContact CG-OE1 3.03Å; I239-E271 HydrophobicContact CG1-CB 4.36Å; V268-E271 PolarHBondContact O-N 3.38Å
272	L	89.3	Confident	91.1	Very high	7 Å²	7	40.5 Å²	40.5	4%	0.037	21%	0.21	C	C	.	.			trans	-119.9	137.2	-175.5	-60.5	-179.8	0	0	0	111.9	F210 I239 C242 V246 V268 D276 L277 I280	F210-L272 HydrophobicContact CZ-CD2 3.84Å; I239-L272 HydrophobicContact CG2-CD2 4.3Å; C242-L272 HydrophobicContact CB-CD1 3.59Å; C242-L272 HydrophobicContact CB-CG 4.07Å; V246-L272 HydrophobicContact CG2-CD1 4.28Å; V268-L272 HydrophobicContact CB-CB 4.31Å; V268-L272 PolarHBondContact O-N 3.39Å; L272-D276 HydrophobicContact CB-CB 4.33Å; L272-D276 HydrophobicContact CD2-CB 4.07Å; L272-L277 HydrophobicContact CB-CD2 4.37Å; L272-L277 HydrophobicContact CD1-CD2 4.1Å; L272-I280 HydrophobicContact CD1-CD1 3.88Å
273	T	90	Very high	91	Very high	83 Å²	83	41.4 Å²	41.4	51%	0.509	21%	0.211	S	C	.	.			trans	-91.5	163.9	169.9	70.8	0	0	0	0	111.2	G275 D276 L277	T273-G275 PolarHBondContact O-N 3.4Å; T273-G275 PolarHBondContact OG1-N 3.16Å; T273-D276 WeakPolarHBondContact CB-OD2 3.42Å; T273-D276 PolarHBondContact N-OD2 3.15Å; T273-D276 WeakPolarHBondContact O-CA 3.32Å; T273-D276 WeakPolarHBondContact O-CB 3.48Å; T273-D276 PolarHBondContact O-N 3.44Å; T273-D276 VanDerWaalsContact OG1-CG 3.31Å; T273-D276 PolarHBondContact OG1-N 3.14Å; T273-D276 PolarHBondContact OG1-OD2 3.14Å; T273-L277 PolarHBondContact O-N 3.2Å; T273-L277 VanDerWaalsContact O-N 3.09Å
274	I	91.5	Very high	91.1	Very high	53 Å²	53	39.8 Å²	39.8	27%	0.272	21%	0.205	S	C	.	.	H	α-helix	trans	-56.7	-32.2	173.2	-167.7	167.5	0	0	0	112.5	V257 A261 F262 D276 L277 W278 N846	V257-I274 HydrophobicContact CG1-CG1 4.02Å; A261-I274 HydrophobicContact CB-CB 4.2Å; A261-I274 HydrophobicContact CB-CD1 3.69Å; A261-I274 HydrophobicContact CB-CG1 3.78Å; F262-I274 HydrophobicContact CE2-CD1 4.31Å; I274-D276 VanDerWaalsContact C-N 3.33Å; I274-L277 WeakPolarHBondContact O-CB 3.48Å; I274-L277 PolarHBondContact O-N 2.9Å; I274-W278 PolarHBondContact O-N 2.65Å; I274-W278 VanDerWaalsContact O-N 3.15Å; I274-N846 HydrophobicContact CD1-CB 4.39Å; I274-N846 VanDerWaalsContact CD1-OD1 3.27Å; I274-N846 WeakPolarHBondContact CD1-OD1 3.31Å
275	G	89	Confident	91.2	Very high	31 Å²	31	40 Å²	40	32%	0.32	21%	0.208	S	C	.	.	H	α-helix	trans	-65.2	-36.6	173.8	0	0	0	0	0	112.6	T273 W278 N279	T273-G275 PolarHBondContact O-N 3.4Å; T273-G275 PolarHBondContact OG1-N 3.16Å; G275-W278 PolarHBondContact O-N 3.43Å; G275-N279 VanDerWaalsContact O-CG 3.31Å; G275-N279 PolarHBondContact O-N 2.71Å; G275-N279 PolarHBondContact O-ND2 3.46Å; G275-N279 VanDerWaalsContact O-ND2 3.12Å
276	D	91.1	Very high	91.3	Very high	35 Å²	35	42 Å²	42	19%	0.187	22%	0.216	C	C	.	.	H	α-helix	trans	-68.6	-37.2	175.3	-57.3	-51.7	0	0	0	111.5	F210 L272 T273 I274 W278 N279 I280	F210-D276 HydrophobicContact CZ-CB 4.43Å; L272-D276 HydrophobicContact CB-CB 4.33Å; L272-D276 HydrophobicContact CD2-CB 4.07Å; T273-D276 WeakPolarHBondContact CB-OD2 3.42Å; T273-D276 PolarHBondContact N-OD2 3.15Å; T273-D276 WeakPolarHBondContact O-CA 3.32Å; T273-D276 WeakPolarHBondContact O-CB 3.48Å; T273-D276 PolarHBondContact O-N 3.44Å; T273-D276 VanDerWaalsContact OG1-CG 3.31Å; T273-D276 PolarHBondContact OG1-N 3.14Å; T273-D276 PolarHBondContact OG1-OD2 3.14Å; I274-D276 VanDerWaalsContact C-N 3.33Å; D276-W278 PolarHBondContact O-N 2.66Å; D276-N279 CarbonylContact O-C 3.56Å; D276-N279 WeakPolarHBondContact O-CB 3.46Å; D276-N279 PolarHBondContact O-N 2.74Å; D276-N279 VanDerWaalsContact O-N 3.14Å; D276-I280 VanDerWaalsContact O-CG1 3.3Å; D276-I280 WeakPolarHBondContact O-CG1 3.41Å; D276-I280 PolarHBondContact O-N 3.04Å
277	L	95	Very high	91.4	Very high	1 Å²	1	41.8 Å²	41.8	1%	0.005	21%	0.214	C	C	.	.	H	α-helix	trans	-61	-43.1	174.5	-58.9	-178.1	0	0	0	112.1	V246 V257 I260 A261 V268 L272 T273 I274 I280 Y281	V246-L277 HydrophobicContact CB-CD2 4.44Å; V246-L277 HydrophobicContact CG1-CD2 4.01Å; V246-L277 HydrophobicContact CG2-CD2 3.51Å; V257-L277 HydrophobicContact CG1-CB 3.56Å; V257-L277 HydrophobicContact CG1-CD1 4.3Å; V257-L277 HydrophobicContact CG2-CB 4.28Å; I260-L277 HydrophobicContact CB-CD1 4.47Å; I260-L277 HydrophobicContact CG2-CD1 4.09Å; A261-L277 HydrophobicContact CB-CD1 3.81Å; V268-L277 HydrophobicContact CB-CD2 4.42Å; V268-L277 HydrophobicContact CG1-CD2 3.96Å; L272-L277 HydrophobicContact CB-CD2 4.37Å; L272-L277 HydrophobicContact CD1-CD2 4.1Å; T273-L277 PolarHBondContact O-N 3.2Å; T273-L277 VanDerWaalsContact O-N 3.09Å; I274-L277 WeakPolarHBondContact O-CB 3.48Å; I274-L277 PolarHBondContact O-N 2.9Å; L277-I280 HydrophobicContact CD2-CD1 4.39Å; L277-I280 WeakPolarHBondContact O-CB 3.33Å; L277-I280 PolarHBondContact O-N 3.18Å; L277-Y281 PolarHBondContact O-N 2.81Å
278	W	94.8	Very high	91.6	Very high	6 Å²	6	38.7 Å²	38.7	2%	0.023	20%	0.204	C	C	.	.	H	α-helix	trans	-64.1	-40	172.7	-73.7	119.6	0	0	0	112.3	V257 P258 I274 G275 D276 I280 Y281 Y282 L842 I845 N846	V257-W278 HydrophobicContact CB-CD2 3.73Å; V257-W278 HydrophobicContact CB-CE3 3.86Å; V257-W278 HydrophobicContact CB-CG 4.45Å; V257-W278 HydrophobicContact CB-CH2 3.81Å; V257-W278 HydrophobicContact CB-CZ2 3.68Å; V257-W278 HydrophobicContact CB-CZ3 3.89Å; V257-W278 HydrophobicContact CG1-CD2 3.58Å; V257-W278 HydrophobicContact CG1-CE3 4.23Å; V257-W278 HydrophobicContact CG1-CG 3.84Å; V257-W278 HydrophobicContact CG1-CH2 4.5Å; V257-W278 HydrophobicContact CG1-CZ2 3.91Å; V257-W278 HydrophobicContact CG2-CD2 3.81Å; V257-W278 HydrophobicContact CG2-CE3 3.59Å; V257-W278 HydrophobicContact CG2-CG 4.46Å; V257-W278 HydrophobicContact CG2-CH2 4.28Å; V257-W278 HydrophobicContact CG2-CZ2 4.48Å; V257-W278 HydrophobicContact CG2-CZ3 3.83Å; P258-W278 HydrophobicContact CG-CZ2 3.99Å; I274-W278 PolarHBondContact O-N 2.65Å; I274-W278 VanDerWaalsContact O-N 3.15Å; G275-W278 PolarHBondContact O-N 3.43Å; D276-W278 PolarHBondContact O-N 2.66Å; W278-I280 VanDerWaalsContact C-N 3.29Å; W278-I280 PolarHBondContact O-N 3.46Å; W278-Y281 AromaticContact CE3-CD1 4Å; W278-Y281 HydrophobicContact CE3-CD1 4Å; W278-Y281 HydrophobicContact CE3-CG 4.32Å; W278-Y281 HydrophobicContact CZ3-CD1 4.18Å; W278-Y281 HydrophobicContact CZ3-CE1 4.38Å; W278-Y281 WeakPolarHBondContact O-CB 3.47Å; W278-Y281 PolarHBondContact O-N 2.98Å; W278-Y282 HydrophobicContact CB-CE2 4.17Å; W278-Y282 WeakPolarHBondContact O-CD2 3.4Å; W278-Y282 WeakPolarHBondContact O-CE2 3.48Å; W278-Y282 PolarHBondContact O-N 2.86Å; W278-L842 HydrophobicContact CB-CD2 4.04Å; W278-L842 HydrophobicContact CD2-CD1 3.37Å; W278-L842 HydrophobicContact CD2-CD2 4.13Å; W278-L842 HydrophobicContact CD2-CG 4.1Å; W278-L842 HydrophobicContact CE3-CD1 3.69Å; W278-L842 HydrophobicContact CG-CD1 3.9Å; W278-L842 HydrophobicContact CG-CD2 3.72Å; W278-L842 HydrophobicContact CG-CG 4.12Å; W278-L842 HydrophobicContact CH2-CD1 3.81Å; W278-L842 HydrophobicContact CZ2-CD1 3.48Å; W278-L842 VanDerWaalsContact CZ2-CD1 3.48Å; W278-L842 HydrophobicContact CZ2-CG 4.47Å; W278-L842 HydrophobicContact CZ3-CD1 3.9Å; W278-I845 HydrophobicContact CH2-CG2 4.38Å; W278-I845 HydrophobicContact CZ2-CG2 3.88Å; W278-N846 PolarHBondContact NE1-OD1 2.79Å
279	N	91.5	Very high	91.8	Very high	59 Å²	59	40.9 Å²	40.9	32%	0.316	21%	0.214	S	C	.	.	H	α-helix	trans	-60.9	-40	173.8	-69.7	-40.8	0	0	0	111.5	L209 G275 D276 Y282 R283	L209-N279 HydrophobicContact CD1-CB 3.81Å; L209-N279 HydrophobicContact CD2-CB 3.61Å; L209-N279 HydrophobicContact CG-CB 4.38Å; G275-N279 VanDerWaalsContact O-CG 3.31Å; G275-N279 PolarHBondContact O-N 2.71Å; G275-N279 PolarHBondContact O-ND2 3.46Å; G275-N279 VanDerWaalsContact O-ND2 3.12Å; D276-N279 CarbonylContact O-C 3.56Å; D276-N279 WeakPolarHBondContact O-CB 3.46Å; D276-N279 PolarHBondContact O-N 2.74Å; D276-N279 VanDerWaalsContact O-N 3.14Å; N279-Y282 PolarHBondContact O-N 3.48Å; N279-R283 WeakPolarHBondContact O-CB 3.5Å; N279-R283 WeakPolarHBondContact O-CG 3.41Å; N279-R283 PolarHBondContact O-N 3.39Å
280	I	94.1	Very high	92.2	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-61.4	-47.8	174.6	-67.4	161.9	0	0	0	110.2	I205 L209 V243 V246 L247 L272 D276 L277 W278 Y282 R283 D284	I205-I280 HydrophobicContact CD1-CG2 4.13Å; I205-I280 HydrophobicContact CG2-CG1 4.17Å; L209-I280 HydrophobicContact CD2-CG1 4.39Å; V243-I280 HydrophobicContact CB-CD1 4.43Å; V243-I280 HydrophobicContact CG1-CD1 4.35Å; V243-I280 HydrophobicContact CG1-CG1 4.37Å; V243-I280 HydrophobicContact CG1-CG2 4.29Å; V243-I280 HydrophobicContact CG2-CD1 3.87Å; V243-I280 HydrophobicContact CG2-CG1 4.35Å; V246-I280 HydrophobicContact CB-CD1 4.47Å; V246-I280 HydrophobicContact CG1-CB 4.41Å; V246-I280 HydrophobicContact CG1-CD1 4.17Å; V246-I280 HydrophobicContact CG1-CG2 3.87Å; L247-I280 HydrophobicContact CD2-CG2 3.85Å; L247-I280 HydrophobicContact CG-CG2 4.27Å; L272-I280 HydrophobicContact CD1-CD1 3.88Å; D276-I280 VanDerWaalsContact O-CG1 3.3Å; D276-I280 WeakPolarHBondContact O-CG1 3.41Å; D276-I280 PolarHBondContact O-N 3.04Å; L277-I280 HydrophobicContact CD2-CD1 4.39Å; L277-I280 WeakPolarHBondContact O-CB 3.33Å; L277-I280 PolarHBondContact O-N 3.18Å; W278-I280 VanDerWaalsContact C-N 3.29Å; W278-I280 PolarHBondContact O-N 3.46Å; I280-Y282 VanDerWaalsContact C-N 3.34Å; I280-Y282 PolarHBondContact O-N 3.24Å; I280-R283 CarbonylContact O-C 3.49Å; I280-R283 PolarHBondContact O-N 3.08Å; I280-D284 PolarHBondContact O-N 2.89Å
281	Y	94.9	Very high	92.6	Very high	13 Å²	13	34 Å²	34	5%	0.051	17%	0.17	C	C	.	.	H	α-helix	trans	-53.5	-45.8	176.6	171.6	-101.8	0	0	0	113.2	R182 F183 R186 M250 L277 W278 R283 E285	R182-Y281 PolarHBondContact O-OH 2.89Å; F183-Y281 AromaticContact CD1-CE2 3.62Å; F183-Y281 HydrophobicContact CD1-CE2 3.62Å; F183-Y281 HydrophobicContact CE1-CD2 4Å; F183-Y281 AromaticContact CE1-CE2 3.41Å; F183-Y281 HydrophobicContact CE1-CE2 3.41Å; F183-Y281 VanDerWaalsContact CE1-CE2 3.41Å; F183-Y281 HydrophobicContact CZ-CE2 4.5Å; R186-Y281 WeakPolarHBondContact CD-OH 3.38Å; R186-Y281 WeakPolarHBondContact CG-OH 3.44Å; R186-Y281 VanDerWaalsContact NH1-CE2 3.28Å; M250-Y281 HydrophobicContact SD-CD2 3.96Å; M250-Y281 HydrophobicContact SD-CG 4.46Å; L277-Y281 PolarHBondContact O-N 2.81Å; W278-Y281 AromaticContact CE3-CD1 4Å; W278-Y281 HydrophobicContact CE3-CD1 4Å; W278-Y281 HydrophobicContact CE3-CG 4.32Å; W278-Y281 HydrophobicContact CZ3-CD1 4.18Å; W278-Y281 HydrophobicContact CZ3-CE1 4.38Å; W278-Y281 WeakPolarHBondContact O-CB 3.47Å; W278-Y281 PolarHBondContact O-N 2.98Å; Y281-R283 VanDerWaalsContact C-N 3.35Å; Y281-E285 PolarHBondContact O-N 3.07Å
282	Y	92.8	Very high	92.9	Very high	43 Å²	43	34.2 Å²	34.2	17%	0.169	18%	0.178	C	C	.	.	H	α-helix	trans	-73.2	-27.5	177.3	-62.9	-57.7	0	0	0	113.2	W278 N279 I280 K286 R838	W278-Y282 HydrophobicContact CB-CE2 4.17Å; W278-Y282 WeakPolarHBondContact O-CD2 3.4Å; W278-Y282 WeakPolarHBondContact O-CE2 3.48Å; W278-Y282 PolarHBondContact O-N 2.86Å; N279-Y282 PolarHBondContact O-N 3.48Å; I280-Y282 VanDerWaalsContact C-N 3.34Å; I280-Y282 PolarHBondContact O-N 3.24Å; Y282-K286 PolarHBondContact O-N 3.41Å; Y282-R838 PolarHBondContact OH-NH1 2.84Å
283	R	93.2	Very high	93.1	Very high	68 Å²	68	40.6 Å²	40.6	26%	0.257	20%	0.202	S	C	.	.	H	α-helix	trans	-76	-33.5	176.9	-68.9	-71	179.1	-172.7	1.3	111.7	W204 I205 N279 I280 Y281 E285 K286 W287	W204-R283 HydrophobicContact CZ3-CB 4.23Å; W204-R283 WeakPolarHBondContact CZ3-O 3.26Å; I205-R283 HydrophobicContact CB-CB 4.43Å; I205-R283 HydrophobicContact CD1-CB 3.94Å; I205-R283 HydrophobicContact CG1-CB 3.83Å; I205-R283 HydrophobicContact CG2-CB 4Å; I205-R283 HydrophobicContact CG2-CG 4.43Å; N279-R283 WeakPolarHBondContact O-CB 3.5Å; N279-R283 WeakPolarHBondContact O-CG 3.41Å; N279-R283 PolarHBondContact O-N 3.39Å; I280-R283 CarbonylContact O-C 3.49Å; I280-R283 PolarHBondContact O-N 3.08Å; Y281-R283 VanDerWaalsContact C-N 3.35Å; R283-E285 VanDerWaalsContact C-N 3.35Å; R283-K286 PolarHBondContact O-N 3.33Å; R283-W287 WeakPolarHBondContact O-CB 3.3Å; R283-W287 PolarHBondContact O-N 2.93Å
284	D	95.6	Very high	93.3	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-56.5	-47.9	168.6	158.2	57	0	0	0	110.9	R186 E201 L247 R251 I280 K286 W287 C288	R186-D284 IonicContact CZ-OD2 3.77Å; R186-D284 IonicContact NH1-OD2 3.32Å; R186-D284 PolarHBondContact NH1-OD2 2.97Å; R186-D284 IonicContact NH2-OD2 2.72Å; R186-D284 PolarHBondContact NH2-OD2 3.49Å; E201-D284 WeakPolarHBondContact OE1-CA 3.25Å; E201-D284 WeakPolarHBondContact OE1-CB 3.48Å; L247-D284 HydrophobicContact CD2-CB 4Å; R251-D284 WeakPolarHBondContact CD-OD1 3.4Å; R251-D284 IonicContact NE-OD1 3.72Å; I280-D284 PolarHBondContact O-N 2.89Å; D284-K286 VanDerWaalsContact C-N 3.34Å; D284-K286 PolarHBondContact O-N 3.19Å; D284-W287 WeakPolarHBondContact O-CB 3.48Å; D284-W287 PolarHBondContact O-N 3.36Å; D284-W287 VanDerWaalsContact O-N 3.1Å; D284-C288 PolarHBondContact O-N 2.99Å; D284-C288 PolarHBondContact O-SG 2.68Å; D284-C288 PolarHBondContact OD1-SG 2.72Å; D284-C288 VanDerWaalsContact OD1-SG 3.4Å
285	E	94.5	Very high	93.3	Very high	34 Å²	34	41 Å²	41	16%	0.159	20%	0.197	C	C	.	.	H	α-helix	trans	-58.2	-46.1	176.8	-167.8	179.5	-153.6	0	0	112.3	S187 V188 Y281 R283 W287 C288 Q289	S187-E285 WeakPolarHBondContact CB-OE1 3.34Å; S187-E285 PolarHBondContact N-OE1 2.87Å; S187-E285 PolarHBondContact OG-OE1 2.9Å; V188-E285 HydrophobicContact CB-CG 4.24Å; V188-E285 PolarHBondContact N-OE1 3.16Å; Y281-E285 PolarHBondContact O-N 3.07Å; R283-E285 VanDerWaalsContact C-N 3.35Å; E285-W287 VanDerWaalsContact C-N 3.32Å; E285-W287 PolarHBondContact O-N 3.38Å; E285-C288 PolarHBondContact O-N 3Å; E285-Q289 VanDerWaalsContact O-CG 3.32Å; E285-Q289 WeakPolarHBondContact O-CG 3.34Å; E285-Q289 PolarHBondContact O-N 3.42Å
286	K	92.7	Very high	93.4	Very high	69 Å²	69	41.5 Å²	41.5	30%	0.3	20%	0.195	S	C	.	.	H	α-helix	trans	-63.8	-37.4	176.5	-71.4	-173.4	177.9	-172.6	0	112.1	W204 Y282 R283 D284 Q289 L290 F341 E606	W204-K286 HydrophobicContact CH2-CB 4.07Å; Y282-K286 PolarHBondContact O-N 3.41Å; R283-K286 PolarHBondContact O-N 3.33Å; D284-K286 VanDerWaalsContact C-N 3.34Å; D284-K286 PolarHBondContact O-N 3.19Å; K286-Q289 PolarHBondContact O-N 3.45Å; K286-L290 WeakPolarHBondContact O-CB 3.5Å; K286-L290 PolarHBondContact O-N 3.39Å; K286-F341 WeakPolarHBondContact O-CZ 3.25Å; K286-E606 IonicContact NZ-OE1 3.22Å
287	W	94.8	Very high	93.5	Very high	26 Å²	26	40 Å²	40	10%	0.098	19%	0.187	C	C	.	.	H	α-helix	trans	-66.8	-44.4	177	177.8	92.2	0	0	0	111.2	E197 E201 W204 R283 D284 E285 Q289 L290 K291	E197-W287 VanDerWaalsContact CD-CH2 3.43Å; E197-W287 HydrophobicContact CG-CH2 3.25Å; E197-W287 HydrophobicContact CG-CZ2 3.79Å; E197-W287 HydrophobicContact CG-CZ3 4.11Å; E197-W287 WeakPolarHBondContact OE1-CH2 3.48Å; E197-W287 VanDerWaalsContact OE1-CZ3 3.24Å; E197-W287 WeakPolarHBondContact OE1-CZ3 3.26Å; E201-W287 HydrophobicContact CB-CD2 3.85Å; E201-W287 HydrophobicContact CB-CE3 4.37Å; E201-W287 HydrophobicContact CB-CG 4.18Å; E201-W287 HydrophobicContact CB-CZ2 4.11Å; E201-W287 HydrophobicContact CG-CB 4.16Å; E201-W287 HydrophobicContact CG-CD2 3.56Å; E201-W287 HydrophobicContact CG-CE3 3.98Å; E201-W287 HydrophobicContact CG-CG 3.61Å; W204-W287 AromaticContact CD2-CD1 3.89Å; W204-W287 HydrophobicContact CE3-CB 3.84Å; W204-W287 AromaticContact CE3-CD1 3.9Å; W204-W287 HydrophobicContact CE3-CG 4.26Å; W204-W287 AromaticContact CG-CD1 3.94Å; W204-W287 HydrophobicContact CZ3-CB 3.86Å; R283-W287 WeakPolarHBondContact O-CB 3.3Å; R283-W287 PolarHBondContact O-N 2.93Å; D284-W287 WeakPolarHBondContact O-CB 3.48Å; D284-W287 PolarHBondContact O-N 3.36Å; D284-W287 VanDerWaalsContact O-N 3.1Å; E285-W287 VanDerWaalsContact C-N 3.32Å; E285-W287 PolarHBondContact O-N 3.38Å; W287-Q289 VanDerWaalsContact C-N 3.33Å; W287-Q289 PolarHBondContact O-N 2.89Å; W287-L290 WeakPolarHBondContact O-CB 3.42Å; W287-L290 PolarHBondContact O-N 3.15Å; W287-L290 VanDerWaalsContact O-N 3.12Å; W287-K291 HydrophobicContact CH2-CB 4.21Å; W287-K291 HydrophobicContact CH2-CD 3.24Å; W287-K291 HydrophobicContact CH2-CG 4.31Å; W287-K291 HydrophobicContact CZ2-CB 4.44Å; W287-K291 HydrophobicContact CZ2-CD 3.92Å; W287-K291 HydrophobicContact CZ3-CB 4.39Å; W287-K291 HydrophobicContact CZ3-CD 3.82Å; W287-K291 PolarHBondContact O-N 3.4Å
288	C	94.3	Very high	93.4	Very high	12 Å²	12	43.1 Å²	43.1	8%	0.081	20%	0.201	C	C	.	.	H	α-helix	trans	-60.2	-42.7	175.4	-74.2	0	0	0	0	111.5	V188 D284 E285 L290 K291 S292	V188-C288 HydrophobicContact CG1-CB 3.84Å; D284-C288 PolarHBondContact O-N 2.99Å; D284-C288 PolarHBondContact O-SG 2.68Å; D284-C288 PolarHBondContact OD1-SG 2.72Å; D284-C288 VanDerWaalsContact OD1-SG 3.4Å; E285-C288 PolarHBondContact O-N 3Å; C288-L290 PolarHBondContact O-N 3.25Å; C288-K291 PolarHBondContact O-N 3.31Å; C288-S292 WeakPolarHBondContact O-CB 3.4Å; C288-S292 PolarHBondContact O-N 3.32Å
289	Q	93.3	Very high	93.1	Very high	49 Å²	49	44.6 Å²	44.6	23%	0.229	22%	0.215	C	C	.	.	H	α-helix	trans	-61.1	-43.1	173.5	-72	174.4	6.3	0	0	112.1	S187 V188 E285 K286 W287 R293 F341	S187-Q289 PolarHBondContact OG-NE2 3.02Å; V188-Q289 HydrophobicContact CG2-CG 3.47Å; V188-Q289 VanDerWaalsContact CG2-CG 3.47Å; E285-Q289 VanDerWaalsContact O-CG 3.32Å; E285-Q289 WeakPolarHBondContact O-CG 3.34Å; E285-Q289 PolarHBondContact O-N 3.42Å; K286-Q289 PolarHBondContact O-N 3.45Å; W287-Q289 VanDerWaalsContact C-N 3.33Å; W287-Q289 PolarHBondContact O-N 2.89Å; Q289-R293 WeakPolarHBondContact O-CB 3.34Å; Q289-R293 VanDerWaalsContact O-CG 3.3Å; Q289-R293 WeakPolarHBondContact O-CG 3.38Å; Q289-R293 PolarHBondContact O-N 3.29Å; Q289-R293 VanDerWaalsContact O-N 3.09Å; Q289-F341 HydrophobicContact CB-CE1 4.15Å; Q289-F341 HydrophobicContact CB-CZ 3.88Å
290	L	93.6	Very high	93	Very high	4 Å²	4	42 Å²	42	2%	0.021	20%	0.201	C	C	.	.	H	α-helix	trans	-64.5	-45.3	178.2	-179.6	63.1	0	0	0	111.2	W204 K286 W287 C288 R293 K294 F341 L344	W204-L290 HydrophobicContact CZ2-CD2 4.26Å; K286-L290 WeakPolarHBondContact O-CB 3.5Å; K286-L290 PolarHBondContact O-N 3.39Å; W287-L290 WeakPolarHBondContact O-CB 3.42Å; W287-L290 PolarHBondContact O-N 3.15Å; W287-L290 VanDerWaalsContact O-N 3.12Å; C288-L290 PolarHBondContact O-N 3.25Å; L290-R293 PolarHBondContact O-N 2.96Å; L290-K294 HydrophobicContact CG-CD 4.5Å; L290-K294 VanDerWaalsContact O-CG 3.32Å; L290-K294 WeakPolarHBondContact O-CG 3.5Å; L290-K294 PolarHBondContact O-N 2.97Å; L290-F341 HydrophobicContact CB-CE1 4.02Å; L290-F341 HydrophobicContact CB-CZ 4.02Å; L290-F341 HydrophobicContact CD1-CD1 4.08Å; L290-F341 HydrophobicContact CD1-CE1 4.23Å; L290-F341 HydrophobicContact CD1-CG 4.49Å; L290-L344 HydrophobicContact CD1-CD2 4.17Å
291	K	92.7	Very high	92.8	Very high	61 Å²	61	42 Å²	42	27%	0.265	20%	0.201	S	C	.	.	H	α-helix	trans	-59.8	-52.4	176.9	174.6	175.3	165	-166	0	111.3	E197 W287 C288 R293 K294 E295	E197-K291 IonicContact OE1-NZ 2.75Å; E197-K291 PolarHBondContact OE1-NZ 2.78Å; E197-K291 IonicContact OE2-NZ 3.5Å; E197-K291 PolarHBondContact OE2-NZ 3.49Å; W287-K291 HydrophobicContact CH2-CB 4.21Å; W287-K291 HydrophobicContact CH2-CD 3.24Å; W287-K291 HydrophobicContact CH2-CG 4.31Å; W287-K291 HydrophobicContact CZ2-CB 4.44Å; W287-K291 HydrophobicContact CZ2-CD 3.92Å; W287-K291 HydrophobicContact CZ3-CB 4.39Å; W287-K291 HydrophobicContact CZ3-CD 3.82Å; W287-K291 PolarHBondContact O-N 3.4Å; C288-K291 PolarHBondContact O-N 3.31Å; K291-R293 VanDerWaalsContact C-N 3.3Å; K291-R293 PolarHBondContact O-N 2.85Å; K291-K294 WeakPolarHBondContact O-CB 3.47Å; K291-K294 PolarHBondContact O-N 3.45Å; K291-E295 WeakPolarHBondContact CE-OE1 3.47Å; K291-E295 HydrophobicContact CG-CG 4.47Å; K291-E295 WeakPolarHBondContact CG-OE1 3.1Å; K291-E295 WeakPolarHBondContact O-CG 3.28Å; K291-E295 PolarHBondContact O-N 3.46Å
292	S	91.7	Very high	92.6	Very high	64 Å²	64	46.6 Å²	46.6	45%	0.448	22%	0.221	S	C	.	.	H	α-helix	trans	-56	-45.4	179.2	173.8	0	0	0	0	111.6	C288 K294 E295 S296	C288-S292 WeakPolarHBondContact O-CB 3.4Å; C288-S292 PolarHBondContact O-N 3.32Å; S292-K294 PolarHBondContact O-N 3.03Å; S292-E295 PolarHBondContact O-N 3.48Å; S292-S296 PolarHBondContact O-N 2.91Å; S292-S296 PolarHBondContact O-OG 2.97Å; S292-S296 VanDerWaalsContact O-OG 3.08Å
293	R	93.2	Very high	92.4	Very high	141 Å²	141	44.8 Å²	44.8	53%	0.532	22%	0.215	S	C	.	.	H	α-helix	trans	-66.7	-34.9	177.7	-69.5	-178.7	-175.8	-175.9	3.8	113.3	Q289 L290 K291 L297 L344	Q289-R293 WeakPolarHBondContact O-CB 3.34Å; Q289-R293 VanDerWaalsContact O-CG 3.3Å; Q289-R293 WeakPolarHBondContact O-CG 3.38Å; Q289-R293 PolarHBondContact O-N 3.29Å; Q289-R293 VanDerWaalsContact O-N 3.09Å; L290-R293 PolarHBondContact O-N 2.96Å; K291-R293 VanDerWaalsContact C-N 3.3Å; K291-R293 PolarHBondContact O-N 2.85Å; R293-L297 WeakPolarHBondContact O-CB 3.26Å; R293-L297 PolarHBondContact O-N 2.83Å; R293-L344 HydrophobicContact CB-CD2 3.5Å; R293-L344 VanDerWaalsContact CB-CD2 3.5Å
294	K	94.2	Very high	92.2	Very high	38 Å²	38	41.6 Å²	41.6	17%	0.165	20%	0.203	C	C	.	.	H	α-helix	trans	-63	-46.2	173.2	-77.8	175.3	172.4	-167.8	0	111.1	L290 K291 S292 L297 H298 V335 T336 A338 L344	L290-K294 HydrophobicContact CG-CD 4.5Å; L290-K294 VanDerWaalsContact O-CG 3.32Å; L290-K294 WeakPolarHBondContact O-CG 3.5Å; L290-K294 PolarHBondContact O-N 2.97Å; K291-K294 WeakPolarHBondContact O-CB 3.47Å; K291-K294 PolarHBondContact O-N 3.45Å; S292-K294 PolarHBondContact O-N 3.03Å; K294-L297 PolarHBondContact O-N 2.91Å; K294-H298 VanDerWaalsContact O-CB 3.27Å; K294-H298 WeakPolarHBondContact O-CB 3.42Å; K294-H298 PolarHBondContact O-N 2.86Å; K294-V335 HydrophobicContact CB-CG1 4.46Å; K294-T336 PolarHBondContact NZ-O 2.8Å; K294-A338 WeakPolarHBondContact CE-O 3.49Å; K294-A338 PolarHBondContact NZ-O 3.26Å; K294-L344 HydrophobicContact CG-CD1 3.9Å; K294-L344 HydrophobicContact CG-CD2 4.19Å
295	E	93.3	Very high	91.9	Very high	108 Å²	108	44 Å²	44	51%	0.505	21%	0.214	S	C	.	.	H	α-helix	trans	-61.8	-44.4	179	-70.9	169.5	170.4	0	0	110.9	K291 S292 L297 H298 A299	K291-E295 WeakPolarHBondContact CE-OE1 3.47Å; K291-E295 HydrophobicContact CG-CG 4.47Å; K291-E295 WeakPolarHBondContact CG-OE1 3.1Å; K291-E295 WeakPolarHBondContact O-CG 3.28Å; K291-E295 PolarHBondContact O-N 3.46Å; S292-E295 PolarHBondContact O-N 3.48Å; E295-L297 PolarHBondContact O-N 3.46Å; E295-H298 PolarHBondContact O-N 3.16Å; E295-A299 WeakPolarHBondContact O-CB 3.28Å; E295-A299 PolarHBondContact O-N 3.09Å
296	S	91	Very high	91.6	Very high	40 Å²	40	45.3 Å²	45.3	28%	0.28	22%	0.22	S	C	.	.	H	α-helix	trans	-60.8	-42.6	174.2	-54.1	0	0	0	0	112.5	S292 A299 L300	S292-S296 PolarHBondContact O-N 2.91Å; S292-S296 PolarHBondContact O-OG 2.97Å; S292-S296 VanDerWaalsContact O-OG 3.08Å; S296-A299 PolarHBondContact O-N 3.06Å; S296-L300 PolarHBondContact O-N 3.48Å; S296-L300 VanDerWaalsContact O-N 3.09Å
297	L	91.8	Very high	91.3	Very high	4 Å²	4	43.5 Å²	43.5	2%	0.021	21%	0.212	C	C	.	.	H	α-helix	trans	-67.4	-41.8	177.9	-172.6	60.5	0	0	0	111.6	R293 K294 E295 L300 F301 V335 L344 L347 Y348	R293-L297 WeakPolarHBondContact O-CB 3.26Å; R293-L297 PolarHBondContact O-N 2.83Å; K294-L297 PolarHBondContact O-N 2.91Å; E295-L297 PolarHBondContact O-N 3.46Å; L297-L300 WeakPolarHBondContact O-CB 3.35Å; L297-L300 PolarHBondContact O-N 2.74Å; L297-F301 HydrophobicContact CD1-CD2 4.03Å; L297-F301 HydrophobicContact CD1-CE2 3.57Å; L297-F301 HydrophobicContact CD2-CE2 4.24Å; L297-F301 HydrophobicContact CG-CD2 4.08Å; L297-F301 HydrophobicContact CG-CE2 3.68Å; L297-F301 HydrophobicContact CG-CZ 4.46Å; L297-F301 WeakPolarHBondContact O-CD2 3.43Å; L297-F301 PolarHBondContact O-N 2.97Å; L297-V335 HydrophobicContact CB-CG1 4.26Å; L297-V335 HydrophobicContact CD2-CG1 4.16Å; L297-V335 HydrophobicContact CD2-CG2 3.98Å; L297-V335 HydrophobicContact CG-CG1 4.33Å; L297-V335 HydrophobicContact CG-CG2 4.28Å; L297-L344 HydrophobicContact CB-CD1 4.46Å; L297-L344 HydrophobicContact CD2-CD1 3.51Å; L297-L344 HydrophobicContact CD2-CG 4.2Å; L297-L347 HydrophobicContact CD2-CB 4.15Å; L297-Y348 HydrophobicContact CD1-CD2 3.71Å; L297-Y348 HydrophobicContact CD1-CG 4.46Å
298	H	92.7	Very high	90.8	Very high	67 Å²	67	42.8 Å²	42.8	31%	0.31	21%	0.21	S	C	.	.	H	α-helix	trans	-63.5	-40.9	177.1	-170.8	-67.9	0	0	0	111.5	K294 E295 L300 F301 K302 F332 V335	K294-H298 VanDerWaalsContact O-CB 3.27Å; K294-H298 WeakPolarHBondContact O-CB 3.42Å; K294-H298 PolarHBondContact O-N 2.86Å; E295-H298 PolarHBondContact O-N 3.16Å; H298-L300 VanDerWaalsContact C-N 3.31Å; H298-L300 PolarHBondContact O-N 3.32Å; H298-F301 PolarHBondContact O-N 2.74Å; H298-K302 WeakPolarHBondContact O-CB 3.3Å; H298-K302 PolarHBondContact O-N 3.34Å; H298-F332 AromaticContact CD2-CD1 3.91Å; H298-F332 AromaticContact CE1-CD1 3.65Å; H298-F332 AromaticContact NE2-CD1 3.52Å; H298-V335 HydrophobicContact CB-CG1 4.35Å
299	A	90.1	Very high	90.4	Very high	37 Å²	37	45 Å²	45	31%	0.306	23%	0.225	S	C	.	.	H	α-helix	trans	-61.7	-39.8	174.4	0	0	0	0	0	111.8	E295 S296 K302 A303 N388	E295-A299 WeakPolarHBondContact O-CB 3.28Å; E295-A299 PolarHBondContact O-N 3.09Å; S296-A299 PolarHBondContact O-N 3.06Å; A299-K302 PolarHBondContact O-N 3.22Å; A299-A303 PolarHBondContact O-N 2.58Å; A299-N388 WeakPolarHBondContact CB-OD1 3.37Å
300	L	87.6	Confident	89.9	Confident	3 Å²	3	45 Å²	45	2%	0.016	23%	0.227	C	C	.	.	H	α-helix	trans	-66.3	-41.5	176	-172.5	62.6	0	0	0	112.4	S296 L297 H298 K302 A303 V304 F351 V359 L390	S296-L300 PolarHBondContact O-N 3.48Å; S296-L300 VanDerWaalsContact O-N 3.09Å; L297-L300 WeakPolarHBondContact O-CB 3.35Å; L297-L300 PolarHBondContact O-N 2.74Å; H298-L300 VanDerWaalsContact C-N 3.31Å; H298-L300 PolarHBondContact O-N 3.32Å; L300-K302 VanDerWaalsContact C-N 3.33Å; L300-A303 PolarHBondContact O-N 3.11Å; L300-V304 PolarHBondContact O-N 3.08Å; L300-V304 VanDerWaalsContact O-N 3.16Å; L300-F351 HydrophobicContact CD2-CD1 4.08Å; L300-F351 HydrophobicContact CD2-CE1 3.39Å; L300-F351 HydrophobicContact CD2-CZ 4.03Å; L300-F351 HydrophobicContact CG-CE1 3.61Å; L300-F351 HydrophobicContact CG-CZ 3.68Å; L300-V359 HydrophobicContact CD1-CG1 3.93Å; L300-V359 HydrophobicContact CD1-CG2 4.12Å; L300-V359 HydrophobicContact CD2-CG2 4.44Å; L300-V359 HydrophobicContact CG-CG2 4.42Å; L300-L390 HydrophobicContact CD2-CD1 4.04Å
301	F	91.7	Very high	89.3	Confident	1 Å²	1	48.8 Å²	48.8	0%	0.004	25%	0.247	C	C	.	.	H	α-helix	trans	-60.2	-46.4	174	-82.9	-139.3	0	0	0	110.4	L297 H298 A303 V304 Q305 L327 D331 F332 V335 F351	L297-F301 HydrophobicContact CD1-CD2 4.03Å; L297-F301 HydrophobicContact CD1-CE2 3.57Å; L297-F301 HydrophobicContact CD2-CE2 4.24Å; L297-F301 HydrophobicContact CG-CD2 4.08Å; L297-F301 HydrophobicContact CG-CE2 3.68Å; L297-F301 HydrophobicContact CG-CZ 4.46Å; L297-F301 WeakPolarHBondContact O-CD2 3.43Å; L297-F301 PolarHBondContact O-N 2.97Å; H298-F301 PolarHBondContact O-N 2.74Å; F301-A303 PolarHBondContact O-N 2.97Å; F301-V304 PolarHBondContact O-N 3.2Å; F301-Q305 WeakPolarHBondContact O-CB 3.35Å; F301-Q305 PolarHBondContact O-N 3.48Å; F301-L327 HydrophobicContact CB-CD1 4.44Å; F301-L327 HydrophobicContact CD1-CD2 3.96Å; F301-L327 HydrophobicContact CE1-CD2 4.28Å; F301-L327 VanDerWaalsContact O-CD1 3.24Å; F301-L327 WeakPolarHBondContact O-CD1 3.27Å; F301-D331 HydrophobicContact CD1-CB 4.23Å; F301-D331 HydrophobicContact CE1-CB 3.99Å; F301-F332 HydrophobicContact CB-CD1 4.04Å; F301-F332 HydrophobicContact CB-CE1 3.47Å; F301-F332 VanDerWaalsContact CB-CE1 3.47Å; F301-F332 HydrophobicContact CB-CZ 3.87Å; F301-V335 HydrophobicContact CD1-CG2 4.23Å; F301-V335 HydrophobicContact CE1-CG2 3.76Å; F301-V335 HydrophobicContact CE2-CG2 4.34Å; F301-V335 HydrophobicContact CZ-CG2 3.82Å; F301-F351 HydrophobicContact CD1-CD2 4.4Å; F301-F351 AromaticContact CD2-CD2 3.26Å; F301-F351 HydrophobicContact CD2-CD2 3.26Å; F301-F351 AromaticContact CD2-CE2 3.43Å; F301-F351 HydrophobicContact CD2-CE2 3.43Å; F301-F351 VanDerWaalsContact CD2-CE2 3.43Å; F301-F351 AromaticContact CD2-CG 3.88Å; F301-F351 HydrophobicContact CD2-CG 3.88Å; F301-F351 HydrophobicContact CD2-CZ 4.17Å; F301-F351 HydrophobicContact CE1-CD2 4.23Å; F301-F351 HydrophobicContact CE2-CB 3.5Å; F301-F351 VanDerWaalsContact CE2-CB 3.5Å; F301-F351 HydrophobicContact CE2-CD1 4.2Å; F301-F351 AromaticContact CE2-CD2 3.03Å; F301-F351 HydrophobicContact CE2-CD2 3.03Å; F301-F351 AromaticContact CE2-CE2 3.75Å; F301-F351 HydrophobicContact CE2-CE2 3.75Å; F301-F351 AromaticContact CE2-CG 3.3Å; F301-F351 HydrophobicContact CE2-CG 3.3Å; F301-F351 AromaticContact CG-CD2 3.97Å; F301-F351 HydrophobicContact CG-CD2 3.97Å; F301-F351 AromaticContact CG-CE2 3.99Å; F301-F351 HydrophobicContact CG-CE2 3.99Å; F301-F351 HydrophobicContact CZ-CB 3.74Å; F301-F351 AromaticContact CZ-CD2 3.58Å; F301-F351 HydrophobicContact CZ-CD2 3.58Å; F301-F351 AromaticContact CZ-CG 3.95Å; F301-F351 HydrophobicContact CZ-CG 3.95Å
302	K	90.5	Very high	88.7	Confident	109 Å²	109	49.3 Å²	49.3	47%	0.474	25%	0.252	S	S	.	.	H	α-helix	trans	-61	-45	179.3	-172.3	175.3	-180	179.7	0	111.9	H298 A299 L300 V304 Q305 E306 F332	H298-K302 WeakPolarHBondContact O-CB 3.3Å; H298-K302 PolarHBondContact O-N 3.34Å; A299-K302 PolarHBondContact O-N 3.22Å; L300-K302 VanDerWaalsContact C-N 3.33Å; K302-V304 VanDerWaalsContact C-N 3.31Å; K302-V304 PolarHBondContact O-N 2.94Å; K302-Q305 PolarHBondContact O-N 3.14Å; K302-E306 WeakPolarHBondContact CE-OE1 3.44Å; K302-E306 WeakPolarHBondContact O-CG 3.43Å; K302-E306 PolarHBondContact O-N 3.04Å; K302-F332 HydrophobicContact CB-CE1 4.17Å
303	A	87.7	Confident	88.2	Confident	6 Å²	6	52.9 Å²	52.9	5%	0.05	27%	0.265	C	S	.	.	H	α-helix	trans	-59.7	-41.6	178	0	0	0	0	0	112.3	A299 L300 F301 Y307	A299-A303 PolarHBondContact O-N 2.58Å; L300-A303 PolarHBondContact O-N 3.11Å; F301-A303 PolarHBondContact O-N 2.97Å; A303-Y307 WeakPolarHBondContact O-CB 3.44Å; A303-Y307 PolarHBondContact O-N 3.29Å; A303-Y307 VanDerWaalsContact O-N 3.17Å
304	V	88.4	Confident	87.6	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-70.8	-40.4	176.5	173.5	0	0	0	0	111.5	L300 F301 K302 E306 Y307 Q308 L327 F351 Y355 D358 V359 A362	L300-V304 PolarHBondContact O-N 3.08Å; L300-V304 VanDerWaalsContact O-N 3.16Å; F301-V304 PolarHBondContact O-N 3.2Å; K302-V304 VanDerWaalsContact C-N 3.31Å; K302-V304 PolarHBondContact O-N 2.94Å; V304-E306 PolarHBondContact O-N 3.07Å; V304-Y307 PolarHBondContact O-N 3.01Å; V304-Q308 HydrophobicContact CG1-CG 4.25Å; V304-Q308 WeakPolarHBondContact O-CB 3.43Å; V304-Q308 VanDerWaalsContact O-CG 3.32Å; V304-Q308 WeakPolarHBondContact O-CG 3.36Å; V304-Q308 PolarHBondContact O-N 2.67Å; V304-L327 HydrophobicContact CB-CD1 3.86Å; V304-L327 HydrophobicContact CG1-CD1 3.78Å; V304-F351 HydrophobicContact CB-CE2 4.42Å; V304-F351 HydrophobicContact CB-CZ 4.3Å; V304-F351 HydrophobicContact CG2-CE2 4.33Å; V304-F351 HydrophobicContact CG2-CZ 3.73Å; V304-Y355 HydrophobicContact CG1-CD1 3.79Å; V304-Y355 HydrophobicContact CG1-CE1 4.45Å; V304-Y355 HydrophobicContact CG1-CG 4.17Å; V304-D358 HydrophobicContact CG1-CB 4.27Å; V304-V359 HydrophobicContact CG2-CG2 4.1Å; V304-A362 HydrophobicContact CG2-CB 3.89Å
305	Q	90.5	Very high	86.8	Confident	50 Å²	50	52 Å²	52	23%	0.234	28%	0.282	C	S	.	.	H	α-helix	trans	-60.3	-46.3	177.2	-174.7	-170.3	39.6	0	0	111.2	F301 K302 Q308 S309 L327 F332	F301-Q305 WeakPolarHBondContact O-CB 3.35Å; F301-Q305 PolarHBondContact O-N 3.48Å; K302-Q305 PolarHBondContact O-N 3.14Å; Q305-Q308 PolarHBondContact O-N 3.46Å; Q305-S309 WeakPolarHBondContact O-CB 3.35Å; Q305-S309 PolarHBondContact O-N 3.36Å; Q305-S309 PolarHBondContact O-OG 3.06Å; Q305-L327 HydrophobicContact CB-CB 4.19Å; Q305-L327 HydrophobicContact CB-CD1 4.16Å; Q305-L327 HydrophobicContact CG-CB 4.35Å; Q305-F332 HydrophobicContact CB-CE2 4.47Å; Q305-F332 HydrophobicContact CB-CZ 4Å; Q305-F332 HydrophobicContact CG-CE2 4.43Å; Q305-F332 HydrophobicContact CG-CZ 4.36Å; Q305-F332 VanDerWaalsContact OE1-CZ 3.26Å
306	E	88.5	Confident	85.8	Confident	62 Å²	62	51.9 Å²	51.9	29%	0.29	29%	0.291	S	S	.	.	H	α-helix	trans	-60.7	-47.3	177.4	-73.7	175.8	-170.3	0	0	111.5	K302 V304 Q308 S309 D310	K302-E306 WeakPolarHBondContact CE-OE1 3.44Å; K302-E306 WeakPolarHBondContact O-CG 3.43Å; K302-E306 PolarHBondContact O-N 3.04Å; V304-E306 PolarHBondContact O-N 3.07Å; E306-Q308 PolarHBondContact O-N 3.44Å; E306-S309 PolarHBondContact O-N 2.94Å; E306-D310 WeakPolarHBondContact O-CB 3.48Å; E306-D310 PolarHBondContact O-N 3.04Å
307	Y	85.9	Confident	85.1	Confident	31 Å²	31	59 Å²	59	12%	0.122	32%	0.319	C	S	.	.	H	α-helix	trans	-58.8	-45	175.9	170.8	-106.7	0	0	0	112.4	A303 V304 L311 D358 K361 A362 Y365	A303-Y307 WeakPolarHBondContact O-CB 3.44Å; A303-Y307 PolarHBondContact O-N 3.29Å; A303-Y307 VanDerWaalsContact O-N 3.17Å; V304-Y307 PolarHBondContact O-N 3.01Å; Y307-L311 HydrophobicContact CD1-CD1 4.13Å; Y307-L311 HydrophobicContact CD2-CD1 4.46Å; Y307-L311 HydrophobicContact CD2-CG 4.48Å; Y307-L311 HydrophobicContact CE1-CD1 3.48Å; Y307-L311 VanDerWaalsContact CE1-CD1 3.48Å; Y307-L311 HydrophobicContact CE1-CG 4.45Å; Y307-L311 HydrophobicContact CE2-CD1 3.88Å; Y307-L311 HydrophobicContact CE2-CD2 4.49Å; Y307-L311 HydrophobicContact CE2-CG 4.1Å; Y307-L311 WeakPolarHBondContact O-CB 3.41Å; Y307-L311 WeakPolarHBondContact O-CG 3.48Å; Y307-L311 PolarHBondContact O-N 3.28Å; Y307-L311 WeakPolarHBondContact OH-CD1 3.42Å; Y307-D358 HydrophobicContact CE1-CB 4.42Å; Y307-K361 HydrophobicContact CE1-CB 4.11Å; Y307-K361 HydrophobicContact CE2-CB 4.12Å; Y307-K361 WeakPolarHBondContact OH-CD 3.38Å; Y307-A362 HydrophobicContact CD1-CB 4.2Å; Y307-A362 HydrophobicContact CG-CB 4Å; Y307-Y365 HydrophobicContact CD2-CD1 4.31Å; Y307-Y365 HydrophobicContact CD2-CD2 4.21Å; Y307-Y365 AromaticContact CD2-CG 3.83Å; Y307-Y365 HydrophobicContact CD2-CG 3.83Å
308	Q	84.7	Confident	84	Confident	11 Å²	11	64.2 Å²	64.2	5%	0.051	35%	0.347	C	S	.	.	H	α-helix	trans	-63.5	-43.7	176.3	-74.7	-176.1	-20.9	0	0	111.6	V304 Q305 E306 D310 L311 I312	V304-Q308 HydrophobicContact CG1-CG 4.25Å; V304-Q308 WeakPolarHBondContact O-CB 3.43Å; V304-Q308 VanDerWaalsContact O-CG 3.32Å; V304-Q308 WeakPolarHBondContact O-CG 3.36Å; V304-Q308 PolarHBondContact O-N 2.67Å; Q305-Q308 PolarHBondContact O-N 3.46Å; E306-Q308 PolarHBondContact O-N 3.44Å; Q308-D310 PolarHBondContact O-N 3.2Å; Q308-L311 PolarHBondContact O-N 2.9Å; Q308-I312 WeakPolarHBondContact O-CB 3.47Å; Q308-I312 WeakPolarHBondContact O-CD1 3.47Å; Q308-I312 WeakPolarHBondContact O-CG1 3.47Å; Q308-I312 PolarHBondContact O-N 2.97Å
309	S	84.5	Confident	82.9	Confident	59 Å²	59	66.5 Å²	66.5	41%	0.413	37%	0.368	S	S	.	.	H	α-helix	trans	-63.2	-44.2	-179.3	-57.5	0	0	0	0	111.2	Q305 E306 L311 I312 L313	Q305-S309 WeakPolarHBondContact O-CB 3.35Å; Q305-S309 PolarHBondContact O-N 3.36Å; Q305-S309 PolarHBondContact O-OG 3.06Å; E306-S309 PolarHBondContact O-N 2.94Å; S309-L311 PolarHBondContact O-N 2.8Å; S309-I312 PolarHBondContact O-N 3Å; S309-L313 VanDerWaalsContact O-CB 3.3Å; S309-L313 WeakPolarHBondContact O-CB 3.36Å; S309-L313 PolarHBondContact O-N 2.9Å
310	D	84.1	Confident	81.8	Confident	50 Å²	50	68.9 Å²	68.9	27%	0.267	38%	0.375	S	S	.	.	H	α-helix	trans	-67.7	-34.8	178.2	-73.4	-27.8	0	0	0	111.7	E306 Q308 A314 Y365 K369	E306-D310 WeakPolarHBondContact O-CB 3.48Å; E306-D310 PolarHBondContact O-N 3.04Å; Q308-D310 PolarHBondContact O-N 3.2Å; D310-A314 WeakPolarHBondContact O-CB 3.49Å; D310-A314 PolarHBondContact O-N 2.98Å; D310-Y365 HydrophobicContact CB-CE1 4.39Å; D310-Y365 VanDerWaalsContact OD2-CE1 3.27Å; D310-Y365 WeakPolarHBondContact OD2-CE1 3.49Å; D310-Y365 VanDerWaalsContact OD2-CZ 3.3Å; D310-Y365 PolarHBondContact OD2-OH 2.86Å; D310-K369 IonicContact OD2-NZ 3.24Å; D310-K369 PolarHBondContact OD2-NZ 3.07Å
311	L	80.7	Confident	81	Confident	82 Å²	82	72 Å²	72	43%	0.429	40%	0.396	S	S	.	.	H	α-helix	trans	-66.9	-42.7	171.9	-78.4	-179.7	0	0	0	113.1	Y307 Q308 S309 L313 A314 N315	Y307-L311 HydrophobicContact CD1-CD1 4.13Å; Y307-L311 HydrophobicContact CD2-CD1 4.46Å; Y307-L311 HydrophobicContact CD2-CG 4.48Å; Y307-L311 HydrophobicContact CE1-CD1 3.48Å; Y307-L311 VanDerWaalsContact CE1-CD1 3.48Å; Y307-L311 HydrophobicContact CE1-CG 4.45Å; Y307-L311 HydrophobicContact CE2-CD1 3.88Å; Y307-L311 HydrophobicContact CE2-CD2 4.49Å; Y307-L311 HydrophobicContact CE2-CG 4.1Å; Y307-L311 WeakPolarHBondContact O-CB 3.41Å; Y307-L311 WeakPolarHBondContact O-CG 3.48Å; Y307-L311 PolarHBondContact O-N 3.28Å; Y307-L311 WeakPolarHBondContact OH-CD1 3.42Å; Q308-L311 PolarHBondContact O-N 2.9Å; S309-L311 PolarHBondContact O-N 2.8Å; L311-L313 VanDerWaalsContact C-N 3.34Å; L311-A314 PolarHBondContact O-N 3.44Å; L311-N315 PolarHBondContact O-N 2.75Å
312	I	79.9	Confident	79.8	Confident	73 Å²	73	75.4 Å²	75.4	37%	0.374	42%	0.42	S	S	.	.	H	α-helix	trans	-65.5	-41.8	178.1	-67.2	161.9	0	0	0	109.8	Q308 S309 A314 N315 L320	Q308-I312 WeakPolarHBondContact O-CB 3.47Å; Q308-I312 WeakPolarHBondContact O-CD1 3.47Å; Q308-I312 WeakPolarHBondContact O-CG1 3.47Å; Q308-I312 PolarHBondContact O-N 2.97Å; S309-I312 PolarHBondContact O-N 3Å; I312-A314 VanDerWaalsContact C-N 3.29Å; I312-A314 PolarHBondContact O-N 2.89Å; I312-N315 CarbonylContact O-C 3.56Å; I312-N315 VanDerWaalsContact O-C 3.26Å; I312-N315 PolarHBondContact O-N 3.08Å; I312-L320 HydrophobicContact CD1-CD2 3.78Å; I312-L320 HydrophobicContact CG1-CD2 3.75Å
313	L	81.9	Confident	78.8	Confident	138 Å²	138	74.1 Å²	74.1	72%	0.723	42%	0.418	S	S	*	.	H	α-helix	trans	-66.5	-31.2	177.9	-164.4	109.2	0	0	0	112.4	S309 L311 N315	S309-L313 VanDerWaalsContact O-CB 3.3Å; S309-L313 WeakPolarHBondContact O-CB 3.36Å; S309-L313 PolarHBondContact O-N 2.9Å; L311-L313 VanDerWaalsContact C-N 3.34Å; L313-N315 VanDerWaalsContact C-N 3.33Å
314	A	79.9	Confident	78.2	Confident	68 Å²	68	76.2 Å²	76.2	56%	0.562	43%	0.43	S	S	*	.	H	α-helix	trans	-68.8	-30.7	176	0	0	0	0	0	112.9	D310 L311 I312	D310-A314 WeakPolarHBondContact O-CB 3.49Å; D310-A314 PolarHBondContact O-N 2.98Å; L311-A314 PolarHBondContact O-N 3.44Å; I312-A314 VanDerWaalsContact C-N 3.29Å; I312-A314 PolarHBondContact O-N 2.89Å
315	N	77.1	Confident	77.9	Confident	94 Å²	94	79.6 Å²	79.6	50%	0.503	44%	0.443	S	S	.	.			trans	-131.9	69.2	-178.7	-59.2	-49.9	0	0	0	111.9	L311 I312 L313 E317 D318	L311-N315 PolarHBondContact O-N 2.75Å; I312-N315 CarbonylContact O-C 3.56Å; I312-N315 VanDerWaalsContact O-C 3.26Å; I312-N315 PolarHBondContact O-N 3.08Å; L313-N315 VanDerWaalsContact C-N 3.33Å; N315-E317 VanDerWaalsContact C-N 3.29Å; N315-E317 PolarHBondContact O-N 3.22Å; N315-D318 HydrophobicContact CB-CB 4.39Å; N315-D318 PolarHBondContact O-N 3.25Å
316	P	73.3	Confident	77.6	Confident	105 Å²	105	79.8 Å²	79.8	68%	0.682	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-18.7	-173.6	26.5	-33.1	0	0	0	114.4
317	E	74.8	Confident	77.6	Confident	188 Å²	188	77.3 Å²	77.3	88%	0.879	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	-16.9	177.4	-63.3	-157.8	164.4	0	0	113.3	N315	N315-E317 VanDerWaalsContact C-N 3.29Å; N315-E317 PolarHBondContact O-N 3.22Å
318	D	70.3	Confident	77.6	Confident	114 Å²	114	78.9 Å²	78.9	61%	0.61	45%	0.45	S	S	*	.	S	Bend	trans	-86.3	122.5	-178.9	-71.4	-31	0	0	0	110.3	N315	N315-D318 HydrophobicContact CB-CB 4.39Å; N315-D318 PolarHBondContact O-N 3.25Å
319	P	68.5	Low	77.9	Confident	115 Å²	115	84.5 Å²	84.5	75%	0.747	48%	0.48	S	S	*	.	P	Polyproline II helix	trans	-62.5	142.1	173.3	26.1	-32.4	0	0	0	110.2
320	L	68.1	Low	78.1	Confident	87 Å²	87	86 Å²	86	46%	0.455	48%	0.484	S	S	.	.	P	Polyproline II helix	trans	-52	126.4	176	-80.8	168.8	0	0	0	110.3	I312 S322 V324 P326	I312-L320 HydrophobicContact CD1-CD2 3.78Å; I312-L320 HydrophobicContact CG1-CD2 3.75Å; L320-S322 PolarHBondContact O-N 3.34Å; L320-V324 HydrophobicContact CD2-CG1 4.39Å; L320-P326 HydrophobicContact CD1-CG 4.34Å
321	P	69.5	Low	78.4	Confident	70 Å²	70	84.3 Å²	84.3	46%	0.455	48%	0.475	S	S	.	.	P	Polyproline II helix	trans	-55.9	140.8	176.2	-25.5	34.4	0	0	0	111.3	D323 V324	P321-D323 WeakPolarHBondContact CB-OD1 3.35Å; P321-D323 PolarHBondContact O-N 2.87Å; P321-V324 HydrophobicContact CB-CG2 4.02Å; P321-V324 HydrophobicContact CG-CG2 4.18Å; P321-V324 PolarHBondContact O-N 3.34Å
322	S	67.3	Low	79	Confident	72 Å²	72	81.3 Å²	81.3	50%	0.503	46%	0.458	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-14.8	-176	59.8	0	0	0	0	115.1	L320 P409	L320-S322 PolarHBondContact O-N 3.34Å; S322-P409 WeakPolarHBondContact OG-CG 3.36Å
323	D	69.6	Low	79.6	Confident	81 Å²	81	81 Å²	81	43%	0.433	46%	0.457	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-13	177.5	56	-52.4	0	0	0	113.5	P321 V403 C408	P321-D323 WeakPolarHBondContact CB-OD1 3.35Å; P321-D323 PolarHBondContact O-N 2.87Å; D323-V403 HydrophobicContact CB-CG1 4.05Å; D323-C408 HydrophobicContact CB-CB 4.21Å; D323-C408 VanDerWaalsContact CB-SG 3.57Å
324	V	74.1	Confident	80	Confident	51 Å²	51	76.2 Å²	76.2	31%	0.309	44%	0.437	S	S	.	.			trans	-94.9	120.9	-179.6	178.9	0	0	0	0	110.2	L320 P321	L320-V324 HydrophobicContact CD2-CG1 4.39Å; P321-V324 HydrophobicContact CB-CG2 4.02Å; P321-V324 HydrophobicContact CG-CG2 4.18Å; P321-V324 PolarHBondContact O-N 3.34Å
325	R	84.1	Confident	80.7	Confident	71 Å²	71	73 Å²	73	27%	0.268	41%	0.411	S	S	.	.			trans	-100	108.7	172	-178	-173.2	179	-81.9	-0.7	109.4	D331 Y354 Y355	R325-D331 IonicContact CZ-OD1 2.79Å; R325-D331 IonicContact CZ-OD2 2.64Å; R325-D331 IonicContact NH1-OD1 3.78Å; R325-D331 PolarHBondContact NH1-OD1 3.5Å; R325-D331 IonicContact NH1-OD2 2.66Å; R325-D331 PolarHBondContact NH1-OD2 3.08Å; R325-D331 IonicContact NH2-OD1 3.62Å; R325-D331 PolarHBondContact NH2-OD1 3.28Å; R325-D331 IonicContact NH2-OD2 3.16Å; R325-D331 PolarHBondContact NH2-OD2 3.34Å; R325-Y354 HydrophobicContact CB-CD1 4.33Å; R325-Y355 PolarHBondContact NH1-OH 3.23Å; R325-Y355 WeakPolarHBondContact O-CE1 3.35Å; R325-Y355 VanDerWaalsContact O-CZ 3.31Å; R325-Y355 PolarHBondContact O-OH 3.02Å
326	P	83.9	Confident	81.3	Confident	54 Å²	54	72.3 Å²	72.3	35%	0.351	41%	0.41	S	S	.	.			trans	-64.8	139.9	175.6	26.4	-32.9	0	0	0	111	L320	L320-P326 HydrophobicContact CD1-CG 4.34Å
327	L	87.3	Confident	82.2	Confident	9 Å²	9	75.3 Å²	75.3	5%	0.047	41%	0.408	C	S	.	.			trans	-72.3	128.6	171.7	-76	167.2	0	0	0	110.3	F301 V304 Q305 D331 F332 F351 Y355	F301-L327 HydrophobicContact CB-CD1 4.44Å; F301-L327 HydrophobicContact CD1-CD2 3.96Å; F301-L327 HydrophobicContact CE1-CD2 4.28Å; F301-L327 VanDerWaalsContact O-CD1 3.24Å; F301-L327 WeakPolarHBondContact O-CD1 3.27Å; V304-L327 HydrophobicContact CB-CD1 3.86Å; V304-L327 HydrophobicContact CG1-CD1 3.78Å; Q305-L327 HydrophobicContact CB-CB 4.19Å; Q305-L327 HydrophobicContact CB-CD1 4.16Å; Q305-L327 HydrophobicContact CG-CB 4.35Å; L327-D331 HydrophobicContact CD2-CB 4.21Å; L327-F332 HydrophobicContact CB-CE2 4.34Å; L327-F351 HydrophobicContact CD1-CE2 4.21Å; L327-Y355 HydrophobicContact CD2-CD2 4.31Å; L327-Y355 HydrophobicContact CD2-CE1 4.39Å; L327-Y355 HydrophobicContact CD2-CE2 3.5Å; L327-Y355 VanDerWaalsContact CD2-CE2 3.5Å; L327-Y355 HydrophobicContact CG-CE1 4.02Å; L327-Y355 HydrophobicContact CG-CE2 4.03Å
328	V	87.1	Confident	83.1	Confident	65 Å²	65	66.6 Å²	66.6	39%	0.394	37%	0.368	S	S	.	.			trans	-116.8	163.8	-178.4	-65.2	0	0	0	0	111.2	D330 D331 F332	V328-D330 HydrophobicContact CG2-CB 4.01Å; V328-D330 PolarHBondContact O-N 2.52Å; V328-D330 VanDerWaalsContact O-N 3.16Å; V328-D331 WeakPolarHBondContact CG2-OD2 3.45Å; V328-D331 PolarHBondContact N-OD2 2.9Å; V328-D331 VanDerWaalsContact N-OD2 3.12Å; V328-D331 VanDerWaalsContact O-CB 3.29Å; V328-D331 WeakPolarHBondContact O-CB 3.37Å; V328-D331 PolarHBondContact O-N 2.81Å; V328-F332 WeakPolarHBondContact O-CD2 3.27Å
329	D	89.4	Confident	84	Confident	128 Å²	128	65.6 Å²	65.6	68%	0.684	36%	0.36	S	S	*	.	H	α-helix	trans	-56.5	-33.3	-179	-63.4	-15.5	0	0	0	113.4	D331 F332 L333	D329-D331 PolarHBondContact O-N 3.11Å; D329-F332 PolarHBondContact O-N 2.82Å; D329-L333 WeakPolarHBondContact O-CB 3.32Å; D329-L333 PolarHBondContact O-N 2.77Å
330	D	89.2	Confident	85.1	Confident	91 Å²	91	61.6 Å²	61.6	49%	0.487	33%	0.334	S	S	.	.	H	α-helix	trans	-55.5	-36.5	173.3	-87.7	1	0	0	0	112.4	V328 L333 A334 K419	V328-D330 HydrophobicContact CG2-CB 4.01Å; V328-D330 PolarHBondContact O-N 2.52Å; V328-D330 VanDerWaalsContact O-N 3.16Å; D330-L333 PolarHBondContact O-N 2.99Å; D330-A334 PolarHBondContact O-N 3.49Å; D330-K419 IonicContact OD2-NZ 3.26Å; D330-K419 PolarHBondContact OD2-NZ 3.42Å; D330-K419 VanDerWaalsContact OD2-NZ 3.16Å
331	D	89.8	Confident	86.2	Confident	15 Å²	15	60.2 Å²	60.2	8%	0.08	33%	0.325	C	S	.	.	H	α-helix	trans	-69.6	-41.2	-179.4	-63.7	-41.8	0	0	0	111.1	F301 R325 L327 V328 D329 A334 V335	F301-D331 HydrophobicContact CD1-CB 4.23Å; F301-D331 HydrophobicContact CE1-CB 3.99Å; R325-D331 IonicContact CZ-OD1 2.79Å; R325-D331 IonicContact CZ-OD2 2.64Å; R325-D331 IonicContact NH1-OD1 3.78Å; R325-D331 PolarHBondContact NH1-OD1 3.5Å; R325-D331 IonicContact NH1-OD2 2.66Å; R325-D331 PolarHBondContact NH1-OD2 3.08Å; R325-D331 IonicContact NH2-OD1 3.62Å; R325-D331 PolarHBondContact NH2-OD1 3.28Å; R325-D331 IonicContact NH2-OD2 3.16Å; R325-D331 PolarHBondContact NH2-OD2 3.34Å; L327-D331 HydrophobicContact CD2-CB 4.21Å; V328-D331 WeakPolarHBondContact CG2-OD2 3.45Å; V328-D331 PolarHBondContact N-OD2 2.9Å; V328-D331 VanDerWaalsContact N-OD2 3.12Å; V328-D331 VanDerWaalsContact O-CB 3.29Å; V328-D331 WeakPolarHBondContact O-CB 3.37Å; V328-D331 PolarHBondContact O-N 2.81Å; D329-D331 PolarHBondContact O-N 3.11Å; D331-A334 PolarHBondContact O-N 2.74Å; D331-V335 PolarHBondContact O-N 3.08Å
332	F	93.2	Very high	87.2	Confident	19 Å²	19	59.5 Å²	59.5	8%	0.083	32%	0.315	C	S	.	.	H	α-helix	trans	-65.9	-42.9	174.9	-68.4	-88.6	0	0	0	111.1	H298 F301 K302 Q305 L327 V328 D329 A334 V335 T336	H298-F332 AromaticContact CD2-CD1 3.91Å; H298-F332 AromaticContact CE1-CD1 3.65Å; H298-F332 AromaticContact NE2-CD1 3.52Å; F301-F332 HydrophobicContact CB-CD1 4.04Å; F301-F332 HydrophobicContact CB-CE1 3.47Å; F301-F332 VanDerWaalsContact CB-CE1 3.47Å; F301-F332 HydrophobicContact CB-CZ 3.87Å; K302-F332 HydrophobicContact CB-CE1 4.17Å; Q305-F332 HydrophobicContact CB-CE2 4.47Å; Q305-F332 HydrophobicContact CB-CZ 4Å; Q305-F332 HydrophobicContact CG-CE2 4.43Å; Q305-F332 HydrophobicContact CG-CZ 4.36Å; Q305-F332 VanDerWaalsContact OE1-CZ 3.26Å; L327-F332 HydrophobicContact CB-CE2 4.34Å; V328-F332 WeakPolarHBondContact O-CD2 3.27Å; D329-F332 PolarHBondContact O-N 2.82Å; F332-A334 VanDerWaalsContact C-N 3.26Å; F332-A334 PolarHBondContact O-N 3.22Å; F332-V335 PolarHBondContact O-N 2.76Å; F332-V335 VanDerWaalsContact O-N 3.16Å; F332-T336 PolarHBondContact O-N 3.06Å; F332-T336 PolarHBondContact O-OG1 2.68Å
333	L	92.9	Very high	88.4	Confident	66 Å²	66	58.5 Å²	58.5	35%	0.346	30%	0.303	S	S	.	.	H	α-helix	trans	-62.1	-35.7	177.8	-173.7	58.3	0	0	0	111.9	D329 D330 T336 R337	D329-L333 WeakPolarHBondContact O-CB 3.32Å; D329-L333 PolarHBondContact O-N 2.77Å; D330-L333 PolarHBondContact O-N 2.99Å; L333-T336 PolarHBondContact O-N 3.45Å; L333-R337 HydrophobicContact CD1-CG 4.26Å; L333-R337 VanDerWaalsContact CD2-CZ 3.48Å; L333-R337 HydrophobicContact CG-CG 4.4Å; L333-R337 VanDerWaalsContact O-CB 3.3Å; L333-R337 WeakPolarHBondContact O-CB 3.48Å; L333-R337 VanDerWaalsContact O-CG 3.25Å; L333-R337 WeakPolarHBondContact O-CG 3.5Å; L333-R337 PolarHBondContact O-N 3.02Å
334	A	91.8	Very high	89.6	Confident	37 Å²	37	55.2 Å²	55.2	31%	0.306	29%	0.285	S	S	.	.	H	α-helix	trans	-62.6	-42.5	174.6	0	0	0	0	0	112.2	D330 D331 F332 R337 A338 L347	D330-A334 PolarHBondContact O-N 3.49Å; D331-A334 PolarHBondContact O-N 2.74Å; F332-A334 VanDerWaalsContact C-N 3.26Å; F332-A334 PolarHBondContact O-N 3.22Å; A334-R337 PolarHBondContact O-N 2.85Å; A334-A338 PolarHBondContact O-N 2.71Å; A334-A338 VanDerWaalsContact O-N 3.11Å; A334-L347 HydrophobicContact CB-CD1 4.45Å; A334-L347 HydrophobicContact CB-CD2 3.76Å; A334-L347 WeakPolarHBondContact O-CD1 3.22Å
335	V	92.9	Very high	90.5	Very high	1 Å²	1	57.7 Å²	57.7	1%	0.006	29%	0.293	C	S	.	.	H	α-helix	trans	-61.5	-45.8	174.8	177.7	0	0	0	0	111.3	K294 L297 H298 F301 D331 F332 R337 A338 L344 L347	K294-V335 HydrophobicContact CB-CG1 4.46Å; L297-V335 HydrophobicContact CB-CG1 4.26Å; L297-V335 HydrophobicContact CD2-CG1 4.16Å; L297-V335 HydrophobicContact CD2-CG2 3.98Å; L297-V335 HydrophobicContact CG-CG1 4.33Å; L297-V335 HydrophobicContact CG-CG2 4.28Å; H298-V335 HydrophobicContact CB-CG1 4.35Å; F301-V335 HydrophobicContact CD1-CG2 4.23Å; F301-V335 HydrophobicContact CE1-CG2 3.76Å; F301-V335 HydrophobicContact CE2-CG2 4.34Å; F301-V335 HydrophobicContact CZ-CG2 3.82Å; D331-V335 PolarHBondContact O-N 3.08Å; F332-V335 PolarHBondContact O-N 2.76Å; F332-V335 VanDerWaalsContact O-N 3.16Å; V335-R337 VanDerWaalsContact C-N 3.33Å; V335-R337 PolarHBondContact O-N 3.27Å; V335-A338 PolarHBondContact O-N 2.99Å; V335-L344 HydrophobicContact CG1-CD1 4.21Å; V335-L347 HydrophobicContact CB-CD1 4.5Å; V335-L347 HydrophobicContact CG2-CD1 4.17Å
336	T	90.9	Very high	91	Very high	80 Å²	80	54.5 Å²	54.5	49%	0.491	28%	0.281	S	S	.	.	H	α-helix	trans	-62	-42.3	178.1	-58.8	0	0	0	0	111.6	K294 F332 L333 A338	K294-T336 PolarHBondContact NZ-O 2.8Å; F332-T336 PolarHBondContact O-N 3.06Å; F332-T336 PolarHBondContact O-OG1 2.68Å; L333-T336 PolarHBondContact O-N 3.45Å; T336-A338 PolarHBondContact O-N 3.14Å
337	R	91.8	Very high	91.6	Very high	168 Å²	168	52.5 Å²	52.5	63%	0.634	27%	0.268	S	S	*	.	H	α-helix	trans	-74.2	-19	-177.6	-75.6	177	177.1	174.8	-0.7	114.9	L333 A334 V335 Q339	L333-R337 HydrophobicContact CD1-CG 4.26Å; L333-R337 VanDerWaalsContact CD2-CZ 3.48Å; L333-R337 HydrophobicContact CG-CG 4.4Å; L333-R337 VanDerWaalsContact O-CB 3.3Å; L333-R337 WeakPolarHBondContact O-CB 3.48Å; L333-R337 VanDerWaalsContact O-CG 3.25Å; L333-R337 WeakPolarHBondContact O-CG 3.5Å; L333-R337 PolarHBondContact O-N 3.02Å; A334-R337 PolarHBondContact O-N 2.85Å; V335-R337 VanDerWaalsContact C-N 3.33Å; V335-R337 PolarHBondContact O-N 3.27Å; R337-Q339 WeakPolarHBondContact O-CG 3.35Å; R337-Q339 PolarHBondContact O-N 2.76Å; R337-Q339 PolarHBondContact O-NE2 2.86Å
338	A	92.7	Very high	91.8	Very high	4 Å²	4	53.8 Å²	53.8	3%	0.033	27%	0.272	C	S	.	.			trans	-54.2	129.6	-179.2	0	0	0	0	0	111.7	K294 A334 V335 T336 E343 L347	K294-A338 WeakPolarHBondContact CE-O 3.49Å; K294-A338 PolarHBondContact NZ-O 3.26Å; A334-A338 PolarHBondContact O-N 2.71Å; A334-A338 VanDerWaalsContact O-N 3.11Å; V335-A338 PolarHBondContact O-N 2.99Å; T336-A338 PolarHBondContact O-N 3.14Å; A338-E343 HydrophobicContact CB-CB 4.07Å; A338-L347 HydrophobicContact CB-CD1 4.02Å
339	Q	90.5	Very high	92.1	Very high	94 Å²	94	51.5 Å²	51.5	44%	0.439	26%	0.259	S	S	.	.			trans	-108.5	-2.4	-177.6	-61	-57.5	-48.8	0	0	113.1	W204 R337 E343	W204-Q339 PolarHBondContact NE1-O 3.17Å; R337-Q339 WeakPolarHBondContact O-CG 3.35Å; R337-Q339 PolarHBondContact O-N 2.76Å; R337-Q339 PolarHBondContact O-NE2 2.86Å; Q339-E343 PolarHBondContact N-OE2 3.44Å
340	S	90.5	Very high	92.2	Very high	31 Å²	31	45.6 Å²	45.6	22%	0.217	23%	0.227	C	C	.	.	S	Bend	trans	-140.5	161.3	-177.3	65.1	0	0	0	0	112.4	E342 E343 L344	S340-E342 WeakPolarHBondContact CB-OE2 3.45Å; S340-E342 PolarHBondContact O-N 3.37Å; S340-E343 PolarHBondContact O-N 3.06Å; S340-E343 WeakPolarHBondContact OG-CB 3.41Å; S340-E343 VanDerWaalsContact OG-CG 3.28Å; S340-E343 WeakPolarHBondContact OG-CG 3.2Å; S340-E343 PolarHBondContact OG-N 2.89Å; S340-L344 PolarHBondContact O-N 3.26Å; S340-L344 VanDerWaalsContact O-N 3.12Å
341	F	91.1	Very high	92.3	Very high	57 Å²	57	41.3 Å²	41.3	25%	0.25	20%	0.204	C	C	.	.	H	α-helix	trans	-65.7	-30.3	175.4	-69.4	-72.9	0	0	0	111.8	K286 Q289 L290 L344 Q345	K286-F341 WeakPolarHBondContact O-CZ 3.25Å; Q289-F341 HydrophobicContact CB-CE1 4.15Å; Q289-F341 HydrophobicContact CB-CZ 3.88Å; L290-F341 HydrophobicContact CB-CE1 4.02Å; L290-F341 HydrophobicContact CB-CZ 4.02Å; L290-F341 HydrophobicContact CD1-CD1 4.08Å; L290-F341 HydrophobicContact CD1-CE1 4.23Å; L290-F341 HydrophobicContact CD1-CG 4.49Å; F341-L344 PolarHBondContact O-N 2.85Å; F341-Q345 VanDerWaalsContact O-CB 3.26Å; F341-Q345 WeakPolarHBondContact O-CB 3.37Å; F341-Q345 PolarHBondContact O-N 2.59Å
342	E	91	Very high	92.3	Very high	55 Å²	55	42.3 Å²	42.3	26%	0.257	21%	0.21	S	C	.	.	H	α-helix	trans	-71.1	-42.9	178.5	-61.5	89	154.2	0	0	111.7	S340 L344 Q345 D346 K603	S340-E342 WeakPolarHBondContact CB-OE2 3.45Å; S340-E342 PolarHBondContact O-N 3.37Å; E342-L344 VanDerWaalsContact C-N 3.32Å; E342-L344 PolarHBondContact O-N 3.22Å; E342-Q345 PolarHBondContact O-N 2.82Å; E342-D346 PolarHBondContact O-N 2.62Å; E342-K603 WeakPolarHBondContact OE1-CE 3.44Å; E342-K603 IonicContact OE1-NZ 2.64Å; E342-K603 PolarHBondContact OE1-NZ 3.41Å
343	E	93.3	Very high	92.1	Very high	51 Å²	51	42.3 Å²	42.3	24%	0.238	21%	0.21	C	C	.	.	H	α-helix	trans	-62.6	-41	172.8	-74.7	175.4	175.3	0	0	111.3	A338 Q339 S340 Q345 D346 L347 Q479	A338-E343 HydrophobicContact CB-CB 4.07Å; Q339-E343 PolarHBondContact N-OE2 3.44Å; S340-E343 PolarHBondContact O-N 3.06Å; S340-E343 WeakPolarHBondContact OG-CB 3.41Å; S340-E343 VanDerWaalsContact OG-CG 3.28Å; S340-E343 WeakPolarHBondContact OG-CG 3.2Å; S340-E343 PolarHBondContact OG-N 2.89Å; E343-Q345 VanDerWaalsContact C-N 3.34Å; E343-Q345 PolarHBondContact O-N 3.48Å; E343-D346 WeakPolarHBondContact O-CB 3.33Å; E343-D346 PolarHBondContact O-N 3.49Å; E343-L347 WeakPolarHBondContact O-CG 3.05Å; E343-L347 PolarHBondContact O-N 3.06Å; E343-Q479 PolarHBondContact OE1-NE2 2.66Å
344	L	94	Very high	91.8	Very high	12 Å²	12	41.4 Å²	41.4	6%	0.063	20%	0.203	C	C	.	.	H	α-helix	trans	-65.7	-38.6	176.1	-167.9	66.1	0	0	0	111.9	L290 R293 K294 L297 V335 S340 F341 E342 D346 L347 Y348	L290-L344 HydrophobicContact CD1-CD2 4.17Å; R293-L344 HydrophobicContact CB-CD2 3.5Å; R293-L344 VanDerWaalsContact CB-CD2 3.5Å; K294-L344 HydrophobicContact CG-CD1 3.9Å; K294-L344 HydrophobicContact CG-CD2 4.19Å; L297-L344 HydrophobicContact CB-CD1 4.46Å; L297-L344 HydrophobicContact CD2-CD1 3.51Å; L297-L344 HydrophobicContact CD2-CG 4.2Å; V335-L344 HydrophobicContact CG1-CD1 4.21Å; S340-L344 PolarHBondContact O-N 3.26Å; S340-L344 VanDerWaalsContact O-N 3.12Å; F341-L344 PolarHBondContact O-N 2.85Å; E342-L344 VanDerWaalsContact C-N 3.32Å; E342-L344 PolarHBondContact O-N 3.22Å; L344-D346 VanDerWaalsContact C-N 3.34Å; L344-L347 PolarHBondContact O-N 2.91Å; L344-Y348 WeakPolarHBondContact O-CB 3.31Å; L344-Y348 PolarHBondContact O-N 3.38Å
345	Q	93.3	Very high	91.6	Very high	103 Å²	103	39.8 Å²	39.8	48%	0.481	19%	0.188	S	C	.	.	H	α-helix	trans	-67.2	-34.3	175.2	-177.3	59.8	51.3	0	0	112.2	F341 E342 E343 S349	F341-Q345 VanDerWaalsContact O-CB 3.26Å; F341-Q345 WeakPolarHBondContact O-CB 3.37Å; F341-Q345 PolarHBondContact O-N 2.59Å; E342-Q345 PolarHBondContact O-N 2.82Å; E343-Q345 VanDerWaalsContact C-N 3.34Å; E343-Q345 PolarHBondContact O-N 3.48Å; Q345-S349 PolarHBondContact NE2-OG 2.87Å; Q345-S349 WeakPolarHBondContact O-CB 3.36Å; Q345-S349 PolarHBondContact O-N 2.99Å; Q345-S349 PolarHBondContact O-OG 2.92Å
346	D	95.3	Very high	91.1	Very high	4 Å²	4	41 Å²	41	2%	0.021	20%	0.197	C	C	.	.	H	α-helix	trans	-63.4	-47.1	173.2	-68.5	-15.6	0	0	0	110.3	E342 E343 L344 Y348 S349 F350 R478 R482	E342-D346 PolarHBondContact O-N 2.62Å; E343-D346 WeakPolarHBondContact O-CB 3.33Å; E343-D346 PolarHBondContact O-N 3.49Å; L344-D346 VanDerWaalsContact C-N 3.34Å; D346-Y348 PolarHBondContact O-N 2.84Å; D346-S349 PolarHBondContact O-N 2.57Å; D346-F350 WeakPolarHBondContact O-CB 3.27Å; D346-F350 PolarHBondContact O-N 3.47Å; D346-R478 VanDerWaalsContact CG-NE 3.27Å; D346-R478 IonicContact OD1-CZ 3.38Å; D346-R478 IonicContact OD1-NE 2.58Å; D346-R478 PolarHBondContact OD1-NE 2.83Å; D346-R478 IonicContact OD1-NH2 3.27Å; D346-R478 PolarHBondContact OD1-NH2 3.09Å; D346-R478 IonicContact OD2-NE 2.7Å; D346-R482 VanDerWaalsContact CG-NH2 3.26Å; D346-R482 IonicContact OD1-NH2 3.06Å; D346-R482 PolarHBondContact OD1-NH2 2.99Å; D346-R482 IonicContact OD2-CZ 3.27Å; D346-R482 IonicContact OD2-NH1 3.35Å; D346-R482 PolarHBondContact OD2-NH1 2.77Å; D346-R482 IonicContact OD2-NH2 3.66Å; D346-R482 PolarHBondContact OD2-NH2 2.87Å
347	L	95.1	Very high	90.5	Very high	13 Å²	13	38.7 Å²	38.7	7%	0.068	18%	0.184	C	C	.	.	H	α-helix	trans	-63.3	-40.6	176.5	-69.5	167.9	0	0	0	112.5	L297 A334 V335 A338 E343 L344 S349 F350 F351 P475	L297-L347 HydrophobicContact CD2-CB 4.15Å; A334-L347 HydrophobicContact CB-CD1 4.45Å; A334-L347 HydrophobicContact CB-CD2 3.76Å; A334-L347 WeakPolarHBondContact O-CD1 3.22Å; V335-L347 HydrophobicContact CB-CD1 4.5Å; V335-L347 HydrophobicContact CG2-CD1 4.17Å; A338-L347 HydrophobicContact CB-CD1 4.02Å; E343-L347 WeakPolarHBondContact O-CG 3.05Å; E343-L347 PolarHBondContact O-N 3.06Å; L344-L347 PolarHBondContact O-N 2.91Å; L347-S349 VanDerWaalsContact C-N 3.35Å; L347-F350 WeakPolarHBondContact O-CB 3.13Å; L347-F350 PolarHBondContact O-N 3.39Å; L347-F351 VanDerWaalsContact O-CB 3.3Å; L347-F351 WeakPolarHBondContact O-CB 3.11Å; L347-F351 PolarHBondContact O-N 3.34Å; L347-P475 HydrophobicContact CD2-CB 4.09Å; L347-P475 HydrophobicContact CD2-CG 3.69Å; L347-P475 HydrophobicContact CG-CG 4.43Å
348	Y	92.7	Very high	90.1	Very high	36 Å²	36	32.1 Å²	32.1	14%	0.141	16%	0.162	C	C	.	.	H	α-helix	trans	-64.7	-40.4	174.3	178.7	-117.6	0	0	0	111.9	L297 L344 D346 F351 L352 L390	L297-Y348 HydrophobicContact CD1-CD2 3.71Å; L297-Y348 HydrophobicContact CD1-CG 4.46Å; L344-Y348 WeakPolarHBondContact O-CB 3.31Å; L344-Y348 PolarHBondContact O-N 3.38Å; D346-Y348 PolarHBondContact O-N 2.84Å; Y348-F351 PolarHBondContact O-N 2.7Å; Y348-L352 HydrophobicContact CD1-CD1 4.06Å; Y348-L352 HydrophobicContact CD1-CG 4.5Å; Y348-L352 HydrophobicContact CD2-CG 4.26Å; Y348-L352 HydrophobicContact CE1-CD1 3.43Å; Y348-L352 VanDerWaalsContact CE1-CD1 3.43Å; Y348-L352 HydrophobicContact CE1-CG 4.1Å; Y348-L352 HydrophobicContact CE2-CD1 4.06Å; Y348-L352 HydrophobicContact CE2-CD2 3.98Å; Y348-L352 HydrophobicContact CE2-CG 3.83Å; Y348-L352 VanDerWaalsContact CZ-CD1 3.44Å; Y348-L352 WeakPolarHBondContact O-CB 3.25Å; Y348-L352 WeakPolarHBondContact O-CG 3.24Å; Y348-L352 PolarHBondContact O-N 3.26Å; Y348-L390 HydrophobicContact CD2-CD1 4.11Å; Y348-L390 HydrophobicContact CE2-CB 4.23Å; Y348-L390 HydrophobicContact CE2-CD1 3.58Å
349	S	91.7	Very high	89.7	Confident	16 Å²	16	32.7 Å²	32.7	11%	0.112	16%	0.164	C	C	.	.	H	α-helix	trans	-67.3	-38	177.4	-56.9	0	0	0	0	112.2	Q345 D346 L347 L353	Q345-S349 PolarHBondContact NE2-OG 2.87Å; Q345-S349 WeakPolarHBondContact O-CB 3.36Å; Q345-S349 PolarHBondContact O-N 2.99Å; Q345-S349 PolarHBondContact O-OG 2.92Å; D346-S349 PolarHBondContact O-N 2.57Å; L347-S349 VanDerWaalsContact C-N 3.35Å; S349-L353 PolarHBondContact O-N 2.58Å
350	F	92.6	Very high	89.3	Confident	5 Å²	5	30.6 Å²	30.6	2%	0.022	16%	0.159	C	C	.	.	H	α-helix	trans	-60.8	-49.8	171.3	173.1	-100.3	0	0	0	110.9	D346 L347 L352 L353 Y354 R473 E474 P475	D346-F350 WeakPolarHBondContact O-CB 3.27Å; D346-F350 PolarHBondContact O-N 3.47Å; L347-F350 WeakPolarHBondContact O-CB 3.13Å; L347-F350 PolarHBondContact O-N 3.39Å; F350-L352 PolarHBondContact O-N 3.47Å; F350-L353 WeakPolarHBondContact O-CB 3.44Å; F350-L353 PolarHBondContact O-N 3.06Å; F350-Y354 HydrophobicContact CD2-CD2 4.33Å; F350-Y354 AromaticContact CD2-CE2 3.83Å; F350-Y354 HydrophobicContact CD2-CE2 3.83Å; F350-Y354 HydrophobicContact CE2-CD2 4.09Å; F350-Y354 AromaticContact CE2-CE2 3.47Å; F350-Y354 HydrophobicContact CE2-CE2 3.47Å; F350-Y354 VanDerWaalsContact CE2-CE2 3.47Å; F350-Y354 HydrophobicContact CZ-CD2 4.21Å; F350-Y354 AromaticContact CZ-CE2 3.95Å; F350-Y354 HydrophobicContact CZ-CE2 3.95Å; F350-Y354 WeakPolarHBondContact O-CD2 3.45Å; F350-R473 WeakPolarHBondContact CB-O 3.32Å; F350-E474 VanDerWaalsContact CE2-OE2 3.29Å; F350-E474 WeakPolarHBondContact CE2-OE2 3.38Å; F350-P475 HydrophobicContact CB-CG 3.93Å; F350-P475 HydrophobicContact CD2-CG 4.33Å; F350-P475 HydrophobicContact CG-CG 4.05Å
351	F	91.1	Very high	89	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-59	-48	178.1	178.1	-95.9	0	0	0	112	L300 F301 V304 L327 L347 Y348 L353 Y354 Y355 V359	L300-F351 HydrophobicContact CD2-CD1 4.08Å; L300-F351 HydrophobicContact CD2-CE1 3.39Å; L300-F351 HydrophobicContact CD2-CZ 4.03Å; L300-F351 HydrophobicContact CG-CE1 3.61Å; L300-F351 HydrophobicContact CG-CZ 3.68Å; F301-F351 HydrophobicContact CD1-CD2 4.4Å; F301-F351 AromaticContact CD2-CD2 3.26Å; F301-F351 HydrophobicContact CD2-CD2 3.26Å; F301-F351 AromaticContact CD2-CE2 3.43Å; F301-F351 HydrophobicContact CD2-CE2 3.43Å; F301-F351 VanDerWaalsContact CD2-CE2 3.43Å; F301-F351 AromaticContact CD2-CG 3.88Å; F301-F351 HydrophobicContact CD2-CG 3.88Å; F301-F351 HydrophobicContact CD2-CZ 4.17Å; F301-F351 HydrophobicContact CE1-CD2 4.23Å; F301-F351 HydrophobicContact CE2-CB 3.5Å; F301-F351 VanDerWaalsContact CE2-CB 3.5Å; F301-F351 HydrophobicContact CE2-CD1 4.2Å; F301-F351 AromaticContact CE2-CD2 3.03Å; F301-F351 HydrophobicContact CE2-CD2 3.03Å; F301-F351 AromaticContact CE2-CE2 3.75Å; F301-F351 HydrophobicContact CE2-CE2 3.75Å; F301-F351 AromaticContact CE2-CG 3.3Å; F301-F351 HydrophobicContact CE2-CG 3.3Å; F301-F351 AromaticContact CG-CD2 3.97Å; F301-F351 HydrophobicContact CG-CD2 3.97Å; F301-F351 AromaticContact CG-CE2 3.99Å; F301-F351 HydrophobicContact CG-CE2 3.99Å; F301-F351 HydrophobicContact CZ-CB 3.74Å; F301-F351 AromaticContact CZ-CD2 3.58Å; F301-F351 HydrophobicContact CZ-CD2 3.58Å; F301-F351 AromaticContact CZ-CG 3.95Å; F301-F351 HydrophobicContact CZ-CG 3.95Å; V304-F351 HydrophobicContact CB-CE2 4.42Å; V304-F351 HydrophobicContact CB-CZ 4.3Å; V304-F351 HydrophobicContact CG2-CE2 4.33Å; V304-F351 HydrophobicContact CG2-CZ 3.73Å; L327-F351 HydrophobicContact CD1-CE2 4.21Å; L347-F351 VanDerWaalsContact O-CB 3.3Å; L347-F351 WeakPolarHBondContact O-CB 3.11Å; L347-F351 PolarHBondContact O-N 3.34Å; Y348-F351 PolarHBondContact O-N 2.7Å; F351-L353 PolarHBondContact O-N 3.15Å; F351-Y354 PolarHBondContact O-N 2.87Å; F351-Y355 HydrophobicContact CB-CD2 4.42Å; F351-Y355 AromaticContact CD2-CD2 3.28Å; F351-Y355 HydrophobicContact CD2-CD2 3.28Å; F351-Y355 AromaticContact CD2-CE2 3.95Å; F351-Y355 HydrophobicContact CD2-CE2 3.95Å; F351-Y355 HydrophobicContact CD2-CG 4.07Å; F351-Y355 AromaticContact CE2-CD2 3.56Å; F351-Y355 HydrophobicContact CE2-CD2 3.56Å; F351-Y355 HydrophobicContact CE2-CE2 4.36Å; F351-Y355 AromaticContact CE2-CG 3.9Å; F351-Y355 HydrophobicContact CE2-CG 3.9Å; F351-Y355 AromaticContact CG-CD2 3.89Å; F351-Y355 HydrophobicContact CG-CD2 3.89Å; F351-Y355 HydrophobicContact CZ-CD2 4.34Å; F351-Y355 HydrophobicContact CZ-CG 4.35Å; F351-Y355 WeakPolarHBondContact O-CB 3.43Å; F351-Y355 WeakPolarHBondContact O-CD2 3.3Å; F351-Y355 PolarHBondContact O-N 3.05Å; F351-V359 HydrophobicContact CE1-CG2 3.49Å; F351-V359 VanDerWaalsContact CE1-CG2 3.49Å; F351-V359 HydrophobicContact CZ-CG2 3.84Å
352	L	89.1	Confident	88.7	Confident	37 Å²	37	31.2 Å²	31.2	19%	0.194	16%	0.158	C	C	.	.	H	α-helix	trans	-61.8	-30.2	178.5	-75.6	-175.5	0	0	0	113.4	Y348 F350 Y354 S356 V393	Y348-L352 HydrophobicContact CD1-CD1 4.06Å; Y348-L352 HydrophobicContact CD1-CG 4.5Å; Y348-L352 HydrophobicContact CD2-CG 4.26Å; Y348-L352 HydrophobicContact CE1-CD1 3.43Å; Y348-L352 VanDerWaalsContact CE1-CD1 3.43Å; Y348-L352 HydrophobicContact CE1-CG 4.1Å; Y348-L352 HydrophobicContact CE2-CD1 4.06Å; Y348-L352 HydrophobicContact CE2-CD2 3.98Å; Y348-L352 HydrophobicContact CE2-CG 3.83Å; Y348-L352 VanDerWaalsContact CZ-CD1 3.44Å; Y348-L352 WeakPolarHBondContact O-CB 3.25Å; Y348-L352 WeakPolarHBondContact O-CG 3.24Å; Y348-L352 PolarHBondContact O-N 3.26Å; F350-L352 PolarHBondContact O-N 3.47Å; L352-Y354 VanDerWaalsContact C-N 3.34Å; L352-Y354 PolarHBondContact O-N 3.15Å; L352-S356 WeakPolarHBondContact O-CB 3.3Å; L352-S356 PolarHBondContact O-N 3.12Å; L352-S356 PolarHBondContact O-OG 3.07Å; L352-S356 VanDerWaalsContact O-OG 3.05Å; L352-V393 HydrophobicContact CD1-CG2 4.17Å
353	L	88.8	Confident	88.3	Confident	18 Å²	18	29 Å²	29	9%	0.094	15%	0.147	C	C	.	.	H	α-helix	trans	-61.5	-44.1	178.8	-178.6	66.1	0	0	0	111.5	S349 F350 F351 Y399 L469 Q470 R473	S349-L353 PolarHBondContact O-N 2.58Å; F350-L353 WeakPolarHBondContact O-CB 3.44Å; F350-L353 PolarHBondContact O-N 3.06Å; F351-L353 PolarHBondContact O-N 3.15Å; L353-Y399 HydrophobicContact CD1-CD1 3.66Å; L353-Y399 HydrophobicContact CD1-CD2 3.78Å; L353-Y399 HydrophobicContact CD1-CE1 3.79Å; L353-Y399 HydrophobicContact CD1-CE2 3.9Å; L353-Y399 HydrophobicContact CD1-CG 3.65Å; L353-Y399 HydrophobicContact CG-CD1 4.43Å; L353-Y399 HydrophobicContact CG-CE1 4.08Å; L353-Y399 HydrophobicContact CG-CE2 4.4Å; L353-Y399 WeakPolarHBondContact O-CE1 3.43Å; L353-L469 HydrophobicContact CD1-CD2 3.68Å; L353-L469 HydrophobicContact CD1-CG 3.95Å; L353-Q470 HydrophobicContact CD2-CB 4.48Å; L353-Q470 HydrophobicContact CD2-CG 4.12Å; L353-R473 HydrophobicContact CD2-CB 3.85Å; L353-R473 HydrophobicContact CD2-CG 4.08Å
354	Y	87.5	Confident	87.8	Confident	48 Å²	48	30.5 Å²	30.5	19%	0.188	16%	0.155	C	C	.	.	H	α-helix	trans	-93.8	-31	-175.4	-63.1	-74.6	0	0	0	113.4	R325 F350 F351 L352	R325-Y354 HydrophobicContact CB-CD1 4.33Å; F350-Y354 HydrophobicContact CD2-CD2 4.33Å; F350-Y354 AromaticContact CD2-CE2 3.83Å; F350-Y354 HydrophobicContact CD2-CE2 3.83Å; F350-Y354 HydrophobicContact CE2-CD2 4.09Å; F350-Y354 AromaticContact CE2-CE2 3.47Å; F350-Y354 HydrophobicContact CE2-CE2 3.47Å; F350-Y354 VanDerWaalsContact CE2-CE2 3.47Å; F350-Y354 HydrophobicContact CZ-CD2 4.21Å; F350-Y354 AromaticContact CZ-CE2 3.95Å; F350-Y354 HydrophobicContact CZ-CE2 3.95Å; F350-Y354 WeakPolarHBondContact O-CD2 3.45Å; F351-Y354 PolarHBondContact O-N 2.87Å; L352-Y354 VanDerWaalsContact C-N 3.34Å; L352-Y354 PolarHBondContact O-N 3.15Å
355	Y	87	Confident	87.1	Confident	2 Å²	2	33.6 Å²	33.6	1%	0.008	17%	0.166	C	C	.	.	H	α-helix	trans	-116	4	-166.3	-52.3	-67	0	0	0	114.6	V304 R325 L327 F351 C357 D358 V359	V304-Y355 HydrophobicContact CG1-CD1 3.79Å; V304-Y355 HydrophobicContact CG1-CE1 4.45Å; V304-Y355 HydrophobicContact CG1-CG 4.17Å; R325-Y355 PolarHBondContact NH1-OH 3.23Å; R325-Y355 WeakPolarHBondContact O-CE1 3.35Å; R325-Y355 VanDerWaalsContact O-CZ 3.31Å; R325-Y355 PolarHBondContact O-OH 3.02Å; L327-Y355 HydrophobicContact CD2-CD2 4.31Å; L327-Y355 HydrophobicContact CD2-CE1 4.39Å; L327-Y355 HydrophobicContact CD2-CE2 3.5Å; L327-Y355 VanDerWaalsContact CD2-CE2 3.5Å; L327-Y355 HydrophobicContact CG-CE1 4.02Å; L327-Y355 HydrophobicContact CG-CE2 4.03Å; F351-Y355 HydrophobicContact CB-CD2 4.42Å; F351-Y355 AromaticContact CD2-CD2 3.28Å; F351-Y355 HydrophobicContact CD2-CD2 3.28Å; F351-Y355 AromaticContact CD2-CE2 3.95Å; F351-Y355 HydrophobicContact CD2-CE2 3.95Å; F351-Y355 HydrophobicContact CD2-CG 4.07Å; F351-Y355 AromaticContact CE2-CD2 3.56Å; F351-Y355 HydrophobicContact CE2-CD2 3.56Å; F351-Y355 HydrophobicContact CE2-CE2 4.36Å; F351-Y355 AromaticContact CE2-CG 3.9Å; F351-Y355 HydrophobicContact CE2-CG 3.9Å; F351-Y355 AromaticContact CG-CD2 3.89Å; F351-Y355 HydrophobicContact CG-CD2 3.89Å; F351-Y355 HydrophobicContact CZ-CD2 4.34Å; F351-Y355 HydrophobicContact CZ-CG 4.35Å; F351-Y355 WeakPolarHBondContact O-CB 3.43Å; F351-Y355 WeakPolarHBondContact O-CD2 3.3Å; F351-Y355 PolarHBondContact O-N 3.05Å; Y355-C357 PolarHBondContact O-N 2.9Å; Y355-C357 VanDerWaalsContact O-N 3.14Å; Y355-D358 PolarHBondContact O-N 2.85Å; Y355-V359 WeakPolarHBondContact O-CG2 3.39Å; Y355-V359 PolarHBondContact O-N 3.27Å
356	S	82.6	Confident	86.4	Confident	27 Å²	27	30.9 Å²	30.9	19%	0.189	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-33.5	-177.3	50.8	0	0	0	0	114.3	L352 P360	L352-S356 WeakPolarHBondContact O-CB 3.3Å; L352-S356 PolarHBondContact O-N 3.12Å; L352-S356 PolarHBondContact O-OG 3.07Å; L352-S356 VanDerWaalsContact O-OG 3.05Å; S356-P360 WeakPolarHBondContact O-CD 3.22Å
357	C	79.9	Confident	85.6	Confident	32 Å²	32	35.6 Å²	35.6	22%	0.216	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.4	-21.8	176.5	-69.8	0	0	0	0	113.8	Y355 K361 Q400	Y355-C357 PolarHBondContact O-N 2.9Å; Y355-C357 VanDerWaalsContact O-N 3.14Å; C357-K361 WeakPolarHBondContact O-CE 3.22Å; C357-Q400 PolarHBondContact SG-OE1 2.84Å
358	D	82.1	Confident	84.9	Confident	30 Å²	30	42.6 Å²	42.6	16%	0.16	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.6	-30.5	-179.3	-69.3	-22.1	0	0	0	111.7	V304 Y307 Y355 K361 A362	V304-D358 HydrophobicContact CG1-CB 4.27Å; Y307-D358 HydrophobicContact CE1-CB 4.42Å; Y355-D358 PolarHBondContact O-N 2.85Å; D358-K361 CarbonylContact O-C 3.26Å; D358-K361 PolarHBondContact O-N 2.85Å; D358-K361 VanDerWaalsContact O-N 3.07Å; D358-A362 VanDerWaalsContact O-CB 3.3Å; D358-A362 WeakPolarHBondContact O-CB 3.39Å; D358-A362 PolarHBondContact O-N 3.3Å
359	V	84.1	Confident	84.1	Confident	15 Å²	15	44.9 Å²	44.9	9%	0.091	21%	0.206	C	C	.	.	H	α-helix	trans	-51	-52	-179.3	164.9	0	0	0	0	113.1	L300 V304 F351 Y355 K361 A362 L363	L300-V359 HydrophobicContact CD1-CG1 3.93Å; L300-V359 HydrophobicContact CD1-CG2 4.12Å; L300-V359 HydrophobicContact CD2-CG2 4.44Å; L300-V359 HydrophobicContact CG-CG2 4.42Å; V304-V359 HydrophobicContact CG2-CG2 4.1Å; F351-V359 HydrophobicContact CE1-CG2 3.49Å; F351-V359 VanDerWaalsContact CE1-CG2 3.49Å; F351-V359 HydrophobicContact CZ-CG2 3.84Å; Y355-V359 WeakPolarHBondContact O-CG2 3.39Å; Y355-V359 PolarHBondContact O-N 3.27Å; V359-K361 VanDerWaalsContact C-N 3.31Å; V359-K361 PolarHBondContact O-N 3.27Å; V359-A362 PolarHBondContact O-N 3.44Å; V359-L363 HydrophobicContact CG1-CD1 4.09Å; V359-L363 VanDerWaalsContact O-CG 3.31Å; V359-L363 WeakPolarHBondContact O-CG 3.33Å; V359-L363 PolarHBondContact O-N 2.9Å
360	P	82.9	Confident	83.2	Confident	50 Å²	50	45.2 Å²	45.2	33%	0.325	21%	0.207	S	C	.	.	H	α-helix	trans	-63.6	-37.7	179.5	-22	34.2	0	0	0	112.8	S356 E364	S356-P360 WeakPolarHBondContact O-CD 3.22Å; P360-E364 WeakPolarHBondContact O-CB 3.21Å; P360-E364 PolarHBondContact O-N 3.46Å
361	K	84.7	Confident	82.4	Confident	100 Å²	100	48 Å²	48	44%	0.435	23%	0.231	S	C	.	.	H	α-helix	trans	-69.2	-42.2	179.7	-57.6	177.5	-168.3	164.5	0	111.1	Y307 C357 D358 V359 E364 Y365	Y307-K361 HydrophobicContact CE1-CB 4.11Å; Y307-K361 HydrophobicContact CE2-CB 4.12Å; Y307-K361 WeakPolarHBondContact OH-CD 3.38Å; C357-K361 WeakPolarHBondContact O-CE 3.22Å; D358-K361 CarbonylContact O-C 3.26Å; D358-K361 PolarHBondContact O-N 2.85Å; D358-K361 VanDerWaalsContact O-N 3.07Å; V359-K361 VanDerWaalsContact C-N 3.31Å; V359-K361 PolarHBondContact O-N 3.27Å; K361-E364 PolarHBondContact O-N 3.23Å; K361-Y365 WeakPolarHBondContact O-CB 3.29Å; K361-Y365 PolarHBondContact O-N 3.24Å
362	A	84	Confident	81.5	Confident	1 Å²	1	53.5 Å²	53.5	1%	0.008	27%	0.265	C	S	.	.	H	α-helix	trans	-64.8	-42.8	177.2	0	0	0	0	0	111.6	V304 Y307 D358 V359 Y365 K366	V304-A362 HydrophobicContact CG2-CB 3.89Å; Y307-A362 HydrophobicContact CD1-CB 4.2Å; Y307-A362 HydrophobicContact CG-CB 4Å; D358-A362 VanDerWaalsContact O-CB 3.3Å; D358-A362 WeakPolarHBondContact O-CB 3.39Å; D358-A362 PolarHBondContact O-N 3.3Å; V359-A362 PolarHBondContact O-N 3.44Å; A362-Y365 PolarHBondContact O-N 3.24Å; A362-K366 WeakPolarHBondContact O-CB 3.48Å; A362-K366 PolarHBondContact O-N 3.47Å
363	L	82.7	Confident	80.5	Confident	8 Å²	8	57 Å²	57	4%	0.042	28%	0.283	C	S	.	.	H	α-helix	trans	-65.7	-41.5	174.6	-68	177.3	0	0	0	111.8	V359 K366 R367 N388	V359-L363 HydrophobicContact CG1-CD1 4.09Å; V359-L363 VanDerWaalsContact O-CG 3.31Å; V359-L363 WeakPolarHBondContact O-CG 3.33Å; V359-L363 PolarHBondContact O-N 2.9Å; L363-K366 PolarHBondContact O-N 3.02Å; L363-R367 WeakPolarHBondContact O-CG 3.46Å; L363-R367 PolarHBondContact O-N 2.81Å; L363-N388 HydrophobicContact CD2-CB 3.77Å
364	E	82.1	Confident	79.2	Confident	83 Å²	83	59.3 Å²	59.3	39%	0.388	31%	0.312	S	S	.	.	H	α-helix	trans	-65	-40.8	174.2	-169.6	-178	173.2	0	0	112.4	P360 K361 R367 R368	P360-E364 WeakPolarHBondContact O-CB 3.21Å; P360-E364 PolarHBondContact O-N 3.46Å; K361-E364 PolarHBondContact O-N 3.23Å; E364-R367 WeakPolarHBondContact O-CB 3Å; E364-R367 PolarHBondContact O-N 2.99Å; E364-R368 WeakPolarHBondContact O-CG 3.17Å; E364-R368 PolarHBondContact O-N 3.03Å; E364-R368 IonicContact OE1-CZ 3.18Å; E364-R368 IonicContact OE1-NE 3.37Å; E364-R368 PolarHBondContact OE1-NE 3.11Å; E364-R368 IonicContact OE1-NH2 3.8Å; E364-R368 PolarHBondContact OE1-NH2 3.47Å
365	Y	80.6	Confident	77.9	Confident	78 Å²	78	64.1 Å²	64.1	31%	0.306	34%	0.341	S	S	.	.	H	α-helix	trans	-59.4	-49.1	174.5	179.6	-96.2	0	0	0	111.1	Y307 D310 K361 A362 R367 R368 K369	Y307-Y365 HydrophobicContact CD2-CD1 4.31Å; Y307-Y365 HydrophobicContact CD2-CD2 4.21Å; Y307-Y365 AromaticContact CD2-CG 3.83Å; Y307-Y365 HydrophobicContact CD2-CG 3.83Å; D310-Y365 HydrophobicContact CB-CE1 4.39Å; D310-Y365 VanDerWaalsContact OD2-CE1 3.27Å; D310-Y365 WeakPolarHBondContact OD2-CE1 3.49Å; D310-Y365 VanDerWaalsContact OD2-CZ 3.3Å; D310-Y365 PolarHBondContact OD2-OH 2.86Å; K361-Y365 WeakPolarHBondContact O-CB 3.29Å; K361-Y365 PolarHBondContact O-N 3.24Å; A362-Y365 PolarHBondContact O-N 3.24Å; Y365-R367 PolarHBondContact O-N 2.83Å; Y365-R368 PolarHBondContact O-N 2.78Å; Y365-K369 HydrophobicContact CE1-CD 3.95Å; Y365-K369 PolarHBondContact O-N 3.19Å
366	K	78.9	Confident	76.2	Confident	46 Å²	46	67.9 Å²	67.9	20%	0.2	36%	0.358	C	S	.	.	H	α-helix	trans	-58.6	-44.7	175.6	-168.9	-176.5	176.2	-156.5	0	111.6	A362 L363 R368 K369 L370 E384	A362-K366 WeakPolarHBondContact O-CB 3.48Å; A362-K366 PolarHBondContact O-N 3.47Å; L363-K366 PolarHBondContact O-N 3.02Å; K366-R368 PolarHBondContact O-N 3.1Å; K366-K369 PolarHBondContact O-N 2.96Å; K366-L370 HydrophobicContact CG-CD1 4.14Å; K366-L370 HydrophobicContact CG-CG 4.5Å; K366-L370 WeakPolarHBondContact O-CG 3.46Å; K366-L370 PolarHBondContact O-N 2.85Å; K366-E384 WeakPolarHBondContact CE-OE2 3.5Å; K366-E384 IonicContact NZ-OE2 3.14Å; K366-E384 PolarHBondContact NZ-OE2 3.42Å
367	R	77.9	Confident	75.1	Confident	103 Å²	103	68.9 Å²	68.9	39%	0.389	37%	0.366	S	S	.	.	H	α-helix	trans	-55.4	-47.6	173.9	-77.4	-172.3	-71.2	-124.3	-2.6	112.5	L363 E364 Y365 L370 A371 I381 C385	L363-R367 WeakPolarHBondContact O-CG 3.46Å; L363-R367 PolarHBondContact O-N 2.81Å; E364-R367 WeakPolarHBondContact O-CB 3Å; E364-R367 PolarHBondContact O-N 2.99Å; Y365-R367 PolarHBondContact O-N 2.83Å; R367-L370 PolarHBondContact O-N 2.87Å; R367-A371 WeakPolarHBondContact O-CB 3.44Å; R367-A371 PolarHBondContact O-N 3.36Å; R367-I381 HydrophobicContact CB-CG2 4.25Å; R367-I381 HydrophobicContact CG-CG2 3.96Å; R367-C385 HydrophobicContact CG-CB 4.09Å; R367-C385 WeakPolarHBondContact CG-SG 3.3Å
368	R	79.8	Confident	73.9	Confident	159 Å²	159	72.8 Å²	72.8	60%	0.6	39%	0.388	S	S	*	.	H	α-helix	trans	-64.9	-40.2	179.9	-70.3	176.9	-174.6	-168.4	2.5	111.6	E364 Y365 K366 A371 T372	E364-R368 WeakPolarHBondContact O-CG 3.17Å; E364-R368 PolarHBondContact O-N 3.03Å; E364-R368 IonicContact OE1-CZ 3.18Å; E364-R368 IonicContact OE1-NE 3.37Å; E364-R368 PolarHBondContact OE1-NE 3.11Å; E364-R368 IonicContact OE1-NH2 3.8Å; E364-R368 PolarHBondContact OE1-NH2 3.47Å; Y365-R368 PolarHBondContact O-N 2.78Å; K366-R368 PolarHBondContact O-N 3.1Å; R368-A371 PolarHBondContact O-N 3.46Å; R368-T372 WeakPolarHBondContact O-CB 3.17Å; R368-T372 PolarHBondContact O-N 3.02Å; R368-T372 PolarHBondContact O-OG1 2.86Å
369	K	76.7	Confident	72.6	Confident	84 Å²	84	74.3 Å²	74.3	37%	0.365	40%	0.401	S	S	.	.	H	α-helix	trans	-64.2	-45.7	177.4	-159.7	171.7	-174.3	168.7	0	111.2	D310 Y365 K366 T372 N373	D310-K369 IonicContact OD2-NZ 3.24Å; D310-K369 PolarHBondContact OD2-NZ 3.07Å; Y365-K369 HydrophobicContact CE1-CD 3.95Å; Y365-K369 PolarHBondContact O-N 3.19Å; K366-K369 PolarHBondContact O-N 2.96Å; K369-T372 PolarHBondContact O-N 3.07Å; K369-N373 PolarHBondContact O-N 3.03Å
370	L	73.2	Confident	71.4	Confident	23 Å²	23	77.3 Å²	77.3	12%	0.12	42%	0.417	C	S	.	.	H	α-helix	trans	-62.8	-43.4	175	-70.9	169.1	0	0	0	112.4	K366 R367 T372 N373 I381	K366-L370 HydrophobicContact CG-CD1 4.14Å; K366-L370 HydrophobicContact CG-CG 4.5Å; K366-L370 WeakPolarHBondContact O-CG 3.46Å; K366-L370 PolarHBondContact O-N 2.85Å; R367-L370 PolarHBondContact O-N 2.87Å; L370-T372 PolarHBondContact O-N 3.38Å; L370-N373 PolarHBondContact O-N 3.12Å; L370-I381 HydrophobicContact CB-CG1 4.24Å
371	A	75.5	Confident	70.1	Confident	65 Å²	65	75.9 Å²	75.9	54%	0.537	41%	0.406	S	S	.	.	H	α-helix	trans	-64.2	-29.6	176.5	0	0	0	0	0	113	R367 R368 I381	R367-A371 WeakPolarHBondContact O-CB 3.44Å; R367-A371 PolarHBondContact O-N 3.36Å; R368-A371 PolarHBondContact O-N 3.46Å; A371-I381 HydrophobicContact CB-CD1 4.21Å
372	T	71.6	Confident	68.8	Low	115 Å²	115	76.8 Å²	76.8	71%	0.706	41%	0.412	S	S	*	.	H	α-helix	trans	-76	-30.1	178	-51	0	0	0	0	111.9	R368 K369 L370 G374	R368-T372 WeakPolarHBondContact O-CB 3.17Å; R368-T372 PolarHBondContact O-N 3.02Å; R368-T372 PolarHBondContact O-OG1 2.86Å; K369-T372 PolarHBondContact O-N 3.07Å; L370-T372 PolarHBondContact O-N 3.38Å; T372-G374 VanDerWaalsContact C-N 3.26Å; T372-G374 PolarHBondContact O-N 3.48Å
373	N	67	Low	67.5	Low	109 Å²	109	80.9 Å²	80.9	58%	0.583	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	-1	-176.7	-76.9	-2.2	0	0	0	114.7	K369 L370 D375	K369-N373 PolarHBondContact O-N 3.03Å; L370-N373 PolarHBondContact O-N 3.12Å; N373-D375 PolarHBondContact O-N 3.06Å
374	G	61.8	Low	66.1	Low	67 Å²	67	83.9 Å²	83.9	69%	0.691	45%	0.448	S	S	*	.	S	Bend	trans	71.5	-13.7	166.1	0	0	0	0	0	117.7	T372	T372-G374 VanDerWaalsContact C-N 3.26Å; T372-G374 PolarHBondContact O-N 3.48Å
375	D	60.6	Low	64.8	Low	149 Å²	149	80.1 Å²	80.1	80%	0.797	43%	0.431	S	S	*	.			trans	-97.7	2.2	-171.8	-86.3	-17.8	0	0	0	115.4	N373	N373-D375 PolarHBondContact O-N 3.06Å
376	H	51.1	Low	63.5	Low	81 Å²	81	82.4 Å²	82.4	38%	0.375	44%	0.444	S	S	.	.			trans	-119.6	133.4	-177.2	-62	-67.2	0	0	0	112.5	D380 I381	H376-D380 HydrophobicContact CB-CB 4.44Å; H376-I381 HydrophobicContact CB-CD1 4.16Å; H376-I381 HydrophobicContact CB-CG1 3.76Å
377	S	59	Low	62.3	Low	49 Å²	49	87.4 Å²	87.4	34%	0.343	47%	0.468	S	S	.	.			trans	-67	156.9	170.8	72.9	0	0	0	0	110.6	S379 D380 I381	S377-S379 PolarHBondContact O-N 2.84Å; S377-S379 PolarHBondContact OG-OG 3.2Å; S377-D380 WeakPolarHBondContact CB-OD2 3.49Å; S377-D380 PolarHBondContact N-OD2 3.2Å; S377-D380 PolarHBondContact O-N 3.27Å; S377-D380 VanDerWaalsContact O-N 3.1Å; S377-D380 PolarHBondContact OG-N 2.96Å; S377-D380 PolarHBondContact OG-OD1 3.3Å; S377-D380 PolarHBondContact OG-OD2 2.96Å; S377-I381 WeakPolarHBondContact O-CG1 3.46Å; S377-I381 PolarHBondContact O-N 2.87Å; S377-I381 VanDerWaalsContact O-N 3.15Å
378	T	56.3	Low	61	Low	113 Å²	113	83.2 Å²	83.2	69%	0.693	45%	0.454	S	S	*	.	H	α-helix	trans	-57.5	-34.9	176	41.6	0	0	0	0	112.2	E382	T378-E382 WeakPolarHBondContact O-CB 3.42Å; T378-E382 WeakPolarHBondContact O-CG 3.38Å; T378-E382 PolarHBondContact O-N 2.8Å
379	S	55.1	Low	59.6	Low	62 Å²	62	78.4 Å²	78.4	43%	0.434	45%	0.448	S	S	.	.	H	α-helix	trans	-66.3	-38.2	175.2	43.8	0	0	0	0	113.1	S377 E382 N383	S377-S379 PolarHBondContact O-N 2.84Å; S377-S379 PolarHBondContact OG-OG 3.2Å; S379-E382 PolarHBondContact O-N 3.24Å; S379-N383 WeakPolarHBondContact O-CB 3.45Å; S379-N383 VanDerWaalsContact O-CG 3.28Å; S379-N383 PolarHBondContact O-N 2.95Å; S379-N383 PolarHBondContact O-ND2 3.48Å
380	D	57.6	Low	58.5	Low	78 Å²	78	77.7 Å²	77.7	42%	0.417	45%	0.448	S	S	.	.	H	α-helix	trans	-67.9	-40.9	178.4	-59.3	-35.3	0	0	0	111	H376 S377 N383 E384	H376-D380 HydrophobicContact CB-CB 4.44Å; S377-D380 WeakPolarHBondContact CB-OD2 3.49Å; S377-D380 PolarHBondContact N-OD2 3.2Å; S377-D380 PolarHBondContact O-N 3.27Å; S377-D380 VanDerWaalsContact O-N 3.1Å; S377-D380 PolarHBondContact OG-N 2.96Å; S377-D380 PolarHBondContact OG-OD1 3.3Å; S377-D380 PolarHBondContact OG-OD2 2.96Å; D380-N383 PolarHBondContact O-N 3.37Å; D380-E384 PolarHBondContact O-N 3.46Å
381	I	56.7	Low	57.5	Low	21 Å²	21	85.2 Å²	85.2	11%	0.108	48%	0.479	C	S	.	.	H	α-helix	trans	-64.2	-43	176.8	-60.5	169.2	0	0	0	110.6	R367 L370 A371 H376 S377 C385	R367-I381 HydrophobicContact CB-CG2 4.25Å; R367-I381 HydrophobicContact CG-CG2 3.96Å; L370-I381 HydrophobicContact CB-CG1 4.24Å; A371-I381 HydrophobicContact CB-CD1 4.21Å; H376-I381 HydrophobicContact CB-CD1 4.16Å; H376-I381 HydrophobicContact CB-CG1 3.76Å; S377-I381 WeakPolarHBondContact O-CG1 3.46Å; S377-I381 PolarHBondContact O-N 2.87Å; S377-I381 VanDerWaalsContact O-N 3.15Å; I381-C385 WeakPolarHBondContact O-CB 3.48Å; I381-C385 PolarHBondContact O-N 3.41Å; I381-C385 PolarHBondContact O-SG 3.47Å; I381-C385 VanDerWaalsContact O-SG 3.34Å
382	E	56.1	Low	56.3	Low	118 Å²	118	88.8 Å²	88.8	55%	0.551	49%	0.485	S	S	*	.	H	α-helix	trans	-65.2	-45.5	176.4	-77.7	-174.1	176.7	0	0	111.7	T378 S379 C385 Q386	T378-E382 WeakPolarHBondContact O-CB 3.42Å; T378-E382 WeakPolarHBondContact O-CG 3.38Å; T378-E382 PolarHBondContact O-N 2.8Å; S379-E382 PolarHBondContact O-N 3.24Å; E382-C385 PolarHBondContact O-N 3.49Å; E382-Q386 WeakPolarHBondContact O-CB 3.22Å; E382-Q386 VanDerWaalsContact O-CG 3.27Å; E382-Q386 WeakPolarHBondContact O-CG 3.08Å; E382-Q386 PolarHBondContact O-N 3.45Å
383	N	56.6	Low	55.3	Low	87 Å²	87	86.6 Å²	86.6	47%	0.465	47%	0.471	S	S	.	.	H	α-helix	trans	-61.7	-46.8	178.5	-78.5	-22.3	0	0	0	112.4	S379 D380 C385 Q386 Q387	S379-N383 WeakPolarHBondContact O-CB 3.45Å; S379-N383 VanDerWaalsContact O-CG 3.28Å; S379-N383 PolarHBondContact O-N 2.95Å; S379-N383 PolarHBondContact O-ND2 3.48Å; D380-N383 PolarHBondContact O-N 3.37Å; N383-C385 VanDerWaalsContact C-N 3.27Å; N383-C385 PolarHBondContact O-N 3.28Å; N383-Q386 PolarHBondContact O-N 2.96Å; N383-Q387 WeakPolarHBondContact O-CB 3.32Å; N383-Q387 WeakPolarHBondContact O-CG 3.22Å; N383-Q387 PolarHBondContact O-N 3.09Å
384	E	54.1	Low	54.4	Low	71 Å²	71	85.1 Å²	85.1	33%	0.332	47%	0.474	S	S	.	.	H	α-helix	trans	-60.8	-36.7	176.2	-88	-152.8	-174.8	0	0	112.3	K366 D380 N388	K366-E384 WeakPolarHBondContact CE-OE2 3.5Å; K366-E384 IonicContact NZ-OE2 3.14Å; K366-E384 PolarHBondContact NZ-OE2 3.42Å; D380-E384 PolarHBondContact O-N 3.46Å; E384-N388 PolarHBondContact O-N 3.28Å; E384-N388 PolarHBondContact O-ND2 3.31Å
385	C	54.1	Low	53.9	Low	5 Å²	5	85.5 Å²	85.5	3%	0.034	47%	0.466	C	S	.	.	H	α-helix	trans	-80.2	-30.5	-179.6	-70.1	0	0	0	0	113.1	R367 I381 E382 N383 A389	R367-C385 HydrophobicContact CG-CB 4.09Å; R367-C385 WeakPolarHBondContact CG-SG 3.3Å; I381-C385 WeakPolarHBondContact O-CB 3.48Å; I381-C385 PolarHBondContact O-N 3.41Å; I381-C385 PolarHBondContact O-SG 3.47Å; I381-C385 VanDerWaalsContact O-SG 3.34Å; E382-C385 PolarHBondContact O-N 3.49Å; N383-C385 VanDerWaalsContact C-N 3.27Å; N383-C385 PolarHBondContact O-N 3.28Å; C385-A389 PolarHBondContact O-N 2.72Å
386	Q	54.4	Low	53.6	Low	126 Å²	126	89 Å²	89	59%	0.589	47%	0.468	S	S	*	.	H	α-helix	trans	-70.8	-41	172.4	-75.8	-179.7	13.9	0	0	111.6	E382 N383 N388 A389	E382-Q386 WeakPolarHBondContact O-CB 3.22Å; E382-Q386 VanDerWaalsContact O-CG 3.27Å; E382-Q386 WeakPolarHBondContact O-CG 3.08Å; E382-Q386 PolarHBondContact O-N 3.45Å; N383-Q386 PolarHBondContact O-N 2.96Å; Q386-N388 PolarHBondContact O-N 3.06Å; Q386-A389 VanDerWaalsContact O-CB 3.3Å; Q386-A389 WeakPolarHBondContact O-CB 3.1Å; Q386-A389 PolarHBondContact O-N 3.21Å
387	Q	52.7	Low	54.4	Low	151 Å²	151	88.9 Å²	88.9	71%	0.706	47%	0.47	S	S	*	.	H	α-helix	trans	-58.2	-32.5	174.6	-79.1	-178.3	-8.3	0	0	112.4	N383	N383-Q387 WeakPolarHBondContact O-CB 3.32Å; N383-Q387 WeakPolarHBondContact O-CG 3.22Å; N383-Q387 PolarHBondContact O-N 3.09Å
388	N	51.2	Low	55.5	Low	15 Å²	15	94.7 Å²	94.7	8%	0.08	49%	0.485	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-2.7	176.5	-67.8	-52.5	0	0	0	114	A299 L363 E384 Q386 L390	A299-N388 WeakPolarHBondContact CB-OD1 3.37Å; L363-N388 HydrophobicContact CD2-CB 3.77Å; E384-N388 PolarHBondContact O-N 3.28Å; E384-N388 PolarHBondContact O-ND2 3.31Å; Q386-N388 PolarHBondContact O-N 3.06Å; N388-L390 VanDerWaalsContact C-N 3.25Å; N388-L390 PolarHBondContact O-N 2.89Å
389	A	50.2	Low	56.9	Low	58 Å²	58	90.3 Å²	90.3	48%	0.479	46%	0.455	S	S	.	.			trans	-79.6	68	-178.2	0	0	0	0	0	111.5	C385 Q386	C385-A389 PolarHBondContact O-N 2.72Å; Q386-A389 VanDerWaalsContact O-CB 3.3Å; Q386-A389 WeakPolarHBondContact O-CB 3.1Å; Q386-A389 PolarHBondContact O-N 3.21Å
390	L	53.6	Low	58.3	Low	69 Å²	69	88.6 Å²	88.6	36%	0.361	44%	0.441	S	S	.	.			trans	-62.8	145.3	165.2	-69.6	173.5	0	0	0	109.8	L300 Y348 N388 Q392	L300-L390 HydrophobicContact CD2-CD1 4.04Å; Y348-L390 HydrophobicContact CD2-CD1 4.11Å; Y348-L390 HydrophobicContact CE2-CB 4.23Å; Y348-L390 HydrophobicContact CE2-CD1 3.58Å; N388-L390 VanDerWaalsContact C-N 3.25Å; N388-L390 PolarHBondContact O-N 2.89Å; L390-Q392 PolarHBondContact O-N 3.33Å
391	K	51.4	Low	59.6	Low	180 Å²	180	88.8 Å²	88.8	78%	0.783	44%	0.441	S	S	*	.			trans	-40.1	107.5	-174.9	-174.5	176.7	-177.5	174.5	0	111.9	V393	K391-V393 PolarHBondContact O-N 2.84Å; K391-V393 VanDerWaalsContact O-N 3.09Å
392	Q	51.4	Low	61	Low	141 Å²	141	88 Å²	88	66%	0.659	44%	0.438	S	S	*	.			trans	-64.6	112.6	177.9	-67.5	-176.9	8.2	0	0	109.2	L390	L390-Q392 PolarHBondContact O-N 3.33Å
393	V	50.1	Low	62.4	Low	69 Å²	69	83.3 Å²	83.3	42%	0.418	42%	0.417	S	S	.	.			trans	-77	134.2	171	-179.6	0	0	0	0	107.7	L352 K391 S395	L352-V393 HydrophobicContact CD1-CG2 4.17Å; K391-V393 PolarHBondContact O-N 2.84Å; K391-V393 VanDerWaalsContact O-N 3.09Å; V393-S395 PolarHBondContact O-N 2.89Å
394	A	49	Very low	63.7	Low	78 Å²	78	84.1 Å²	84.1	65%	0.645	42%	0.421	S	S	*	.			trans	-51	123.8	178.3	0	0	0	0	0	110.7	R396	A394-R396 PolarHBondContact O-N 3.41Å
395	S	51	Low	65.3	Low	74 Å²	74	81.6 Å²	81.6	52%	0.517	41%	0.412	S	S	.	.	S	Bend	trans	-54.4	-17	-177	149.8	0	0	0	0	114.4	V393 N397 Q400	V393-S395 PolarHBondContact O-N 2.89Å; S395-N397 VanDerWaalsContact C-N 3.34Å; S395-N397 PolarHBondContact O-N 2.76Å; S395-N397 VanDerWaalsContact O-N 3.15Å; S395-Q400 WeakPolarHBondContact O-CB 3.3Å; S395-Q400 WeakPolarHBondContact O-CG 3.48Å
396	R	53.7	Low	66.8	Low	222 Å²	222	83 Å²	83	84%	0.838	43%	0.428	S	S	*	.			trans	-90	54.5	-178.6	-67.9	-174.7	173.6	177.8	-1	113.8	A394	A394-R396 PolarHBondContact O-N 3.41Å
397	N	68.6	Low	68.4	Low	79 Å²	79	77 Å²	77	42%	0.422	40%	0.4	S	S	.	.			trans	-78.7	152.4	169	-81.4	-28.1	0	0	0	111.3	S395 Y399 Q400 L401	S395-N397 VanDerWaalsContact C-N 3.34Å; S395-N397 PolarHBondContact O-N 2.76Å; S395-N397 VanDerWaalsContact O-N 3.15Å; N397-Y399 PolarHBondContact O-N 2.76Å; N397-Y399 VanDerWaalsContact O-N 3.14Å; N397-Q400 WeakPolarHBondContact O-CB 3.13Å; N397-Q400 PolarHBondContact O-N 2.97Å; N397-L401 PolarHBondContact O-N 2.76Å; N397-L401 VanDerWaalsContact O-N 3.11Å
398	R	81.3	Confident	70	Confident	172 Å²	172	70 Å²	70	65%	0.649	37%	0.368	S	S	*	.	H	α-helix	trans	-55.5	-31.3	176.6	-68.6	178.1	71.3	167.6	0.7	112.9	C402 Y465	R398-C402 PolarHBondContact O-N 3.43Å; R398-C402 PolarHBondContact O-SG 3.48Å; R398-Y465 HydrophobicContact CB-CD1 4.44Å; R398-Y465 HydrophobicContact CB-CE1 3.72Å
399	Y	86.3	Confident	71.7	Confident	20 Å²	20	71.6 Å²	71.6	8%	0.078	38%	0.379	C	S	.	.	H	α-helix	trans	-65.2	-48.8	173.2	-176.5	-99.9	0	0	0	112	L353 N397 L401 C402 V403 M466 L469 Q470	L353-Y399 HydrophobicContact CD1-CD1 3.66Å; L353-Y399 HydrophobicContact CD1-CD2 3.78Å; L353-Y399 HydrophobicContact CD1-CE1 3.79Å; L353-Y399 HydrophobicContact CD1-CE2 3.9Å; L353-Y399 HydrophobicContact CD1-CG 3.65Å; L353-Y399 HydrophobicContact CG-CD1 4.43Å; L353-Y399 HydrophobicContact CG-CE1 4.08Å; L353-Y399 HydrophobicContact CG-CE2 4.4Å; L353-Y399 WeakPolarHBondContact O-CE1 3.43Å; N397-Y399 PolarHBondContact O-N 2.76Å; N397-Y399 VanDerWaalsContact O-N 3.14Å; Y399-L401 PolarHBondContact O-N 3.16Å; Y399-C402 WeakPolarHBondContact O-CA 3.3Å; Y399-C402 VanDerWaalsContact O-CB 3.28Å; Y399-C402 WeakPolarHBondContact O-CB 3.12Å; Y399-C402 PolarHBondContact O-N 3.41Å; Y399-V403 HydrophobicContact CD1-CG2 3.99Å; Y399-V403 HydrophobicContact CE1-CG2 3.67Å; Y399-V403 PolarHBondContact O-N 2.62Å; Y399-M466 HydrophobicContact CD2-CG 3.84Å; Y399-M466 HydrophobicContact CE2-CE 3.91Å; Y399-M466 HydrophobicContact CE2-CG 3.52Å; Y399-L469 HydrophobicContact CD2-CD2 3.86Å; Y399-L469 HydrophobicContact CG-CD2 4.04Å; Y399-Q470 HydrophobicContact CE2-CG 3.86Å; Y399-Q470 PolarHBondContact OH-NE2 3.14Å
400	Q	83.8	Confident	73.6	Confident	26 Å²	26	68.9 Å²	68.9	12%	0.121	36%	0.356	C	S	.	.	H	α-helix	trans	-60.5	-37.1	178.2	-168.5	60.6	47.1	0	0	111.5	C357 S395 N397 C402 V403 D404	C357-Q400 PolarHBondContact SG-OE1 2.84Å; S395-Q400 WeakPolarHBondContact O-CB 3.3Å; S395-Q400 WeakPolarHBondContact O-CG 3.48Å; N397-Q400 WeakPolarHBondContact O-CB 3.13Å; N397-Q400 PolarHBondContact O-N 2.97Å; Q400-C402 PolarHBondContact O-N 2.85Å; Q400-V403 WeakPolarHBondContact O-CB 3.49Å; Q400-V403 PolarHBondContact O-N 2.85Å; Q400-V403 VanDerWaalsContact O-N 3.12Å; Q400-D404 PolarHBondContact NE2-OD1 3.31Å; Q400-D404 WeakPolarHBondContact O-CB 3.21Å; Q400-D404 PolarHBondContact O-N 3.47Å
401	L	84.9	Confident	75.2	Confident	83 Å²	83	65.7 Å²	65.7	44%	0.435	34%	0.34	S	S	.	.	H	α-helix	trans	-60.5	-31.3	172.8	-66	175.2	0	0	0	113.3	N397 Y399 A405	N397-L401 PolarHBondContact O-N 2.76Å; N397-L401 VanDerWaalsContact O-N 3.11Å; Y399-L401 PolarHBondContact O-N 3.16Å; L401-A405 VanDerWaalsContact O-CB 3.27Å; L401-A405 WeakPolarHBondContact O-CB 3.29Å; L401-A405 PolarHBondContact O-N 3.37Å
402	C	87.1	Confident	76.9	Confident	4 Å²	4	61.6 Å²	61.6	3%	0.027	33%	0.327	C	S	.	.	H	α-helix	trans	-75.2	-38.1	174.9	-58.3	0	0	0	0	111.3	R398 Y399 Q400 A405 G406 L407 M466	R398-C402 PolarHBondContact O-N 3.43Å; R398-C402 PolarHBondContact O-SG 3.48Å; Y399-C402 WeakPolarHBondContact O-CA 3.3Å; Y399-C402 VanDerWaalsContact O-CB 3.28Å; Y399-C402 WeakPolarHBondContact O-CB 3.12Å; Y399-C402 PolarHBondContact O-N 3.41Å; Q400-C402 PolarHBondContact O-N 2.85Å; C402-A405 PolarHBondContact O-N 2.86Å; C402-G406 PolarHBondContact O-N 2.8Å; C402-L407 HydrophobicContact CB-CB 4.48Å; C402-L407 HydrophobicContact CB-CD1 4.15Å; C402-L407 WeakPolarHBondContact O-CB 3.22Å; C402-L407 PolarHBondContact O-N 2.92Å; C402-L407 VanDerWaalsContact O-N 3.09Å; C402-M466 HydrophobicContact CB-CB 4.41Å; C402-M466 HydrophobicContact CB-CG 4.38Å; C402-M466 HydrophobicContact CB-SD 3.84Å
403	V	85.8	Confident	78.7	Confident	20 Å²	20	57.6 Å²	57.6	12%	0.121	31%	0.307	C	S	.	.	H	α-helix	trans	-63.9	-51.1	175.1	176.5	0	0	0	0	110.5	D323 Y399 Q400 A405 G406 M466	D323-V403 HydrophobicContact CB-CG1 4.05Å; Y399-V403 HydrophobicContact CD1-CG2 3.99Å; Y399-V403 HydrophobicContact CE1-CG2 3.67Å; Y399-V403 PolarHBondContact O-N 2.62Å; Q400-V403 WeakPolarHBondContact O-CB 3.49Å; Q400-V403 PolarHBondContact O-N 2.85Å; Q400-V403 VanDerWaalsContact O-N 3.12Å; V403-A405 PolarHBondContact O-N 3.17Å; V403-A405 VanDerWaalsContact O-N 3.17Å; V403-G406 PolarHBondContact O-N 2.92Å; V403-M466 HydrophobicContact CG2-CE 4.26Å
404	D	84.2	Confident	80.5	Confident	103 Å²	103	54.4 Å²	54.4	55%	0.551	29%	0.287	S	S	*	.	H	α-helix	trans	-62.4	-24.7	178.9	-63.2	-12.7	0	0	0	112.6	Q400 G406	Q400-D404 PolarHBondContact NE2-OD1 3.31Å; Q400-D404 WeakPolarHBondContact O-CB 3.21Å; Q400-D404 PolarHBondContact O-N 3.47Å; D404-G406 VanDerWaalsContact C-N 3.3Å
405	A	86.1	Confident	82.3	Confident	18 Å²	18	51.4 Å²	51.4	15%	0.149	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-1.8	174.3	0	0	0	0	0	113.6	L401 C402 V403 L407 F453	L401-A405 VanDerWaalsContact O-CB 3.27Å; L401-A405 WeakPolarHBondContact O-CB 3.29Å; L401-A405 PolarHBondContact O-N 3.37Å; C402-A405 PolarHBondContact O-N 2.86Å; V403-A405 PolarHBondContact O-N 3.17Å; V403-A405 VanDerWaalsContact O-N 3.17Å; A405-L407 HydrophobicContact CB-CG 4.16Å; A405-F453 HydrophobicContact CB-CD2 3.77Å; A405-F453 HydrophobicContact CB-CE2 3.49Å; A405-F453 VanDerWaalsContact CB-CE2 3.49Å
406	G	85.1	Confident	84.1	Confident	34 Å²	34	48.4 Å²	48.4	35%	0.351	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	72.2	30.7	179	0	0	0	0	0	114	C402 V403 D404 P409 H448	C402-G406 PolarHBondContact O-N 2.8Å; V403-G406 PolarHBondContact O-N 2.92Å; D404-G406 VanDerWaalsContact C-N 3.3Å; G406-P409 WeakPolarHBondContact O-CD 3.27Å; G406-H448 PolarHBondContact O-ND1 3.09Å
407	L	88.4	Confident	85.9	Confident	0 Å²	0	41 Å²	41	0%	0	22%	0.222	C	C	.	.			trans	-84.5	-9.5	-178.7	-61.5	-176.8	0	0	0	114.1	C402 A405 L410 A411 H448 F453 V459 A462 V463 M466	C402-L407 HydrophobicContact CB-CB 4.48Å; C402-L407 HydrophobicContact CB-CD1 4.15Å; C402-L407 WeakPolarHBondContact O-CB 3.22Å; C402-L407 PolarHBondContact O-N 2.92Å; C402-L407 VanDerWaalsContact O-N 3.09Å; A405-L407 HydrophobicContact CB-CG 4.16Å; L407-L410 PolarHBondContact O-N 2.99Å; L407-L410 VanDerWaalsContact O-N 3.1Å; L407-A411 PolarHBondContact O-N 3.42Å; L407-H448 HydrophobicContact CD2-CB 3.86Å; L407-F453 HydrophobicContact CD1-CD2 3.84Å; L407-F453 HydrophobicContact CD1-CE2 3.62Å; L407-F453 HydrophobicContact CD1-CZ 4.26Å; L407-F453 HydrophobicContact CG-CE2 4.47Å; L407-V459 HydrophobicContact CD2-CG1 3.97Å; L407-A462 HydrophobicContact CD1-CB 3.68Å; L407-V463 HydrophobicContact CB-CG2 4.27Å; L407-V463 HydrophobicContact CD1-CG2 4.23Å; L407-V463 HydrophobicContact CD2-CG2 4.47Å; L407-M466 HydrophobicContact CB-SD 4.33Å
408	C	87.8	Confident	87	Confident	6 Å²	6	38.2 Å²	38.2	4%	0.041	21%	0.208	C	C	.	.	H	α-helix	trans	-55	-46.4	-178.3	-47.8	0	0	0	0	113.9	D323 L410 A411 N412 M466	D323-C408 HydrophobicContact CB-CB 4.21Å; D323-C408 VanDerWaalsContact CB-SG 3.57Å; C408-L410 VanDerWaalsContact C-N 3.27Å; C408-L410 PolarHBondContact O-N 3.05Å; C408-A411 PolarHBondContact O-N 3.44Å; C408-N412 PolarHBondContact O-N 3.25Å; C408-M466 HydrophobicContact CB-CE 4.04Å; C408-M466 VanDerWaalsContact SG-CE 3.52Å
409	P	86.2	Confident	87.5	Confident	48 Å²	48	34.6 Å²	34.6	31%	0.312	20%	0.197	S	C	.	.	H	α-helix	trans	-60.4	-37.1	177.1	-23	33.6	0	0	0	112.9	S322 G406 K413	S322-P409 WeakPolarHBondContact OG-CG 3.36Å; G406-P409 WeakPolarHBondContact O-CD 3.27Å; P409-K413 WeakPolarHBondContact O-CG 3.08Å; P409-K413 PolarHBondContact O-N 2.87Å
410	L	88.8	Confident	87.9	Confident	0 Å²	0	37 Å²	37	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-72.1	-38.9	178.4	-178.1	56.3	0	0	0	111.4	L407 C408 K413 F441 I444 A445 H448 V459 V463	L407-L410 PolarHBondContact O-N 2.99Å; L407-L410 VanDerWaalsContact O-N 3.1Å; C408-L410 VanDerWaalsContact C-N 3.27Å; C408-L410 PolarHBondContact O-N 3.05Å; L410-K413 PolarHBondContact O-N 3.26Å; L410-F441 HydrophobicContact CD1-CD2 4.36Å; L410-F441 HydrophobicContact CD1-CE2 3.71Å; L410-F441 HydrophobicContact CD1-CZ 4.14Å; L410-F441 HydrophobicContact CD2-CE2 4.46Å; L410-F441 HydrophobicContact CD2-CZ 4.06Å; L410-F441 HydrophobicContact CG-CE2 4.02Å; L410-F441 HydrophobicContact CG-CZ 4.07Å; L410-I444 HydrophobicContact CD1-CB 4.23Å; L410-I444 HydrophobicContact CD1-CG2 3.66Å; L410-A445 HydrophobicContact CD2-CB 4.33Å; L410-H448 HydrophobicContact CD2-CB 4.16Å; L410-V459 HydrophobicContact CD2-CG1 3.87Å; L410-V463 HydrophobicContact CB-CG2 4.43Å; L410-V463 HydrophobicContact CD2-CG2 3.8Å; L410-V463 HydrophobicContact CG-CG2 4Å
411	A	88.9	Confident	88.4	Confident	3 Å²	3	35.8 Å²	35.8	3%	0.025	20%	0.203	C	C	.	.	H	α-helix	trans	-60.8	-43.6	174.8	0	0	0	0	0	112.2	L407 C408 K413 L414 V463 M466 V467	L407-A411 PolarHBondContact O-N 3.42Å; C408-A411 PolarHBondContact O-N 3.44Å; A411-K413 PolarHBondContact O-N 3.05Å; A411-L414 VanDerWaalsContact O-CB 3.3Å; A411-L414 WeakPolarHBondContact O-CB 3.25Å; A411-L414 PolarHBondContact O-N 2.97Å; A411-V463 HydrophobicContact CB-CG1 4.27Å; A411-M466 HydrophobicContact CB-CE 4.28Å; A411-M466 HydrophobicContact CB-CG 4.43Å; A411-M466 HydrophobicContact CB-SD 3.88Å; A411-V467 HydrophobicContact CB-CG2 3.73Å
412	N	87.2	Confident	88.9	Confident	94 Å²	94	31.8 Å²	31.8	50%	0.503	18%	0.183	S	C	.	.	H	α-helix	trans	-63.9	-22.6	178	-68.6	-14.4	0	0	0	113.4	C408 L414	C408-N412 PolarHBondContact O-N 3.25Å; N412-L414 VanDerWaalsContact C-N 3.33Å
413	K	88.5	Confident	89.2	Confident	57 Å²	57	33.6 Å²	33.6	25%	0.248	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-17.2	175.4	-65.8	178.3	-178.4	176.4	0	113.1	P409 L410 A411 Y437 W576	P409-K413 WeakPolarHBondContact O-CG 3.08Å; P409-K413 PolarHBondContact O-N 2.87Å; L410-K413 PolarHBondContact O-N 3.26Å; A411-K413 PolarHBondContact O-N 3.05Å; K413-Y437 HydrophobicContact CB-CD2 4Å; K413-Y437 HydrophobicContact CB-CE2 3.6Å; K413-Y437 HydrophobicContact CD-CE1 4.13Å; K413-Y437 HydrophobicContact CD-CE2 4.48Å; K413-Y437 HydrophobicContact CG-CD2 4.41Å; K413-Y437 HydrophobicContact CG-CE1 4.11Å; K413-Y437 HydrophobicContact CG-CE2 3.77Å; K413-W576 HydrophobicContact CB-CH2 4.03Å; K413-W576 HydrophobicContact CB-CZ3 4.21Å; K413-W576 VanDerWaalsContact O-CZ3 3.25Å; K413-W576 WeakPolarHBondContact O-CZ3 3.47Å
414	L	87.6	Confident	89.6	Confident	1 Å²	1	32.7 Å²	32.7	1%	0.005	19%	0.185	C	C	.	.	S	Bend	trans	-71.4	-34.8	-169.3	-166	68	0	0	0	113.7	A411 N412 F441 V463 V467 W576 L579 R580 V583	A411-L414 VanDerWaalsContact O-CB 3.3Å; A411-L414 WeakPolarHBondContact O-CB 3.25Å; A411-L414 PolarHBondContact O-N 2.97Å; N412-L414 VanDerWaalsContact C-N 3.33Å; L414-F441 HydrophobicContact CD1-CD2 4.12Å; L414-F441 HydrophobicContact CD1-CE2 3.94Å; L414-V463 HydrophobicContact CD2-CG1 4.33Å; L414-V467 HydrophobicContact CB-CG2 4.29Å; L414-V467 HydrophobicContact CD2-CB 4.15Å; L414-V467 HydrophobicContact CD2-CG1 4.34Å; L414-V467 HydrophobicContact CD2-CG2 3.84Å; L414-W576 HydrophobicContact CD1-CE3 3.9Å; L414-W576 HydrophobicContact CD1-CZ3 4.03Å; L414-L579 HydrophobicContact CD1-CB 3.93Å; L414-L579 HydrophobicContact CD1-CD1 4.22Å; L414-R580 WeakPolarHBondContact O-CG 3.42Å; L414-R580 PolarHBondContact O-NE 3.22Å; L414-R580 PolarHBondContact O-NH2 3.07Å; L414-V583 HydrophobicContact CD2-CG2 3.6Å
415	G	86.2	Confident	90.1	Very high	15 Å²	15	27.9 Å²	27.9	16%	0.155	16%	0.159	C	C	.	.	S	Bend	trans	-169.7	-158.1	-177.5	0	0	0	0	0	112.5
416	L	90.4	Very high	90.3	Very high	11 Å²	11	31.7 Å²	31.7	6%	0.058	17%	0.174	C	C	.	.			trans	-65.5	155.5	174.8	-57.3	174.5	0	0	0	110.5	E420 F421 N424 N432 E433 I434 Y564	L416-E420 HydrophobicContact CB-CB 3.95Å; L416-E420 HydrophobicContact CD1-CB 4.46Å; L416-F421 HydrophobicContact CB-CB 4.3Å; L416-F421 HydrophobicContact CD1-CB 4.45Å; L416-N424 WeakPolarHBondContact CD1-ND2 3.28Å; L416-N432 HydrophobicContact CD1-CB 4.19Å; L416-N432 HydrophobicContact CD2-CB 4.18Å; L416-E433 WeakPolarHBondContact CD2-O 3.36Å; L416-I434 HydrophobicContact CD1-CG1 4.4Å; L416-I434 HydrophobicContact CD2-CB 4.46Å; L416-I434 HydrophobicContact CD2-CG1 3.65Å; L416-I434 HydrophobicContact CG-CD1 4.31Å; L416-I434 HydrophobicContact CG-CG1 3.58Å; L416-Y564 HydrophobicContact CB-CD2 4.06Å; L416-Y564 HydrophobicContact CB-CE2 3.71Å; L416-Y564 HydrophobicContact CD1-CD2 4.24Å; L416-Y564 HydrophobicContact CG-CD2 4.21Å; L416-Y564 HydrophobicContact CG-CE2 4.3Å; L416-Y564 WeakPolarHBondContact O-CE2 3.19Å; L416-Y564 PolarHBondContact O-OH 2.92Å; L416-Y564 VanDerWaalsContact O-OH 3.13Å
417	T	90.7	Very high	90.6	Very high	68 Å²	68	32.5 Å²	32.5	42%	0.417	17%	0.172	S	C	.	.			trans	-60.4	154.7	165.5	65.1	0	0	0	0	110.2	K419 E420 F421	T417-K419 VanDerWaalsContact C-N 3.25Å; T417-K419 PolarHBondContact O-N 2.92Å; T417-E420 WeakPolarHBondContact CB-OE2 3.45Å; T417-E420 WeakPolarHBondContact CG2-OE2 3.4Å; T417-E420 PolarHBondContact N-OE2 3.17Å; T417-E420 PolarHBondContact O-N 3.04Å; T417-E420 WeakPolarHBondContact OG1-CB 3.3Å; T417-E420 WeakPolarHBondContact OG1-CG 3.45Å; T417-E420 PolarHBondContact OG1-N 3.3Å; T417-E420 PolarHBondContact OG1-OE2 2.94Å; T417-F421 PolarHBondContact O-N 2.86Å
418	P	92.2	Very high	90.7	Very high	19 Å²	19	36 Å²	36	12%	0.123	19%	0.191	C	C	.	.	H	α-helix	trans	-54.9	-39.7	178.2	-26.8	34.7	0	0	0	113.6	F421 A422 Q470 L471 E474	P418-F421 PolarHBondContact O-N 2.86Å; P418-A422 WeakPolarHBondContact O-CB 3.24Å; P418-A422 PolarHBondContact O-N 2.66Å; P418-Q470 HydrophobicContact CG-CB 3.99Å; P418-L471 HydrophobicContact CB-CD2 4.08Å; P418-L471 HydrophobicContact CG-CD2 4.15Å; P418-E474 HydrophobicContact CB-CB 3.95Å; P418-E474 HydrophobicContact CB-CG 4.01Å
419	K	90.7	Very high	90.8	Very high	96 Å²	96	42.3 Å²	42.3	42%	0.417	22%	0.215	S	C	.	.	H	α-helix	trans	-64.3	-48.8	177	-172.2	173.8	-178.6	174.2	0	112	D330 T417 F421 A422 E423	D330-K419 IonicContact OD2-NZ 3.26Å; D330-K419 PolarHBondContact OD2-NZ 3.42Å; D330-K419 VanDerWaalsContact OD2-NZ 3.16Å; T417-K419 VanDerWaalsContact C-N 3.25Å; T417-K419 PolarHBondContact O-N 2.92Å; K419-F421 VanDerWaalsContact C-N 3.32Å; K419-F421 PolarHBondContact O-N 3.1Å; K419-A422 WeakPolarHBondContact O-CB 3.41Å; K419-A422 PolarHBondContact O-N 3.13Å; K419-A422 VanDerWaalsContact O-N 3.13Å; K419-E423 WeakPolarHBondContact O-CG 3.32Å; K419-E423 PolarHBondContact O-N 2.83Å
420	E	94.1	Very high	90.8	Very high	71 Å²	71	43 Å²	43	33%	0.332	21%	0.214	S	C	.	.	H	α-helix	trans	-61.5	-39.2	178.1	-74.6	164.7	155.6	0	0	112.5	L416 T417 E423 N424 N432	L416-E420 HydrophobicContact CB-CB 3.95Å; L416-E420 HydrophobicContact CD1-CB 4.46Å; T417-E420 WeakPolarHBondContact CB-OE2 3.45Å; T417-E420 WeakPolarHBondContact CG2-OE2 3.4Å; T417-E420 PolarHBondContact N-OE2 3.17Å; T417-E420 PolarHBondContact O-N 3.04Å; T417-E420 WeakPolarHBondContact OG1-CB 3.3Å; T417-E420 WeakPolarHBondContact OG1-CG 3.45Å; T417-E420 PolarHBondContact OG1-N 3.3Å; T417-E420 PolarHBondContact OG1-OE2 2.94Å; E420-E423 PolarHBondContact O-N 3.43Å; E420-N424 PolarHBondContact O-N 3.12Å; E420-N424 VanDerWaalsContact O-N 3.13Å; E420-N432 WeakPolarHBondContact CA-ND2 3.44Å; E420-N432 HydrophobicContact CB-CB 3.91Å; E420-N432 HydrophobicContact CG-CB 4.22Å; E420-N432 PolarHBondContact O-ND2 3.08Å; E420-N432 VanDerWaalsContact O-ND2 3.12Å
421	F	95.6	Very high	90.8	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-68.1	-38.7	174.3	179.8	-126.4	0	0	0	111.9	L416 T417 P418 K419 E423 N424 L425 L471 I477 V558 L563 Y564 L584 F588	L416-F421 HydrophobicContact CB-CB 4.3Å; L416-F421 HydrophobicContact CD1-CB 4.45Å; T417-F421 PolarHBondContact O-N 2.86Å; P418-F421 PolarHBondContact O-N 2.86Å; K419-F421 VanDerWaalsContact C-N 3.32Å; K419-F421 PolarHBondContact O-N 3.1Å; F421-E423 VanDerWaalsContact C-N 3.31Å; F421-E423 PolarHBondContact O-N 3.01Å; F421-N424 WeakPolarHBondContact O-CB 3.48Å; F421-N424 PolarHBondContact O-N 3.14Å; F421-L425 HydrophobicContact CD1-CD1 4.17Å; F421-L425 HydrophobicContact CD2-CG 4.38Å; F421-L425 HydrophobicContact CE1-CD1 3.7Å; F421-L425 HydrophobicContact CE1-CD2 4.48Å; F421-L425 HydrophobicContact CE1-CG 4.16Å; F421-L425 HydrophobicContact CE2-CD1 4.39Å; F421-L425 HydrophobicContact CE2-CD2 3.9Å; F421-L425 HydrophobicContact CE2-CG 3.95Å; F421-L425 HydrophobicContact CZ-CD1 3.83Å; F421-L425 HydrophobicContact CZ-CD2 3.76Å; F421-L425 HydrophobicContact CZ-CG 3.85Å; F421-L425 WeakPolarHBondContact O-CG 3.41Å; F421-L425 PolarHBondContact O-N 3.19Å; F421-L471 HydrophobicContact CB-CD2 4.41Å; F421-L471 HydrophobicContact CD1-CD1 4.38Å; F421-L471 HydrophobicContact CD1-CD2 3.96Å; F421-I477 HydrophobicContact CD1-CD1 3.55Å; F421-I477 HydrophobicContact CD1-CG1 4.39Å; F421-I477 HydrophobicContact CE1-CD1 4.2Å; F421-I477 HydrophobicContact CG-CD1 4.49Å; F421-V558 HydrophobicContact CE2-CG1 4.08Å; F421-V558 HydrophobicContact CZ-CG1 3.98Å; F421-L563 HydrophobicContact CE2-CB 4.22Å; F421-Y564 HydrophobicContact CB-CD2 3.84Å; F421-Y564 HydrophobicContact CB-CE2 3.94Å; F421-Y564 HydrophobicContact CD1-CD2 4.28Å; F421-Y564 AromaticContact CD2-CD2 3.45Å; F421-Y564 HydrophobicContact CD2-CD2 3.45Å; F421-Y564 VanDerWaalsContact CD2-CD2 3.45Å; F421-Y564 HydrophobicContact CD2-CE2 4.35Å; F421-Y564 HydrophobicContact CD2-CG 4.01Å; F421-Y564 HydrophobicContact CE2-CD2 4.07Å; F421-Y564 HydrophobicContact CE2-CG 4.17Å; F421-Y564 AromaticContact CG-CD2 3.58Å; F421-Y564 HydrophobicContact CG-CD2 3.58Å; F421-Y564 HydrophobicContact CG-CE2 4.04Å; F421-Y564 HydrophobicContact CG-CG 4.41Å; F421-L584 HydrophobicContact CE1-CD2 3.94Å; F421-L584 HydrophobicContact CE2-CD2 4.5Å; F421-L584 HydrophobicContact CZ-CD2 3.74Å; F421-F588 HydrophobicContact CE1-CE2 4.32Å; F421-F588 HydrophobicContact CZ-CE2 4.23Å; F421-F588 HydrophobicContact CZ-CZ 4.45Å
422	A	94.1	Very high	90.9	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-59.7	-42.6	174.4	0	0	0	0	0	112.1	P418 K419 N424 L425 Q426 E474 L476 I477	P418-A422 WeakPolarHBondContact O-CB 3.24Å; P418-A422 PolarHBondContact O-N 2.66Å; K419-A422 WeakPolarHBondContact O-CB 3.41Å; K419-A422 PolarHBondContact O-N 3.13Å; K419-A422 VanDerWaalsContact O-N 3.13Å; A422-N424 PolarHBondContact O-N 3.17Å; A422-L425 WeakPolarHBondContact O-CB 3.48Å; A422-L425 PolarHBondContact O-N 2.89Å; A422-Q426 WeakPolarHBondContact O-CG 2.96Å; A422-Q426 PolarHBondContact O-N 3.45Å; A422-E474 HydrophobicContact CB-CG 4.21Å; A422-L476 HydrophobicContact CB-CB 3.57Å; A422-L476 HydrophobicContact CB-CD1 4.38Å; A422-I477 HydrophobicContact CB-CD1 4.4Å; A422-I477 HydrophobicContact CB-CG1 3.55Å
423	E	94.3	Very high	91.1	Very high	42 Å²	42	53.9 Å²	53.9	20%	0.196	26%	0.257	C	S	.	.	H	α-helix	trans	-61.3	-43.4	175.1	-70.2	178.5	-179.1	0	0	111.7	K419 E420 F421 L425 Q426 V427 R431 N432	K419-E423 WeakPolarHBondContact O-CG 3.32Å; K419-E423 PolarHBondContact O-N 2.83Å; E420-E423 PolarHBondContact O-N 3.43Å; F421-E423 VanDerWaalsContact C-N 3.31Å; F421-E423 PolarHBondContact O-N 3.01Å; E423-L425 VanDerWaalsContact C-N 3.3Å; E423-L425 PolarHBondContact O-N 3.02Å; E423-Q426 PolarHBondContact O-N 3.14Å; E423-V427 WeakPolarHBondContact O-CG2 3.47Å; E423-V427 PolarHBondContact O-N 3.48Å; E423-R431 IonicContact OE2-CZ 2.98Å; E423-R431 IonicContact OE2-NE 3.72Å; E423-N432 PolarHBondContact OE2-ND2 3.4Å
424	N	94.4	Very high	91	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-59.3	-40.2	173.9	-77	1.2	0	0	0	111.9	L416 E420 F421 A422 N428 Y429 R431 N432 L563	L416-N424 WeakPolarHBondContact CD1-ND2 3.28Å; E420-N424 PolarHBondContact O-N 3.12Å; E420-N424 VanDerWaalsContact O-N 3.13Å; F421-N424 WeakPolarHBondContact O-CB 3.48Å; F421-N424 PolarHBondContact O-N 3.14Å; A422-N424 PolarHBondContact O-N 3.17Å; N424-N428 WeakPolarHBondContact O-CA 3.24Å; N424-N428 PolarHBondContact O-N 3.32Å; N424-Y429 PolarHBondContact O-N 3.35Å; N424-R431 WeakPolarHBondContact OD1-CA 3.47Å; N424-R431 WeakPolarHBondContact OD1-CB 3.37Å; N424-R431 PolarHBondContact OD1-N 2.87Å; N424-N432 PolarHBondContact ND2-O 2.64Å; N424-N432 PolarHBondContact OD1-N 2.67Å; N424-L563 HydrophobicContact CB-CB 4.36Å; N424-L563 PolarHBondContact ND2-O 3.43Å
425	L	93.9	Very high	90.9	Very high	3 Å²	3	55.3 Å²	55.3	2%	0.016	28%	0.278	C	S	.	.	H	α-helix	trans	-67.1	-43.5	176.8	-69.9	179.4	0	0	0	112.3	F421 A422 E423 N428 I477 T480 V481 V558 L563 F588	F421-L425 HydrophobicContact CD1-CD1 4.17Å; F421-L425 HydrophobicContact CD2-CG 4.38Å; F421-L425 HydrophobicContact CE1-CD1 3.7Å; F421-L425 HydrophobicContact CE1-CD2 4.48Å; F421-L425 HydrophobicContact CE1-CG 4.16Å; F421-L425 HydrophobicContact CE2-CD1 4.39Å; F421-L425 HydrophobicContact CE2-CD2 3.9Å; F421-L425 HydrophobicContact CE2-CG 3.95Å; F421-L425 HydrophobicContact CZ-CD1 3.83Å; F421-L425 HydrophobicContact CZ-CD2 3.76Å; F421-L425 HydrophobicContact CZ-CG 3.85Å; F421-L425 WeakPolarHBondContact O-CG 3.41Å; F421-L425 PolarHBondContact O-N 3.19Å; A422-L425 WeakPolarHBondContact O-CB 3.48Å; A422-L425 PolarHBondContact O-N 2.89Å; E423-L425 VanDerWaalsContact C-N 3.3Å; E423-L425 PolarHBondContact O-N 3.02Å; L425-N428 PolarHBondContact O-N 2.96Å; L425-I477 HydrophobicContact CD1-CB 4.41Å; L425-I477 HydrophobicContact CD1-CG1 4.19Å; L425-I477 HydrophobicContact CD1-CG2 3.91Å; L425-T480 HydrophobicContact CB-CG2 4.16Å; L425-V481 HydrophobicContact CD1-CG2 4.46Å; L425-V558 HydrophobicContact CD2-CG1 4.04Å; L425-V558 HydrophobicContact CD2-CG2 3.64Å; L425-L563 HydrophobicContact CD2-CD1 4.09Å; L425-F588 HydrophobicContact CD1-CZ 4.43Å
426	Q	91	Very high	90.8	Very high	98 Å²	98	56.7 Å²	56.7	46%	0.458	28%	0.28	S	S	.	.	H	α-helix	trans	-64.3	-46.8	-179.6	-77.7	-170.1	-6	0	0	112.6	A422 E423 N428 T480	A422-Q426 WeakPolarHBondContact O-CG 2.96Å; A422-Q426 PolarHBondContact O-N 3.45Å; E423-Q426 PolarHBondContact O-N 3.14Å; Q426-N428 VanDerWaalsContact C-N 3.28Å; Q426-T480 VanDerWaalsContact CG-OG1 3.3Å; Q426-T480 WeakPolarHBondContact CG-OG1 3.44Å
427	V	92	Very high	90.5	Very high	50 Å²	50	60.3 Å²	60.3	30%	0.303	29%	0.293	S	S	.	.	H	α-helix	trans	-79.7	-15	179	-59.7	0	0	0	0	112.6	E423 Y429 R431	E423-V427 WeakPolarHBondContact O-CG2 3.47Å; E423-V427 PolarHBondContact O-N 3.48Å; V427-Y429 HydrophobicContact CB-CD1 3.78Å; V427-Y429 HydrophobicContact CB-CE1 3.47Å; V427-Y429 VanDerWaalsContact CB-CE1 3.47Å; V427-Y429 HydrophobicContact CG1-CE1 4.32Å; V427-Y429 HydrophobicContact CG2-CD1 3.73Å; V427-Y429 HydrophobicContact CG2-CD2 4.28Å; V427-Y429 HydrophobicContact CG2-CE1 3.66Å; V427-Y429 HydrophobicContact CG2-CE2 4.19Å; V427-Y429 HydrophobicContact CG2-CG 4.04Å; V427-Y429 WeakPolarHBondContact CG2-O 3.43Å; V427-Y429 VanDerWaalsContact O-CD1 3.24Å; V427-Y429 WeakPolarHBondContact O-CD1 3.36Å; V427-Y429 PolarHBondContact O-N 3.47Å; V427-R431 HydrophobicContact CG2-CB 4.03Å
428	N	89.6	Confident	90.2	Very high	75 Å²	75	62.3 Å²	62.3	40%	0.401	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.3	27.2	177.9	-159.5	17.9	0	0	0	114	N424 L425 Q426 K561	N424-N428 WeakPolarHBondContact O-CA 3.24Å; N424-N428 PolarHBondContact O-N 3.32Å; L425-N428 PolarHBondContact O-N 2.96Å; Q426-N428 VanDerWaalsContact C-N 3.28Å; N428-K561 VanDerWaalsContact CG-NZ 3.28Å; N428-K561 PolarHBondContact ND2-NZ 3.28Å; N428-K561 VanDerWaalsContact ND2-NZ 3.11Å; N428-K561 PolarHBondContact OD1-NZ 3.03Å
429	Y	89.4	Confident	90.1	Very high	138 Å²	138	66 Å²	66	54%	0.541	32%	0.323	S	S	.	.	S	Bend	trans	-147.2	166.8	170.9	69.5	-96.9	0	0	0	109.9	N424 V427 R431 L563	N424-Y429 PolarHBondContact O-N 3.35Å; V427-Y429 HydrophobicContact CB-CD1 3.78Å; V427-Y429 HydrophobicContact CB-CE1 3.47Å; V427-Y429 VanDerWaalsContact CB-CE1 3.47Å; V427-Y429 HydrophobicContact CG1-CE1 4.32Å; V427-Y429 HydrophobicContact CG2-CD1 3.73Å; V427-Y429 HydrophobicContact CG2-CD2 4.28Å; V427-Y429 HydrophobicContact CG2-CE1 3.66Å; V427-Y429 HydrophobicContact CG2-CE2 4.19Å; V427-Y429 HydrophobicContact CG2-CG 4.04Å; V427-Y429 WeakPolarHBondContact CG2-O 3.43Å; V427-Y429 VanDerWaalsContact O-CD1 3.24Å; V427-Y429 WeakPolarHBondContact O-CD1 3.36Å; V427-Y429 PolarHBondContact O-N 3.47Å; Y429-R431 HydrophobicContact CE2-CB 3.97Å; Y429-R431 PolarHBondContact O-N 3Å; Y429-L563 VanDerWaalsContact C-CD2 3.47Å
430	M	86.3	Confident	89.9	Confident	61 Å²	61	63 Å²	63	30%	0.3	31%	0.314	S	S	.	.			trans	-74.8	90.2	-179.9	-163.6	-177.6	-44.2	0	0	110.3	N432 E433 K562	M430-N432 WeakPolarHBondContact CG-O 3.15Å; M430-E433 HydrophobicContact CG-CG 4.14Å; M430-E433 HydrophobicContact SD-CG 3.86Å; M430-K562 HydrophobicContact CE-CB 3.95Å; M430-K562 WeakPolarHBondContact CE-O 3.07Å
431	R	89.9	Confident	89.6	Confident	141 Å²	141	59.9 Å²	59.9	53%	0.532	30%	0.299	S	S	.	.	S	Bend	trans	-80.9	-39.1	172.6	176.3	-179.9	177.3	174.1	-3.8	111	E423 N424 V427 Y429	E423-R431 IonicContact OE2-CZ 2.98Å; E423-R431 IonicContact OE2-NE 3.72Å; N424-R431 WeakPolarHBondContact OD1-CA 3.47Å; N424-R431 WeakPolarHBondContact OD1-CB 3.37Å; N424-R431 PolarHBondContact OD1-N 2.87Å; V427-R431 HydrophobicContact CG2-CB 4.03Å; Y429-R431 HydrophobicContact CE2-CB 3.97Å; Y429-R431 PolarHBondContact O-N 3Å
432	N	91.4	Very high	89.2	Confident	36 Å²	36	62.3 Å²	62.3	19%	0.193	32%	0.317	C	S	.	.	S	Bend	trans	-113.3	133.4	177.8	-59.2	-55.9	0	0	0	109.2	L416 E420 E423 N424 M430	L416-N432 HydrophobicContact CD1-CB 4.19Å; L416-N432 HydrophobicContact CD2-CB 4.18Å; E420-N432 WeakPolarHBondContact CA-ND2 3.44Å; E420-N432 HydrophobicContact CB-CB 3.91Å; E420-N432 HydrophobicContact CG-CB 4.22Å; E420-N432 PolarHBondContact O-ND2 3.08Å; E420-N432 VanDerWaalsContact O-ND2 3.12Å; E423-N432 PolarHBondContact OE2-ND2 3.4Å; N424-N432 PolarHBondContact ND2-O 2.64Å; N424-N432 PolarHBondContact OD1-N 2.67Å; M430-N432 WeakPolarHBondContact CG-O 3.15Å
433	E	89.9	Confident	89	Confident	150 Å²	150	67.1 Å²	67.1	70%	0.701	34%	0.339	S	S	*	.			trans	-107.5	146.8	-177.7	-60.4	-173.7	-177.9	0	0	110.9	L416 M430	L416-E433 WeakPolarHBondContact CD2-O 3.36Å; M430-E433 HydrophobicContact CG-CG 4.14Å; M430-E433 HydrophobicContact SD-CG 3.86Å
434	I	87.9	Confident	88.6	Confident	12 Å²	12	65.2 Å²	65.2	6%	0.062	33%	0.33	C	S	.	.	P	Polyproline II helix	trans	-81	128.6	-177.8	-67.9	173.6	0	0	0	110.5	L416 Q436 Y564 H566	L416-I434 HydrophobicContact CD1-CG1 4.4Å; L416-I434 HydrophobicContact CD2-CB 4.46Å; L416-I434 HydrophobicContact CD2-CG1 3.65Å; L416-I434 HydrophobicContact CG-CD1 4.31Å; L416-I434 HydrophobicContact CG-CG1 3.58Å; I434-Q436 PolarHBondContact O-N 3.27Å; I434-Y564 HydrophobicContact CD1-CG 4.46Å; I434-Y564 VanDerWaalsContact CD1-O 3.23Å; I434-Y564 WeakPolarHBondContact CD1-O 3.48Å; I434-H566 HydrophobicContact CB-CB 4.36Å; I434-H566 PolarHBondContact O-ND1 3.41Å
435	A	84.6	Confident	88.3	Confident	76 Å²	76	65.2 Å²	65.2	63%	0.628	33%	0.33	S	S	*	.	P	Polyproline II helix	trans	-70.8	118	166.5	0	0	0	0	0	110.5
436	Q	83.4	Confident	88.1	Confident	44 Å²	44	70.6 Å²	70.6	21%	0.206	36%	0.355	C	S	.	.	P	Polyproline II helix	trans	-88.7	129.2	179.5	178.9	64.4	46.7	0	0	112.4	I434 V573 R580	I434-Q436 PolarHBondContact O-N 3.27Å; Q436-V573 HydrophobicContact CG-CG2 3.64Å; Q436-R580 VanDerWaalsContact OE1-NH1 3.13Å
437	Y	84.9	Confident	87.8	Confident	86 Å²	86	72.8 Å²	72.8	34%	0.337	37%	0.365	S	S	.	.	P	Polyproline II helix	trans	-83.9	140.8	173.1	-71.3	-90.4	0	0	0	111.8	K413 Q439 W576	K413-Y437 HydrophobicContact CB-CD2 4Å; K413-Y437 HydrophobicContact CB-CE2 3.6Å; K413-Y437 HydrophobicContact CD-CE1 4.13Å; K413-Y437 HydrophobicContact CD-CE2 4.48Å; K413-Y437 HydrophobicContact CG-CD2 4.41Å; K413-Y437 HydrophobicContact CG-CE1 4.11Å; K413-Y437 HydrophobicContact CG-CE2 3.77Å; Y437-Q439 PolarHBondContact O-N 2.84Å; Y437-W576 HydrophobicContact CD2-CH2 4.34Å; Y437-W576 HydrophobicContact CG-CZ2 4.48Å
438	P	85.3	Confident	87.5	Confident	111 Å²	111	72.2 Å²	72.2	72%	0.721	36%	0.359	S	S	*	.	S	Bend	trans	-76	-22	-174.7	29.3	-35.2	0	0	0	113.9
439	Q	88.5	Confident	87.3	Confident	95 Å²	95	72.4 Å²	72.4	44%	0.444	36%	0.359	S	S	.	.	S	Bend	trans	-89.2	145.9	-178.8	-70	164	-27.7	0	0	111.2	Y437 I444 W576	Y437-Q439 PolarHBondContact O-N 2.84Å; Q439-I444 HydrophobicContact CB-CD1 4.24Å; Q439-I444 HydrophobicContact CB-CG1 4.14Å; Q439-W576 PolarHBondContact O-NE1 2.79Å
440	P	87.3	Confident	87	Confident	35 Å²	35	67.5 Å²	67.5	23%	0.227	35%	0.345	C	S	.	.			trans	-57.2	142.8	168.8	-21.7	32.4	0	0	0	111.9	S442 E443 V572	P440-S442 PolarHBondContact O-N 3.39Å; P440-E443 HydrophobicContact CB-CG 4.43Å; P440-E443 HydrophobicContact CG-CG 4.45Å; P440-E443 PolarHBondContact O-N 3.24Å; P440-E443 VanDerWaalsContact O-N 3.12Å; P440-V572 HydrophobicContact CG-CG2 4.44Å
441	F	88.5	Confident	86.8	Confident	4 Å²	4	73.7 Å²	73.7	2%	0.018	37%	0.37	C	S	.	.	H	α-helix	trans	-59	-35.7	-178.9	-178.5	-89.8	0	0	0	112.1	L410 L414 E443 I444 A445 T460 V463 W576 L579	L410-F441 HydrophobicContact CD1-CD2 4.36Å; L410-F441 HydrophobicContact CD1-CE2 3.71Å; L410-F441 HydrophobicContact CD1-CZ 4.14Å; L410-F441 HydrophobicContact CD2-CE2 4.46Å; L410-F441 HydrophobicContact CD2-CZ 4.06Å; L410-F441 HydrophobicContact CG-CE2 4.02Å; L410-F441 HydrophobicContact CG-CZ 4.07Å; L414-F441 HydrophobicContact CD1-CD2 4.12Å; L414-F441 HydrophobicContact CD1-CE2 3.94Å; F441-E443 VanDerWaalsContact C-N 3.26Å; F441-E443 PolarHBondContact O-N 3.06Å; F441-I444 PolarHBondContact O-N 3.35Å; F441-A445 HydrophobicContact CD1-CB 4.11Å; F441-A445 HydrophobicContact CE1-CB 3.84Å; F441-A445 VanDerWaalsContact O-CB 3.28Å; F441-A445 WeakPolarHBondContact O-CB 3.5Å; F441-A445 PolarHBondContact O-N 3.16Å; F441-T460 HydrophobicContact CD1-CG2 4.37Å; F441-T460 HydrophobicContact CE1-CG2 3.87Å; F441-V463 HydrophobicContact CE2-CG1 4.38Å; F441-V463 HydrophobicContact CZ-CB 4.26Å; F441-V463 HydrophobicContact CZ-CG1 4.04Å; F441-V463 HydrophobicContact CZ-CG2 4.47Å; F441-W576 HydrophobicContact CB-CD2 4.35Å; F441-W576 HydrophobicContact CB-CZ2 4.16Å; F441-W576 HydrophobicContact CD2-CE3 4.06Å; F441-W576 AromaticContact CD2-CH2 3.61Å; F441-W576 HydrophobicContact CD2-CH2 3.61Å; F441-W576 HydrophobicContact CD2-CZ2 4.09Å; F441-W576 AromaticContact CD2-CZ3 3.58Å; F441-W576 HydrophobicContact CD2-CZ3 3.58Å; F441-W576 HydrophobicContact CE2-CH2 4.37Å; F441-W576 HydrophobicContact CE2-CZ3 4.21Å; F441-L579 HydrophobicContact CB-CD1 3.52Å; F441-L579 HydrophobicContact CD1-CD1 3.4Å; F441-L579 HydrophobicContact CD2-CD1 3.75Å; F441-L579 HydrophobicContact CE1-CD1 4.02Å; F441-L579 HydrophobicContact CE2-CD1 4.33Å; F441-L579 HydrophobicContact CG-CD1 3.25Å; F441-L579 HydrophobicContact CZ-CD1 4.44Å
442	S	87.7	Confident	86.4	Confident	52 Å²	52	72.3 Å²	72.3	36%	0.364	37%	0.37	S	S	.	.	H	α-helix	trans	-59.7	-32.2	179	54.1	0	0	0	0	114	P440 Q446	P440-S442 PolarHBondContact O-N 3.39Å; S442-Q446 WeakPolarHBondContact O-CG 3.43Å; S442-Q446 PolarHBondContact O-N 2.86Å
443	E	89	Confident	86.2	Confident	100 Å²	100	72.1 Å²	72.1	47%	0.467	37%	0.367	S	S	.	.	H	α-helix	trans	-73.4	-46.1	178.2	-67.7	179.1	-170.9	0	0	110.4	P440 F441 A445 Q446	P440-E443 HydrophobicContact CB-CG 4.43Å; P440-E443 HydrophobicContact CG-CG 4.45Å; P440-E443 PolarHBondContact O-N 3.24Å; P440-E443 VanDerWaalsContact O-N 3.12Å; F441-E443 VanDerWaalsContact C-N 3.26Å; F441-E443 PolarHBondContact O-N 3.06Å; E443-A445 VanDerWaalsContact C-N 3.3Å; E443-A445 PolarHBondContact O-N 3.48Å; E443-Q446 WeakPolarHBondContact O-CB 3.12Å; E443-Q446 PolarHBondContact O-N 3.03Å
444	I	86.8	Confident	86.2	Confident	2 Å²	2	72.7 Å²	72.7	1%	0.01	37%	0.37	C	S	.	.	H	α-helix	trans	-64.6	-38.2	177.1	-47.6	-177.3	0	0	0	110.5	L410 Q439 F441 Q446 E447 H448 W576	L410-I444 HydrophobicContact CD1-CB 4.23Å; L410-I444 HydrophobicContact CD1-CG2 3.66Å; Q439-I444 HydrophobicContact CB-CD1 4.24Å; Q439-I444 HydrophobicContact CB-CG1 4.14Å; F441-I444 PolarHBondContact O-N 3.35Å; I444-Q446 VanDerWaalsContact C-N 3.28Å; I444-Q446 PolarHBondContact O-N 3.23Å; I444-E447 WeakPolarHBondContact O-CB 3.32Å; I444-E447 PolarHBondContact O-N 3.27Å; I444-H448 PolarHBondContact O-CD2 3.05Å; I444-W576 HydrophobicContact CD1-CH2 4.07Å; I444-W576 HydrophobicContact CD1-CZ2 3.7Å
445	A	87.3	Confident	86.2	Confident	0 Å²	0	76 Å²	76	0%	0	39%	0.388	C	S	.	.	H	α-helix	trans	-66.8	-26.1	178.8	0	0	0	0	0	113.5	L410 F441 E443 E447 H448 V456 V459	L410-A445 HydrophobicContact CD2-CB 4.33Å; F441-A445 HydrophobicContact CD1-CB 4.11Å; F441-A445 HydrophobicContact CE1-CB 3.84Å; F441-A445 VanDerWaalsContact O-CB 3.28Å; F441-A445 WeakPolarHBondContact O-CB 3.5Å; F441-A445 PolarHBondContact O-N 3.16Å; E443-A445 VanDerWaalsContact C-N 3.3Å; E443-A445 PolarHBondContact O-N 3.48Å; A445-E447 PolarHBondContact O-N 2.78Å; A445-H448 PolarHBondContact O-N 2.95Å; A445-V456 HydrophobicContact CB-CG1 3.93Å; A445-V459 HydrophobicContact CB-CG1 4.15Å
446	Q	88.7	Confident	86.4	Confident	117 Å²	117	74.2 Å²	74.2	55%	0.547	37%	0.369	S	S	.	.	H	α-helix	trans	-64.1	-31.5	173.7	-76.2	170.9	17.4	0	0	112	S442 E443 I444 H448 I449 V456	S442-Q446 WeakPolarHBondContact O-CG 3.43Å; S442-Q446 PolarHBondContact O-N 2.86Å; E443-Q446 WeakPolarHBondContact O-CB 3.12Å; E443-Q446 PolarHBondContact O-N 3.03Å; I444-Q446 VanDerWaalsContact C-N 3.28Å; I444-Q446 PolarHBondContact O-N 3.23Å; Q446-H448 PolarHBondContact O-N 3.27Å; Q446-I449 HydrophobicContact CB-CD1 4.48Å; Q446-I449 HydrophobicContact CG-CD1 4.47Å; Q446-I449 WeakPolarHBondContact O-CG1 3.48Å; Q446-I449 PolarHBondContact O-N 3.25Å; Q446-V456 HydrophobicContact CG-CG2 3.46Å; Q446-V456 VanDerWaalsContact CG-CG2 3.46Å
447	E	85.5	Confident	86.7	Confident	144 Å²	144	77.6 Å²	77.6	67%	0.673	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	-20.2	178.1	-56.7	179.8	173.1	0	0	112.6	I444 A445	I444-E447 WeakPolarHBondContact O-CB 3.32Å; I444-E447 PolarHBondContact O-N 3.27Å; A445-E447 PolarHBondContact O-N 2.78Å
448	H	85.1	Confident	87	Confident	38 Å²	38	74.9 Å²	74.9	18%	0.176	38%	0.38	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.5	11.9	-178	-73.2	-92.3	0	0	0	113.7	G406 L407 L410 I444 A445 Q446 C450 V459	G406-H448 PolarHBondContact O-ND1 3.09Å; L407-H448 HydrophobicContact CD2-CB 3.86Å; L410-H448 HydrophobicContact CD2-CB 4.16Å; I444-H448 PolarHBondContact O-CD2 3.05Å; A445-H448 PolarHBondContact O-N 2.95Å; Q446-H448 PolarHBondContact O-N 3.27Å; H448-C450 PolarHBondContact O-N 3.3Å; H448-V459 HydrophobicContact CB-CG1 4.2Å
449	I	86.9	Confident	87.3	Confident	78 Å²	78	69.6 Å²	69.6	40%	0.4	35%	0.346	S	S	.	.			trans	-65.9	127.1	173.5	-66	173.2	0	0	0	109.2	Q446 V456 V459	Q446-I449 HydrophobicContact CB-CD1 4.48Å; Q446-I449 HydrophobicContact CG-CD1 4.47Å; Q446-I449 WeakPolarHBondContact O-CG1 3.48Å; Q446-I449 PolarHBondContact O-N 3.25Å; I449-V456 HydrophobicContact CD1-CG2 4.01Å; I449-V459 HydrophobicContact CG1-CG2 4.41Å
450	C	82.9	Confident	87.5	Confident	36 Å²	36	66 Å²	66	24%	0.243	33%	0.331	C	S	.	.			trans	-138.7	-178.3	-176.8	72.7	0	0	0	0	111.4	H448 Q452 F453	H448-C450 PolarHBondContact O-N 3.3Å; C450-Q452 PolarHBondContact O-N 2.9Å; C450-Q452 PolarHBondContact SG-OE1 2.76Å; C450-Q452 VanDerWaalsContact SG-OE1 3.39Å; C450-F453 PolarHBondContact N-O 3.18Å; C450-F453 CarbonylContact O-C 3.13Å; C450-F453 VanDerWaalsContact O-C 3.24Å; C450-F453 PolarHBondContact O-N 2.81Å
451	K	82.1	Confident	87.7	Confident	191 Å²	191	69.7 Å²	69.7	83%	0.83	34%	0.343	S	S	*	.	S	Bend	trans	-61.5	-33.1	-179	-67.9	-177.7	-179.6	176.6	0	112.4
452	Q	81.1	Confident	87.8	Confident	112 Å²	112	70 Å²	70	52%	0.523	35%	0.346	S	S	.	.	S	Bend	trans	-79.5	-33.4	-179.2	-62.7	86.3	-25.4	0	0	112.3	C450	C450-Q452 PolarHBondContact O-N 2.9Å; C450-Q452 PolarHBondContact SG-OE1 2.76Å; C450-Q452 VanDerWaalsContact SG-OE1 3.39Å
453	F	87.5	Confident	88.1	Confident	32 Å²	32	67.5 Å²	67.5	14%	0.14	33%	0.329	C	S	.	.			trans	-127.3	93	-178.7	-55.7	-68.8	0	0	0	109.6	A405 L407 C450 D455 A458 V459 A462	A405-F453 HydrophobicContact CB-CD2 3.77Å; A405-F453 HydrophobicContact CB-CE2 3.49Å; A405-F453 VanDerWaalsContact CB-CE2 3.49Å; L407-F453 HydrophobicContact CD1-CD2 3.84Å; L407-F453 HydrophobicContact CD1-CE2 3.62Å; L407-F453 HydrophobicContact CD1-CZ 4.26Å; L407-F453 HydrophobicContact CG-CE2 4.47Å; C450-F453 PolarHBondContact N-O 3.18Å; C450-F453 CarbonylContact O-C 3.13Å; C450-F453 VanDerWaalsContact O-C 3.24Å; C450-F453 PolarHBondContact O-N 2.81Å; F453-D455 PolarHBondContact O-N 3.48Å; F453-A458 HydrophobicContact CB-CB 4.33Å; F453-A458 HydrophobicContact CD1-CB 4.19Å; F453-V459 HydrophobicContact CB-CG2 3.61Å; F453-A462 HydrophobicContact CD1-CB 3.97Å; F453-A462 HydrophobicContact CE1-CB 3.5Å; F453-A462 HydrophobicContact CE2-CB 4.25Å; F453-A462 HydrophobicContact CZ-CB 3.66Å
454	Q	88.5	Confident	88.3	Confident	161 Å²	161	64.2 Å²	64.2	75%	0.752	31%	0.313	S	S	*	.			trans	-80.4	-15	-166.5	-63	176.5	9.1	0	0	114.3
455	D	87.8	Confident	88.6	Confident	82 Å²	82	67 Å²	67	44%	0.439	32%	0.324	S	S	.	.	S	Bend	trans	-134.3	161.8	-178.6	61.3	18.5	0	0	0	111.8	F453 E457 A458 V459	F453-D455 PolarHBondContact O-N 3.48Å; D455-E457 PolarHBondContact O-N 3.03Å; D455-A458 PolarHBondContact O-N 3.23Å; D455-A458 WeakPolarHBondContact OD1-CA 3.32Å; D455-A458 WeakPolarHBondContact OD1-CB 3.5Å; D455-A458 PolarHBondContact OD1-N 3.17Å; D455-V459 WeakPolarHBondContact O-CG2 3.49Å; D455-V459 PolarHBondContact O-N 3.04Å; D455-V459 VanDerWaalsContact O-N 3.13Å
456	V	89.3	Confident	88.9	Confident	38 Å²	38	67 Å²	67	23%	0.23	32%	0.324	C	S	.	.	H	α-helix	trans	-59.9	-34.4	178.4	179.2	0	0	0	0	110.9	A445 Q446 I449 T460	A445-V456 HydrophobicContact CB-CG1 3.93Å; Q446-V456 HydrophobicContact CG-CG2 3.46Å; Q446-V456 VanDerWaalsContact CG-CG2 3.46Å; I449-V456 HydrophobicContact CD1-CG2 4.01Å; V456-T460 WeakPolarHBondContact O-CB 3.33Å; V456-T460 PolarHBondContact O-N 3.34Å; V456-T460 PolarHBondContact O-OG1 3.44Å
457	E	90.6	Very high	89.1	Confident	115 Å²	115	61.5 Å²	61.5	54%	0.537	30%	0.298	S	S	.	.	H	α-helix	trans	-70.1	-39.9	-178.2	-165.2	-177.8	156.9	0	0	112.3	D455 T460 K461	D455-E457 PolarHBondContact O-N 3.03Å; E457-T460 PolarHBondContact O-N 3.14Å; E457-K461 HydrophobicContact CG-CD 4.47Å; E457-K461 WeakPolarHBondContact O-CB 3.48Å; E457-K461 WeakPolarHBondContact O-CG 3.5Å; E457-K461 PolarHBondContact O-N 2.94Å; E457-K461 WeakPolarHBondContact OE1-CE 3.27Å; E457-K461 IonicContact OE1-NZ 3.62Å; E457-K461 PolarHBondContact OE1-NZ 2.85Å
458	A	90.6	Very high	89.6	Confident	30 Å²	30	54.7 Å²	54.7	25%	0.248	27%	0.266	C	S	.	.	H	α-helix	trans	-68.2	-42.5	175.3	0	0	0	0	0	111.2	F453 D455 T460 K461 A462	F453-A458 HydrophobicContact CB-CB 4.33Å; F453-A458 HydrophobicContact CD1-CB 4.19Å; D455-A458 PolarHBondContact O-N 3.23Å; D455-A458 WeakPolarHBondContact OD1-CA 3.32Å; D455-A458 WeakPolarHBondContact OD1-CB 3.5Å; D455-A458 PolarHBondContact OD1-N 3.17Å; A458-T460 VanDerWaalsContact C-N 3.3Å; A458-T460 PolarHBondContact O-N 3.19Å; A458-K461 PolarHBondContact O-N 3.06Å; A458-A462 VanDerWaalsContact O-CB 3.25Å; A458-A462 WeakPolarHBondContact O-CB 3.37Å; A458-A462 PolarHBondContact O-N 2.94Å
459	V	91.7	Very high	90.1	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-57.5	-47.2	171.7	174.7	0	0	0	0	109.8	L407 L410 A445 H448 I449 F453 D455 K461 A462 V463	L407-V459 HydrophobicContact CD2-CG1 3.97Å; L410-V459 HydrophobicContact CD2-CG1 3.87Å; A445-V459 HydrophobicContact CB-CG1 4.15Å; H448-V459 HydrophobicContact CB-CG1 4.2Å; I449-V459 HydrophobicContact CG1-CG2 4.41Å; F453-V459 HydrophobicContact CB-CG2 3.61Å; D455-V459 WeakPolarHBondContact O-CG2 3.49Å; D455-V459 PolarHBondContact O-N 3.04Å; D455-V459 VanDerWaalsContact O-N 3.13Å; V459-K461 PolarHBondContact O-N 3.08Å; V459-A462 PolarHBondContact O-N 2.86Å; V459-V463 HydrophobicContact CG1-CG2 4.3Å; V459-V463 VanDerWaalsContact O-CG2 3.3Å; V459-V463 WeakPolarHBondContact O-CG2 3.42Å; V459-V463 PolarHBondContact O-N 3.46Å
460	T	91.9	Very high	90.4	Very high	20 Å²	20	50.7 Å²	50.7	12%	0.123	25%	0.247	C	C	.	.	H	α-helix	trans	-61.6	-46.2	178.7	-55	0	0	0	0	111.8	F441 V456 E457 A458 A462 V463 K464 L579	F441-T460 HydrophobicContact CD1-CG2 4.37Å; F441-T460 HydrophobicContact CE1-CG2 3.87Å; V456-T460 WeakPolarHBondContact O-CB 3.33Å; V456-T460 PolarHBondContact O-N 3.34Å; V456-T460 PolarHBondContact O-OG1 3.44Å; E457-T460 PolarHBondContact O-N 3.14Å; A458-T460 VanDerWaalsContact C-N 3.3Å; A458-T460 PolarHBondContact O-N 3.19Å; T460-A462 VanDerWaalsContact C-N 3.34Å; T460-A462 PolarHBondContact O-N 3.23Å; T460-V463 PolarHBondContact O-N 3.4Å; T460-K464 HydrophobicContact CG2-CD 4.36Å; T460-K464 HydrophobicContact CG2-CG 4.48Å; T460-K464 WeakPolarHBondContact O-CB 3.34Å; T460-K464 VanDerWaalsContact O-CG 3.25Å; T460-K464 WeakPolarHBondContact O-CG 3.49Å; T460-K464 PolarHBondContact O-N 3.37Å; T460-L579 HydrophobicContact CG2-CD2 3.57Å
461	K	91.5	Very high	91	Very high	112 Å²	112	49 Å²	49	49%	0.487	24%	0.235	S	C	.	.	H	α-helix	trans	-62	-40.6	176.3	-76.5	172.5	-174.8	162.8	0	112	E457 A458 V459 Y465	E457-K461 HydrophobicContact CG-CD 4.47Å; E457-K461 WeakPolarHBondContact O-CB 3.48Å; E457-K461 WeakPolarHBondContact O-CG 3.5Å; E457-K461 PolarHBondContact O-N 2.94Å; E457-K461 WeakPolarHBondContact OE1-CE 3.27Å; E457-K461 IonicContact OE1-NZ 3.62Å; E457-K461 PolarHBondContact OE1-NZ 2.85Å; A458-K461 PolarHBondContact O-N 3.06Å; V459-K461 PolarHBondContact O-N 3.08Å; K461-Y465 WeakPolarHBondContact O-CB 3.34Å; K461-Y465 PolarHBondContact O-N 3.02Å
462	A	91	Very high	91.7	Very high	9 Å²	9	40.1 Å²	40.1	7%	0.074	20%	0.197	C	C	.	.	H	α-helix	trans	-65.1	-48.2	177.9	0	0	0	0	0	111.5	L407 F453 A458 V459 T460 Y465 M466	L407-A462 HydrophobicContact CD1-CB 3.68Å; F453-A462 HydrophobicContact CD1-CB 3.97Å; F453-A462 HydrophobicContact CE1-CB 3.5Å; F453-A462 HydrophobicContact CE2-CB 4.25Å; F453-A462 HydrophobicContact CZ-CB 3.66Å; A458-A462 VanDerWaalsContact O-CB 3.25Å; A458-A462 WeakPolarHBondContact O-CB 3.37Å; A458-A462 PolarHBondContact O-N 2.94Å; V459-A462 PolarHBondContact O-N 2.86Å; T460-A462 VanDerWaalsContact C-N 3.34Å; T460-A462 PolarHBondContact O-N 3.23Å; A462-Y465 PolarHBondContact O-N 3.15Å; A462-M466 VanDerWaalsContact O-CB 3.29Å; A462-M466 WeakPolarHBondContact O-CB 3.34Å; A462-M466 PolarHBondContact O-N 3.16Å
463	V	93.6	Very high	92.3	Very high	0 Å²	0	39 Å²	39	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-61.7	-45.5	176.6	173	0	0	0	0	111.2	L407 L410 A411 L414 F441 V459 T460 Y465 M466 V467	L407-V463 HydrophobicContact CB-CG2 4.27Å; L407-V463 HydrophobicContact CD1-CG2 4.23Å; L407-V463 HydrophobicContact CD2-CG2 4.47Å; L410-V463 HydrophobicContact CB-CG2 4.43Å; L410-V463 HydrophobicContact CD2-CG2 3.8Å; L410-V463 HydrophobicContact CG-CG2 4Å; A411-V463 HydrophobicContact CB-CG1 4.27Å; L414-V463 HydrophobicContact CD2-CG1 4.33Å; F441-V463 HydrophobicContact CE2-CG1 4.38Å; F441-V463 HydrophobicContact CZ-CB 4.26Å; F441-V463 HydrophobicContact CZ-CG1 4.04Å; F441-V463 HydrophobicContact CZ-CG2 4.47Å; V459-V463 HydrophobicContact CG1-CG2 4.3Å; V459-V463 VanDerWaalsContact O-CG2 3.3Å; V459-V463 WeakPolarHBondContact O-CG2 3.42Å; V459-V463 PolarHBondContact O-N 3.46Å; T460-V463 PolarHBondContact O-N 3.4Å; V463-Y465 VanDerWaalsContact C-N 3.35Å; V463-Y465 PolarHBondContact O-N 3.31Å; V463-M466 WeakPolarHBondContact O-CB 3.37Å; V463-M466 PolarHBondContact O-N 3.16Å; V463-V467 HydrophobicContact CG1-CG2 4.39Å; V463-V467 WeakPolarHBondContact O-CG2 3.15Å; V463-V467 PolarHBondContact O-N 2.84Å
464	K	94	Very high	92.7	Very high	31 Å²	31	38.4 Å²	38.4	14%	0.135	19%	0.186	C	C	.	.	H	α-helix	trans	-57.7	-47.9	176.2	-74.9	-174.6	-62.9	179.9	0	111.9	T460 M466 A468 L579 E582 V583 I586	T460-K464 HydrophobicContact CG2-CD 4.36Å; T460-K464 HydrophobicContact CG2-CG 4.48Å; T460-K464 WeakPolarHBondContact O-CB 3.34Å; T460-K464 VanDerWaalsContact O-CG 3.25Å; T460-K464 WeakPolarHBondContact O-CG 3.49Å; T460-K464 PolarHBondContact O-N 3.37Å; K464-M466 VanDerWaalsContact C-N 3.33Å; K464-M466 PolarHBondContact O-N 3.25Å; K464-A468 WeakPolarHBondContact O-CB 3.27Å; K464-A468 PolarHBondContact O-N 3.32Å; K464-L579 HydrophobicContact CD-CD2 4.15Å; K464-E582 HydrophobicContact CD-CB 3.96Å; K464-E582 VanDerWaalsContact CD-OE2 3.23Å; K464-E582 WeakPolarHBondContact CD-OE2 3.2Å; K464-E582 WeakPolarHBondContact CE-OE2 3.43Å; K464-E582 IonicContact NZ-OE2 2.8Å; K464-E582 PolarHBondContact NZ-OE2 3.41Å; K464-V583 HydrophobicContact CB-CG2 3.86Å; K464-V583 HydrophobicContact CG-CG2 3.83Å; K464-I586 HydrophobicContact CB-CD1 4.42Å
465	Y	93.3	Very high	93	Very high	60 Å²	60	31.8 Å²	31.8	24%	0.235	16%	0.157	C	C	.	.	H	α-helix	trans	-62.2	-42	177.4	175.9	-97.7	0	0	0	111.8	R398 K461 A462 V463 A468 L469 M591	R398-Y465 HydrophobicContact CB-CD1 4.44Å; R398-Y465 HydrophobicContact CB-CE1 3.72Å; K461-Y465 WeakPolarHBondContact O-CB 3.34Å; K461-Y465 PolarHBondContact O-N 3.02Å; A462-Y465 PolarHBondContact O-N 3.15Å; V463-Y465 VanDerWaalsContact C-N 3.35Å; V463-Y465 PolarHBondContact O-N 3.31Å; Y465-A468 PolarHBondContact O-N 3.34Å; Y465-L469 HydrophobicContact CE1-CD2 4.17Å; Y465-L469 VanDerWaalsContact O-CB 3.26Å; Y465-L469 WeakPolarHBondContact O-CB 3.42Å; Y465-L469 PolarHBondContact O-N 2.96Å; Y465-M591 HydrophobicContact CD2-CE 3.77Å; Y465-M591 HydrophobicContact CE2-CE 3.53Å
466	M	92.5	Very high	93.2	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-60.7	-50.8	179.1	-175.8	179	175.1	0	0	111.6	Y399 C402 V403 L407 C408 A411 A462 V463 K464 L469 Q470	Y399-M466 HydrophobicContact CD2-CG 3.84Å; Y399-M466 HydrophobicContact CE2-CE 3.91Å; Y399-M466 HydrophobicContact CE2-CG 3.52Å; C402-M466 HydrophobicContact CB-CB 4.41Å; C402-M466 HydrophobicContact CB-CG 4.38Å; C402-M466 HydrophobicContact CB-SD 3.84Å; V403-M466 HydrophobicContact CG2-CE 4.26Å; L407-M466 HydrophobicContact CB-SD 4.33Å; C408-M466 HydrophobicContact CB-CE 4.04Å; C408-M466 VanDerWaalsContact SG-CE 3.52Å; A411-M466 HydrophobicContact CB-CE 4.28Å; A411-M466 HydrophobicContact CB-CG 4.43Å; A411-M466 HydrophobicContact CB-SD 3.88Å; A462-M466 VanDerWaalsContact O-CB 3.29Å; A462-M466 WeakPolarHBondContact O-CB 3.34Å; A462-M466 PolarHBondContact O-N 3.16Å; V463-M466 WeakPolarHBondContact O-CB 3.37Å; V463-M466 PolarHBondContact O-N 3.16Å; K464-M466 VanDerWaalsContact C-N 3.33Å; K464-M466 PolarHBondContact O-N 3.25Å; M466-L469 PolarHBondContact O-N 2.78Å; M466-Q470 WeakPolarHBondContact O-CG 3.12Å; M466-Q470 PolarHBondContact O-N 3.25Å
467	V	94.6	Very high	93.6	Very high	3 Å²	3	28.7 Å²	28.7	2%	0.018	14%	0.138	C	C	.	.	H	α-helix	trans	-65.7	-45.5	178	-179.9	0	0	0	0	110.6	A411 L414 V463 L469 Q470 L471 V583	A411-V467 HydrophobicContact CB-CG2 3.73Å; L414-V467 HydrophobicContact CB-CG2 4.29Å; L414-V467 HydrophobicContact CD2-CB 4.15Å; L414-V467 HydrophobicContact CD2-CG1 4.34Å; L414-V467 HydrophobicContact CD2-CG2 3.84Å; V463-V467 HydrophobicContact CG1-CG2 4.39Å; V463-V467 WeakPolarHBondContact O-CG2 3.15Å; V463-V467 PolarHBondContact O-N 2.84Å; V467-L469 PolarHBondContact O-N 2.98Å; V467-Q470 WeakPolarHBondContact O-CB 3.38Å; V467-Q470 PolarHBondContact O-N 3.37Å; V467-Q470 VanDerWaalsContact O-N 3.13Å; V467-L471 HydrophobicContact CG1-CD1 4.17Å; V467-L471 HydrophobicContact CG1-CG 4.28Å; V467-L471 WeakPolarHBondContact O-CG 3.46Å; V467-L471 PolarHBondContact O-N 3.21Å; V467-V583 HydrophobicContact CB-CG1 4.1Å; V467-V583 HydrophobicContact CB-CG2 4.45Å; V467-V583 HydrophobicContact CG1-CG1 3.73Å
468	A	95.6	Very high	93.8	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-57.5	-40.8	177.3	0	0	0	0	0	111.7	K464 Y465 L471 S472 V583 I586 C587 M591	K464-A468 WeakPolarHBondContact O-CB 3.27Å; K464-A468 PolarHBondContact O-N 3.32Å; Y465-A468 PolarHBondContact O-N 3.34Å; A468-L471 PolarHBondContact O-N 3.03Å; A468-S472 VanDerWaalsContact O-CB 3.28Å; A468-S472 WeakPolarHBondContact O-CB 3.17Å; A468-S472 PolarHBondContact O-N 2.98Å; A468-S472 PolarHBondContact O-OG 2.77Å; A468-V583 HydrophobicContact CB-CG1 4.18Å; A468-I586 HydrophobicContact CB-CB 3.96Å; A468-I586 HydrophobicContact CB-CG2 3.71Å; A468-C587 HydrophobicContact CB-CB 4.21Å; A468-M591 HydrophobicContact CB-CE 4.29Å; A468-M591 HydrophobicContact CB-SD 4.36Å
469	L	94.2	Very high	94	Very high	18 Å²	18	26.3 Å²	26.3	9%	0.094	12%	0.122	C	C	.	.	H	α-helix	trans	-66.1	-44.5	176.7	-172.1	64.6	0	0	0	111.7	L353 Y399 Y465 M466 V467 L471 S472 R473 M591	L353-L469 HydrophobicContact CD1-CD2 3.68Å; L353-L469 HydrophobicContact CD1-CG 3.95Å; Y399-L469 HydrophobicContact CD2-CD2 3.86Å; Y399-L469 HydrophobicContact CG-CD2 4.04Å; Y465-L469 HydrophobicContact CE1-CD2 4.17Å; Y465-L469 VanDerWaalsContact O-CB 3.26Å; Y465-L469 WeakPolarHBondContact O-CB 3.42Å; Y465-L469 PolarHBondContact O-N 2.96Å; M466-L469 PolarHBondContact O-N 2.78Å; V467-L469 PolarHBondContact O-N 2.98Å; L469-L471 PolarHBondContact O-N 2.99Å; L469-S472 WeakPolarHBondContact CA-OG 3.29Å; L469-S472 PolarHBondContact O-N 3.24Å; L469-S472 PolarHBondContact O-OG 2.84Å; L469-R473 HydrophobicContact CD1-CG 4.11Å; L469-R473 HydrophobicContact CG-CG 4.35Å; L469-R473 WeakPolarHBondContact O-CB 3.36Å; L469-R473 WeakPolarHBondContact O-CG 3.28Å; L469-R473 PolarHBondContact O-N 3.43Å; L469-R473 VanDerWaalsContact O-N 3.09Å; L469-M591 HydrophobicContact CB-CE 4.31Å; L469-M591 HydrophobicContact CD1-CE 4.36Å; L469-M591 HydrophobicContact CD1-SD 4.26Å
470	Q	94.2	Very high	94.1	Very high	15 Å²	15	27.3 Å²	27.3	7%	0.07	13%	0.128	C	C	.	.	H	α-helix	trans	-57.1	-47.6	175.3	-72.4	171.4	-18.1	0	0	111.9	L353 Y399 P418 M466 V467 R473 E474	L353-Q470 HydrophobicContact CD2-CB 4.48Å; L353-Q470 HydrophobicContact CD2-CG 4.12Å; Y399-Q470 HydrophobicContact CE2-CG 3.86Å; Y399-Q470 PolarHBondContact OH-NE2 3.14Å; P418-Q470 HydrophobicContact CG-CB 3.99Å; M466-Q470 WeakPolarHBondContact O-CG 3.12Å; M466-Q470 PolarHBondContact O-N 3.25Å; V467-Q470 WeakPolarHBondContact O-CB 3.38Å; V467-Q470 PolarHBondContact O-N 3.37Å; V467-Q470 VanDerWaalsContact O-N 3.13Å; Q470-R473 PolarHBondContact O-N 3.4Å; Q470-E474 PolarHBondContact O-N 2.77Å
471	L	95.7	Very high	94.3	Very high	1 Å²	1	26.4 Å²	26.4	1%	0.005	12%	0.122	C	C	.	.	H	α-helix	trans	-63.2	-43.6	176.5	-60.1	178.6	0	0	0	111.7	P418 F421 V467 A468 L469 R473 E474 I477 Y564 V583 L584	P418-L471 HydrophobicContact CB-CD2 4.08Å; P418-L471 HydrophobicContact CG-CD2 4.15Å; F421-L471 HydrophobicContact CB-CD2 4.41Å; F421-L471 HydrophobicContact CD1-CD1 4.38Å; F421-L471 HydrophobicContact CD1-CD2 3.96Å; V467-L471 HydrophobicContact CG1-CD1 4.17Å; V467-L471 HydrophobicContact CG1-CG 4.28Å; V467-L471 WeakPolarHBondContact O-CG 3.46Å; V467-L471 PolarHBondContact O-N 3.21Å; A468-L471 PolarHBondContact O-N 3.03Å; L469-L471 PolarHBondContact O-N 2.99Å; L471-R473 PolarHBondContact O-N 3.06Å; L471-E474 PolarHBondContact O-N 2.76Å; L471-I477 HydrophobicContact CB-CD1 4.1Å; L471-I477 HydrophobicContact CD2-CD1 4.1Å; L471-I477 WeakPolarHBondContact O-CD1 3.25Å; L471-Y564 HydrophobicContact CD1-CE1 4.23Å; L471-Y564 HydrophobicContact CD1-CE2 4.42Å; L471-Y564 HydrophobicContact CD2-CE2 4.37Å; L471-V583 HydrophobicContact CD1-CG1 3.9Å; L471-L584 HydrophobicContact CD1-CD2 4.23Å
472	S	95.8	Very high	94.4	Very high	4 Å²	4	22.3 Å²	22.3	3%	0.028	10%	0.103	C	C	.	.	H	α-helix	trans	-68.1	-19.1	-177.7	76.6	0	0	0	0	114.3	A468 L469 R478 M591 L592	A468-S472 VanDerWaalsContact O-CB 3.28Å; A468-S472 WeakPolarHBondContact O-CB 3.17Å; A468-S472 PolarHBondContact O-N 2.98Å; A468-S472 PolarHBondContact O-OG 2.77Å; L469-S472 WeakPolarHBondContact CA-OG 3.29Å; L469-S472 PolarHBondContact O-N 3.24Å; L469-S472 PolarHBondContact O-OG 2.84Å; S472-R478 VanDerWaalsContact O-CD 3.22Å; S472-R478 WeakPolarHBondContact O-CD 3.48Å; S472-R478 VanDerWaalsContact O-CG 3.26Å; S472-R478 WeakPolarHBondContact O-CG 3.36Å; S472-R478 PolarHBondContact O-NH1 3.1Å; S472-M591 PolarHBondContact OG-SD 3.14Å; S472-L592 WeakPolarHBondContact O-CD2 3.43Å
473	R	94.4	Very high	94.4	Very high	89 Å²	89	24.8 Å²	24.8	34%	0.336	12%	0.12	S	C	.	.	H	α-helix	trans	-101.2	-6.8	-178.7	-65.1	-65.9	175.2	-175	-0.6	113.3	F350 L353 L469 Q470 L471 P475	F350-R473 WeakPolarHBondContact CB-O 3.32Å; L353-R473 HydrophobicContact CD2-CB 3.85Å; L353-R473 HydrophobicContact CD2-CG 4.08Å; L469-R473 HydrophobicContact CD1-CG 4.11Å; L469-R473 HydrophobicContact CG-CG 4.35Å; L469-R473 WeakPolarHBondContact O-CB 3.36Å; L469-R473 WeakPolarHBondContact O-CG 3.28Å; L469-R473 PolarHBondContact O-N 3.43Å; L469-R473 VanDerWaalsContact O-N 3.09Å; Q470-R473 PolarHBondContact O-N 3.4Å; L471-R473 PolarHBondContact O-N 3.06Å; R473-P475 WeakPolarHBondContact O-CD 3.15Å
474	E	95.4	Very high	94.4	Very high	19 Å²	19	27.1 Å²	27.1	9%	0.089	13%	0.131	C	C	.	.			trans	-68.1	120.8	174.8	-176.9	58.2	-144.8	0	0	110.7	F350 P418 A422 Q470 L471 L476 I477 R478	F350-E474 VanDerWaalsContact CE2-OE2 3.29Å; F350-E474 WeakPolarHBondContact CE2-OE2 3.38Å; P418-E474 HydrophobicContact CB-CB 3.95Å; P418-E474 HydrophobicContact CB-CG 4.01Å; A422-E474 HydrophobicContact CB-CG 4.21Å; Q470-E474 PolarHBondContact O-N 2.77Å; L471-E474 PolarHBondContact O-N 2.76Å; E474-L476 VanDerWaalsContact C-N 3.33Å; E474-L476 PolarHBondContact O-N 3.15Å; E474-I477 HydrophobicContact CB-CB 4.08Å; E474-I477 HydrophobicContact CB-CD1 3.75Å; E474-I477 HydrophobicContact CB-CG1 3.83Å; E474-I477 HydrophobicContact CG-CB 4.4Å; E474-I477 HydrophobicContact CG-CD1 4.03Å; E474-I477 HydrophobicContact CG-CG1 3.82Å; E474-I477 PolarHBondContact O-N 3.33Å; E474-R478 WeakPolarHBondContact O-CG 3.48Å; E474-R478 PolarHBondContact O-N 3.17Å
475	P	94.7	Very high	94.3	Very high	22 Å²	22	25.9 Å²	25.9	14%	0.143	13%	0.126	C	C	.	.	H	α-helix	trans	-57.9	-41	-175.1	-25.7	33.5	0	0	0	113.6	L347 F350 R473 R478 Q479	L347-P475 HydrophobicContact CD2-CB 4.09Å; L347-P475 HydrophobicContact CD2-CG 3.69Å; L347-P475 HydrophobicContact CG-CG 4.43Å; F350-P475 HydrophobicContact CB-CG 3.93Å; F350-P475 HydrophobicContact CD2-CG 4.33Å; F350-P475 HydrophobicContact CG-CG 4.05Å; R473-P475 WeakPolarHBondContact O-CD 3.15Å; P475-R478 PolarHBondContact O-N 3.36Å; P475-Q479 WeakPolarHBondContact O-CB 3.24Å; P475-Q479 PolarHBondContact O-N 3.38Å
476	L	93	Very high	94.2	Very high	54 Å²	54	24.4 Å²	24.4	28%	0.283	12%	0.123	S	C	.	.	H	α-helix	trans	-67.3	-39.7	-179.6	-65.4	176.2	0	0	0	112	A422 E474 Q479 T480	A422-L476 HydrophobicContact CB-CB 3.57Å; A422-L476 HydrophobicContact CB-CD1 4.38Å; E474-L476 VanDerWaalsContact C-N 3.33Å; E474-L476 PolarHBondContact O-N 3.15Å; L476-Q479 PolarHBondContact O-N 2.79Å; L476-T480 PolarHBondContact O-N 2.83Å; L476-T480 PolarHBondContact O-OG1 2.93Å; L476-T480 VanDerWaalsContact O-OG1 3.13Å
477	I	96.9	Very high	94.1	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-61.3	-49.1	173.1	-62.4	-179.3	0	0	0	109.3	F421 A422 L425 L471 E474 Q479 T480 V481 L592	F421-I477 HydrophobicContact CD1-CD1 3.55Å; F421-I477 HydrophobicContact CD1-CG1 4.39Å; F421-I477 HydrophobicContact CE1-CD1 4.2Å; F421-I477 HydrophobicContact CG-CD1 4.49Å; A422-I477 HydrophobicContact CB-CD1 4.4Å; A422-I477 HydrophobicContact CB-CG1 3.55Å; L425-I477 HydrophobicContact CD1-CB 4.41Å; L425-I477 HydrophobicContact CD1-CG1 4.19Å; L425-I477 HydrophobicContact CD1-CG2 3.91Å; L471-I477 HydrophobicContact CB-CD1 4.1Å; L471-I477 HydrophobicContact CD2-CD1 4.1Å; L471-I477 WeakPolarHBondContact O-CD1 3.25Å; E474-I477 HydrophobicContact CB-CB 4.08Å; E474-I477 HydrophobicContact CB-CD1 3.75Å; E474-I477 HydrophobicContact CB-CG1 3.83Å; E474-I477 HydrophobicContact CG-CB 4.4Å; E474-I477 HydrophobicContact CG-CD1 4.03Å; E474-I477 HydrophobicContact CG-CG1 3.82Å; E474-I477 PolarHBondContact O-N 3.33Å; I477-Q479 VanDerWaalsContact C-N 3.33Å; I477-Q479 PolarHBondContact O-N 2.99Å; I477-T480 PolarHBondContact O-N 2.65Å; I477-V481 HydrophobicContact CG2-CG2 4.07Å; I477-V481 WeakPolarHBondContact O-CB 3.39Å; I477-V481 VanDerWaalsContact O-CG2 3.24Å; I477-V481 WeakPolarHBondContact O-CG2 3.03Å; I477-V481 PolarHBondContact O-N 3.33Å; I477-L592 HydrophobicContact CG2-CD1 4.09Å
478	R	96.1	Very high	94	Very high	16 Å²	16	33.1 Å²	33.1	6%	0.06	16%	0.164	C	C	.	.	H	α-helix	trans	-60.2	-43.2	-179.9	-68.6	-178.2	66	70.5	4.1	111.7	D346 S472 E474 P475 R482 L592 S595 F596	D346-R478 VanDerWaalsContact CG-NE 3.27Å; D346-R478 IonicContact OD1-CZ 3.38Å; D346-R478 IonicContact OD1-NE 2.58Å; D346-R478 PolarHBondContact OD1-NE 2.83Å; D346-R478 IonicContact OD1-NH2 3.27Å; D346-R478 PolarHBondContact OD1-NH2 3.09Å; D346-R478 IonicContact OD2-NE 2.7Å; S472-R478 VanDerWaalsContact O-CD 3.22Å; S472-R478 WeakPolarHBondContact O-CD 3.48Å; S472-R478 VanDerWaalsContact O-CG 3.26Å; S472-R478 WeakPolarHBondContact O-CG 3.36Å; S472-R478 PolarHBondContact O-NH1 3.1Å; E474-R478 WeakPolarHBondContact O-CG 3.48Å; E474-R478 PolarHBondContact O-N 3.17Å; P475-R478 PolarHBondContact O-N 3.36Å; R478-R482 WeakPolarHBondContact O-CA 3.49Å; R478-R482 WeakPolarHBondContact O-CB 3.37Å; R478-R482 PolarHBondContact O-N 2.87Å; R478-L592 HydrophobicContact CG-CD2 3.96Å; R478-S595 PolarHBondContact NH2-OG 3.49Å; R478-F596 HydrophobicContact CB-CZ 4.12Å; R478-F596 HydrophobicContact CG-CZ 4.43Å; R478-F596 WeakPolarHBondContact O-CZ 3.42Å
479	Q	93.7	Very high	93.9	Very high	80 Å²	80	33.2 Å²	33.2	37%	0.374	17%	0.165	S	C	.	.	H	α-helix	trans	-60.6	-49.7	177.3	-170.2	-176	37	0	0	111.9	E343 P475 L476 I477 S483	E343-Q479 PolarHBondContact OE1-NE2 2.66Å; P475-Q479 WeakPolarHBondContact O-CB 3.24Å; P475-Q479 PolarHBondContact O-N 3.38Å; L476-Q479 PolarHBondContact O-N 2.79Å; I477-Q479 VanDerWaalsContact C-N 3.33Å; I477-Q479 PolarHBondContact O-N 2.99Å; Q479-S483 WeakPolarHBondContact O-CB 3.39Å; Q479-S483 PolarHBondContact O-N 3.49Å
480	T	94.2	Very high	94	Very high	21 Å²	21	32.6 Å²	32.6	13%	0.129	16%	0.162	C	C	.	.	H	α-helix	trans	-64	-47.2	179.4	-58.2	0	0	0	0	111.6	L425 Q426 L476 I477 S483 E484	L425-T480 HydrophobicContact CB-CG2 4.16Å; Q426-T480 VanDerWaalsContact CG-OG1 3.3Å; Q426-T480 WeakPolarHBondContact CG-OG1 3.44Å; L476-T480 PolarHBondContact O-N 2.83Å; L476-T480 PolarHBondContact O-OG1 2.93Å; L476-T480 VanDerWaalsContact O-OG1 3.13Å; I477-T480 PolarHBondContact O-N 2.65Å; T480-S483 PolarHBondContact O-N 2.95Å; T480-E484 PolarHBondContact O-N 2.82Å
481	V	95.1	Very high	94.1	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-68.5	-37.9	-179.5	-178.3	0	0	0	0	111.4	L425 I477 E484 Y485 Y554 F588 L592 Y593 F596	L425-V481 HydrophobicContact CD1-CG2 4.46Å; I477-V481 HydrophobicContact CG2-CG2 4.07Å; I477-V481 WeakPolarHBondContact O-CB 3.39Å; I477-V481 VanDerWaalsContact O-CG2 3.24Å; I477-V481 WeakPolarHBondContact O-CG2 3.03Å; I477-V481 PolarHBondContact O-N 3.33Å; V481-E484 PolarHBondContact O-N 2.82Å; V481-Y485 WeakPolarHBondContact O-CB 3.42Å; V481-Y485 PolarHBondContact O-N 2.95Å; V481-Y554 HydrophobicContact CG2-CE1 4.12Å; V481-F588 HydrophobicContact CG1-CD1 4.32Å; V481-F588 HydrophobicContact CG1-CE1 4.14Å; V481-F588 HydrophobicContact CG2-CD1 4.49Å; V481-F588 HydrophobicContact CG2-CE1 3.61Å; V481-F588 HydrophobicContact CG2-CZ 4.09Å; V481-L592 HydrophobicContact CB-CD1 4.31Å; V481-L592 HydrophobicContact CG1-CB 4.41Å; V481-L592 HydrophobicContact CG1-CD1 4.17Å; V481-L592 HydrophobicContact CG2-CD1 4.08Å; V481-Y593 HydrophobicContact CG1-CE1 4.19Å; V481-F596 HydrophobicContact CB-CE2 3.91Å; V481-F596 HydrophobicContact CG1-CD2 4.08Å; V481-F596 HydrophobicContact CG1-CE2 3.67Å
482	R	93.7	Very high	94.1	Very high	26 Å²	26	32.9 Å²	32.9	10%	0.098	17%	0.166	C	C	.	.	H	α-helix	trans	-58.7	-47.1	173.5	179.6	-172.9	-69.5	107.5	-1.1	111.2	D346 R478 Y485 T486 F596 E599	D346-R482 VanDerWaalsContact CG-NH2 3.26Å; D346-R482 IonicContact OD1-NH2 3.06Å; D346-R482 PolarHBondContact OD1-NH2 2.99Å; D346-R482 IonicContact OD2-CZ 3.27Å; D346-R482 IonicContact OD2-NH1 3.35Å; D346-R482 PolarHBondContact OD2-NH1 2.77Å; D346-R482 IonicContact OD2-NH2 3.66Å; D346-R482 PolarHBondContact OD2-NH2 2.87Å; R478-R482 WeakPolarHBondContact O-CA 3.49Å; R478-R482 WeakPolarHBondContact O-CB 3.37Å; R478-R482 PolarHBondContact O-N 2.87Å; R482-Y485 PolarHBondContact O-N 3.02Å; R482-T486 VanDerWaalsContact O-CB 3.3Å; R482-T486 WeakPolarHBondContact O-CB 3.44Å; R482-T486 PolarHBondContact O-N 3.16Å; R482-T486 PolarHBondContact O-OG1 3.04Å; R482-F596 HydrophobicContact CB-CD1 4.05Å; R482-F596 HydrophobicContact CB-CE1 3.76Å; R482-F596 HydrophobicContact CB-CE2 4.46Å; R482-F596 HydrophobicContact CB-CZ 3.98Å; R482-F596 HydrophobicContact CG-CD1 4.18Å; R482-F596 HydrophobicContact CG-CE1 4.24Å; R482-E599 WeakPolarHBondContact CD-OE1 3.5Å; R482-E599 IonicContact CZ-OE2 2.79Å; R482-E599 IonicContact NE-OE1 2.75Å; R482-E599 PolarHBondContact NE-OE1 3.01Å; R482-E599 IonicContact NE-OE2 2.76Å; R482-E599 PolarHBondContact NE-OE2 2.89Å; R482-E599 IonicContact NH2-OE2 3.2Å
483	S	92	Very high	94.1	Very high	61 Å²	61	33 Å²	33	43%	0.427	17%	0.166	S	C	.	.	H	α-helix	trans	-60.6	-50.5	178.3	-176.6	0	0	0	0	111.1	Q479 T480 Y485 T486 N487	Q479-S483 WeakPolarHBondContact O-CB 3.39Å; Q479-S483 PolarHBondContact O-N 3.49Å; T480-S483 PolarHBondContact O-N 2.95Å; S483-Y485 PolarHBondContact O-N 3.05Å; S483-T486 PolarHBondContact O-N 3.39Å; S483-N487 WeakPolarHBondContact O-CB 3.45Å; S483-N487 VanDerWaalsContact O-CG 3.22Å; S483-N487 PolarHBondContact O-N 3.36Å; S483-N487 PolarHBondContact O-ND2 3.32Å; S483-N487 PolarHBondContact OG-ND2 2.89Å
484	E	92.3	Very high	94.2	Very high	49 Å²	49	32.5 Å²	32.5	23%	0.229	17%	0.167	C	C	.	.	H	α-helix	trans	-62	-44.5	177.8	-73.3	-63.3	133.6	0	0	112.3	T480 V481 T486 N487 R488 M546 Y554	T480-E484 PolarHBondContact O-N 2.82Å; V481-E484 PolarHBondContact O-N 2.82Å; E484-T486 PolarHBondContact O-N 3.34Å; E484-N487 PolarHBondContact O-N 3.38Å; E484-R488 WeakPolarHBondContact O-CB 3.48Å; E484-R488 WeakPolarHBondContact O-CG 3.4Å; E484-R488 PolarHBondContact O-N 3.32Å; E484-R488 VanDerWaalsContact O-N 3.08Å; E484-R488 IonicContact OE2-CZ 2.64Å; E484-R488 IonicContact OE2-NE 2.81Å; E484-R488 PolarHBondContact OE2-NE 2.84Å; E484-R488 IonicContact OE2-NH2 2.88Å; E484-R488 PolarHBondContact OE2-NH2 3.3Å; E484-M546 VanDerWaalsContact C-CE 3.47Å; E484-M546 HydrophobicContact CB-CE 3.76Å; E484-M546 WeakPolarHBondContact O-CE 3.37Å; E484-Y554 HydrophobicContact CB-CD2 4.43Å; E484-Y554 HydrophobicContact CB-CE2 4.37Å; E484-Y554 HydrophobicContact CG-CD2 4.29Å; E484-Y554 HydrophobicContact CG-CE2 3.82Å
485	Y	93.6	Very high	94.3	Very high	5 Å²	5	31.7 Å²	31.7	2%	0.02	16%	0.164	C	C	.	.	H	α-helix	trans	-60.8	-47.3	178.9	-169.1	-81	0	0	0	110.7	V481 R482 S483 N487 R488 A489 L544 M546 Y593 F596 I600	V481-Y485 WeakPolarHBondContact O-CB 3.42Å; V481-Y485 PolarHBondContact O-N 2.95Å; R482-Y485 PolarHBondContact O-N 3.02Å; S483-Y485 PolarHBondContact O-N 3.05Å; Y485-N487 PolarHBondContact O-N 2.87Å; Y485-R488 CarbonylContact O-C 3.11Å; Y485-R488 PolarHBondContact O-N 3.25Å; Y485-A489 HydrophobicContact CD1-CB 4.49Å; Y485-A489 HydrophobicContact CE1-CB 4.44Å; Y485-A489 WeakPolarHBondContact O-CA 3.22Å; Y485-A489 WeakPolarHBondContact O-CB 3.41Å; Y485-A489 PolarHBondContact O-N 2.86Å; Y485-L544 HydrophobicContact CE1-CD2 3.77Å; Y485-L544 WeakPolarHBondContact OH-CD2 3.34Å; Y485-M546 HydrophobicContact CD2-CB 3.78Å; Y485-M546 HydrophobicContact CD2-CG 4.11Å; Y485-M546 HydrophobicContact CD2-SD 3.84Å; Y485-M546 HydrophobicContact CE2-CB 3.79Å; Y485-M546 HydrophobicContact CG-SD 4.43Å; Y485-Y593 AromaticContact CD2-CD1 3.52Å; Y485-Y593 HydrophobicContact CD2-CD1 3.52Å; Y485-Y593 HydrophobicContact CD2-CE1 4.03Å; Y485-Y593 HydrophobicContact CD2-CG 4.2Å; Y485-Y593 AromaticContact CE2-CD1 3.78Å; Y485-Y593 HydrophobicContact CE2-CD1 3.78Å; Y485-Y593 AromaticContact CE2-CG 3.96Å; Y485-Y593 HydrophobicContact CE2-CG 3.96Å; Y485-F596 HydrophobicContact CD1-CB 3.88Å; Y485-F596 HydrophobicContact CD2-CB 4.49Å; Y485-F596 HydrophobicContact CE1-CB 4.25Å; Y485-F596 HydrophobicContact CG-CB 4.03Å; Y485-I600 HydrophobicContact CD1-CD1 3.51Å; Y485-I600 HydrophobicContact CE1-CD1 3.76Å
486	T	91.3	Very high	94.3	Very high	30 Å²	30	32.1 Å²	32.1	18%	0.184	17%	0.166	C	C	.	.	H	α-helix	trans	-61.7	-44.8	178.3	-55.8	0	0	0	0	111.9	L215 R482 S483 E484 R488 I520 I600	L215-T486 HydrophobicContact CD2-CG2 3.45Å; L215-T486 VanDerWaalsContact CD2-CG2 3.45Å; R482-T486 VanDerWaalsContact O-CB 3.3Å; R482-T486 WeakPolarHBondContact O-CB 3.44Å; R482-T486 PolarHBondContact O-N 3.16Å; R482-T486 PolarHBondContact O-OG1 3.04Å; S483-T486 PolarHBondContact O-N 3.39Å; E484-T486 PolarHBondContact O-N 3.34Å; T486-R488 VanDerWaalsContact C-N 3.28Å; T486-R488 PolarHBondContact O-N 2.81Å; T486-I520 HydrophobicContact CG2-CD1 4.4Å; T486-I600 HydrophobicContact CG2-CD1 4.39Å
487	N	90.3	Very high	94.2	Very high	113 Å²	113	33.5 Å²	33.5	60%	0.604	18%	0.18	S	C	*	.	H	α-helix	trans	-66.1	-29.3	-179.3	-73.5	-33.5	0	0	0	113.4	S483 E484 Y485	S483-N487 WeakPolarHBondContact O-CB 3.45Å; S483-N487 VanDerWaalsContact O-CG 3.22Å; S483-N487 PolarHBondContact O-N 3.36Å; S483-N487 PolarHBondContact O-ND2 3.32Å; S483-N487 PolarHBondContact OG-ND2 2.89Å; E484-N487 PolarHBondContact O-N 3.38Å; Y485-N487 PolarHBondContact O-N 2.87Å
488	R	91.9	Very high	94	Very high	72 Å²	72	36.8 Å²	36.8	27%	0.272	20%	0.197	S	C	.	.	H	α-helix	trans	-108.6	1.5	-176.5	-54.8	-171.7	-160.7	-163	5.7	113.8	E484 Y485 T486 T490 M546 G547 E557	E484-R488 WeakPolarHBondContact O-CB 3.48Å; E484-R488 WeakPolarHBondContact O-CG 3.4Å; E484-R488 PolarHBondContact O-N 3.32Å; E484-R488 VanDerWaalsContact O-N 3.08Å; E484-R488 IonicContact OE2-CZ 2.64Å; E484-R488 IonicContact OE2-NE 2.81Å; E484-R488 PolarHBondContact OE2-NE 2.84Å; E484-R488 IonicContact OE2-NH2 2.88Å; E484-R488 PolarHBondContact OE2-NH2 3.3Å; Y485-R488 CarbonylContact O-C 3.11Å; Y485-R488 PolarHBondContact O-N 3.25Å; T486-R488 VanDerWaalsContact C-N 3.28Å; T486-R488 PolarHBondContact O-N 2.81Å; R488-T490 PolarHBondContact O-N 2.86Å; R488-M546 HydrophobicContact CB-CE 4.26Å; R488-M546 HydrophobicContact CB-CG 4.03Å; R488-M546 HydrophobicContact CG-CE 4.37Å; R488-G547 PolarHBondContact O-N 3.19Å; R488-E557 IonicContact CZ-OE1 2.74Å; R488-E557 IonicContact CZ-OE2 3.44Å; R488-E557 VanDerWaalsContact NH1-CD 3.34Å; R488-E557 IonicContact NH1-OE1 3.42Å; R488-E557 PolarHBondContact NH1-OE1 3.28Å; R488-E557 IonicContact NH1-OE2 3.4Å; R488-E557 PolarHBondContact NH1-OE2 3.21Å; R488-E557 IonicContact NH2-OE1 3.44Å; R488-E557 IonicContact NH2-OE2 3.24Å; R488-E557 PolarHBondContact NH2-OE2 3.35Å
489	A	94.1	Very high	93.9	Very high	2 Å²	2	36 Å²	36	2%	0.017	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	130.2	-178.4	0	0	0	0	0	111	Y485 I520 L544 K545 I600	Y485-A489 HydrophobicContact CD1-CB 4.49Å; Y485-A489 HydrophobicContact CE1-CB 4.44Å; Y485-A489 WeakPolarHBondContact O-CA 3.22Å; Y485-A489 WeakPolarHBondContact O-CB 3.41Å; Y485-A489 PolarHBondContact O-N 2.86Å; A489-I520 HydrophobicContact CB-CD1 3.71Å; A489-I520 HydrophobicContact CB-CG1 3.99Å; A489-I520 HydrophobicContact CB-CG2 4.04Å; A489-I520 PolarHBondContact O-N 3.1Å; A489-I520 VanDerWaalsContact O-N 3.14Å; A489-L544 HydrophobicContact CB-CD2 4.13Å; A489-K545 WeakPolarHBondContact CA-O 3.36Å; A489-I600 HydrophobicContact CB-CD1 4Å
490	T	95.6	Very high	93.8	Very high	6 Å²	6	35.8 Å²	35.8	4%	0.037	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	150.6	174.6	68.3	0	0	0	0	110.9	R488 K518 L544 K545 G547 R548	R488-T490 PolarHBondContact O-N 2.86Å; T490-K518 CarbonylContact C-O 3.58Å; T490-K518 WeakPolarHBondContact CA-O 3.38Å; T490-L544 WeakPolarHBondContact O-CA 3.45Å; T490-K545 PolarHBondContact N-O 2.92Å; T490-K545 PolarHBondContact O-N 3.38Å; T490-G547 PolarHBondContact OG1-O 3.36Å; T490-R548 HydrophobicContact CG2-CG 4.1Å
491	I	95.8	Very high	93.5	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	136.6	178.5	-165.2	164.7	0	0	0	109.8	L493 K518 L523 Y528 Y531 V542 T543	I491-L493 HydrophobicContact CG1-CD2 4.34Å; I491-K518 HydrophobicContact CG2-CB 3.89Å; I491-K518 HydrophobicContact CG2-CG 4.27Å; I491-K518 WeakPolarHBondContact CG2-O 3.34Å; I491-K518 PolarHBondContact N-O 3.27Å; I491-K518 PolarHBondContact O-N 3.25Å; I491-L523 HydrophobicContact CG2-CD1 4.48Å; I491-L523 HydrophobicContact CG2-CD2 4.17Å; I491-Y528 HydrophobicContact CD1-CD2 3.92Å; I491-Y528 HydrophobicContact CD1-CE2 3.74Å; I491-Y531 HydrophobicContact CD1-CD2 3.71Å; I491-Y531 HydrophobicContact CD1-CE2 3.94Å; I491-Y531 HydrophobicContact CG2-CE2 4.46Å; I491-V542 HydrophobicContact CD1-CG1 3.65Å; I491-V542 HydrophobicContact CG1-CG1 3.87Å; I491-T543 WeakPolarHBondContact CA-O 3.4Å
492	S	96	Very high	93.3	Very high	22 Å²	22	47.6 Å²	47.6	15%	0.154	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	138.4	174.6	-61.6	0	0	0	0	110.2	I515 D517 T543	S492-I515 CarbonylContact C-O 3.56Å; S492-I515 VanDerWaalsContact CA-O 3.23Å; S492-I515 WeakPolarHBondContact CA-O 3.15Å; S492-I515 WeakPolarHBondContact CB-O 3.46Å; S492-D517 PolarHBondContact OG-N 3.3Å; S492-T543 PolarHBondContact N-O 3.05Å; S492-T543 PolarHBondContact O-N 2.95Å; S492-T543 PolarHBondContact O-OG1 3.28Å; S492-T543 VanDerWaalsContact O-OG1 3.12Å
493	L	97	Very high	93.1	Very high	6 Å²	6	46.4 Å²	46.4	3%	0.031	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	133.6	-177.6	-54.4	-175.7	0	0	0	110.3	I491 Y512 I515 Y531 I540 V542	I491-L493 HydrophobicContact CG1-CD2 4.34Å; L493-Y512 WeakPolarHBondContact CD1-O 3.38Å; L493-I515 HydrophobicContact CB-CB 3.94Å; L493-I515 HydrophobicContact CB-CG1 4.3Å; L493-I515 HydrophobicContact CD1-CB 4.18Å; L493-I515 HydrophobicContact CD1-CG1 3.83Å; L493-I515 HydrophobicContact CG-CB 3.9Å; L493-I515 HydrophobicContact CG-CG1 4.13Å; L493-I515 PolarHBondContact N-O 3.49Å; L493-I515 PolarHBondContact O-N 3.03Å; L493-I515 VanDerWaalsContact O-N 3.09Å; L493-Y531 HydrophobicContact CD1-CD1 3.68Å; L493-Y531 HydrophobicContact CD1-CD2 4Å; L493-Y531 HydrophobicContact CD1-CE1 3.53Å; L493-Y531 HydrophobicContact CD1-CE2 3.8Å; L493-Y531 HydrophobicContact CD1-CG 3.93Å; L493-Y531 HydrophobicContact CD2-CD2 4.02Å; L493-Y531 HydrophobicContact CD2-CE2 4.32Å; L493-Y531 HydrophobicContact CD2-CG 4.25Å; L493-Y531 HydrophobicContact CG-CD2 4.49Å; L493-Y531 HydrophobicContact CG-CE2 4.36Å; L493-I540 HydrophobicContact CD1-CD1 4.22Å; L493-I540 HydrophobicContact CD2-CD1 4.13Å; L493-V542 HydrophobicContact CD2-CB 4.08Å; L493-V542 HydrophobicContact CD2-CG1 3.91Å; L493-V542 HydrophobicContact CD2-CG2 3.71Å
494	H	96.1	Very high	92.7	Very high	78 Å²	78	48 Å²	48	36%	0.361	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	133.3	172.7	-160.4	-73.7	0	0	0	110.1	I540 T541 D1191	H494-I540 CarbonylContact O-C 3.52Å; H494-I540 WeakPolarHBondContact O-CA 3.26Å; H494-T541 PolarHBondContact N-O 3.3Å; H494-T541 PolarHBondContact O-N 3.41Å; H494-D1191 IonicContact CE1-OD1 2.72Å; H494-D1191 IonicContact CE1-OD2 2.74Å; H494-D1191 PolarHBondContact CE1-OD2 3.29Å; H494-D1191 IonicContact NE2-OD2 3.19Å
495	P	96.4	Very high	92.1	Very high	2 Å²	2	47.6 Å²	47.6	1%	0.013	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	145.4	179.3	29.7	-30.7	0	0	0	110.8	R500 K513 Y514 L539	P495-R500 HydrophobicContact CB-CG 3.97Å; P495-R500 HydrophobicContact CG-CG 3.84Å; P495-R500 PolarHBondContact O-NH1 3.29Å; P495-R500 VanDerWaalsContact O-NH1 3.12Å; P495-K513 HydrophobicContact CB-CG 4.24Å; P495-K513 VanDerWaalsContact CD-O 3.3Å; P495-K513 WeakPolarHBondContact CD-O 3.47Å; P495-K513 HydrophobicContact CG-CG 4.21Å; P495-Y514 VanDerWaalsContact CD-CD1 3.46Å; P495-Y514 HydrophobicContact CG-CD1 3.97Å; P495-Y514 HydrophobicContact CG-CD2 4.48Å; P495-Y514 HydrophobicContact CG-CE1 3.34Å; P495-Y514 HydrophobicContact CG-CE2 3.94Å; P495-Y514 HydrophobicContact CG-CG 4.49Å; P495-L539 WeakPolarHBondContact CA-O 3.4Å
496	T	95.2	Very high	91.4	Very high	32 Å²	32	49.8 Å²	49.8	20%	0.196	26%	0.263	C	S	.	.			trans	-77.8	175.1	170.6	71.6	0	0	0	0	110.2	L498 G499 R500 R538 L539	T496-L498 PolarHBondContact O-N 3.42Å; T496-L498 PolarHBondContact OG1-N 3.15Å; T496-G499 PolarHBondContact O-N 2.99Å; T496-G499 PolarHBondContact OG1-N 2.99Å; T496-G499 VanDerWaalsContact OG1-N 3.13Å; T496-R500 WeakPolarHBondContact O-CG 3.18Å; T496-R500 PolarHBondContact O-N 2.92Å; T496-R538 WeakPolarHBondContact CB-O 3.16Å; T496-R538 VanDerWaalsContact CG2-O 3.3Å; T496-R538 WeakPolarHBondContact CG2-O 3.23Å; T496-R538 PolarHBondContact OG1-O 2.89Å; T496-L539 PolarHBondContact N-O 3.4Å; T496-L539 PolarHBondContact OG1-O 2.65Å
497	S	90.7	Very high	91.2	Very high	82 Å²	82	51 Å²	51	57%	0.573	27%	0.266	S	S	*	.	H	α-helix	trans	-59.7	-29.2	173.4	67.2	0	0	0	0	113.5
498	L	93.9	Very high	91	Very high	70 Å²	70	49.6 Å²	49.6	37%	0.366	26%	0.263	S	S	.	.	H	α-helix	trans	-77.4	-50.9	175.2	-174.5	62.8	0	0	0	110.7	T496 R500 K501 E502 L539	T496-L498 PolarHBondContact O-N 3.42Å; T496-L498 PolarHBondContact OG1-N 3.15Å; L498-R500 PolarHBondContact O-N 2.95Å; L498-K501 WeakPolarHBondContact O-CA 3.23Å; L498-K501 WeakPolarHBondContact O-CB 3.48Å; L498-K501 PolarHBondContact O-N 3.22Å; L498-E502 HydrophobicContact CD1-CG 4.09Å; L498-E502 WeakPolarHBondContact CD1-OE1 3.34Å; L498-E502 HydrophobicContact CG-CG 4.33Å; L498-E502 PolarHBondContact O-N 3.21Å; L498-L539 HydrophobicContact CD2-CD2 4.12Å; L498-L539 HydrophobicContact CG-CD2 4.01Å
499	G	92.7	Very high	91	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-64.6	-26.4	-179.6	0	0	0	0	0	113.9	T496 K501 I503 L539	T496-G499 PolarHBondContact O-N 2.99Å; T496-G499 PolarHBondContact OG1-N 2.99Å; T496-G499 VanDerWaalsContact OG1-N 3.13Å; G499-K501 PolarHBondContact O-N 2.89Å; G499-I503 WeakPolarHBondContact O-CB 3.45Å; G499-I503 VanDerWaalsContact O-CG1 3.31Å; G499-I503 WeakPolarHBondContact O-CG1 3.43Å; G499-I503 PolarHBondContact O-N 2.86Å; G499-L539 VanDerWaalsContact CA-O 3.27Å; G499-L539 WeakPolarHBondContact CA-O 3.27Å
500	R	92.1	Very high	90.8	Very high	74 Å²	74	47.2 Å²	47.2	28%	0.279	25%	0.254	S	S	.	.	H	α-helix	trans	-58.8	-37	169.8	-82.6	-166.8	-71.2	-81	-4.7	112.7	P495 T496 L498 K513 D1191	P495-R500 HydrophobicContact CB-CG 3.97Å; P495-R500 HydrophobicContact CG-CG 3.84Å; P495-R500 PolarHBondContact O-NH1 3.29Å; P495-R500 VanDerWaalsContact O-NH1 3.12Å; T496-R500 WeakPolarHBondContact O-CG 3.18Å; T496-R500 PolarHBondContact O-N 2.92Å; L498-R500 PolarHBondContact O-N 2.95Å; R500-K513 PolarHBondContact O-NZ 3.08Å; R500-D1191 WeakPolarHBondContact CD-OD2 3.3Å; R500-D1191 IonicContact CZ-OD2 3.14Å; R500-D1191 IonicContact NE-OD2 3.46Å; R500-D1191 IonicContact NH1-OD1 3.73Å; R500-D1191 IonicContact NH1-OD2 3.19Å; R500-D1191 PolarHBondContact NH1-OD2 2.83Å
501	K	88.2	Confident	90.5	Very high	162 Å²	162	47.7 Å²	47.7	70%	0.704	26%	0.257	S	S	*	.	H	α-helix	trans	-83.4	-41.5	-179.5	-64.4	177.6	179.9	176.3	0	112.8	L498 G499	L498-K501 WeakPolarHBondContact O-CA 3.23Å; L498-K501 WeakPolarHBondContact O-CB 3.48Å; L498-K501 PolarHBondContact O-N 3.22Å; G499-K501 PolarHBondContact O-N 2.89Å
502	E	90.3	Very high	90.4	Very high	107 Å²	107	50.3 Å²	50.3	50%	0.5	27%	0.268	S	S	.	.	H	α-helix	trans	-89.7	-30.4	-172.4	-64.6	-169.3	173.7	0	0	114	L498 D504 L539	L498-E502 HydrophobicContact CD1-CG 4.09Å; L498-E502 WeakPolarHBondContact CD1-OE1 3.34Å; L498-E502 HydrophobicContact CG-CG 4.33Å; L498-E502 PolarHBondContact O-N 3.21Å; E502-D504 VanDerWaalsContact C-N 3.3Å; E502-D504 PolarHBondContact O-N 3.06Å; E502-L539 HydrophobicContact CB-CD2 4.17Å; E502-L539 VanDerWaalsContact OE2-CD2 3.27Å; E502-L539 WeakPolarHBondContact OE2-CD2 3.49Å
503	I	89.5	Confident	90.2	Very high	1 Å²	1	50.5 Å²	50.5	1%	0.005	27%	0.266	C	S	.	.			trans	-78.3	86.2	176.3	-55.6	171.1	0	0	0	108.5	G499 H507 M509 K513 L539 I540	G499-I503 WeakPolarHBondContact O-CB 3.45Å; G499-I503 VanDerWaalsContact O-CG1 3.31Å; G499-I503 WeakPolarHBondContact O-CG1 3.43Å; G499-I503 PolarHBondContact O-N 2.86Å; I503-H507 HydrophobicContact CG2-CB 4.2Å; I503-M509 HydrophobicContact CD1-CB 4.16Å; I503-M509 HydrophobicContact CD1-CG 3.89Å; I503-M509 HydrophobicContact CG1-CB 4.43Å; I503-M509 HydrophobicContact CG2-CB 4.11Å; I503-K513 HydrophobicContact CB-CD 4.18Å; I503-K513 HydrophobicContact CB-CG 4.46Å; I503-K513 HydrophobicContact CD1-CG 4.47Å; I503-K513 HydrophobicContact CG2-CB 4.32Å; I503-K513 HydrophobicContact CG2-CD 3.97Å; I503-K513 HydrophobicContact CG2-CG 4.13Å; I503-K513 PolarHBondContact O-NZ 3.13Å; I503-L539 HydrophobicContact CD1-CB 3.99Å; I503-L539 HydrophobicContact CG1-CB 4.33Å; I503-L539 HydrophobicContact CG1-CD1 4.33Å; I503-I540 HydrophobicContact CD1-CG2 3.7Å
504	D	83.8	Confident	90.2	Very high	96 Å²	96	50.7 Å²	50.7	51%	0.513	27%	0.266	S	S	.	.			trans	-93.4	-174.9	170.5	73.5	4	0	0	0	111.6	E502 G506 H507 Y510	E502-D504 VanDerWaalsContact C-N 3.3Å; E502-D504 PolarHBondContact O-N 3.06Å; D504-G506 PolarHBondContact O-N 2.86Å; D504-G506 WeakPolarHBondContact OD1-CA 3.34Å; D504-G506 PolarHBondContact OD1-N 3.37Å; D504-H507 PolarHBondContact O-N 2.83Å; D504-H507 PolarHBondContact OD1-N 3.23Å; D504-Y510 VanDerWaalsContact C-CD2 3.42Å; D504-Y510 VanDerWaalsContact O-CB 3.23Å; D504-Y510 WeakPolarHBondContact O-CB 3.46Å; D504-Y510 WeakPolarHBondContact O-CD2 3.07Å
505	E	80.3	Confident	90.2	Very high	39 Å²	39	47.1 Å²	47.1	18%	0.182	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-22.7	179.5	-169.4	-178.4	155.3	0	0	113.9	Y510 R1148 R1176	E505-Y510 HydrophobicContact CB-CE1 4.49Å; E505-Y510 HydrophobicContact CB-CE2 4.48Å; E505-Y510 HydrophobicContact CG-CD1 4.42Å; E505-Y510 HydrophobicContact CG-CE1 4.22Å; E505-R1148 IonicContact OE1-CZ 3Å; E505-R1148 IonicContact OE1-NH1 3.62Å; E505-R1148 PolarHBondContact OE1-NH1 3.23Å; E505-R1148 IonicContact OE1-NH2 2.68Å; E505-R1148 PolarHBondContact OE1-NH2 3.46Å; E505-R1148 IonicContact OE2-CZ 2.74Å; E505-R1148 IonicContact OE2-NH1 2.75Å; E505-R1148 IonicContact OE2-NH2 3.86Å; E505-R1148 PolarHBondContact OE2-NH2 3.45Å; E505-R1176 HydrophobicContact CG-CG 4Å; E505-R1176 VanDerWaalsContact OE1-CG 3.25Å; E505-R1176 WeakPolarHBondContact OE1-CG 3.48Å; E505-R1176 IonicContact OE2-NE 3.18Å; E505-R1176 PolarHBondContact OE2-NE 3.23Å
506	G	78.6	Confident	90.1	Very high	51 Å²	51	51.2 Å²	51.2	53%	0.526	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-28.7	177.2	0	0	0	0	0	112.7	D504	D504-G506 PolarHBondContact O-N 2.86Å; D504-G506 WeakPolarHBondContact OD1-CA 3.34Å; D504-G506 PolarHBondContact OD1-N 3.37Å
507	H	87.6	Confident	90	Very high	56 Å²	56	51.2 Å²	51.2	26%	0.259	27%	0.266	S	S	.	.	S	Bend	trans	-69.2	134.9	-177	-165.9	-83.1	0	0	0	112.3	I503 D504 M509 Y510	I503-H507 HydrophobicContact CG2-CB 4.2Å; D504-H507 PolarHBondContact O-N 2.83Å; D504-H507 PolarHBondContact OD1-N 3.23Å; H507-M509 WeakPolarHBondContact ND1-CB 3.26Å; H507-M509 PolarHBondContact ND1-N 3.1Å; H507-M509 PolarHBondContact O-N 3.41Å; H507-M509 VanDerWaalsContact O-N 3.08Å; H507-Y510 VanDerWaalsContact O-CB 3.27Å; H507-Y510 WeakPolarHBondContact O-CB 3.31Å; H507-Y510 PolarHBondContact O-N 3.39Å
508	P	86.3	Confident	90.2	Very high	83 Å²	83	47.3 Å²	47.3	54%	0.539	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-30.2	179.7	-27.5	34.9	0	0	0	114.6	Y510 P511 L530	P508-Y510 VanDerWaalsContact C-N 3.29Å; P508-Y510 PolarHBondContact O-N 3.21Å; P508-P511 WeakPolarHBondContact O-CD 3.42Å; P508-L530 HydrophobicContact CB-CD2 4.28Å
509	M	91.4	Very high	90.3	Very high	2 Å²	2	44.5 Å²	44.5	1%	0.01	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-8.8	178.1	-164.1	54	72.3	0	0	114.6	I503 H507 Y512 K513 L530 Y531 A534 I540	I503-M509 HydrophobicContact CD1-CB 4.16Å; I503-M509 HydrophobicContact CD1-CG 3.89Å; I503-M509 HydrophobicContact CG1-CB 4.43Å; I503-M509 HydrophobicContact CG2-CB 4.11Å; H507-M509 WeakPolarHBondContact ND1-CB 3.26Å; H507-M509 PolarHBondContact ND1-N 3.1Å; H507-M509 PolarHBondContact O-N 3.41Å; H507-M509 VanDerWaalsContact O-N 3.08Å; M509-Y512 CarbonylContact O-C 3.6Å; M509-Y512 PolarHBondContact O-N 3.28Å; M509-Y512 HydrophobicContact SD-CD2 4.18Å; M509-Y512 HydrophobicContact SD-CG 4.41Å; M509-K513 PolarHBondContact O-N 3.47Å; M509-L530 HydrophobicContact CE-CB 3.83Å; M509-L530 WeakPolarHBondContact CE-O 3.36Å; M509-Y531 HydrophobicContact CE-CD1 3.8Å; M509-Y531 HydrophobicContact SD-CD1 3.92Å; M509-Y531 HydrophobicContact SD-CE1 4.24Å; M509-A534 HydrophobicContact CE-CB 3.42Å; M509-A534 VanDerWaalsContact CE-CB 3.42Å; M509-A534 HydrophobicContact CG-CB 4.3Å; M509-I540 HydrophobicContact CE-CD1 4.08Å; M509-I540 HydrophobicContact CG-CG2 4.32Å; M509-I540 HydrophobicContact SD-CD1 4.26Å
510	Y	89.1	Confident	90.4	Very high	23 Å²	23	44.7 Å²	44.7	9%	0.09	23%	0.226	C	C	.	.	G	3₁₀ helix	trans	-51.6	-45.1	-177	-174.2	-105.8	0	0	0	115.1	D504 E505 H507 P508 Y512 K513	D504-Y510 VanDerWaalsContact C-CD2 3.42Å; D504-Y510 VanDerWaalsContact O-CB 3.23Å; D504-Y510 WeakPolarHBondContact O-CB 3.46Å; D504-Y510 WeakPolarHBondContact O-CD2 3.07Å; E505-Y510 HydrophobicContact CB-CE1 4.49Å; E505-Y510 HydrophobicContact CB-CE2 4.48Å; E505-Y510 HydrophobicContact CG-CD1 4.42Å; E505-Y510 HydrophobicContact CG-CE1 4.22Å; H507-Y510 VanDerWaalsContact O-CB 3.27Å; H507-Y510 WeakPolarHBondContact O-CB 3.31Å; H507-Y510 PolarHBondContact O-N 3.39Å; P508-Y510 VanDerWaalsContact C-N 3.29Å; P508-Y510 PolarHBondContact O-N 3.21Å; Y510-Y512 PolarHBondContact O-N 3.27Å; Y510-K513 PolarHBondContact O-N 2.96Å
511	P	90.2	Very high	90.3	Very high	15 Å²	15	48.3 Å²	48.3	10%	0.097	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-65	-20.7	179.6	-16.4	30.9	0	0	0	113.5	P508 P1177 D1180 Y1183	P508-P511 WeakPolarHBondContact O-CD 3.42Å; P511-P1177 HydrophobicContact CG-CB 3.84Å; P511-D1180 PolarHBondContact O-N 3.37Å; P511-Y1183 VanDerWaalsContact O-CD2 3.22Å; P511-Y1183 WeakPolarHBondContact O-CD2 3.33Å; P511-Y1183 WeakPolarHBondContact O-CE2 3.43Å
512	Y	93.4	Very high	90.5	Very high	56 Å²	56	41.9 Å²	41.9	22%	0.22	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-114.7	10.2	-172.7	-43.3	-71	0	0	0	112.7	L493 M509 Y510 Y514 I515 E527 L530 Y531 D1180	L493-Y512 WeakPolarHBondContact CD1-O 3.38Å; M509-Y512 CarbonylContact O-C 3.6Å; M509-Y512 PolarHBondContact O-N 3.28Å; M509-Y512 HydrophobicContact SD-CD2 4.18Å; M509-Y512 HydrophobicContact SD-CG 4.41Å; Y510-Y512 PolarHBondContact O-N 3.27Å; Y512-Y514 PolarHBondContact O-N 3.06Å; Y512-Y514 VanDerWaalsContact O-N 3.1Å; Y512-I515 WeakPolarHBondContact O-CG1 3.39Å; Y512-E527 WeakPolarHBondContact CD1-OE1 3.48Å; Y512-E527 HydrophobicContact CE1-CG 4.36Å; Y512-E527 WeakPolarHBondContact CE1-OE1 3.46Å; Y512-L530 HydrophobicContact CE2-CD1 4.49Å; Y512-Y531 HydrophobicContact CD1-CE1 4.4Å; Y512-Y531 HydrophobicContact CD2-CE1 4.38Å; Y512-Y531 AromaticContact CG-CE1 3.97Å; Y512-Y531 HydrophobicContact CG-CE1 3.97Å; Y512-D1180 HydrophobicContact CD1-CB 3.92Å; Y512-D1180 HydrophobicContact CE1-CB 4.21Å
513	K	92.1	Very high	90.7	Very high	25 Å²	25	36.8 Å²	36.8	11%	0.109	19%	0.188	C	C	.	.	S	Bend	trans	-54.3	-35.6	-172.6	-170.7	175.1	-175.8	166.4	0	113.4	P495 R500 I503 M509 Y510 Y1183	P495-K513 HydrophobicContact CB-CG 4.24Å; P495-K513 VanDerWaalsContact CD-O 3.3Å; P495-K513 WeakPolarHBondContact CD-O 3.47Å; P495-K513 HydrophobicContact CG-CG 4.21Å; R500-K513 PolarHBondContact O-NZ 3.08Å; I503-K513 HydrophobicContact CB-CD 4.18Å; I503-K513 HydrophobicContact CB-CG 4.46Å; I503-K513 HydrophobicContact CD1-CG 4.47Å; I503-K513 HydrophobicContact CG2-CB 4.32Å; I503-K513 HydrophobicContact CG2-CD 3.97Å; I503-K513 HydrophobicContact CG2-CG 4.13Å; I503-K513 PolarHBondContact O-NZ 3.13Å; M509-K513 PolarHBondContact O-N 3.47Å; Y510-K513 PolarHBondContact O-N 2.96Å; K513-Y1183 HydrophobicContact CB-CE2 4.36Å
514	Y	95.6	Very high	90.8	Very high	10 Å²	10	41.2 Å²	41.2	4%	0.039	20%	0.204	C	C	.	.	S	Bend	trans	-131.7	114.8	174	-61.9	-95.4	0	0	0	108.8	P495 Y512 Y1183 D1184 A1187 E1188 D1191	P495-Y514 VanDerWaalsContact CD-CD1 3.46Å; P495-Y514 HydrophobicContact CG-CD1 3.97Å; P495-Y514 HydrophobicContact CG-CD2 4.48Å; P495-Y514 HydrophobicContact CG-CE1 3.34Å; P495-Y514 HydrophobicContact CG-CE2 3.94Å; P495-Y514 HydrophobicContact CG-CG 4.49Å; Y512-Y514 PolarHBondContact O-N 3.06Å; Y512-Y514 VanDerWaalsContact O-N 3.1Å; Y514-Y1183 HydrophobicContact CD2-CE1 4.12Å; Y514-Y1183 AromaticContact CD2-CZ 3.85Å; Y514-Y1183 WeakPolarHBondContact CD2-OH 3.5Å; Y514-Y1183 VanDerWaalsContact O-CA 3.24Å; Y514-Y1183 WeakPolarHBondContact O-CA 2.81Å; Y514-Y1183 VanDerWaalsContact O-CD2 3.29Å; Y514-Y1183 WeakPolarHBondContact O-CD2 3.41Å; Y514-D1184 PolarHBondContact O-N 3.39Å; Y514-A1187 HydrophobicContact CD1-CB 3.92Å; Y514-A1187 HydrophobicContact CE1-CB 4.48Å; Y514-E1188 HydrophobicContact CD1-CB 4.41Å; Y514-E1188 HydrophobicContact CD2-CB 3.8Å; Y514-E1188 HydrophobicContact CD2-CG 4.09Å; Y514-E1188 HydrophobicContact CE1-CB 4.35Å; Y514-E1188 HydrophobicContact CE2-CB 3.72Å; Y514-E1188 HydrophobicContact CE2-CG 3.65Å; Y514-E1188 HydrophobicContact CG-CB 4.16Å; Y514-D1191 HydrophobicContact CE1-CB 4.5Å; Y514-D1191 PolarHBondContact OH-OD2 3Å
515	I	96	Very high	91.1	Very high	4 Å²	4	41.9 Å²	41.9	2%	0.021	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	137.7	178.4	-62.5	-65	0	0	0	108.9	S492 L493 Y512 K518 D1180	S492-I515 CarbonylContact C-O 3.56Å; S492-I515 VanDerWaalsContact CA-O 3.23Å; S492-I515 WeakPolarHBondContact CA-O 3.15Å; S492-I515 WeakPolarHBondContact CB-O 3.46Å; L493-I515 HydrophobicContact CB-CB 3.94Å; L493-I515 HydrophobicContact CB-CG1 4.3Å; L493-I515 HydrophobicContact CD1-CB 4.18Å; L493-I515 HydrophobicContact CD1-CG1 3.83Å; L493-I515 HydrophobicContact CG-CB 3.9Å; L493-I515 HydrophobicContact CG-CG1 4.13Å; L493-I515 PolarHBondContact N-O 3.49Å; L493-I515 PolarHBondContact O-N 3.03Å; L493-I515 VanDerWaalsContact O-N 3.09Å; Y512-I515 WeakPolarHBondContact O-CG1 3.39Å; I515-K518 HydrophobicContact CG2-CB 3.54Å; I515-K518 HydrophobicContact CG2-CD 4.19Å; I515-D1180 HydrophobicContact CD1-CB 3.5Å
516	K	94.8	Very high	91.6	Very high	88 Å²	88	42.1 Å²	42.1	38%	0.383	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	129.2	176.6	179.7	172.1	-179.4	175.4	0	112.1	K518 Y1182 D1184	K516-K518 PolarHBondContact O-N 3.21Å; K516-K518 VanDerWaalsContact O-N 3.14Å; K516-Y1182 PolarHBondContact N-O 3.02Å; K516-D1184 HydrophobicContact CB-CB 3.85Å; K516-D1184 VanDerWaalsContact CD-OD2 3.29Å; K516-D1184 WeakPolarHBondContact CD-OD2 3.49Å
517	D	94.2	Very high	92.3	Very high	32 Å²	32	40 Å²	40	17%	0.171	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	50.3	36.4	172.2	-56.7	-28.1	0	0	0	113.9	S492 P519 R548 C549	S492-D517 PolarHBondContact OG-N 3.3Å; D517-P519 WeakPolarHBondContact O-CD 3.46Å; D517-R548 HydrophobicContact CB-CB 4.36Å; D517-R548 HydrophobicContact CB-CG 4.28Å; D517-C549 WeakPolarHBondContact OD2-CB 3.02Å; D517-C549 PolarHBondContact OD2-N 2.79Å
518	K	95.2	Very high	92.8	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	122.3	177.6	176.5	169.7	178	170.2	0	109.5	T490 I491 I515 K516 I520 E522 L523 E527 D1180 Y1182	T490-K518 CarbonylContact C-O 3.58Å; T490-K518 WeakPolarHBondContact CA-O 3.38Å; I491-K518 HydrophobicContact CG2-CB 3.89Å; I491-K518 HydrophobicContact CG2-CG 4.27Å; I491-K518 WeakPolarHBondContact CG2-O 3.34Å; I491-K518 PolarHBondContact N-O 3.27Å; I491-K518 PolarHBondContact O-N 3.25Å; I515-K518 HydrophobicContact CG2-CB 3.54Å; I515-K518 HydrophobicContact CG2-CD 4.19Å; K516-K518 PolarHBondContact O-N 3.21Å; K516-K518 VanDerWaalsContact O-N 3.14Å; K518-I520 PolarHBondContact O-N 2.84Å; K518-E522 WeakPolarHBondContact CE-O 3.26Å; K518-E522 HydrophobicContact CG-CB 4.42Å; K518-L523 HydrophobicContact CD-CD2 4.26Å; K518-E527 IonicContact NZ-OE1 2.99Å; K518-E527 PolarHBondContact NZ-OE1 2.97Å; K518-E527 IonicContact NZ-OE2 2.65Å; K518-E527 PolarHBondContact NZ-OE2 3.33Å; K518-D1180 IonicContact NZ-OD1 3.2Å; K518-D1180 IonicContact NZ-OD2 3.88Å; K518-D1180 PolarHBondContact NZ-OD2 3.27Å; K518-Y1182 HydrophobicContact CB-CD1 4.24Å; K518-Y1182 HydrophobicContact CB-CD2 4.1Å; K518-Y1182 HydrophobicContact CB-CG 3.8Å; K518-Y1182 HydrophobicContact CD-CD2 4.09Å; K518-Y1182 HydrophobicContact CG-CD2 3.77Å; K518-Y1182 HydrophobicContact CG-CE2 4.24Å; K518-Y1182 HydrophobicContact CG-CG 4.02Å
519	P	94.5	Very high	93.2	Very high	11 Å²	11	33.9 Å²	33.9	7%	0.071	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	137.3	176	-23.5	35.1	0	0	0	111.3	D517 R521 E522 Y1182	D517-P519 WeakPolarHBondContact O-CD 3.46Å; P519-R521 HydrophobicContact CB-CG 3.91Å; P519-R521 PolarHBondContact O-N 2.69Å; P519-R521 VanDerWaalsContact O-N 3.14Å; P519-E522 HydrophobicContact CB-CG 4.31Å; P519-E522 HydrophobicContact CG-CG 4.44Å; P519-E522 WeakPolarHBondContact O-CB 3.4Å; P519-E522 PolarHBondContact O-N 3.43Å; P519-Y1182 VanDerWaalsContact CD-CE1 3.47Å; P519-Y1182 VanDerWaalsContact CD-CZ 3.43Å; P519-Y1182 HydrophobicContact CG-CE1 4.39Å
520	I	94.5	Very high	93.4	Very high	4 Å²	4	34.7 Å²	34.7	2%	0.021	15%	0.147	C	C	.	.	G	3₁₀ helix	trans	-59.4	-30.5	-178.5	61.3	168.6	0	0	0	112.7	L215 T486 A489 K518 E522 L523 L544 I600 L604	L215-I520 HydrophobicContact CB-CD1 4.5Å; T486-I520 HydrophobicContact CG2-CD1 4.4Å; A489-I520 HydrophobicContact CB-CD1 3.71Å; A489-I520 HydrophobicContact CB-CG1 3.99Å; A489-I520 HydrophobicContact CB-CG2 4.04Å; A489-I520 PolarHBondContact O-N 3.1Å; A489-I520 VanDerWaalsContact O-N 3.14Å; K518-I520 PolarHBondContact O-N 2.84Å; I520-E522 PolarHBondContact O-N 3.09Å; I520-E522 VanDerWaalsContact O-N 3.15Å; I520-L523 HydrophobicContact CB-CD1 4.24Å; I520-L523 HydrophobicContact CG2-CD1 4.4Å; I520-L523 VanDerWaalsContact O-CB 3.26Å; I520-L523 WeakPolarHBondContact O-CB 3.31Å; I520-L523 WeakPolarHBondContact O-CG 3.46Å; I520-L523 PolarHBondContact O-N 3.45Å; I520-L544 HydrophobicContact CG2-CD1 4.32Å; I520-I600 HydrophobicContact CD1-CD1 4.1Å; I520-I600 HydrophobicContact CD1-CG2 3.83Å; I520-L604 HydrophobicContact CB-CD1 4.24Å; I520-L604 HydrophobicContact CB-CD2 4.4Å; I520-L604 HydrophobicContact CG2-CD1 4.01Å
521	R	90.8	Very high	93.8	Very high	150 Å²	150	33.6 Å²	33.6	57%	0.566	14%	0.143	S	C	*	.	G	3₁₀ helix	trans	-63.4	-15	173.2	71.4	179.4	-167.8	178.7	1.8	115.4	L215 R217 P519	L215-R521 WeakPolarHBondContact O-CA 3.32Å; L215-R521 PolarHBondContact O-N 2.8Å; R217-R521 WeakPolarHBondContact CG-O 3.45Å; P519-R521 HydrophobicContact CB-CG 3.91Å; P519-R521 PolarHBondContact O-N 2.69Å; P519-R521 VanDerWaalsContact O-N 3.14Å
522	E	92.4	Very high	94.1	Very high	26 Å²	26	34.1 Å²	34.1	12%	0.121	15%	0.146	C	C	.	.	G	3₁₀ helix	trans	-97.1	-3.4	176	-68.3	-69.1	151.6	0	0	112.2	R217 K518 P519 I520 R524 Y1182	R217-E522 IonicContact CZ-OE1 2.78Å; R217-E522 IonicContact CZ-OE2 2.72Å; R217-E522 IonicContact NH1-OE1 3.32Å; R217-E522 PolarHBondContact NH1-OE1 3.48Å; R217-E522 IonicContact NH1-OE2 3.03Å; R217-E522 PolarHBondContact NH1-OE2 2.8Å; R217-E522 IonicContact NH2-OE1 2.7Å; R217-E522 PolarHBondContact NH2-OE1 3.04Å; R217-E522 IonicContact NH2-OE2 2.7Å; K518-E522 WeakPolarHBondContact CE-O 3.26Å; K518-E522 HydrophobicContact CG-CB 4.42Å; P519-E522 HydrophobicContact CB-CG 4.31Å; P519-E522 HydrophobicContact CG-CG 4.44Å; P519-E522 WeakPolarHBondContact O-CB 3.4Å; P519-E522 PolarHBondContact O-N 3.43Å; I520-E522 PolarHBondContact O-N 3.09Å; I520-E522 VanDerWaalsContact O-N 3.15Å; E522-R524 PolarHBondContact O-NH1 3.22Å; E522-R524 IonicContact OE2-CZ 3.95Å; E522-R524 IonicContact OE2-NH1 2.81Å; E522-R524 IonicContact OE2-NH2 2.89Å; E522-R524 PolarHBondContact OE2-NH2 2.76Å; E522-Y1182 HydrophobicContact CB-CE2 4.33Å; E522-Y1182 HydrophobicContact CG-CE2 4.28Å
523	L	93.8	Very high	94.1	Very high	1 Å²	1	33.6 Å²	33.6	1%	0.005	15%	0.145	C	C	.	.			trans	-65.1	138.7	169.4	-66.2	169.2	0	0	0	109.3	R217 I491 K518 I520 E527 Y528 Y531 L604	R217-L523 PolarHBondContact N-O 2.84Å; I491-L523 HydrophobicContact CG2-CD1 4.48Å; I491-L523 HydrophobicContact CG2-CD2 4.17Å; K518-L523 HydrophobicContact CD-CD2 4.26Å; I520-L523 HydrophobicContact CB-CD1 4.24Å; I520-L523 HydrophobicContact CG2-CD1 4.4Å; I520-L523 VanDerWaalsContact O-CB 3.26Å; I520-L523 WeakPolarHBondContact O-CB 3.31Å; I520-L523 WeakPolarHBondContact O-CG 3.46Å; I520-L523 PolarHBondContact O-N 3.45Å; L523-E527 WeakPolarHBondContact CA-OE2 3.49Å; L523-E527 HydrophobicContact CD2-CG 4.09Å; L523-Y528 HydrophobicContact CD1-CD2 4.11Å; L523-Y531 HydrophobicContact CD2-CD2 4.46Å; L523-Y531 HydrophobicContact CD2-CE2 3.53Å; L523-L604 HydrophobicContact CD1-CD1 3.95Å; L523-L604 HydrophobicContact CD1-CD2 4.05Å
524	R	91.4	Very high	94.3	Very high	93 Å²	93	32.5 Å²	32.5	35%	0.351	14%	0.141	S	C	.	.	B	Isolated β-bridge	trans	-122.5	135.1	-174.5	-66.4	176.7	-179.4	75.3	5.3	110.9	R217 E522 D526 E527	R217-R524 HydrophobicContact CB-CG 4.26Å; R217-R524 WeakPolarHBondContact O-CA 3.33Å; E522-R524 PolarHBondContact O-NH1 3.22Å; E522-R524 IonicContact OE2-CZ 3.95Å; E522-R524 IonicContact OE2-NH1 2.81Å; E522-R524 IonicContact OE2-NH2 2.89Å; E522-R524 PolarHBondContact OE2-NH2 2.76Å; R524-D526 PolarHBondContact O-N 3.36Å; R524-E527 PolarHBondContact N-OE2 3.25Å; R524-E527 WeakPolarHBondContact O-CB 3.38Å; R524-E527 PolarHBondContact O-N 2.94Å
525	R	90.7	Very high	94.3	Very high	110 Å²	110	34.7 Å²	34.7	42%	0.415	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.4	-125.1	164.6	-57.3	175.6	179.8	153.7	-0.7	112	R217 Q218 D220 E527 F611	R217-R525 PolarHBondContact O-N 2.85Å; R217-R525 VanDerWaalsContact O-N 3.13Å; Q218-R525 PolarHBondContact NE2-O 2.68Å; Q218-R525 PolarHBondContact OE1-O 3.09Å; D220-R525 IonicContact OD1-CZ 2.83Å; D220-R525 VanDerWaalsContact OD1-CZ 3.26Å; D220-R525 IonicContact OD1-NE 3.35Å; D220-R525 PolarHBondContact OD1-NE 3.02Å; D220-R525 IonicContact OD1-NH2 3.32Å; D220-R525 PolarHBondContact OD1-NH2 3.44Å; R525-E527 VanDerWaalsContact C-N 3.32Å; R525-F611 HydrophobicContact CB-CD1 3.81Å; R525-F611 HydrophobicContact CB-CD2 4.12Å; R525-F611 HydrophobicContact CB-CE1 3.62Å; R525-F611 HydrophobicContact CB-CE2 3.93Å; R525-F611 HydrophobicContact CB-CG 4.07Å; R525-F611 HydrophobicContact CB-CZ 3.68Å; R525-F611 HydrophobicContact CG-CD2 4.19Å; R525-F611 HydrophobicContact CG-CE1 4.14Å; R525-F611 HydrophobicContact CG-CE2 3.68Å; R525-F611 HydrophobicContact CG-CZ 3.66Å
526	D	90.9	Very high	94.2	Very high	45 Å²	45	39.4 Å²	39.4	24%	0.241	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.9	3.8	179.8	56.8	-20.8	0	0	0	114.4	R524 Y528 L529 L530 F611 V612 L827	R524-D526 PolarHBondContact O-N 3.36Å; D526-Y528 PolarHBondContact O-N 2.92Å; D526-L529 WeakPolarHBondContact O-CB 3.3Å; D526-L529 PolarHBondContact O-N 3.46Å; D526-L529 VanDerWaalsContact O-N 3.1Å; D526-L530 PolarHBondContact O-N 3.46Å; D526-F611 HydrophobicContact CB-CD1 4.09Å; D526-F611 HydrophobicContact CB-CE1 4.45Å; D526-V612 HydrophobicContact CB-CG2 3.74Å; D526-L827 HydrophobicContact CB-CD1 4.03Å
527	E	94.1	Very high	94.2	Very high	5 Å²	5	39 Å²	39	2%	0.023	18%	0.179	C	C	.	.	H	α-helix	trans	-56.8	-44.7	-175.2	178.2	170.5	-156.1	0	0	113.2	Y512 K518 L523 R524 R525 L529 L530 Y531	Y512-E527 WeakPolarHBondContact CD1-OE1 3.48Å; Y512-E527 HydrophobicContact CE1-CG 4.36Å; Y512-E527 WeakPolarHBondContact CE1-OE1 3.46Å; K518-E527 IonicContact NZ-OE1 2.99Å; K518-E527 PolarHBondContact NZ-OE1 2.97Å; K518-E527 IonicContact NZ-OE2 2.65Å; K518-E527 PolarHBondContact NZ-OE2 3.33Å; L523-E527 WeakPolarHBondContact CA-OE2 3.49Å; L523-E527 HydrophobicContact CD2-CG 4.09Å; R524-E527 PolarHBondContact N-OE2 3.25Å; R524-E527 WeakPolarHBondContact O-CB 3.38Å; R524-E527 PolarHBondContact O-N 2.94Å; R525-E527 VanDerWaalsContact C-N 3.32Å; E527-L529 VanDerWaalsContact C-N 3.33Å; E527-L529 PolarHBondContact O-N 3.44Å; E527-L530 WeakPolarHBondContact O-CB 3.4Å; E527-L530 PolarHBondContact O-N 3.39Å; E527-Y531 HydrophobicContact CG-CD1 4.42Å; E527-Y531 HydrophobicContact CG-CE1 3.53Å; E527-Y531 HydrophobicContact CG-CE2 4.18Å; E527-Y531 VanDerWaalsContact CG-CZ 3.41Å; E527-Y531 WeakPolarHBondContact CG-OH 3.21Å; E527-Y531 WeakPolarHBondContact O-CD1 3.49Å; E527-Y531 WeakPolarHBondContact O-CE1 3.42Å; E527-Y531 PolarHBondContact O-N 3.01Å; E527-Y531 PolarHBondContact OE1-OH 2.87Å
528	Y	96.8	Very high	94.3	Very high	9 Å²	9	46.7 Å²	46.7	4%	0.035	21%	0.205	C	C	.	.	H	α-helix	trans	-68.2	-34.8	179.4	-173	-107.7	0	0	0	112.2	I491 L523 D526 L530 Y531 V532 R601 L604 L605	I491-Y528 HydrophobicContact CD1-CD2 3.92Å; I491-Y528 HydrophobicContact CD1-CE2 3.74Å; L523-Y528 HydrophobicContact CD1-CD2 4.11Å; D526-Y528 PolarHBondContact O-N 2.92Å; Y528-L530 VanDerWaalsContact C-N 3.31Å; Y528-L530 PolarHBondContact O-N 3.14Å; Y528-Y531 HydrophobicContact CD2-CD2 4.04Å; Y528-Y531 WeakPolarHBondContact O-CB 3.36Å; Y528-Y531 PolarHBondContact O-N 3.39Å; Y528-Y531 VanDerWaalsContact O-N 3.1Å; Y528-V532 HydrophobicContact CD1-CG2 4.22Å; Y528-V532 HydrophobicContact CE1-CG2 3.84Å; Y528-V532 WeakPolarHBondContact O-CG2 3.36Å; Y528-V532 PolarHBondContact O-N 2.94Å; Y528-R601 WeakPolarHBondContact OH-CG 3.18Å; Y528-L604 HydrophobicContact CD1-CB 3.46Å; Y528-L604 VanDerWaalsContact CD1-CB 3.46Å; Y528-L604 WeakPolarHBondContact CD1-O 3.25Å; Y528-L604 HydrophobicContact CD2-CB 4.23Å; Y528-L604 HydrophobicContact CD2-CD1 4.18Å; Y528-L604 HydrophobicContact CE1-CB 3.51Å; Y528-L604 HydrophobicContact CE2-CB 4.29Å; Y528-L604 HydrophobicContact CE2-CD1 4.03Å; Y528-L604 HydrophobicContact CG-CB 3.83Å; Y528-L605 HydrophobicContact CD1-CB 4.41Å; Y528-L605 HydrophobicContact CE1-CB 4.06Å
529	L	96.1	Very high	94.4	Very high	2 Å²	2	46.9 Å²	46.9	1%	0.01	21%	0.206	C	C	.	.	H	α-helix	trans	-65.3	-36.9	175.8	-174.7	60.5	0	0	0	111.4	D526 E527 Y531 V532 Q533 L605 A608 Q609 V612 L827 V831	D526-L529 WeakPolarHBondContact O-CB 3.3Å; D526-L529 PolarHBondContact O-N 3.46Å; D526-L529 VanDerWaalsContact O-N 3.1Å; E527-L529 VanDerWaalsContact C-N 3.33Å; E527-L529 PolarHBondContact O-N 3.44Å; L529-Y531 VanDerWaalsContact C-N 3.29Å; L529-Y531 PolarHBondContact O-N 3.28Å; L529-V532 PolarHBondContact O-N 3.16Å; L529-Q533 WeakPolarHBondContact O-CB 3.39Å; L529-Q533 PolarHBondContact O-N 2.63Å; L529-L605 HydrophobicContact CD1-CD1 3.73Å; L529-A608 HydrophobicContact CB-CB 3.88Å; L529-Q609 HydrophobicContact CD1-CG 4.08Å; L529-Q609 HydrophobicContact CD2-CG 4.38Å; L529-V612 HydrophobicContact CD2-CB 4.44Å; L529-V612 HydrophobicContact CD2-CG2 3.81Å; L529-L827 HydrophobicContact CD2-CB 4.25Å; L529-L827 HydrophobicContact CD2-CD1 4.27Å; L529-V831 HydrophobicContact CD2-CG1 4.37Å
530	L	95.1	Very high	94.5	Very high	20 Å²	20	46.5 Å²	46.5	11%	0.105	20%	0.204	C	C	.	.	H	α-helix	trans	-60.3	-40.4	171.1	-68.6	172.9	0	0	0	111.4	P508 M509 Y512 D526 E527 Y528 Q533 A534 L827	P508-L530 HydrophobicContact CB-CD2 4.28Å; M509-L530 HydrophobicContact CE-CB 3.83Å; M509-L530 WeakPolarHBondContact CE-O 3.36Å; Y512-L530 HydrophobicContact CE2-CD1 4.49Å; D526-L530 PolarHBondContact O-N 3.46Å; E527-L530 WeakPolarHBondContact O-CB 3.4Å; E527-L530 PolarHBondContact O-N 3.39Å; Y528-L530 VanDerWaalsContact C-N 3.31Å; Y528-L530 PolarHBondContact O-N 3.14Å; L530-Q533 PolarHBondContact O-N 2.92Å; L530-A534 WeakPolarHBondContact O-CB 3.34Å; L530-A534 PolarHBondContact O-N 3.06Å; L530-L827 HydrophobicContact CD2-CD1 3.77Å; L530-L827 HydrophobicContact CD2-CD2 3.91Å; L530-L827 HydrophobicContact CD2-CG 4.39Å; L530-L827 HydrophobicContact CG-CD1 4.15Å
531	Y	96.5	Very high	94.6	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-63.2	-46.2	179.3	-59.4	-7.6	0	0	0	111.1	I491 L493 M509 Y512 L523 E527 Y528 L529 A534 E535	I491-Y531 HydrophobicContact CD1-CD2 3.71Å; I491-Y531 HydrophobicContact CD1-CE2 3.94Å; I491-Y531 HydrophobicContact CG2-CE2 4.46Å; L493-Y531 HydrophobicContact CD1-CD1 3.68Å; L493-Y531 HydrophobicContact CD1-CD2 4Å; L493-Y531 HydrophobicContact CD1-CE1 3.53Å; L493-Y531 HydrophobicContact CD1-CE2 3.8Å; L493-Y531 HydrophobicContact CD1-CG 3.93Å; L493-Y531 HydrophobicContact CD2-CD2 4.02Å; L493-Y531 HydrophobicContact CD2-CE2 4.32Å; L493-Y531 HydrophobicContact CD2-CG 4.25Å; L493-Y531 HydrophobicContact CG-CD2 4.49Å; L493-Y531 HydrophobicContact CG-CE2 4.36Å; M509-Y531 HydrophobicContact CE-CD1 3.8Å; M509-Y531 HydrophobicContact SD-CD1 3.92Å; M509-Y531 HydrophobicContact SD-CE1 4.24Å; Y512-Y531 HydrophobicContact CD1-CE1 4.4Å; Y512-Y531 HydrophobicContact CD2-CE1 4.38Å; Y512-Y531 AromaticContact CG-CE1 3.97Å; Y512-Y531 HydrophobicContact CG-CE1 3.97Å; L523-Y531 HydrophobicContact CD2-CD2 4.46Å; L523-Y531 HydrophobicContact CD2-CE2 3.53Å; E527-Y531 HydrophobicContact CG-CD1 4.42Å; E527-Y531 HydrophobicContact CG-CE1 3.53Å; E527-Y531 HydrophobicContact CG-CE2 4.18Å; E527-Y531 VanDerWaalsContact CG-CZ 3.41Å; E527-Y531 WeakPolarHBondContact CG-OH 3.21Å; E527-Y531 WeakPolarHBondContact O-CD1 3.49Å; E527-Y531 WeakPolarHBondContact O-CE1 3.42Å; E527-Y531 PolarHBondContact O-N 3.01Å; E527-Y531 PolarHBondContact OE1-OH 2.87Å; Y528-Y531 HydrophobicContact CD2-CD2 4.04Å; Y528-Y531 WeakPolarHBondContact O-CB 3.36Å; Y528-Y531 PolarHBondContact O-N 3.39Å; Y528-Y531 VanDerWaalsContact O-N 3.1Å; L529-Y531 VanDerWaalsContact C-N 3.29Å; L529-Y531 PolarHBondContact O-N 3.28Å; Y531-A534 PolarHBondContact O-N 3.03Å; Y531-E535 WeakPolarHBondContact O-CB 3.29Å; Y531-E535 PolarHBondContact O-N 3.14Å
532	V	96.1	Very high	94.9	Very high	26 Å²	26	42.8 Å²	42.8	16%	0.158	20%	0.198	C	C	.	.	H	α-helix	trans	-59.8	-48.2	176.8	174.3	0	0	0	0	110.4	Y528 L529 A534 E535 D536 L605	Y528-V532 HydrophobicContact CD1-CG2 4.22Å; Y528-V532 HydrophobicContact CE1-CG2 3.84Å; Y528-V532 WeakPolarHBondContact O-CG2 3.36Å; Y528-V532 PolarHBondContact O-N 2.94Å; L529-V532 PolarHBondContact O-N 3.16Å; V532-A534 VanDerWaalsContact C-N 3.32Å; V532-A534 PolarHBondContact O-N 3.05Å; V532-E535 PolarHBondContact O-N 3.12Å; V532-E535 VanDerWaalsContact O-N 3.13Å; V532-D536 PolarHBondContact O-N 3.29Å; V532-L605 HydrophobicContact CG2-CD1 4.33Å
533	Q	94.6	Very high	95	Very high	44 Å²	44	44.1 Å²	44.1	21%	0.206	21%	0.208	C	C	.	.	H	α-helix	trans	-55.6	-45.6	175.7	175.8	-178.7	22.6	0	0	112.5	L529 L530 N537 Y830	L529-Q533 WeakPolarHBondContact O-CB 3.39Å; L529-Q533 PolarHBondContact O-N 2.63Å; L530-Q533 PolarHBondContact O-N 2.92Å; Q533-N537 WeakPolarHBondContact O-CB 3.46Å; Q533-N537 VanDerWaalsContact O-CG 3.23Å; Q533-N537 PolarHBondContact O-N 3.48Å; Q533-N537 PolarHBondContact O-ND2 2.68Å; Q533-Y830 HydrophobicContact CB-CD1 4.48Å; Q533-Y830 HydrophobicContact CB-CE1 4.18Å; Q533-Y830 HydrophobicContact CG-CE1 3.9Å; Q533-Y830 HydrophobicContact CG-CE2 4Å; Q533-Y830 VanDerWaalsContact NE2-CE2 3.31Å; Q533-Y830 PolarHBondContact NE2-OH 2.71Å
534	A	95.2	Very high	95	Very high	2 Å²	2	44.3 Å²	44.3	2%	0.017	21%	0.209	C	C	.	.	H	α-helix	trans	-72.1	-29.4	-179.6	0	0	0	0	0	112.7	M509 L530 Y531 V532 R538 L539 I540	M509-A534 HydrophobicContact CE-CB 3.42Å; M509-A534 VanDerWaalsContact CE-CB 3.42Å; M509-A534 HydrophobicContact CG-CB 4.3Å; L530-A534 WeakPolarHBondContact O-CB 3.34Å; L530-A534 PolarHBondContact O-N 3.06Å; Y531-A534 PolarHBondContact O-N 3.03Å; V532-A534 VanDerWaalsContact C-N 3.32Å; V532-A534 PolarHBondContact O-N 3.05Å; A534-R538 PolarHBondContact O-N 3.18Å; A534-L539 HydrophobicContact CB-CB 4.34Å; A534-L539 WeakPolarHBondContact O-CB 3.27Å; A534-L539 PolarHBondContact O-N 2.9Å; A534-I540 HydrophobicContact CB-CD1 3.73Å; A534-I540 HydrophobicContact CB-CG1 3.72Å; A534-I540 HydrophobicContact CB-CG2 4.39Å; A534-I540 PolarHBondContact O-N 3.2Å
535	E	96	Very high	94.9	Very high	56 Å²	56	46.5 Å²	46.5	26%	0.262	22%	0.221	S	C	.	.	H	α-helix	trans	-68.9	-45.5	172.7	-177.7	159.9	-118.6	0	0	111	Y531 V532 N537 R538 I540 V542 R601	Y531-E535 WeakPolarHBondContact O-CB 3.29Å; Y531-E535 PolarHBondContact O-N 3.14Å; V532-E535 PolarHBondContact O-N 3.12Å; V532-E535 VanDerWaalsContact O-N 3.13Å; E535-N537 VanDerWaalsContact C-N 3.3Å; E535-N537 PolarHBondContact O-N 3.27Å; E535-R538 VanDerWaalsContact O-CA 3.32Å; E535-R538 WeakPolarHBondContact O-CA 3.44Å; E535-R538 PolarHBondContact O-N 2.74Å; E535-I540 HydrophobicContact CB-CG1 4.44Å; E535-V542 HydrophobicContact CB-CG2 3.98Å; E535-V542 HydrophobicContact CG-CG2 4.33Å; E535-V542 WeakPolarHBondContact OE1-CB 3.34Å; E535-V542 PolarHBondContact OE1-N 3.04Å; E535-R601 IonicContact OE2-NH1 3.91Å; E535-R601 PolarHBondContact OE2-NH1 3.38Å
536	D	95.3	Very high	94.7	Very high	104 Å²	104	42.7 Å²	42.7	56%	0.556	21%	0.209	S	C	*	.	H	α-helix	trans	-61.7	-39.4	175.6	-71.3	-20.3	0	0	0	111.7	V532 R538	V532-D536 PolarHBondContact O-N 3.29Å; D536-R538 PolarHBondContact O-N 2.96Å
537	N	94.9	Very high	94.1	Very high	78 Å²	78	41 Å²	41	42%	0.417	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.1	3.7	172.7	-67.5	-16.9	0	0	0	113.3	Q533 E535 L539	Q533-N537 WeakPolarHBondContact O-CB 3.46Å; Q533-N537 VanDerWaalsContact O-CG 3.23Å; Q533-N537 PolarHBondContact O-N 3.48Å; Q533-N537 PolarHBondContact O-ND2 2.68Å; E535-N537 VanDerWaalsContact C-N 3.3Å; E535-N537 PolarHBondContact O-N 3.27Å; N537-L539 HydrophobicContact CB-CD1 4.18Å; N537-L539 HydrophobicContact CB-CG 3.95Å; N537-L539 PolarHBondContact O-N 3.47Å
538	R	96.1	Very high	93.4	Very high	194 Å²	194	46.1 Å²	46.1	73%	0.732	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.9	26.7	177.9	-51.8	178.1	-177.6	175.7	0	113.9	T496 A534 E535 D536	T496-R538 WeakPolarHBondContact CB-O 3.16Å; T496-R538 VanDerWaalsContact CG2-O 3.3Å; T496-R538 WeakPolarHBondContact CG2-O 3.23Å; T496-R538 PolarHBondContact OG1-O 2.89Å; A534-R538 PolarHBondContact O-N 3.18Å; E535-R538 VanDerWaalsContact O-CA 3.32Å; E535-R538 WeakPolarHBondContact O-CA 3.44Å; E535-R538 PolarHBondContact O-N 2.74Å; D536-R538 PolarHBondContact O-N 2.96Å
539	L	96	Very high	92.2	Very high	4 Å²	4	50.3 Å²	50.3	2%	0.021	25%	0.25	C	S	.	.	S	Bend	trans	-84	-33.8	177.8	-55.2	-179.9	0	0	0	111.3	P495 T496 L498 G499 E502 I503 A534 N537	P495-L539 WeakPolarHBondContact CA-O 3.4Å; T496-L539 PolarHBondContact N-O 3.4Å; T496-L539 PolarHBondContact OG1-O 2.65Å; L498-L539 HydrophobicContact CD2-CD2 4.12Å; L498-L539 HydrophobicContact CG-CD2 4.01Å; G499-L539 VanDerWaalsContact CA-O 3.27Å; G499-L539 WeakPolarHBondContact CA-O 3.27Å; E502-L539 HydrophobicContact CB-CD2 4.17Å; E502-L539 VanDerWaalsContact OE2-CD2 3.27Å; E502-L539 WeakPolarHBondContact OE2-CD2 3.49Å; I503-L539 HydrophobicContact CD1-CB 3.99Å; I503-L539 HydrophobicContact CG1-CB 4.33Å; I503-L539 HydrophobicContact CG1-CD1 4.33Å; A534-L539 HydrophobicContact CB-CB 4.34Å; A534-L539 WeakPolarHBondContact O-CB 3.27Å; A534-L539 PolarHBondContact O-N 2.9Å; N537-L539 HydrophobicContact CB-CD1 4.18Å; N537-L539 HydrophobicContact CB-CG 3.95Å; N537-L539 PolarHBondContact O-N 3.47Å
540	I	97	Very high	91	Very high	3 Å²	3	54.1 Å²	54.1	2%	0.015	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	169.5	179.9	68.9	176	0	0	0	111.5	L493 H494 I503 M509 A534 E535 V542	L493-I540 HydrophobicContact CD1-CD1 4.22Å; L493-I540 HydrophobicContact CD2-CD1 4.13Å; H494-I540 CarbonylContact O-C 3.52Å; H494-I540 WeakPolarHBondContact O-CA 3.26Å; I503-I540 HydrophobicContact CD1-CG2 3.7Å; M509-I540 HydrophobicContact CE-CD1 4.08Å; M509-I540 HydrophobicContact CG-CG2 4.32Å; M509-I540 HydrophobicContact SD-CD1 4.26Å; A534-I540 HydrophobicContact CB-CD1 3.73Å; A534-I540 HydrophobicContact CB-CG1 3.72Å; A534-I540 HydrophobicContact CB-CG2 4.39Å; A534-I540 PolarHBondContact O-N 3.2Å; E535-I540 HydrophobicContact CB-CG1 4.44Å; I540-V542 HydrophobicContact CD1-CG2 4.02Å; I540-V542 HydrophobicContact CG1-CG2 4.26Å
541	T	97	Very high	90.3	Very high	70 Å²	70	58.1 Å²	58.1	43%	0.429	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	125.5	168.9	-57.5	0	0	0	0	108.3	H494 T543	H494-T541 PolarHBondContact N-O 3.3Å; H494-T541 PolarHBondContact O-N 3.41Å; T541-T543 HydrophobicContact CG2-CG2 4.39Å
542	V	96.1	Very high	89.5	Confident	6 Å²	6	62.9 Å²	62.9	4%	0.036	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	119.5	-178.1	-176.2	0	0	0	0	109.1	I491 L493 E535 I540 R601	I491-V542 HydrophobicContact CD1-CG1 3.65Å; I491-V542 HydrophobicContact CG1-CG1 3.87Å; L493-V542 HydrophobicContact CD2-CB 4.08Å; L493-V542 HydrophobicContact CD2-CG1 3.91Å; L493-V542 HydrophobicContact CD2-CG2 3.71Å; E535-V542 HydrophobicContact CB-CG2 3.98Å; E535-V542 HydrophobicContact CG-CG2 4.33Å; E535-V542 WeakPolarHBondContact OE1-CB 3.34Å; E535-V542 PolarHBondContact OE1-N 3.04Å; I540-V542 HydrophobicContact CD1-CG2 4.02Å; I540-V542 HydrophobicContact CG1-CG2 4.26Å; V542-R601 PolarHBondContact O-NH2 3.37Å
543	T	94.7	Very high	89.1	Confident	55 Å²	55	63 Å²	63	34%	0.337	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	127.9	176.7	57.1	0	0	0	0	110.3	I491 S492 T541	I491-T543 WeakPolarHBondContact CA-O 3.4Å; S492-T543 PolarHBondContact N-O 3.05Å; S492-T543 PolarHBondContact O-N 2.95Å; S492-T543 PolarHBondContact O-OG1 3.28Å; S492-T543 VanDerWaalsContact O-OG1 3.12Å; T541-T543 HydrophobicContact CG2-CG2 4.39Å
544	L	93.6	Very high	88.8	Confident	5 Å²	5	61.3 Å²	61.3	3%	0.026	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	126.9	176.9	-162.9	152.7	0	0	0	108.4	Y485 A489 T490 I520 E597 I600 R601 L604	Y485-L544 HydrophobicContact CE1-CD2 3.77Å; Y485-L544 WeakPolarHBondContact OH-CD2 3.34Å; A489-L544 HydrophobicContact CB-CD2 4.13Å; T490-L544 WeakPolarHBondContact O-CA 3.45Å; I520-L544 HydrophobicContact CG2-CD1 4.32Å; L544-E597 HydrophobicContact CB-CG 4.13Å; L544-E597 HydrophobicContact CD2-CG 4.27Å; L544-I600 HydrophobicContact CD1-CG2 3.72Å; L544-I600 HydrophobicContact CD2-CG2 4.48Å; L544-R601 HydrophobicContact CD1-CG 4.39Å; L544-L604 HydrophobicContact CD1-CD1 4.24Å
545	K	90.1	Very high	88.7	Confident	138 Å²	138	61.8 Å²	61.8	60%	0.6	32%	0.324	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-141	158.4	-176.5	-65.8	-176.1	-178.9	177.9	0	110.8	A489 T490	A489-K545 WeakPolarHBondContact CA-O 3.36Å; T490-K545 PolarHBondContact N-O 2.92Å; T490-K545 PolarHBondContact O-N 3.38Å
546	M	86.7	Confident	88.4	Confident	31 Å²	31	63.3 Å²	63.3	15%	0.153	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	127.7	172.2	-171.2	-179.8	-173.6	0	0	110.5	E484 Y485 R488 Y554 Y593	E484-M546 VanDerWaalsContact C-CE 3.47Å; E484-M546 HydrophobicContact CB-CE 3.76Å; E484-M546 WeakPolarHBondContact O-CE 3.37Å; Y485-M546 HydrophobicContact CD2-CB 3.78Å; Y485-M546 HydrophobicContact CD2-CG 4.11Å; Y485-M546 HydrophobicContact CD2-SD 3.84Å; Y485-M546 HydrophobicContact CE2-CB 3.79Å; Y485-M546 HydrophobicContact CG-SD 4.43Å; R488-M546 HydrophobicContact CB-CE 4.26Å; R488-M546 HydrophobicContact CB-CG 4.03Å; R488-M546 HydrophobicContact CG-CE 4.37Å; M546-Y554 HydrophobicContact CE-CD1 4.47Å; M546-Y554 HydrophobicContact CE-CD2 4.47Å; M546-Y554 HydrophobicContact CE-CG 3.88Å; M546-Y593 HydrophobicContact SD-CE1 3.78Å
547	G	78.5	Confident	88.1	Confident	10 Å²	10	60.5 Å²	60.5	10%	0.103	32%	0.315	C	S	.	.	S	Bend	trans	84.4	170	179	0	0	0	0	0	113.6	R488 T490	R488-G547 PolarHBondContact O-N 3.19Å; T490-G547 PolarHBondContact OG1-O 3.36Å
548	R	79.6	Confident	88	Confident	112 Å²	112	56.8 Å²	56.8	42%	0.423	30%	0.295	S	S	.	.			trans	-96.9	161.4	176.5	-59.6	177.7	175	171.1	1.3	111.4	T490 D517 G550 E551	T490-R548 HydrophobicContact CG2-CG 4.1Å; D517-R548 HydrophobicContact CB-CB 4.36Å; D517-R548 HydrophobicContact CB-CG 4.28Å; R548-G550 PolarHBondContact O-N 3.06Å; R548-G550 VanDerWaalsContact O-N 3.12Å; R548-E551 HydrophobicContact CB-CG 4.15Å; R548-E551 PolarHBondContact N-OE2 2.56Å; R548-E551 WeakPolarHBondContact O-CB 3.4Å; R548-E551 PolarHBondContact O-N 3.21Å
549	C	70	Confident	87.7	Confident	96 Å²	96	51.5 Å²	51.5	65%	0.649	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	120	173.9	-171.3	0	0	0	0	111.3	D517	D517-C549 WeakPolarHBondContact OD2-CB 3.02Å; D517-C549 PolarHBondContact OD2-N 2.79Å
550	G	71.8	Confident	87.4	Confident	82 Å²	82	56.8 Å²	56.8	85%	0.845	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	96.8	-11.7	-178.6	0	0	0	0	0	114.7	R548	R548-G550 PolarHBondContact O-N 3.06Å; R548-G550 VanDerWaalsContact O-N 3.12Å
551	E	79.9	Confident	87.1	Confident	104 Å²	104	60.6 Å²	60.6	49%	0.486	32%	0.318	S	S	.	.	S	Bend	trans	-77.8	149.5	169.3	-66.7	176.3	175.4	0	0	110.4	R548	R548-E551 HydrophobicContact CB-CG 4.15Å; R548-E551 PolarHBondContact N-OE2 2.56Å; R548-E551 WeakPolarHBondContact O-CB 3.4Å; R548-E551 PolarHBondContact O-N 3.21Å
552	K	81.1	Confident	86.8	Confident	101 Å²	101	60.2 Å²	60.2	44%	0.439	31%	0.311	S	S	.	.	P	Polyproline II helix	trans	-72.7	145	174.2	-62.9	-177.7	-172	-177.2	0	109	Q556 E560	K552-Q556 HydrophobicContact CB-CB 4.17Å; K552-E560 WeakPolarHBondContact CD-OE1 3.38Å; K552-E560 WeakPolarHBondContact CE-OE1 3.27Å; K552-E560 IonicContact NZ-OE1 2.72Å; K552-E560 PolarHBondContact NZ-OE1 2.68Å; K552-E560 IonicContact NZ-OE2 3.49Å; K552-E560 PolarHBondContact NZ-OE2 3.45Å
553	S	85.9	Confident	86.6	Confident	28 Å²	28	60 Å²	60	20%	0.196	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-67.2	153.6	173.1	71.8	0	0	0	0	110	Y555 Q556 E557	S553-Y555 PolarHBondContact O-N 3.07Å; S553-Q556 WeakPolarHBondContact O-CA 3.26Å; S553-Q556 WeakPolarHBondContact O-CB 3.5Å; S553-Q556 PolarHBondContact O-N 3.36Å; S553-Q556 VanDerWaalsContact OG-CG 3.3Å; S553-Q556 WeakPolarHBondContact OG-CG 3.32Å; S553-Q556 PolarHBondContact OG-N 3.24Å; S553-Q556 VanDerWaalsContact OG-N 3.14Å; S553-E557 PolarHBondContact O-N 2.97Å
554	Y	90.2	Very high	86.5	Confident	8 Å²	8	57.4 Å²	57.4	3%	0.031	29%	0.293	C	S	.	.	H	α-helix	trans	-60.3	-36.2	176.6	177.5	-108.5	0	0	0	111.8	V481 E484 M546 Q556 E557 V558 F588	V481-Y554 HydrophobicContact CG2-CE1 4.12Å; E484-Y554 HydrophobicContact CB-CD2 4.43Å; E484-Y554 HydrophobicContact CB-CE2 4.37Å; E484-Y554 HydrophobicContact CG-CD2 4.29Å; E484-Y554 HydrophobicContact CG-CE2 3.82Å; M546-Y554 HydrophobicContact CE-CD1 4.47Å; M546-Y554 HydrophobicContact CE-CD2 4.47Å; M546-Y554 HydrophobicContact CE-CG 3.88Å; Y554-Q556 VanDerWaalsContact C-N 3.32Å; Y554-Q556 PolarHBondContact O-N 2.81Å; Y554-E557 WeakPolarHBondContact O-CB 3.31Å; Y554-E557 PolarHBondContact O-N 3.5Å; Y554-E557 VanDerWaalsContact O-N 3.11Å; Y554-V558 HydrophobicContact CD1-CG2 4.21Å; Y554-V558 HydrophobicContact CE1-CG2 3.85Å; Y554-V558 HydrophobicContact CE2-CG2 4.33Å; Y554-V558 WeakPolarHBondContact O-CG2 3.4Å; Y554-V558 PolarHBondContact O-N 3.41Å; Y554-F588 HydrophobicContact CD1-CD1 4.34Å; Y554-F588 AromaticContact CD1-CE1 3.68Å; Y554-F588 HydrophobicContact CD1-CE1 3.68Å; Y554-F588 AromaticContact CE1-CE1 3.77Å; Y554-F588 HydrophobicContact CE1-CE1 3.77Å; Y554-F588 HydrophobicContact CE1-CZ 4.32Å
555	Y	91.7	Very high	86.4	Confident	13 Å²	13	58 Å²	58	5%	0.051	30%	0.296	C	S	.	.	H	α-helix	trans	-55.5	-43.9	168.6	159.8	-121.1	0	0	0	112.5	S553 E557 V558 K559 D581 L584 Q585 F588 Y593	S553-Y555 PolarHBondContact O-N 3.07Å; Y555-E557 VanDerWaalsContact C-N 3.34Å; Y555-E557 PolarHBondContact O-N 3.31Å; Y555-V558 PolarHBondContact O-N 2.89Å; Y555-K559 WeakPolarHBondContact O-CB 3.34Å; Y555-K559 PolarHBondContact O-N 2.95Å; Y555-D581 VanDerWaalsContact OH-CG 3.28Å; Y555-D581 PolarHBondContact OH-O 2.76Å; Y555-D581 PolarHBondContact OH-OD1 2.95Å; Y555-L584 HydrophobicContact CD2-CB 3.96Å; Y555-L584 HydrophobicContact CE2-CB 3.56Å; Y555-L584 HydrophobicContact CE2-CD1 4.36Å; Y555-Q585 HydrophobicContact CE1-CB 4.39Å; Y555-Q585 HydrophobicContact CE1-CG 4.37Å; Y555-F588 HydrophobicContact CD2-CD2 4.39Å; Y555-F588 HydrophobicContact CG-CB 4.46Å; Y555-Y593 PolarHBondContact N-OH 2.98Å
556	Q	89.9	Confident	86.2	Confident	87 Å²	87	53.5 Å²	53.5	41%	0.407	28%	0.277	S	S	.	.	H	α-helix	trans	-63.6	-37	174.8	-73.8	170.3	2.4	0	0	112.5	K552 S553 Y554 K559 E560	K552-Q556 HydrophobicContact CB-CB 4.17Å; S553-Q556 WeakPolarHBondContact O-CA 3.26Å; S553-Q556 WeakPolarHBondContact O-CB 3.5Å; S553-Q556 PolarHBondContact O-N 3.36Å; S553-Q556 VanDerWaalsContact OG-CG 3.3Å; S553-Q556 WeakPolarHBondContact OG-CG 3.32Å; S553-Q556 PolarHBondContact OG-N 3.24Å; S553-Q556 VanDerWaalsContact OG-N 3.14Å; Y554-Q556 VanDerWaalsContact C-N 3.32Å; Y554-Q556 PolarHBondContact O-N 2.81Å; Q556-K559 WeakPolarHBondContact O-CB 3.24Å; Q556-K559 PolarHBondContact O-N 3.22Å; Q556-E560 WeakPolarHBondContact O-CG 3.41Å; Q556-E560 PolarHBondContact O-N 3.18Å
557	E	90.3	Very high	86.2	Confident	45 Å²	45	56.2 Å²	56.2	21%	0.21	29%	0.292	C	S	.	.	H	α-helix	trans	-64.6	-44.1	174.5	-67.3	178.3	-164	0	0	112.1	R488 S553 Y554 Y555 K559 E560 K561	R488-E557 IonicContact CZ-OE1 2.74Å; R488-E557 IonicContact CZ-OE2 3.44Å; R488-E557 VanDerWaalsContact NH1-CD 3.34Å; R488-E557 IonicContact NH1-OE1 3.42Å; R488-E557 PolarHBondContact NH1-OE1 3.28Å; R488-E557 IonicContact NH1-OE2 3.4Å; R488-E557 PolarHBondContact NH1-OE2 3.21Å; R488-E557 IonicContact NH2-OE1 3.44Å; R488-E557 IonicContact NH2-OE2 3.24Å; R488-E557 PolarHBondContact NH2-OE2 3.35Å; S553-E557 PolarHBondContact O-N 2.97Å; Y554-E557 WeakPolarHBondContact O-CB 3.31Å; Y554-E557 PolarHBondContact O-N 3.5Å; Y554-E557 VanDerWaalsContact O-N 3.11Å; Y555-E557 VanDerWaalsContact C-N 3.34Å; Y555-E557 PolarHBondContact O-N 3.31Å; E557-K559 VanDerWaalsContact C-N 3.27Å; E557-K559 PolarHBondContact O-N 2.93Å; E557-E560 PolarHBondContact O-N 3.36Å; E557-K561 WeakPolarHBondContact O-CB 3.46Å; E557-K561 WeakPolarHBondContact O-CG 3.33Å; E557-K561 PolarHBondContact O-N 2.79Å
558	V	91.7	Very high	86.6	Confident	1 Å²	1	60.2 Å²	60.2	1%	0.006	31%	0.308	C	S	.	.	H	α-helix	trans	-59.2	-41.2	175.5	170.7	0	0	0	0	110.5	F421 L425 Y554 Y555 K562 L563 L584 F588	F421-V558 HydrophobicContact CE2-CG1 4.08Å; F421-V558 HydrophobicContact CZ-CG1 3.98Å; L425-V558 HydrophobicContact CD2-CG1 4.04Å; L425-V558 HydrophobicContact CD2-CG2 3.64Å; Y554-V558 HydrophobicContact CD1-CG2 4.21Å; Y554-V558 HydrophobicContact CE1-CG2 3.85Å; Y554-V558 HydrophobicContact CE2-CG2 4.33Å; Y554-V558 WeakPolarHBondContact O-CG2 3.4Å; Y554-V558 PolarHBondContact O-N 3.41Å; Y555-V558 PolarHBondContact O-N 2.89Å; V558-K562 PolarHBondContact O-N 3.06Å; V558-L563 HydrophobicContact CG1-CB 4.14Å; V558-L563 HydrophobicContact CG1-CD1 4.36Å; V558-L563 HydrophobicContact CG2-CD1 4.39Å; V558-L563 PolarHBondContact O-N 3.27Å; V558-L584 HydrophobicContact CG1-CD1 4.42Å; V558-F588 HydrophobicContact CG2-CZ 4.42Å
559	K	90.6	Very high	86.8	Confident	82 Å²	82	64.4 Å²	64.4	36%	0.357	33%	0.325	S	S	.	.	H	α-helix	trans	-64.9	-47.6	175.6	-179.7	179.4	-175.7	160.9	0	112.8	Y555 Q556 E557 K561 K562 F565 D581	Y555-K559 WeakPolarHBondContact O-CB 3.34Å; Y555-K559 PolarHBondContact O-N 2.95Å; Q556-K559 WeakPolarHBondContact O-CB 3.24Å; Q556-K559 PolarHBondContact O-N 3.22Å; E557-K559 VanDerWaalsContact C-N 3.27Å; E557-K559 PolarHBondContact O-N 2.93Å; K559-K561 VanDerWaalsContact C-N 3.31Å; K559-K561 PolarHBondContact O-N 3.12Å; K559-K562 WeakPolarHBondContact O-CA 2.93Å; K559-K562 PolarHBondContact O-N 2.94Å; K559-F565 HydrophobicContact CB-CE2 4.09Å; K559-F565 HydrophobicContact CB-CZ 4.42Å; K559-F565 HydrophobicContact CG-CE2 3.96Å; K559-F565 HydrophobicContact CG-CZ 3.93Å; K559-D581 VanDerWaalsContact CD-OD1 3.28Å; K559-D581 WeakPolarHBondContact CD-OD1 3.3Å; K559-D581 WeakPolarHBondContact CE-OD1 3.49Å; K559-D581 IonicContact NZ-OD1 2.65Å; K559-D581 PolarHBondContact NZ-OD1 2.91Å; K559-D581 IonicContact NZ-OD2 2.79Å; K559-D581 PolarHBondContact NZ-OD2 2.87Å
560	E	89.5	Confident	87.8	Confident	115 Å²	115	61.7 Å²	61.7	54%	0.537	31%	0.307	S	S	.	.	H	α-helix	trans	-63.9	-37.4	179.4	-76.5	-178.9	174.6	0	0	112.5	K552 Q556 E557 K562	K552-E560 WeakPolarHBondContact CD-OE1 3.38Å; K552-E560 WeakPolarHBondContact CE-OE1 3.27Å; K552-E560 IonicContact NZ-OE1 2.72Å; K552-E560 PolarHBondContact NZ-OE1 2.68Å; K552-E560 IonicContact NZ-OE2 3.49Å; K552-E560 PolarHBondContact NZ-OE2 3.45Å; Q556-E560 WeakPolarHBondContact O-CG 3.41Å; Q556-E560 PolarHBondContact O-N 3.18Å; E557-E560 PolarHBondContact O-N 3.36Å; E560-K562 PolarHBondContact O-N 3.4Å
561	K	90.5	Very high	88.6	Confident	83 Å²	83	61.6 Å²	61.6	36%	0.361	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-2	174.5	-70.2	172.6	179.5	168.4	0	113.5	N428 E557 K559 L563	N428-K561 VanDerWaalsContact CG-NZ 3.28Å; N428-K561 PolarHBondContact ND2-NZ 3.28Å; N428-K561 VanDerWaalsContact ND2-NZ 3.11Å; N428-K561 PolarHBondContact OD1-NZ 3.03Å; E557-K561 WeakPolarHBondContact O-CB 3.46Å; E557-K561 WeakPolarHBondContact O-CG 3.33Å; E557-K561 PolarHBondContact O-N 2.79Å; K559-K561 VanDerWaalsContact C-N 3.31Å; K559-K561 PolarHBondContact O-N 3.12Å; K561-L563 HydrophobicContact CB-CD1 4.35Å; K561-L563 HydrophobicContact CB-CD2 3.88Å; K561-L563 HydrophobicContact CB-CG 3.75Å; K561-L563 PolarHBondContact O-N 3.07Å
562	K	90.7	Very high	89.1	Confident	62 Å²	62	58.2 Å²	58.2	27%	0.27	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.7	31.8	178.3	-58	-178.2	-172.2	174.4	0	113.4	M430 V558 K559 E560 Y564 F565 D567	M430-K562 HydrophobicContact CE-CB 3.95Å; M430-K562 WeakPolarHBondContact CE-O 3.07Å; V558-K562 PolarHBondContact O-N 3.06Å; K559-K562 WeakPolarHBondContact O-CA 2.93Å; K559-K562 PolarHBondContact O-N 2.94Å; E560-K562 PolarHBondContact O-N 3.4Å; K562-Y564 PolarHBondContact O-N 3.39Å; K562-F565 HydrophobicContact CB-CB 4.05Å; K562-F565 HydrophobicContact CG-CB 4.47Å; K562-F565 PolarHBondContact O-N 2.93Å; K562-F565 VanDerWaalsContact O-N 3.12Å; K562-D567 HydrophobicContact CD-CB 4.13Å; K562-D567 IonicContact NZ-OD1 3.87Å; K562-D567 PolarHBondContact NZ-OD1 2.74Å; K562-D567 IonicContact NZ-OD2 2.65Å; K562-D567 PolarHBondContact NZ-OD2 3.37Å
563	L	91.3	Very high	89.4	Confident	1 Å²	1	53.5 Å²	53.5	1%	0.005	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-13.7	-172.3	-58.8	-177.2	0	0	0	114.4	F421 N424 L425 Y429 V558 K561	F421-L563 HydrophobicContact CE2-CB 4.22Å; N424-L563 HydrophobicContact CB-CB 4.36Å; N424-L563 PolarHBondContact ND2-O 3.43Å; L425-L563 HydrophobicContact CD2-CD1 4.09Å; Y429-L563 VanDerWaalsContact C-CD2 3.47Å; V558-L563 HydrophobicContact CG1-CB 4.14Å; V558-L563 HydrophobicContact CG1-CD1 4.36Å; V558-L563 HydrophobicContact CG2-CD1 4.39Å; V558-L563 PolarHBondContact O-N 3.27Å; K561-L563 HydrophobicContact CB-CD1 4.35Å; K561-L563 HydrophobicContact CB-CD2 3.88Å; K561-L563 HydrophobicContact CB-CG 3.75Å; K561-L563 PolarHBondContact O-N 3.07Å
564	Y	92.9	Very high	89.6	Confident	2 Å²	2	57.3 Å²	57.3	1%	0.008	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-137.4	31.2	175.1	-158.7	-109	0	0	0	111.4	L416 F421 I434 L471 K562 R580 L584	L416-Y564 HydrophobicContact CB-CD2 4.06Å; L416-Y564 HydrophobicContact CB-CE2 3.71Å; L416-Y564 HydrophobicContact CD1-CD2 4.24Å; L416-Y564 HydrophobicContact CG-CD2 4.21Å; L416-Y564 HydrophobicContact CG-CE2 4.3Å; L416-Y564 WeakPolarHBondContact O-CE2 3.19Å; L416-Y564 PolarHBondContact O-OH 2.92Å; L416-Y564 VanDerWaalsContact O-OH 3.13Å; F421-Y564 HydrophobicContact CB-CD2 3.84Å; F421-Y564 HydrophobicContact CB-CE2 3.94Å; F421-Y564 HydrophobicContact CD1-CD2 4.28Å; F421-Y564 AromaticContact CD2-CD2 3.45Å; F421-Y564 HydrophobicContact CD2-CD2 3.45Å; F421-Y564 VanDerWaalsContact CD2-CD2 3.45Å; F421-Y564 HydrophobicContact CD2-CE2 4.35Å; F421-Y564 HydrophobicContact CD2-CG 4.01Å; F421-Y564 HydrophobicContact CE2-CD2 4.07Å; F421-Y564 HydrophobicContact CE2-CG 4.17Å; F421-Y564 AromaticContact CG-CD2 3.58Å; F421-Y564 HydrophobicContact CG-CD2 3.58Å; F421-Y564 HydrophobicContact CG-CE2 4.04Å; F421-Y564 HydrophobicContact CG-CG 4.41Å; I434-Y564 HydrophobicContact CD1-CG 4.46Å; I434-Y564 VanDerWaalsContact CD1-O 3.23Å; I434-Y564 WeakPolarHBondContact CD1-O 3.48Å; L471-Y564 HydrophobicContact CD1-CE1 4.23Å; L471-Y564 HydrophobicContact CD1-CE2 4.42Å; L471-Y564 HydrophobicContact CD2-CE2 4.37Å; K562-Y564 PolarHBondContact O-N 3.39Å; Y564-R580 HydrophobicContact CD1-CB 4.14Å; Y564-R580 HydrophobicContact CD1-CG 4.32Å; Y564-R580 HydrophobicContact CE1-CB 4.45Å; Y564-R580 HydrophobicContact CE1-CG 4.31Å; Y564-R580 WeakPolarHBondContact O-CD 3.43Å; Y564-L584 HydrophobicContact CD1-CD1 4.39Å; Y564-L584 HydrophobicContact CD1-CD2 3.88Å; Y564-L584 HydrophobicContact CD1-CG 4.09Å; Y564-L584 HydrophobicContact CG-CD2 4.11Å
565	F	90.7	Very high	89.6	Confident	18 Å²	18	58.4 Å²	58.4	8%	0.079	29%	0.286	C	S	.	.	S	Bend	trans	-130	144.1	-179.6	-64	-92.2	0	0	0	110.1	K559 K562 N577 R580 D581 L584	K559-F565 HydrophobicContact CB-CE2 4.09Å; K559-F565 HydrophobicContact CB-CZ 4.42Å; K559-F565 HydrophobicContact CG-CE2 3.96Å; K559-F565 HydrophobicContact CG-CZ 3.93Å; K562-F565 HydrophobicContact CB-CB 4.05Å; K562-F565 HydrophobicContact CG-CB 4.47Å; K562-F565 PolarHBondContact O-N 2.93Å; K562-F565 VanDerWaalsContact O-N 3.12Å; F565-N577 HydrophobicContact CD1-CB 3.93Å; F565-N577 WeakPolarHBondContact CE1-O 3.44Å; F565-R580 HydrophobicContact CD1-CB 4.36Å; F565-R580 HydrophobicContact CE1-CB 4.21Å; F565-D581 HydrophobicContact CE1-CB 3.91Å; F565-D581 HydrophobicContact CZ-CB 4.07Å; F565-L584 HydrophobicContact CE2-CD1 3.55Å; F565-L584 HydrophobicContact CZ-CD1 3.84Å
566	H	87.6	Confident	89.7	Confident	42 Å²	42	57.8 Å²	57.8	19%	0.194	28%	0.283	C	S	.	.			trans	-86	128.5	171.7	-174.2	59.5	0	0	0	109.7	I434 E568 V573 N577	I434-H566 HydrophobicContact CB-CB 4.36Å; I434-H566 PolarHBondContact O-ND1 3.41Å; H566-E568 IonicContact CD2-OE2 3.64Å; H566-E568 IonicContact NE2-OE2 3.11Å; H566-E568 PolarHBondContact NE2-OE2 2.81Å; H566-E568 VanDerWaalsContact NE2-OE2 3.11Å; H566-E568 PolarHBondContact O-N 2.74Å; H566-E568 VanDerWaalsContact O-N 3.15Å; H566-V573 HydrophobicContact CB-CG1 4.2Å; H566-N577 PolarHBondContact N-OD1 2.97Å; H566-N577 VanDerWaalsContact N-OD1 3.16Å; H566-N577 PolarHBondContact O-ND2 3.04Å
567	D	86.1	Confident	89.8	Confident	89 Å²	89	54.9 Å²	54.9	48%	0.476	27%	0.271	S	S	.	.			trans	-87.9	78	-174.8	-164.1	7.2	0	0	0	112.4	K562	K562-D567 HydrophobicContact CD-CB 4.13Å; K562-D567 IonicContact NZ-OD1 3.87Å; K562-D567 PolarHBondContact NZ-OD1 2.74Å; K562-D567 IonicContact NZ-OD2 2.65Å; K562-D567 PolarHBondContact NZ-OD2 3.37Å
568	E	86.4	Confident	89.9	Confident	94 Å²	94	58.7 Å²	58.7	44%	0.439	28%	0.283	S	S	.	.			trans	-147.6	142	176.4	-174.7	-171.9	149	0	0	111.9	H566 S570 V573	H566-E568 IonicContact CD2-OE2 3.64Å; H566-E568 IonicContact NE2-OE2 3.11Å; H566-E568 PolarHBondContact NE2-OE2 2.81Å; H566-E568 VanDerWaalsContact NE2-OE2 3.11Å; H566-E568 PolarHBondContact O-N 2.74Å; H566-E568 VanDerWaalsContact O-N 3.15Å; E568-S570 VanDerWaalsContact C-N 3.29Å; E568-S570 PolarHBondContact O-N 3.5Å; E568-S570 WeakPolarHBondContact OE1-CB 3.37Å; E568-V573 HydrophobicContact CB-CB 4.32Å; E568-V573 HydrophobicContact CB-CG1 4.05Å; E568-V573 HydrophobicContact CB-CG2 3.87Å; E568-V573 HydrophobicContact CG-CG2 4.06Å; E568-V573 VanDerWaalsContact O-CG1 3.29Å; E568-V573 WeakPolarHBondContact O-CG1 3.29Å
569	Y	84.6	Confident	90	Very high	199 Å²	199	59 Å²	59	78%	0.78	29%	0.285	S	S	*	.			trans	-92	40	-177.4	-65.1	-89.3	0	0	0	113.1
570	S	90.2	Very high	90.2	Very high	39 Å²	39	55.1 Å²	55.1	27%	0.273	27%	0.268	S	S	.	.			trans	-93.2	144.2	173	173.1	0	0	0	0	110.7	E568 V572 V573 Q574	E568-S570 VanDerWaalsContact C-N 3.29Å; E568-S570 PolarHBondContact O-N 3.5Å; E568-S570 WeakPolarHBondContact OE1-CB 3.37Å; S570-V572 PolarHBondContact O-N 3.37Å; S570-V572 PolarHBondContact OG-N 3.46Å; S570-V573 PolarHBondContact O-N 2.72Å; S570-V573 VanDerWaalsContact O-N 3.12Å; S570-Q574 WeakPolarHBondContact O-CG 3.46Å; S570-Q574 PolarHBondContact O-N 3.16Å
571	A	89.1	Confident	90.4	Very high	81 Å²	81	51.1 Å²	51.1	67%	0.669	25%	0.25	S	S	*	.	H	α-helix	trans	-58.2	-36.8	176.6	0	0	0	0	0	111.7	D575	A571-D575 PolarHBondContact O-N 2.72Å; A571-D575 VanDerWaalsContact O-N 3.07Å
572	V	90	Very high	90.7	Very high	33 Å²	33	49.8 Å²	49.8	20%	0.2	25%	0.245	C	C	.	.	H	α-helix	trans	-64.8	-49.6	174.7	179.8	0	0	0	0	110	P440 S570 Q574 D575 W576	P440-V572 HydrophobicContact CG-CG2 4.44Å; S570-V572 PolarHBondContact O-N 3.37Å; S570-V572 PolarHBondContact OG-N 3.46Å; V572-Q574 VanDerWaalsContact C-N 3.29Å; V572-Q574 PolarHBondContact O-N 2.66Å; V572-D575 WeakPolarHBondContact O-CA 3.23Å; V572-D575 VanDerWaalsContact O-CB 3.23Å; V572-D575 WeakPolarHBondContact O-CB 3.47Å; V572-D575 PolarHBondContact O-N 2.84Å; V572-W576 VanDerWaalsContact O-CD1 3.25Å; V572-W576 PolarHBondContact O-N 2.81Å; V572-W576 VanDerWaalsContact O-N 3.09Å
573	V	88	Confident	90.9	Very high	2 Å²	2	46.9 Å²	46.9	1%	0.012	23%	0.233	C	C	.	.	H	α-helix	trans	-58.6	-42.4	179	175.6	0	0	0	0	111.6	Q436 H566 E568 S570 D575 W576 N577	Q436-V573 HydrophobicContact CG-CG2 3.64Å; H566-V573 HydrophobicContact CB-CG1 4.2Å; E568-V573 HydrophobicContact CB-CB 4.32Å; E568-V573 HydrophobicContact CB-CG1 4.05Å; E568-V573 HydrophobicContact CB-CG2 3.87Å; E568-V573 HydrophobicContact CG-CG2 4.06Å; E568-V573 VanDerWaalsContact O-CG1 3.29Å; E568-V573 WeakPolarHBondContact O-CG1 3.29Å; S570-V573 PolarHBondContact O-N 2.72Å; S570-V573 VanDerWaalsContact O-N 3.12Å; V573-D575 VanDerWaalsContact C-N 3.27Å; V573-D575 PolarHBondContact O-N 2.62Å; V573-W576 PolarHBondContact O-N 3.24Å; V573-N577 WeakPolarHBondContact CG1-ND2 3.22Å; V573-N577 VanDerWaalsContact O-CB 3.29Å; V573-N577 WeakPolarHBondContact O-CB 3.37Å; V573-N577 PolarHBondContact O-N 3Å
574	Q	90.4	Very high	91.2	Very high	107 Å²	107	46.8 Å²	46.8	50%	0.5	23%	0.232	S	C	.	.	H	α-helix	trans	-63.3	-34.9	177	-71.3	176.1	5.5	0	0	112.1	S570 V572 N577 R578	S570-Q574 WeakPolarHBondContact O-CG 3.46Å; S570-Q574 PolarHBondContact O-N 3.16Å; V572-Q574 VanDerWaalsContact C-N 3.29Å; V572-Q574 PolarHBondContact O-N 2.66Å; Q574-N577 PolarHBondContact O-N 2.95Å; Q574-R578 WeakPolarHBondContact O-CB 3.5Å; Q574-R578 PolarHBondContact O-N 3.19Å
575	D	89.8	Confident	91.3	Very high	31 Å²	31	50.6 Å²	50.6	17%	0.166	25%	0.25	C	S	.	.	H	α-helix	trans	-62.7	-49	174.1	-163	58.9	0	0	0	111.7	A571 V572 V573 R578 L579	A571-D575 PolarHBondContact O-N 2.72Å; A571-D575 VanDerWaalsContact O-N 3.07Å; V572-D575 WeakPolarHBondContact O-CA 3.23Å; V572-D575 VanDerWaalsContact O-CB 3.23Å; V572-D575 WeakPolarHBondContact O-CB 3.47Å; V572-D575 PolarHBondContact O-N 2.84Å; V573-D575 VanDerWaalsContact C-N 3.27Å; V573-D575 PolarHBondContact O-N 2.62Å; D575-R578 WeakPolarHBondContact O-CB 3.35Å; D575-R578 PolarHBondContact O-N 2.92Å; D575-R578 IonicContact OD1-CZ 3.82Å; D575-R578 IonicContact OD1-NH1 2.66Å; D575-R578 PolarHBondContact OD1-NH1 3.28Å; D575-R578 IonicContact OD1-NH2 2.75Å; D575-R578 PolarHBondContact OD1-NH2 3.15Å; D575-L579 PolarHBondContact O-N 3.27Å
576	W	93	Very high	91.5	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-64.5	-42.8	174.8	-75.6	85.8	0	0	0	112.3	K413 L414 Y437 Q439 F441 I444 V572 V573 R578 L579 R580	K413-W576 HydrophobicContact CB-CH2 4.03Å; K413-W576 HydrophobicContact CB-CZ3 4.21Å; K413-W576 VanDerWaalsContact O-CZ3 3.25Å; K413-W576 WeakPolarHBondContact O-CZ3 3.47Å; L414-W576 HydrophobicContact CD1-CE3 3.9Å; L414-W576 HydrophobicContact CD1-CZ3 4.03Å; Y437-W576 HydrophobicContact CD2-CH2 4.34Å; Y437-W576 HydrophobicContact CG-CZ2 4.48Å; Q439-W576 PolarHBondContact O-NE1 2.79Å; F441-W576 HydrophobicContact CB-CD2 4.35Å; F441-W576 HydrophobicContact CB-CZ2 4.16Å; F441-W576 HydrophobicContact CD2-CE3 4.06Å; F441-W576 AromaticContact CD2-CH2 3.61Å; F441-W576 HydrophobicContact CD2-CH2 3.61Å; F441-W576 HydrophobicContact CD2-CZ2 4.09Å; F441-W576 AromaticContact CD2-CZ3 3.58Å; F441-W576 HydrophobicContact CD2-CZ3 3.58Å; F441-W576 HydrophobicContact CE2-CH2 4.37Å; F441-W576 HydrophobicContact CE2-CZ3 4.21Å; I444-W576 HydrophobicContact CD1-CH2 4.07Å; I444-W576 HydrophobicContact CD1-CZ2 3.7Å; V572-W576 VanDerWaalsContact O-CD1 3.25Å; V572-W576 PolarHBondContact O-N 2.81Å; V572-W576 VanDerWaalsContact O-N 3.09Å; V573-W576 PolarHBondContact O-N 3.24Å; W576-R578 VanDerWaalsContact C-N 3.29Å; W576-R578 PolarHBondContact O-N 3.34Å; W576-L579 WeakPolarHBondContact O-CB 3.38Å; W576-L579 PolarHBondContact O-N 3.38Å; W576-L579 VanDerWaalsContact O-N 3.14Å; W576-R580 WeakPolarHBondContact O-CG 3.43Å; W576-R580 PolarHBondContact O-N 3.36Å
577	N	92.1	Very high	91.9	Very high	27 Å²	27	49.1 Å²	49.1	14%	0.144	24%	0.244	C	C	.	.	H	α-helix	trans	-63.2	-34.1	177.4	-80	-15.9	0	0	0	112.1	F565 H566 V573 Q574 L579 R580 D581	F565-N577 HydrophobicContact CD1-CB 3.93Å; F565-N577 WeakPolarHBondContact CE1-O 3.44Å; H566-N577 PolarHBondContact N-OD1 2.97Å; H566-N577 VanDerWaalsContact N-OD1 3.16Å; H566-N577 PolarHBondContact O-ND2 3.04Å; V573-N577 WeakPolarHBondContact CG1-ND2 3.22Å; V573-N577 VanDerWaalsContact O-CB 3.29Å; V573-N577 WeakPolarHBondContact O-CB 3.37Å; V573-N577 PolarHBondContact O-N 3Å; Q574-N577 PolarHBondContact O-N 2.95Å; N577-L579 VanDerWaalsContact C-N 3.34Å; N577-R580 PolarHBondContact O-N 2.95Å; N577-R580 PolarHBondContact OD1-NH1 3.48Å; N577-D581 WeakPolarHBondContact O-CB 3.3Å; N577-D581 PolarHBondContact O-N 3.13Å
578	R	93	Very high	92.4	Very high	124 Å²	124	44.9 Å²	44.9	47%	0.468	22%	0.222	S	C	.	.	H	α-helix	trans	-62.3	-42.8	172.7	-172.3	-179.9	69.3	-108.1	-3.4	111.3	Q574 D575 W576 D581 E582	Q574-R578 WeakPolarHBondContact O-CB 3.5Å; Q574-R578 PolarHBondContact O-N 3.19Å; D575-R578 WeakPolarHBondContact O-CB 3.35Å; D575-R578 PolarHBondContact O-N 2.92Å; D575-R578 IonicContact OD1-CZ 3.82Å; D575-R578 IonicContact OD1-NH1 2.66Å; D575-R578 PolarHBondContact OD1-NH1 3.28Å; D575-R578 IonicContact OD1-NH2 2.75Å; D575-R578 PolarHBondContact OD1-NH2 3.15Å; W576-R578 VanDerWaalsContact C-N 3.29Å; W576-R578 PolarHBondContact O-N 3.34Å; R578-D581 WeakPolarHBondContact O-CB 3.39Å; R578-D581 PolarHBondContact O-N 3.16Å; R578-E582 WeakPolarHBondContact O-CG 3.27Å; R578-E582 PolarHBondContact O-N 3.24Å; R578-E582 VanDerWaalsContact O-N 3.12Å
579	L	93	Very high	92.8	Very high	8 Å²	8	44.1 Å²	44.1	4%	0.042	22%	0.218	C	C	.	.	H	α-helix	trans	-66.4	-41.6	175.9	-63.7	173.7	0	0	0	112.2	L414 F441 T460 K464 D575 W576 N577 D581 E582 V583	L414-L579 HydrophobicContact CD1-CB 3.93Å; L414-L579 HydrophobicContact CD1-CD1 4.22Å; F441-L579 HydrophobicContact CB-CD1 3.52Å; F441-L579 HydrophobicContact CD1-CD1 3.4Å; F441-L579 HydrophobicContact CD2-CD1 3.75Å; F441-L579 HydrophobicContact CE1-CD1 4.02Å; F441-L579 HydrophobicContact CE2-CD1 4.33Å; F441-L579 HydrophobicContact CG-CD1 3.25Å; F441-L579 HydrophobicContact CZ-CD1 4.44Å; T460-L579 HydrophobicContact CG2-CD2 3.57Å; K464-L579 HydrophobicContact CD-CD2 4.15Å; D575-L579 PolarHBondContact O-N 3.27Å; W576-L579 WeakPolarHBondContact O-CB 3.38Å; W576-L579 PolarHBondContact O-N 3.38Å; W576-L579 VanDerWaalsContact O-N 3.14Å; N577-L579 VanDerWaalsContact C-N 3.34Å; L579-D581 VanDerWaalsContact C-N 3.29Å; L579-D581 PolarHBondContact O-N 2.95Å; L579-E582 PolarHBondContact O-N 3.18Å; L579-V583 WeakPolarHBondContact O-CG2 3.35Å; L579-V583 PolarHBondContact O-N 3.11Å
580	R	94.8	Very high	93.3	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-58.9	-41.5	174.3	-68.3	168	-170.8	138.7	1.4	111.3	L414 Q436 Y564 F565 W576 N577 V583 L584	L414-R580 WeakPolarHBondContact O-CG 3.42Å; L414-R580 PolarHBondContact O-NE 3.22Å; L414-R580 PolarHBondContact O-NH2 3.07Å; Q436-R580 VanDerWaalsContact OE1-NH1 3.13Å; Y564-R580 HydrophobicContact CD1-CB 4.14Å; Y564-R580 HydrophobicContact CD1-CG 4.32Å; Y564-R580 HydrophobicContact CE1-CB 4.45Å; Y564-R580 HydrophobicContact CE1-CG 4.31Å; Y564-R580 WeakPolarHBondContact O-CD 3.43Å; F565-R580 HydrophobicContact CD1-CB 4.36Å; F565-R580 HydrophobicContact CE1-CB 4.21Å; W576-R580 WeakPolarHBondContact O-CG 3.43Å; W576-R580 PolarHBondContact O-N 3.36Å; N577-R580 PolarHBondContact O-N 2.95Å; N577-R580 PolarHBondContact OD1-NH1 3.48Å; R580-V583 PolarHBondContact O-N 2.75Å; R580-L584 WeakPolarHBondContact O-CG 3.34Å; R580-L584 PolarHBondContact O-N 3.27Å
581	D	94.9	Very high	93.5	Very high	31 Å²	31	41 Å²	41	17%	0.166	21%	0.207	C	C	.	.	H	α-helix	trans	-59.7	-48.9	175.9	-163.8	42.9	0	0	0	112.1	Y555 K559 F565 N577 R578 L579 V583 L584 Q585	Y555-D581 VanDerWaalsContact OH-CG 3.28Å; Y555-D581 PolarHBondContact OH-O 2.76Å; Y555-D581 PolarHBondContact OH-OD1 2.95Å; K559-D581 VanDerWaalsContact CD-OD1 3.28Å; K559-D581 WeakPolarHBondContact CD-OD1 3.3Å; K559-D581 WeakPolarHBondContact CE-OD1 3.49Å; K559-D581 IonicContact NZ-OD1 2.65Å; K559-D581 PolarHBondContact NZ-OD1 2.91Å; K559-D581 IonicContact NZ-OD2 2.79Å; K559-D581 PolarHBondContact NZ-OD2 2.87Å; F565-D581 HydrophobicContact CE1-CB 3.91Å; F565-D581 HydrophobicContact CZ-CB 4.07Å; N577-D581 WeakPolarHBondContact O-CB 3.3Å; N577-D581 PolarHBondContact O-N 3.13Å; R578-D581 WeakPolarHBondContact O-CB 3.39Å; R578-D581 PolarHBondContact O-N 3.16Å; L579-D581 VanDerWaalsContact C-N 3.29Å; L579-D581 PolarHBondContact O-N 2.95Å; D581-V583 VanDerWaalsContact C-N 3.32Å; D581-V583 PolarHBondContact O-N 3.06Å; D581-L584 PolarHBondContact O-N 3.19Å; D581-Q585 WeakPolarHBondContact O-CB 3.19Å; D581-Q585 PolarHBondContact O-N 3.41Å
582	E	95.6	Very high	93.9	Very high	56 Å²	56	37.1 Å²	37.1	26%	0.262	18%	0.175	S	C	.	.	H	α-helix	trans	-63	-37.3	177.3	-68.8	173.7	-163.8	0	0	112	K464 R578 L579 Q585 I586	K464-E582 HydrophobicContact CD-CB 3.96Å; K464-E582 VanDerWaalsContact CD-OE2 3.23Å; K464-E582 WeakPolarHBondContact CD-OE2 3.2Å; K464-E582 WeakPolarHBondContact CE-OE2 3.43Å; K464-E582 IonicContact NZ-OE2 2.8Å; K464-E582 PolarHBondContact NZ-OE2 3.41Å; R578-E582 WeakPolarHBondContact O-CG 3.27Å; R578-E582 PolarHBondContact O-N 3.24Å; R578-E582 VanDerWaalsContact O-N 3.12Å; L579-E582 PolarHBondContact O-N 3.18Å; E582-Q585 PolarHBondContact O-N 2.75Å; E582-I586 VanDerWaalsContact O-CG1 3.32Å; E582-I586 WeakPolarHBondContact O-CG1 3.46Å; E582-I586 PolarHBondContact O-N 3.2Å
583	V	96.2	Very high	94.1	Very high	0 Å²	0	37 Å²	37	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-63.2	-48	174.5	164.6	0	0	0	0	111.7	L414 K464 V467 A468 L471 L579 R580 D581 Q585 I586 C587	L414-V583 HydrophobicContact CD2-CG2 3.6Å; K464-V583 HydrophobicContact CB-CG2 3.86Å; K464-V583 HydrophobicContact CG-CG2 3.83Å; V467-V583 HydrophobicContact CB-CG1 4.1Å; V467-V583 HydrophobicContact CB-CG2 4.45Å; V467-V583 HydrophobicContact CG1-CG1 3.73Å; A468-V583 HydrophobicContact CB-CG1 4.18Å; L471-V583 HydrophobicContact CD1-CG1 3.9Å; L579-V583 WeakPolarHBondContact O-CG2 3.35Å; L579-V583 PolarHBondContact O-N 3.11Å; R580-V583 PolarHBondContact O-N 2.75Å; D581-V583 VanDerWaalsContact C-N 3.32Å; D581-V583 PolarHBondContact O-N 3.06Å; V583-Q585 VanDerWaalsContact C-N 3.28Å; V583-Q585 PolarHBondContact O-N 3.29Å; V583-I586 PolarHBondContact O-N 2.98Å; V583-C587 VanDerWaalsContact O-CB 3.29Å; V583-C587 WeakPolarHBondContact O-CB 3.46Å; V583-C587 PolarHBondContact O-N 2.92Å
584	L	96	Very high	94.4	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-63.3	-38.6	176.9	-67.2	-178.2	0	0	0	110.9	F421 L471 Y555 V558 Y564 F565 R580 D581 C587 F588	F421-L584 HydrophobicContact CE1-CD2 3.94Å; F421-L584 HydrophobicContact CE2-CD2 4.5Å; F421-L584 HydrophobicContact CZ-CD2 3.74Å; L471-L584 HydrophobicContact CD1-CD2 4.23Å; Y555-L584 HydrophobicContact CD2-CB 3.96Å; Y555-L584 HydrophobicContact CE2-CB 3.56Å; Y555-L584 HydrophobicContact CE2-CD1 4.36Å; V558-L584 HydrophobicContact CG1-CD1 4.42Å; Y564-L584 HydrophobicContact CD1-CD1 4.39Å; Y564-L584 HydrophobicContact CD1-CD2 3.88Å; Y564-L584 HydrophobicContact CD1-CG 4.09Å; Y564-L584 HydrophobicContact CG-CD2 4.11Å; F565-L584 HydrophobicContact CE2-CD1 3.55Å; F565-L584 HydrophobicContact CZ-CD1 3.84Å; R580-L584 WeakPolarHBondContact O-CG 3.34Å; R580-L584 PolarHBondContact O-N 3.27Å; D581-L584 PolarHBondContact O-N 3.19Å; L584-C587 PolarHBondContact O-N 3.23Å; L584-F588 HydrophobicContact CB-CD2 4.41Å; L584-F588 HydrophobicContact CD2-CE2 4.2Å; L584-F588 WeakPolarHBondContact O-CB 3.44Å; L584-F588 VanDerWaalsContact O-CD2 3.31Å; L584-F588 WeakPolarHBondContact O-CD2 3.49Å; L584-F588 PolarHBondContact O-N 3.44Å
585	Q	95.2	Very high	94.6	Very high	82 Å²	82	36.2 Å²	36.2	38%	0.383	18%	0.176	S	C	.	.	H	α-helix	trans	-60.1	-49.3	177.2	-167.6	177.4	8.8	0	0	111.7	Y555 D581 E582 V583 C587 E589	Y555-Q585 HydrophobicContact CE1-CB 4.39Å; Y555-Q585 HydrophobicContact CE1-CG 4.37Å; D581-Q585 WeakPolarHBondContact O-CB 3.19Å; D581-Q585 PolarHBondContact O-N 3.41Å; E582-Q585 PolarHBondContact O-N 2.75Å; V583-Q585 VanDerWaalsContact C-N 3.28Å; V583-Q585 PolarHBondContact O-N 3.29Å; Q585-C587 VanDerWaalsContact C-N 3.34Å; Q585-C587 PolarHBondContact O-N 2.93Å; Q585-E589 HydrophobicContact CG-CG 4.28Å; Q585-E589 WeakPolarHBondContact CG-OE2 3.32Å; Q585-E589 PolarHBondContact NE2-OE2 3.34Å; Q585-E589 WeakPolarHBondContact O-CB 3.48Å; Q585-E589 PolarHBondContact O-N 2.94Å
586	I	96	Very high	94.9	Very high	29 Å²	29	34.8 Å²	34.8	15%	0.149	17%	0.168	C	C	.	.	I	π-helix	trans	-60.2	-45.4	175.8	-65.2	164.7	0	0	0	110.4	K464 A468 E582 V583 E590 M591	K464-I586 HydrophobicContact CB-CD1 4.42Å; A468-I586 HydrophobicContact CB-CB 3.96Å; A468-I586 HydrophobicContact CB-CG2 3.71Å; E582-I586 VanDerWaalsContact O-CG1 3.32Å; E582-I586 WeakPolarHBondContact O-CG1 3.46Å; E582-I586 PolarHBondContact O-N 3.2Å; V583-I586 PolarHBondContact O-N 2.98Å; I586-E590 WeakPolarHBondContact O-CB 3.4Å; I586-E590 PolarHBondContact O-N 3.33Å; I586-M591 HydrophobicContact CG2-CE 3.77Å; I586-M591 HydrophobicContact CG2-SD 4.43Å; I586-M591 PolarHBondContact O-N 3.05Å
587	C	96.6	Very high	95	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	18%	0.181	C	C	.	.	I	π-helix	trans	-60.4	-52.6	-179.5	179.8	0	0	0	0	112	A468 V583 L584 Q585 M591 L592	A468-C587 HydrophobicContact CB-CB 4.21Å; V583-C587 VanDerWaalsContact O-CB 3.29Å; V583-C587 WeakPolarHBondContact O-CB 3.46Å; V583-C587 PolarHBondContact O-N 2.92Å; L584-C587 PolarHBondContact O-N 3.23Å; Q585-C587 VanDerWaalsContact C-N 3.34Å; Q585-C587 PolarHBondContact O-N 2.93Å; C587-M591 WeakPolarHBondContact O-CB 3.26Å; C587-L592 WeakPolarHBondContact O-CB 3.5Å; C587-L592 WeakPolarHBondContact O-CG 3.21Å; C587-L592 PolarHBondContact O-N 3.07Å
588	F	95.9	Very high	95.1	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	21%	0.206	C	C	.	.	I	π-helix	trans	-76.7	-54.7	-175.9	-79.7	-94.5	0	0	0	112.4	F421 L425 V481 Y554 Y555 V558 L584 L592 Y593	F421-F588 HydrophobicContact CE1-CE2 4.32Å; F421-F588 HydrophobicContact CZ-CE2 4.23Å; F421-F588 HydrophobicContact CZ-CZ 4.45Å; L425-F588 HydrophobicContact CD1-CZ 4.43Å; V481-F588 HydrophobicContact CG1-CD1 4.32Å; V481-F588 HydrophobicContact CG1-CE1 4.14Å; V481-F588 HydrophobicContact CG2-CD1 4.49Å; V481-F588 HydrophobicContact CG2-CE1 3.61Å; V481-F588 HydrophobicContact CG2-CZ 4.09Å; Y554-F588 HydrophobicContact CD1-CD1 4.34Å; Y554-F588 AromaticContact CD1-CE1 3.68Å; Y554-F588 HydrophobicContact CD1-CE1 3.68Å; Y554-F588 AromaticContact CE1-CE1 3.77Å; Y554-F588 HydrophobicContact CE1-CE1 3.77Å; Y554-F588 HydrophobicContact CE1-CZ 4.32Å; Y555-F588 HydrophobicContact CD2-CD2 4.39Å; Y555-F588 HydrophobicContact CG-CB 4.46Å; V558-F588 HydrophobicContact CG2-CZ 4.42Å; L584-F588 HydrophobicContact CB-CD2 4.41Å; L584-F588 HydrophobicContact CD2-CE2 4.2Å; L584-F588 WeakPolarHBondContact O-CB 3.44Å; L584-F588 VanDerWaalsContact O-CD2 3.31Å; L584-F588 WeakPolarHBondContact O-CD2 3.49Å; L584-F588 PolarHBondContact O-N 3.44Å; F588-L592 HydrophobicContact CD1-CD1 4.45Å; F588-Y593 HydrophobicContact CB-CE2 4.21Å; F588-Y593 AromaticContact CD1-CE1 3.96Å; F588-Y593 HydrophobicContact CD1-CE1 3.96Å; F588-Y593 AromaticContact CD1-CZ 3.94Å; F588-Y593 WeakPolarHBondContact O-CB 3.36Å; F588-Y593 WeakPolarHBondContact O-CD2 3.26Å; F588-Y593 PolarHBondContact O-N 3.42Å
589	E	94	Very high	95.2	Very high	77 Å²	77	39.1 Å²	39.1	36%	0.36	19%	0.191	S	C	.	.	I	π-helix	trans	-81.2	-36.4	-168.5	-58.5	-173.3	157.4	0	0	113	Q585 Y593 P594	Q585-E589 HydrophobicContact CG-CG 4.28Å; Q585-E589 WeakPolarHBondContact CG-OE2 3.32Å; Q585-E589 PolarHBondContact NE2-OE2 3.34Å; Q585-E589 WeakPolarHBondContact O-CB 3.48Å; Q585-E589 PolarHBondContact O-N 2.94Å; E589-Y593 HydrophobicContact CG-CD2 4.41Å; E589-Y593 HydrophobicContact CG-CE2 4.33Å; E589-P594 WeakPolarHBondContact O-CD 3.41Å; E589-P594 WeakPolarHBondContact O-CG 3.32Å
590	E	95.5	Very high	95.3	Very high	135 Å²	135	38.9 Å²	38.9	63%	0.631	19%	0.19	S	C	*	.	I	π-helix	trans	-95.6	-28	-176.6	-57.9	-176.7	-156.4	0	0	113.5	I586	I586-E590 WeakPolarHBondContact O-CB 3.4Å; I586-E590 PolarHBondContact O-N 3.33Å
591	M	95.3	Very high	95.4	Very high	38 Å²	38	41.7 Å²	41.7	19%	0.187	20%	0.2	C	C	.	.	I	π-helix	trans	-108.5	-57.2	-175.1	-58.2	179.9	174.3	0	0	113.4	Y465 A468 L469 S472 I586 C587 S595	Y465-M591 HydrophobicContact CD2-CE 3.77Å; Y465-M591 HydrophobicContact CE2-CE 3.53Å; A468-M591 HydrophobicContact CB-CE 4.29Å; A468-M591 HydrophobicContact CB-SD 4.36Å; L469-M591 HydrophobicContact CB-CE 4.31Å; L469-M591 HydrophobicContact CD1-CE 4.36Å; L469-M591 HydrophobicContact CD1-SD 4.26Å; S472-M591 PolarHBondContact OG-SD 3.14Å; I586-M591 HydrophobicContact CG2-CE 3.77Å; I586-M591 HydrophobicContact CG2-SD 4.43Å; I586-M591 PolarHBondContact O-N 3.05Å; C587-M591 WeakPolarHBondContact O-CB 3.26Å; M591-S595 WeakPolarHBondContact O-CB 3.09Å
592	L	96	Very high	95.4	Very high	0 Å²	0	43 Å²	43	0%	0	22%	0.216	C	C	.	.	I	π-helix	trans	-75.6	-54.5	-172.2	-69.2	177.6	0	0	0	112.9	S472 I477 R478 V481 C587 F588 S595 F596	S472-L592 WeakPolarHBondContact O-CD2 3.43Å; I477-L592 HydrophobicContact CG2-CD1 4.09Å; R478-L592 HydrophobicContact CG-CD2 3.96Å; V481-L592 HydrophobicContact CB-CD1 4.31Å; V481-L592 HydrophobicContact CG1-CB 4.41Å; V481-L592 HydrophobicContact CG1-CD1 4.17Å; V481-L592 HydrophobicContact CG2-CD1 4.08Å; C587-L592 WeakPolarHBondContact O-CB 3.5Å; C587-L592 WeakPolarHBondContact O-CG 3.21Å; C587-L592 PolarHBondContact O-N 3.07Å; F588-L592 HydrophobicContact CD1-CD1 4.45Å; L592-S595 WeakPolarHBondContact O-CB 3.48Å; L592-S595 PolarHBondContact O-N 2.83Å; L592-S595 VanDerWaalsContact O-N 3.09Å; L592-F596 HydrophobicContact CB-CD2 4.25Å; L592-F596 HydrophobicContact CB-CE2 3.83Å; L592-F596 HydrophobicContact CD2-CE2 3.92Å; L592-F596 HydrophobicContact CD2-CZ 4.03Å; L592-F596 HydrophobicContact CG-CE2 4.37Å; L592-F596 WeakPolarHBondContact O-CD2 3.48Å; L592-F596 WeakPolarHBondContact O-CG 3.4Å; L592-F596 PolarHBondContact O-N 2.95Å
593	Y	95	Very high	95.3	Very high	29 Å²	29	43 Å²	43	11%	0.114	21%	0.214	C	C	.	.	H	α-helix	trans	-59.1	-44.3	-176.6	-64.1	-20.2	0	0	0	113.5	V481 Y485 M546 Y555 F588 E589 S595 F596 E597	V481-Y593 HydrophobicContact CG1-CE1 4.19Å; Y485-Y593 AromaticContact CD2-CD1 3.52Å; Y485-Y593 HydrophobicContact CD2-CD1 3.52Å; Y485-Y593 HydrophobicContact CD2-CE1 4.03Å; Y485-Y593 HydrophobicContact CD2-CG 4.2Å; Y485-Y593 AromaticContact CE2-CD1 3.78Å; Y485-Y593 HydrophobicContact CE2-CD1 3.78Å; Y485-Y593 AromaticContact CE2-CG 3.96Å; Y485-Y593 HydrophobicContact CE2-CG 3.96Å; M546-Y593 HydrophobicContact SD-CE1 3.78Å; Y555-Y593 PolarHBondContact N-OH 2.98Å; F588-Y593 HydrophobicContact CB-CE2 4.21Å; F588-Y593 AromaticContact CD1-CE1 3.96Å; F588-Y593 HydrophobicContact CD1-CE1 3.96Å; F588-Y593 AromaticContact CD1-CZ 3.94Å; F588-Y593 WeakPolarHBondContact O-CB 3.36Å; F588-Y593 WeakPolarHBondContact O-CD2 3.26Å; F588-Y593 PolarHBondContact O-N 3.42Å; E589-Y593 HydrophobicContact CG-CD2 4.41Å; E589-Y593 HydrophobicContact CG-CE2 4.33Å; Y593-S595 VanDerWaalsContact C-N 3.28Å; Y593-S595 PolarHBondContact O-N 3.45Å; Y593-F596 PolarHBondContact O-N 3.13Å; Y593-E597 WeakPolarHBondContact O-CB 3.32Å; Y593-E597 PolarHBondContact O-N 3.2Å
594	P	95.2	Very high	95.3	Very high	49 Å²	49	43 Å²	43	32%	0.318	22%	0.215	S	C	.	.	H	α-helix	trans	-65.6	-31	176.3	-23.6	36.8	0	0	0	113.1	E589 K598	E589-P594 WeakPolarHBondContact O-CD 3.41Å; E589-P594 WeakPolarHBondContact O-CG 3.32Å; P594-K598 WeakPolarHBondContact O-CG 3.29Å; P594-K598 PolarHBondContact O-N 3.35Å
595	S	94.4	Very high	95.3	Very high	44 Å²	44	45.3 Å²	45.3	31%	0.308	23%	0.227	S	C	.	.	H	α-helix	trans	-66.4	-46.1	174.6	-177.6	0	0	0	0	111.2	R478 M591 L592 Y593 K598 E599	R478-S595 PolarHBondContact NH2-OG 3.49Å; M591-S595 WeakPolarHBondContact O-CB 3.09Å; L592-S595 WeakPolarHBondContact O-CB 3.48Å; L592-S595 PolarHBondContact O-N 2.83Å; L592-S595 VanDerWaalsContact O-N 3.09Å; Y593-S595 VanDerWaalsContact C-N 3.28Å; Y593-S595 PolarHBondContact O-N 3.45Å; S595-K598 PolarHBondContact O-N 3.41Å; S595-E599 PolarHBondContact O-N 2.93Å; S595-E599 VanDerWaalsContact O-N 3.16Å
596	F	95.3	Very high	95.3	Very high	1 Å²	1	46.6 Å²	46.6	0%	0.004	23%	0.233	C	C	.	.	H	α-helix	trans	-76.9	-29.4	-177.9	-59.4	-44.9	0	0	0	112.9	R478 V481 R482 Y485 L592 Y593 K598 E599 I600	R478-F596 HydrophobicContact CB-CZ 4.12Å; R478-F596 HydrophobicContact CG-CZ 4.43Å; R478-F596 WeakPolarHBondContact O-CZ 3.42Å; V481-F596 HydrophobicContact CB-CE2 3.91Å; V481-F596 HydrophobicContact CG1-CD2 4.08Å; V481-F596 HydrophobicContact CG1-CE2 3.67Å; R482-F596 HydrophobicContact CB-CD1 4.05Å; R482-F596 HydrophobicContact CB-CE1 3.76Å; R482-F596 HydrophobicContact CB-CE2 4.46Å; R482-F596 HydrophobicContact CB-CZ 3.98Å; R482-F596 HydrophobicContact CG-CD1 4.18Å; R482-F596 HydrophobicContact CG-CE1 4.24Å; Y485-F596 HydrophobicContact CD1-CB 3.88Å; Y485-F596 HydrophobicContact CD2-CB 4.49Å; Y485-F596 HydrophobicContact CE1-CB 4.25Å; Y485-F596 HydrophobicContact CG-CB 4.03Å; L592-F596 HydrophobicContact CB-CD2 4.25Å; L592-F596 HydrophobicContact CB-CE2 3.83Å; L592-F596 HydrophobicContact CD2-CE2 3.92Å; L592-F596 HydrophobicContact CD2-CZ 4.03Å; L592-F596 HydrophobicContact CG-CE2 4.37Å; L592-F596 WeakPolarHBondContact O-CD2 3.48Å; L592-F596 WeakPolarHBondContact O-CG 3.4Å; L592-F596 PolarHBondContact O-N 2.95Å; Y593-F596 PolarHBondContact O-N 3.13Å; F596-K598 VanDerWaalsContact C-N 3.32Å; F596-K598 PolarHBondContact O-N 3Å; F596-E599 PolarHBondContact O-N 3.29Å; F596-I600 WeakPolarHBondContact O-CB 3.41Å; F596-I600 WeakPolarHBondContact O-CG1 3.32Å; F596-I600 PolarHBondContact O-N 3.05Å
597	E	95.2	Very high	95.1	Very high	55 Å²	55	46.7 Å²	46.7	26%	0.257	23%	0.232	S	C	.	.	H	α-helix	trans	-56.8	-48.7	168.9	-174.3	-177.6	166.8	0	0	110.3	L544 Y593 E599 I600 R601	L544-E597 HydrophobicContact CB-CG 4.13Å; L544-E597 HydrophobicContact CD2-CG 4.27Å; Y593-E597 WeakPolarHBondContact O-CB 3.32Å; Y593-E597 PolarHBondContact O-N 3.2Å; E597-E599 PolarHBondContact O-N 3.05Å; E597-I600 PolarHBondContact O-N 3.35Å; E597-R601 HydrophobicContact CG-CG 4.46Å; E597-R601 WeakPolarHBondContact O-CB 3.38Å; E597-R601 VanDerWaalsContact O-CG 3.3Å; E597-R601 WeakPolarHBondContact O-CG 3.46Å; E597-R601 PolarHBondContact O-N 3.25Å; E597-R601 IonicContact OE1-CZ 2.83Å; E597-R601 IonicContact OE1-NE 3.18Å; E597-R601 PolarHBondContact OE1-NE 3.05Å; E597-R601 IonicContact OE1-NH2 3.86Å; E597-R601 PolarHBondContact OE1-NH2 2.89Å; E597-R601 VanDerWaalsContact OE1-NH2 3.08Å
598	K	95.2	Very high	95.1	Very high	158 Å²	158	46.7 Å²	46.7	69%	0.687	23%	0.232	S	C	*	.	H	α-helix	trans	-61.7	-43.3	178.1	-71.8	176.2	-177.5	-178.8	0	112.3	P594 S595 F596 R601 A602	P594-K598 WeakPolarHBondContact O-CG 3.29Å; P594-K598 PolarHBondContact O-N 3.35Å; S595-K598 PolarHBondContact O-N 3.41Å; F596-K598 VanDerWaalsContact C-N 3.32Å; F596-K598 PolarHBondContact O-N 3Å; K598-R601 PolarHBondContact O-N 3.07Å; K598-A602 PolarHBondContact O-N 2.83Å
599	E	94.2	Very high	95.1	Very high	30 Å²	30	48.5 Å²	48.5	14%	0.14	24%	0.241	C	C	.	.	H	α-helix	trans	-60.4	-47.5	177.8	-167.3	-172.9	136.6	0	0	111.4	R482 S595 F596 E597 A602 K603	R482-E599 WeakPolarHBondContact CD-OE1 3.5Å; R482-E599 IonicContact CZ-OE2 2.79Å; R482-E599 IonicContact NE-OE1 2.75Å; R482-E599 PolarHBondContact NE-OE1 3.01Å; R482-E599 IonicContact NE-OE2 2.76Å; R482-E599 PolarHBondContact NE-OE2 2.89Å; R482-E599 IonicContact NH2-OE2 3.2Å; S595-E599 PolarHBondContact O-N 2.93Å; S595-E599 VanDerWaalsContact O-N 3.16Å; F596-E599 PolarHBondContact O-N 3.29Å; E597-E599 PolarHBondContact O-N 3.05Å; E599-A602 PolarHBondContact O-N 3.34Å; E599-K603 HydrophobicContact CG-CD 4.46Å; E599-K603 PolarHBondContact O-N 2.92Å; E599-K603 IonicContact OE1-NZ 2.66Å; E599-K603 PolarHBondContact OE1-NZ 3.4Å
600	I	95.2	Very high	94.9	Very high	3 Å²	3	46.9 Å²	46.9	2%	0.015	24%	0.238	C	C	.	.	H	α-helix	trans	-65.9	-42	178.8	-70.9	-175.7	0	0	0	111.5	L215 Y485 T486 A489 I520 L544 F596 E597 A602 K603 L604	L215-I600 HydrophobicContact CD1-CG1 4.43Å; Y485-I600 HydrophobicContact CD1-CD1 3.51Å; Y485-I600 HydrophobicContact CE1-CD1 3.76Å; T486-I600 HydrophobicContact CG2-CD1 4.39Å; A489-I600 HydrophobicContact CB-CD1 4Å; I520-I600 HydrophobicContact CD1-CD1 4.1Å; I520-I600 HydrophobicContact CD1-CG2 3.83Å; L544-I600 HydrophobicContact CD1-CG2 3.72Å; L544-I600 HydrophobicContact CD2-CG2 4.48Å; F596-I600 WeakPolarHBondContact O-CB 3.41Å; F596-I600 WeakPolarHBondContact O-CG1 3.32Å; F596-I600 PolarHBondContact O-N 3.05Å; E597-I600 PolarHBondContact O-N 3.35Å; I600-A602 VanDerWaalsContact C-N 3.29Å; I600-A602 PolarHBondContact O-N 2.87Å; I600-K603 PolarHBondContact O-N 3.23Å; I600-L604 HydrophobicContact CG2-CD1 3.63Å; I600-L604 HydrophobicContact CG2-CG 3.99Å; I600-L604 WeakPolarHBondContact O-CB 3.44Å; I600-L604 VanDerWaalsContact O-CG 3.3Å; I600-L604 WeakPolarHBondContact O-CG 3.41Å; I600-L604 PolarHBondContact O-N 3Å
601	R	96.4	Very high	94.8	Very high	58 Å²	58	41.9 Å²	41.9	22%	0.219	22%	0.215	C	C	.	.	H	α-helix	trans	-58	-44	175.9	-74.6	-175.4	174.4	-101.3	4	111.4	Y528 E535 V542 L544 E597 K598 L605	Y528-R601 WeakPolarHBondContact OH-CG 3.18Å; E535-R601 IonicContact OE2-NH1 3.91Å; E535-R601 PolarHBondContact OE2-NH1 3.38Å; V542-R601 PolarHBondContact O-NH2 3.37Å; L544-R601 HydrophobicContact CD1-CG 4.39Å; E597-R601 HydrophobicContact CG-CG 4.46Å; E597-R601 WeakPolarHBondContact O-CB 3.38Å; E597-R601 VanDerWaalsContact O-CG 3.3Å; E597-R601 WeakPolarHBondContact O-CG 3.46Å; E597-R601 PolarHBondContact O-N 3.25Å; E597-R601 IonicContact OE1-CZ 2.83Å; E597-R601 IonicContact OE1-NE 3.18Å; E597-R601 PolarHBondContact OE1-NE 3.05Å; E597-R601 IonicContact OE1-NH2 3.86Å; E597-R601 PolarHBondContact OE1-NH2 2.89Å; E597-R601 VanDerWaalsContact OE1-NH2 3.08Å; K598-R601 PolarHBondContact O-N 3.07Å; R601-L605 WeakPolarHBondContact O-CB 3.37Å; R601-L605 PolarHBondContact O-N 3.25Å
602	A	95.3	Very high	94.8	Very high	60 Å²	60	40.1 Å²	40.1	50%	0.496	21%	0.206	S	C	.	.	H	α-helix	trans	-63.2	-47	177.1	0	0	0	0	0	112	K598 E599 I600 L605 E606	K598-A602 PolarHBondContact O-N 2.83Å; E599-A602 PolarHBondContact O-N 3.34Å; I600-A602 VanDerWaalsContact C-N 3.29Å; I600-A602 PolarHBondContact O-N 2.87Å; A602-L605 WeakPolarHBondContact O-CB 3.41Å; A602-L605 PolarHBondContact O-N 2.8Å; A602-E606 PolarHBondContact O-N 3.38Å
603	K	93.4	Very high	94.8	Very high	54 Å²	54	40.4 Å²	40.4	24%	0.235	21%	0.208	C	C	.	.	H	α-helix	trans	-64.9	-42.7	179.2	-74.7	179	174.1	169	0	113.2	L215 E342 E599 I600 L605 E606 E607	L215-K603 HydrophobicContact CD1-CB 3.62Å; L215-K603 HydrophobicContact CD1-CD 3.98Å; L215-K603 HydrophobicContact CD1-CG 4.42Å; E342-K603 WeakPolarHBondContact OE1-CE 3.44Å; E342-K603 IonicContact OE1-NZ 2.64Å; E342-K603 PolarHBondContact OE1-NZ 3.41Å; E599-K603 HydrophobicContact CG-CD 4.46Å; E599-K603 PolarHBondContact O-N 2.92Å; E599-K603 IonicContact OE1-NZ 2.66Å; E599-K603 PolarHBondContact OE1-NZ 3.4Å; I600-K603 PolarHBondContact O-N 3.23Å; K603-L605 VanDerWaalsContact C-N 3.28Å; K603-L605 PolarHBondContact O-N 3.42Å; K603-E606 PolarHBondContact O-N 3.27Å; K603-E607 WeakPolarHBondContact O-CB 3.27Å; K603-E607 WeakPolarHBondContact O-CG 3.47Å; K603-E607 PolarHBondContact O-N 3.4Å
604	L	96.1	Very high	94.7	Very high	1 Å²	1	45 Å²	45	1%	0.005	23%	0.228	C	C	.	.	H	α-helix	trans	-63.8	-36	176	-71.7	175.4	0	0	0	111.7	L215 I520 L523 Y528 L544 I600 A608	L215-L604 HydrophobicContact CB-CD2 4.07Å; I520-L604 HydrophobicContact CB-CD1 4.24Å; I520-L604 HydrophobicContact CB-CD2 4.4Å; I520-L604 HydrophobicContact CG2-CD1 4.01Å; L523-L604 HydrophobicContact CD1-CD1 3.95Å; L523-L604 HydrophobicContact CD1-CD2 4.05Å; Y528-L604 HydrophobicContact CD1-CB 3.46Å; Y528-L604 VanDerWaalsContact CD1-CB 3.46Å; Y528-L604 WeakPolarHBondContact CD1-O 3.25Å; Y528-L604 HydrophobicContact CD2-CB 4.23Å; Y528-L604 HydrophobicContact CD2-CD1 4.18Å; Y528-L604 HydrophobicContact CE1-CB 3.51Å; Y528-L604 HydrophobicContact CE2-CB 4.29Å; Y528-L604 HydrophobicContact CE2-CD1 4.03Å; Y528-L604 HydrophobicContact CG-CB 3.83Å; L544-L604 HydrophobicContact CD1-CD1 4.24Å; I600-L604 HydrophobicContact CG2-CD1 3.63Å; I600-L604 HydrophobicContact CG2-CG 3.99Å; I600-L604 WeakPolarHBondContact O-CB 3.44Å; I600-L604 VanDerWaalsContact O-CG 3.3Å; I600-L604 WeakPolarHBondContact O-CG 3.41Å; I600-L604 PolarHBondContact O-N 3Å; L604-A608 WeakPolarHBondContact O-CB 3.46Å; L604-A608 PolarHBondContact O-N 2.83Å
605	L	96.6	Very high	94.6	Very high	49 Å²	49	49.3 Å²	49.3	26%	0.257	24%	0.238	S	C	.	.	H	α-helix	trans	-66.4	-48.4	174.9	-177.7	59.9	0	0	0	111.1	Y528 L529 V532 R601 A602 K603 E607 A608 Q609	Y528-L605 HydrophobicContact CD1-CB 4.41Å; Y528-L605 HydrophobicContact CE1-CB 4.06Å; L529-L605 HydrophobicContact CD1-CD1 3.73Å; V532-L605 HydrophobicContact CG2-CD1 4.33Å; R601-L605 WeakPolarHBondContact O-CB 3.37Å; R601-L605 PolarHBondContact O-N 3.25Å; A602-L605 WeakPolarHBondContact O-CB 3.41Å; A602-L605 PolarHBondContact O-N 2.8Å; K603-L605 VanDerWaalsContact C-N 3.28Å; K603-L605 PolarHBondContact O-N 3.42Å; L605-E607 VanDerWaalsContact C-N 3.33Å; L605-E607 PolarHBondContact O-N 2.98Å; L605-A608 PolarHBondContact O-N 3.04Å; L605-Q609 HydrophobicContact CD1-CG 3.99Å; L605-Q609 HydrophobicContact CG-CG 4.32Å; L605-Q609 WeakPolarHBondContact O-CB 3.42Å; L605-Q609 VanDerWaalsContact O-CG 3.3Å; L605-Q609 WeakPolarHBondContact O-CG 3.4Å; L605-Q609 PolarHBondContact O-N 2.75Å
606	E	93.6	Very high	94.6	Very high	109 Å²	109	47.2 Å²	47.2	51%	0.509	22%	0.223	S	C	.	.	H	α-helix	trans	-56.5	-46.4	176.5	-175.4	-176	173.2	0	0	111.2	K286 A602 K603 Q609 S610	K286-E606 IonicContact NZ-OE1 3.22Å; A602-E606 PolarHBondContact O-N 3.38Å; K603-E606 PolarHBondContact O-N 3.27Å; E606-Q609 PolarHBondContact O-N 3.38Å; E606-S610 VanDerWaalsContact O-CB 3.26Å; E606-S610 WeakPolarHBondContact O-CB 3.39Å; E606-S610 PolarHBondContact O-N 2.96Å
607	E	93.3	Very high	94.5	Very high	30 Å²	30	47.5 Å²	47.5	14%	0.14	23%	0.226	C	C	.	.	H	α-helix	trans	-61.6	-46.1	178.4	-76.1	179.6	-171.3	0	0	112.5	C214 L215 S216 Q218 K603 L605 S610 F611	C214-E607 WeakPolarHBondContact CA-OE1 3.39Å; C214-E607 HydrophobicContact CB-CG 4.49Å; L215-E607 PolarHBondContact N-OE1 2.91Å; L215-E607 PolarHBondContact N-OE2 3.46Å; S216-E607 WeakPolarHBondContact CB-OE2 3.35Å; S216-E607 PolarHBondContact N-OE2 3.44Å; S216-E607 PolarHBondContact OG-OE2 3.05Å; Q218-E607 HydrophobicContact CG-CB 4.02Å; Q218-E607 PolarHBondContact OE1-O 2.88Å; K603-E607 WeakPolarHBondContact O-CB 3.27Å; K603-E607 WeakPolarHBondContact O-CG 3.47Å; K603-E607 PolarHBondContact O-N 3.4Å; L605-E607 VanDerWaalsContact C-N 3.33Å; L605-E607 PolarHBondContact O-N 2.98Å; E607-S610 PolarHBondContact O-N 2.78Å; E607-F611 PolarHBondContact O-N 3.06Å
608	A	95.5	Very high	94.5	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-69.9	-38.7	-179.7	0	0	0	0	0	112.4	L529 L604 L605 F611 V612	L529-A608 HydrophobicContact CB-CB 3.88Å; L604-A608 WeakPolarHBondContact O-CB 3.46Å; L604-A608 PolarHBondContact O-N 2.83Å; L605-A608 PolarHBondContact O-N 3.04Å; A608-F611 PolarHBondContact O-N 2.81Å; A608-V612 PolarHBondContact O-N 3.29Å
609	Q	95.7	Very high	94.4	Very high	38 Å²	38	43.7 Å²	43.7	18%	0.178	21%	0.212	C	C	.	.	H	α-helix	trans	-64.1	-44.2	173.5	-74.1	177.8	-29	0	0	111	L529 L605 E606 F611 V612 L613 Y830 V831	L529-Q609 HydrophobicContact CD1-CG 4.08Å; L529-Q609 HydrophobicContact CD2-CG 4.38Å; L605-Q609 HydrophobicContact CD1-CG 3.99Å; L605-Q609 HydrophobicContact CG-CG 4.32Å; L605-Q609 WeakPolarHBondContact O-CB 3.42Å; L605-Q609 VanDerWaalsContact O-CG 3.3Å; L605-Q609 WeakPolarHBondContact O-CG 3.4Å; L605-Q609 PolarHBondContact O-N 2.75Å; E606-Q609 PolarHBondContact O-N 3.38Å; Q609-F611 PolarHBondContact O-N 3.27Å; Q609-V612 PolarHBondContact O-N 3.2Å; Q609-V612 VanDerWaalsContact O-N 3.11Å; Q609-L613 WeakPolarHBondContact O-CB 3.43Å; Q609-L613 WeakPolarHBondContact O-CD1 3.31Å; Q609-L613 VanDerWaalsContact O-CG 3.25Å; Q609-L613 WeakPolarHBondContact O-CG 3.48Å; Q609-L613 PolarHBondContact O-N 3.36Å; Q609-Y830 PolarHBondContact NE2-O 3.38Å; Q609-V831 HydrophobicContact CB-CG1 4.18Å; Q609-V831 HydrophobicContact CG-CG1 4.25Å
610	S	91.6	Very high	94.5	Very high	44 Å²	44	42.3 Å²	42.3	31%	0.308	21%	0.205	S	C	.	.	H	α-helix	trans	-56.4	-38.4	176.8	-172.2	0	0	0	0	112.2	E606 E607 K614	E606-S610 VanDerWaalsContact O-CB 3.26Å; E606-S610 WeakPolarHBondContact O-CB 3.39Å; E606-S610 PolarHBondContact O-N 2.96Å; E607-S610 PolarHBondContact O-N 2.78Å; S610-K614 WeakPolarHBondContact O-CB 3.18Å; S610-K614 VanDerWaalsContact O-CG 3.29Å; S610-K614 WeakPolarHBondContact O-CG 3.27Å; S610-K614 PolarHBondContact O-N 2.9Å
611	F	93.2	Very high	94.5	Very high	30 Å²	30	45.4 Å²	45.4	13%	0.132	22%	0.22	C	C	.	.	H	α-helix	trans	-64.6	-46.7	175	177.3	-91.2	0	0	0	113	Q218 R525 D526 E607 A608 Q609 L613 K614 R615	Q218-F611 VanDerWaalsContact OE1-CB 3.23Å; R525-F611 HydrophobicContact CB-CD1 3.81Å; R525-F611 HydrophobicContact CB-CD2 4.12Å; R525-F611 HydrophobicContact CB-CE1 3.62Å; R525-F611 HydrophobicContact CB-CE2 3.93Å; R525-F611 HydrophobicContact CB-CG 4.07Å; R525-F611 HydrophobicContact CB-CZ 3.68Å; R525-F611 HydrophobicContact CG-CD2 4.19Å; R525-F611 HydrophobicContact CG-CE1 4.14Å; R525-F611 HydrophobicContact CG-CE2 3.68Å; R525-F611 HydrophobicContact CG-CZ 3.66Å; D526-F611 HydrophobicContact CB-CD1 4.09Å; D526-F611 HydrophobicContact CB-CE1 4.45Å; E607-F611 PolarHBondContact O-N 3.06Å; A608-F611 PolarHBondContact O-N 2.81Å; Q609-F611 PolarHBondContact O-N 3.27Å; F611-L613 VanDerWaalsContact C-N 3.34Å; F611-K614 PolarHBondContact O-N 2.87Å; F611-R615 PolarHBondContact O-N 3.34Å
612	V	94.9	Very high	94.4	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-63	-43.9	177.8	173.8	0	0	0	0	110.8	D526 L529 A608 Q609 K614 R615 C616 N825 L827 V831	D526-V612 HydrophobicContact CB-CG2 3.74Å; L529-V612 HydrophobicContact CD2-CB 4.44Å; L529-V612 HydrophobicContact CD2-CG2 3.81Å; A608-V612 PolarHBondContact O-N 3.29Å; Q609-V612 PolarHBondContact O-N 3.2Å; Q609-V612 VanDerWaalsContact O-N 3.11Å; V612-K614 PolarHBondContact O-N 3.28Å; V612-R615 WeakPolarHBondContact O-CB 3.39Å; V612-R615 PolarHBondContact O-N 2.89Å; V612-R615 VanDerWaalsContact O-N 3.11Å; V612-C616 PolarHBondContact O-N 3.35Å; V612-C616 PolarHBondContact O-SG 2.82Å; V612-C616 VanDerWaalsContact O-SG 3.36Å; V612-N825 HydrophobicContact CG1-CB 4.3Å; V612-L827 HydrophobicContact CG1-CB 4.2Å; V612-L827 HydrophobicContact CG2-CB 4.35Å; V612-L827 HydrophobicContact CG2-CD1 4.35Å; V612-V831 HydrophobicContact CB-CG1 3.82Å; V612-V831 HydrophobicContact CG1-CG1 3.71Å
613	L	95.3	Very high	94.4	Very high	7 Å²	7	44.7 Å²	44.7	4%	0.037	21%	0.211	C	C	.	.	H	α-helix	trans	-54.4	-51	174.9	-79	167.3	0	0	0	112	Q609 F611 R615 C616 A617 V831 E835 L836 L839	Q609-L613 WeakPolarHBondContact O-CB 3.43Å; Q609-L613 WeakPolarHBondContact O-CD1 3.31Å; Q609-L613 VanDerWaalsContact O-CG 3.25Å; Q609-L613 WeakPolarHBondContact O-CG 3.48Å; Q609-L613 PolarHBondContact O-N 3.36Å; F611-L613 VanDerWaalsContact C-N 3.34Å; L613-R615 VanDerWaalsContact C-N 3.26Å; L613-R615 PolarHBondContact O-N 3.34Å; L613-C616 WeakPolarHBondContact O-CB 3.19Å; L613-C616 PolarHBondContact O-N 3.45Å; L613-C616 VanDerWaalsContact O-N 3.16Å; L613-A617 PolarHBondContact O-N 3.28Å; L613-V831 HydrophobicContact CD2-CB 3.98Å; L613-V831 HydrophobicContact CD2-CG2 3.77Å; L613-V831 HydrophobicContact CG-CB 3.97Å; L613-V831 HydrophobicContact CG-CG1 4.15Å; L613-V831 HydrophobicContact CG-CG2 4.22Å; L613-E835 HydrophobicContact CD1-CB 4.22Å; L613-E835 HydrophobicContact CD1-CG 3.48Å; L613-E835 VanDerWaalsContact CD1-CG 3.48Å; L613-E835 HydrophobicContact CD2-CB 4.4Å; L613-E835 HydrophobicContact CD2-CG 4.2Å; L613-E835 HydrophobicContact CG-CG 4.47Å; L613-L836 HydrophobicContact CD2-CB 3.59Å; L613-L836 HydrophobicContact CD2-CD1 4.06Å; L613-L836 HydrophobicContact CD2-CG 4.43Å; L613-L839 HydrophobicContact CB-CD1 3.75Å; L613-L839 HydrophobicContact CD2-CD1 4.45Å
614	K	92.3	Very high	94.5	Very high	126 Å²	126	42.2 Å²	42.2	55%	0.548	20%	0.2	S	C	.	.	H	α-helix	trans	-60.2	-35.2	175.9	-74.2	172.7	-177.9	178.3	0	112.7	S610 F611 V612 A617 A618	S610-K614 WeakPolarHBondContact O-CB 3.18Å; S610-K614 VanDerWaalsContact O-CG 3.29Å; S610-K614 WeakPolarHBondContact O-CG 3.27Å; S610-K614 PolarHBondContact O-N 2.9Å; F611-K614 PolarHBondContact O-N 2.87Å; V612-K614 PolarHBondContact O-N 3.28Å; K614-A617 PolarHBondContact O-N 3.21Å; K614-A618 WeakPolarHBondContact O-CB 3.34Å; K614-A618 PolarHBondContact O-N 2.95Å
615	R	93.2	Very high	94.5	Very high	138 Å²	138	47.3 Å²	47.3	52%	0.521	22%	0.219	S	C	.	.	H	α-helix	trans	-72.8	-33.6	177.3	-173.6	168.8	140	94.5	-3.2	112.4	F611 V612 L613 R619 N825	F611-R615 PolarHBondContact O-N 3.34Å; V612-R615 WeakPolarHBondContact O-CB 3.39Å; V612-R615 PolarHBondContact O-N 2.89Å; V612-R615 VanDerWaalsContact O-N 3.11Å; L613-R615 VanDerWaalsContact C-N 3.26Å; L613-R615 PolarHBondContact O-N 3.34Å; R615-R619 WeakPolarHBondContact O-CB 3.37Å; R615-R619 PolarHBondContact O-N 3.09Å; R615-R619 VanDerWaalsContact O-N 3.07Å; R615-N825 PolarHBondContact NE-ND2 3.24Å; R615-N825 VanDerWaalsContact NE-ND2 3.14Å
616	C	95.3	Very high	94.4	Very high	0 Å²	0	47 Å²	47	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-64.8	-46.9	169.7	-65.1	0	0	0	0	111.1	V612 L613 R619 M620 F824 N825 L836	V612-C616 PolarHBondContact O-N 3.35Å; V612-C616 PolarHBondContact O-SG 2.82Å; V612-C616 VanDerWaalsContact O-SG 3.36Å; L613-C616 WeakPolarHBondContact O-CB 3.19Å; L613-C616 PolarHBondContact O-N 3.45Å; L613-C616 VanDerWaalsContact O-N 3.16Å; C616-R619 WeakPolarHBondContact O-CB 3.38Å; C616-R619 PolarHBondContact O-N 3.49Å; C616-R619 VanDerWaalsContact O-N 3.13Å; C616-M620 PolarHBondContact O-N 3.42Å; C616-F824 HydrophobicContact CB-CB 3.8Å; C616-F824 HydrophobicContact CB-CG 4.42Å; C616-N825 WeakPolarHBondContact SG-CB 3.46Å; C616-L836 HydrophobicContact CB-CD1 3.49Å; C616-L836 VanDerWaalsContact CB-CD1 3.49Å
617	A	94.1	Very high	94.3	Very high	7 Å²	7	42 Å²	42	6%	0.058	20%	0.196	C	C	.	.	H	α-helix	trans	-59.6	-47.1	175.9	0	0	0	0	0	111.7	L613 K614 R619 M620 Q621 L839 E843	L613-A617 PolarHBondContact O-N 3.28Å; K614-A617 PolarHBondContact O-N 3.21Å; A617-R619 PolarHBondContact O-N 3.45Å; A617-M620 CarbonylContact O-C 3.54Å; A617-M620 WeakPolarHBondContact O-CA 3.17Å; A617-M620 WeakPolarHBondContact O-CB 3.41Å; A617-M620 PolarHBondContact O-N 3.48Å; A617-Q621 PolarHBondContact O-N 3.36Å; A617-L839 HydrophobicContact CB-CB 4.18Å; A617-E843 HydrophobicContact CB-CG 4.29Å
618	A	93.9	Very high	94.2	Very high	34 Å²	34	42.9 Å²	42.9	28%	0.281	21%	0.205	S	C	.	.	H	α-helix	trans	-58.8	-35.4	175.1	0	0	0	0	0	112.6	K614 Q621 D622	K614-A618 WeakPolarHBondContact O-CB 3.34Å; K614-A618 PolarHBondContact O-N 2.95Å; A618-Q621 WeakPolarHBondContact O-CB 3.49Å; A618-Q621 PolarHBondContact O-N 2.89Å; A618-D622 VanDerWaalsContact O-CG 3.32Å; A618-D622 PolarHBondContact O-N 3.09Å
619	R	94.4	Very high	93.8	Very high	100 Å²	100	44 Å²	44	38%	0.377	21%	0.21	S	C	.	.	H	α-helix	trans	-66.3	-39.4	175	-176.2	60.2	176.5	144.8	0.4	111.9	R615 C616 A617 Y623 F824	R615-R619 WeakPolarHBondContact O-CB 3.37Å; R615-R619 PolarHBondContact O-N 3.09Å; R615-R619 VanDerWaalsContact O-N 3.07Å; C616-R619 WeakPolarHBondContact O-CB 3.38Å; C616-R619 PolarHBondContact O-N 3.49Å; C616-R619 VanDerWaalsContact O-N 3.13Å; A617-R619 PolarHBondContact O-N 3.45Å; R619-Y623 HydrophobicContact CG-CE2 4.12Å; R619-Y623 PolarHBondContact NE-OH 3.43Å; R619-Y623 VanDerWaalsContact NE-OH 3.16Å; R619-Y623 VanDerWaalsContact NH2-CE1 3.31Å; R619-Y623 PolarHBondContact NH2-OH 2.93Å; R619-Y623 WeakPolarHBondContact O-CD2 3.33Å; R619-Y623 PolarHBondContact O-N 2.96Å; R619-F824 HydrophobicContact CB-CB 4.38Å; R619-F824 HydrophobicContact CG-CB 4.41Å; R619-F824 HydrophobicContact CG-CD1 4.34Å
620	M	96.1	Very high	92.9	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-65.9	-44.7	172.7	-177.3	57.6	76.9	0	0	111.2	C616 A617 D622 Y623 L624 F809 I819 F824 I840 E843 F844	C616-M620 PolarHBondContact O-N 3.42Å; A617-M620 CarbonylContact O-C 3.54Å; A617-M620 WeakPolarHBondContact O-CA 3.17Å; A617-M620 WeakPolarHBondContact O-CB 3.41Å; A617-M620 PolarHBondContact O-N 3.48Å; M620-D622 VanDerWaalsContact C-N 3.28Å; M620-D622 PolarHBondContact O-N 3.15Å; M620-Y623 WeakPolarHBondContact O-CA 3.18Å; M620-Y623 WeakPolarHBondContact O-CB 3.49Å; M620-Y623 PolarHBondContact O-N 3.05Å; M620-Y623 HydrophobicContact SD-CD2 4.33Å; M620-L624 HydrophobicContact CG-CD1 3.86Å; M620-L624 HydrophobicContact CG-CG 4.1Å; M620-L624 WeakPolarHBondContact O-CG 3.45Å; M620-L624 PolarHBondContact O-N 3.13Å; M620-L624 HydrophobicContact SD-CD1 4.16Å; M620-L624 HydrophobicContact SD-CD2 4.21Å; M620-L624 HydrophobicContact SD-CG 3.94Å; M620-F809 HydrophobicContact CE-CD1 4.38Å; M620-F809 HydrophobicContact SD-CD1 4.36Å; M620-I819 HydrophobicContact CE-CD1 3.69Å; M620-I819 HydrophobicContact CE-CG1 3.86Å; M620-F824 HydrophobicContact CE-CE1 3.39Å; M620-F824 HydrophobicContact CE-CZ 3.46Å; M620-F824 VanDerWaalsContact CE-CZ 3.46Å; M620-I840 HydrophobicContact CB-CD1 3.64Å; M620-I840 HydrophobicContact CE-CD1 4.36Å; M620-I840 HydrophobicContact CE-CG2 3.72Å; M620-I840 HydrophobicContact CG-CD1 4.27Å; M620-I840 HydrophobicContact CG-CG2 4.24Å; M620-E843 HydrophobicContact CG-CB 4.13Å; M620-F844 HydrophobicContact CE-CE2 4.04Å; M620-F844 HydrophobicContact CE-CZ 4.26Å; M620-F844 HydrophobicContact CG-CE2 4.28Å; M620-F844 HydrophobicContact SD-CE2 4.08Å; M620-F844 HydrophobicContact SD-CZ 4.1Å
621	Q	94.7	Very high	91.5	Very high	68 Å²	68	47.8 Å²	47.8	32%	0.318	23%	0.233	S	C	.	.	H	α-helix	trans	-53.1	-45.7	174.8	-171.3	-177.1	42.3	0	0	111.6	A617 A618 Y623 L624 R625 E843	A617-Q621 PolarHBondContact O-N 3.36Å; A618-Q621 WeakPolarHBondContact O-CB 3.49Å; A618-Q621 PolarHBondContact O-N 2.89Å; Q621-Y623 VanDerWaalsContact C-N 3.26Å; Q621-Y623 PolarHBondContact O-N 3.32Å; Q621-L624 PolarHBondContact O-N 2.85Å; Q621-R625 VanDerWaalsContact O-CB 3.25Å; Q621-R625 WeakPolarHBondContact O-CB 3.39Å; Q621-R625 PolarHBondContact O-N 3.36Å; Q621-E843 HydrophobicContact CB-CG 4.33Å; Q621-E843 WeakPolarHBondContact CB-OE2 3.3Å; Q621-E843 WeakPolarHBondContact CG-OE2 3.26Å
622	D	94.3	Very high	89.6	Confident	81 Å²	81	51.2 Å²	51.2	43%	0.433	25%	0.252	S	S	.	.	H	α-helix	trans	-59.5	-35.2	176.3	-72.3	-21.8	0	0	0	112.5	A618 M620	A618-D622 VanDerWaalsContact O-CG 3.32Å; A618-D622 PolarHBondContact O-N 3.09Å; M620-D622 VanDerWaalsContact C-N 3.28Å; M620-D622 PolarHBondContact O-N 3.15Å
623	Y	95.2	Very high	87.4	Confident	23 Å²	23	57.5 Å²	57.5	9%	0.09	29%	0.292	C	S	.	.	H	α-helix	trans	-71.9	-44.5	176	-65.8	-37.2	0	0	0	112.2	R619 M620 Q621 R625 V626 F809 F824	R619-Y623 HydrophobicContact CG-CE2 4.12Å; R619-Y623 PolarHBondContact NE-OH 3.43Å; R619-Y623 VanDerWaalsContact NE-OH 3.16Å; R619-Y623 VanDerWaalsContact NH2-CE1 3.31Å; R619-Y623 PolarHBondContact NH2-OH 2.93Å; R619-Y623 WeakPolarHBondContact O-CD2 3.33Å; R619-Y623 PolarHBondContact O-N 2.96Å; M620-Y623 WeakPolarHBondContact O-CA 3.18Å; M620-Y623 WeakPolarHBondContact O-CB 3.49Å; M620-Y623 PolarHBondContact O-N 3.05Å; M620-Y623 HydrophobicContact SD-CD2 4.33Å; Q621-Y623 VanDerWaalsContact C-N 3.26Å; Q621-Y623 PolarHBondContact O-N 3.32Å; Y623-R625 VanDerWaalsContact C-N 3.3Å; Y623-R625 PolarHBondContact O-N 2.89Å; Y623-V626 PolarHBondContact O-N 3.07Å; Y623-F809 HydrophobicContact CD1-CZ 4.35Å; Y623-F809 AromaticContact CD2-CE1 3.96Å; Y623-F809 HydrophobicContact CD2-CE1 3.96Å; Y623-F809 HydrophobicContact CD2-CE2 4.34Å; Y623-F809 AromaticContact CD2-CZ 3.64Å; Y623-F809 HydrophobicContact CD2-CZ 3.64Å; Y623-F809 HydrophobicContact CE2-CE1 4.4Å; Y623-F809 HydrophobicContact CE2-CZ 4.2Å; Y623-F809 HydrophobicContact CG-CE1 4.47Å; Y623-F809 HydrophobicContact CG-CE2 4.05Å; Y623-F809 AromaticContact CG-CZ 3.73Å; Y623-F809 HydrophobicContact CG-CZ 3.73Å; Y623-F824 HydrophobicContact CE2-CD1 4.42Å; Y623-F824 HydrophobicContact CE2-CE1 4.43Å
624	L	96.3	Very high	85.1	Confident	1 Å²	1	60.9 Å²	60.9	1%	0.005	33%	0.329	C	S	.	.	H	α-helix	trans	-77	-17.5	-176.6	-59.7	-175.1	0	0	0	112.9	M620 Q621 V626 L806 F809 E843 F844 R847 R1018	M620-L624 HydrophobicContact CG-CD1 3.86Å; M620-L624 HydrophobicContact CG-CG 4.1Å; M620-L624 WeakPolarHBondContact O-CG 3.45Å; M620-L624 PolarHBondContact O-N 3.13Å; M620-L624 HydrophobicContact SD-CD1 4.16Å; M620-L624 HydrophobicContact SD-CD2 4.21Å; M620-L624 HydrophobicContact SD-CG 3.94Å; Q621-L624 PolarHBondContact O-N 2.85Å; L624-V626 PolarHBondContact O-N 3.12Å; L624-L806 HydrophobicContact CD1-CD1 4.26Å; L624-L806 HydrophobicContact CD2-CD1 3.88Å; L624-F809 HydrophobicContact CD2-CB 4.05Å; L624-F809 HydrophobicContact CD2-CD2 4.25Å; L624-F809 HydrophobicContact CD2-CG 4.39Å; L624-E843 HydrophobicContact CD1-CB 4.14Å; L624-F844 HydrophobicContact CD1-CD1 3.95Å; L624-F844 HydrophobicContact CD1-CD2 4.25Å; L624-F844 HydrophobicContact CD1-CE1 4.13Å; L624-F844 HydrophobicContact CD1-CE2 4.42Å; L624-F844 HydrophobicContact CD1-CG 4.02Å; L624-F844 HydrophobicContact CD1-CZ 4.39Å; L624-F844 HydrophobicContact CD2-CD1 4.36Å; L624-F844 HydrophobicContact CD2-CE1 3.91Å; L624-F844 HydrophobicContact CD2-CZ 4.35Å; L624-R847 HydrophobicContact CB-CB 4.21Å; L624-R847 HydrophobicContact CB-CG 3.97Å; L624-R847 HydrophobicContact CD1-CB 4.38Å; L624-R847 WeakPolarHBondContact O-CD 3.33Å; L624-R847 WeakPolarHBondContact O-CG 3.27Å; L624-R1018 WeakPolarHBondContact O-CD 3.35Å
625	R	95	Very high	82.7	Confident	109 Å²	109	58 Å²	58	41%	0.411	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-15.8	174.7	-168.7	172.6	-171.3	-156.5	0.1	113.1	Q621 Y623 R1018 E1019	Q621-R625 VanDerWaalsContact O-CB 3.25Å; Q621-R625 WeakPolarHBondContact O-CB 3.39Å; Q621-R625 PolarHBondContact O-N 3.36Å; Y623-R625 VanDerWaalsContact C-N 3.3Å; Y623-R625 PolarHBondContact O-N 2.89Å; R625-R1018 VanDerWaalsContact O-CB 3.27Å; R625-R1018 WeakPolarHBondContact O-CB 3.48Å; R625-E1019 HydrophobicContact CG-CG 4.19Å; R625-E1019 IonicContact CZ-OE1 2.68Å; R625-E1019 IonicContact NE-OE1 2.58Å; R625-E1019 PolarHBondContact NE-OE1 3.4Å; R625-E1019 IonicContact NH1-OE1 3.45Å; R625-E1019 PolarHBondContact NH1-OE1 3.41Å; R625-E1019 VanDerWaalsContact NH1-OE1 3.14Å; R625-E1019 IonicContact NH2-OE1 3.74Å; R625-E1019 PolarHBondContact NH2-OE1 3.1Å; R625-E1019 PolarHBondContact O-N 3.06Å
626	V	94.3	Very high	80.3	Confident	42 Å²	42	55.4 Å²	55.4	26%	0.255	33%	0.328	S	S	.	.	B	Isolated β-bridge	trans	-81.4	125.8	175.9	-176.2	0	0	0	0	109.3	Y623 L624 P805 R1018 F1021	Y623-V626 PolarHBondContact O-N 3.07Å; L624-V626 PolarHBondContact O-N 3.12Å; V626-P805 HydrophobicContact CB-CG 4.21Å; V626-P805 HydrophobicContact CG1-CG 4.23Å; V626-R1018 PolarHBondContact O-NH1 3.39Å; V626-F1021 HydrophobicContact CG1-CB 4.33Å; V626-F1021 HydrophobicContact CG1-CD2 4.26Å
627	G	91.6	Very high	77.7	Confident	3 Å²	3	62.2 Å²	62.2	3%	0.031	36%	0.36	C	S	.	.			trans	-83.4	175.3	176.6	0	0	0	0	0	113.2	E1019	G627-E1019 PolarHBondContact N-O 3.47Å
628	P	91.2	Very high	75.1	Confident	50 Å²	50	66.9 Å²	66.9	33%	0.325	38%	0.384	S	S	.	.			trans	-53.2	148.2	174.6	-29.8	40.2	0	0	0	112.5	S630 N803 D804	P628-S630 PolarHBondContact O-N 3.35Å; P628-N803 VanDerWaalsContact CA-O 3.22Å; P628-N803 WeakPolarHBondContact CA-O 3.43Å; P628-N803 WeakPolarHBondContact CB-O 3.35Å; P628-D804 HydrophobicContact CG-CB 4.4Å
629	Y	87.6	Confident	72.8	Confident	24 Å²	24	68.6 Å²	68.6	9%	0.094	39%	0.388	C	S	.	.			trans	-65.3	125	170.1	-176.5	-87.2	0	0	0	110.4	L631 I712 V713 L802 F1021	Y629-L631 HydrophobicContact CE1-CD2 4.02Å; Y629-L631 HydrophobicContact CE1-CG 4.33Å; Y629-I712 HydrophobicContact CD1-CD1 4Å; Y629-I712 HydrophobicContact CD1-CG1 4.48Å; Y629-I712 HydrophobicContact CE1-CD1 4.22Å; Y629-I712 HydrophobicContact CE1-CG1 4.38Å; Y629-V713 HydrophobicContact CD1-CB 4.14Å; Y629-V713 HydrophobicContact CD1-CG1 3.8Å; Y629-V713 HydrophobicContact CD2-CG2 4.43Å; Y629-V713 HydrophobicContact CE1-CB 3.64Å; Y629-V713 HydrophobicContact CE1-CG1 3.83Å; Y629-V713 HydrophobicContact CE1-CG2 4.19Å; Y629-V713 HydrophobicContact CE2-CB 4.25Å; Y629-V713 HydrophobicContact CE2-CG2 3.87Å; Y629-V713 HydrophobicContact CG-CG1 4.16Å; Y629-L802 VanDerWaalsContact CB-O 3.27Å; Y629-L802 WeakPolarHBondContact CB-O 3.45Å; Y629-L802 HydrophobicContact CD2-CD1 4Å; Y629-L802 HydrophobicContact CD2-CD2 4.38Å; Y629-L802 HydrophobicContact CD2-CG 4.23Å; Y629-L802 HydrophobicContact CG-CD1 4.39Å; Y629-L802 HydrophobicContact CG-CG 4.21Å; Y629-L802 PolarHBondContact N-O 3.29Å; Y629-L802 VanDerWaalsContact N-O 3.08Å; Y629-F1021 HydrophobicContact CD2-CB 4.29Å; Y629-F1021 AromaticContact CD2-CD1 3.67Å; Y629-F1021 HydrophobicContact CD2-CD1 3.67Å; Y629-F1021 HydrophobicContact CD2-CE1 4.3Å; Y629-F1021 HydrophobicContact CD2-CG 4.12Å; Y629-F1021 HydrophobicContact CE2-CD1 4.01Å; Y629-F1021 HydrophobicContact CE2-CE1 4.43Å
630	S	75.7	Confident	70.4	Confident	74 Å²	74	71.1 Å²	71.1	52%	0.517	41%	0.409	S	S	.	.			trans	-130.8	134.5	175.3	178.8	0	0	0	0	110.5	P628 L632	P628-S630 PolarHBondContact O-N 3.35Å; S630-L632 VanDerWaalsContact C-N 3.32Å; S630-L632 PolarHBondContact O-N 3.16Å
631	L	63.5	Low	68	Low	87 Å²	87	76 Å²	76	46%	0.455	44%	0.439	S	S	.	.	S	Bend	trans	-68.3	-28.7	-178.7	-77.9	173.8	0	0	0	113.3	Y629 I712	Y629-L631 HydrophobicContact CE1-CD2 4.02Å; Y629-L631 HydrophobicContact CE1-CG 4.33Å; L631-I712 HydrophobicContact CD1-CB 3.73Å; L631-I712 HydrophobicContact CD1-CG2 3.68Å; L631-I712 HydrophobicContact CD2-CB 4.16Å; L631-I712 HydrophobicContact CG-CB 4.02Å; L631-I712 HydrophobicContact CG-CD1 4.34Å; L631-I712 HydrophobicContact CG-CG2 4.47Å
632	L	53.7	Low	65.9	Low	102 Å²	102	75.2 Å²	75.2	53%	0.534	44%	0.437	S	S	.	.			trans	-129.5	109.1	-170.4	-71.4	167.4	0	0	0	110.4	S630 G634 S635	S630-L632 VanDerWaalsContact C-N 3.32Å; S630-L632 PolarHBondContact O-N 3.16Å; L632-G634 PolarHBondContact O-N 3.22Å; L632-S635 WeakPolarHBondContact CB-OG 3.47Å; L632-S635 VanDerWaalsContact CD1-OG 3.3Å; L632-S635 WeakPolarHBondContact CD1-OG 3.31Å
633	P	48.6	Very low	64	Low	131 Å²	131	76.9 Å²	76.9	85%	0.851	45%	0.446	S	S	*	.	S	Bend	trans	-70.5	100.4	165.9	27	-28.7	0	0	0	108.7
634	G	46.1	Very low	62.6	Low	79 Å²	79	83.9 Å²	83.9	81%	0.814	48%	0.477	S	S	*	.	S	Bend	trans	95.7	12	165.7	0	0	0	0	0	117.5	L632	L632-G634 PolarHBondContact O-N 3.22Å
635	S	42.1	Very low	61.6	Low	64 Å²	64	85.3 Å²	85.3	45%	0.448	48%	0.483	S	S	.	.			trans	-67.3	140.6	156.7	55.7	0	0	0	0	108	L632 Q637	L632-S635 WeakPolarHBondContact CB-OG 3.47Å; L632-S635 VanDerWaalsContact CD1-OG 3.3Å; L632-S635 WeakPolarHBondContact CD1-OG 3.31Å; S635-Q637 PolarHBondContact O-N 3.23Å
636	S	42.1	Very low	61.5	Low	85 Å²	85	81.4 Å²	81.4	59%	0.594	47%	0.47	S	S	*	.			trans	-37.4	138.6	163.3	-42.7	0	0	0	0	109	D638	S636-D638 PolarHBondContact O-N 3.32Å
637	Q	41.6	Very low	61.5	Low	143 Å²	143	79.5 Å²	79.5	67%	0.668	46%	0.459	S	S	*	.			trans	-65	68.6	166.2	-69.2	171.5	-14.6	0	0	107.4	S635 D639	S635-Q637 PolarHBondContact O-N 3.23Å; Q637-D639 PolarHBondContact O-N 2.83Å
638	D	39	Very low	61.7	Low	105 Å²	105	79.3 Å²	79.3	56%	0.561	46%	0.457	S	S	*	.			trans	-68	95	168.6	-72.9	-20.7	0	0	0	104.5	S636 D640 V641	S636-D638 PolarHBondContact O-N 3.32Å; D638-D640 PolarHBondContact O-N 3.46Å; D638-D640 VanDerWaalsContact O-N 3.07Å; D638-V641 HydrophobicContact CB-CG2 4.48Å; D638-V641 PolarHBondContact O-N 2.8Å
639	D	45	Very low	61.9	Low	70 Å²	70	77 Å²	77	37%	0.374	44%	0.442	S	S	.	.	H	α-helix	trans	-55.6	-27.9	-170.4	-68.7	-55.2	0	0	0	112.8	Q637 V641 N642 Q922	Q637-D639 PolarHBondContact O-N 2.83Å; D639-V641 PolarHBondContact O-N 2.99Å; D639-N642 WeakPolarHBondContact O-CB 3.38Å; D639-N642 PolarHBondContact O-N 3.27Å; D639-Q922 PolarHBondContact OD1-NE2 3.4Å; D639-Q922 PolarHBondContact OD2-NE2 2.89Å
640	D	43.7	Very low	62.2	Low	153 Å²	153	75.8 Å²	75.8	82%	0.818	44%	0.437	S	S	*	.	H	α-helix	trans	-59.3	-27.8	175.8	-75.1	-23.3	0	0	0	113.8	D638	D638-D640 PolarHBondContact O-N 3.46Å; D638-D640 VanDerWaalsContact O-N 3.07Å
641	V	46.3	Very low	63	Low	101 Å²	101	72.3 Å²	72.3	61%	0.612	41%	0.413	S	S	*	.	H	α-helix	trans	-84.6	-24.5	177.2	-172.1	0	0	0	0	111.2	D638 D639	D638-V641 HydrophobicContact CB-CG2 4.48Å; D638-V641 PolarHBondContact O-N 2.8Å; D639-V641 PolarHBondContact O-N 2.99Å
642	N	50	Low	64.2	Low	53 Å²	53	68.3 Å²	68.3	28%	0.283	39%	0.392	S	S	.	.	H	α-helix	trans	-71.1	-34.4	-173.8	-95.9	-14.2	0	0	0	113.6	D639 K644 Q645	D639-N642 WeakPolarHBondContact O-CB 3.38Å; D639-N642 PolarHBondContact O-N 3.27Å; N642-K644 PolarHBondContact O-N 3.16Å; N642-K644 VanDerWaalsContact O-N 3.08Å; N642-Q645 WeakPolarHBondContact O-CG 3.48Å; N642-Q645 PolarHBondContact O-N 3.01Å; N642-Q645 PolarHBondContact OD1-NE2 3.12Å
643	D	54.9	Low	65.5	Low	116 Å²	116	63.8 Å²	63.8	62%	0.62	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-12.5	-174.1	-81	-6.2	0	0	0	114.9	K667	D643-K667 WeakPolarHBondContact OD1-CE 3.43Å; D643-K667 IonicContact OD1-NZ 2.75Å; D643-K667 PolarHBondContact OD1-NZ 2.95Å
644	K	65.4	Low	66.6	Low	170 Å²	170	61.2 Å²	61.2	74%	0.739	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.4	16.3	-178.7	-65.5	178.7	-175.8	165.6	0	113.9	N642 L646	N642-K644 PolarHBondContact O-N 3.16Å; N642-K644 VanDerWaalsContact O-N 3.08Å; K644-L646 PolarHBondContact O-N 3.36Å; K644-L646 VanDerWaalsContact O-N 3.13Å
645	Q	76.9	Confident	68	Low	31 Å²	31	60.8 Å²	60.8	15%	0.145	33%	0.325	C	S	.	.			trans	-73.6	104.5	177.5	-69.4	-171.3	15.7	0	0	111.3	N642 D666 K667 I712	N642-Q645 WeakPolarHBondContact O-CG 3.48Å; N642-Q645 PolarHBondContact O-N 3.01Å; N642-Q645 PolarHBondContact OD1-NE2 3.12Å; Q645-D666 CarbonylContact O-C 3.52Å; Q645-D666 WeakPolarHBondContact O-CA 3.45Å; Q645-K667 HydrophobicContact CB-CB 4.49Å; Q645-K667 PolarHBondContact O-N 3.48Å; Q645-I712 HydrophobicContact CB-CD1 3.94Å; Q645-I712 HydrophobicContact CG-CD1 3.98Å
646	L	91.2	Very high	69.3	Low	26 Å²	26	59.3 Å²	59.3	14%	0.136	31%	0.31	C	S	.	.			trans	-109.9	129.4	174.5	-64.9	178.4	0	0	0	110.9	K644 L664 V665 D666 V672 R709 P711 I712	K644-L646 PolarHBondContact O-N 3.36Å; K644-L646 VanDerWaalsContact O-N 3.13Å; L646-L664 HydrophobicContact CB-CD2 4.32Å; L646-V665 CarbonylContact C-O 3.5Å; L646-V665 WeakPolarHBondContact CA-O 3.29Å; L646-D666 HydrophobicContact CD2-CB 4.12Å; L646-V672 HydrophobicContact CD2-CB 4.31Å; L646-V672 HydrophobicContact CD2-CG1 4.18Å; L646-V672 HydrophobicContact CD2-CG2 3.8Å; L646-R709 HydrophobicContact CD1-CB 3.93Å; L646-P711 CarbonylContact O-C 3.58Å; L646-P711 WeakPolarHBondContact O-CA 3.39Å; L646-P711 VanDerWaalsContact O-CB 3.29Å; L646-P711 WeakPolarHBondContact O-CB 3.5Å; L646-I712 WeakPolarHBondContact O-CG1 3.39Å; L646-I712 PolarHBondContact O-N 3.24Å
647	I	94.4	Very high	70.8	Confident	2 Å²	2	60.7 Å²	60.7	1%	0.01	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	128.5	175.2	-60.3	-174.6	0	0	0	108.9	L664 V665 I712 V713 A799 L802 N803	I647-L664 WeakPolarHBondContact O-CA 3.48Å; I647-V665 PolarHBondContact N-O 2.86Å; I647-V665 PolarHBondContact O-N 3.08Å; I647-I712 HydrophobicContact CG1-CG1 4.35Å; I647-V713 HydrophobicContact CB-CG1 4.35Å; I647-V713 HydrophobicContact CD1-CG1 4.27Å; I647-V713 HydrophobicContact CG1-CG1 3.92Å; I647-V713 HydrophobicContact CG2-CG1 3.95Å; I647-A799 HydrophobicContact CG2-CB 4Å; I647-L802 HydrophobicContact CD1-CB 4.5Å; I647-L802 HydrophobicContact CG2-CD2 4.32Å; I647-N803 HydrophobicContact CD1-CB 3.84Å
648	L	96	Very high	72.8	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	110	175.4	-178.2	70.3	0	0	0	110.3	I650 C662 V663 L664 L702 F705 I706 P711 V713 I714 A715	L648-I650 HydrophobicContact CD2-CD1 4.21Å; L648-I650 HydrophobicContact CD2-CG1 4.38Å; L648-I650 HydrophobicContact CG-CG1 4.21Å; L648-C662 HydrophobicContact CD1-CB 4.07Å; L648-V663 CarbonylContact C-O 3.19Å; L648-V663 WeakPolarHBondContact CA-O 3.08Å; L648-L664 HydrophobicContact CB-CD2 3.91Å; L648-L664 HydrophobicContact CD1-CD2 3.78Å; L648-L664 HydrophobicContact CD1-CG 3.89Å; L648-L664 HydrophobicContact CG-CD2 4.45Å; L648-L702 HydrophobicContact CD2-CD1 4.48Å; L648-F705 HydrophobicContact CD1-CD1 4.12Å; L648-F705 HydrophobicContact CD1-CE1 3.63Å; L648-I706 HydrophobicContact CD2-CD1 4.04Å; L648-I706 HydrophobicContact CD2-CG1 3.87Å; L648-P711 HydrophobicContact CB-CB 3.84Å; L648-P711 HydrophobicContact CB-CG 3.91Å; L648-P711 HydrophobicContact CD2-CG 4.42Å; L648-V713 PolarHBondContact N-O 3.08Å; L648-I714 HydrophobicContact CB-CB 4.49Å; L648-I714 HydrophobicContact CB-CG1 4.13Å; L648-I714 HydrophobicContact CB-CG2 4.35Å; L648-I714 HydrophobicContact CD2-CD1 4.11Å; L648-I714 HydrophobicContact CD2-CG1 3.95Å; L648-I714 HydrophobicContact CD2-CG2 3.91Å; L648-I714 HydrophobicContact CG-CG2 4.26Å; L648-I714 CarbonylContact O-C 3.57Å; L648-I714 WeakPolarHBondContact O-CA 3.17Å; L648-A715 PolarHBondContact O-N 3.09Å
649	G	96.1	Very high	75.2	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	132.9	169.8	0	0	0	0	0	111.6	C662 V663 A715	G649-C662 CarbonylContact O-C 3.59Å; G649-C662 VanDerWaalsContact O-CA 3.23Å; G649-C662 WeakPolarHBondContact O-CA 3.43Å; G649-V663 PolarHBondContact N-O 3.04Å; G649-V663 PolarHBondContact O-N 3.22Å; G649-A715 CarbonylContact C-O 3.6Å
650	I	94.6	Very high	77.4	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	116.9	174.9	-53.7	-176.6	0	0	0	108.9	L648 C662 I714 A715 I716 A717 L741 V745	L648-I650 HydrophobicContact CD2-CD1 4.21Å; L648-I650 HydrophobicContact CD2-CG1 4.38Å; L648-I650 HydrophobicContact CG-CG1 4.21Å; I650-C662 HydrophobicContact CG1-CB 4.22Å; I650-I714 HydrophobicContact CD1-CG2 3.65Å; I650-I714 HydrophobicContact CG1-CG2 4.13Å; I650-A715 PolarHBondContact N-O 2.86Å; I650-I716 HydrophobicContact CB-CG1 4.3Å; I650-I716 HydrophobicContact CD1-CG1 4.34Å; I650-A717 PolarHBondContact O-N 3.38Å; I650-L741 HydrophobicContact CG2-CD2 4.06Å; I650-V745 HydrophobicContact CD1-CG2 4.18Å
651	S	92.7	Very high	79.8	Confident	1 Å²	1	44.6 Å²	44.6	1%	0.007	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	147.6	169.7	-175.7	0	0	0	0	110.5	F661 T791 Q794	S651-F661 PolarHBondContact N-O 3.39Å; S651-F661 PolarHBondContact O-N 2.94Å; S651-F661 VanDerWaalsContact O-O 3.06Å; S651-T791 WeakPolarHBondContact CB-O 3.29Å; S651-Q794 WeakPolarHBondContact OG-CB 3.47Å; S651-Q794 PolarHBondContact OG-OE1 3.05Å
652	Y	88.1	Confident	82.2	Confident	2 Å²	2	39.8 Å²	39.8	1%	0.008	20%	0.197	C	C	.	.			trans	-137.7	144.6	-179.9	54.9	-101.8	0	0	0	110.2	S660 T681 I716 A717 M737 A738 L741	Y652-S660 WeakPolarHBondContact CB-OG 3.4Å; Y652-T681 HydrophobicContact CD2-CG2 4.35Å; Y652-T681 HydrophobicContact CG-CG2 4.07Å; Y652-I716 HydrophobicContact CE1-CG2 3.92Å; Y652-A717 WeakPolarHBondContact CE1-O 3.34Å; Y652-A717 PolarHBondContact OH-O 2.97Å; Y652-A717 VanDerWaalsContact OH-O 3.06Å; Y652-M737 HydrophobicContact CD2-CE 3.23Å; Y652-M737 HydrophobicContact CE2-CE 3.26Å; Y652-M737 HydrophobicContact CG-CE 4.2Å; Y652-A738 WeakPolarHBondContact OH-CA 3.5Å; Y652-A738 VanDerWaalsContact OH-CB 3.25Å; Y652-A738 WeakPolarHBondContact OH-CB 3.48Å; Y652-L741 HydrophobicContact CD1-CD2 3.57Å; Y652-L741 HydrophobicContact CE1-CD2 3.75Å
653	P	80.8	Confident	84.4	Confident	7 Å²	7	37.2 Å²	37.2	5%	0.045	18%	0.183	C	C	.	.			trans	-77.1	159.5	179.4	30.3	-29.9	0	0	0	111.3	D655 Q658 A659	P653-D655 VanDerWaalsContact C-N 3.34Å; P653-D655 WeakPolarHBondContact CG-O 3.26Å; P653-Q658 HydrophobicContact CB-CB 3.74Å; P653-Q658 HydrophobicContact CG-CB 3.38Å; P653-Q658 WeakPolarHBondContact CG-O 3.47Å; P653-A659 WeakPolarHBondContact CD-O 3.29Å; P653-A659 WeakPolarHBondContact CG-O 3.46Å
654	M	72.5	Confident	86.4	Confident	77 Å²	77	31.8 Å²	31.8	38%	0.379	15%	0.154	S	C	.	.	S	Bend	trans	-70.2	-35.4	173.5	-56.3	-62.3	169.9	0	0	111.6	S719 S720 L734	M654-S719 VanDerWaalsContact CE-CB 3.47Å; M654-S720 WeakPolarHBondContact CE-O 3.49Å; M654-L734 HydrophobicContact CB-CD2 4.35Å; M654-L734 HydrophobicContact SD-CD2 3.68Å
655	D	74.9	Confident	87.8	Confident	70 Å²	70	23.7 Å²	23.7	37%	0.374	12%	0.119	S	C	.	.	S	Bend	trans	-77.9	123.3	173.7	-173.4	-1.6	0	0	0	109.9	P653 D657 Q658	P653-D655 VanDerWaalsContact C-N 3.34Å; P653-D655 WeakPolarHBondContact CG-O 3.26Å; D655-D657 PolarHBondContact O-N 3.08Å; D655-D657 PolarHBondContact OD1-N 3.31Å; D655-Q658 HydrophobicContact CB-CB 4.46Å; D655-Q658 HydrophobicContact CB-CG 4.01Å; D655-Q658 PolarHBondContact O-N 3.21Å
656	R	69.2	Low	88.5	Confident	34 Å²	34	24 Å²	24	13%	0.128	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74	-16.3	-177.6	-63.7	179.6	174.2	-170.5	-3.6	113.3	Q658 R682 Q683	R656-Q658 VanDerWaalsContact C-N 3.25Å; R656-R682 PolarHBondContact O-NE 2.93Å; R656-Q683 VanDerWaalsContact NH1-CD 3.29Å
657	D	73.8	Confident	88.3	Confident	114 Å²	114	26.1 Å²	26.1	61%	0.61	13%	0.13	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79	-16.2	174.7	-74.7	-43.3	0	0	0	112.3	D655 R682	D655-D657 PolarHBondContact O-N 3.08Å; D655-D657 PolarHBondContact OD1-N 3.31Å; D657-R682 IonicContact OD1-CZ 3.64Å; D657-R682 IonicContact OD1-NH1 2.92Å; D657-R682 IonicContact OD1-NH2 3.78Å; D657-R682 PolarHBondContact OD1-NH2 3.2Å
658	Q	83.3	Confident	88	Confident	101 Å²	101	27.4 Å²	27.4	47%	0.472	14%	0.137	S	C	.	.	S	Bend	trans	-86.8	150.7	175.2	-63.8	-178.9	-4	0	0	111.9	P653 D655 R656	P653-Q658 HydrophobicContact CB-CB 3.74Å; P653-Q658 HydrophobicContact CG-CB 3.38Å; P653-Q658 WeakPolarHBondContact CG-O 3.47Å; D655-Q658 HydrophobicContact CB-CB 4.46Å; D655-Q658 HydrophobicContact CB-CG 4.01Å; D655-Q658 PolarHBondContact O-N 3.21Å; R656-Q658 VanDerWaalsContact C-N 3.25Å
659	A	88.8	Confident	87.7	Confident	10 Å²	10	27.4 Å²	27.4	8%	0.083	14%	0.137	C	C	.	.	P	Polyproline II helix	trans	-79.5	144.1	-177.2	0	0	0	0	0	111.9	P653 F661 R676 A678	P653-A659 WeakPolarHBondContact CD-O 3.29Å; P653-A659 WeakPolarHBondContact CG-O 3.46Å; A659-F661 HydrophobicContact CB-CE2 4.18Å; A659-F661 HydrophobicContact CB-CZ 4.48Å; A659-F661 WeakPolarHBondContact O-CD2 3.48Å; A659-F661 WeakPolarHBondContact O-CE2 3.31Å; A659-R676 HydrophobicContact CB-CG 3.71Å; A659-A678 HydrophobicContact CB-CB 4.35Å
660	S	91.4	Very high	87.6	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	155.1	168.5	-50	0	0	0	0	110.3	Y652 L677	Y652-S660 WeakPolarHBondContact CB-OG 3.4Å; S660-L677 PolarHBondContact N-O 3.34Å; S660-L677 PolarHBondContact O-N 3.49Å
661	F	95	Very high	87.5	Confident	21 Å²	21	32.6 Å²	32.6	9%	0.092	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	143.2	-178.1	-71.6	-92.1	0	0	0	111	S651 A659 I675 R676 P789 T791 L792	S651-F661 PolarHBondContact N-O 3.39Å; S651-F661 PolarHBondContact O-N 2.94Å; S651-F661 VanDerWaalsContact O-O 3.06Å; A659-F661 HydrophobicContact CB-CE2 4.18Å; A659-F661 HydrophobicContact CB-CZ 4.48Å; A659-F661 WeakPolarHBondContact O-CD2 3.48Å; A659-F661 WeakPolarHBondContact O-CE2 3.31Å; F661-I675 WeakPolarHBondContact CA-O 3.22Å; F661-R676 HydrophobicContact CD1-CB 4.1Å; F661-R676 HydrophobicContact CD1-CG 4.38Å; F661-R676 HydrophobicContact CE1-CB 3.67Å; F661-R676 HydrophobicContact CE1-CG 3.7Å; F661-R676 HydrophobicContact CZ-CB 4.29Å; F661-R676 HydrophobicContact CZ-CG 3.79Å; F661-P789 HydrophobicContact CE1-CG 3.94Å; F661-P789 HydrophobicContact CE2-CB 4.46Å; F661-P789 HydrophobicContact CE2-CG 3.79Å; F661-P789 HydrophobicContact CZ-CB 4.44Å; F661-P789 HydrophobicContact CZ-CG 3.46Å; F661-P789 VanDerWaalsContact CZ-CG 3.46Å; F661-T791 HydrophobicContact CD2-CG2 3.95Å; F661-L792 HydrophobicContact CB-CB 4.14Å; F661-L792 HydrophobicContact CB-CD1 3.97Å; F661-L792 HydrophobicContact CD1-CB 3.96Å; F661-L792 HydrophobicContact CD1-CD1 4.15Å; F661-L792 HydrophobicContact CD1-CD2 4.3Å; F661-L792 HydrophobicContact CD1-CG 4.37Å; F661-L792 HydrophobicContact CD2-CB 4.4Å; F661-L792 HydrophobicContact CE1-CB 4.48Å; F661-L792 HydrophobicContact CG-CB 3.91Å; F661-L792 HydrophobicContact CG-CD1 4.35Å
662	C	95.8	Very high	87.5	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	141.3	170.6	-49.3	0	0	0	0	109.2	L648 G649 I650 H674 I675 L702	L648-C662 HydrophobicContact CD1-CB 4.07Å; G649-C662 CarbonylContact O-C 3.59Å; G649-C662 VanDerWaalsContact O-CA 3.23Å; G649-C662 WeakPolarHBondContact O-CA 3.43Å; I650-C662 HydrophobicContact CG1-CB 4.22Å; C662-H674 CarbonylContact O-C 3.58Å; C662-H674 WeakPolarHBondContact O-CA 3Å; C662-H674 WeakPolarHBondContact O-CB 3.27Å; C662-I675 HydrophobicContact CB-CG2 3.77Å; C662-I675 PolarHBondContact N-O 3.17Å; C662-I675 PolarHBondContact O-N 3.47Å; C662-L702 HydrophobicContact CB-CD1 4.4Å
663	V	96.9	Very high	87.9	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	136.6	-178.8	63.7	0	0	0	0	110.2	L648 G649 V665 I671 H674 L792 A795 I796	L648-V663 CarbonylContact C-O 3.19Å; L648-V663 WeakPolarHBondContact CA-O 3.08Å; G649-V663 PolarHBondContact N-O 3.04Å; G649-V663 PolarHBondContact O-N 3.22Å; V663-V665 HydrophobicContact CG1-CG2 4.31Å; V663-V665 HydrophobicContact CG2-CG2 4.1Å; V663-I671 HydrophobicContact CG2-CG1 4.4Å; V663-I671 HydrophobicContact CG2-CG2 3.7Å; V663-H674 HydrophobicContact CB-CB 4.25Å; V663-H674 HydrophobicContact CG2-CB 4.18Å; V663-L792 HydrophobicContact CB-CD1 4.23Å; V663-A795 VanDerWaalsContact CG1-C 3.42Å; V663-A795 HydrophobicContact CG1-CB 3.75Å; V663-A795 WeakPolarHBondContact CG1-O 3.46Å; V663-I796 HydrophobicContact CB-CG1 4.37Å; V663-I796 HydrophobicContact CG1-CG1 4.07Å; V663-I796 HydrophobicContact CG2-CG1 3.97Å
664	L	96.6	Very high	88.6	Confident	1 Å²	1	39.9 Å²	39.9	1%	0.005	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	128.2	169.4	-74.9	165.3	0	0	0	108.7	L646 I647 L648 V672 D673 F705 R709 P711	L646-L664 HydrophobicContact CB-CD2 4.32Å; I647-L664 WeakPolarHBondContact O-CA 3.48Å; L648-L664 HydrophobicContact CB-CD2 3.91Å; L648-L664 HydrophobicContact CD1-CD2 3.78Å; L648-L664 HydrophobicContact CD1-CG 3.89Å; L648-L664 HydrophobicContact CG-CD2 4.45Å; L664-V672 HydrophobicContact CB-CB 4.15Å; L664-V672 HydrophobicContact CB-CG1 4.48Å; L664-V672 PolarHBondContact O-N 3.39Å; L664-D673 HydrophobicContact CD1-CB 4.49Å; L664-D673 PolarHBondContact N-O 2.93Å; L664-F705 HydrophobicContact CD1-CD1 4.32Å; L664-F705 HydrophobicContact CD1-CE1 3.59Å; L664-F705 HydrophobicContact CD1-CZ 3.72Å; L664-F705 HydrophobicContact CG-CE1 3.67Å; L664-F705 HydrophobicContact CG-CZ 3.98Å; L664-R709 HydrophobicContact CD1-CB 3.72Å; L664-P711 HydrophobicContact CD2-CB 4.07Å
665	V	94.9	Very high	89.7	Confident	1 Å²	1	37.5 Å²	37.5	1%	0.006	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	139.7	178	-178.7	0	0	0	0	108.4	L646 I647 V663 G669 E670 A799 R800	L646-V665 CarbonylContact C-O 3.5Å; L646-V665 WeakPolarHBondContact CA-O 3.29Å; I647-V665 PolarHBondContact N-O 2.86Å; I647-V665 PolarHBondContact O-N 3.08Å; V663-V665 HydrophobicContact CG1-CG2 4.31Å; V663-V665 HydrophobicContact CG2-CG2 4.1Å; V665-G669 VanDerWaalsContact CG1-CA 3.4Å; V665-E670 VanDerWaalsContact CA-O 3.27Å; V665-E670 WeakPolarHBondContact CA-O 3.39Å; V665-A799 HydrophobicContact CB-CB 3.99Å; V665-A799 HydrophobicContact CG2-CB 3.63Å; V665-R800 HydrophobicContact CG1-CG 4.16Å
666	D	91.9	Very high	90.7	Very high	38 Å²	38	41.8 Å²	41.8	20%	0.203	20%	0.199	C	C	.	.			trans	-85.3	-177	175.6	69.5	13.1	0	0	0	113.1	Q645 L646 N668 G669 E670 V672 N803	Q645-D666 CarbonylContact O-C 3.52Å; Q645-D666 WeakPolarHBondContact O-CA 3.45Å; L646-D666 HydrophobicContact CD2-CB 4.12Å; D666-N668 PolarHBondContact O-N 3.09Å; D666-N668 WeakPolarHBondContact OD1-CA 3.34Å; D666-N668 PolarHBondContact OD1-N 2.83Å; D666-G669 PolarHBondContact O-N 3.12Å; D666-G669 VanDerWaalsContact O-N 3.15Å; D666-G669 PolarHBondContact OD1-N 3.4Å; D666-E670 PolarHBondContact N-O 3.17Å; D666-E670 VanDerWaalsContact N-O 3.1Å; D666-E670 PolarHBondContact OD1-N 3.18Å; D666-V672 HydrophobicContact CB-CG2 3.9Å; D666-N803 PolarHBondContact O-ND2 3.35Å; D666-N803 VanDerWaalsContact O-ND2 3.14Å
667	K	86.4	Confident	91.9	Very high	70 Å²	70	40.1 Å²	40.1	30%	0.304	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-24.6	177.1	72.8	175.5	-169.3	177.9	0	113.7	D643 Q645 N803 R857	D643-K667 WeakPolarHBondContact OD1-CE 3.43Å; D643-K667 IonicContact OD1-NZ 2.75Å; D643-K667 PolarHBondContact OD1-NZ 2.95Å; Q645-K667 HydrophobicContact CB-CB 4.49Å; Q645-K667 PolarHBondContact O-N 3.48Å; K667-N803 VanDerWaalsContact C-ND2 3.27Å; K667-N803 PolarHBondContact O-ND2 3.42Å; K667-R857 PolarHBondContact O-NH2 2.86Å
668	N	88.4	Confident	92.6	Very high	29 Å²	29	36.1 Å²	36.1	16%	0.155	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-10.1	-178.3	-68.6	-23.3	0	0	0	112.7	D666 H861	D666-N668 PolarHBondContact O-N 3.09Å; D666-N668 WeakPolarHBondContact OD1-CA 3.34Å; D666-N668 PolarHBondContact OD1-N 2.83Å; N668-H861 PolarHBondContact ND2-NE2 3.45Å
669	G	90	Very high	92.7	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	16%	0.162	C	C	.	.	S	Bend	trans	93.1	6	-177.3	0	0	0	0	0	113	V665 D666 R800	V665-G669 VanDerWaalsContact CG1-CA 3.4Å; D666-G669 PolarHBondContact O-N 3.12Å; D666-G669 VanDerWaalsContact O-N 3.15Å; D666-G669 PolarHBondContact OD1-N 3.4Å; G669-R800 VanDerWaalsContact O-CZ 3.28Å; G669-R800 PolarHBondContact O-NE 3.24Å; G669-R800 PolarHBondContact O-NH2 3.46Å
670	E	93	Very high	92.5	Very high	67 Å²	67	33 Å²	33	31%	0.313	16%	0.159	S	C	.	.			trans	-78.7	147.6	178.9	-63.5	-58.3	148.9	0	0	111.6	V665 D666 V672 H861	V665-E670 VanDerWaalsContact CA-O 3.27Å; V665-E670 WeakPolarHBondContact CA-O 3.39Å; D666-E670 PolarHBondContact N-O 3.17Å; D666-E670 VanDerWaalsContact N-O 3.1Å; D666-E670 PolarHBondContact OD1-N 3.18Å; E670-V672 PolarHBondContact O-N 3.05Å; E670-H861 VanDerWaalsContact CG-ND1 3.32Å; E670-H861 WeakPolarHBondContact CG-ND1 3.46Å; E670-H861 IonicContact OE1-CG 2.77Å; E670-H861 IonicContact OE1-ND1 3.05Å; E670-H861 PolarHBondContact OE1-ND1 2.91Å
671	I	93.7	Very high	91.9	Very high	41 Å²	41	33.5 Å²	33.5	21%	0.21	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	115.4	-176.5	-61.1	167.7	0	0	0	109.3	V663 F785 Y788 I796	V663-I671 HydrophobicContact CG2-CG1 4.4Å; V663-I671 HydrophobicContact CG2-CG2 3.7Å; I671-F785 HydrophobicContact CD1-CD1 4.13Å; I671-F785 HydrophobicContact CD1-CE1 3.34Å; I671-F785 HydrophobicContact CD1-CE2 4.43Å; I671-F785 HydrophobicContact CD1-CZ 3.53Å; I671-Y788 HydrophobicContact CD1-CE2 4.09Å; I671-I796 HydrophobicContact CD1-CD1 3.45Å; I671-I796 VanDerWaalsContact CD1-CD1 3.45Å; I671-I796 HydrophobicContact CD1-CG1 3.85Å; I671-I796 HydrophobicContact CD1-CG2 4.35Å; I671-I796 HydrophobicContact CG1-CD1 4.41Å; I671-I796 HydrophobicContact CG1-CG1 4.3Å
672	V	93	Very high	91	Very high	43 Å²	43	34.4 Å²	34.4	26%	0.261	17%	0.165	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	-43.8	-173.4	170.6	0	0	0	0	112.3	L646 L664 D666 E670 R709	L646-V672 HydrophobicContact CD2-CB 4.31Å; L646-V672 HydrophobicContact CD2-CG1 4.18Å; L646-V672 HydrophobicContact CD2-CG2 3.8Å; L664-V672 HydrophobicContact CB-CB 4.15Å; L664-V672 HydrophobicContact CB-CG1 4.48Å; L664-V672 PolarHBondContact O-N 3.39Å; D666-V672 HydrophobicContact CB-CG2 3.9Å; E670-V672 PolarHBondContact O-N 3.05Å; V672-R709 PolarHBondContact O-NH1 3.28Å
673	D	95	Very high	89.6	Confident	49 Å²	49	36.6 Å²	36.6	26%	0.262	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-163	158.2	174.3	-164.9	3.7	0	0	0	108.9	L664 F705 R708	L664-D673 HydrophobicContact CD1-CB 4.49Å; L664-D673 PolarHBondContact N-O 2.93Å; D673-F705 HydrophobicContact CB-CE2 3.93Å; D673-F705 HydrophobicContact CB-CZ 3.96Å; D673-F705 VanDerWaalsContact CG-CE2 3.47Å; D673-F705 VanDerWaalsContact OD2-CE2 3.26Å; D673-F705 WeakPolarHBondContact OD2-CE2 3.33Å; D673-R708 IonicContact OD2-CZ 2.85Å; D673-R708 IonicContact OD2-NH2 3.43Å; D673-R708 PolarHBondContact OD2-NH2 2.88Å
674	H	95.6	Very high	88.1	Confident	71 Å²	71	40 Å²	40	33%	0.329	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	156.9	173.2	69.6	-91.2	0	0	0	112.1	C662 V663 L792	C662-H674 CarbonylContact O-C 3.58Å; C662-H674 WeakPolarHBondContact O-CA 3Å; C662-H674 WeakPolarHBondContact O-CB 3.27Å; V663-H674 HydrophobicContact CB-CB 4.25Å; V663-H674 HydrophobicContact CG2-CB 4.18Å; H674-L792 HydrophobicContact CB-CD1 3.99Å
675	I	96.3	Very high	86.3	Confident	27 Å²	27	48.4 Å²	48.4	14%	0.138	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	140.4	-179.9	-171.1	169.4	0	0	0	111.9	F661 C662 L677 R701 F705	F661-I675 WeakPolarHBondContact CA-O 3.22Å; C662-I675 HydrophobicContact CB-CG2 3.77Å; C662-I675 PolarHBondContact N-O 3.17Å; C662-I675 PolarHBondContact O-N 3.47Å; I675-L677 HydrophobicContact CD1-CD2 4.07Å; I675-L677 HydrophobicContact CG1-CD2 4.12Å; I675-L677 HydrophobicContact CG2-CG 4.48Å; I675-R701 HydrophobicContact CD1-CB 4.02Å; I675-F705 HydrophobicContact CB-CD2 3.82Å; I675-F705 HydrophobicContact CB-CE2 3.92Å; I675-F705 HydrophobicContact CB-CG 4.33Å; I675-F705 HydrophobicContact CB-CZ 4.49Å; I675-F705 HydrophobicContact CD1-CB 4.31Å; I675-F705 HydrophobicContact CD1-CD2 4.25Å; I675-F705 HydrophobicContact CG2-CB 4.42Å; I675-F705 HydrophobicContact CG2-CD1 4.01Å; I675-F705 HydrophobicContact CG2-CD2 3.81Å; I675-F705 HydrophobicContact CG2-CE1 4.16Å; I675-F705 HydrophobicContact CG2-CE2 4.01Å; I675-F705 HydrophobicContact CG2-CG 3.83Å; I675-F705 HydrophobicContact CG2-CZ 4.19Å
676	R	96	Very high	84.2	Confident	160 Å²	160	54.4 Å²	54.4	60%	0.604	26%	0.255	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.1	127.3	173.5	-177.3	-179.3	173.7	-165	-0.4	111.1	A659 F661	A659-R676 HydrophobicContact CB-CG 3.71Å; F661-R676 HydrophobicContact CD1-CB 4.1Å; F661-R676 HydrophobicContact CD1-CG 4.38Å; F661-R676 HydrophobicContact CE1-CB 3.67Å; F661-R676 HydrophobicContact CE1-CG 3.7Å; F661-R676 HydrophobicContact CZ-CB 4.29Å; F661-R676 HydrophobicContact CZ-CG 3.79Å
677	L	93.7	Very high	82.4	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	96.7	-179.2	-57.6	174.6	0	0	0	110	S660 I675 H679 L680 D698 R701 L702	S660-L677 PolarHBondContact N-O 3.34Å; S660-L677 PolarHBondContact O-N 3.49Å; I675-L677 HydrophobicContact CD1-CD2 4.07Å; I675-L677 HydrophobicContact CG1-CD2 4.12Å; I675-L677 HydrophobicContact CG2-CG 4.48Å; L677-H679 VanDerWaalsContact C-N 3.3Å; L677-H679 PolarHBondContact O-N 2.9Å; L677-L680 HydrophobicContact CB-CB 3.98Å; L677-L680 HydrophobicContact CB-CD2 4.48Å; L677-L680 HydrophobicContact CD1-CD1 4.34Å; L677-L680 HydrophobicContact CD1-CD2 3.95Å; L677-D698 HydrophobicContact CB-CB 4.33Å; L677-D698 HydrophobicContact CD2-CB 4.08Å; L677-R701 HydrophobicContact CD2-CB 4.1Å; L677-L702 HydrophobicContact CD1-CB 4.08Å; L677-L702 HydrophobicContact CD1-CD1 4.33Å; L677-L702 HydrophobicContact CD1-CD2 4.39Å
678	A	88.5	Confident	80.9	Confident	29 Å²	29	58.8 Å²	58.8	24%	0.24	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-16.9	-169.6	0	0	0	0	0	115.1	A659 D698	A659-A678 HydrophobicContact CB-CB 4.35Å; A678-D698 PolarHBondContact N-OD2 2.84Å
679	H	86.4	Confident	79.7	Confident	44 Å²	44	59.2 Å²	59.2	20%	0.204	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-131	6.8	-168.6	-53.7	-49.4	0	0	0	113.2	L677 T681 R682 L694 D698	L677-H679 VanDerWaalsContact C-N 3.3Å; L677-H679 PolarHBondContact O-N 2.9Å; H679-T681 VanDerWaalsContact C-N 3.33Å; H679-T681 PolarHBondContact O-N 3.32Å; H679-R682 HydrophobicContact CB-CG 4.48Å; H679-R682 WeakPolarHBondContact ND1-CD 3.48Å; H679-R682 PolarHBondContact ND1-NE 3.43Å; H679-R682 PolarHBondContact O-N 3.07Å; H679-R682 VanDerWaalsContact O-N 3.14Å; H679-L694 HydrophobicContact CB-CB 4.11Å; H679-D698 VanDerWaalsContact CA-OD2 3.32Å; H679-D698 WeakPolarHBondContact CA-OD2 3.38Å; H679-D698 WeakPolarHBondContact CB-OD2 3.31Å; H679-D698 PolarHBondContact N-OD2 3.44Å
680	L	84.2	Confident	78.7	Confident	2 Å²	2	63.9 Å²	63.9	1%	0.01	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-44.1	-178.3	-173.7	65.9	0	0	0	113	L677 K695 D698 L699 L741	L677-L680 HydrophobicContact CB-CB 3.98Å; L677-L680 HydrophobicContact CB-CD2 4.48Å; L677-L680 HydrophobicContact CD1-CD1 4.34Å; L677-L680 HydrophobicContact CD1-CD2 3.95Å; L680-K695 WeakPolarHBondContact O-CD 3.44Å; L680-K695 VanDerWaalsContact O-CE 3.23Å; L680-K695 WeakPolarHBondContact O-CE 3.38Å; L680-D698 PolarHBondContact N-OD2 2.83Å; L680-L699 HydrophobicContact CD1-CD2 3.76Å; L680-L741 HydrophobicContact CD1-CD1 3.95Å; L680-L741 HydrophobicContact CD2-CD1 3.81Å; L680-L741 HydrophobicContact CD2-CD2 4.49Å; L680-L741 HydrophobicContact CG-CD1 3.87Å
681	T	78.6	Confident	77.7	Confident	11 Å²	11	63.6 Å²	63.6	7%	0.067	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91	-4.5	-179.1	51.9	0	0	0	0	113.9	Y652 H679 M737	Y652-T681 HydrophobicContact CD2-CG2 4.35Å; Y652-T681 HydrophobicContact CG-CG2 4.07Å; H679-T681 VanDerWaalsContact C-N 3.33Å; H679-T681 PolarHBondContact O-N 3.32Å; T681-M737 VanDerWaalsContact CB-SD 3.51Å; T681-M737 HydrophobicContact CG2-CE 3.85Å; T681-M737 HydrophobicContact CG2-CG 3.99Å; T681-M737 HydrophobicContact CG2-SD 3.55Å; T681-M737 VanDerWaalsContact CG2-SD 3.55Å
682	R	76.7	Confident	77	Confident	39 Å²	39	63.1 Å²	63.1	15%	0.147	34%	0.344	C	S	.	.	S	Bend	trans	-71.7	141	-179.4	-69.5	-169	-179.2	-143.4	-9.6	111.3	R656 D657 H679 Y691	R656-R682 PolarHBondContact O-NE 2.93Å; D657-R682 IonicContact OD1-CZ 3.64Å; D657-R682 IonicContact OD1-NH1 2.92Å; D657-R682 IonicContact OD1-NH2 3.78Å; D657-R682 PolarHBondContact OD1-NH2 3.2Å; H679-R682 HydrophobicContact CB-CG 4.48Å; H679-R682 WeakPolarHBondContact ND1-CD 3.48Å; H679-R682 PolarHBondContact ND1-NE 3.43Å; H679-R682 PolarHBondContact O-N 3.07Å; H679-R682 VanDerWaalsContact O-N 3.14Å; R682-Y691 HydrophobicContact CB-CG 4.42Å
683	Q	66.7	Low	76.6	Confident	47 Å²	47	64.7 Å²	64.7	22%	0.22	35%	0.354	C	S	.	.			trans	-74.4	139.7	178.3	-92	-175.9	-34.4	0	0	112.4	R656 K685 W686 Y691	R656-Q683 VanDerWaalsContact NH1-CD 3.29Å; Q683-K685 VanDerWaalsContact C-N 3.28Å; Q683-K685 PolarHBondContact O-N 3.35Å; Q683-W686 HydrophobicContact CB-CB 4.44Å; Q683-Y691 WeakPolarHBondContact O-CB 3.03Å
684	T	64.7	Low	76.2	Confident	72 Å²	72	65.2 Å²	65.2	44%	0.442	36%	0.357	S	S	.	.	S	Bend	trans	-51.1	-42.8	175.8	-50.2	0	0	0	0	112.8	N690 Y691 A692	T684-N690 PolarHBondContact O-OD1 3.45Å; T684-Y691 PolarHBondContact O-N 3.24Å; T684-A692 HydrophobicContact CG2-CB 3.33Å; T684-A692 PolarHBondContact O-N 2.7Å
685	K	59.1	Low	75.7	Confident	177 Å²	177	63.5 Å²	63.5	77%	0.77	35%	0.348	S	S	*	.	S	Bend	trans	-129.2	108.4	178.7	-62.9	-175.1	-180	-176.1	0	109.9	Q683	Q683-K685 VanDerWaalsContact C-N 3.28Å; Q683-K685 PolarHBondContact O-N 3.35Å
686	W	51.3	Low	75.3	Confident	126 Å²	126	63.7 Å²	63.7	48%	0.477	36%	0.357	S	S	.	.	B	Isolated β-bridge	trans	-143.8	130.2	174.3	179.4	-93.9	0	0	0	111	Q683 G688 A689	Q683-W686 HydrophobicContact CB-CB 4.44Å; W686-G688 VanDerWaalsContact C-N 3.33Å; W686-G688 PolarHBondContact O-N 2.86Å; W686-A689 PolarHBondContact N-O 2.89Å; W686-A689 PolarHBondContact O-N 2.86Å
687	S	53.8	Low	75.1	Confident	109 Å²	109	62.6 Å²	62.6	76%	0.762	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.5	45.5	170	-165.4	0	0	0	0	115.2	A689	S687-A689 PolarHBondContact O-N 3.36Å
688	G	55.3	Low	75.1	Confident	91 Å²	91	63 Å²	63	94%	0.938	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.9	-15.5	179.9	0	0	0	0	0	115.3	W686	W686-G688 VanDerWaalsContact C-N 3.33Å; W686-G688 PolarHBondContact O-N 2.86Å
689	A	61.6	Low	75.2	Confident	38 Å²	38	63.1 Å²	63.1	31%	0.314	36%	0.355	S	S	.	.	B	Isolated β-bridge	trans	-89.6	131.4	174	0	0	0	0	0	111.2	W686 S687 Y691	W686-A689 PolarHBondContact N-O 2.89Å; W686-A689 PolarHBondContact O-N 2.86Å; S687-A689 PolarHBondContact O-N 3.36Å; A689-Y691 HydrophobicContact CB-CD2 4.18Å; A689-Y691 HydrophobicContact CB-CE2 3.57Å
690	N	69.5	Low	75.6	Confident	99 Å²	99	65.8 Å²	65.8	53%	0.529	37%	0.368	S	S	.	.			trans	-96.4	95.6	175.6	-171.9	10.8	0	0	0	109.3	T684 A692 P693	T684-N690 PolarHBondContact O-OD1 3.45Å; N690-A692 VanDerWaalsContact C-N 3.29Å; N690-A692 WeakPolarHBondContact OD1-CB 3.39Å; N690-A692 PolarHBondContact OD1-N 2.86Å; N690-P693 WeakPolarHBondContact O-CD 3.5Å
691	Y	72.9	Confident	76.1	Confident	60 Å²	60	72.6 Å²	72.6	24%	0.235	39%	0.394	C	S	.	.			trans	-84.2	-2.7	176.7	-63.6	-82.6	0	0	0	113	R682 Q683 T684 A689 P693 L694 K695	R682-Y691 HydrophobicContact CB-CG 4.42Å; Q683-Y691 WeakPolarHBondContact O-CB 3.03Å; T684-Y691 PolarHBondContact O-N 3.24Å; A689-Y691 HydrophobicContact CB-CD2 4.18Å; A689-Y691 HydrophobicContact CB-CE2 3.57Å; Y691-P693 VanDerWaalsContact C-CD 3.49Å; Y691-L694 HydrophobicContact CD1-CD1 3.78Å; Y691-L694 HydrophobicContact CE1-CD1 4.37Å; Y691-L694 WeakPolarHBondContact O-CB 3.27Å; Y691-L694 PolarHBondContact O-N 3.48Å; Y691-K695 PolarHBondContact O-N 3.1Å
692	A	78.5	Confident	76.9	Confident	32 Å²	32	72.1 Å²	72.1	26%	0.264	39%	0.39	S	S	.	.	H	α-helix	trans	-45.6	-50.6	175.7	0	0	0	0	0	114.6	T684 N690 L694 K695 G696	T684-A692 HydrophobicContact CG2-CB 3.33Å; T684-A692 PolarHBondContact O-N 2.7Å; N690-A692 VanDerWaalsContact C-N 3.29Å; N690-A692 WeakPolarHBondContact OD1-CB 3.39Å; N690-A692 PolarHBondContact OD1-N 2.86Å; A692-L694 VanDerWaalsContact C-N 3.3Å; A692-L694 PolarHBondContact O-N 3.17Å; A692-K695 PolarHBondContact O-N 2.89Å; A692-G696 PolarHBondContact O-N 3.27Å
693	P	84.4	Confident	77.7	Confident	75 Å²	75	70.9 Å²	70.9	49%	0.487	39%	0.386	S	S	.	.	H	α-helix	trans	-65.6	-33.4	179.3	25.9	-35.8	0	0	0	112.5	N690 Y691 G696 K697	N690-P693 WeakPolarHBondContact O-CD 3.5Å; Y691-P693 VanDerWaalsContact C-CD 3.49Å; P693-G696 PolarHBondContact O-N 3.21Å; P693-K697 WeakPolarHBondContact O-CG 3.34Å; P693-K697 PolarHBondContact O-N 2.94Å
694	L	86	Confident	79	Confident	60 Å²	60	71 Å²	71	31%	0.314	39%	0.392	S	S	.	.	H	α-helix	trans	-72.2	-44.4	179.5	-68.1	171.1	0	0	0	111.4	H679 Y691 A692 G696 K697 D698	H679-L694 HydrophobicContact CB-CB 4.11Å; Y691-L694 HydrophobicContact CD1-CD1 3.78Å; Y691-L694 HydrophobicContact CE1-CD1 4.37Å; Y691-L694 WeakPolarHBondContact O-CB 3.27Å; Y691-L694 PolarHBondContact O-N 3.48Å; A692-L694 VanDerWaalsContact C-N 3.3Å; A692-L694 PolarHBondContact O-N 3.17Å; L694-G696 VanDerWaalsContact C-N 3.3Å; L694-G696 PolarHBondContact O-N 3.07Å; L694-K697 WeakPolarHBondContact O-CB 3.24Å; L694-K697 PolarHBondContact O-N 3.29Å; L694-D698 PolarHBondContact O-N 3.27Å; L694-D698 VanDerWaalsContact O-N 3.13Å
695	K	86.4	Confident	80.4	Confident	35 Å²	35	67.6 Å²	67.6	15%	0.152	37%	0.371	C	S	.	.	H	α-helix	trans	-60.4	-41.5	171	179.7	173.8	173.9	180	0	111.2	L680 Y691 A692 K697 D698 L699 D744	L680-K695 WeakPolarHBondContact O-CD 3.44Å; L680-K695 VanDerWaalsContact O-CE 3.23Å; L680-K695 WeakPolarHBondContact O-CE 3.38Å; Y691-K695 PolarHBondContact O-N 3.1Å; A692-K695 PolarHBondContact O-N 2.89Å; K695-K697 VanDerWaalsContact C-N 3.34Å; K695-K697 PolarHBondContact O-N 3.18Å; K695-D698 PolarHBondContact O-N 3.29Å; K695-L699 HydrophobicContact CG-CD1 4.31Å; K695-L699 HydrophobicContact CG-CG 4.46Å; K695-L699 WeakPolarHBondContact O-CG 3.3Å; K695-L699 PolarHBondContact O-N 3.19Å; K695-D744 WeakPolarHBondContact CE-OD2 3.28Å; K695-D744 IonicContact NZ-OD2 3.83Å; K695-D744 PolarHBondContact NZ-OD2 3.26Å
696	G	88.1	Confident	82	Confident	31 Å²	31	59.3 Å²	59.3	32%	0.32	34%	0.335	S	S	.	.	H	α-helix	trans	-58.8	-42.7	175.6	0	0	0	0	0	112.8	A692 P693 L694 D698 L699 E700	A692-G696 PolarHBondContact O-N 3.27Å; P693-G696 PolarHBondContact O-N 3.21Å; L694-G696 VanDerWaalsContact C-N 3.3Å; L694-G696 PolarHBondContact O-N 3.07Å; G696-D698 PolarHBondContact O-N 3.35Å; G696-L699 PolarHBondContact O-N 3.46Å; G696-E700 PolarHBondContact O-N 3.42Å
697	K	91	Very high	83.9	Confident	137 Å²	137	57.7 Å²	57.7	60%	0.596	33%	0.329	S	S	*	.	H	α-helix	trans	-60.2	-43.2	173.7	-74.6	177.7	-179.9	-173.5	0	112.3	P693 L694 K695 E700 R701	P693-K697 WeakPolarHBondContact O-CG 3.34Å; P693-K697 PolarHBondContact O-N 2.94Å; L694-K697 WeakPolarHBondContact O-CB 3.24Å; L694-K697 PolarHBondContact O-N 3.29Å; K695-K697 VanDerWaalsContact C-N 3.34Å; K695-K697 PolarHBondContact O-N 3.18Å; K697-E700 PolarHBondContact O-N 3.4Å; K697-R701 WeakPolarHBondContact O-CG 3.16Å; K697-R701 PolarHBondContact O-N 3.32Å
698	D	93	Very high	85.7	Confident	8 Å²	8	60.2 Å²	60.2	4%	0.043	32%	0.322	C	S	.	.	H	α-helix	trans	-66.1	-37.7	177.7	-81.5	5.4	0	0	0	112.5	L677 A678 H679 L680 L694 K695 G696 R701 L702	L677-D698 HydrophobicContact CB-CB 4.33Å; L677-D698 HydrophobicContact CD2-CB 4.08Å; A678-D698 PolarHBondContact N-OD2 2.84Å; H679-D698 VanDerWaalsContact CA-OD2 3.32Å; H679-D698 WeakPolarHBondContact CA-OD2 3.38Å; H679-D698 WeakPolarHBondContact CB-OD2 3.31Å; H679-D698 PolarHBondContact N-OD2 3.44Å; L680-D698 PolarHBondContact N-OD2 2.83Å; L694-D698 PolarHBondContact O-N 3.27Å; L694-D698 VanDerWaalsContact O-N 3.13Å; K695-D698 PolarHBondContact O-N 3.29Å; G696-D698 PolarHBondContact O-N 3.35Å; D698-R701 PolarHBondContact O-N 3.39Å; D698-L702 WeakPolarHBondContact O-CB 3.19Å; D698-L702 PolarHBondContact O-N 3.06Å
699	L	91.7	Very high	87.3	Confident	33 Å²	33	61.4 Å²	61.4	17%	0.173	30%	0.298	C	S	.	.	H	α-helix	trans	-64.2	-38.8	173.7	-69.1	173.4	0	0	0	112	L680 K695 G696 L702 K703 D744 I748	L680-L699 HydrophobicContact CD1-CD2 3.76Å; K695-L699 HydrophobicContact CG-CD1 4.31Å; K695-L699 HydrophobicContact CG-CG 4.46Å; K695-L699 WeakPolarHBondContact O-CG 3.3Å; K695-L699 PolarHBondContact O-N 3.19Å; G696-L699 PolarHBondContact O-N 3.46Å; L699-L702 PolarHBondContact O-N 3.32Å; L699-K703 WeakPolarHBondContact O-CB 3.21Å; L699-K703 PolarHBondContact O-N 2.96Å; L699-D744 HydrophobicContact CD2-CB 4.07Å; L699-I748 HydrophobicContact CB-CD1 4.25Å; L699-I748 HydrophobicContact CD2-CD1 3.89Å
700	E	93.8	Very high	88.6	Confident	100 Å²	100	62.6 Å²	62.6	47%	0.467	30%	0.303	S	S	.	.	H	α-helix	trans	-68.2	-34.5	173.8	-73.5	-57.6	148.7	0	0	112.7	G696 K697 K703 S704	G696-E700 PolarHBondContact O-N 3.42Å; K697-E700 PolarHBondContact O-N 3.4Å; E700-K703 PolarHBondContact O-N 2.89Å; E700-S704 WeakPolarHBondContact O-CB 3.39Å; E700-S704 PolarHBondContact O-N 3.41Å; E700-S704 PolarHBondContact O-OG 3.08Å
701	R	95.6	Very high	89.7	Confident	145 Å²	145	58.1 Å²	58.1	55%	0.547	28%	0.279	S	S	.	.	H	α-helix	trans	-65.5	-43.7	172.2	-72.1	-179.7	113	-168.5	1.4	111.3	I675 L677 K697 D698 S704 F705	I675-R701 HydrophobicContact CD1-CB 4.02Å; L677-R701 HydrophobicContact CD2-CB 4.1Å; K697-R701 WeakPolarHBondContact O-CG 3.16Å; K697-R701 PolarHBondContact O-N 3.32Å; D698-R701 PolarHBondContact O-N 3.39Å; R701-S704 PolarHBondContact O-N 2.99Å; R701-F705 WeakPolarHBondContact O-CB 3.39Å; R701-F705 PolarHBondContact O-N 2.96Å
702	L	93.9	Very high	90.5	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-62.3	-44	174.4	-178.9	56.9	0	0	0	111.5	L648 C662 L677 D698 L699 S704 F705 I706 V745 I748	L648-L702 HydrophobicContact CD2-CD1 4.48Å; C662-L702 HydrophobicContact CB-CD1 4.4Å; L677-L702 HydrophobicContact CD1-CB 4.08Å; L677-L702 HydrophobicContact CD1-CD1 4.33Å; L677-L702 HydrophobicContact CD1-CD2 4.39Å; D698-L702 WeakPolarHBondContact O-CB 3.19Å; D698-L702 PolarHBondContact O-N 3.06Å; L699-L702 PolarHBondContact O-N 3.32Å; L702-S704 VanDerWaalsContact C-N 3.33Å; L702-S704 PolarHBondContact O-N 3.23Å; L702-F705 WeakPolarHBondContact O-CB 3.41Å; L702-F705 PolarHBondContact O-N 3.27Å; L702-I706 HydrophobicContact CD1-CD1 4.14Å; L702-I706 HydrophobicContact CD1-CG1 4.31Å; L702-I706 HydrophobicContact CG-CD1 4.08Å; L702-I706 WeakPolarHBondContact O-CG1 3.44Å; L702-I706 PolarHBondContact O-N 3.08Å; L702-V745 HydrophobicContact CD2-CG2 4.24Å; L702-I748 HydrophobicContact CB-CD1 4.35Å; L702-I748 HydrophobicContact CD2-CD1 4.03Å; L702-I748 HydrophobicContact CG-CD1 4.24Å
703	K	94.2	Very high	91.1	Very high	13 Å²	13	54.8 Å²	54.8	6%	0.057	26%	0.26	C	S	.	.	H	α-helix	trans	-58.4	-44.9	174.3	-178.9	176.3	-175.1	-176.6	0	111.8	L699 E700 F705 I706 R707 I748 L752 E755	L699-K703 WeakPolarHBondContact O-CB 3.21Å; L699-K703 PolarHBondContact O-N 2.96Å; E700-K703 PolarHBondContact O-N 2.89Å; K703-F705 VanDerWaalsContact C-N 3.32Å; K703-I706 PolarHBondContact O-N 3.28Å; K703-R707 VanDerWaalsContact O-CB 3.31Å; K703-R707 WeakPolarHBondContact O-CB 3.39Å; K703-R707 PolarHBondContact O-N 2.93Å; K703-I748 HydrophobicContact CB-CG2 3.76Å; K703-I748 HydrophobicContact CG-CG2 3.95Å; K703-L752 HydrophobicContact CD-CD2 4.48Å; K703-L752 HydrophobicContact CG-CD1 4.35Å; K703-L752 HydrophobicContact CG-CD2 3.78Å; K703-L752 HydrophobicContact CG-CG 4.1Å; K703-E755 VanDerWaalsContact CE-OE1 3.27Å; K703-E755 WeakPolarHBondContact CE-OE1 3.16Å; K703-E755 IonicContact NZ-OE1 3.86Å; K703-E755 PolarHBondContact NZ-OE1 3.12Å; K703-E755 IonicContact NZ-OE2 2.68Å
704	S	93.6	Very high	91.6	Very high	49 Å²	49	51.2 Å²	51.2	34%	0.343	24%	0.237	S	C	.	.	H	α-helix	trans	-66	-35.7	176.6	-58.2	0	0	0	0	112.2	E700 R701 L702 R707 R708	E700-S704 WeakPolarHBondContact O-CB 3.39Å; E700-S704 PolarHBondContact O-N 3.41Å; E700-S704 PolarHBondContact O-OG 3.08Å; R701-S704 PolarHBondContact O-N 2.99Å; L702-S704 VanDerWaalsContact C-N 3.33Å; L702-S704 PolarHBondContact O-N 3.23Å; S704-R707 PolarHBondContact O-N 2.94Å; S704-R708 WeakPolarHBondContact O-CG 3.47Å; S704-R708 PolarHBondContact O-N 3.05Å; S704-R708 VanDerWaalsContact O-N 3.14Å
705	F	94.6	Very high	91.9	Very high	2 Å²	2	48.4 Å²	48.4	1%	0.009	22%	0.222	C	C	.	.	H	α-helix	trans	-63.2	-50.5	175.4	-172.6	-100.6	0	0	0	111.5	L648 L664 D673 I675 R701 L702 K703 R707 R708 R709	L648-F705 HydrophobicContact CD1-CD1 4.12Å; L648-F705 HydrophobicContact CD1-CE1 3.63Å; L664-F705 HydrophobicContact CD1-CD1 4.32Å; L664-F705 HydrophobicContact CD1-CE1 3.59Å; L664-F705 HydrophobicContact CD1-CZ 3.72Å; L664-F705 HydrophobicContact CG-CE1 3.67Å; L664-F705 HydrophobicContact CG-CZ 3.98Å; D673-F705 HydrophobicContact CB-CE2 3.93Å; D673-F705 HydrophobicContact CB-CZ 3.96Å; D673-F705 VanDerWaalsContact CG-CE2 3.47Å; D673-F705 VanDerWaalsContact OD2-CE2 3.26Å; D673-F705 WeakPolarHBondContact OD2-CE2 3.33Å; I675-F705 HydrophobicContact CB-CD2 3.82Å; I675-F705 HydrophobicContact CB-CE2 3.92Å; I675-F705 HydrophobicContact CB-CG 4.33Å; I675-F705 HydrophobicContact CB-CZ 4.49Å; I675-F705 HydrophobicContact CD1-CB 4.31Å; I675-F705 HydrophobicContact CD1-CD2 4.25Å; I675-F705 HydrophobicContact CG2-CB 4.42Å; I675-F705 HydrophobicContact CG2-CD1 4.01Å; I675-F705 HydrophobicContact CG2-CD2 3.81Å; I675-F705 HydrophobicContact CG2-CE1 4.16Å; I675-F705 HydrophobicContact CG2-CE2 4.01Å; I675-F705 HydrophobicContact CG2-CG 3.83Å; I675-F705 HydrophobicContact CG2-CZ 4.19Å; R701-F705 WeakPolarHBondContact O-CB 3.39Å; R701-F705 PolarHBondContact O-N 2.96Å; L702-F705 WeakPolarHBondContact O-CB 3.41Å; L702-F705 PolarHBondContact O-N 3.27Å; K703-F705 VanDerWaalsContact C-N 3.32Å; F705-R707 VanDerWaalsContact C-N 3.35Å; F705-R707 PolarHBondContact O-N 3.36Å; F705-R708 PolarHBondContact O-N 2.99Å; F705-R709 PolarHBondContact O-N 2.82Å
706	I	92.8	Very high	92.2	Very high	2 Å²	2	46.7 Å²	46.7	1%	0.01	22%	0.215	C	C	.	.	H	α-helix	trans	-62.4	-40.8	176.1	-64.5	170.1	0	0	0	111.2	L648 L702 K703 R708 R709 P710 P711 I714 I748 L752	L648-I706 HydrophobicContact CD2-CD1 4.04Å; L648-I706 HydrophobicContact CD2-CG1 3.87Å; L702-I706 HydrophobicContact CD1-CD1 4.14Å; L702-I706 HydrophobicContact CD1-CG1 4.31Å; L702-I706 HydrophobicContact CG-CD1 4.08Å; L702-I706 WeakPolarHBondContact O-CG1 3.44Å; L702-I706 PolarHBondContact O-N 3.08Å; K703-I706 PolarHBondContact O-N 3.28Å; I706-R708 VanDerWaalsContact C-N 3.31Å; I706-R708 PolarHBondContact O-N 3.23Å; I706-R709 CarbonylContact O-C 3.41Å; I706-R709 PolarHBondContact O-N 3.35Å; I706-P710 WeakPolarHBondContact O-CA 3.49Å; I706-P711 HydrophobicContact CG2-CG 4.45Å; I706-I714 HydrophobicContact CD1-CD1 4.08Å; I706-I748 HydrophobicContact CD1-CG2 4.09Å; I706-L752 HydrophobicContact CB-CD1 3.88Å; I706-L752 HydrophobicContact CG2-CD1 3.44Å; I706-L752 VanDerWaalsContact CG2-CD1 3.44Å
707	R	92	Very high	92.3	Very high	92 Å²	92	45.2 Å²	45.2	35%	0.347	20%	0.2	S	C	.	.	H	α-helix	trans	-59.8	-38.9	177.5	177.2	-179.2	-60.4	125.5	-9.5	112.7	K703 S704 F705 L752 E755 I757	K703-R707 VanDerWaalsContact O-CB 3.31Å; K703-R707 WeakPolarHBondContact O-CB 3.39Å; K703-R707 PolarHBondContact O-N 2.93Å; S704-R707 PolarHBondContact O-N 2.94Å; F705-R707 VanDerWaalsContact C-N 3.35Å; F705-R707 PolarHBondContact O-N 3.36Å; R707-L752 HydrophobicContact CB-CD2 4.11Å; R707-E755 IonicContact CZ-OE2 3.83Å; R707-E755 IonicContact NE-OE2 3.91Å; R707-E755 IonicContact NH2-OE1 2.83Å; R707-E755 IonicContact NH2-OE2 3.17Å; R707-E755 PolarHBondContact NH2-OE2 2.85Å; R707-I757 HydrophobicContact CB-CG2 4.5Å; R707-I757 HydrophobicContact CG-CD1 3.83Å; R707-I757 HydrophobicContact CG-CG1 4.47Å; R707-I757 HydrophobicContact CG-CG2 4.1Å
708	R	90.5	Very high	91.7	Very high	162 Å²	162	38.7 Å²	38.7	61%	0.611	17%	0.171	S	C	*	.	H	α-helix	trans	-68.8	-38.9	-178.3	-73.9	-176.9	-54.3	158.7	17	112.3	D673 S704 F705 I706	D673-R708 IonicContact OD2-CZ 2.85Å; D673-R708 IonicContact OD2-NH2 3.43Å; D673-R708 PolarHBondContact OD2-NH2 2.88Å; S704-R708 WeakPolarHBondContact O-CG 3.47Å; S704-R708 PolarHBondContact O-N 3.05Å; S704-R708 VanDerWaalsContact O-N 3.14Å; F705-R708 PolarHBondContact O-N 2.99Å; I706-R708 VanDerWaalsContact C-N 3.31Å; I706-R708 PolarHBondContact O-N 3.23Å
709	R	88.7	Confident	90.6	Very high	117 Å²	117	38.4 Å²	38.4	44%	0.442	17%	0.17	S	C	.	.	S	Bend	trans	-140.9	93.1	-179.2	-72.7	-171.7	173.1	165.4	-6.9	108.7	L646 L664 V672 F705 I706 P711	L646-R709 HydrophobicContact CD1-CB 3.93Å; L664-R709 HydrophobicContact CD1-CB 3.72Å; V672-R709 PolarHBondContact O-NH1 3.28Å; F705-R709 PolarHBondContact O-N 2.82Å; I706-R709 CarbonylContact O-C 3.41Å; I706-R709 PolarHBondContact O-N 3.35Å; R709-P711 WeakPolarHBondContact O-CD 3.26Å
710	P	89.6	Confident	88.9	Confident	63 Å²	63	37.8 Å²	37.8	41%	0.409	17%	0.168	S	C	.	.			trans	-69.5	124.3	-174.3	27.1	-33.6	0	0	0	110.8	I706 L758	I706-P710 WeakPolarHBondContact O-CA 3.49Å; P710-L758 HydrophobicContact CB-CD2 3.45Å; P710-L758 VanDerWaalsContact CB-CD2 3.45Å
711	P	91.6	Very high	86.7	Confident	4 Å²	4	35.6 Å²	35.6	3%	0.026	16%	0.159	C	C	.	.			trans	-82.6	157.8	175.8	34.2	-33.6	0	0	0	111.8	L646 L648 L664 I706 R709 I714 V762	L646-P711 CarbonylContact O-C 3.58Å; L646-P711 WeakPolarHBondContact O-CA 3.39Å; L646-P711 VanDerWaalsContact O-CB 3.29Å; L646-P711 WeakPolarHBondContact O-CB 3.5Å; L648-P711 HydrophobicContact CB-CB 3.84Å; L648-P711 HydrophobicContact CB-CG 3.91Å; L648-P711 HydrophobicContact CD2-CG 4.42Å; L664-P711 HydrophobicContact CD2-CB 4.07Å; I706-P711 HydrophobicContact CG2-CG 4.45Å; R709-P711 WeakPolarHBondContact O-CD 3.26Å; P711-I714 HydrophobicContact CG-CD1 4.35Å; P711-I714 HydrophobicContact CG-CG1 3.9Å; P711-V762 WeakPolarHBondContact O-CG2 3.3Å
712	I	89.5	Confident	84	Confident	23 Å²	23	35.3 Å²	35.3	12%	0.118	17%	0.174	C	C	.	.	S	Bend	trans	-80.6	-28.4	173.5	67	171.2	0	0	0	112.3	Y629 L631 Q645 L646 I647	Y629-I712 HydrophobicContact CD1-CD1 4Å; Y629-I712 HydrophobicContact CD1-CG1 4.48Å; Y629-I712 HydrophobicContact CE1-CD1 4.22Å; Y629-I712 HydrophobicContact CE1-CG1 4.38Å; L631-I712 HydrophobicContact CD1-CB 3.73Å; L631-I712 HydrophobicContact CD1-CG2 3.68Å; L631-I712 HydrophobicContact CD2-CB 4.16Å; L631-I712 HydrophobicContact CG-CB 4.02Å; L631-I712 HydrophobicContact CG-CD1 4.34Å; L631-I712 HydrophobicContact CG-CG2 4.47Å; Q645-I712 HydrophobicContact CB-CD1 3.94Å; Q645-I712 HydrophobicContact CG-CD1 3.98Å; L646-I712 WeakPolarHBondContact O-CG1 3.39Å; L646-I712 PolarHBondContact O-N 3.24Å; I647-I712 HydrophobicContact CG1-CG1 4.35Å
713	V	91.8	Very high	81.3	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	146.3	179.7	67.1	0	0	0	0	109.7	Y629 I647 L648 P763 E765 L802	Y629-V713 HydrophobicContact CD1-CB 4.14Å; Y629-V713 HydrophobicContact CD1-CG1 3.8Å; Y629-V713 HydrophobicContact CD2-CG2 4.43Å; Y629-V713 HydrophobicContact CE1-CB 3.64Å; Y629-V713 HydrophobicContact CE1-CG1 3.83Å; Y629-V713 HydrophobicContact CE1-CG2 4.19Å; Y629-V713 HydrophobicContact CE2-CB 4.25Å; Y629-V713 HydrophobicContact CE2-CG2 3.87Å; Y629-V713 HydrophobicContact CG-CG1 4.16Å; I647-V713 HydrophobicContact CB-CG1 4.35Å; I647-V713 HydrophobicContact CD1-CG1 4.27Å; I647-V713 HydrophobicContact CG1-CG1 3.92Å; I647-V713 HydrophobicContact CG2-CG1 3.95Å; L648-V713 PolarHBondContact N-O 3.08Å; V713-P763 HydrophobicContact CG2-CB 4.39Å; V713-E765 HydrophobicContact CG2-CG 4.02Å; V713-L802 HydrophobicContact CB-CD2 4.35Å; V713-L802 HydrophobicContact CG1-CD2 3.51Å; V713-L802 HydrophobicContact CG1-CG 4.43Å; V713-L802 HydrophobicContact CG2-CD2 3.85Å
714	I	94.4	Very high	78.6	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	114.7	176.3	-55.8	175.1	0	0	0	108.6	L648 I650 I706 P711 I716 V745 V749 V762 P763 V764 E765	L648-I714 HydrophobicContact CB-CB 4.49Å; L648-I714 HydrophobicContact CB-CG1 4.13Å; L648-I714 HydrophobicContact CB-CG2 4.35Å; L648-I714 HydrophobicContact CD2-CD1 4.11Å; L648-I714 HydrophobicContact CD2-CG1 3.95Å; L648-I714 HydrophobicContact CD2-CG2 3.91Å; L648-I714 HydrophobicContact CG-CG2 4.26Å; L648-I714 CarbonylContact O-C 3.57Å; L648-I714 WeakPolarHBondContact O-CA 3.17Å; I650-I714 HydrophobicContact CD1-CG2 3.65Å; I650-I714 HydrophobicContact CG1-CG2 4.13Å; I706-I714 HydrophobicContact CD1-CD1 4.08Å; P711-I714 HydrophobicContact CG-CD1 4.35Å; P711-I714 HydrophobicContact CG-CG1 3.9Å; I714-I716 HydrophobicContact CG2-CG1 4.37Å; I714-V745 HydrophobicContact CD1-CG1 3.72Å; I714-V745 HydrophobicContact CG2-CG1 4.17Å; I714-V749 HydrophobicContact CD1-CG2 3.88Å; I714-V762 HydrophobicContact CD1-CG1 4.25Å; I714-V762 HydrophobicContact CG1-CG1 3.92Å; I714-P763 PolarHBondContact N-O 2.89Å; I714-V764 HydrophobicContact CB-CG2 4.4Å; I714-V764 HydrophobicContact CD1-CG2 4.49Å; I714-V764 CarbonylContact O-C 3.43Å; I714-V764 WeakPolarHBondContact O-CA 3.43Å; I714-E765 PolarHBondContact O-N 3.3Å
715	A	93.9	Very high	76.1	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	122.6	177.8	0	0	0	0	0	110.6	L648 G649 I650 E765 V767 I798 L802	L648-A715 PolarHBondContact O-N 3.09Å; G649-A715 CarbonylContact C-O 3.6Å; I650-A715 PolarHBondContact N-O 2.86Å; A715-E765 CarbonylContact C-O 3.6Å; A715-E765 WeakPolarHBondContact CA-O 3.43Å; A715-V767 HydrophobicContact CB-CG2 3.95Å; A715-I798 HydrophobicContact CB-CG2 3.59Å; A715-L802 HydrophobicContact CB-CD2 3.89Å
716	I	92.4	Very high	73.5	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	129.4	178.6	-61.2	178.4	0	0	0	109.2	I650 Y652 I714 G718 L741 V742 V745 V764 E765 V766 V767	I650-I716 HydrophobicContact CB-CG1 4.3Å; I650-I716 HydrophobicContact CD1-CG1 4.34Å; Y652-I716 HydrophobicContact CE1-CG2 3.92Å; I714-I716 HydrophobicContact CG2-CG1 4.37Å; I716-G718 PolarHBondContact O-N 3.25Å; I716-L741 HydrophobicContact CD1-CD2 4.5Å; I716-L741 HydrophobicContact CD1-CG 4.21Å; I716-L741 HydrophobicContact CG2-CD2 3.91Å; I716-V742 HydrophobicContact CD1-CB 4.43Å; I716-V742 HydrophobicContact CD1-CG2 3.73Å; I716-V745 HydrophobicContact CD1-CB 4.5Å; I716-V745 HydrophobicContact CD1-CG2 4.21Å; I716-V764 HydrophobicContact CD1-CG1 3.38Å; I716-V764 HydrophobicContact CG1-CG1 4.08Å; I716-E765 PolarHBondContact N-O 3.05Å; I716-V766 WeakPolarHBondContact O-CA 3.31Å; I716-V767 PolarHBondContact O-N 3.26Å
717	A	89.1	Confident	71.1	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.1	124.5	176	0	0	0	0	0	112	I650 Y652 S719 D769 I798	I650-A717 PolarHBondContact O-N 3.38Å; Y652-A717 WeakPolarHBondContact CE1-O 3.34Å; Y652-A717 PolarHBondContact OH-O 2.97Å; Y652-A717 VanDerWaalsContact OH-O 3.06Å; A717-S719 PolarHBondContact O-N 3.49Å; A717-D769 HydrophobicContact CB-CB 4.16Å; A717-I798 HydrophobicContact CB-CD1 4.31Å; A717-I798 HydrophobicContact CB-CG1 4.14Å
718	G	79.8	Confident	68.8	Low	0 Å²	0	58.7 Å²	58.7	0%	0	32%	0.315	C	S	.	.			trans	-79.2	46.1	176.2	0	0	0	0	0	113.2	I716 V767 K1035	I716-G718 PolarHBondContact O-N 3.25Å; G718-V767 WeakPolarHBondContact CA-O 3.17Å; G718-V767 PolarHBondContact N-O 3.48Å; G718-K1035 PolarHBondContact O-NZ 2.83Å
719	S	68.4	Low	66.6	Low	1 Å²	1	57 Å²	57	1%	0.007	32%	0.318	C	S	.	.			trans	-66	130.9	-171.8	-72.5	0	0	0	0	113.8	M654 A717 D769	M654-S719 VanDerWaalsContact CE-CB 3.47Å; A717-S719 PolarHBondContact O-N 3.49Å; S719-D769 WeakPolarHBondContact CA-OD2 3.44Å; S719-D769 WeakPolarHBondContact CB-OD2 3.4Å; S719-D769 PolarHBondContact OG-OD2 2.65Å
720	S	55.7	Low	64.6	Low	20 Å²	20	55.4 Å²	55.4	14%	0.14	32%	0.315	C	S	.	.			trans	-133.5	160.3	176.9	-176.2	0	0	0	0	112.1	M654 V722 L1033 I1034	M654-S720 WeakPolarHBondContact CE-O 3.49Å; S720-V722 PolarHBondContact O-N 2.86Å; S720-L1033 WeakPolarHBondContact CB-O 3.49Å; S720-L1033 PolarHBondContact OG-O 3.42Å; S720-I1034 PolarHBondContact OG-O 3.23Å
721	L	48.7	Very low	62.6	Low	54 Å²	54	53.9 Å²	53.9	28%	0.283	30%	0.304	S	S	.	.			trans	-64.3	120.9	178.2	-69.8	161.9	0	0	0	112.5	N731 L734	L721-N731 HydrophobicContact CD1-CB 4.04Å; L721-N731 VanDerWaalsContact CD1-OD1 3.3Å; L721-N731 WeakPolarHBondContact CD1-OD1 3.38Å; L721-L734 HydrophobicContact CD1-CD1 4.44Å; L721-L734 HydrophobicContact CD2-CD1 4.41Å; L721-L734 HydrophobicContact CD2-CD2 4.36Å
722	V	39.2	Very low	60.5	Low	140 Å²	140	55.8 Å²	55.8	85%	0.848	31%	0.312	S	S	*	.			trans	-135.8	75.3	138.4	-173.9	0	0	0	0	107.6	S720	S720-V722 PolarHBondContact O-N 2.86Å
723	S	37.3	Very low	58.6	Low	104 Å²	104	57.6 Å²	57.6	73%	0.727	32%	0.318	S	S	*	.			trans	-146.5	117	161.6	-179.6	0	0	0	0	109.1	L725	S723-L725 PolarHBondContact O-N 3.05Å
724	A	36.7	Very low	56.7	Low	81 Å²	81	58 Å²	58	67%	0.669	32%	0.32	S	S	*	.			trans	-91.2	20.5	-154.4	0	0	0	0	0	116.2
725	L	40.3	Very low	55.1	Low	168 Å²	168	59.4 Å²	59.4	88%	0.88	33%	0.325	S	S	*	.	S	Bend	trans	-128.2	17.2	-165.5	-82.7	164.3	0	0	0	119.5	S723	S723-L725 PolarHBondContact O-N 3.05Å
726	S	41.7	Very low	53.8	Low	80 Å²	80	64.8 Å²	64.8	56%	0.559	35%	0.345	S	S	*	.	S	Bend	trans	-140.9	91.6	164.8	-165.6	0	0	0	0	112.8
727	K	42	Very low	52.8	Low	155 Å²	155	65.7 Å²	65.7	67%	0.674	35%	0.35	S	S	*	.			trans	-94.2	0.6	-131.6	-137	173.7	-174.8	176.9	0	119.8
728	W	44.3	Very low	52.2	Low	61 Å²	61	65.7 Å²	65.7	23%	0.231	35%	0.35	C	S	.	.	S	Bend	trans	-150.1	-19.5	-177.6	-90.3	96.4	0	0	0	118.7	R1050 R1113	W728-R1050 HydrophobicContact CD2-CB 4.37Å; W728-R1050 HydrophobicContact CE3-CB 3.66Å; W728-R1050 HydrophobicContact CE3-CG 4.39Å; W728-R1050 HydrophobicContact CH2-CB 3.3Å; W728-R1050 VanDerWaalsContact CH2-N 3.34Å; W728-R1050 HydrophobicContact CZ2-CB 4.01Å; W728-R1050 HydrophobicContact CZ3-CB 3.07Å; W728-R1050 HydrophobicContact CZ3-CG 4.23Å; W728-R1113 HydrophobicContact CE3-CG 4.29Å; W728-R1113 WeakPolarHBondContact CH2-O 3.48Å; W728-R1113 HydrophobicContact CZ3-CB 4.02Å; W728-R1113 HydrophobicContact CZ3-CG 3.86Å; W728-R1113 VanDerWaalsContact CZ3-O 3.26Å; W728-R1113 WeakPolarHBondContact CZ3-O 3.32Å
729	L	44.4	Very low	52.2	Low	125 Å²	125	67.6 Å²	67.6	65%	0.654	36%	0.36	S	S	*	.	S	Bend	trans	-103.2	-26	-177.6	-91.2	151.6	0	0	0	113.8
730	Q	46.3	Very low	52.8	Low	84 Å²	84	70 Å²	70	39%	0.393	37%	0.371	S	S	.	.	S	Bend	trans	-72.6	-40.8	177.3	-121.3	99.8	14.3	0	0	112.6	F732 Y733 L734	Q730-F732 VanDerWaalsContact C-N 3.28Å; Q730-F732 PolarHBondContact O-N 2.98Å; Q730-F732 VanDerWaalsContact O-N 3.08Å; Q730-Y733 PolarHBondContact O-N 3.28Å; Q730-L734 WeakPolarHBondContact O-CD1 3.43Å
731	N	46.2	Very low	54.2	Low	31 Å²	31	69.4 Å²	69.4	17%	0.166	37%	0.366	C	S	.	.	G	3₁₀ helix	trans	-60.8	-25.9	-167.6	-65.4	8.1	0	0	0	115.5	L721 Y733 E1115 G1117	L721-N731 HydrophobicContact CD1-CB 4.04Å; L721-N731 VanDerWaalsContact CD1-OD1 3.3Å; L721-N731 WeakPolarHBondContact CD1-OD1 3.38Å; N731-Y733 PolarHBondContact O-N 3.44Å; N731-E1115 PolarHBondContact ND2-O 3.09Å; N731-G1117 WeakPolarHBondContact O-CA 3.48Å
732	F	47.5	Very low	56.1	Low	44 Å²	44	67.9 Å²	67.9	19%	0.193	36%	0.359	C	S	.	.	G	3₁₀ helix	trans	-64.5	-10.5	-178	179	-104.8	0	0	0	114.4	Q730 T1119	Q730-F732 VanDerWaalsContact C-N 3.28Å; Q730-F732 PolarHBondContact O-N 2.98Å; Q730-F732 VanDerWaalsContact O-N 3.08Å; F732-T1119 HydrophobicContact CD2-CG2 4.11Å; F732-T1119 HydrophobicContact CE2-CG2 3.66Å
733	Y	50.7	Low	58.4	Low	62 Å²	62	66.5 Å²	66.5	24%	0.243	34%	0.342	C	S	.	.	G	3₁₀ helix	trans	-123.8	-6	-164.7	-65.6	-74.3	0	0	0	116.6	Q730 N731 M737	Q730-Y733 PolarHBondContact O-N 3.28Å; N731-Y733 PolarHBondContact O-N 3.44Å; Y733-M737 WeakPolarHBondContact O-CB 3.3Å; Y733-M737 PolarHBondContact O-N 3.43Å
734	L	51.5	Low	60.9	Low	9 Å²	9	62.6 Å²	62.6	5%	0.047	31%	0.313	C	S	.	.	H	α-helix	trans	-83.5	-48.7	-170.8	-76.7	98	0	0	0	115.2	M654 L721 Q730 R736 M737 A738	M654-L734 HydrophobicContact CB-CD2 4.35Å; M654-L734 HydrophobicContact SD-CD2 3.68Å; L721-L734 HydrophobicContact CD1-CD1 4.44Å; L721-L734 HydrophobicContact CD2-CD1 4.41Å; L721-L734 HydrophobicContact CD2-CD2 4.36Å; Q730-L734 WeakPolarHBondContact O-CD1 3.43Å; L734-R736 PolarHBondContact O-N 3.27Å; L734-M737 VanDerWaalsContact O-CA 3.31Å; L734-M737 WeakPolarHBondContact O-CA 3.43Å; L734-M737 WeakPolarHBondContact O-CB 3.43Å; L734-M737 PolarHBondContact O-N 3.42Å; L734-A738 PolarHBondContact O-N 3.25Å
735	Y	61.6	Low	63.5	Low	29 Å²	29	58.8 Å²	58.8	11%	0.114	28%	0.281	C	S	.	.	H	α-helix	trans	-62.5	-33.4	171.9	74.4	-91.6	0	0	0	111	M737 A738 L739 L1118 M1157	Y735-M737 PolarHBondContact O-N 2.61Å; Y735-A738 PolarHBondContact O-N 3.13Å; Y735-L739 HydrophobicContact CD2-CD1 4.27Å; Y735-L739 WeakPolarHBondContact O-CG 3.4Å; Y735-L739 PolarHBondContact O-N 3.18Å; Y735-L1118 HydrophobicContact CD1-CD2 4.38Å; Y735-L1118 HydrophobicContact CE1-CD2 4.07Å; Y735-M1157 HydrophobicContact CD2-CB 4.06Å; Y735-M1157 HydrophobicContact CD2-CE 3.74Å; Y735-M1157 HydrophobicContact CD2-CG 4.13Å; Y735-M1157 HydrophobicContact CE2-CB 3.5Å; Y735-M1157 HydrophobicContact CE2-CE 4.33Å; Y735-M1157 HydrophobicContact CE2-CG 4.01Å; Y735-M1157 HydrophobicContact CG-CE 4.15Å
736	R	65.5	Low	66.1	Low	113 Å²	113	53.4 Å²	53.4	43%	0.426	25%	0.253	S	S	.	.	H	α-helix	trans	-62.1	-31.1	170.7	-173.9	179	163.2	162.6	2	110.4	L734 L739 E740	L734-R736 PolarHBondContact O-N 3.27Å; R736-L739 PolarHBondContact O-N 3.17Å; R736-E740 HydrophobicContact CG-CG 3.58Å; R736-E740 IonicContact CZ-OE2 2.91Å; R736-E740 IonicContact NE-OE2 2.73Å; R736-E740 PolarHBondContact NE-OE2 3Å; R736-E740 IonicContact NH2-OE2 3.83Å; R736-E740 PolarHBondContact NH2-OE2 2.98Å; R736-E740 WeakPolarHBondContact O-CB 3.33Å; R736-E740 WeakPolarHBondContact O-CG 3.25Å; R736-E740 PolarHBondContact O-N 3.24Å
737	M	71.3	Confident	68.5	Low	18 Å²	18	55.1 Å²	55.1	9%	0.089	25%	0.25	C	S	.	.	H	α-helix	trans	-65.1	-48.4	176.9	-157.7	162.7	72.2	0	0	111.8	Y652 T681 Y733 L734 Y735 L739 E740 L741	Y652-M737 HydrophobicContact CD2-CE 3.23Å; Y652-M737 HydrophobicContact CE2-CE 3.26Å; Y652-M737 HydrophobicContact CG-CE 4.2Å; T681-M737 VanDerWaalsContact CB-SD 3.51Å; T681-M737 HydrophobicContact CG2-CE 3.85Å; T681-M737 HydrophobicContact CG2-CG 3.99Å; T681-M737 HydrophobicContact CG2-SD 3.55Å; T681-M737 VanDerWaalsContact CG2-SD 3.55Å; Y733-M737 WeakPolarHBondContact O-CB 3.3Å; Y733-M737 PolarHBondContact O-N 3.43Å; L734-M737 VanDerWaalsContact O-CA 3.31Å; L734-M737 WeakPolarHBondContact O-CA 3.43Å; L734-M737 WeakPolarHBondContact O-CB 3.43Å; L734-M737 PolarHBondContact O-N 3.42Å; Y735-M737 PolarHBondContact O-N 2.61Å; M737-L739 VanDerWaalsContact C-N 3.34Å; M737-L739 PolarHBondContact O-N 2.8Å; M737-E740 PolarHBondContact O-N 2.86Å; M737-L741 WeakPolarHBondContact O-CB 3.33Å; M737-L741 PolarHBondContact O-N 3.29Å
738	A	77	Confident	70.9	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-54.6	-51.5	174	0	0	0	0	0	110.6	Y652 L734 Y735 L741 V742 L1033	Y652-A738 WeakPolarHBondContact OH-CA 3.5Å; Y652-A738 VanDerWaalsContact OH-CB 3.25Å; Y652-A738 WeakPolarHBondContact OH-CB 3.48Å; L734-A738 PolarHBondContact O-N 3.25Å; Y735-A738 PolarHBondContact O-N 3.13Å; A738-L741 PolarHBondContact O-N 3.33Å; A738-V742 WeakPolarHBondContact O-CB 3.24Å; A738-V742 WeakPolarHBondContact O-CG2 3.5Å; A738-V742 PolarHBondContact O-N 3.13Å; A738-L1033 HydrophobicContact CB-CD2 3.79Å
739	L	80.2	Confident	73.1	Confident	40 Å²	40	45.2 Å²	45.2	21%	0.209	21%	0.209	C	C	.	.	H	α-helix	trans	-69.1	-35.3	-177.8	-64.8	177.4	0	0	0	113.7	Y735 R736 M737 K743 M1029 L1033 M1157	Y735-L739 HydrophobicContact CD2-CD1 4.27Å; Y735-L739 WeakPolarHBondContact O-CG 3.4Å; Y735-L739 PolarHBondContact O-N 3.18Å; R736-L739 PolarHBondContact O-N 3.17Å; M737-L739 VanDerWaalsContact C-N 3.34Å; M737-L739 PolarHBondContact O-N 2.8Å; L739-K743 VanDerWaalsContact O-CG 3.28Å; L739-K743 WeakPolarHBondContact O-CG 3.32Å; L739-K743 PolarHBondContact O-N 3.31Å; L739-M1029 HydrophobicContact CD2-CE 4.25Å; L739-L1033 HydrophobicContact CD2-CD1 4.39Å; L739-L1033 HydrophobicContact CG-CD1 4.39Å; L739-M1157 HydrophobicContact CD1-CG 3.95Å
740	E	80.5	Confident	75.4	Confident	53 Å²	53	42.7 Å²	42.7	25%	0.248	20%	0.202	C	C	.	.	H	α-helix	trans	-74.6	-34.3	175.7	-62.9	-79.6	101.4	0	0	110.8	R736 M737 K743 D744	R736-E740 HydrophobicContact CG-CG 3.58Å; R736-E740 IonicContact CZ-OE2 2.91Å; R736-E740 IonicContact NE-OE2 2.73Å; R736-E740 PolarHBondContact NE-OE2 3Å; R736-E740 IonicContact NH2-OE2 3.83Å; R736-E740 PolarHBondContact NH2-OE2 2.98Å; R736-E740 WeakPolarHBondContact O-CB 3.33Å; R736-E740 WeakPolarHBondContact O-CG 3.25Å; R736-E740 PolarHBondContact O-N 3.24Å; M737-E740 PolarHBondContact O-N 2.86Å; E740-K743 WeakPolarHBondContact O-CB 3.49Å; E740-K743 PolarHBondContact O-N 3.26Å; E740-K743 WeakPolarHBondContact OE1-CD 3.47Å; E740-K743 IonicContact OE1-NZ 3.63Å; E740-K743 PolarHBondContact OE1-NZ 3.43Å; E740-D744 WeakPolarHBondContact O-CB 3.5Å; E740-D744 VanDerWaalsContact O-CG 3.26Å; E740-D744 PolarHBondContact O-N 2.97Å
741	L	85.3	Confident	77.6	Confident	7 Å²	7	42.6 Å²	42.6	4%	0.037	20%	0.202	C	C	.	.	H	α-helix	trans	-64.8	-46.3	171.9	-178.6	61	0	0	0	110.3	I650 Y652 L680 I716 M737 A738 K743 D744 V745	I650-L741 HydrophobicContact CG2-CD2 4.06Å; Y652-L741 HydrophobicContact CD1-CD2 3.57Å; Y652-L741 HydrophobicContact CE1-CD2 3.75Å; L680-L741 HydrophobicContact CD1-CD1 3.95Å; L680-L741 HydrophobicContact CD2-CD1 3.81Å; L680-L741 HydrophobicContact CD2-CD2 4.49Å; L680-L741 HydrophobicContact CG-CD1 3.87Å; I716-L741 HydrophobicContact CD1-CD2 4.5Å; I716-L741 HydrophobicContact CD1-CG 4.21Å; I716-L741 HydrophobicContact CG2-CD2 3.91Å; M737-L741 WeakPolarHBondContact O-CB 3.33Å; M737-L741 PolarHBondContact O-N 3.29Å; A738-L741 PolarHBondContact O-N 3.33Å; L741-K743 VanDerWaalsContact C-N 3.27Å; L741-K743 PolarHBondContact O-N 2.98Å; L741-D744 PolarHBondContact O-N 3.43Å; L741-D744 VanDerWaalsContact O-N 3.1Å; L741-V745 HydrophobicContact CD1-CG2 4.03Å; L741-V745 HydrophobicContact CG-CG2 4.28Å; L741-V745 WeakPolarHBondContact O-CB 3.27Å; L741-V745 VanDerWaalsContact O-CG2 3.29Å; L741-V745 WeakPolarHBondContact O-CG2 3.43Å; L741-V745 PolarHBondContact O-N 3.38Å
742	V	88.1	Confident	79.7	Confident	22 Å²	22	41.1 Å²	41.1	13%	0.133	19%	0.194	C	C	.	.	H	α-helix	trans	-53.6	-45.7	171.1	169.4	0	0	0	0	110.3	I716 A738 N746 V764 V766	I716-V742 HydrophobicContact CD1-CB 4.43Å; I716-V742 HydrophobicContact CD1-CG2 3.73Å; A738-V742 WeakPolarHBondContact O-CB 3.24Å; A738-V742 WeakPolarHBondContact O-CG2 3.5Å; A738-V742 PolarHBondContact O-N 3.13Å; V742-N746 VanDerWaalsContact CG1-ND2 3.27Å; V742-N746 WeakPolarHBondContact CG1-ND2 3.42Å; V742-N746 VanDerWaalsContact O-CB 3.26Å; V742-N746 WeakPolarHBondContact O-CB 3.26Å; V742-N746 PolarHBondContact O-N 3.11Å; V742-N746 PolarHBondContact O-ND2 2.88Å; V742-V764 HydrophobicContact CG1-CG1 4.26Å; V742-V764 HydrophobicContact CG2-CG1 4.31Å; V742-V766 HydrophobicContact CG2-CG2 3.67Å
743	K	88.8	Confident	81.7	Confident	111 Å²	111	41.5 Å²	41.5	48%	0.483	20%	0.199	S	C	.	.	H	α-helix	trans	-63.7	-42.8	176.2	-73	171.6	-166.9	171.3	0	112.8	L739 E740 L741 N746 K747	L739-K743 VanDerWaalsContact O-CG 3.28Å; L739-K743 WeakPolarHBondContact O-CG 3.32Å; L739-K743 PolarHBondContact O-N 3.31Å; E740-K743 WeakPolarHBondContact O-CB 3.49Å; E740-K743 PolarHBondContact O-N 3.26Å; E740-K743 WeakPolarHBondContact OE1-CD 3.47Å; E740-K743 IonicContact OE1-NZ 3.63Å; E740-K743 PolarHBondContact OE1-NZ 3.43Å; L741-K743 VanDerWaalsContact C-N 3.27Å; L741-K743 PolarHBondContact O-N 2.98Å; K743-N746 PolarHBondContact O-N 3.49Å; K743-K747 VanDerWaalsContact O-CG 3.31Å; K743-K747 WeakPolarHBondContact O-CG 3.4Å; K743-K747 PolarHBondContact O-N 3.38Å
744	D	90	Very high	83.6	Confident	22 Å²	22	42.8 Å²	42.8	12%	0.118	22%	0.223	C	C	.	.	H	α-helix	trans	-68.9	-40.2	-178.4	-72.3	-20.1	0	0	0	111.1	K695 L699 E740 L741 K747 I748	K695-D744 WeakPolarHBondContact CE-OD2 3.28Å; K695-D744 IonicContact NZ-OD2 3.83Å; K695-D744 PolarHBondContact NZ-OD2 3.26Å; L699-D744 HydrophobicContact CD2-CB 4.07Å; E740-D744 WeakPolarHBondContact O-CB 3.5Å; E740-D744 VanDerWaalsContact O-CG 3.26Å; E740-D744 PolarHBondContact O-N 2.97Å; L741-D744 PolarHBondContact O-N 3.43Å; L741-D744 VanDerWaalsContact O-N 3.1Å; D744-K747 WeakPolarHBondContact O-CB 3.49Å; D744-K747 PolarHBondContact O-N 3.31Å; D744-K747 IonicContact OD1-NZ 2.68Å; D744-K747 PolarHBondContact OD1-NZ 3.36Å; D744-I748 WeakPolarHBondContact O-CG1 3.42Å; D744-I748 PolarHBondContact O-N 3.17Å; D744-I748 VanDerWaalsContact O-N 3.1Å
745	V	91.2	Very high	85.5	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-65.6	-44.8	172.9	175.9	0	0	0	0	110.9	I650 L702 I714 I716 L741 K747 I748 V749 V764	I650-V745 HydrophobicContact CD1-CG2 4.18Å; L702-V745 HydrophobicContact CD2-CG2 4.24Å; I714-V745 HydrophobicContact CD1-CG1 3.72Å; I714-V745 HydrophobicContact CG2-CG1 4.17Å; I716-V745 HydrophobicContact CD1-CB 4.5Å; I716-V745 HydrophobicContact CD1-CG2 4.21Å; L741-V745 HydrophobicContact CD1-CG2 4.03Å; L741-V745 HydrophobicContact CG-CG2 4.28Å; L741-V745 WeakPolarHBondContact O-CB 3.27Å; L741-V745 VanDerWaalsContact O-CG2 3.29Å; L741-V745 WeakPolarHBondContact O-CG2 3.43Å; L741-V745 PolarHBondContact O-N 3.38Å; V745-K747 PolarHBondContact O-N 2.83Å; V745-I748 WeakPolarHBondContact O-CA 3.47Å; V745-I748 WeakPolarHBondContact O-CB 2.92Å; V745-I748 PolarHBondContact O-N 3.38Å; V745-V749 HydrophobicContact CG1-CG2 4.36Å; V745-V749 WeakPolarHBondContact O-CG2 3.28Å; V745-V749 PolarHBondContact O-N 2.87Å; V745-V764 HydrophobicContact CG1-CG1 4.21Å; V745-V764 HydrophobicContact CG1-CG2 3.79Å
746	N	93.2	Very high	86.5	Confident	55 Å²	55	52 Å²	52	29%	0.294	27%	0.271	S	S	.	.	H	α-helix	trans	-59.8	-34.5	175.5	-83.9	-60.2	0	0	0	112.6	V742 K743 S750	V742-N746 VanDerWaalsContact CG1-ND2 3.27Å; V742-N746 WeakPolarHBondContact CG1-ND2 3.42Å; V742-N746 VanDerWaalsContact O-CB 3.26Å; V742-N746 WeakPolarHBondContact O-CB 3.26Å; V742-N746 PolarHBondContact O-N 3.11Å; V742-N746 PolarHBondContact O-ND2 2.88Å; K743-N746 PolarHBondContact O-N 3.49Å; N746-S750 WeakPolarHBondContact O-CB 3.34Å; N746-S750 PolarHBondContact O-N 3.12Å; N746-S750 PolarHBondContact O-OG 2.98Å
747	K	93.3	Very high	87.3	Confident	117 Å²	117	49.2 Å²	49.2	51%	0.509	27%	0.265	S	S	.	.	H	α-helix	trans	-65.6	-42.9	171.9	-70.4	167.9	-163.2	157.4	0	111.5	K743 D744 V745 S750 Q751	K743-K747 VanDerWaalsContact O-CG 3.31Å; K743-K747 WeakPolarHBondContact O-CG 3.4Å; K743-K747 PolarHBondContact O-N 3.38Å; D744-K747 WeakPolarHBondContact O-CB 3.49Å; D744-K747 PolarHBondContact O-N 3.31Å; D744-K747 IonicContact OD1-NZ 2.68Å; D744-K747 PolarHBondContact OD1-NZ 3.36Å; V745-K747 PolarHBondContact O-N 2.83Å; K747-S750 PolarHBondContact O-N 2.94Å; K747-Q751 VanDerWaalsContact O-CG 3.27Å; K747-Q751 WeakPolarHBondContact O-CG 3.48Å; K747-Q751 PolarHBondContact O-N 3.39Å
748	I	91.4	Very high	87.8	Confident	7 Å²	7	48.8 Å²	48.8	4%	0.036	26%	0.263	C	S	.	.	H	α-helix	trans	-59.8	-48.6	175.9	-69.6	168.5	0	0	0	109.9	L699 L702 K703 I706 D744 V745 S750 Q751 L752	L699-I748 HydrophobicContact CB-CD1 4.25Å; L699-I748 HydrophobicContact CD2-CD1 3.89Å; L702-I748 HydrophobicContact CB-CD1 4.35Å; L702-I748 HydrophobicContact CD2-CD1 4.03Å; L702-I748 HydrophobicContact CG-CD1 4.24Å; K703-I748 HydrophobicContact CB-CG2 3.76Å; K703-I748 HydrophobicContact CG-CG2 3.95Å; I706-I748 HydrophobicContact CD1-CG2 4.09Å; D744-I748 WeakPolarHBondContact O-CG1 3.42Å; D744-I748 PolarHBondContact O-N 3.17Å; D744-I748 VanDerWaalsContact O-N 3.1Å; V745-I748 WeakPolarHBondContact O-CA 3.47Å; V745-I748 WeakPolarHBondContact O-CB 2.92Å; V745-I748 PolarHBondContact O-N 3.38Å; I748-S750 PolarHBondContact O-N 3.36Å; I748-Q751 WeakPolarHBondContact O-CB 3.1Å; I748-Q751 PolarHBondContact O-N 3Å; I748-L752 HydrophobicContact CG2-CD1 3.85Å; I748-L752 HydrophobicContact CG2-CG 4.36Å; I748-L752 WeakPolarHBondContact O-CG 3.47Å; I748-L752 PolarHBondContact O-N 3.16Å
749	V	91.1	Very high	87.9	Confident	0 Å²	0	54 Å²	54	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-57.6	-49.4	176.3	173.8	0	0	0	0	110.5	I714 V745 Q751 L752 V753 L758 V762 V764	I714-V749 HydrophobicContact CD1-CG2 3.88Å; V745-V749 HydrophobicContact CG1-CG2 4.36Å; V745-V749 WeakPolarHBondContact O-CG2 3.28Å; V745-V749 PolarHBondContact O-N 2.87Å; V749-Q751 VanDerWaalsContact C-N 3.27Å; V749-Q751 PolarHBondContact O-N 3.44Å; V749-L752 PolarHBondContact O-N 3.3Å; V749-L752 VanDerWaalsContact O-N 3.1Å; V749-V753 HydrophobicContact CG1-CG2 4.39Å; V749-V753 WeakPolarHBondContact O-CG2 3.45Å; V749-V753 PolarHBondContact O-N 3.21Å; V749-L758 HydrophobicContact CG1-CD1 4.1Å; V749-V762 HydrophobicContact CG1-CB 4.14Å; V749-V764 HydrophobicContact CG2-CG2 4.44Å
750	S	92.6	Very high	87.9	Confident	72 Å²	72	56 Å²	56	50%	0.503	32%	0.323	S	S	.	.	H	α-helix	trans	-58.8	-38.1	178.3	-56.6	0	0	0	0	112.7	N746 K747 I748 A754	N746-S750 WeakPolarHBondContact O-CB 3.34Å; N746-S750 PolarHBondContact O-N 3.12Å; N746-S750 PolarHBondContact O-OG 2.98Å; K747-S750 PolarHBondContact O-N 2.94Å; I748-S750 PolarHBondContact O-N 3.36Å; S750-A754 WeakPolarHBondContact O-CB 3.29Å; S750-A754 PolarHBondContact O-N 3.35Å
751	Q	92.3	Very high	88.1	Confident	83 Å²	83	57.1 Å²	57.1	39%	0.388	34%	0.336	S	S	.	.	H	α-helix	trans	-68.7	-41.7	175.6	-72.9	174	7.5	0	0	112	K747 I748 V749 V753 A754 E755	K747-Q751 VanDerWaalsContact O-CG 3.27Å; K747-Q751 WeakPolarHBondContact O-CG 3.48Å; K747-Q751 PolarHBondContact O-N 3.39Å; I748-Q751 WeakPolarHBondContact O-CB 3.1Å; I748-Q751 PolarHBondContact O-N 3Å; V749-Q751 VanDerWaalsContact C-N 3.27Å; V749-Q751 PolarHBondContact O-N 3.44Å; Q751-V753 VanDerWaalsContact C-N 3.33Å; Q751-A754 PolarHBondContact O-N 2.94Å; Q751-E755 WeakPolarHBondContact O-CB 3.49Å; Q751-E755 VanDerWaalsContact O-CG 3.28Å; Q751-E755 WeakPolarHBondContact O-CG 3.1Å; Q751-E755 PolarHBondContact O-N 2.87Å
752	L	90.8	Very high	88.3	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-69	-31.9	178.8	-69.8	173	0	0	0	112.5	K703 I706 R707 I748 V749 E755 D756 I757 L758	K703-L752 HydrophobicContact CD-CD2 4.48Å; K703-L752 HydrophobicContact CG-CD1 4.35Å; K703-L752 HydrophobicContact CG-CD2 3.78Å; K703-L752 HydrophobicContact CG-CG 4.1Å; I706-L752 HydrophobicContact CB-CD1 3.88Å; I706-L752 HydrophobicContact CG2-CD1 3.44Å; I706-L752 VanDerWaalsContact CG2-CD1 3.44Å; R707-L752 HydrophobicContact CB-CD2 4.11Å; I748-L752 HydrophobicContact CG2-CD1 3.85Å; I748-L752 HydrophobicContact CG2-CG 4.36Å; I748-L752 WeakPolarHBondContact O-CG 3.47Å; I748-L752 PolarHBondContact O-N 3.16Å; V749-L752 PolarHBondContact O-N 3.3Å; V749-L752 VanDerWaalsContact O-N 3.1Å; L752-E755 PolarHBondContact O-N 2.96Å; L752-D756 PolarHBondContact O-N 3Å; L752-I757 HydrophobicContact CD2-CD1 3.64Å; L752-I757 PolarHBondContact O-N 3.44Å; L752-L758 HydrophobicContact CB-CD1 3.67Å; L752-L758 HydrophobicContact CB-CG 3.91Å; L752-L758 HydrophobicContact CD1-CD1 4.15Å; L752-L758 PolarHBondContact O-N 2.87Å
753	V	89.7	Confident	88.4	Confident	51 Å²	51	58.3 Å²	58.3	31%	0.309	35%	0.345	S	S	.	.	H	α-helix	trans	-67.1	-44.3	169.2	173.9	0	0	0	0	110.5	V749 Q751 E755 D756 L758	V749-V753 HydrophobicContact CG1-CG2 4.39Å; V749-V753 WeakPolarHBondContact O-CG2 3.45Å; V749-V753 PolarHBondContact O-N 3.21Å; Q751-V753 VanDerWaalsContact C-N 3.33Å; V753-E755 PolarHBondContact O-N 3.34Å; V753-D756 PolarHBondContact O-N 3.19Å; V753-L758 HydrophobicContact CG2-CB 3.83Å; V753-L758 HydrophobicContact CG2-CD1 4.41Å
754	A	91.3	Very high	88.6	Confident	89 Å²	89	54 Å²	54	74%	0.736	33%	0.328	S	S	*	.	H	α-helix	trans	-65.7	-25.4	176.5	0	0	0	0	0	113.4	S750 Q751 D756	S750-A754 WeakPolarHBondContact O-CB 3.29Å; S750-A754 PolarHBondContact O-N 3.35Å; Q751-A754 PolarHBondContact O-N 2.94Å; A754-D756 VanDerWaalsContact C-N 3.28Å
755	E	89.8	Confident	88.7	Confident	85 Å²	85	53.9 Å²	53.9	40%	0.397	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	4.3	172.8	-72.2	170	-161.6	0	0	113.2	K703 R707 Q751 L752 V753 I757	K703-E755 VanDerWaalsContact CE-OE1 3.27Å; K703-E755 WeakPolarHBondContact CE-OE1 3.16Å; K703-E755 IonicContact NZ-OE1 3.86Å; K703-E755 PolarHBondContact NZ-OE1 3.12Å; K703-E755 IonicContact NZ-OE2 2.68Å; R707-E755 IonicContact CZ-OE2 3.83Å; R707-E755 IonicContact NE-OE2 3.91Å; R707-E755 IonicContact NH2-OE1 2.83Å; R707-E755 IonicContact NH2-OE2 3.17Å; R707-E755 PolarHBondContact NH2-OE2 2.85Å; Q751-E755 WeakPolarHBondContact O-CB 3.49Å; Q751-E755 VanDerWaalsContact O-CG 3.28Å; Q751-E755 WeakPolarHBondContact O-CG 3.1Å; Q751-E755 PolarHBondContact O-N 2.87Å; L752-E755 PolarHBondContact O-N 2.96Å; V753-E755 PolarHBondContact O-N 3.34Å; E755-I757 HydrophobicContact CB-CD1 3.75Å; E755-I757 HydrophobicContact CB-CG1 4.23Å; E755-I757 PolarHBondContact O-N 2.8Å; E755-I757 WeakPolarHBondContact OE2-CD1 3.5Å
756	D	83.2	Confident	88.6	Confident	146 Å²	146	54.1 Å²	54.1	78%	0.781	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.6	27.3	179.8	-151.8	32.6	0	0	0	114.3	L752 V753 A754	L752-D756 PolarHBondContact O-N 3Å; V753-D756 PolarHBondContact O-N 3.19Å; A754-D756 VanDerWaalsContact C-N 3.28Å
757	I	83.2	Confident	88.5	Confident	56 Å²	56	52 Å²	52	29%	0.287	32%	0.317	S	S	.	.	S	Bend	trans	-89	-39.6	176.1	-65.7	156.8	0	0	0	110.6	R707 L752 E755	R707-I757 HydrophobicContact CB-CG2 4.5Å; R707-I757 HydrophobicContact CG-CD1 3.83Å; R707-I757 HydrophobicContact CG-CG1 4.47Å; R707-I757 HydrophobicContact CG-CG2 4.1Å; L752-I757 HydrophobicContact CD2-CD1 3.64Å; L752-I757 PolarHBondContact O-N 3.44Å; E755-I757 HydrophobicContact CB-CD1 3.75Å; E755-I757 HydrophobicContact CB-CG1 4.23Å; E755-I757 PolarHBondContact O-N 2.8Å; E755-I757 WeakPolarHBondContact OE2-CD1 3.5Å
758	L	81.6	Confident	88.4	Confident	9 Å²	9	47.4 Å²	47.4	5%	0.047	30%	0.298	C	S	.	.	S	Bend	trans	-102.2	123.3	176	-64.8	176.4	0	0	0	108.7	P710 V749 L752 V753 S760 V762	P710-L758 HydrophobicContact CB-CD2 3.45Å; P710-L758 VanDerWaalsContact CB-CD2 3.45Å; V749-L758 HydrophobicContact CG1-CD1 4.1Å; L752-L758 HydrophobicContact CB-CD1 3.67Å; L752-L758 HydrophobicContact CB-CG 3.91Å; L752-L758 HydrophobicContact CD1-CD1 4.15Å; L752-L758 PolarHBondContact O-N 2.87Å; V753-L758 HydrophobicContact CG2-CB 3.83Å; V753-L758 HydrophobicContact CG2-CD1 4.41Å; L758-S760 PolarHBondContact O-N 3.2Å; L758-V762 HydrophobicContact CD1-CG2 3.95Å; L758-V762 HydrophobicContact CD2-CG2 4.11Å
759	A	77.4	Confident	88.3	Confident	109 Å²	109	47.5 Å²	47.5	90%	0.901	30%	0.299	S	S	*	.	S	Bend	trans	-61.9	-30.5	179.8	0	0	0	0	0	113
760	S	81.5	Confident	88.2	Confident	82 Å²	82	49.4 Å²	49.4	57%	0.573	31%	0.308	S	S	*	.	S	Bend	trans	-147	167	178.9	67.2	0	0	0	0	111.1	L758 V762	L758-S760 PolarHBondContact O-N 3.2Å; S760-V762 PolarHBondContact O-N 3.1Å; S760-V762 VanDerWaalsContact O-N 3.08Å
761	S	84.9	Confident	88.3	Confident	76 Å²	76	46.1 Å²	46.1	53%	0.531	28%	0.284	S	S	.	.			trans	-68.7	107	176.9	-177.1	0	0	0	0	110.4
762	V	88.5	Confident	88.4	Confident	10 Å²	10	42.2 Å²	42.2	6%	0.061	27%	0.266	C	S	.	.			trans	-61.6	126.7	175.2	176.1	0	0	0	0	110.5	P711 I714 V749 L758 S760	P711-V762 WeakPolarHBondContact O-CG2 3.3Å; I714-V762 HydrophobicContact CD1-CG1 4.25Å; I714-V762 HydrophobicContact CG1-CG1 3.92Å; V749-V762 HydrophobicContact CG1-CB 4.14Å; L758-V762 HydrophobicContact CD1-CG2 3.95Å; L758-V762 HydrophobicContact CD2-CG2 4.11Å; S760-V762 PolarHBondContact O-N 3.1Å; S760-V762 VanDerWaalsContact O-N 3.08Å
763	P	91.2	Very high	88.4	Confident	44 Å²	44	47.2 Å²	47.2	29%	0.286	29%	0.285	S	S	.	.			trans	-64.8	140.9	176.6	-23.6	36	0	0	0	112.4	V713 I714	V713-P763 HydrophobicContact CG2-CB 4.39Å; I714-P763 PolarHBondContact N-O 2.89Å
764	V	91.8	Very high	88.6	Confident	21 Å²	21	45.2 Å²	45.2	13%	0.127	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	104.6	176	-176.7	0	0	0	0	108.4	I714 I716 V742 V745 V749	I714-V764 HydrophobicContact CB-CG2 4.4Å; I714-V764 HydrophobicContact CD1-CG2 4.49Å; I714-V764 CarbonylContact O-C 3.43Å; I714-V764 WeakPolarHBondContact O-CA 3.43Å; I716-V764 HydrophobicContact CD1-CG1 3.38Å; I716-V764 HydrophobicContact CG1-CG1 4.08Å; V742-V764 HydrophobicContact CG1-CG1 4.26Å; V742-V764 HydrophobicContact CG2-CG1 4.31Å; V745-V764 HydrophobicContact CG1-CG1 4.21Å; V745-V764 HydrophobicContact CG1-CG2 3.79Å; V749-V764 HydrophobicContact CG2-CG2 4.44Å
765	E	92	Very high	88.8	Confident	20 Å²	20	41 Å²	41	9%	0.093	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	140.3	-173.9	-66.1	-60.9	160.2	0	0	111.4	V713 I714 A715 I716 F1021 S1023	V713-E765 HydrophobicContact CG2-CG 4.02Å; I714-E765 PolarHBondContact O-N 3.3Å; A715-E765 CarbonylContact C-O 3.6Å; A715-E765 WeakPolarHBondContact CA-O 3.43Å; I716-E765 PolarHBondContact N-O 3.05Å; E765-F1021 HydrophobicContact CB-CZ 4.48Å; E765-F1021 HydrophobicContact CG-CE1 3.96Å; E765-F1021 HydrophobicContact CG-CZ 4.31Å; E765-S1023 VanDerWaalsContact CD-OG 3.29Å; E765-S1023 WeakPolarHBondContact OE1-CB 3.27Å; E765-S1023 PolarHBondContact OE1-OG 3.47Å; E765-S1023 VanDerWaalsContact OE2-CB 3.26Å; E765-S1023 WeakPolarHBondContact OE2-CB 3.31Å; E765-S1023 PolarHBondContact OE2-OG 3.05Å
766	V	90.3	Very high	89	Confident	4 Å²	4	37 Å²	37	2%	0.024	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	120.3	171.4	-178.4	0	0	0	0	108	I716 V742 M1029 M1032 L1033	I716-V766 WeakPolarHBondContact O-CA 3.31Å; V742-V766 HydrophobicContact CG2-CG2 3.67Å; V766-M1029 HydrophobicContact CB-CE 4.16Å; V766-M1029 HydrophobicContact CG2-CE 3.81Å; V766-M1032 HydrophobicContact CG1-SD 4.04Å; V766-L1033 HydrophobicContact CG1-CD2 4.23Å
767	V	91.5	Very high	89.4	Confident	10 Å²	10	36.1 Å²	36.1	6%	0.061	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	139.7	-175.5	-177.6	0	0	0	0	109.5	A715 I716 G718 D769 I798	A715-V767 HydrophobicContact CB-CG2 3.95Å; I716-V767 PolarHBondContact O-N 3.26Å; G718-V767 WeakPolarHBondContact CA-O 3.17Å; G718-V767 PolarHBondContact N-O 3.48Å; V767-D769 PolarHBondContact O-N 3.1Å; V767-I798 HydrophobicContact CB-CD1 4.22Å; V767-I798 HydrophobicContact CB-CG2 4.25Å; V767-I798 HydrophobicContact CG1-CD1 4.1Å
768	D	89.6	Confident	89.9	Confident	21 Å²	21	33.5 Å²	33.5	11%	0.112	20%	0.195	C	C	.	.			trans	-63.3	128.5	176.5	171.6	46.4	0	0	0	111.4	E770 R801 M1032 K1035	D768-E770 PolarHBondContact OD1-N 3.21Å; D768-R801 PolarHBondContact O-NH1 3.31Å; D768-R801 IonicContact OD2-NH1 2.65Å; D768-R801 PolarHBondContact OD2-NH1 2.88Å; D768-R801 IonicContact OD2-NH2 3.29Å; D768-M1032 HydrophobicContact CB-CE 4.11Å; D768-M1032 HydrophobicContact CB-CG 3.93Å; D768-M1032 HydrophobicContact CB-SD 4.07Å; D768-K1035 IonicContact OD1-NZ 2.71Å; D768-K1035 PolarHBondContact OD1-NZ 2.84Å
769	D	89.4	Confident	90.4	Very high	10 Å²	10	38 Å²	38	5%	0.053	22%	0.216	C	C	.	.			trans	-95.1	5.6	-173	71.7	-40.1	0	0	0	114.4	A717 S719 V767 L771 A772 R773 I798 K1035	A717-D769 HydrophobicContact CB-CB 4.16Å; S719-D769 WeakPolarHBondContact CA-OD2 3.44Å; S719-D769 WeakPolarHBondContact CB-OD2 3.4Å; S719-D769 PolarHBondContact OG-OD2 2.65Å; V767-D769 PolarHBondContact O-N 3.1Å; D769-L771 PolarHBondContact O-N 3.29Å; D769-A772 PolarHBondContact O-N 2.97Å; D769-R773 VanDerWaalsContact O-CB 3.3Å; D769-R773 WeakPolarHBondContact O-CB 3.45Å; D769-R773 PolarHBondContact O-N 3.33Å; D769-I798 HydrophobicContact CB-CD1 4.15Å; D769-K1035 VanDerWaalsContact OD1-CE 3.25Å; D769-K1035 WeakPolarHBondContact OD1-CE 3.37Å; D769-K1035 IonicContact OD1-NZ 2.66Å; D769-K1035 PolarHBondContact OD1-NZ 3.06Å
770	E	89.7	Confident	91	Very high	40 Å²	40	34.5 Å²	34.5	19%	0.187	18%	0.183	C	C	.	.	H	α-helix	trans	-60.1	-48.8	-179.4	-170	178.8	179.7	0	0	112.1	D768 R773 V774 L822 K823	D768-E770 PolarHBondContact OD1-N 3.21Å; E770-R773 PolarHBondContact O-N 3.39Å; E770-V774 PolarHBondContact O-N 2.78Å; E770-L822 HydrophobicContact CG-CD2 4.01Å; E770-K823 PolarHBondContact OE1-N 2.98Å
771	L	94.7	Very high	91.5	Very high	2 Å²	2	30.6 Å²	30.6	1%	0.01	16%	0.156	C	C	.	.	H	α-helix	trans	-57.3	-52	174.4	177.3	58.7	0	0	0	111.2	D769 R773 V774 Y775 R801 E808 F809 L812 L822	D769-L771 PolarHBondContact O-N 3.29Å; L771-R773 VanDerWaalsContact C-N 3.26Å; L771-R773 PolarHBondContact O-N 3.47Å; L771-V774 PolarHBondContact O-N 3.19Å; L771-V774 VanDerWaalsContact O-N 3.08Å; L771-Y775 WeakPolarHBondContact O-CB 3.44Å; L771-Y775 PolarHBondContact O-N 2.89Å; L771-R801 HydrophobicContact CD2-CB 4.38Å; L771-R801 HydrophobicContact CD2-CG 4.1Å; L771-E808 HydrophobicContact CD2-CB 4.28Å; L771-E808 HydrophobicContact CD2-CG 3.6Å; L771-E808 HydrophobicContact CG-CG 4.26Å; L771-F809 HydrophobicContact CB-CE1 4.26Å; L771-F809 HydrophobicContact CB-CZ 4.43Å; L771-F809 HydrophobicContact CD1-CD1 3.69Å; L771-F809 HydrophobicContact CD1-CE1 3.89Å; L771-F809 HydrophobicContact CD1-CG 4.33Å; L771-F809 HydrophobicContact CD2-CD1 3.86Å; L771-F809 HydrophobicContact CD2-CD2 3.88Å; L771-F809 HydrophobicContact CD2-CE1 3.83Å; L771-F809 HydrophobicContact CD2-CE2 3.82Å; L771-F809 HydrophobicContact CD2-CG 3.89Å; L771-F809 HydrophobicContact CD2-CZ 3.8Å; L771-F809 HydrophobicContact CG-CD1 4.33Å; L771-F809 HydrophobicContact CG-CE1 4.21Å; L771-L812 HydrophobicContact CD1-CD1 3.49Å; L771-L812 VanDerWaalsContact CD1-CD1 3.49Å; L771-L812 HydrophobicContact CD1-CG 4.26Å; L771-L822 HydrophobicContact CD1-CD1 4.3Å
772	A	94	Very high	91.9	Very high	1 Å²	1	29.6 Å²	29.6	1%	0.008	15%	0.145	C	C	.	.	H	α-helix	trans	-60.3	-35.1	-178.8	0	0	0	0	0	113.2	D769 A776 Q794 S797 I798	D769-A772 PolarHBondContact O-N 2.97Å; A772-A776 WeakPolarHBondContact O-CB 3.3Å; A772-A776 PolarHBondContact O-N 3.43Å; A772-Q794 HydrophobicContact CB-CB 4.32Å; A772-Q794 WeakPolarHBondContact O-CG 3.42Å; A772-S797 WeakPolarHBondContact CA-OG 3.3Å; A772-I798 HydrophobicContact CB-CD1 3.91Å; A772-I798 HydrophobicContact CB-CG1 3.83Å
773	R	92.1	Very high	92	Very high	105 Å²	105	32.9 Å²	32.9	40%	0.396	17%	0.173	S	C	.	.	H	α-helix	trans	-68.5	-36.8	177	-176.4	-171.9	61.6	76.7	3.4	112.2	D769 E770 L771	D769-R773 VanDerWaalsContact O-CB 3.3Å; D769-R773 WeakPolarHBondContact O-CB 3.45Å; D769-R773 PolarHBondContact O-N 3.33Å; E770-R773 PolarHBondContact O-N 3.39Å; L771-R773 VanDerWaalsContact C-N 3.26Å; L771-R773 PolarHBondContact O-N 3.47Å
774	V	93.9	Very high	91.9	Very high	10 Å²	10	34.8 Å²	34.8	6%	0.061	18%	0.18	C	C	.	.	H	α-helix	trans	-72.8	-52.6	175.4	176.8	0	0	0	0	109.6	E770 L771 A776 K777 S778 L812 F821 L822	E770-V774 PolarHBondContact O-N 2.78Å; L771-V774 PolarHBondContact O-N 3.19Å; L771-V774 VanDerWaalsContact O-N 3.08Å; V774-A776 VanDerWaalsContact C-N 3.32Å; V774-A776 PolarHBondContact O-N 2.8Å; V774-K777 PolarHBondContact O-N 3.33Å; V774-S778 PolarHBondContact O-N 3.43Å; V774-L812 HydrophobicContact CB-CD1 4.09Å; V774-L812 HydrophobicContact CG1-CD1 3.65Å; V774-L812 HydrophobicContact CG1-CD2 4.15Å; V774-F821 HydrophobicContact CG1-CB 3.99Å; V774-F821 HydrophobicContact CG1-CD2 4.3Å; V774-F821 HydrophobicContact CG2-CB 4.28Å; V774-L822 HydrophobicContact CB-CD2 4.12Å; V774-L822 HydrophobicContact CG2-CD2 3.67Å; V774-L822 HydrophobicContact CG2-CG 4.5Å
775	Y	95.1	Very high	92	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-53.6	-44.9	177	175.1	-95.2	0	0	0	112.8	L771 K777 S778 V780 A781 F785 R800 Q811 L812	L771-Y775 WeakPolarHBondContact O-CB 3.44Å; L771-Y775 PolarHBondContact O-N 2.89Å; Y775-K777 PolarHBondContact O-N 3.17Å; Y775-S778 WeakPolarHBondContact O-CB 3.36Å; Y775-S778 PolarHBondContact O-N 3.18Å; Y775-S778 PolarHBondContact O-OG 3.35Å; Y775-V780 HydrophobicContact CE2-CG1 4.49Å; Y775-A781 HydrophobicContact CD1-CB 4.04Å; Y775-A781 HydrophobicContact CD2-CB 4.34Å; Y775-A781 HydrophobicContact CE1-CB 3.69Å; Y775-A781 HydrophobicContact CE2-CB 3.98Å; Y775-A781 HydrophobicContact CG-CB 4.38Å; Y775-A781 WeakPolarHBondContact O-CB 2.99Å; Y775-F785 WeakPolarHBondContact OH-CE2 3.45Å; Y775-R800 PolarHBondContact OH-NH1 2.89Å; Y775-Q811 HydrophobicContact CD2-CB 4.15Å; Y775-Q811 HydrophobicContact CE2-CB 4.13Å; Y775-Q811 HydrophobicContact CE2-CG 4.32Å; Y775-L812 HydrophobicContact CD2-CD2 4.49Å
776	A	92.9	Very high	91.9	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-13.5	-177.6	0	0	0	0	0	114.9	A772 V774 I790 R793 Q794	A772-A776 WeakPolarHBondContact O-CB 3.3Å; A772-A776 PolarHBondContact O-N 3.43Å; V774-A776 VanDerWaalsContact C-N 3.32Å; V774-A776 PolarHBondContact O-N 2.8Å; A776-I790 HydrophobicContact CB-CG2 3.81Å; A776-R793 HydrophobicContact CB-CB 3.85Å; A776-R793 PolarHBondContact O-NH1 3.24Å; A776-Q794 HydrophobicContact CB-CB 4.42Å; A776-Q794 HydrophobicContact CB-CG 3.43Å; A776-Q794 VanDerWaalsContact CB-CG 3.43Å
777	K	92.4	Very high	92.1	Very high	129 Å²	129	45.1 Å²	45.1	56%	0.561	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-110.6	0.4	175.5	-62	-176.3	179.3	-172.2	0	113.1	V774 Y775	V774-K777 PolarHBondContact O-N 3.33Å; Y775-K777 PolarHBondContact O-N 3.17Å
778	S	94.1	Very high	92.2	Very high	0 Å²	0	48 Å²	48	0%	0	25%	0.251	C	S	.	.	S	Bend	trans	-72.9	158.4	-177.9	64.4	0	0	0	0	112.4	V774 Y775 V780 A781 N782 E818	V774-S778 PolarHBondContact O-N 3.43Å; Y775-S778 WeakPolarHBondContact O-CB 3.36Å; Y775-S778 PolarHBondContact O-N 3.18Å; Y775-S778 PolarHBondContact O-OG 3.35Å; S778-V780 VanDerWaalsContact C-N 3.28Å; S778-V780 PolarHBondContact O-N 3.36Å; S778-A781 PolarHBondContact O-N 3.1Å; S778-A781 WeakPolarHBondContact OG-CB 3.16Å; S778-A781 PolarHBondContact OG-N 3.19Å; S778-N782 VanDerWaalsContact O-CG 3.3Å; S778-N782 PolarHBondContact O-N 3.27Å; S778-N782 PolarHBondContact O-ND2 2.7Å; S778-E818 WeakPolarHBondContact CA-OE1 3.45Å; S778-E818 WeakPolarHBondContact CB-OE1 3.48Å; S778-E818 WeakPolarHBondContact CB-OE2 3.45Å
779	E	90.7	Very high	92.4	Very high	104 Å²	104	49.7 Å²	49.7	49%	0.486	26%	0.263	S	S	.	.	H	α-helix	trans	-62.6	-37	174.1	-67.3	-53.3	130.3	0	0	111.9	A781 N782 A783 E818	E779-A781 PolarHBondContact O-N 3Å; E779-N782 WeakPolarHBondContact O-CB 3.47Å; E779-N782 PolarHBondContact O-N 3.11Å; E779-A783 WeakPolarHBondContact O-CB 3.26Å; E779-A783 PolarHBondContact O-N 3.35Å; E779-E818 PolarHBondContact N-OE1 3.39Å
780	V	91.6	Very high	92.5	Very high	36 Å²	36	53.3 Å²	53.3	22%	0.218	28%	0.282	C	S	.	.	H	α-helix	trans	-60.2	-47.2	175.7	177.9	0	0	0	0	110.7	Y775 S778 N782 A783 D784	Y775-V780 HydrophobicContact CE2-CG1 4.49Å; S778-V780 VanDerWaalsContact C-N 3.28Å; S778-V780 PolarHBondContact O-N 3.36Å; V780-N782 VanDerWaalsContact C-N 3.32Å; V780-N782 PolarHBondContact O-N 3.3Å; V780-A783 PolarHBondContact O-N 2.92Å; V780-D784 PolarHBondContact O-N 3.39Å
781	A	92.2	Very high	92.6	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-71.4	-27.9	179	0	0	0	0	0	112.9	Y775 S778 E779 F785	Y775-A781 HydrophobicContact CD1-CB 4.04Å; Y775-A781 HydrophobicContact CD2-CB 4.34Å; Y775-A781 HydrophobicContact CE1-CB 3.69Å; Y775-A781 HydrophobicContact CE2-CB 3.98Å; Y775-A781 HydrophobicContact CG-CB 4.38Å; Y775-A781 WeakPolarHBondContact O-CB 2.99Å; S778-A781 PolarHBondContact O-N 3.1Å; S778-A781 WeakPolarHBondContact OG-CB 3.16Å; S778-A781 PolarHBondContact OG-N 3.19Å; E779-A781 PolarHBondContact O-N 3Å; A781-F785 CarbonylContact O-C 3.36Å; A781-F785 WeakPolarHBondContact O-CA 3.22Å; A781-F785 PolarHBondContact O-N 2.82Å
782	N	92.2	Very high	92.6	Very high	55 Å²	55	52.1 Å²	52.1	29%	0.294	28%	0.277	S	S	.	.	H	α-helix	trans	-68.1	-40.2	171.5	-73.6	-32.8	0	0	0	111.4	S778 E779 V780 S786 R793	S778-N782 VanDerWaalsContact O-CG 3.3Å; S778-N782 PolarHBondContact O-N 3.27Å; S778-N782 PolarHBondContact O-ND2 2.7Å; E779-N782 WeakPolarHBondContact O-CB 3.47Å; E779-N782 PolarHBondContact O-N 3.11Å; V780-N782 VanDerWaalsContact C-N 3.32Å; V780-N782 PolarHBondContact O-N 3.3Å; N782-S786 WeakPolarHBondContact O-CA 3.3Å; N782-S786 WeakPolarHBondContact O-CB 3.2Å; N782-S786 PolarHBondContact O-N 3.49Å; N782-R793 PolarHBondContact OD1-NH1 2.85Å
783	A	90.4	Very high	92.7	Very high	79 Å²	79	52.8 Å²	52.8	65%	0.653	28%	0.28	S	S	*	.	H	α-helix	trans	-68.7	-49.1	178	0	0	0	0	0	111.6	E779 V780	E779-A783 WeakPolarHBondContact O-CB 3.26Å; E779-A783 PolarHBondContact O-N 3.35Å; V780-A783 PolarHBondContact O-N 2.92Å
784	D	89.6	Confident	92.8	Very high	83 Å²	83	49 Å²	49	44%	0.444	27%	0.267	S	S	.	.	H	α-helix	trans	-70.1	-37.6	-177.9	-69.4	-9.3	0	0	0	112.6	V780	V780-D784 PolarHBondContact O-N 3.39Å
785	F	93	Very high	92.8	Very high	29 Å²	29	48.6 Å²	48.6	13%	0.127	26%	0.264	C	S	.	.			trans	-135.9	42	-167.2	-52.3	-62.8	0	0	0	113.3	I671 Y775 A781 D787 Y788 R793 I796	I671-F785 HydrophobicContact CD1-CD1 4.13Å; I671-F785 HydrophobicContact CD1-CE1 3.34Å; I671-F785 HydrophobicContact CD1-CE2 4.43Å; I671-F785 HydrophobicContact CD1-CZ 3.53Å; Y775-F785 WeakPolarHBondContact OH-CE2 3.45Å; A781-F785 CarbonylContact O-C 3.36Å; A781-F785 WeakPolarHBondContact O-CA 3.22Å; A781-F785 PolarHBondContact O-N 2.82Å; F785-D787 PolarHBondContact O-N 2.97Å; F785-D787 VanDerWaalsContact O-N 3.15Å; F785-Y788 HydrophobicContact CB-CD2 4.05Å; F785-Y788 HydrophobicContact CB-CG 4.02Å; F785-Y788 AromaticContact CD1-CD2 3.99Å; F785-Y788 HydrophobicContact CD1-CD2 3.99Å; F785-Y788 HydrophobicContact CD1-CE2 4.03Å; F785-Y788 HydrophobicContact CG-CD2 4.19Å; F785-Y788 WeakPolarHBondContact O-CB 3.44Å; F785-Y788 PolarHBondContact O-N 3.42Å; F785-R793 HydrophobicContact CB-CG 4.19Å; F785-R793 PolarHBondContact O-NE 3.47Å; F785-R793 PolarHBondContact O-NH2 2.95Å; F785-I796 HydrophobicContact CD2-CD1 4.43Å; F785-I796 HydrophobicContact CE2-CD1 4.45Å; F785-I796 HydrophobicContact CE2-CG2 4.38Å
786	S	91	Very high	92.9	Very high	82 Å²	82	48.6 Å²	48.6	57%	0.573	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-46.9	-44	-179.1	59.8	0	0	0	0	113.3	N782 Y788 R793	N782-S786 WeakPolarHBondContact O-CA 3.3Å; N782-S786 WeakPolarHBondContact O-CB 3.2Å; N782-S786 PolarHBondContact O-N 3.49Å; S786-Y788 VanDerWaalsContact C-N 3.31Å; S786-Y788 PolarHBondContact O-N 2.99Å; S786-R793 PolarHBondContact O-NH2 3.29Å
787	D	93.4	Very high	93	Very high	152 Å²	152	48.6 Å²	48.6	81%	0.813	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76	-13.3	-179.2	-66	-35.7	0	0	0	114.5	F785	F785-D787 PolarHBondContact O-N 2.97Å; F785-D787 VanDerWaalsContact O-N 3.15Å
788	Y	94.4	Very high	93.2	Very high	69 Å²	69	42.5 Å²	42.5	27%	0.271	24%	0.238	S	C	.	.	S	Bend	trans	-88	137.7	-175	-72.8	15.4	0	0	0	111.2	I671 F785 S786 L792 R793 I796	I671-Y788 HydrophobicContact CD1-CE2 4.09Å; F785-Y788 HydrophobicContact CB-CD2 4.05Å; F785-Y788 HydrophobicContact CB-CG 4.02Å; F785-Y788 AromaticContact CD1-CD2 3.99Å; F785-Y788 HydrophobicContact CD1-CD2 3.99Å; F785-Y788 HydrophobicContact CD1-CE2 4.03Å; F785-Y788 HydrophobicContact CG-CD2 4.19Å; F785-Y788 WeakPolarHBondContact O-CB 3.44Å; F785-Y788 PolarHBondContact O-N 3.42Å; S786-Y788 VanDerWaalsContact C-N 3.31Å; S786-Y788 PolarHBondContact O-N 2.99Å; Y788-L792 HydrophobicContact CD1-CD2 4.4Å; Y788-L792 HydrophobicContact CD2-CD2 3.44Å; Y788-L792 VanDerWaalsContact CD2-CD2 3.44Å; Y788-L792 HydrophobicContact CD2-CG 3.84Å; Y788-L792 HydrophobicContact CE2-CD2 3.86Å; Y788-L792 HydrophobicContact CE2-CG 4.43Å; Y788-L792 HydrophobicContact CG-CD2 3.73Å; Y788-L792 HydrophobicContact CG-CG 4.39Å; Y788-R793 PolarHBondContact O-NE 2.66Å; Y788-R793 VanDerWaalsContact O-NE 3.07Å; Y788-R793 PolarHBondContact O-NH2 3.28Å; Y788-I796 HydrophobicContact CD2-CD1 3.81Å; Y788-I796 HydrophobicContact CE2-CD1 4.11Å
789	P	92.8	Very high	93.3	Very high	58 Å²	58	42.5 Å²	42.5	38%	0.377	24%	0.238	S	C	.	.			trans	-67.3	150	176.2	27.1	-32.9	0	0	0	111.5	F661 T791 L792 R793	F661-P789 HydrophobicContact CE1-CG 3.94Å; F661-P789 HydrophobicContact CE2-CB 4.46Å; F661-P789 HydrophobicContact CE2-CG 3.79Å; F661-P789 HydrophobicContact CZ-CB 4.44Å; F661-P789 HydrophobicContact CZ-CG 3.46Å; F661-P789 VanDerWaalsContact CZ-CG 3.46Å; P789-T791 PolarHBondContact O-N 3.27Å; P789-L792 HydrophobicContact CG-CB 3.87Å; P789-L792 WeakPolarHBondContact O-CA 3.44Å; P789-L792 WeakPolarHBondContact O-CB 3.22Å; P789-L792 PolarHBondContact O-N 3.19Å; P789-R793 PolarHBondContact O-N 3.24Å; P789-R793 VanDerWaalsContact O-N 3.16Å
790	I	91.7	Very high	93.5	Very high	86 Å²	86	37.8 Å²	37.8	44%	0.441	22%	0.215	S	C	.	.	H	α-helix	trans	-48.9	-42.3	-178.2	-62	174.1	0	0	0	112.1	A776 L792 R793 Q794	A776-I790 HydrophobicContact CB-CG2 3.81Å; I790-L792 VanDerWaalsContact C-N 3.34Å; I790-L792 PolarHBondContact O-N 3.02Å; I790-R793 PolarHBondContact O-N 3.46Å; I790-Q794 WeakPolarHBondContact O-CG 3.28Å; I790-Q794 PolarHBondContact O-N 3.27Å
791	T	91.5	Very high	93.7	Very high	15 Å²	15	37.6 Å²	37.6	9%	0.092	21%	0.211	C	C	.	.	H	α-helix	trans	-64.7	-34.5	179	-50.9	0	0	0	0	113.1	S651 F661 P789 Q794 A795	S651-T791 WeakPolarHBondContact CB-O 3.29Å; F661-T791 HydrophobicContact CD2-CG2 3.95Å; P789-T791 PolarHBondContact O-N 3.27Å; T791-Q794 PolarHBondContact O-N 3.47Å; T791-A795 PolarHBondContact O-N 3.32Å; T791-A795 VanDerWaalsContact O-N 3.08Å
792	L	95.3	Very high	93.7	Very high	2 Å²	2	37.8 Å²	37.8	1%	0.01	21%	0.212	C	C	.	.	H	α-helix	trans	-69.8	-42	174.9	178.2	56.4	0	0	0	110.7	F661 V663 H674 Y788 P789 I790 Q794 A795 I796	F661-L792 HydrophobicContact CB-CB 4.14Å; F661-L792 HydrophobicContact CB-CD1 3.97Å; F661-L792 HydrophobicContact CD1-CB 3.96Å; F661-L792 HydrophobicContact CD1-CD1 4.15Å; F661-L792 HydrophobicContact CD1-CD2 4.3Å; F661-L792 HydrophobicContact CD1-CG 4.37Å; F661-L792 HydrophobicContact CD2-CB 4.4Å; F661-L792 HydrophobicContact CE1-CB 4.48Å; F661-L792 HydrophobicContact CG-CB 3.91Å; F661-L792 HydrophobicContact CG-CD1 4.35Å; V663-L792 HydrophobicContact CB-CD1 4.23Å; H674-L792 HydrophobicContact CB-CD1 3.99Å; Y788-L792 HydrophobicContact CD1-CD2 4.4Å; Y788-L792 HydrophobicContact CD2-CD2 3.44Å; Y788-L792 VanDerWaalsContact CD2-CD2 3.44Å; Y788-L792 HydrophobicContact CD2-CG 3.84Å; Y788-L792 HydrophobicContact CE2-CD2 3.86Å; Y788-L792 HydrophobicContact CE2-CG 4.43Å; Y788-L792 HydrophobicContact CG-CD2 3.73Å; Y788-L792 HydrophobicContact CG-CG 4.39Å; P789-L792 HydrophobicContact CG-CB 3.87Å; P789-L792 WeakPolarHBondContact O-CA 3.44Å; P789-L792 WeakPolarHBondContact O-CB 3.22Å; P789-L792 PolarHBondContact O-N 3.19Å; I790-L792 VanDerWaalsContact C-N 3.34Å; I790-L792 PolarHBondContact O-N 3.02Å; L792-Q794 VanDerWaalsContact C-N 3.29Å; L792-Q794 PolarHBondContact O-N 3.45Å; L792-A795 WeakPolarHBondContact O-CA 3.24Å; L792-A795 WeakPolarHBondContact O-CB 3.29Å; L792-A795 PolarHBondContact O-N 3.21Å; L792-I796 HydrophobicContact CG-CD1 4.26Å; L792-I796 WeakPolarHBondContact O-CG1 3.35Å; L792-I796 PolarHBondContact O-N 2.77Å
793	R	95.5	Very high	93.7	Very high	14 Å²	14	35.9 Å²	35.9	5%	0.053	20%	0.201	C	C	.	.	H	α-helix	trans	-60.6	-37.6	173.8	-57.7	-171.4	-162.3	162.4	-3.1	112.5	A776 N782 F785 S786 Y788 P789 I790 I796 S797	A776-R793 HydrophobicContact CB-CB 3.85Å; A776-R793 PolarHBondContact O-NH1 3.24Å; N782-R793 PolarHBondContact OD1-NH1 2.85Å; F785-R793 HydrophobicContact CB-CG 4.19Å; F785-R793 PolarHBondContact O-NE 3.47Å; F785-R793 PolarHBondContact O-NH2 2.95Å; S786-R793 PolarHBondContact O-NH2 3.29Å; Y788-R793 PolarHBondContact O-NE 2.66Å; Y788-R793 VanDerWaalsContact O-NE 3.07Å; Y788-R793 PolarHBondContact O-NH2 3.28Å; P789-R793 PolarHBondContact O-N 3.24Å; P789-R793 VanDerWaalsContact O-N 3.16Å; I790-R793 PolarHBondContact O-N 3.46Å; R793-I796 WeakPolarHBondContact O-CB 3.26Å; R793-I796 PolarHBondContact O-N 2.76Å; R793-S797 PolarHBondContact O-N 2.75Å
794	Q	94.1	Very high	93.8	Very high	27 Å²	27	33 Å²	33	13%	0.126	18%	0.175	C	C	.	.	H	α-helix	trans	-62.2	-41.9	171.1	-71.2	174.6	-9.1	0	0	112	S651 A772 A776 I790 T791 L792 I796 S797 I798	S651-Q794 WeakPolarHBondContact OG-CB 3.47Å; S651-Q794 PolarHBondContact OG-OE1 3.05Å; A772-Q794 HydrophobicContact CB-CB 4.32Å; A772-Q794 WeakPolarHBondContact O-CG 3.42Å; A776-Q794 HydrophobicContact CB-CB 4.42Å; A776-Q794 HydrophobicContact CB-CG 3.43Å; A776-Q794 VanDerWaalsContact CB-CG 3.43Å; I790-Q794 WeakPolarHBondContact O-CG 3.28Å; I790-Q794 PolarHBondContact O-N 3.27Å; T791-Q794 PolarHBondContact O-N 3.47Å; L792-Q794 VanDerWaalsContact C-N 3.29Å; L792-Q794 PolarHBondContact O-N 3.45Å; Q794-I796 VanDerWaalsContact C-N 3.29Å; Q794-I796 PolarHBondContact O-N 3.09Å; Q794-S797 PolarHBondContact O-N 3.37Å; Q794-I798 VanDerWaalsContact O-CG1 3.27Å; Q794-I798 WeakPolarHBondContact O-CG1 3.2Å; Q794-I798 PolarHBondContact O-N 3.02Å
795	A	95.3	Very high	94.1	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-62.7	-39.2	177.4	0	0	0	0	0	111.5	V663 T791 L792 I798 A799	V663-A795 VanDerWaalsContact CG1-C 3.42Å; V663-A795 HydrophobicContact CG1-CB 3.75Å; V663-A795 WeakPolarHBondContact CG1-O 3.46Å; T791-A795 PolarHBondContact O-N 3.32Å; T791-A795 VanDerWaalsContact O-N 3.08Å; L792-A795 WeakPolarHBondContact O-CA 3.24Å; L792-A795 WeakPolarHBondContact O-CB 3.29Å; L792-A795 PolarHBondContact O-N 3.21Å; A795-I798 PolarHBondContact O-N 3.44Å; A795-A799 PolarHBondContact O-N 3.48Å; A795-A799 VanDerWaalsContact O-N 3.14Å
796	I	96.5	Very high	94.3	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-60.4	-52.2	176.1	-68.3	159.2	0	0	0	109.8	V663 I671 F785 Y788 L792 R793 Q794 I798 A799 R800	V663-I796 HydrophobicContact CB-CG1 4.37Å; V663-I796 HydrophobicContact CG1-CG1 4.07Å; V663-I796 HydrophobicContact CG2-CG1 3.97Å; I671-I796 HydrophobicContact CD1-CD1 3.45Å; I671-I796 VanDerWaalsContact CD1-CD1 3.45Å; I671-I796 HydrophobicContact CD1-CG1 3.85Å; I671-I796 HydrophobicContact CD1-CG2 4.35Å; I671-I796 HydrophobicContact CG1-CD1 4.41Å; I671-I796 HydrophobicContact CG1-CG1 4.3Å; F785-I796 HydrophobicContact CD2-CD1 4.43Å; F785-I796 HydrophobicContact CE2-CD1 4.45Å; F785-I796 HydrophobicContact CE2-CG2 4.38Å; Y788-I796 HydrophobicContact CD2-CD1 3.81Å; Y788-I796 HydrophobicContact CE2-CD1 4.11Å; L792-I796 HydrophobicContact CG-CD1 4.26Å; L792-I796 WeakPolarHBondContact O-CG1 3.35Å; L792-I796 PolarHBondContact O-N 2.77Å; R793-I796 WeakPolarHBondContact O-CB 3.26Å; R793-I796 PolarHBondContact O-N 2.76Å; Q794-I796 VanDerWaalsContact C-N 3.29Å; Q794-I796 PolarHBondContact O-N 3.09Å; I796-I798 VanDerWaalsContact C-N 3.34Å; I796-I798 PolarHBondContact O-N 3.25Å; I796-A799 PolarHBondContact O-N 3.11Å; I796-A799 VanDerWaalsContact O-N 3.16Å; I796-R800 HydrophobicContact CG2-CG 4.34Å; I796-R800 WeakPolarHBondContact O-CB 3.47Å; I796-R800 WeakPolarHBondContact O-CG 3.23Å; I796-R800 PolarHBondContact O-N 3.49Å
797	S	95.9	Very high	94.6	Very high	1 Å²	1	25.1 Å²	25.1	1%	0.007	13%	0.128	C	C	.	.	H	α-helix	trans	-60.9	-39.3	179	178.6	0	0	0	0	113.2	A772 R793 Q794 A799 R800 R801 E808	A772-S797 WeakPolarHBondContact CA-OG 3.3Å; R793-S797 PolarHBondContact O-N 2.75Å; Q794-S797 PolarHBondContact O-N 3.37Å; S797-A799 VanDerWaalsContact C-N 3.34Å; S797-A799 PolarHBondContact O-N 3.1Å; S797-R800 PolarHBondContact O-N 2.86Å; S797-R801 VanDerWaalsContact O-CB 3.22Å; S797-R801 WeakPolarHBondContact O-CB 3.4Å; S797-R801 PolarHBondContact O-N 3.15Å; S797-E808 WeakPolarHBondContact CA-OE1 3.22Å; S797-E808 WeakPolarHBondContact CB-OE1 3.33Å; S797-E808 PolarHBondContact OG-OE1 3.28Å
798	I	95.6	Very high	94.7	Very high	1 Å²	1	17.9 Å²	17.9	1%	0.005	9%	0.089	C	C	.	.	H	α-helix	trans	-61.8	-41.9	175.7	-71.6	-67.9	0	0	0	111.8	A715 A717 V767 D769 A772 Q794 A795 I796 L802	A715-I798 HydrophobicContact CB-CG2 3.59Å; A717-I798 HydrophobicContact CB-CD1 4.31Å; A717-I798 HydrophobicContact CB-CG1 4.14Å; V767-I798 HydrophobicContact CB-CD1 4.22Å; V767-I798 HydrophobicContact CB-CG2 4.25Å; V767-I798 HydrophobicContact CG1-CD1 4.1Å; D769-I798 HydrophobicContact CB-CD1 4.15Å; A772-I798 HydrophobicContact CB-CD1 3.91Å; A772-I798 HydrophobicContact CB-CG1 3.83Å; Q794-I798 VanDerWaalsContact O-CG1 3.27Å; Q794-I798 WeakPolarHBondContact O-CG1 3.2Å; Q794-I798 PolarHBondContact O-N 3.02Å; A795-I798 PolarHBondContact O-N 3.44Å; I796-I798 VanDerWaalsContact C-N 3.34Å; I796-I798 PolarHBondContact O-N 3.25Å; I798-L802 PolarHBondContact O-N 3.15Å
799	A	95.8	Very high	94.9	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-67.9	-47.5	176.5	0	0	0	0	0	111.4	I647 V665 A795 I796 S797 R801 L802 N803	I647-A799 HydrophobicContact CG2-CB 4Å; V665-A799 HydrophobicContact CB-CB 3.99Å; V665-A799 HydrophobicContact CG2-CB 3.63Å; A795-A799 PolarHBondContact O-N 3.48Å; A795-A799 VanDerWaalsContact O-N 3.14Å; I796-A799 PolarHBondContact O-N 3.11Å; I796-A799 VanDerWaalsContact O-N 3.16Å; S797-A799 VanDerWaalsContact C-N 3.34Å; S797-A799 PolarHBondContact O-N 3.1Å; A799-R801 PolarHBondContact O-N 3.06Å; A799-L802 PolarHBondContact O-N 2.77Å; A799-N803 PolarHBondContact O-N 3.34Å
800	R	95.5	Very high	95.1	Very high	5 Å²	5	12 Å²	12	2%	0.019	6%	0.06	C	C	.	.	H	α-helix	trans	-63	-38.6	179.4	-75.2	-179.9	171.9	-178.4	-5.6	113	V665 G669 Y775 I796 S797 L802 N803 D804 E808 Y863	V665-R800 HydrophobicContact CG1-CG 4.16Å; G669-R800 VanDerWaalsContact O-CZ 3.28Å; G669-R800 PolarHBondContact O-NE 3.24Å; G669-R800 PolarHBondContact O-NH2 3.46Å; Y775-R800 PolarHBondContact OH-NH1 2.89Å; I796-R800 HydrophobicContact CG2-CG 4.34Å; I796-R800 WeakPolarHBondContact O-CB 3.47Å; I796-R800 WeakPolarHBondContact O-CG 3.23Å; I796-R800 PolarHBondContact O-N 3.49Å; S797-R800 PolarHBondContact O-N 2.86Å; R800-L802 VanDerWaalsContact C-N 3.28Å; R800-L802 PolarHBondContact O-N 3.48Å; R800-N803 WeakPolarHBondContact O-CA 3.38Å; R800-N803 VanDerWaalsContact O-CB 3.3Å; R800-N803 WeakPolarHBondContact O-CB 3.25Å; R800-N803 PolarHBondContact O-N 3.49Å; R800-N803 VanDerWaalsContact O-N 3.08Å; R800-D804 PolarHBondContact O-N 3.47Å; R800-E808 HydrophobicContact CB-CB 4.48Å; R800-E808 HydrophobicContact CB-CG 4.37Å; R800-E808 WeakPolarHBondContact CB-OE2 3.48Å; R800-E808 WeakPolarHBondContact CD-OE2 3.46Å; R800-Y863 VanDerWaalsContact NH1-CD2 3.3Å
801	R	95.3	Very high	95.3	Very high	32 Å²	32	8.6 Å²	8.6	12%	0.121	4%	0.042	C	C	.	.	H	α-helix	trans	-58.4	-38.6	173.7	-177.5	179.7	178	168.3	7.9	112.3	D768 L771 S797 A799 P805 E808	D768-R801 PolarHBondContact O-NH1 3.31Å; D768-R801 IonicContact OD2-NH1 2.65Å; D768-R801 PolarHBondContact OD2-NH1 2.88Å; D768-R801 IonicContact OD2-NH2 3.29Å; L771-R801 HydrophobicContact CD2-CB 4.38Å; L771-R801 HydrophobicContact CD2-CG 4.1Å; S797-R801 VanDerWaalsContact O-CB 3.22Å; S797-R801 WeakPolarHBondContact O-CB 3.4Å; S797-R801 PolarHBondContact O-N 3.15Å; A799-R801 PolarHBondContact O-N 3.06Å; R801-P805 VanDerWaalsContact O-CD 3.29Å; R801-P805 WeakPolarHBondContact O-CD 3.43Å; R801-P805 VanDerWaalsContact O-CG 3.3Å; R801-P805 WeakPolarHBondContact O-CG 3.41Å; R801-E808 HydrophobicContact CB-CB 4.42Å; R801-E808 HydrophobicContact CB-CG 4.08Å
802	L	92.8	Very high	95.5	Very high	4 Å²	4	7.9 Å²	7.9	2%	0.021	4%	0.037	C	C	.	.	H	α-helix	trans	-76.7	-29.3	177.7	-167.9	61.6	0	0	0	111.5	Y629 I647 V713 A715 I798 A799 R800 F1021	Y629-L802 VanDerWaalsContact CB-O 3.27Å; Y629-L802 WeakPolarHBondContact CB-O 3.45Å; Y629-L802 HydrophobicContact CD2-CD1 4Å; Y629-L802 HydrophobicContact CD2-CD2 4.38Å; Y629-L802 HydrophobicContact CD2-CG 4.23Å; Y629-L802 HydrophobicContact CG-CD1 4.39Å; Y629-L802 HydrophobicContact CG-CG 4.21Å; Y629-L802 PolarHBondContact N-O 3.29Å; Y629-L802 VanDerWaalsContact N-O 3.08Å; I647-L802 HydrophobicContact CD1-CB 4.5Å; I647-L802 HydrophobicContact CG2-CD2 4.32Å; V713-L802 HydrophobicContact CB-CD2 4.35Å; V713-L802 HydrophobicContact CG1-CD2 3.51Å; V713-L802 HydrophobicContact CG1-CG 4.43Å; V713-L802 HydrophobicContact CG2-CD2 3.85Å; A715-L802 HydrophobicContact CB-CD2 3.89Å; I798-L802 PolarHBondContact O-N 3.15Å; A799-L802 PolarHBondContact O-N 2.77Å; R800-L802 VanDerWaalsContact C-N 3.28Å; R800-L802 PolarHBondContact O-N 3.48Å; L802-F1021 HydrophobicContact CD1-CD1 4.18Å; L802-F1021 HydrophobicContact CD1-CD2 3.56Å; L802-F1021 HydrophobicContact CD1-CE1 4.11Å; L802-F1021 HydrophobicContact CD1-CE2 3.46Å; L802-F1021 VanDerWaalsContact CD1-CE2 3.46Å; L802-F1021 HydrophobicContact CD1-CG 3.93Å; L802-F1021 HydrophobicContact CD1-CZ 3.75Å
803	N	92	Very high	95.5	Very high	14 Å²	14	7.9 Å²	7.9	8%	0.075	4%	0.038	C	C	.	.	H	α-helix	trans	-67.4	-55	175.2	-160.9	32.6	0	0	0	111.8	P628 I647 D666 K667 A799 R800	P628-N803 VanDerWaalsContact CA-O 3.22Å; P628-N803 WeakPolarHBondContact CA-O 3.43Å; P628-N803 WeakPolarHBondContact CB-O 3.35Å; I647-N803 HydrophobicContact CD1-CB 3.84Å; D666-N803 PolarHBondContact O-ND2 3.35Å; D666-N803 VanDerWaalsContact O-ND2 3.14Å; K667-N803 VanDerWaalsContact C-ND2 3.27Å; K667-N803 PolarHBondContact O-ND2 3.42Å; A799-N803 PolarHBondContact O-N 3.34Å; R800-N803 WeakPolarHBondContact O-CA 3.38Å; R800-N803 VanDerWaalsContact O-CB 3.3Å; R800-N803 WeakPolarHBondContact O-CB 3.25Å; R800-N803 PolarHBondContact O-N 3.49Å; R800-N803 VanDerWaalsContact O-N 3.08Å
804	D	93.9	Very high	95.2	Very high	18 Å²	18	8.9 Å²	8.9	10%	0.096	4%	0.044	C	C	.	.			trans	-152.1	112.9	166.1	-167	-32.3	0	0	0	110.4	P628 R800 L806 L807 E808 R1018	P628-D804 HydrophobicContact CG-CB 4.4Å; R800-D804 PolarHBondContact O-N 3.47Å; D804-L806 VanDerWaalsContact C-N 3.29Å; D804-L806 PolarHBondContact O-N 2.94Å; D804-L806 WeakPolarHBondContact OD1-CB 3.47Å; D804-L806 PolarHBondContact OD1-N 3.19Å; D804-L807 HydrophobicContact CB-CB 4.26Å; D804-L807 HydrophobicContact CB-CD1 3.98Å; D804-L807 HydrophobicContact CB-CG 4.11Å; D804-L807 PolarHBondContact O-N 2.95Å; D804-E808 PolarHBondContact O-N 2.99Å; D804-R1018 IonicContact OD1-CZ 2.6Å; D804-R1018 IonicContact OD1-NH1 3.9Å; D804-R1018 PolarHBondContact OD1-NH1 2.9Å; D804-R1018 IonicContact OD1-NH2 3.06Å; D804-R1018 PolarHBondContact OD1-NH2 2.9Å; D804-R1018 IonicContact OD2-CZ 3.07Å; D804-R1018 IonicContact OD2-NH1 2.82Å; D804-R1018 IonicContact OD2-NH2 2.91Å; D804-R1018 PolarHBondContact OD2-NH2 3.36Å
805	P	96	Very high	94.8	Very high	9 Å²	9	11.4 Å²	11.4	6%	0.058	6%	0.056	C	C	.	.	H	α-helix	trans	-56.4	-39.7	176.2	-25.5	33.6	0	0	0	113.5	V626 R801 L807 E808 F809	V626-P805 HydrophobicContact CB-CG 4.21Å; V626-P805 HydrophobicContact CG1-CG 4.23Å; R801-P805 VanDerWaalsContact O-CD 3.29Å; R801-P805 WeakPolarHBondContact O-CD 3.43Å; R801-P805 VanDerWaalsContact O-CG 3.3Å; R801-P805 WeakPolarHBondContact O-CG 3.41Å; P805-L807 PolarHBondContact O-N 3.07Å; P805-E808 PolarHBondContact O-N 2.87Å; P805-F809 HydrophobicContact CB-CD2 4.34Å; P805-F809 WeakPolarHBondContact O-CB 3.38Å; P805-F809 WeakPolarHBondContact O-CD2 3.29Å; P805-F809 PolarHBondContact O-N 2.95Å
806	L	97.2	Very high	94.6	Very high	6 Å²	6	14.6 Å²	14.6	3%	0.031	7%	0.073	C	C	.	.	H	α-helix	trans	-61.7	-46.9	-175.7	174.9	63.8	0	0	0	111.2	L624 D804 A810 F844 R847 V851 V867	L624-L806 HydrophobicContact CD1-CD1 4.26Å; L624-L806 HydrophobicContact CD2-CD1 3.88Å; D804-L806 VanDerWaalsContact C-N 3.29Å; D804-L806 PolarHBondContact O-N 2.94Å; D804-L806 WeakPolarHBondContact OD1-CB 3.47Å; D804-L806 PolarHBondContact OD1-N 3.19Å; L806-A810 VanDerWaalsContact O-CB 3.23Å; L806-A810 WeakPolarHBondContact O-CB 3.2Å; L806-A810 PolarHBondContact O-N 3.03Å; L806-F844 HydrophobicContact CD1-CD1 3.84Å; L806-F844 HydrophobicContact CD1-CE1 4.36Å; L806-R847 HydrophobicContact CD1-CB 4.25Å; L806-R847 HydrophobicContact CD1-CG 4.19Å; L806-R847 HydrophobicContact CD2-CG 4.21Å; L806-V851 HydrophobicContact CD2-CG2 4.42Å; L806-V867 HydrophobicContact CG-CG1 4.17Å
807	L	96	Very high	94.4	Very high	14 Å²	14	16.7 Å²	16.7	7%	0.073	8%	0.083	C	C	.	.	H	α-helix	trans	-65.1	-41.7	179.5	-67.3	177.6	0	0	0	112.2	D804 P805 A810 Q811 Y863 T864 V867	D804-L807 HydrophobicContact CB-CB 4.26Å; D804-L807 HydrophobicContact CB-CD1 3.98Å; D804-L807 HydrophobicContact CB-CG 4.11Å; D804-L807 PolarHBondContact O-N 2.95Å; P805-L807 PolarHBondContact O-N 3.07Å; L807-A810 PolarHBondContact O-N 3.06Å; L807-Q811 WeakPolarHBondContact O-CG 3.16Å; L807-Q811 PolarHBondContact O-N 2.95Å; L807-Q811 PolarHBondContact O-NE2 2.83Å; L807-Y863 HydrophobicContact CB-CE1 4.17Å; L807-Y863 HydrophobicContact CD1-CE1 4.38Å; L807-T864 HydrophobicContact CD1-CG2 4.18Å; L807-V867 HydrophobicContact CD2-CB 4.41Å; L807-V867 HydrophobicContact CD2-CG1 3.78Å; L807-V867 HydrophobicContact CD2-CG2 3.73Å
808	E	96.7	Very high	94.3	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-72.4	-40.6	-177.1	-177.3	62	-163.3	0	0	111.6	L771 S797 R800 R801 D804 P805 A810 Q811 Y863	L771-E808 HydrophobicContact CD2-CB 4.28Å; L771-E808 HydrophobicContact CD2-CG 3.6Å; L771-E808 HydrophobicContact CG-CG 4.26Å; S797-E808 WeakPolarHBondContact CA-OE1 3.22Å; S797-E808 WeakPolarHBondContact CB-OE1 3.33Å; S797-E808 PolarHBondContact OG-OE1 3.28Å; R800-E808 HydrophobicContact CB-CB 4.48Å; R800-E808 HydrophobicContact CB-CG 4.37Å; R800-E808 WeakPolarHBondContact CB-OE2 3.48Å; R800-E808 WeakPolarHBondContact CD-OE2 3.46Å; R801-E808 HydrophobicContact CB-CB 4.42Å; R801-E808 HydrophobicContact CB-CG 4.08Å; D804-E808 PolarHBondContact O-N 2.99Å; P805-E808 PolarHBondContact O-N 2.87Å; E808-A810 VanDerWaalsContact C-N 3.31Å; E808-A810 PolarHBondContact O-N 3.3Å; E808-Q811 WeakPolarHBondContact O-CB 3.12Å; E808-Q811 WeakPolarHBondContact O-CG 3.1Å; E808-Q811 PolarHBondContact O-N 3.49Å; E808-Y863 WeakPolarHBondContact CA-OH 3.46Å; E808-Y863 PolarHBondContact N-OH 3.11Å; E808-Y863 PolarHBondContact OE2-OH 3.31Å; E808-Y863 VanDerWaalsContact OE2-OH 3.11Å
809	F	97.7	Very high	94.4	Very high	4 Å²	4	17.1 Å²	17.1	2%	0.018	9%	0.085	C	C	.	.	H	α-helix	trans	-65.8	-35.3	173.7	-85	-74.3	0	0	0	111.8	M620 Y623 L624 L771 P805 Q811 L812 I819 L822 F844	M620-F809 HydrophobicContact CE-CD1 4.38Å; M620-F809 HydrophobicContact SD-CD1 4.36Å; Y623-F809 HydrophobicContact CD1-CZ 4.35Å; Y623-F809 AromaticContact CD2-CE1 3.96Å; Y623-F809 HydrophobicContact CD2-CE1 3.96Å; Y623-F809 HydrophobicContact CD2-CE2 4.34Å; Y623-F809 AromaticContact CD2-CZ 3.64Å; Y623-F809 HydrophobicContact CD2-CZ 3.64Å; Y623-F809 HydrophobicContact CE2-CE1 4.4Å; Y623-F809 HydrophobicContact CE2-CZ 4.2Å; Y623-F809 HydrophobicContact CG-CE1 4.47Å; Y623-F809 HydrophobicContact CG-CE2 4.05Å; Y623-F809 AromaticContact CG-CZ 3.73Å; Y623-F809 HydrophobicContact CG-CZ 3.73Å; L624-F809 HydrophobicContact CD2-CB 4.05Å; L624-F809 HydrophobicContact CD2-CD2 4.25Å; L624-F809 HydrophobicContact CD2-CG 4.39Å; L771-F809 HydrophobicContact CB-CE1 4.26Å; L771-F809 HydrophobicContact CB-CZ 4.43Å; L771-F809 HydrophobicContact CD1-CD1 3.69Å; L771-F809 HydrophobicContact CD1-CE1 3.89Å; L771-F809 HydrophobicContact CD1-CG 4.33Å; L771-F809 HydrophobicContact CD2-CD1 3.86Å; L771-F809 HydrophobicContact CD2-CD2 3.88Å; L771-F809 HydrophobicContact CD2-CE1 3.83Å; L771-F809 HydrophobicContact CD2-CE2 3.82Å; L771-F809 HydrophobicContact CD2-CG 3.89Å; L771-F809 HydrophobicContact CD2-CZ 3.8Å; L771-F809 HydrophobicContact CG-CD1 4.33Å; L771-F809 HydrophobicContact CG-CE1 4.21Å; P805-F809 HydrophobicContact CB-CD2 4.34Å; P805-F809 WeakPolarHBondContact O-CB 3.38Å; P805-F809 WeakPolarHBondContact O-CD2 3.29Å; P805-F809 PolarHBondContact O-N 2.95Å; F809-Q811 PolarHBondContact O-N 3.03Å; F809-L812 PolarHBondContact O-N 3.17Å; F809-I819 HydrophobicContact CD1-CD1 4.24Å; F809-L822 HydrophobicContact CD1-CD1 3.96Å; F809-L822 HydrophobicContact CE1-CD1 3.74Å; F809-F844 HydrophobicContact CB-CE1 3.81Å; F809-F844 HydrophobicContact CB-CZ 3.76Å
810	A	97	Very high	94.4	Very high	1 Å²	1	17.9 Å²	17.9	1%	0.008	9%	0.089	C	C	.	.	H	α-helix	trans	-63.3	-24.2	179.6	0	0	0	0	0	113.4	L806 L807 E808 L812 C813 F844 V867 F870	L806-A810 VanDerWaalsContact O-CB 3.23Å; L806-A810 WeakPolarHBondContact O-CB 3.2Å; L806-A810 PolarHBondContact O-N 3.03Å; L807-A810 PolarHBondContact O-N 3.06Å; E808-A810 VanDerWaalsContact C-N 3.31Å; E808-A810 PolarHBondContact O-N 3.3Å; A810-L812 PolarHBondContact O-N 2.66Å; A810-C813 WeakPolarHBondContact O-CB 3.47Å; A810-C813 PolarHBondContact O-N 2.81Å; A810-F844 HydrophobicContact CB-CD1 4.24Å; A810-F844 HydrophobicContact CB-CE1 4.01Å; A810-V867 HydrophobicContact CB-CG1 3.55Å; A810-F870 HydrophobicContact CB-CE2 3.96Å
811	Q	95.7	Very high	94.3	Very high	13 Å²	13	23.6 Å²	23.6	6%	0.061	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-27.4	176.6	-56.2	-54.3	-53.7	0	0	113.3	Y775 L807 E808 F809 N814 Y863 S866	Y775-Q811 HydrophobicContact CD2-CB 4.15Å; Y775-Q811 HydrophobicContact CE2-CB 4.13Å; Y775-Q811 HydrophobicContact CE2-CG 4.32Å; L807-Q811 WeakPolarHBondContact O-CG 3.16Å; L807-Q811 PolarHBondContact O-N 2.95Å; L807-Q811 PolarHBondContact O-NE2 2.83Å; E808-Q811 WeakPolarHBondContact O-CB 3.12Å; E808-Q811 WeakPolarHBondContact O-CG 3.1Å; E808-Q811 PolarHBondContact O-N 3.49Å; F809-Q811 PolarHBondContact O-N 3.03Å; Q811-N814 PolarHBondContact O-ND2 3.5Å; Q811-Y863 VanDerWaalsContact CD-CE2 3.46Å; Q811-Y863 HydrophobicContact CG-CD2 4.17Å; Q811-Y863 HydrophobicContact CG-CE2 3.64Å; Q811-Y863 VanDerWaalsContact NE2-CE2 3.33Å; Q811-Y863 PolarHBondContact NE2-O 3.25Å; Q811-S866 PolarHBondContact NE2-OG 3.38Å
812	L	96.5	Very high	94.2	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-6.1	179.8	-60	-175.2	0	0	0	113.1	L771 V774 Y775 F809 A810 N814 E818 I819 L822	L771-L812 HydrophobicContact CD1-CD1 3.49Å; L771-L812 VanDerWaalsContact CD1-CD1 3.49Å; L771-L812 HydrophobicContact CD1-CG 4.26Å; V774-L812 HydrophobicContact CB-CD1 4.09Å; V774-L812 HydrophobicContact CG1-CD1 3.65Å; V774-L812 HydrophobicContact CG1-CD2 4.15Å; Y775-L812 HydrophobicContact CD2-CD2 4.49Å; F809-L812 PolarHBondContact O-N 3.17Å; A810-L812 PolarHBondContact O-N 2.66Å; L812-N814 VanDerWaalsContact C-N 3.3Å; L812-N814 PolarHBondContact O-N 2.79Å; L812-N814 VanDerWaalsContact O-N 3.14Å; L812-E818 HydrophobicContact CB-CB 4.45Å; L812-E818 HydrophobicContact CD2-CB 4.28Å; L812-E818 PolarHBondContact O-N 3.49Å; L812-I819 HydrophobicContact CB-CB 3.94Å; L812-I819 HydrophobicContact CB-CD1 3.92Å; L812-I819 HydrophobicContact CD1-CD1 4.44Å; L812-I819 WeakPolarHBondContact O-CB 3.25Å; L812-I819 PolarHBondContact O-N 3.01Å; L812-L822 HydrophobicContact CD1-CD1 4.3Å; L812-L822 HydrophobicContact CD1-CG 4.45Å
813	C	94.2	Very high	94.1	Very high	3 Å²	3	28.2 Å²	28.2	2%	0.02	14%	0.135	C	C	.	.			trans	-87.6	75.1	174.9	-68.8	0	0	0	0	109.6	A810 F844 Q869 F870	A810-C813 WeakPolarHBondContact O-CB 3.47Å; A810-C813 PolarHBondContact O-N 2.81Å; C813-F844 WeakPolarHBondContact SG-CE2 3.37Å; C813-F844 WeakPolarHBondContact SG-CZ 3.42Å; C813-Q869 PolarHBondContact O-NE2 3.32Å; C813-F870 HydrophobicContact CB-CE1 4.36Å; C813-F870 HydrophobicContact CB-CE2 4.47Å; C813-F870 HydrophobicContact CB-CZ 3.57Å
814	N	90	Very high	94	Very high	34 Å²	34	28.2 Å²	28.2	18%	0.182	13%	0.134	C	C	.	.	S	Bend	trans	-124.6	-178	178.8	57.1	40.6	0	0	0	110.2	Q811 L812 D816 E817 E818	Q811-N814 PolarHBondContact O-ND2 3.5Å; L812-N814 VanDerWaalsContact C-N 3.3Å; L812-N814 PolarHBondContact O-N 2.79Å; L812-N814 VanDerWaalsContact O-N 3.14Å; N814-D816 PolarHBondContact O-N 3.07Å; N814-D816 PolarHBondContact OD1-N 3.22Å; N814-D816 VanDerWaalsContact OD1-N 3.16Å; N814-E817 PolarHBondContact O-N 3.48Å; N814-E817 PolarHBondContact OD1-N 3.46Å; N814-E818 PolarHBondContact ND2-OE2 2.81Å
815	Q	86.1	Confident	93.9	Very high	81 Å²	81	28 Å²	28	38%	0.379	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-20.6	-176.6	-65	170.7	11.3	0	0	114.1	R164 F166 E817	R164-Q815 PolarHBondContact O-NE2 3.1Å; R164-Q815 PolarHBondContact O-OE1 2.92Å; F166-Q815 HydrophobicContact CE1-CG 4.31Å; F166-Q815 HydrophobicContact CZ-CG 4.1Å; Q815-E817 PolarHBondContact O-N 3.27Å
816	D	89.6	Confident	93.5	Very high	66 Å²	66	31.2 Å²	31.2	35%	0.353	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-1.4	175.2	-62.2	-54.1	0	0	0	112	R164 N814 E818	R164-D816 IonicContact CZ-OD1 3.2Å; R164-D816 IonicContact CZ-OD2 3.99Å; R164-D816 IonicContact NH2-OD1 2.89Å; R164-D816 PolarHBondContact NH2-OD1 3.28Å; R164-D816 IonicContact NH2-OD2 3.41Å; R164-D816 PolarHBondContact NH2-OD2 3.19Å; N814-D816 PolarHBondContact O-N 3.07Å; N814-D816 PolarHBondContact OD1-N 3.22Å; N814-D816 VanDerWaalsContact OD1-N 3.16Å; D816-E818 HydrophobicContact CB-CG 3.92Å; D816-E818 PolarHBondContact O-N 2.81Å
817	E	92.7	Very high	93.2	Very high	44 Å²	44	31.4 Å²	31.4	21%	0.206	16%	0.161	C	C	.	.			trans	54.3	34.4	176.2	-56	175.5	165.6	0	0	112.7	N814 Q815 I819 L820 K833 F837	N814-E817 PolarHBondContact O-N 3.48Å; N814-E817 PolarHBondContact OD1-N 3.46Å; Q815-E817 PolarHBondContact O-N 3.27Å; E817-I819 PolarHBondContact O-N 2.86Å; E817-L820 HydrophobicContact CB-CD1 4.04Å; E817-L820 HydrophobicContact CB-CG 4.27Å; E817-L820 WeakPolarHBondContact O-CB 3.46Å; E817-L820 WeakPolarHBondContact O-CG 3.3Å; E817-L820 PolarHBondContact O-N 3.28Å; E817-K833 WeakPolarHBondContact OE2-CE 3.32Å; E817-K833 IonicContact OE2-NZ 2.76Å; E817-K833 PolarHBondContact OE2-NZ 2.91Å; E817-F837 HydrophobicContact CB-CD2 4.1Å; E817-F837 HydrophobicContact CB-CE2 4.14Å; E817-F837 HydrophobicContact CG-CD1 4.48Å; E817-F837 HydrophobicContact CG-CD2 4.02Å; E817-F837 HydrophobicContact CG-CE1 4.43Å; E817-F837 HydrophobicContact CG-CE2 3.96Å; E817-F837 HydrophobicContact CG-CG 4.28Å; E817-F837 HydrophobicContact CG-CZ 4.17Å
818	E	95.2	Very high	93	Very high	12 Å²	12	31.9 Å²	31.9	6%	0.056	16%	0.163	C	C	.	.	G	3₁₀ helix	trans	-62.1	-21.5	-173.2	-61.5	-179.6	120	0	0	112.9	S778 E779 L812 N814 D816 L820 F821	S778-E818 WeakPolarHBondContact CA-OE1 3.45Å; S778-E818 WeakPolarHBondContact CB-OE1 3.48Å; S778-E818 WeakPolarHBondContact CB-OE2 3.45Å; E779-E818 PolarHBondContact N-OE1 3.39Å; L812-E818 HydrophobicContact CB-CB 4.45Å; L812-E818 HydrophobicContact CD2-CB 4.28Å; L812-E818 PolarHBondContact O-N 3.49Å; N814-E818 PolarHBondContact ND2-OE2 2.81Å; D816-E818 HydrophobicContact CB-CG 3.92Å; D816-E818 PolarHBondContact O-N 2.81Å; E818-L820 PolarHBondContact O-N 2.75Å; E818-L820 VanDerWaalsContact O-N 3.16Å; E818-F821 HydrophobicContact CB-CD2 3.98Å; E818-F821 HydrophobicContact CB-CE2 3.99Å; E818-F821 HydrophobicContact CG-CD2 4.3Å; E818-F821 HydrophobicContact CG-CE2 3.8Å; E818-F821 VanDerWaalsContact O-CB 3.27Å; E818-F821 WeakPolarHBondContact O-CB 3.49Å; E818-F821 WeakPolarHBondContact O-CG 3.43Å; E818-F821 PolarHBondContact O-N 3.18Å
819	I	96.4	Very high	92.8	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	20%	0.201	C	C	.	.	G	3₁₀ helix	trans	-54.4	-30.2	171.2	-168.8	68.5	0	0	0	112.1	M620 F809 L812 E817 F821 L822 F824 F837 I840 F844	M620-I819 HydrophobicContact CE-CD1 3.69Å; M620-I819 HydrophobicContact CE-CG1 3.86Å; F809-I819 HydrophobicContact CD1-CD1 4.24Å; L812-I819 HydrophobicContact CB-CB 3.94Å; L812-I819 HydrophobicContact CB-CD1 3.92Å; L812-I819 HydrophobicContact CD1-CD1 4.44Å; L812-I819 WeakPolarHBondContact O-CB 3.25Å; L812-I819 PolarHBondContact O-N 3.01Å; E817-I819 PolarHBondContact O-N 2.86Å; I819-F821 PolarHBondContact O-N 3.05Å; I819-L822 HydrophobicContact CD1-CD1 3.75Å; I819-L822 WeakPolarHBondContact O-CB 3.44Å; I819-L822 PolarHBondContact O-N 3.28Å; I819-F824 HydrophobicContact CG1-CZ 4.36Å; I819-F824 WeakPolarHBondContact O-CZ 3.32Å; I819-F837 HydrophobicContact CG2-CD2 3.85Å; I819-F837 HydrophobicContact CG2-CE2 3.72Å; I819-I840 HydrophobicContact CG1-CG2 3.95Å; I819-F844 HydrophobicContact CD1-CE2 4.41Å; I819-F844 HydrophobicContact CD1-CZ 4.16Å; I819-F844 HydrophobicContact CG1-CE2 4.39Å
820	L	95.7	Very high	92.5	Very high	16 Å²	16	43.1 Å²	43.1	8%	0.084	21%	0.213	C	C	.	.	G	3₁₀ helix	trans	-74.9	-10	178.7	-57.1	-175	0	0	0	113.5	E817 E818 L822 Q828 K833 L836 F837	E817-L820 HydrophobicContact CB-CD1 4.04Å; E817-L820 HydrophobicContact CB-CG 4.27Å; E817-L820 WeakPolarHBondContact O-CB 3.46Å; E817-L820 WeakPolarHBondContact O-CG 3.3Å; E817-L820 PolarHBondContact O-N 3.28Å; E818-L820 PolarHBondContact O-N 2.75Å; E818-L820 VanDerWaalsContact O-N 3.16Å; L820-L822 PolarHBondContact O-N 3.02Å; L820-Q828 PolarHBondContact O-NE2 3.36Å; L820-Q828 VanDerWaalsContact O-NE2 3.16Å; L820-K833 HydrophobicContact CD1-CD 4.19Å; L820-K833 HydrophobicContact CD1-CG 3.5Å; L820-K833 VanDerWaalsContact CD1-CG 3.5Å; L820-L836 HydrophobicContact CD2-CD2 3.96Å; L820-L836 HydrophobicContact CD2-CG 3.93Å; L820-F837 HydrophobicContact CD1-CB 3.99Å; L820-F837 HydrophobicContact CD1-CD2 4.32Å; L820-F837 HydrophobicContact CD2-CB 4.22Å; L820-F837 HydrophobicContact CD2-CD2 4.23Å; L820-F837 HydrophobicContact CG-CB 4.48Å; L820-F837 HydrophobicContact CG-CD2 4.17Å
821	F	94.6	Very high	92.5	Very high	124 Å²	124	43.7 Å²	43.7	54%	0.544	22%	0.216	S	C	.	.	G	3₁₀ helix	trans	-76.1	-8.5	173	-55.9	-21.5	0	0	0	112.7	V774 E818 I819	V774-F821 HydrophobicContact CG1-CB 3.99Å; V774-F821 HydrophobicContact CG1-CD2 4.3Å; V774-F821 HydrophobicContact CG2-CB 4.28Å; E818-F821 HydrophobicContact CB-CD2 3.98Å; E818-F821 HydrophobicContact CB-CE2 3.99Å; E818-F821 HydrophobicContact CG-CD2 4.3Å; E818-F821 HydrophobicContact CG-CE2 3.8Å; E818-F821 VanDerWaalsContact O-CB 3.27Å; E818-F821 WeakPolarHBondContact O-CB 3.49Å; E818-F821 WeakPolarHBondContact O-CG 3.43Å; E818-F821 PolarHBondContact O-N 3.18Å; I819-F821 PolarHBondContact O-N 3.05Å
822	L	92.8	Very high	92.5	Very high	6 Å²	6	45.5 Å²	45.5	3%	0.031	23%	0.229	C	C	.	.	S	Bend	trans	-78.3	141.7	167.2	-58.9	175.6	0	0	0	110.4	E770 L771 V774 F809 L812 I819 L820 F824 Q828	E770-L822 HydrophobicContact CG-CD2 4.01Å; L771-L822 HydrophobicContact CD1-CD1 4.3Å; V774-L822 HydrophobicContact CB-CD2 4.12Å; V774-L822 HydrophobicContact CG2-CD2 3.67Å; V774-L822 HydrophobicContact CG2-CG 4.5Å; F809-L822 HydrophobicContact CD1-CD1 3.96Å; F809-L822 HydrophobicContact CE1-CD1 3.74Å; L812-L822 HydrophobicContact CD1-CD1 4.3Å; L812-L822 HydrophobicContact CD1-CG 4.45Å; I819-L822 HydrophobicContact CD1-CD1 3.75Å; I819-L822 WeakPolarHBondContact O-CB 3.44Å; I819-L822 PolarHBondContact O-N 3.28Å; L820-L822 PolarHBondContact O-N 3.02Å; L822-F824 HydrophobicContact CB-CE1 3.88Å; L822-F824 HydrophobicContact CB-CE2 4.18Å; L822-F824 HydrophobicContact CB-CZ 3.64Å; L822-F824 HydrophobicContact CD1-CE1 4.17Å; L822-F824 HydrophobicContact CD1-CZ 4.05Å; L822-F824 HydrophobicContact CG-CZ 4.44Å; L822-F824 PolarHBondContact O-N 3.35Å; L822-Q828 PolarHBondContact O-NE2 3.3Å; L822-Q828 PolarHBondContact O-OE1 3.42Å
823	K	89.3	Confident	92.4	Very high	128 Å²	128	50.3 Å²	50.3	56%	0.557	25%	0.25	S	S	*	.			trans	-95.6	94	-178.6	-170	168	-175.6	162.7	0	111	E770	E770-K823 PolarHBondContact OE1-N 2.98Å
824	F	91.7	Very high	92.4	Very high	14 Å²	14	56.6 Å²	56.6	6%	0.061	28%	0.28	C	S	.	.	S	Bend	trans	-79.3	-32.4	177.3	-50.5	-67.7	0	0	0	112.7	C616 R619 M620 Y623 I819 L822 Q828 I840	C616-F824 HydrophobicContact CB-CB 3.8Å; C616-F824 HydrophobicContact CB-CG 4.42Å; R619-F824 HydrophobicContact CB-CB 4.38Å; R619-F824 HydrophobicContact CG-CB 4.41Å; R619-F824 HydrophobicContact CG-CD1 4.34Å; M620-F824 HydrophobicContact CE-CE1 3.39Å; M620-F824 HydrophobicContact CE-CZ 3.46Å; M620-F824 VanDerWaalsContact CE-CZ 3.46Å; Y623-F824 HydrophobicContact CE2-CD1 4.42Å; Y623-F824 HydrophobicContact CE2-CE1 4.43Å; I819-F824 HydrophobicContact CG1-CZ 4.36Å; I819-F824 WeakPolarHBondContact O-CZ 3.32Å; L822-F824 HydrophobicContact CB-CE1 3.88Å; L822-F824 HydrophobicContact CB-CE2 4.18Å; L822-F824 HydrophobicContact CB-CZ 3.64Å; L822-F824 HydrophobicContact CD1-CE1 4.17Å; L822-F824 HydrophobicContact CD1-CZ 4.05Å; L822-F824 HydrophobicContact CG-CZ 4.44Å; L822-F824 PolarHBondContact O-N 3.35Å; F824-Q828 VanDerWaalsContact CD2-OE1 3.27Å; F824-I840 HydrophobicContact CD2-CD1 4.14Å; F824-I840 HydrophobicContact CE1-CD1 4.48Å; F824-I840 HydrophobicContact CE2-CD1 4.01Å; F824-I840 HydrophobicContact CE2-CG1 4.34Å; F824-I840 HydrophobicContact CG-CD1 4.44Å; F824-I840 HydrophobicContact CZ-CD1 4.19Å
825	N	91	Very high	92.6	Very high	12 Å²	12	58.3 Å²	58.3	6%	0.064	29%	0.286	C	S	.	.			trans	-145.8	156.5	-179.3	-166.7	-56.4	0	0	0	111.4	V612 R615 C616 L827 Q828	V612-N825 HydrophobicContact CG1-CB 4.3Å; R615-N825 PolarHBondContact NE-ND2 3.24Å; R615-N825 VanDerWaalsContact NE-ND2 3.14Å; C616-N825 WeakPolarHBondContact SG-CB 3.46Å; N825-L827 VanDerWaalsContact C-N 3.31Å; N825-L827 PolarHBondContact O-N 2.87Å; N825-L827 PolarHBondContact OD1-N 3.25Å; N825-Q828 HydrophobicContact CB-CB 4.43Å; N825-Q828 WeakPolarHBondContact O-CB 3.34Å
826	A	86.7	Confident	93.1	Very high	77 Å²	77	54.7 Å²	54.7	64%	0.636	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-30.1	174.8	0	0	0	0	0	113.4
827	L	91.4	Very high	93.4	Very high	11 Å²	11	53.9 Å²	53.9	6%	0.058	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.2	12.9	-178.6	-59.7	179	0	0	0	113.6	D526 L529 L530 V612 N825 E829 Y830	D526-L827 HydrophobicContact CB-CD1 4.03Å; L529-L827 HydrophobicContact CD2-CB 4.25Å; L529-L827 HydrophobicContact CD2-CD1 4.27Å; L530-L827 HydrophobicContact CD2-CD1 3.77Å; L530-L827 HydrophobicContact CD2-CD2 3.91Å; L530-L827 HydrophobicContact CD2-CG 4.39Å; L530-L827 HydrophobicContact CG-CD1 4.15Å; V612-L827 HydrophobicContact CG1-CB 4.2Å; V612-L827 HydrophobicContact CG2-CB 4.35Å; V612-L827 HydrophobicContact CG2-CD1 4.35Å; N825-L827 VanDerWaalsContact C-N 3.31Å; N825-L827 PolarHBondContact O-N 2.87Å; N825-L827 PolarHBondContact OD1-N 3.25Å; L827-E829 PolarHBondContact O-N 2.93Å; L827-Y830 HydrophobicContact CD2-CD2 4.48Å; L827-Y830 PolarHBondContact O-N 2.81Å
828	Q	92.8	Very high	93.5	Very high	24 Å²	24	54.7 Å²	54.7	11%	0.112	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-58.4	-29.5	-177.3	-177.6	178.2	-36.6	0	0	113.4	L820 L822 F824 N825 Y830 V831 L836	L820-Q828 PolarHBondContact O-NE2 3.36Å; L820-Q828 VanDerWaalsContact O-NE2 3.16Å; L822-Q828 PolarHBondContact O-NE2 3.3Å; L822-Q828 PolarHBondContact O-OE1 3.42Å; F824-Q828 VanDerWaalsContact CD2-OE1 3.27Å; N825-Q828 HydrophobicContact CB-CB 4.43Å; N825-Q828 WeakPolarHBondContact O-CB 3.34Å; Q828-Y830 PolarHBondContact O-N 2.91Å; Q828-V831 WeakPolarHBondContact O-CG2 3.43Å; Q828-V831 PolarHBondContact O-N 3.33Å; Q828-L836 HydrophobicContact CG-CD2 3.41Å; Q828-L836 VanDerWaalsContact CG-CD2 3.41Å
829	E	90.9	Very high	93.5	Very high	168 Å²	168	55.4 Å²	55.4	79%	0.785	27%	0.268	S	S	*	.	G	3₁₀ helix	trans	-72.2	-13.5	179.3	-64.7	172.7	-168.3	0	0	113.3	L827	L827-E829 PolarHBondContact O-N 2.93Å
830	Y	92.7	Very high	93.5	Very high	71 Å²	71	55.4 Å²	55.4	28%	0.278	27%	0.268	S	S	.	.	G	3₁₀ helix	trans	-104.9	8.8	-178.2	-62.9	-88.9	0	0	0	113.3	Q533 Q609 L827 Q828	Q533-Y830 HydrophobicContact CB-CD1 4.48Å; Q533-Y830 HydrophobicContact CB-CE1 4.18Å; Q533-Y830 HydrophobicContact CG-CE1 3.9Å; Q533-Y830 HydrophobicContact CG-CE2 4Å; Q533-Y830 VanDerWaalsContact NE2-CE2 3.31Å; Q533-Y830 PolarHBondContact NE2-OH 2.71Å; Q609-Y830 PolarHBondContact NE2-O 3.38Å; L827-Y830 HydrophobicContact CD2-CD2 4.48Å; L827-Y830 PolarHBondContact O-N 2.81Å; Q828-Y830 PolarHBondContact O-N 2.91Å
831	V	95.8	Very high	93.5	Very high	13 Å²	13	55.9 Å²	55.9	8%	0.079	27%	0.272	C	S	.	.	S	Bend	trans	-105.9	153.9	172.3	-59.4	0	0	0	0	110.6	L529 Q609 V612 L613 Q828 K833 L836	L529-V831 HydrophobicContact CD2-CG1 4.37Å; Q609-V831 HydrophobicContact CB-CG1 4.18Å; Q609-V831 HydrophobicContact CG-CG1 4.25Å; V612-V831 HydrophobicContact CB-CG1 3.82Å; V612-V831 HydrophobicContact CG1-CG1 3.71Å; L613-V831 HydrophobicContact CD2-CB 3.98Å; L613-V831 HydrophobicContact CD2-CG2 3.77Å; L613-V831 HydrophobicContact CG-CB 3.97Å; L613-V831 HydrophobicContact CG-CG1 4.15Å; L613-V831 HydrophobicContact CG-CG2 4.22Å; Q828-V831 WeakPolarHBondContact O-CG2 3.43Å; Q828-V831 PolarHBondContact O-N 3.33Å; V831-K833 PolarHBondContact O-N 3.44Å; V831-L836 HydrophobicContact CG2-CB 4.26Å; V831-L836 HydrophobicContact CG2-CD2 4.27Å
832	P	96.2	Very high	93.5	Very high	51 Å²	51	50.6 Å²	50.6	33%	0.331	25%	0.249	S	C	.	.			trans	-59	129.3	176	-21.6	33.3	0	0	0	111.1	E834 E835 L836	P832-E834 PolarHBondContact O-N 3.37Å; P832-E835 HydrophobicContact CB-CB 4.12Å; P832-E835 PolarHBondContact O-N 3.48Å; P832-L836 WeakPolarHBondContact O-CB 3.31Å; P832-L836 PolarHBondContact O-N 3.19Å; P832-L836 VanDerWaalsContact O-N 3.08Å
833	K	95.4	Very high	93.7	Very high	102 Å²	102	51.5 Å²	51.5	44%	0.443	25%	0.253	S	S	.	.	H	α-helix	trans	-64.8	-42.2	-173.4	-171.6	-167.6	-175.3	-149.1	0	111.2	E817 L820 V831 L836 F837	E817-K833 WeakPolarHBondContact OE2-CE 3.32Å; E817-K833 IonicContact OE2-NZ 2.76Å; E817-K833 PolarHBondContact OE2-NZ 2.91Å; L820-K833 HydrophobicContact CD1-CD 4.19Å; L820-K833 HydrophobicContact CD1-CG 3.5Å; L820-K833 VanDerWaalsContact CD1-CG 3.5Å; V831-K833 PolarHBondContact O-N 3.44Å; K833-L836 WeakPolarHBondContact O-CB 3.21Å; K833-L836 PolarHBondContact O-N 3.35Å; K833-F837 WeakPolarHBondContact O-CB 3.35Å; K833-F837 PolarHBondContact O-N 2.96Å
834	E	93.2	Very high	94.1	Very high	135 Å²	135	45.4 Å²	45.4	63%	0.631	23%	0.227	S	C	*	.	H	α-helix	trans	-64.3	-44.8	-177.1	-58.3	74.5	-164.1	0	0	110.6	P832 F837 R838	P832-E834 PolarHBondContact O-N 3.37Å; E834-F837 PolarHBondContact O-N 2.9Å; E834-R838 VanDerWaalsContact O-CB 3.31Å; E834-R838 WeakPolarHBondContact O-CB 3.49Å; E834-R838 PolarHBondContact O-N 3.05Å
835	E	94.2	Very high	94.4	Very high	70 Å²	70	45.1 Å²	45.1	33%	0.327	23%	0.226	S	C	.	.	H	α-helix	trans	-68.9	-37.2	178.6	-175.8	68.2	173.1	0	0	111.8	L613 P832 R838 L839	L613-E835 HydrophobicContact CD1-CB 4.22Å; L613-E835 HydrophobicContact CD1-CG 3.48Å; L613-E835 VanDerWaalsContact CD1-CG 3.48Å; L613-E835 HydrophobicContact CD2-CB 4.4Å; L613-E835 HydrophobicContact CD2-CG 4.2Å; L613-E835 HydrophobicContact CG-CG 4.47Å; P832-E835 HydrophobicContact CB-CB 4.12Å; P832-E835 PolarHBondContact O-N 3.48Å; E835-R838 IonicContact OE1-CZ 3.5Å; E835-R838 IonicContact OE1-NE 2.97Å; E835-R838 IonicContact OE1-NH2 3.71Å; E835-R838 PolarHBondContact OE1-NH2 3.49Å; E835-R838 IonicContact OE2-CZ 2.83Å; E835-R838 VanDerWaalsContact OE2-CZ 3.28Å; E835-R838 IonicContact OE2-NE 3.75Å; E835-R838 PolarHBondContact OE2-NE 2.69Å; E835-R838 IonicContact OE2-NH2 2.78Å; E835-R838 PolarHBondContact OE2-NH2 3.45Å; E835-L839 WeakPolarHBondContact O-CG 3.05Å; E835-L839 PolarHBondContact O-N 2.73Å; E835-L839 VanDerWaalsContact O-N 3.08Å
836	L	96.8	Very high	94.6	Very high	5 Å²	5	45.2 Å²	45.2	3%	0.026	23%	0.226	C	C	.	.	H	α-helix	trans	-62.4	-51.1	173.6	175.9	64.1	0	0	0	111	L613 C616 L820 Q828 V831 P832 K833 R838 L839 I840	L613-L836 HydrophobicContact CD2-CB 3.59Å; L613-L836 HydrophobicContact CD2-CD1 4.06Å; L613-L836 HydrophobicContact CD2-CG 4.43Å; C616-L836 HydrophobicContact CB-CD1 3.49Å; C616-L836 VanDerWaalsContact CB-CD1 3.49Å; L820-L836 HydrophobicContact CD2-CD2 3.96Å; L820-L836 HydrophobicContact CD2-CG 3.93Å; Q828-L836 HydrophobicContact CG-CD2 3.41Å; Q828-L836 VanDerWaalsContact CG-CD2 3.41Å; V831-L836 HydrophobicContact CG2-CB 4.26Å; V831-L836 HydrophobicContact CG2-CD2 4.27Å; P832-L836 WeakPolarHBondContact O-CB 3.31Å; P832-L836 PolarHBondContact O-N 3.19Å; P832-L836 VanDerWaalsContact O-N 3.08Å; K833-L836 WeakPolarHBondContact O-CB 3.21Å; K833-L836 PolarHBondContact O-N 3.35Å; L836-R838 VanDerWaalsContact C-N 3.32Å; L836-R838 PolarHBondContact O-N 3.05Å; L836-L839 PolarHBondContact O-N 2.78Å; L836-I840 HydrophobicContact CD1-CG1 4.08Å; L836-I840 HydrophobicContact CG-CG1 4.43Å; L836-I840 VanDerWaalsContact O-CG1 3.26Å; L836-I840 WeakPolarHBondContact O-CG1 3.38Å; L836-I840 PolarHBondContact O-N 2.84Å
837	F	96.1	Very high	95.1	Very high	48 Å²	48	42.6 Å²	42.6	21%	0.211	20%	0.2	C	C	.	.	H	α-helix	trans	-57.8	-46.7	178.3	-177.3	-109.2	0	0	0	111.2	E817 I819 L820 K833 E834 L839 I840 T841	E817-F837 HydrophobicContact CB-CD2 4.1Å; E817-F837 HydrophobicContact CB-CE2 4.14Å; E817-F837 HydrophobicContact CG-CD1 4.48Å; E817-F837 HydrophobicContact CG-CD2 4.02Å; E817-F837 HydrophobicContact CG-CE1 4.43Å; E817-F837 HydrophobicContact CG-CE2 3.96Å; E817-F837 HydrophobicContact CG-CG 4.28Å; E817-F837 HydrophobicContact CG-CZ 4.17Å; I819-F837 HydrophobicContact CG2-CD2 3.85Å; I819-F837 HydrophobicContact CG2-CE2 3.72Å; L820-F837 HydrophobicContact CD1-CB 3.99Å; L820-F837 HydrophobicContact CD1-CD2 4.32Å; L820-F837 HydrophobicContact CD2-CB 4.22Å; L820-F837 HydrophobicContact CD2-CD2 4.23Å; L820-F837 HydrophobicContact CG-CB 4.48Å; L820-F837 HydrophobicContact CG-CD2 4.17Å; K833-F837 WeakPolarHBondContact O-CB 3.35Å; K833-F837 PolarHBondContact O-N 2.96Å; E834-F837 PolarHBondContact O-N 2.9Å; F837-L839 PolarHBondContact O-N 3.32Å; F837-I840 PolarHBondContact O-N 3.25Å; F837-T841 WeakPolarHBondContact O-CB 3.45Å; F837-T841 PolarHBondContact O-N 3.14Å; F837-T841 PolarHBondContact O-OG1 3.45Å; F837-T841 VanDerWaalsContact O-OG1 3.07Å
838	R	93.8	Very high	95.4	Very high	62 Å²	62	42.1 Å²	42.1	23%	0.234	20%	0.198	C	C	.	.	H	α-helix	trans	-55.4	-46.9	177.4	-169.1	-170.2	61.7	63.7	-9.9	112.4	Y282 E834 E835 L836 L842	Y282-R838 PolarHBondContact OH-NH1 2.84Å; E834-R838 VanDerWaalsContact O-CB 3.31Å; E834-R838 WeakPolarHBondContact O-CB 3.49Å; E834-R838 PolarHBondContact O-N 3.05Å; E835-R838 IonicContact OE1-CZ 3.5Å; E835-R838 IonicContact OE1-NE 2.97Å; E835-R838 IonicContact OE1-NH2 3.71Å; E835-R838 PolarHBondContact OE1-NH2 3.49Å; E835-R838 IonicContact OE2-CZ 2.83Å; E835-R838 VanDerWaalsContact OE2-CZ 3.28Å; E835-R838 IonicContact OE2-NE 3.75Å; E835-R838 PolarHBondContact OE2-NE 2.69Å; E835-R838 IonicContact OE2-NH2 2.78Å; E835-R838 PolarHBondContact OE2-NH2 3.45Å; L836-R838 VanDerWaalsContact C-N 3.32Å; L836-R838 PolarHBondContact O-N 3.05Å; R838-L842 PolarHBondContact O-N 3.43Å
839	L	95.1	Very high	95.5	Very high	27 Å²	27	41.1 Å²	41.1	14%	0.141	19%	0.193	C	C	.	.	H	α-helix	trans	-71.1	-34.3	179.3	-72.1	177.6	0	0	0	113.3	L613 A617 E835 L836 F837 L842 E843	L613-L839 HydrophobicContact CB-CD1 3.75Å; L613-L839 HydrophobicContact CD2-CD1 4.45Å; A617-L839 HydrophobicContact CB-CB 4.18Å; E835-L839 WeakPolarHBondContact O-CG 3.05Å; E835-L839 PolarHBondContact O-N 2.73Å; E835-L839 VanDerWaalsContact O-N 3.08Å; L836-L839 PolarHBondContact O-N 2.78Å; F837-L839 PolarHBondContact O-N 3.32Å; L839-L842 HydrophobicContact CD2-CD2 4.27Å; L839-L842 VanDerWaalsContact O-CB 3.26Å; L839-L842 WeakPolarHBondContact O-CB 3.38Å; L839-L842 PolarHBondContact O-N 3.06Å; L839-E843 PolarHBondContact O-N 2.76Å
840	I	97.1	Very high	95.7	Very high	0 Å²	0	35 Å²	35	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-65.1	-48.2	174.3	-68.5	-69	0	0	0	109.9	M620 I819 F824 L836 F837 L842 E843 F844	M620-I840 HydrophobicContact CB-CD1 3.64Å; M620-I840 HydrophobicContact CE-CD1 4.36Å; M620-I840 HydrophobicContact CE-CG2 3.72Å; M620-I840 HydrophobicContact CG-CD1 4.27Å; M620-I840 HydrophobicContact CG-CG2 4.24Å; I819-I840 HydrophobicContact CG1-CG2 3.95Å; F824-I840 HydrophobicContact CD2-CD1 4.14Å; F824-I840 HydrophobicContact CE1-CD1 4.48Å; F824-I840 HydrophobicContact CE2-CD1 4.01Å; F824-I840 HydrophobicContact CE2-CG1 4.34Å; F824-I840 HydrophobicContact CG-CD1 4.44Å; F824-I840 HydrophobicContact CZ-CD1 4.19Å; L836-I840 HydrophobicContact CD1-CG1 4.08Å; L836-I840 HydrophobicContact CG-CG1 4.43Å; L836-I840 VanDerWaalsContact O-CG1 3.26Å; L836-I840 WeakPolarHBondContact O-CG1 3.38Å; L836-I840 PolarHBondContact O-N 2.84Å; F837-I840 PolarHBondContact O-N 3.25Å; I840-L842 PolarHBondContact O-N 3.44Å; I840-E843 WeakPolarHBondContact O-CB 3.32Å; I840-E843 PolarHBondContact O-N 3.38Å; I840-F844 HydrophobicContact CG2-CD2 4.36Å; I840-F844 HydrophobicContact CG2-CE2 3.9Å; I840-F844 WeakPolarHBondContact O-CD2 3.41Å; I840-F844 PolarHBondContact O-N 2.86Å
841	T	95.5	Very high	95.7	Very high	25 Å²	25	32.2 Å²	32.2	15%	0.153	16%	0.155	C	C	.	.	H	α-helix	trans	-57.8	-35	174.7	-63.5	0	0	0	0	112	F837 E843 F844 I845 F870	F837-T841 WeakPolarHBondContact O-CB 3.45Å; F837-T841 PolarHBondContact O-N 3.14Å; F837-T841 PolarHBondContact O-OG1 3.45Å; F837-T841 VanDerWaalsContact O-OG1 3.07Å; T841-E843 VanDerWaalsContact C-N 3.29Å; T841-E843 PolarHBondContact O-N 3.08Å; T841-F844 WeakPolarHBondContact O-CB 3.31Å; T841-F844 PolarHBondContact O-N 2.77Å; T841-F844 VanDerWaalsContact O-N 3.12Å; T841-I845 HydrophobicContact CG2-CD1 4.12Å; T841-I845 HydrophobicContact CG2-CG1 4.48Å; T841-I845 WeakPolarHBondContact O-CG1 2.88Å; T841-I845 PolarHBondContact O-N 2.78Å; T841-F870 HydrophobicContact CG2-CD1 4.14Å; T841-F870 HydrophobicContact CG2-CE1 3.91Å
842	L	95.3	Very high	95.6	Very high	13 Å²	13	32 Å²	32	7%	0.068	16%	0.155	C	C	.	.	H	α-helix	trans	-58.7	-39.2	174.7	-156.2	66.4	0	0	0	113.2	W278 R838 L839 I840 F844 I845 N846	W278-L842 HydrophobicContact CB-CD2 4.04Å; W278-L842 HydrophobicContact CD2-CD1 3.37Å; W278-L842 HydrophobicContact CD2-CD2 4.13Å; W278-L842 HydrophobicContact CD2-CG 4.1Å; W278-L842 HydrophobicContact CE3-CD1 3.69Å; W278-L842 HydrophobicContact CG-CD1 3.9Å; W278-L842 HydrophobicContact CG-CD2 3.72Å; W278-L842 HydrophobicContact CG-CG 4.12Å; W278-L842 HydrophobicContact CH2-CD1 3.81Å; W278-L842 HydrophobicContact CZ2-CD1 3.48Å; W278-L842 VanDerWaalsContact CZ2-CD1 3.48Å; W278-L842 HydrophobicContact CZ2-CG 4.47Å; W278-L842 HydrophobicContact CZ3-CD1 3.9Å; R838-L842 PolarHBondContact O-N 3.43Å; L839-L842 HydrophobicContact CD2-CD2 4.27Å; L839-L842 VanDerWaalsContact O-CB 3.26Å; L839-L842 WeakPolarHBondContact O-CB 3.38Å; L839-L842 PolarHBondContact O-N 3.06Å; I840-L842 PolarHBondContact O-N 3.44Å; L842-F844 VanDerWaalsContact C-N 3.32Å; L842-I845 HydrophobicContact CD1-CD1 4.47Å; L842-I845 PolarHBondContact O-N 3.46Å; L842-N846 WeakPolarHBondContact O-CB 3.35Å; L842-N846 VanDerWaalsContact O-CG 3.22Å; L842-N846 PolarHBondContact O-N 2.87Å; L842-N846 PolarHBondContact O-ND2 3.15Å
843	E	96.5	Very high	95.5	Very high	25 Å²	25	30 Å²	30	12%	0.117	14%	0.142	C	C	.	.	H	α-helix	trans	-68.2	-34.2	177.1	-64	-56.4	141.9	0	0	111.7	A617 M620 Q621 L624 L839 I840 T841 R847	A617-E843 HydrophobicContact CB-CG 4.29Å; M620-E843 HydrophobicContact CG-CB 4.13Å; Q621-E843 HydrophobicContact CB-CG 4.33Å; Q621-E843 WeakPolarHBondContact CB-OE2 3.3Å; Q621-E843 WeakPolarHBondContact CG-OE2 3.26Å; L624-E843 HydrophobicContact CD1-CB 4.14Å; L839-E843 PolarHBondContact O-N 2.76Å; I840-E843 WeakPolarHBondContact O-CB 3.32Å; I840-E843 PolarHBondContact O-N 3.38Å; T841-E843 VanDerWaalsContact C-N 3.29Å; T841-E843 PolarHBondContact O-N 3.08Å; E843-R847 VanDerWaalsContact O-CB 3.26Å; E843-R847 WeakPolarHBondContact O-CB 3.31Å; E843-R847 PolarHBondContact O-N 3.05Å
844	F	97.9	Very high	95.3	Very high	0 Å²	0	27 Å²	27	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-65	-44	170	-73.5	-86.6	0	0	0	111.8	M620 L624 L806 F809 A810 C813 I819 I840 T841 L842 R847 T848 F870	M620-F844 HydrophobicContact CE-CE2 4.04Å; M620-F844 HydrophobicContact CE-CZ 4.26Å; M620-F844 HydrophobicContact CG-CE2 4.28Å; M620-F844 HydrophobicContact SD-CE2 4.08Å; M620-F844 HydrophobicContact SD-CZ 4.1Å; L624-F844 HydrophobicContact CD1-CD1 3.95Å; L624-F844 HydrophobicContact CD1-CD2 4.25Å; L624-F844 HydrophobicContact CD1-CE1 4.13Å; L624-F844 HydrophobicContact CD1-CE2 4.42Å; L624-F844 HydrophobicContact CD1-CG 4.02Å; L624-F844 HydrophobicContact CD1-CZ 4.39Å; L624-F844 HydrophobicContact CD2-CD1 4.36Å; L624-F844 HydrophobicContact CD2-CE1 3.91Å; L624-F844 HydrophobicContact CD2-CZ 4.35Å; L806-F844 HydrophobicContact CD1-CD1 3.84Å; L806-F844 HydrophobicContact CD1-CE1 4.36Å; F809-F844 HydrophobicContact CB-CE1 3.81Å; F809-F844 HydrophobicContact CB-CZ 3.76Å; A810-F844 HydrophobicContact CB-CD1 4.24Å; A810-F844 HydrophobicContact CB-CE1 4.01Å; C813-F844 WeakPolarHBondContact SG-CE2 3.37Å; C813-F844 WeakPolarHBondContact SG-CZ 3.42Å; I819-F844 HydrophobicContact CD1-CE2 4.41Å; I819-F844 HydrophobicContact CD1-CZ 4.16Å; I819-F844 HydrophobicContact CG1-CE2 4.39Å; I840-F844 HydrophobicContact CG2-CD2 4.36Å; I840-F844 HydrophobicContact CG2-CE2 3.9Å; I840-F844 WeakPolarHBondContact O-CD2 3.41Å; I840-F844 PolarHBondContact O-N 2.86Å; T841-F844 WeakPolarHBondContact O-CB 3.31Å; T841-F844 PolarHBondContact O-N 2.77Å; T841-F844 VanDerWaalsContact O-N 3.12Å; L842-F844 VanDerWaalsContact C-N 3.32Å; F844-R847 PolarHBondContact O-N 2.64Å; F844-T848 WeakPolarHBondContact O-CA 3.44Å; F844-T848 WeakPolarHBondContact O-CB 3.44Å; F844-T848 PolarHBondContact O-N 3.5Å; F844-T848 PolarHBondContact O-OG1 2.89Å; F844-F870 HydrophobicContact CB-CB 4.5Å; F844-F870 HydrophobicContact CB-CD1 3.84Å; F844-F870 HydrophobicContact CB-CD2 3.73Å; F844-F870 HydrophobicContact CB-CE1 3.97Å; F844-F870 HydrophobicContact CB-CE2 3.86Å; F844-F870 HydrophobicContact CB-CG 3.75Å; F844-F870 HydrophobicContact CB-CZ 3.99Å; F844-F870 HydrophobicContact CD1-CD2 4.33Å; F844-F870 AromaticContact CD1-CE2 3.92Å; F844-F870 HydrophobicContact CD1-CE2 3.92Å; F844-F870 HydrophobicContact CD1-CZ 4.37Å; F844-F870 HydrophobicContact CG-CD2 4.35Å; F844-F870 HydrophobicContact CG-CE1 4.49Å; F844-F870 HydrophobicContact CG-CE2 4.03Å; F844-F870 HydrophobicContact CG-CZ 4.13Å
845	I	97.7	Very high	95.2	Very high	8 Å²	8	20.6 Å²	20.6	4%	0.041	10%	0.101	C	C	.	.	H	α-helix	trans	-58.2	-53.7	175.8	-65.7	165.3	0	0	0	109.9	P258 W278 T841 L842 R847 T848 N849 F870	P258-I845 HydrophobicContact CG-CG2 3.61Å; W278-I845 HydrophobicContact CH2-CG2 4.38Å; W278-I845 HydrophobicContact CZ2-CG2 3.88Å; T841-I845 HydrophobicContact CG2-CD1 4.12Å; T841-I845 HydrophobicContact CG2-CG1 4.48Å; T841-I845 WeakPolarHBondContact O-CG1 2.88Å; T841-I845 PolarHBondContact O-N 2.78Å; L842-I845 HydrophobicContact CD1-CD1 4.47Å; L842-I845 PolarHBondContact O-N 3.46Å; I845-R847 VanDerWaalsContact C-N 3.34Å; I845-R847 PolarHBondContact O-N 3.11Å; I845-T848 PolarHBondContact O-N 3.34Å; I845-N849 WeakPolarHBondContact O-CB 3.38Å; I845-N849 PolarHBondContact O-N 3.45Å; I845-N849 VanDerWaalsContact O-N 3.07Å; I845-N849 PolarHBondContact O-ND2 3.01Å; I845-F870 HydrophobicContact CG1-CB 4.1Å; I845-F870 HydrophobicContact CG1-CD1 4.14Å
846	N	96.2	Very high	95	Very high	15 Å²	15	17.7 Å²	17.7	8%	0.08	9%	0.088	C	C	.	.	H	α-helix	trans	-59.5	-46.1	-178.7	-66.8	-27.3	0	0	0	111.4	I274 W278 L842 E850	I274-N846 HydrophobicContact CD1-CB 4.39Å; I274-N846 VanDerWaalsContact CD1-OD1 3.27Å; I274-N846 WeakPolarHBondContact CD1-OD1 3.31Å; W278-N846 PolarHBondContact NE1-OD1 2.79Å; L842-N846 WeakPolarHBondContact O-CB 3.35Å; L842-N846 VanDerWaalsContact O-CG 3.22Å; L842-N846 PolarHBondContact O-N 2.87Å; L842-N846 PolarHBondContact O-ND2 3.15Å; N846-E850 WeakPolarHBondContact O-CB 3.35Å; N846-E850 PolarHBondContact O-N 3.5Å; N846-E850 VanDerWaalsContact O-N 3.11Å
847	R	96.4	Very high	94.6	Very high	21 Å²	21	20.8 Å²	20.8	8%	0.079	10%	0.099	C	C	.	.	H	α-helix	trans	-72.2	-40.1	-177.6	-168.3	59.3	49.3	-172.1	-17.5	113.1	L624 L806 E843 F844 I845 N849 E850 V851	L624-R847 HydrophobicContact CB-CB 4.21Å; L624-R847 HydrophobicContact CB-CG 3.97Å; L624-R847 HydrophobicContact CD1-CB 4.38Å; L624-R847 WeakPolarHBondContact O-CD 3.33Å; L624-R847 WeakPolarHBondContact O-CG 3.27Å; L806-R847 HydrophobicContact CD1-CB 4.25Å; L806-R847 HydrophobicContact CD1-CG 4.19Å; L806-R847 HydrophobicContact CD2-CG 4.21Å; E843-R847 VanDerWaalsContact O-CB 3.26Å; E843-R847 WeakPolarHBondContact O-CB 3.31Å; E843-R847 PolarHBondContact O-N 3.05Å; F844-R847 PolarHBondContact O-N 2.64Å; I845-R847 VanDerWaalsContact C-N 3.34Å; I845-R847 PolarHBondContact O-N 3.11Å; R847-N849 VanDerWaalsContact C-N 3.35Å; R847-E850 IonicContact CZ-OE1 3.67Å; R847-E850 IonicContact CZ-OE2 2.86Å; R847-E850 IonicContact NE-OE2 3.7Å; R847-E850 IonicContact NH1-OE1 3.51Å; R847-E850 PolarHBondContact NH1-OE1 2.86Å; R847-E850 IonicContact NH1-OE2 3.2Å; R847-E850 PolarHBondContact NH1-OE2 3.47Å; R847-E850 IonicContact NH2-OE2 3.08Å; R847-E850 PolarHBondContact NH2-OE2 3.31Å; R847-E850 PolarHBondContact O-N 3.16Å; R847-V851 HydrophobicContact CG-CG2 4.47Å; R847-V851 WeakPolarHBondContact O-CG2 3.48Å; R847-V851 PolarHBondContact O-N 2.81Å
848	T	97.1	Very high	94.4	Very high	2 Å²	2	18.7 Å²	18.7	1%	0.012	9%	0.09	C	C	.	.	H	α-helix	trans	-63.3	-43.2	179.4	-60	0	0	0	0	110.7	F844 I845 V851 G852 V853 V867 F870 V871	F844-T848 WeakPolarHBondContact O-CA 3.44Å; F844-T848 WeakPolarHBondContact O-CB 3.44Å; F844-T848 PolarHBondContact O-N 3.5Å; F844-T848 PolarHBondContact O-OG1 2.89Å; I845-T848 PolarHBondContact O-N 3.34Å; T848-V851 PolarHBondContact O-N 3.13Å; T848-G852 WeakPolarHBondContact O-CA 3.4Å; T848-G852 PolarHBondContact O-N 2.96Å; T848-V853 HydrophobicContact CG2-CG2 3.32Å; T848-V867 HydrophobicContact CG2-CB 4.1Å; T848-F870 HydrophobicContact CG2-CB 4.13Å; T848-V871 HydrophobicContact CG2-CG2 4.25Å
849	N	96.3	Very high	94.2	Very high	3 Å²	3	16.9 Å²	16.9	2%	0.016	9%	0.085	C	C	.	.	H	α-helix	trans	-72.8	-27.4	177.7	-68.4	-70	0	0	0	112.6	P258 F262 I845 R847 F870 C872 F916	P258-N849 HydrophobicContact CB-CB 4Å; F262-N849 HydrophobicContact CE2-CB 4.4Å; I845-N849 WeakPolarHBondContact O-CB 3.38Å; I845-N849 PolarHBondContact O-N 3.45Å; I845-N849 VanDerWaalsContact O-N 3.07Å; I845-N849 PolarHBondContact O-ND2 3.01Å; R847-N849 VanDerWaalsContact C-N 3.35Å; N849-F870 PolarHBondContact ND2-O 3.39Å; N849-C872 WeakPolarHBondContact OD1-CB 3.44Å; N849-C872 PolarHBondContact OD1-N 3.12Å; N849-F916 HydrophobicContact CB-CD1 3.64Å; N849-F916 HydrophobicContact CB-CE1 3.73Å; N849-F916 HydrophobicContact CB-CG 4.16Å; N849-F916 HydrophobicContact CB-CZ 4.33Å; N849-F916 WeakPolarHBondContact O-CD1 3.41Å; N849-F916 VanDerWaalsContact OD1-CG 3.3Å; N849-F916 WeakPolarHBondContact OD1-CG 3.44Å
850	E	94.2	Very high	94	Very high	40 Å²	40	20.9 Å²	20.9	19%	0.187	10%	0.103	C	C	.	.	H	α-helix	trans	-67.2	-41.4	171.4	-169.4	-176.8	145.3	0	0	112.3	F262 N846 R847 R938	F262-E850 HydrophobicContact CE1-CB 4.31Å; F262-E850 HydrophobicContact CE1-CG 4.3Å; F262-E850 HydrophobicContact CZ-CB 3.79Å; F262-E850 HydrophobicContact CZ-CG 4.14Å; N846-E850 WeakPolarHBondContact O-CB 3.35Å; N846-E850 PolarHBondContact O-N 3.5Å; N846-E850 VanDerWaalsContact O-N 3.11Å; R847-E850 IonicContact CZ-OE1 3.67Å; R847-E850 IonicContact CZ-OE2 2.86Å; R847-E850 IonicContact NE-OE2 3.7Å; R847-E850 IonicContact NH1-OE1 3.51Å; R847-E850 PolarHBondContact NH1-OE1 2.86Å; R847-E850 IonicContact NH1-OE2 3.2Å; R847-E850 PolarHBondContact NH1-OE2 3.47Å; R847-E850 IonicContact NH2-OE2 3.08Å; R847-E850 PolarHBondContact NH2-OE2 3.31Å; R847-E850 PolarHBondContact O-N 3.16Å; E850-R938 PolarHBondContact O-NH1 2.86Å
851	V	93.7	Very high	93.7	Very high	12 Å²	12	22.2 Å²	22.2	7%	0.073	11%	0.109	C	C	.	.	H	α-helix	trans	-80.5	-44	-178.2	176.1	0	0	0	0	111.3	L806 R847 T848 K918 R1018	L806-V851 HydrophobicContact CD2-CG2 4.42Å; R847-V851 HydrophobicContact CG-CG2 4.47Å; R847-V851 WeakPolarHBondContact O-CG2 3.48Å; R847-V851 PolarHBondContact O-N 2.81Å; T848-V851 PolarHBondContact O-N 3.13Å; V851-K918 WeakPolarHBondContact O-CE 3.11Å; V851-K918 PolarHBondContact O-NZ 3.19Å; V851-R1018 HydrophobicContact CG2-CG 4.26Å
852	G	93.1	Very high	93.4	Very high	9 Å²	9	24.9 Å²	24.9	9%	0.093	13%	0.127	C	C	.	.			trans	86.2	154.7	-171.1	0	0	0	0	0	113.4	T848 F916 K918	T848-G852 WeakPolarHBondContact O-CA 3.4Å; T848-G852 PolarHBondContact O-N 2.96Å; G852-F916 CarbonylContact C-O 3.56Å; G852-F916 WeakPolarHBondContact CA-O 3.37Å; G852-K918 WeakPolarHBondContact O-CE 3.23Å
853	V	93.9	Very high	93.2	Very high	7 Å²	7	24.9 Å²	24.9	4%	0.042	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	127.5	-175.6	179.9	0	0	0	0	110.9	T848 V867 L868 V871 F916 K918	T848-V853 HydrophobicContact CG2-CG2 3.32Å; V853-V867 HydrophobicContact CG1-CG2 4.16Å; V853-V867 HydrophobicContact CG2-CB 4.48Å; V853-V867 HydrophobicContact CG2-CG2 3.89Å; V853-L868 HydrophobicContact CG1-CD1 4.14Å; V853-V871 HydrophobicContact CB-CG2 3.97Å; V853-V871 HydrophobicContact CG2-CG2 3.53Å; V853-F916 PolarHBondContact N-O 3.3Å; V853-K918 PolarHBondContact O-N 3.39Å
854	D	92	Very high	93	Very high	40 Å²	40	23.9 Å²	23.9	21%	0.214	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	113.7	175	-178.3	-22.6	0	0	0	110.4	N856 R857 C858 K918	D854-N856 PolarHBondContact OD1-N 3.2Å; D854-R857 HydrophobicContact CB-CB 3.86Å; D854-R857 PolarHBondContact OD1-N 2.87Å; D854-C858 PolarHBondContact O-N 3.48Å; D854-C858 VanDerWaalsContact O-N 3.12Å; D854-C858 PolarHBondContact O-SG 2.86Å; D854-K918 HydrophobicContact CB-CB 4.18Å
855	L	89.8	Confident	92.8	Very high	1 Å²	1	24.5 Å²	24.5	1%	0.005	13%	0.126	C	C	.	.	H	α-helix	trans	-71.3	-38.9	-176.7	-73.9	-179.8	0	0	0	112.9	R857 C858 I859 L868 L882 L886 I893 L899 I917	L855-R857 VanDerWaalsContact C-N 3.3Å; L855-R857 PolarHBondContact O-N 3.06Å; L855-C858 WeakPolarHBondContact O-CA 3.39Å; L855-C858 WeakPolarHBondContact O-CB 3.48Å; L855-C858 PolarHBondContact O-N 3.29Å; L855-I859 WeakPolarHBondContact O-CG1 3.35Å; L855-I859 PolarHBondContact O-N 3.44Å; L855-L868 HydrophobicContact CD2-CD1 3.52Å; L855-L868 HydrophobicContact CD2-CD2 4.13Å; L855-L868 HydrophobicContact CD2-CG 4.49Å; L855-L882 HydrophobicContact CD2-CD2 4.29Å; L855-L886 HydrophobicContact CD1-CD1 4.5Å; L855-I893 HydrophobicContact CB-CD1 3.86Å; L855-I893 HydrophobicContact CD1-CD1 3.46Å; L855-I893 VanDerWaalsContact CD1-CD1 3.46Å; L855-I893 HydrophobicContact CG-CD1 4.31Å; L855-L899 HydrophobicContact CD1-CD2 3.68Å; L855-I917 HydrophobicContact CD1-CB 4.48Å; L855-I917 HydrophobicContact CD1-CD1 4.06Å; L855-I917 HydrophobicContact CD1-CG1 4.22Å; L855-I917 HydrophobicContact CD1-CG2 3.48Å; L855-I917 VanDerWaalsContact CD1-CG2 3.48Å; L855-I917 HydrophobicContact CG-CG1 4.47Å; L855-I917 HydrophobicContact CG-CG2 3.77Å
856	N	89.7	Confident	92.6	Very high	9 Å²	9	25.2 Å²	25.2	5%	0.048	13%	0.132	C	C	.	.	H	α-helix	trans	-65.1	-41.6	179.9	-66.7	-28.6	0	0	0	109.9	D854 C858 I859 E860 H892 I893	D854-N856 PolarHBondContact OD1-N 3.2Å; N856-C858 VanDerWaalsContact C-N 3.3Å; N856-C858 PolarHBondContact O-N 3.41Å; N856-I859 WeakPolarHBondContact O-CB 3.3Å; N856-I859 PolarHBondContact O-N 3.27Å; N856-I859 VanDerWaalsContact O-N 3.1Å; N856-E860 WeakPolarHBondContact O-CG 3.5Å; N856-E860 PolarHBondContact O-N 3.15Å; N856-H892 VanDerWaalsContact CG-CD2 3.44Å; N856-H892 PolarHBondContact ND2-CE1 2.89Å; N856-H892 PolarHBondContact ND2-NE2 3.07Å; N856-I893 PolarHBondContact ND2-O 3.41Å; N856-I893 PolarHBondContact OD1-N 3.05Å
857	R	89.9	Confident	92.6	Very high	70 Å²	70	24.9 Å²	24.9	26%	0.264	13%	0.131	S	C	.	.	H	α-helix	trans	-60.6	-37.6	171.8	-169.9	177.9	175.3	-171.5	-3.7	112.7	K667 D854 L855 I859 H861 T864	K667-R857 PolarHBondContact O-NH2 2.86Å; D854-R857 HydrophobicContact CB-CB 3.86Å; D854-R857 PolarHBondContact OD1-N 2.87Å; L855-R857 VanDerWaalsContact C-N 3.3Å; L855-R857 PolarHBondContact O-N 3.06Å; R857-I859 VanDerWaalsContact C-N 3.31Å; R857-I859 PolarHBondContact O-N 3.11Å; R857-H861 WeakPolarHBondContact O-CA 3.26Å; R857-H861 WeakPolarHBondContact O-CB 3.49Å; R857-H861 PolarHBondContact O-N 3.47Å; R857-T864 HydrophobicContact CG-CG2 4.24Å; R857-T864 PolarHBondContact O-OG1 2.66Å
858	C	91.7	Very high	92.6	Very high	3 Å²	3	23.9 Å²	23.9	2%	0.02	13%	0.127	C	C	.	.	H	α-helix	trans	-65.1	-32.5	175.1	-67.4	0	0	0	0	113.1	D854 L855 N856 T864 A865 L883	D854-C858 PolarHBondContact O-N 3.48Å; D854-C858 VanDerWaalsContact O-N 3.12Å; D854-C858 PolarHBondContact O-SG 2.86Å; L855-C858 WeakPolarHBondContact O-CA 3.39Å; L855-C858 WeakPolarHBondContact O-CB 3.48Å; L855-C858 PolarHBondContact O-N 3.29Å; N856-C858 VanDerWaalsContact C-N 3.3Å; N856-C858 PolarHBondContact O-N 3.41Å; C858-T864 WeakPolarHBondContact CA-OG1 3.47Å; C858-T864 PolarHBondContact N-OG1 2.96Å; C858-A865 HydrophobicContact CB-CB 3.99Å; C858-L883 HydrophobicContact CB-CD2 4.05Å
859	I	89.8	Confident	92.5	Very high	24 Å²	24	26 Å²	26	12%	0.123	14%	0.136	C	C	.	.	H	α-helix	trans	-73.1	-51.1	176.5	-62.7	163.7	0	0	0	109.9	L855 N856 R857 L886	L855-I859 WeakPolarHBondContact O-CG1 3.35Å; L855-I859 PolarHBondContact O-N 3.44Å; N856-I859 WeakPolarHBondContact O-CB 3.3Å; N856-I859 PolarHBondContact O-N 3.27Å; N856-I859 VanDerWaalsContact O-N 3.1Å; R857-I859 VanDerWaalsContact C-N 3.31Å; R857-I859 PolarHBondContact O-N 3.11Å; I859-L886 HydrophobicContact CD1-CB 3.84Å; I859-L886 HydrophobicContact CD1-CD1 4.17Å; I859-L886 HydrophobicContact CD1-CD2 4.42Å; I859-L886 HydrophobicContact CD1-CG 4.37Å; I859-L886 HydrophobicContact CG1-CB 4.17Å; I859-L886 HydrophobicContact CG1-CD1 4.48Å
860	E	89.1	Confident	92.6	Very high	112 Å²	112	26 Å²	26	52%	0.523	14%	0.136	S	C	.	.	H	α-helix	trans	-66.5	-38.6	-177.8	-69	178.4	177	0	0	112.7	N856	N856-E860 WeakPolarHBondContact O-CG 3.5Å; N856-E860 PolarHBondContact O-N 3.15Å
861	H	90.9	Very high	92.7	Very high	27 Å²	27	24 Å²	24	13%	0.125	13%	0.127	C	C	.	.			trans	-124.5	90.9	-175.3	-63.5	-71.2	0	0	0	110.6	N668 E670 R857 Y863 T864	N668-H861 PolarHBondContact ND2-NE2 3.45Å; E670-H861 VanDerWaalsContact CG-ND1 3.32Å; E670-H861 WeakPolarHBondContact CG-ND1 3.46Å; E670-H861 IonicContact OE1-CG 2.77Å; E670-H861 IonicContact OE1-ND1 3.05Å; E670-H861 PolarHBondContact OE1-ND1 2.91Å; R857-H861 WeakPolarHBondContact O-CA 3.26Å; R857-H861 WeakPolarHBondContact O-CB 3.49Å; R857-H861 PolarHBondContact O-N 3.47Å; H861-Y863 PolarHBondContact O-N 3.43Å; H861-T864 HydrophobicContact CB-CG2 3.96Å; H861-T864 PolarHBondContact O-N 2.8Å; H861-T864 PolarHBondContact O-OG1 3.21Å
862	P	90.4	Very high	92.9	Very high	82 Å²	82	23.5 Å²	23.5	53%	0.532	12%	0.124	S	C	.	.	G	3₁₀ helix	trans	-53.1	-31.1	-176.5	-29.5	35.8	0	0	0	114.7	T864 A865	P862-T864 PolarHBondContact O-N 3.33Å; P862-A865 VanDerWaalsContact O-CB 3.32Å; P862-A865 WeakPolarHBondContact O-CB 3.29Å; P862-A865 PolarHBondContact O-N 2.89Å; P862-A865 VanDerWaalsContact O-N 3.11Å
863	Y	91.4	Very high	92.9	Very high	13 Å²	13	23 Å²	23	5%	0.051	12%	0.12	C	C	.	.	G	3₁₀ helix	trans	-55.7	-31.9	174.6	163.2	-103.2	0	0	0	113	R800 L807 E808 Q811 H861 A865	R800-Y863 VanDerWaalsContact NH1-CD2 3.3Å; L807-Y863 HydrophobicContact CB-CE1 4.17Å; L807-Y863 HydrophobicContact CD1-CE1 4.38Å; E808-Y863 WeakPolarHBondContact CA-OH 3.46Å; E808-Y863 PolarHBondContact N-OH 3.11Å; E808-Y863 PolarHBondContact OE2-OH 3.31Å; E808-Y863 VanDerWaalsContact OE2-OH 3.11Å; Q811-Y863 VanDerWaalsContact CD-CE2 3.46Å; Q811-Y863 HydrophobicContact CG-CD2 4.17Å; Q811-Y863 HydrophobicContact CG-CE2 3.64Å; Q811-Y863 VanDerWaalsContact NE2-CE2 3.33Å; Q811-Y863 PolarHBondContact NE2-O 3.25Å; H861-Y863 PolarHBondContact O-N 3.43Å; Y863-A865 VanDerWaalsContact C-N 3.33Å
864	T	92.4	Very high	92.9	Very high	4 Å²	4	22.8 Å²	22.8	3%	0.025	12%	0.118	C	C	.	.	G	3₁₀ helix	trans	-83.2	-11.2	-177.3	69.3	0	0	0	0	113.3	L807 R857 C858 H861 P862 S866 V867	L807-T864 HydrophobicContact CD1-CG2 4.18Å; R857-T864 HydrophobicContact CG-CG2 4.24Å; R857-T864 PolarHBondContact O-OG1 2.66Å; C858-T864 WeakPolarHBondContact CA-OG1 3.47Å; C858-T864 PolarHBondContact N-OG1 2.96Å; H861-T864 HydrophobicContact CB-CG2 3.96Å; H861-T864 PolarHBondContact O-N 2.8Å; H861-T864 PolarHBondContact O-OG1 3.21Å; P862-T864 PolarHBondContact O-N 3.33Å; T864-S866 VanDerWaalsContact C-N 3.3Å; T864-S866 PolarHBondContact O-N 3.09Å; T864-V867 WeakPolarHBondContact O-CG2 3.47Å
865	A	93.7	Very high	92.9	Very high	12 Å²	12	21 Å²	21	10%	0.099	11%	0.108	C	C	.	.	G	3₁₀ helix	trans	-75.3	-15.1	-176	0	0	0	0	0	114.1	C858 P862 Y863 V867 L868 L883	C858-A865 HydrophobicContact CB-CB 3.99Å; P862-A865 VanDerWaalsContact O-CB 3.32Å; P862-A865 WeakPolarHBondContact O-CB 3.29Å; P862-A865 PolarHBondContact O-N 2.89Å; P862-A865 VanDerWaalsContact O-N 3.11Å; Y863-A865 VanDerWaalsContact C-N 3.33Å; A865-V867 PolarHBondContact O-N 2.76Å; A865-L868 VanDerWaalsContact O-CB 3.22Å; A865-L868 WeakPolarHBondContact O-CB 3.38Å; A865-L868 PolarHBondContact O-N 2.92Å; A865-L883 HydrophobicContact CB-CD1 3.78Å; A865-L883 HydrophobicContact CB-CD2 4.2Å
866	S	93.3	Very high	93.1	Very high	24 Å²	24	23.1 Å²	23.1	17%	0.168	12%	0.123	C	C	.	.	G	3₁₀ helix	trans	-61.1	-27.7	-176.3	62.7	0	0	0	0	114.1	Q811 T864 L868 Q869	Q811-S866 PolarHBondContact NE2-OG 3.38Å; T864-S866 VanDerWaalsContact C-N 3.3Å; T864-S866 PolarHBondContact O-N 3.09Å; S866-L868 VanDerWaalsContact C-N 3.33Å; S866-Q869 WeakPolarHBondContact O-CG 3.36Å; S866-Q869 PolarHBondContact O-NE2 2.77Å
867	V	96.2	Very high	93.2	Very high	7 Å²	7	24 Å²	24	4%	0.042	13%	0.125	C	C	.	.	G	3₁₀ helix	trans	-78.8	-15.1	178.2	-68.4	0	0	0	0	113.8	L806 L807 A810 T848 V853 T864 A865 Q869 F870	L806-V867 HydrophobicContact CG-CG1 4.17Å; L807-V867 HydrophobicContact CD2-CB 4.41Å; L807-V867 HydrophobicContact CD2-CG1 3.78Å; L807-V867 HydrophobicContact CD2-CG2 3.73Å; A810-V867 HydrophobicContact CB-CG1 3.55Å; T848-V867 HydrophobicContact CG2-CB 4.1Å; V853-V867 HydrophobicContact CG1-CG2 4.16Å; V853-V867 HydrophobicContact CG2-CB 4.48Å; V853-V867 HydrophobicContact CG2-CG2 3.89Å; T864-V867 WeakPolarHBondContact O-CG2 3.47Å; A865-V867 PolarHBondContact O-N 2.76Å; V867-Q869 PolarHBondContact O-N 2.85Å; V867-F870 HydrophobicContact CB-CD2 4.25Å; V867-F870 HydrophobicContact CG1-CD2 4.42Å; V867-F870 WeakPolarHBondContact O-CB 3.38Å; V867-F870 WeakPolarHBondContact O-CD2 3.42Å; V867-F870 PolarHBondContact O-N 3.06Å
868	L	96	Very high	93.4	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	12%	0.115	C	C	.	.	G	3₁₀ helix	trans	-60.6	-32.8	-175.9	-173.7	61.9	0	0	0	112.5	V853 L855 A865 S866 F870 V871 L874 A879 L882 L883	V853-L868 HydrophobicContact CG1-CD1 4.14Å; L855-L868 HydrophobicContact CD2-CD1 3.52Å; L855-L868 HydrophobicContact CD2-CD2 4.13Å; L855-L868 HydrophobicContact CD2-CG 4.49Å; A865-L868 VanDerWaalsContact O-CB 3.22Å; A865-L868 WeakPolarHBondContact O-CB 3.38Å; A865-L868 PolarHBondContact O-N 2.92Å; S866-L868 VanDerWaalsContact C-N 3.33Å; L868-F870 PolarHBondContact O-N 3.03Å; L868-F870 VanDerWaalsContact O-N 3.12Å; L868-V871 HydrophobicContact CD1-CG2 4.04Å; L868-V871 WeakPolarHBondContact O-CB 3.36Å; L868-V871 WeakPolarHBondContact O-CG2 3.16Å; L868-V871 PolarHBondContact O-N 2.83Å; L868-V871 VanDerWaalsContact O-N 3.14Å; L868-L874 HydrophobicContact CD1-CD1 3.83Å; L868-L874 HydrophobicContact CG-CD1 4.1Å; L868-A879 HydrophobicContact CB-CB 4.15Å; L868-A879 HydrophobicContact CD2-CB 4.06Å; L868-A879 HydrophobicContact CG-CB 3.79Å; L868-L882 HydrophobicContact CD2-CD2 4.34Å; L868-L883 HydrophobicContact CD2-CD1 3.81Å; L868-L883 HydrophobicContact CD2-CD2 3.8Å; L868-L883 HydrophobicContact CD2-CG 3.51Å
869	Q	95.5	Very high	93.5	Very high	46 Å²	46	21.4 Å²	21.4	22%	0.215	12%	0.116	C	C	.	.	G	3₁₀ helix	trans	-60.3	-20.4	175.6	71.3	-179.1	-62.1	0	0	113.8	R182 C813 S866 V867 G875 P876 A879	R182-Q869 PolarHBondContact NH1-O 3.22Å; C813-Q869 PolarHBondContact O-NE2 3.32Å; S866-Q869 WeakPolarHBondContact O-CG 3.36Å; S866-Q869 PolarHBondContact O-NE2 2.77Å; V867-Q869 PolarHBondContact O-N 2.85Å; Q869-G875 WeakPolarHBondContact O-CA 3.45Å; Q869-P876 HydrophobicContact CB-CB 4.22Å; Q869-A879 HydrophobicContact CB-CB 4.25Å
870	F	97.5	Very high	93.5	Very high	3 Å²	3	22.3 Å²	22.3	1%	0.013	13%	0.127	C	C	.	.	G	3₁₀ helix	trans	-93.6	-5	-178.4	-52.1	-54.5	0	0	0	113.4	A810 C813 T841 F844 I845 T848 N849 V867 L868	A810-F870 HydrophobicContact CB-CE2 3.96Å; C813-F870 HydrophobicContact CB-CE1 4.36Å; C813-F870 HydrophobicContact CB-CE2 4.47Å; C813-F870 HydrophobicContact CB-CZ 3.57Å; T841-F870 HydrophobicContact CG2-CD1 4.14Å; T841-F870 HydrophobicContact CG2-CE1 3.91Å; F844-F870 HydrophobicContact CB-CB 4.5Å; F844-F870 HydrophobicContact CB-CD1 3.84Å; F844-F870 HydrophobicContact CB-CD2 3.73Å; F844-F870 HydrophobicContact CB-CE1 3.97Å; F844-F870 HydrophobicContact CB-CE2 3.86Å; F844-F870 HydrophobicContact CB-CG 3.75Å; F844-F870 HydrophobicContact CB-CZ 3.99Å; F844-F870 HydrophobicContact CD1-CD2 4.33Å; F844-F870 AromaticContact CD1-CE2 3.92Å; F844-F870 HydrophobicContact CD1-CE2 3.92Å; F844-F870 HydrophobicContact CD1-CZ 4.37Å; F844-F870 HydrophobicContact CG-CD2 4.35Å; F844-F870 HydrophobicContact CG-CE1 4.49Å; F844-F870 HydrophobicContact CG-CE2 4.03Å; F844-F870 HydrophobicContact CG-CZ 4.13Å; I845-F870 HydrophobicContact CG1-CB 4.1Å; I845-F870 HydrophobicContact CG1-CD1 4.14Å; T848-F870 HydrophobicContact CG2-CB 4.13Å; N849-F870 PolarHBondContact ND2-O 3.39Å; V867-F870 HydrophobicContact CB-CD2 4.25Å; V867-F870 HydrophobicContact CG1-CD2 4.42Å; V867-F870 WeakPolarHBondContact O-CB 3.38Å; V867-F870 WeakPolarHBondContact O-CD2 3.42Å; V867-F870 PolarHBondContact O-N 3.06Å; L868-F870 PolarHBondContact O-N 3.03Å; L868-F870 VanDerWaalsContact O-N 3.12Å
871	V	97.7	Very high	93.6	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	11%	0.112	C	C	.	.	S	Bend	trans	-64.8	139.7	176.6	176.4	0	0	0	0	109.7	R182 T848 V853 L868 L874 C913 F916	R182-V871 PolarHBondContact NH1-O 3.18Å; R182-V871 PolarHBondContact NH2-O 3.49Å; T848-V871 HydrophobicContact CG2-CG2 4.25Å; V853-V871 HydrophobicContact CB-CG2 3.97Å; V853-V871 HydrophobicContact CG2-CG2 3.53Å; L868-V871 HydrophobicContact CD1-CG2 4.04Å; L868-V871 WeakPolarHBondContact O-CB 3.36Å; L868-V871 WeakPolarHBondContact O-CG2 3.16Å; L868-V871 PolarHBondContact O-N 2.83Å; L868-V871 VanDerWaalsContact O-N 3.14Å; V871-L874 HydrophobicContact CB-CB 4.39Å; V871-L874 HydrophobicContact CB-CD1 3.98Å; V871-L874 HydrophobicContact CB-CG 4.24Å; V871-L874 HydrophobicContact CG1-CD1 4.17Å; V871-L874 HydrophobicContact CG1-CG 4.29Å; V871-L874 PolarHBondContact O-N 2.92Å; V871-L874 VanDerWaalsContact O-N 3.12Å; V871-C913 HydrophobicContact CG1-CB 3.98Å; V871-F916 HydrophobicContact CG1-CB 4.14Å
872	C	96.2	Very high	93.6	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	11%	0.108	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.2	139.5	175.3	-169	0	0	0	0	111.1	R182 P258 F259 N849 L874 N912 C913 F916	R182-C872 VanDerWaalsContact NH2-CA 3.28Å; P258-C872 HydrophobicContact CB-CB 4Å; P258-C872 HydrophobicContact CG-CB 4.34Å; F259-C872 PolarHBondContact N-SG 3.33Å; N849-C872 WeakPolarHBondContact OD1-CB 3.44Å; N849-C872 PolarHBondContact OD1-N 3.12Å; C872-L874 PolarHBondContact O-N 3.44Å; C872-L874 VanDerWaalsContact O-N 3.09Å; C872-N912 VanDerWaalsContact CB-O 3.24Å; C872-N912 WeakPolarHBondContact CB-O 3.2Å; C872-N912 PolarHBondContact SG-O 2.89Å; C872-C913 VanDerWaalsContact O-CA 3.27Å; C872-C913 WeakPolarHBondContact O-CA 3.3Å; C872-C913 WeakPolarHBondContact O-CB 3.47Å; C872-F916 HydrophobicContact CB-CD2 3.4Å; C872-F916 VanDerWaalsContact CB-CD2 3.4Å; C872-F916 HydrophobicContact CB-CE2 3.34Å; C872-F916 HydrophobicContact CB-CG 4.37Å; C872-F916 HydrophobicContact CB-CZ 4.29Å
873	G	93	Very high	93.5	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	9%	0.087	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.4	-32.5	-173.5	0	0	0	0	0	114.6	P180 E181 E256	P180-G873 WeakPolarHBondContact CA-O 3.36Å; E181-G873 PolarHBondContact N-O 2.73Å; E256-G873 WeakPolarHBondContact OE1-CA 3.16Å; E256-G873 PolarHBondContact OE1-N 2.81Å
874	L	94.8	Very high	93.4	Very high	2 Å²	2	20.2 Å²	20.2	1%	0.01	11%	0.108	C	C	.	.			trans	-88.4	173.3	179.7	-53.2	-171.6	0	0	0	111.9	R182 L868 V871 C872 K878 L882 V909 C913	R182-L874 PolarHBondContact NH1-O 3.17Å; R182-L874 PolarHBondContact NH2-O 2.65Å; L868-L874 HydrophobicContact CD1-CD1 3.83Å; L868-L874 HydrophobicContact CG-CD1 4.1Å; V871-L874 HydrophobicContact CB-CB 4.39Å; V871-L874 HydrophobicContact CB-CD1 3.98Å; V871-L874 HydrophobicContact CB-CG 4.24Å; V871-L874 HydrophobicContact CG1-CD1 4.17Å; V871-L874 HydrophobicContact CG1-CG 4.29Å; V871-L874 PolarHBondContact O-N 2.92Å; V871-L874 VanDerWaalsContact O-N 3.12Å; C872-L874 PolarHBondContact O-N 3.44Å; C872-L874 VanDerWaalsContact O-N 3.09Å; L874-K878 HydrophobicContact CD2-CB 4.28Å; L874-L882 HydrophobicContact CD1-CD2 3.97Å; L874-V909 HydrophobicContact CD2-CG1 3.83Å; L874-C913 HydrophobicContact CG-CB 4.39Å
875	G	92.9	Very high	93.2	Very high	1 Å²	1	20.8 Å²	20.8	1%	0.01	11%	0.111	C	C	.	.			trans	-155	-173.1	165.5	0	0	0	0	0	108.2	E181 Q869 R877 K878 A879	E181-G875 VanDerWaalsContact CD-CA 3.4Å; E181-G875 WeakPolarHBondContact OE2-CA 3.37Å; E181-G875 PolarHBondContact OE2-N 3.09Å; Q869-G875 WeakPolarHBondContact O-CA 3.45Å; G875-R877 VanDerWaalsContact C-N 3.26Å; G875-R877 PolarHBondContact O-N 2.8Å; G875-K878 PolarHBondContact O-N 3.29Å; G875-A879 WeakPolarHBondContact O-CB 3.47Å; G875-A879 PolarHBondContact O-N 3.24Å
876	P	93.3	Very high	92.8	Very high	47 Å²	47	20.3 Å²	20.3	31%	0.305	11%	0.106	S	C	.	.	H	α-helix	trans	-59.6	-35	-175.9	25.3	-35.7	0	0	0	113.2	F166 E181 Q869 A880	F166-P876 HydrophobicContact CE2-CB 3.75Å; F166-P876 HydrophobicContact CZ-CB 3.59Å; F166-P876 HydrophobicContact CZ-CG 4.13Å; E181-P876 WeakPolarHBondContact OE1-CD 2.89Å; E181-P876 WeakPolarHBondContact OE1-CG 3.46Å; Q869-P876 HydrophobicContact CB-CB 4.22Å; P876-A880 VanDerWaalsContact O-CB 3.32Å; P876-A880 WeakPolarHBondContact O-CB 3.03Å; P876-A880 PolarHBondContact O-N 3.18Å; P876-A880 VanDerWaalsContact O-N 3.14Å
877	R	92.5	Very high	92.5	Very high	28 Å²	28	25.4 Å²	25.4	11%	0.106	12%	0.122	C	C	.	.	H	α-helix	trans	-75.4	-49.1	-179.3	-56.4	172.7	-173.5	-72	21.5	111.4	F166 D171 Q175 E181 G875 A879 A880 Y881	F166-R877 HydrophobicContact CB-CG 4.25Å; F166-R877 HydrophobicContact CD1-CG 3.96Å; F166-R877 HydrophobicContact CD2-CG 4.48Å; F166-R877 HydrophobicContact CE1-CG 4.27Å; F166-R877 HydrophobicContact CG-CG 4Å; D171-R877 VanDerWaalsContact CG-CZ 3.44Å; D171-R877 IonicContact OD1-CZ 3.26Å; D171-R877 IonicContact OD1-NE 3.32Å; D171-R877 IonicContact OD1-NH1 3.53Å; D171-R877 PolarHBondContact OD1-NH1 3.14Å; D171-R877 IonicContact OD1-NH2 3.37Å; D171-R877 PolarHBondContact OD1-NH2 3.31Å; D171-R877 IonicContact OD2-NH1 2.67Å; D171-R877 PolarHBondContact OD2-NH1 2.71Å; D171-R877 VanDerWaalsContact OD2-NH1 3.17Å; Q175-R877 HydrophobicContact CG-CB 4.01Å; E181-R877 VanDerWaalsContact OE1-CB 3.31Å; E181-R877 WeakPolarHBondContact OE1-CB 3.38Å; E181-R877 WeakPolarHBondContact OE1-CG 3.44Å; E181-R877 PolarHBondContact OE1-N 3.21Å; E181-R877 PolarHBondContact OE2-N 2.56Å; E181-R877 VanDerWaalsContact OE2-N 3.16Å; G875-R877 VanDerWaalsContact C-N 3.26Å; G875-R877 PolarHBondContact O-N 2.8Å; R877-A879 VanDerWaalsContact C-N 3.35Å; R877-A880 PolarHBondContact O-N 3.07Å; R877-Y881 WeakPolarHBondContact O-CB 3.2Å; R877-Y881 PolarHBondContact O-N 3.27Å
878	K	93.4	Very high	91.9	Very high	13 Å²	13	31 Å²	31	6%	0.057	15%	0.147	C	C	.	.	H	α-helix	trans	-66	-36.2	178.2	-72.5	-173.8	-179.3	-69.4	0	112	V174 Q175 E177 R179 E181 L874 G875 Y881 L882 V909	V174-K878 WeakPolarHBondContact O-CE 3.39Å; V174-K878 PolarHBondContact O-NZ 2.87Å; Q175-K878 PolarHBondContact O-NZ 2.74Å; E177-K878 PolarHBondContact O-NZ 3.03Å; R179-K878 WeakPolarHBondContact O-CE 3.36Å; E181-K878 HydrophobicContact CB-CD 3.97Å; E181-K878 HydrophobicContact CB-CG 4.26Å; E181-K878 WeakPolarHBondContact OE2-CB 3.16Å; E181-K878 PolarHBondContact OE2-N 3.21Å; L874-K878 HydrophobicContact CD2-CB 4.28Å; G875-K878 PolarHBondContact O-N 3.29Å; K878-Y881 PolarHBondContact O-N 3.09Å; K878-L882 VanDerWaalsContact O-CB 3.31Å; K878-L882 WeakPolarHBondContact O-CB 3.26Å; K878-L882 PolarHBondContact O-N 2.82Å; K878-V909 HydrophobicContact CD-CG1 4.45Å; K878-V909 HydrophobicContact CD-CG2 4.42Å
879	A	93.5	Very high	90.8	Very high	4 Å²	4	35.6 Å²	35.6	3%	0.033	17%	0.168	C	C	.	.	H	α-helix	trans	-66.2	-44.1	175.1	0	0	0	0	0	112	L868 Q869 G875 R877 Y881 L882 L883	L868-A879 HydrophobicContact CB-CB 4.15Å; L868-A879 HydrophobicContact CD2-CB 4.06Å; L868-A879 HydrophobicContact CG-CB 3.79Å; Q869-A879 HydrophobicContact CB-CB 4.25Å; G875-A879 WeakPolarHBondContact O-CB 3.47Å; G875-A879 PolarHBondContact O-N 3.24Å; R877-A879 VanDerWaalsContact C-N 3.35Å; A879-Y881 VanDerWaalsContact C-N 3.35Å; A879-L882 PolarHBondContact O-N 3.06Å; A879-L883 WeakPolarHBondContact O-CG 3.38Å; A879-L883 PolarHBondContact O-N 2.6Å
880	A	91	Very high	89.4	Confident	43 Å²	43	36.4 Å²	36.4	36%	0.355	17%	0.171	S	C	.	.	H	α-helix	trans	-62.3	-42.6	175.4	0	0	0	0	0	111.8	F166 P876 R877 L883 K884	F166-A880 HydrophobicContact CD2-CB 4.34Å; P876-A880 VanDerWaalsContact O-CB 3.32Å; P876-A880 WeakPolarHBondContact O-CB 3.03Å; P876-A880 PolarHBondContact O-N 3.18Å; P876-A880 VanDerWaalsContact O-N 3.14Å; R877-A880 PolarHBondContact O-N 3.07Å; A880-L883 PolarHBondContact O-N 3.39Å; A880-K884 PolarHBondContact O-N 3.05Å
881	Y	90	Very high	88.2	Confident	52 Å²	52	39 Å²	39	20%	0.204	20%	0.198	C	C	.	.	H	α-helix	trans	-61.6	-48.5	174.6	-179.5	-104.7	0	0	0	111.9	Q175 R877 K878 A879 L883 K884 M885	Q175-Y881 HydrophobicContact CB-CG 4.26Å; Q175-Y881 HydrophobicContact CG-CG 4.39Å; R877-Y881 WeakPolarHBondContact O-CB 3.2Å; R877-Y881 PolarHBondContact O-N 3.27Å; K878-Y881 PolarHBondContact O-N 3.09Å; A879-Y881 VanDerWaalsContact C-N 3.35Å; Y881-L883 VanDerWaalsContact C-N 3.34Å; Y881-L883 PolarHBondContact O-N 2.83Å; Y881-K884 WeakPolarHBondContact O-CB 3.46Å; Y881-K884 PolarHBondContact O-N 3.13Å; Y881-K884 VanDerWaalsContact O-N 3.09Å; Y881-M885 HydrophobicContact CD1-CG 4.12Å; Y881-M885 HydrophobicContact CD2-CG 4.38Å; Y881-M885 HydrophobicContact CE1-CG 3.71Å; Y881-M885 HydrophobicContact CE1-SD 4.42Å; Y881-M885 HydrophobicContact CE2-CG 3.98Å; Y881-M885 HydrophobicContact CE2-SD 3.83Å; Y881-M885 HydrophobicContact CG-CG 4.44Å; Y881-M885 WeakPolarHBondContact O-CG 3.39Å; Y881-M885 PolarHBondContact O-N 2.58Å
882	L	90.5	Very high	87.3	Confident	7 Å²	7	41.1 Å²	41.1	4%	0.037	21%	0.208	C	C	.	.	H	α-helix	trans	-56.1	-46.5	177.3	178.6	59.8	0	0	0	111.7	L855 L868 L874 K878 A879 K884 M885 L886 L899 C903 M905	L855-L882 HydrophobicContact CD2-CD2 4.29Å; L868-L882 HydrophobicContact CD2-CD2 4.34Å; L874-L882 HydrophobicContact CD1-CD2 3.97Å; K878-L882 VanDerWaalsContact O-CB 3.31Å; K878-L882 WeakPolarHBondContact O-CB 3.26Å; K878-L882 PolarHBondContact O-N 2.82Å; A879-L882 PolarHBondContact O-N 3.06Å; L882-K884 VanDerWaalsContact C-N 3.33Å; L882-K884 PolarHBondContact O-N 2.83Å; L882-M885 PolarHBondContact O-N 3.45Å; L882-L886 HydrophobicContact CD1-CD1 3.98Å; L882-L886 HydrophobicContact CD1-CG 4.23Å; L882-L886 HydrophobicContact CG-CD1 3.91Å; L882-L886 WeakPolarHBondContact O-CB 3.27Å; L882-L886 VanDerWaalsContact O-CG 3.24Å; L882-L886 WeakPolarHBondContact O-CG 3.39Å; L882-L886 PolarHBondContact O-N 3.28Å; L882-L899 HydrophobicContact CD1-CD2 4.5Å; L882-C903 HydrophobicContact CD1-CB 3.86Å; L882-M905 HydrophobicContact CD1-CE 3.78Å; L882-M905 HydrophobicContact CD2-CE 3.8Å; L882-M905 HydrophobicContact CG-CE 4.39Å
883	L	90	Very high	86.7	Confident	18 Å²	18	41.1 Å²	41.1	9%	0.094	21%	0.209	C	C	.	.	H	α-helix	trans	-63.4	-37.8	176.9	-71.8	165.4	0	0	0	112.7	C858 A865 L868 A879 A880 Y881 R887	C858-L883 HydrophobicContact CB-CD2 4.05Å; A865-L883 HydrophobicContact CB-CD1 3.78Å; A865-L883 HydrophobicContact CB-CD2 4.2Å; L868-L883 HydrophobicContact CD2-CD1 3.81Å; L868-L883 HydrophobicContact CD2-CD2 3.8Å; L868-L883 HydrophobicContact CD2-CG 3.51Å; A879-L883 WeakPolarHBondContact O-CG 3.38Å; A879-L883 PolarHBondContact O-N 2.6Å; A880-L883 PolarHBondContact O-N 3.39Å; Y881-L883 VanDerWaalsContact C-N 3.34Å; Y881-L883 PolarHBondContact O-N 2.83Å; L883-R887 WeakPolarHBondContact O-CB 3.5Å; L883-R887 WeakPolarHBondContact O-CD 3.36Å; L883-R887 VanDerWaalsContact O-CG 3.24Å; L883-R887 WeakPolarHBondContact O-CG 3.41Å; L883-R887 PolarHBondContact O-N 3.37Å
884	K	88.3	Confident	86	Confident	113 Å²	113	43.8 Å²	43.8	49%	0.491	22%	0.221	S	C	.	.	H	α-helix	trans	-62.5	-49.6	175.4	-176.9	-172.4	172.5	-168.5	0	110.5	A880 Y881 L882 L886 R887 Q888	A880-K884 PolarHBondContact O-N 3.05Å; Y881-K884 WeakPolarHBondContact O-CB 3.46Å; Y881-K884 PolarHBondContact O-N 3.13Å; Y881-K884 VanDerWaalsContact O-N 3.09Å; L882-K884 VanDerWaalsContact C-N 3.33Å; L882-K884 PolarHBondContact O-N 2.83Å; K884-L886 VanDerWaalsContact C-N 3.34Å; K884-L886 PolarHBondContact O-N 2.88Å; K884-R887 PolarHBondContact O-N 2.87Å; K884-Q888 WeakPolarHBondContact O-CG 3.48Å; K884-Q888 PolarHBondContact O-N 3.26Å
885	M	87.2	Confident	85.5	Confident	17 Å²	17	44.3 Å²	44.3	8%	0.084	23%	0.225	C	C	.	.	H	α-helix	trans	-61.1	-43	-179.8	-65.8	-50	-65.1	0	0	112.1	Y881 L882 Q888 K889	Y881-M885 HydrophobicContact CD1-CG 4.12Å; Y881-M885 HydrophobicContact CD2-CG 4.38Å; Y881-M885 HydrophobicContact CE1-CG 3.71Å; Y881-M885 HydrophobicContact CE1-SD 4.42Å; Y881-M885 HydrophobicContact CE2-CG 3.98Å; Y881-M885 HydrophobicContact CE2-SD 3.83Å; Y881-M885 HydrophobicContact CG-CG 4.44Å; Y881-M885 WeakPolarHBondContact O-CG 3.39Å; Y881-M885 PolarHBondContact O-N 2.58Å; L882-M885 PolarHBondContact O-N 3.45Å; M885-Q888 PolarHBondContact O-N 3.13Å; M885-K889 HydrophobicContact CE-CD 3.84Å; M885-K889 HydrophobicContact CE-CG 4.4Å; M885-K889 PolarHBondContact O-N 2.94Å
886	L	86.3	Confident	85.1	Confident	1 Å²	1	44.5 Å²	44.5	1%	0.005	23%	0.225	C	C	.	.	H	α-helix	trans	-61.4	-47.2	175.9	-71.7	169.1	0	0	0	111.5	L855 I859 L882 K884 Q888 E890 I893 C903	L855-L886 HydrophobicContact CD1-CD1 4.5Å; I859-L886 HydrophobicContact CD1-CB 3.84Å; I859-L886 HydrophobicContact CD1-CD1 4.17Å; I859-L886 HydrophobicContact CD1-CD2 4.42Å; I859-L886 HydrophobicContact CD1-CG 4.37Å; I859-L886 HydrophobicContact CG1-CB 4.17Å; I859-L886 HydrophobicContact CG1-CD1 4.48Å; L882-L886 HydrophobicContact CD1-CD1 3.98Å; L882-L886 HydrophobicContact CD1-CG 4.23Å; L882-L886 HydrophobicContact CG-CD1 3.91Å; L882-L886 WeakPolarHBondContact O-CB 3.27Å; L882-L886 VanDerWaalsContact O-CG 3.24Å; L882-L886 WeakPolarHBondContact O-CG 3.39Å; L882-L886 PolarHBondContact O-N 3.28Å; K884-L886 VanDerWaalsContact C-N 3.34Å; K884-L886 PolarHBondContact O-N 2.88Å; L886-Q888 PolarHBondContact O-N 3.33Å; L886-E890 CarbonylContact C-O 3.55Å; L886-E890 CarbonylContact O-C 3.58Å; L886-E890 PolarHBondContact O-N 3.25Å; L886-I893 HydrophobicContact CD1-CD1 3.84Å; L886-I893 HydrophobicContact CD2-CD1 3.3Å; L886-I893 HydrophobicContact CD2-CG1 3.4Å; L886-I893 HydrophobicContact CG-CD1 4.21Å; L886-C903 WeakPolarHBondContact CD2-SG 3.29Å
887	R	86.2	Confident	84.6	Confident	132 Å²	132	45.4 Å²	45.4	50%	0.498	23%	0.23	S	C	.	.	H	α-helix	trans	-64.1	-27	178.2	-71.6	169.3	-179.8	166.3	2.1	113.8	L883 K884	L883-R887 WeakPolarHBondContact O-CB 3.5Å; L883-R887 WeakPolarHBondContact O-CD 3.36Å; L883-R887 VanDerWaalsContact O-CG 3.24Å; L883-R887 WeakPolarHBondContact O-CG 3.41Å; L883-R887 PolarHBondContact O-N 3.37Å; K884-R887 PolarHBondContact O-N 2.87Å
888	Q	84.5	Confident	84.3	Confident	123 Å²	123	45.5 Å²	45.5	58%	0.575	23%	0.232	S	C	*	.	H	α-helix	trans	-85.1	-47.8	-179.5	-73.2	177.9	-39.7	0	0	113.3	K884 M885 L886	K884-Q888 WeakPolarHBondContact O-CG 3.48Å; K884-Q888 PolarHBondContact O-N 3.26Å; M885-Q888 PolarHBondContact O-N 3.13Å; L886-Q888 PolarHBondContact O-N 3.33Å
889	K	72.9	Confident	84	Confident	98 Å²	98	44.9 Å²	44.9	43%	0.426	23%	0.229	S	C	.	.	H	α-helix	trans	-91.9	-50.8	-168.6	-68	-173.2	170.3	-176.2	0	113.7	M885 V902	M885-K889 HydrophobicContact CE-CD 3.84Å; M885-K889 HydrophobicContact CE-CG 4.4Å; M885-K889 PolarHBondContact O-N 2.94Å; K889-V902 HydrophobicContact CB-CG1 3.83Å; K889-V902 HydrophobicContact CD-CG1 4.09Å; K889-V902 VanDerWaalsContact CD-O 3.26Å; K889-V902 WeakPolarHBondContact CD-O 3.38Å; K889-V902 PolarHBondContact NZ-O 3.23Å
890	E	66	Low	83.6	Confident	62 Å²	62	45.6 Å²	45.6	29%	0.29	23%	0.233	S	C	.	.			trans	-142	111.8	-176.4	-77.6	-174.9	161.7	0	0	109.3	L886 H892 Q898 V902	L886-E890 CarbonylContact C-O 3.55Å; L886-E890 CarbonylContact O-C 3.58Å; L886-E890 PolarHBondContact O-N 3.25Å; E890-H892 PolarHBondContact O-N 3.08Å; E890-Q898 PolarHBondContact OE1-NE2 3.32Å; E890-Q898 PolarHBondContact OE2-NE2 3.18Å; E890-V902 HydrophobicContact CB-CG1 4.32Å; E890-V902 HydrophobicContact CG-CG1 3.9Å; E890-V902 WeakPolarHBondContact OE2-CG2 3.45Å
891	G	71.2	Confident	83.2	Confident	57 Å²	57	48 Å²	48	59%	0.588	24%	0.243	S	C	*	.	S	Bend	trans	-64.2	0.8	177.4	0	0	0	0	0	115.1
892	H	80.1	Confident	82.7	Confident	45 Å²	45	46.7 Å²	46.7	21%	0.208	24%	0.241	C	C	.	.	S	Bend	trans	-158.6	138.2	-178.9	-173.3	-89	0	0	0	111.5	N856 E890	N856-H892 VanDerWaalsContact CG-CD2 3.44Å; N856-H892 PolarHBondContact ND2-CE1 2.89Å; N856-H892 PolarHBondContact ND2-NE2 3.07Å; E890-H892 PolarHBondContact O-N 3.08Å
893	I	83.1	Confident	82.4	Confident	1 Å²	1	46.6 Å²	46.6	1%	0.005	24%	0.241	C	C	.	.			trans	-103	127.4	176.1	-51.5	176.1	0	0	0	109.4	L855 N856 L886 S895 Q898 L899 I919	L855-I893 HydrophobicContact CB-CD1 3.86Å; L855-I893 HydrophobicContact CD1-CD1 3.46Å; L855-I893 VanDerWaalsContact CD1-CD1 3.46Å; L855-I893 HydrophobicContact CG-CD1 4.31Å; N856-I893 PolarHBondContact ND2-O 3.41Å; N856-I893 PolarHBondContact OD1-N 3.05Å; L886-I893 HydrophobicContact CD1-CD1 3.84Å; L886-I893 HydrophobicContact CD2-CD1 3.3Å; L886-I893 HydrophobicContact CD2-CG1 3.4Å; L886-I893 HydrophobicContact CG-CD1 4.21Å; I893-S895 WeakPolarHBondContact CG2-O 3.48Å; I893-Q898 HydrophobicContact CG2-CB 4.18Å; I893-L899 HydrophobicContact CD1-CD2 3.86Å; I893-I919 HydrophobicContact CG2-CD1 4Å
894	E	79.3	Confident	82	Confident	56 Å²	56	47.8 Å²	47.8	26%	0.262	25%	0.245	S	C	.	.			trans	-102.5	-27.5	179	-59.5	-174.9	169.1	0	0	113	N924	E894-N924 PolarHBondContact O-ND2 3.02Å
895	S	82.6	Confident	81.9	Confident	13 Å²	13	43.4 Å²	43.4	9%	0.091	23%	0.226	C	C	.	.			trans	-143	152	-179.9	176.5	0	0	0	0	113.2	I893 T897 Q898 D935	I893-S895 WeakPolarHBondContact CG2-O 3.48Å; S895-T897 PolarHBondContact O-N 2.86Å; S895-T897 PolarHBondContact OG-N 2.94Å; S895-T897 PolarHBondContact OG-OG1 2.81Å; S895-Q898 WeakPolarHBondContact O-CB 3.37Å; S895-Q898 PolarHBondContact O-N 2.92Å; S895-D935 VanDerWaalsContact CA-OD2 3.29Å; S895-D935 WeakPolarHBondContact CA-OD2 3.23Å; S895-D935 WeakPolarHBondContact CB-OD2 3.41Å; S895-D935 PolarHBondContact OG-OD2 3.02Å
896	R	86.4	Confident	81.9	Confident	4 Å²	4	43.5 Å²	43.5	2%	0.015	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-28.5	172.9	-72.8	-176.1	169.1	140.3	1.5	112.5	Q898 L899 F910 S914 I917 I919 D935 S937 V939 Y944	R896-Q898 PolarHBondContact O-N 2.68Å; R896-L899 VanDerWaalsContact O-CB 3.29Å; R896-L899 WeakPolarHBondContact O-CB 3.1Å; R896-L899 PolarHBondContact O-N 3.22Å; R896-L899 VanDerWaalsContact O-N 3.08Å; R896-F910 HydrophobicContact CB-CE2 4.36Å; R896-F910 HydrophobicContact CB-CZ 4.41Å; R896-F910 WeakPolarHBondContact O-CE2 3.31Å; R896-S914 VanDerWaalsContact CZ-O 3.29Å; R896-S914 PolarHBondContact NE-O 3.03Å; R896-S914 PolarHBondContact NH2-O 2.84Å; R896-I917 PolarHBondContact NH2-O 3.06Å; R896-I919 HydrophobicContact CB-CD1 4.43Å; R896-I919 HydrophobicContact CG-CD1 3.7Å; R896-D935 HydrophobicContact CG-CB 4.38Å; R896-D935 PolarHBondContact N-OD2 3.37Å; R896-S937 PolarHBondContact NH1-O 2.95Å; R896-S937 PolarHBondContact NH2-O 3.01Å; R896-V939 PolarHBondContact NH1-O 3.13Å; R896-Y944 PolarHBondContact NH1-OH 2.93Å
897	T	82.1	Confident	82	Confident	67 Å²	67	44 Å²	44	41%	0.411	23%	0.233	S	C	.	.	H	α-helix	trans	-59.8	-32.8	176.3	-52.7	0	0	0	0	112.1	F98 S895 L899 V900 T901	F98-T897 HydrophobicContact CE1-CG2 4.3Å; S895-T897 PolarHBondContact O-N 2.86Å; S895-T897 PolarHBondContact OG-N 2.94Å; S895-T897 PolarHBondContact OG-OG1 2.81Å; T897-L899 PolarHBondContact O-N 2.76Å; T897-V900 PolarHBondContact O-N 3.49Å; T897-T901 HydrophobicContact CG2-CG2 4.04Å; T897-T901 PolarHBondContact O-N 3.03Å; T897-T901 PolarHBondContact O-OG1 3.22Å
898	Q	85.9	Confident	82.2	Confident	30 Å²	30	39.8 Å²	39.8	14%	0.14	22%	0.219	C	C	.	.	H	α-helix	trans	-67	-22.9	177	-72.1	168.7	-57.5	0	0	113.4	E890 I893 S895 R896 V900 T901 V902 C903	E890-Q898 PolarHBondContact OE1-NE2 3.32Å; E890-Q898 PolarHBondContact OE2-NE2 3.18Å; I893-Q898 HydrophobicContact CG2-CB 4.18Å; S895-Q898 WeakPolarHBondContact O-CB 3.37Å; S895-Q898 PolarHBondContact O-N 2.92Å; R896-Q898 PolarHBondContact O-N 2.68Å; Q898-V900 PolarHBondContact O-N 3.44Å; Q898-T901 WeakPolarHBondContact CA-OG1 3.37Å; Q898-V902 HydrophobicContact CB-CB 4.36Å; Q898-V902 HydrophobicContact CB-CG2 3.99Å; Q898-V902 HydrophobicContact CG-CG2 4Å; Q898-V902 WeakPolarHBondContact O-CA 3.48Å; Q898-V902 VanDerWaalsContact O-CB 3.27Å; Q898-V902 WeakPolarHBondContact O-CB 3.08Å; Q898-V902 PolarHBondContact O-N 3.17Å; Q898-C903 PolarHBondContact O-N 3.1Å; Q898-C903 VanDerWaalsContact O-N 3.08Å
899	L	86.1	Confident	82.5	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-61.1	-39.5	171.3	-62.8	172.5	0	0	0	110.4	L855 L882 I893 R896 T897 C903 M905 F910 I917	L855-L899 HydrophobicContact CD1-CD2 3.68Å; L882-L899 HydrophobicContact CD1-CD2 4.5Å; I893-L899 HydrophobicContact CD1-CD2 3.86Å; R896-L899 VanDerWaalsContact O-CB 3.29Å; R896-L899 WeakPolarHBondContact O-CB 3.1Å; R896-L899 PolarHBondContact O-N 3.22Å; R896-L899 VanDerWaalsContact O-N 3.08Å; T897-L899 PolarHBondContact O-N 2.76Å; L899-C903 CarbonylContact O-C 3.45Å; L899-C903 VanDerWaalsContact O-CB 3.27Å; L899-C903 WeakPolarHBondContact O-CB 3.36Å; L899-M905 HydrophobicContact CB-CE 4.43Å; L899-M905 HydrophobicContact CB-SD 4.38Å; L899-M905 HydrophobicContact CD2-CE 4.31Å; L899-M905 WeakPolarHBondContact O-CB 3.48Å; L899-M905 PolarHBondContact O-N 3.48Å; L899-F910 HydrophobicContact CB-CD2 4.12Å; L899-F910 HydrophobicContact CB-CE2 4.23Å; L899-F910 HydrophobicContact CD1-CD2 4.42Å; L899-F910 HydrophobicContact CD1-CE2 4.2Å; L899-I917 HydrophobicContact CD1-CD1 3.7Å; L899-I917 HydrophobicContact CD1-CG2 4.37Å
900	V	85	Confident	83.5	Confident	19 Å²	19	29.6 Å²	29.6	12%	0.115	17%	0.173	C	C	.	.	H	α-helix	trans	-79.7	-49.6	178.3	179	0	0	0	0	110.9	F98 F102 T897 Q898 K904 F910	F98-V900 HydrophobicContact CE1-CB 4.31Å; F98-V900 HydrophobicContact CE1-CG2 4.02Å; F98-V900 HydrophobicContact CE2-CG2 3.78Å; F98-V900 HydrophobicContact CZ-CB 4.16Å; F98-V900 HydrophobicContact CZ-CG2 3.39Å; F102-V900 HydrophobicContact CE1-CG1 3.61Å; F102-V900 HydrophobicContact CZ-CG1 4.08Å; T897-V900 PolarHBondContact O-N 3.49Å; Q898-V900 PolarHBondContact O-N 3.44Å; V900-K904 VanDerWaalsContact O-CA 3.29Å; V900-K904 WeakPolarHBondContact O-CA 3.48Å; V900-K904 PolarHBondContact O-N 3.29Å; V900-F910 HydrophobicContact CG2-CB 4.18Å; V900-F910 HydrophobicContact CG2-CD1 4.28Å; V900-F910 HydrophobicContact CG2-CD2 3.44Å; V900-F910 VanDerWaalsContact CG2-CD2 3.44Å; V900-F910 HydrophobicContact CG2-CE2 3.86Å; V900-F910 HydrophobicContact CG2-CG 3.68Å; V900-F910 HydrophobicContact CG2-CZ 4.46Å
901	T	82.9	Confident	84.8	Confident	93 Å²	93	26.7 Å²	26.7	57%	0.571	16%	0.159	S	C	*	.	H	α-helix	trans	-77.3	-43.1	-172.3	58.7	0	0	0	0	113.4	T897 Q898	T897-T901 HydrophobicContact CG2-CG2 4.04Å; T897-T901 PolarHBondContact O-N 3.03Å; T897-T901 PolarHBondContact O-OG1 3.22Å; Q898-T901 WeakPolarHBondContact CA-OG1 3.37Å
902	V	80.4	Confident	85.9	Confident	25 Å²	25	24 Å²	24	15%	0.152	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.5	-48.6	-174.3	-179.4	0	0	0	0	111.1	K889 E890 Q898 K904	K889-V902 HydrophobicContact CB-CG1 3.83Å; K889-V902 HydrophobicContact CD-CG1 4.09Å; K889-V902 VanDerWaalsContact CD-O 3.26Å; K889-V902 WeakPolarHBondContact CD-O 3.38Å; K889-V902 PolarHBondContact NZ-O 3.23Å; E890-V902 HydrophobicContact CB-CG1 4.32Å; E890-V902 HydrophobicContact CG-CG1 3.9Å; E890-V902 WeakPolarHBondContact OE2-CG2 3.45Å; Q898-V902 HydrophobicContact CB-CB 4.36Å; Q898-V902 HydrophobicContact CB-CG2 3.99Å; Q898-V902 HydrophobicContact CG-CG2 4Å; Q898-V902 WeakPolarHBondContact O-CA 3.48Å; Q898-V902 VanDerWaalsContact O-CB 3.27Å; Q898-V902 WeakPolarHBondContact O-CB 3.08Å; Q898-V902 PolarHBondContact O-N 3.17Å; V902-K904 PolarHBondContact O-N 3.05Å
903	C	83.6	Confident	86.6	Confident	5 Å²	5	21.8 Å²	21.8	3%	0.034	12%	0.121	C	C	.	.	S	Bend	trans	-80.9	0.3	-179	-53.4	0	0	0	0	113	L882 L886 Q898 L899 M905	L882-C903 HydrophobicContact CD1-CB 3.86Å; L886-C903 WeakPolarHBondContact CD2-SG 3.29Å; Q898-C903 PolarHBondContact O-N 3.1Å; Q898-C903 VanDerWaalsContact O-N 3.08Å; L899-C903 CarbonylContact O-C 3.45Å; L899-C903 VanDerWaalsContact O-CB 3.27Å; L899-C903 WeakPolarHBondContact O-CB 3.36Å; C903-M905 PolarHBondContact O-N 3Å; C903-M905 VanDerWaalsContact O-N 3.12Å
904	K	82	Confident	87	Confident	43 Å²	43	21.8 Å²	21.8	19%	0.187	12%	0.121	C	C	.	.			trans	48.7	36.3	-175.6	-64.3	-173.8	174.6	-175.2	0	111.6	V107 D111 V900 V902 A906	V107-K904 HydrophobicContact CG1-CB 4.11Å; V107-K904 HydrophobicContact CG1-CD 4.23Å; V107-K904 HydrophobicContact CG1-CG 4.47Å; V107-K904 PolarHBondContact O-NZ 3.43Å; D111-K904 IonicContact OD1-NZ 3.67Å; D111-K904 PolarHBondContact OD1-NZ 2.91Å; D111-K904 IonicContact OD2-NZ 2.99Å; V900-K904 VanDerWaalsContact O-CA 3.29Å; V900-K904 WeakPolarHBondContact O-CA 3.48Å; V900-K904 PolarHBondContact O-N 3.29Å; V902-K904 PolarHBondContact O-N 3.05Å; K904-A906 PolarHBondContact O-N 3.32Å
905	M	85.7	Confident	87.5	Confident	20 Å²	20	19.1 Å²	19.1	10%	0.099	11%	0.109	C	C	.	.			trans	-70.5	126.5	-176.9	-172.8	175.1	-68.4	0	0	110.1	L882 L899 C903 V909 F910 C913	L882-M905 HydrophobicContact CD1-CE 3.78Å; L882-M905 HydrophobicContact CD2-CE 3.8Å; L882-M905 HydrophobicContact CG-CE 4.39Å; L899-M905 HydrophobicContact CB-CE 4.43Å; L899-M905 HydrophobicContact CB-SD 4.38Å; L899-M905 HydrophobicContact CD2-CE 4.31Å; L899-M905 WeakPolarHBondContact O-CB 3.48Å; L899-M905 PolarHBondContact O-N 3.48Å; C903-M905 PolarHBondContact O-N 3Å; C903-M905 VanDerWaalsContact O-N 3.12Å; M905-V909 HydrophobicContact CG-CB 4.33Å; M905-V909 HydrophobicContact CG-CG1 4.11Å; M905-V909 HydrophobicContact SD-CG1 4.23Å; M905-F910 HydrophobicContact CG-CB 4.19Å; M905-F910 HydrophobicContact SD-CB 4.14Å; M905-F910 HydrophobicContact SD-CD2 4.38Å; M905-C913 PolarHBondContact SD-SG 3.29Å
906	A	86.9	Confident	88.1	Confident	20 Å²	20	18.6 Å²	18.6	17%	0.165	11%	0.105	C	C	.	.			trans	-69.7	149.9	-175.7	0	0	0	0	0	112.8	D178 K904 K908 V909 F910	D178-A906 HydrophobicContact CB-CB 3.49Å; D178-A906 VanDerWaalsContact CB-CB 3.49Å; D178-A906 WeakPolarHBondContact OD1-CB 3.15Å; K904-A906 PolarHBondContact O-N 3.32Å; A906-K908 PolarHBondContact O-N 3.16Å; A906-V909 PolarHBondContact O-N 2.81Å; A906-F910 WeakPolarHBondContact O-CB 3.13Å; A906-F910 PolarHBondContact O-N 2.92Å
907	P	88.2	Confident	88.5	Confident	10 Å²	10	18.5 Å²	18.5	7%	0.065	10%	0.104	C	C	.	.	H	α-helix	trans	-55.4	-46.6	-167.9	-30.3	36.7	0	0	0	115.8	A94 F102 D178 F910 M911	A94-P907 HydrophobicContact CB-CB 3.64Å; F102-P907 HydrophobicContact CB-CG 4.23Å; F102-P907 HydrophobicContact CD1-CG 3.61Å; F102-P907 HydrophobicContact CD2-CG 4.13Å; F102-P907 HydrophobicContact CE1-CG 3.9Å; F102-P907 HydrophobicContact CE2-CG 4.4Å; F102-P907 HydrophobicContact CG-CG 3.72Å; F102-P907 HydrophobicContact CZ-CG 4.29Å; D178-P907 WeakPolarHBondContact OD2-CD 3.44Å; P907-F910 WeakPolarHBondContact O-CB 3.34Å; P907-F910 PolarHBondContact O-N 2.75Å; P907-M911 VanDerWaalsContact O-CG 3.3Å; P907-M911 WeakPolarHBondContact O-CG 3.5Å; P907-M911 PolarHBondContact O-N 3.16Å
908	K	90.4	Very high	88.9	Confident	45 Å²	45	16.8 Å²	16.8	20%	0.196	9%	0.091	C	C	.	.	H	α-helix	trans	-73	-35.1	-177.2	-60.7	-178.9	-168.8	159.9	0	111.8	A90 D178 E254 A906 F910 N912	A90-K908 HydrophobicContact CB-CG 4.06Å; D178-K908 WeakPolarHBondContact OD1-CB 3.49Å; D178-K908 PolarHBondContact OD1-N 3.48Å; D178-K908 WeakPolarHBondContact OD2-CG 3.32Å; D178-K908 PolarHBondContact OD2-N 2.83Å; E254-K908 HydrophobicContact CB-CD 4.38Å; E254-K908 WeakPolarHBondContact OE2-CD 3.13Å; E254-K908 WeakPolarHBondContact OE2-CE 3.29Å; E254-K908 IonicContact OE2-NZ 3.94Å; E254-K908 PolarHBondContact OE2-NZ 3.02Å; A906-K908 PolarHBondContact O-N 3.16Å; K908-F910 VanDerWaalsContact C-N 3.35Å; K908-N912 PolarHBondContact O-N 3.36Å; K908-N912 VanDerWaalsContact O-N 3.14Å; K908-N912 PolarHBondContact O-ND2 3.04Å
909	V	92.4	Very high	88.8	Confident	6 Å²	6	15.5 Å²	15.5	4%	0.036	9%	0.085	C	C	.	.	H	α-helix	trans	-63.3	-45.4	172.5	179.2	0	0	0	0	109.9	D178 L874 K878 M905 A906 N912 C913	D178-V909 PolarHBondContact OD1-N 3.39Å; L874-V909 HydrophobicContact CD2-CG1 3.83Å; K878-V909 HydrophobicContact CD-CG1 4.45Å; K878-V909 HydrophobicContact CD-CG2 4.42Å; M905-V909 HydrophobicContact CG-CB 4.33Å; M905-V909 HydrophobicContact CG-CG1 4.11Å; M905-V909 HydrophobicContact SD-CG1 4.23Å; A906-V909 PolarHBondContact O-N 2.81Å; V909-N912 PolarHBondContact O-N 2.97Å; V909-C913 PolarHBondContact O-N 3.2Å; V909-C913 VanDerWaalsContact O-N 3.1Å; V909-C913 PolarHBondContact O-SG 3.43Å
910	F	93.5	Very high	88	Confident	1 Å²	1	18.7 Å²	18.7	0%	0.004	10%	0.102	C	C	.	.	H	α-helix	trans	-58.3	-48.4	176.1	174.3	-91.2	0	0	0	112.1	L97 F98 R896 L899 V900 M905 A906 P907 K908 N912 C913 S914 P941	L97-F910 HydrophobicContact CD2-CE1 3.64Å; L97-F910 HydrophobicContact CD2-CZ 4.4Å; F98-F910 AromaticContact CE2-CD1 3.63Å; F98-F910 HydrophobicContact CE2-CD1 3.63Å; F98-F910 AromaticContact CE2-CE1 3.44Å; F98-F910 HydrophobicContact CE2-CE1 3.44Å; F98-F910 VanDerWaalsContact CE2-CE1 3.44Å; F98-F910 HydrophobicContact CE2-CG 4.36Å; F98-F910 HydrophobicContact CE2-CZ 4.01Å; F98-F910 AromaticContact CZ-CD1 3.9Å; F98-F910 HydrophobicContact CZ-CD1 3.9Å; F98-F910 HydrophobicContact CZ-CD2 4.46Å; F98-F910 AromaticContact CZ-CE1 3.4Å; F98-F910 HydrophobicContact CZ-CE1 3.4Å; F98-F910 AromaticContact CZ-CE2 3.99Å; F98-F910 HydrophobicContact CZ-CE2 3.99Å; F98-F910 HydrophobicContact CZ-CG 4.42Å; F98-F910 AromaticContact CZ-CZ 3.44Å; F98-F910 HydrophobicContact CZ-CZ 3.44Å; F98-F910 VanDerWaalsContact CZ-CZ 3.44Å; R896-F910 HydrophobicContact CB-CE2 4.36Å; R896-F910 HydrophobicContact CB-CZ 4.41Å; R896-F910 WeakPolarHBondContact O-CE2 3.31Å; L899-F910 HydrophobicContact CB-CD2 4.12Å; L899-F910 HydrophobicContact CB-CE2 4.23Å; L899-F910 HydrophobicContact CD1-CD2 4.42Å; L899-F910 HydrophobicContact CD1-CE2 4.2Å; V900-F910 HydrophobicContact CG2-CB 4.18Å; V900-F910 HydrophobicContact CG2-CD1 4.28Å; V900-F910 HydrophobicContact CG2-CD2 3.44Å; V900-F910 VanDerWaalsContact CG2-CD2 3.44Å; V900-F910 HydrophobicContact CG2-CE2 3.86Å; V900-F910 HydrophobicContact CG2-CG 3.68Å; V900-F910 HydrophobicContact CG2-CZ 4.46Å; M905-F910 HydrophobicContact CG-CB 4.19Å; M905-F910 HydrophobicContact SD-CB 4.14Å; M905-F910 HydrophobicContact SD-CD2 4.38Å; A906-F910 WeakPolarHBondContact O-CB 3.13Å; A906-F910 PolarHBondContact O-N 2.92Å; P907-F910 WeakPolarHBondContact O-CB 3.34Å; P907-F910 PolarHBondContact O-N 2.75Å; K908-F910 VanDerWaalsContact C-N 3.35Å; F910-N912 VanDerWaalsContact C-N 3.27Å; F910-N912 PolarHBondContact O-N 3.34Å; F910-C913 PolarHBondContact O-N 3.29Å; F910-C913 VanDerWaalsContact O-N 3.17Å; F910-S914 WeakPolarHBondContact O-CB 3.43Å; F910-S914 PolarHBondContact O-N 3.26Å; F910-S914 PolarHBondContact O-OG 2.95Å; F910-P941 HydrophobicContact CE1-CG 4.43Å; F910-P941 HydrophobicContact CZ-CG 4.17Å
911	M	92.5	Very high	86.7	Confident	0 Å²	0	19.2 Å²	19.2	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-57.6	-42.1	177.9	-73.4	-60.9	-67	0	0	111.6	E93 A94 L97 F255 F259 P907 C913 H940	E93-M911 HydrophobicContact CB-CE 3.65Å; E93-M911 WeakPolarHBondContact OE2-CE 3.39Å; A94-M911 HydrophobicContact CB-CG 3.97Å; A94-M911 HydrophobicContact CB-SD 4.28Å; L97-M911 HydrophobicContact CD2-SD 4.46Å; F255-M911 HydrophobicContact CE1-CB 4.41Å; F259-M911 WeakPolarHBondContact CD2-O 3.34Å; F259-M911 WeakPolarHBondContact CE2-O 3.15Å; P907-M911 VanDerWaalsContact O-CG 3.3Å; P907-M911 WeakPolarHBondContact O-CG 3.5Å; P907-M911 PolarHBondContact O-N 3.16Å; M911-C913 PolarHBondContact O-N 2.98Å; M911-H940 PolarHBondContact O-NE2 3.43Å
912	N	94.7	Very high	85.4	Confident	0 Å²	0	19.8 Å²	19.8	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-69.6	-32.2	179.4	-84.7	-82.6	0	0	0	113.7	E254 F255 E256 C872 K908 V909 F910 F916	E254-N912 PolarHBondContact O-ND2 2.92Å; F255-N912 WeakPolarHBondContact CA-OD1 3.4Å; E256-N912 PolarHBondContact N-OD1 3.26Å; C872-N912 VanDerWaalsContact CB-O 3.24Å; C872-N912 WeakPolarHBondContact CB-O 3.2Å; C872-N912 PolarHBondContact SG-O 2.89Å; K908-N912 PolarHBondContact O-N 3.36Å; K908-N912 VanDerWaalsContact O-N 3.14Å; K908-N912 PolarHBondContact O-ND2 3.04Å; V909-N912 PolarHBondContact O-N 2.97Å; F910-N912 VanDerWaalsContact C-N 3.27Å; F910-N912 PolarHBondContact O-N 3.34Å; N912-F916 VanDerWaalsContact O-CD2 3.28Å; N912-F916 WeakPolarHBondContact O-CD2 3.39Å; N912-F916 VanDerWaalsContact O-CE2 3.3Å; N912-F916 WeakPolarHBondContact O-CE2 3.39Å
913	C	94.3	Very high	84.1	Confident	0 Å²	0	24.9 Å²	24.9	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-102.3	-28.3	-169.1	75.3	0	0	0	0	114.7	V871 C872 L874 M905 V909 F910 M911 G915 F916 I917	V871-C913 HydrophobicContact CG1-CB 3.98Å; C872-C913 VanDerWaalsContact O-CA 3.27Å; C872-C913 WeakPolarHBondContact O-CA 3.3Å; C872-C913 WeakPolarHBondContact O-CB 3.47Å; L874-C913 HydrophobicContact CG-CB 4.39Å; M905-C913 PolarHBondContact SD-SG 3.29Å; V909-C913 PolarHBondContact O-N 3.2Å; V909-C913 VanDerWaalsContact O-N 3.1Å; V909-C913 PolarHBondContact O-SG 3.43Å; F910-C913 PolarHBondContact O-N 3.29Å; F910-C913 VanDerWaalsContact O-N 3.17Å; M911-C913 PolarHBondContact O-N 2.98Å; C913-G915 PolarHBondContact O-N 3.32Å; C913-F916 PolarHBondContact O-N 2.84Å; C913-I917 HydrophobicContact CB-CD1 4.14Å; C913-I917 PolarHBondContact O-N 3.33Å
914	S	91.8	Very high	82.6	Confident	0 Å²	0	25.1 Å²	25.1	0%	0	12%	0.124	C	C	.	.	G	3₁₀ helix	trans	-57.3	-42.1	-163.4	63.2	0	0	0	0	113.9	R896 F910 F916 I917 H940 P941	R896-S914 VanDerWaalsContact CZ-O 3.29Å; R896-S914 PolarHBondContact NE-O 3.03Å; R896-S914 PolarHBondContact NH2-O 2.84Å; F910-S914 WeakPolarHBondContact O-CB 3.43Å; F910-S914 PolarHBondContact O-N 3.26Å; F910-S914 PolarHBondContact O-OG 2.95Å; S914-F916 VanDerWaalsContact C-N 3.28Å; S914-F916 PolarHBondContact O-N 3.07Å; S914-I917 PolarHBondContact O-N 3.43Å; S914-H940 PolarHBondContact OG-CD2 3.5Å; S914-H940 PolarHBondContact OG-NE2 2.84Å; S914-H940 VanDerWaalsContact OG-NE2 3.07Å; S914-P941 WeakPolarHBondContact OG-CD 3.32Å
915	G	91	Very high	81.1	Confident	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.143	C	C	.	.	G	3₁₀ helix	trans	-69.3	-21.2	178.7	0	0	0	0	0	114.8	Y263 C913	Y263-G915 WeakPolarHBondContact OH-CA 3.19Å; Y263-G915 PolarHBondContact OH-O 2.91Å; C913-G915 PolarHBondContact O-N 3.32Å
916	F	95.4	Very high	79.4	Confident	3 Å²	3	35.8 Å²	35.8	1%	0.013	18%	0.179	C	C	.	.	G	3₁₀ helix	trans	-92.8	-12.8	179.8	-56.7	-67.1	0	0	0	113.3	P258 F259 F262 Y263 N849 G852 V853 V871 C872 N912 C913 S914	P258-F916 HydrophobicContact CB-CZ 4.16Å; F259-F916 HydrophobicContact CB-CE2 4.5Å; F262-F916 HydrophobicContact CB-CE1 3.84Å; F262-F916 HydrophobicContact CB-CZ 3.91Å; F262-F916 AromaticContact CD2-CE1 3.73Å; F262-F916 HydrophobicContact CD2-CE1 3.73Å; F262-F916 HydrophobicContact CD2-CZ 4.04Å; F262-F916 HydrophobicContact CE2-CE1 4.49Å; F262-F916 AromaticContact CG-CE1 3.82Å; F262-F916 HydrophobicContact CG-CE1 3.82Å; F262-F916 HydrophobicContact CG-CZ 4.23Å; Y263-F916 HydrophobicContact CD2-CE2 4.16Å; Y263-F916 AromaticContact CD2-CZ 3.87Å; Y263-F916 HydrophobicContact CD2-CZ 3.87Å; Y263-F916 HydrophobicContact CE2-CD1 4.28Å; Y263-F916 HydrophobicContact CE2-CD2 4.25Å; Y263-F916 AromaticContact CE2-CE1 3.74Å; Y263-F916 HydrophobicContact CE2-CE1 3.74Å; Y263-F916 AromaticContact CE2-CE2 3.72Å; Y263-F916 HydrophobicContact CE2-CE2 3.72Å; Y263-F916 AromaticContact CE2-CZ 3.45Å; Y263-F916 HydrophobicContact CE2-CZ 3.45Å; Y263-F916 VanDerWaalsContact CE2-CZ 3.45Å; N849-F916 HydrophobicContact CB-CD1 3.64Å; N849-F916 HydrophobicContact CB-CE1 3.73Å; N849-F916 HydrophobicContact CB-CG 4.16Å; N849-F916 HydrophobicContact CB-CZ 4.33Å; N849-F916 WeakPolarHBondContact O-CD1 3.41Å; N849-F916 VanDerWaalsContact OD1-CG 3.3Å; N849-F916 WeakPolarHBondContact OD1-CG 3.44Å; G852-F916 CarbonylContact C-O 3.56Å; G852-F916 WeakPolarHBondContact CA-O 3.37Å; V853-F916 PolarHBondContact N-O 3.3Å; V871-F916 HydrophobicContact CG1-CB 4.14Å; C872-F916 HydrophobicContact CB-CD2 3.4Å; C872-F916 VanDerWaalsContact CB-CD2 3.4Å; C872-F916 HydrophobicContact CB-CE2 3.34Å; C872-F916 HydrophobicContact CB-CG 4.37Å; C872-F916 HydrophobicContact CB-CZ 4.29Å; N912-F916 VanDerWaalsContact O-CD2 3.28Å; N912-F916 WeakPolarHBondContact O-CD2 3.39Å; N912-F916 VanDerWaalsContact O-CE2 3.3Å; N912-F916 WeakPolarHBondContact O-CE2 3.39Å; C913-F916 PolarHBondContact O-N 2.84Å; S914-F916 VanDerWaalsContact C-N 3.28Å; S914-F916 PolarHBondContact O-N 3.07Å
917	I	93	Very high	77.6	Confident	1 Å²	1	42.4 Å²	42.4	1%	0.005	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	128	173.7	-71.1	164.3	0	0	0	108.9	L855 R896 L899 C913 S914 I919	L855-I917 HydrophobicContact CD1-CB 4.48Å; L855-I917 HydrophobicContact CD1-CD1 4.06Å; L855-I917 HydrophobicContact CD1-CG1 4.22Å; L855-I917 HydrophobicContact CD1-CG2 3.48Å; L855-I917 VanDerWaalsContact CD1-CG2 3.48Å; L855-I917 HydrophobicContact CG-CG1 4.47Å; L855-I917 HydrophobicContact CG-CG2 3.77Å; R896-I917 PolarHBondContact NH2-O 3.06Å; L899-I917 HydrophobicContact CD1-CD1 3.7Å; L899-I917 HydrophobicContact CD1-CG2 4.37Å; C913-I917 HydrophobicContact CB-CD1 4.14Å; C913-I917 PolarHBondContact O-N 3.33Å; S914-I917 PolarHBondContact O-N 3.43Å; I917-I919 HydrophobicContact CG2-CG1 4.18Å
918	K	90.7	Very high	75.8	Confident	32 Å²	32	46.3 Å²	46.3	14%	0.139	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	137.4	173.2	-49.8	-173.5	172.7	171.9	0	110	V851 G852 V853 D854 Y1014	V851-K918 WeakPolarHBondContact O-CE 3.11Å; V851-K918 PolarHBondContact O-NZ 3.19Å; G852-K918 WeakPolarHBondContact O-CE 3.23Å; V853-K918 PolarHBondContact O-N 3.39Å; D854-K918 HydrophobicContact CB-CB 4.18Å; K918-Y1014 WeakPolarHBondContact CA-OH 3.3Å; K918-Y1014 HydrophobicContact CB-CD1 4.31Å; K918-Y1014 HydrophobicContact CB-CE1 3.84Å; K918-Y1014 HydrophobicContact CB-CE2 4.19Å; K918-Y1014 HydrophobicContact CD-CD1 3.67Å; K918-Y1014 HydrophobicContact CD-CD2 4.42Å; K918-Y1014 HydrophobicContact CD-CE1 4.05Å; K918-Y1014 HydrophobicContact CD-CG 3.89Å; K918-Y1014 HydrophobicContact CG-CD1 3.64Å; K918-Y1014 HydrophobicContact CG-CE1 3.5Å; K918-Y1014 HydrophobicContact CG-CG 4.27Å
919	I	83.9	Confident	73.9	Confident	2 Å²	2	50 Å²	50	1%	0.01	25%	0.25	C	S	.	.			trans	-131	115.4	171.9	-56.1	178.7	0	0	0	105.7	I893 R896 I917 S936 Y1014	I893-I919 HydrophobicContact CG2-CD1 4Å; R896-I919 HydrophobicContact CB-CD1 4.43Å; R896-I919 HydrophobicContact CG-CD1 3.7Å; I917-I919 HydrophobicContact CG2-CG1 4.18Å; I919-S936 WeakPolarHBondContact O-CA 3.29Å; I919-Y1014 PolarHBondContact N-OH 2.95Å
920	D	69.8	Low	72.3	Confident	67 Å²	67	53.5 Å²	53.5	36%	0.358	28%	0.28	S	S	.	.			trans	-74	134.6	-175.3	-164	-19.7	0	0	0	111.8	Q922	D920-Q922 PolarHBondContact OD1-N 2.75Å
921	S	58.2	Low	70.9	Confident	31 Å²	31	55.6 Å²	55.6	22%	0.217	29%	0.29	C	S	.	.	S	Bend	trans	-71.7	-25	174.9	54.8	0	0	0	0	114.8	F923 N924 A925 R1013	S921-F923 PolarHBondContact O-N 2.91Å; S921-F923 VanDerWaalsContact O-N 3.09Å; S921-N924 PolarHBondContact O-N 2.87Å; S921-A925 PolarHBondContact O-N 2.78Å; S921-R1013 PolarHBondContact OG-NH1 3.02Å
922	Q	56.1	Low	70.2	Confident	104 Å²	104	57.3 Å²	57.3	49%	0.486	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-29.3	-170.4	-74.3	-178.6	3.9	0	0	113.1	D639 D920	D639-Q922 PolarHBondContact OD1-NE2 3.4Å; D639-Q922 PolarHBondContact OD2-NE2 2.89Å; D920-Q922 PolarHBondContact OD1-N 2.75Å
923	F	52.1	Low	69.5	Low	133 Å²	133	58.2 Å²	58.2	58%	0.583	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-26.3	174.4	-109.6	-91	0	0	0	113.7	S921	S921-F923 PolarHBondContact O-N 2.91Å; S921-F923 VanDerWaalsContact O-N 3.09Å
924	N	51.3	Low	69.1	Low	9 Å²	9	58.3 Å²	58.3	5%	0.048	31%	0.305	C	S	.	.	G	3₁₀ helix	trans	-83	-20.9	-173	-70.5	-9.5	0	0	0	113.7	E894 S921 Y926 R927 H931	E894-N924 PolarHBondContact O-ND2 3.02Å; S921-N924 PolarHBondContact O-N 2.87Å; N924-Y926 PolarHBondContact O-N 3.02Å; N924-R927 PolarHBondContact O-N 2.76Å; N924-H931 PolarHBondContact O-CE1 2.81Å; N924-H931 VanDerWaalsContact O-CE1 3.3Å
925	A	51.6	Low	68.9	Low	71 Å²	71	58.5 Å²	58.5	59%	0.587	31%	0.306	S	S	*	.	G	3₁₀ helix	trans	-55.7	-18.7	-174.9	0	0	0	0	0	114.7	S921	S921-A925 PolarHBondContact O-N 2.78Å
926	Y	50.5	Low	68.6	Low	217 Å²	217	58.9 Å²	58.9	85%	0.851	31%	0.308	S	S	*	.	G	3₁₀ helix	trans	-118.6	-3.9	179.5	-60.9	-72.5	0	0	0	114.9	N924	N924-Y926 PolarHBondContact O-N 3.02Å
927	R	48.2	Very low	68.3	Low	158 Å²	158	58.8 Å²	58.8	60%	0.596	31%	0.308	S	S	*	.	S	Bend	trans	-121.1	105	-172.1	-71.7	-173	176.1	-137.4	0.8	111.7	N924 H931	N924-R927 PolarHBondContact O-N 2.76Å; R927-H931 PolarHBondContact O-ND1 3.31Å
928	T	50.3	Low	68.2	Low	92 Å²	92	60.3 Å²	60.3	56%	0.564	31%	0.314	S	S	*	.			trans	70.9	147.3	161.5	74.2	0	0	0	0	118.1	A930 H931	T928-A930 PolarHBondContact O-N 3.06Å; T928-H931 PolarHBondContact O-CE1 2.66Å; T928-H931 PolarHBondContact O-ND1 3.34Å
929	T	51	Low	68.3	Low	123 Å²	123	59 Å²	59	76%	0.755	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	7.6	-179.5	48.8	0	0	0	0	113.8	R966	T929-R966 VanDerWaalsContact O-CZ 3.25Å; T929-R966 PolarHBondContact O-NH1 2.93Å; T929-R966 PolarHBondContact O-NH2 3.45Å
930	A	57.7	Low	68.7	Low	80 Å²	80	59 Å²	59	66%	0.661	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.9	-11.6	-169.2	0	0	0	0	0	114.9	T928	T928-A930 PolarHBondContact O-N 3.06Å
931	H	66	Low	69.6	Low	45 Å²	45	56.2 Å²	56.2	21%	0.208	29%	0.294	C	S	.	.			trans	-84.3	145.8	-178.2	62.3	-87.7	0	0	0	112.3	N924 R927 T928 R966	N924-H931 PolarHBondContact O-CE1 2.81Å; N924-H931 VanDerWaalsContact O-CE1 3.3Å; R927-H931 PolarHBondContact O-ND1 3.31Å; T928-H931 PolarHBondContact O-CE1 2.66Å; T928-H931 PolarHBondContact O-ND1 3.34Å; H931-R966 PolarHBondContact O-NH2 2.95Å
932	D	76.6	Confident	71	Confident	36 Å²	36	56.6 Å²	56.6	19%	0.193	30%	0.297	C	S	.	.			trans	-92.1	130.1	167.4	-164.5	-39	0	0	0	108.6	L934 D935 Y944 R948	D932-L934 PolarHBondContact O-N 3.28Å; D932-L934 WeakPolarHBondContact OD1-CB 3.36Å; D932-L934 PolarHBondContact OD1-N 3.42Å; D932-D935 WeakPolarHBondContact O-CB 3.47Å; D932-D935 PolarHBondContact O-N 3.43Å; D932-Y944 HydrophobicContact CB-CE2 4.26Å; D932-Y944 WeakPolarHBondContact OD2-CD2 3.47Å; D932-R948 IonicContact OD2-CZ 3.45Å; D932-R948 IonicContact OD2-NH2 3.87Å; D932-R948 PolarHBondContact OD2-NH2 3.25Å
933	V	80.4	Confident	72.6	Confident	19 Å²	19	52.2 Å²	52.2	12%	0.115	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-57.5	-33.1	179	178.8	0	0	0	0	110.8	D935 S936 D970 L973	V933-D935 VanDerWaalsContact C-N 3.28Å; V933-D935 PolarHBondContact O-N 2.95Å; V933-S936 PolarHBondContact O-N 3.14Å; V933-S936 PolarHBondContact O-OG 3.22Å; V933-D970 VanDerWaalsContact CG2-OD1 3.26Å; V933-D970 WeakPolarHBondContact CG2-OD1 3.35Å; V933-L973 HydrophobicContact CG1-CD1 3.25Å
934	L	86.4	Confident	74.3	Confident	1 Å²	1	46.6 Å²	46.6	1%	0.005	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-71.7	-15.7	179.6	-64.4	177.5	0	0	0	114.3	D932 S936 S937 Y944 A947 L969 L1010	D932-L934 PolarHBondContact O-N 3.28Å; D932-L934 WeakPolarHBondContact OD1-CB 3.36Å; D932-L934 PolarHBondContact OD1-N 3.42Å; L934-S936 PolarHBondContact O-N 3.03Å; L934-S937 WeakPolarHBondContact O-CB 3.5Å; L934-S937 PolarHBondContact O-N 2.75Å; L934-S937 PolarHBondContact O-OG 2.93Å; L934-Y944 HydrophobicContact CB-CD1 3.89Å; L934-Y944 HydrophobicContact CB-CD2 4.2Å; L934-Y944 HydrophobicContact CB-CE1 3.61Å; L934-Y944 HydrophobicContact CB-CE2 3.96Å; L934-Y944 HydrophobicContact CB-CG 4.17Å; L934-Y944 HydrophobicContact CD1-CD1 3.71Å; L934-Y944 HydrophobicContact CD1-CD2 4.19Å; L934-Y944 HydrophobicContact CD1-CE1 4.32Å; L934-Y944 HydrophobicContact CD1-CG 3.63Å; L934-Y944 HydrophobicContact CG-CD1 4.46Å; L934-Y944 PolarHBondContact O-OH 3.15Å; L934-A947 HydrophobicContact CD1-CB 3.8Å; L934-A947 HydrophobicContact CD2-CB 4.19Å; L934-L969 HydrophobicContact CD1-CD1 3.88Å; L934-L969 HydrophobicContact CD2-CD1 4Å; L934-L969 HydrophobicContact CD2-CD2 3.96Å; L934-L969 HydrophobicContact CG-CD1 3.73Å; L934-L1010 HydrophobicContact CD2-CD2 3.85Å
935	D	86.9	Confident	76	Confident	5 Å²	5	50.8 Å²	50.8	3%	0.027	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-60.5	-25.7	173.8	-76.6	-6.8	0	0	0	111.5	S895 R896 D932 V933 S937 Y944 Y1014	S895-D935 VanDerWaalsContact CA-OD2 3.29Å; S895-D935 WeakPolarHBondContact CA-OD2 3.23Å; S895-D935 WeakPolarHBondContact CB-OD2 3.41Å; S895-D935 PolarHBondContact OG-OD2 3.02Å; R896-D935 HydrophobicContact CG-CB 4.38Å; R896-D935 PolarHBondContact N-OD2 3.37Å; D932-D935 WeakPolarHBondContact O-CB 3.47Å; D932-D935 PolarHBondContact O-N 3.43Å; V933-D935 VanDerWaalsContact C-N 3.28Å; V933-D935 PolarHBondContact O-N 2.95Å; D935-S937 PolarHBondContact O-N 3.24Å; D935-Y944 WeakPolarHBondContact CA-OH 2.94Å; D935-Y944 PolarHBondContact N-OH 2.55Å; D935-Y944 WeakPolarHBondContact OD1-CE2 3.08Å; D935-Y944 PolarHBondContact OD1-OH 2.99Å; D935-Y1014 PolarHBondContact O-OH 2.85Å
936	S	84.5	Confident	77.8	Confident	7 Å²	7	48.5 Å²	48.5	5%	0.049	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	-82.2	20.6	173.9	73	0	0	0	0	114.7	I919 V933 L934 R1013 Y1014	I919-S936 WeakPolarHBondContact O-CA 3.29Å; V933-S936 PolarHBondContact O-N 3.14Å; V933-S936 PolarHBondContact O-OG 3.22Å; L934-S936 PolarHBondContact O-N 3.03Å; S936-R1013 WeakPolarHBondContact O-CD 3.37Å; S936-R1013 PolarHBondContact OG-NH1 3.28Å; S936-Y1014 VanDerWaalsContact C-CZ 3.41Å; S936-Y1014 WeakPolarHBondContact CA-OH 3.3Å; S936-Y1014 WeakPolarHBondContact O-CE2 3.21Å
937	S	88.9	Confident	79.6	Confident	1 Å²	1	38.2 Å²	38.2	1%	0.007	21%	0.207	C	C	.	.	S	Bend	trans	-133.9	167.9	178.1	79.4	0	0	0	0	111.7	R896 L934 D935 V939 Y1014	R896-S937 PolarHBondContact NH1-O 2.95Å; R896-S937 PolarHBondContact NH2-O 3.01Å; L934-S937 WeakPolarHBondContact O-CB 3.5Å; L934-S937 PolarHBondContact O-N 2.75Å; L934-S937 PolarHBondContact O-OG 2.93Å; D935-S937 PolarHBondContact O-N 3.24Å; S937-V939 PolarHBondContact O-N 2.79Å; S937-V939 WeakPolarHBondContact OG-CB 3.46Å; S937-V939 WeakPolarHBondContact OG-CG2 3.08Å; S937-V939 PolarHBondContact OG-N 3.08Å; S937-V939 VanDerWaalsContact OG-N 3.16Å; S937-Y1014 PolarHBondContact N-OH 3.13Å; S937-Y1014 VanDerWaalsContact N-OH 3.15Å; S937-Y1014 PolarHBondContact O-OH 2.8Å
938	R	91.5	Very high	81.5	Confident	33 Å²	33	33.8 Å²	33.8	13%	0.125	19%	0.19	C	C	.	.	S	Bend	trans	-81.2	4.2	168.2	-70.8	176.7	-74.7	-160.9	-4.3	114.3	Y263 E850 H940 E1009 Y1014 K1015	Y263-R938 WeakPolarHBondContact CE1-O 3.39Å; Y263-R938 PolarHBondContact OH-O 3.1Å; E850-R938 PolarHBondContact O-NH1 2.86Å; R938-H940 PolarHBondContact O-N 2.73Å; R938-E1009 HydrophobicContact CB-CG 4.14Å; R938-E1009 IonicContact CZ-OE2 2.71Å; R938-E1009 VanDerWaalsContact CZ-OE2 3.27Å; R938-E1009 PolarHBondContact N-OE1 2.94Å; R938-E1009 IonicContact NE-OE1 2.62Å; R938-E1009 PolarHBondContact NE-OE1 2.89Å; R938-E1009 IonicContact NE-OE2 3.81Å; R938-E1009 PolarHBondContact NE-OE2 3.08Å; R938-E1009 IonicContact NH2-OE1 3.58Å; R938-E1009 IonicContact NH2-OE2 3.56Å; R938-E1009 PolarHBondContact NH2-OE2 2.94Å; R938-Y1014 HydrophobicContact CG-CD1 3.65Å; R938-Y1014 HydrophobicContact CG-CE1 3.71Å; R938-Y1014 VanDerWaalsContact NH2-C 3.32Å; R938-K1015 PolarHBondContact NH1-O 3.01Å; R938-K1015 VanDerWaalsContact NH1-O 3.16Å; R938-K1015 PolarHBondContact NH2-O 3.43Å
939	V	92	Very high	83.2	Confident	5 Å²	5	32.3 Å²	32.3	3%	0.03	18%	0.176	C	C	.	.			trans	-60.4	132	172.5	-177.5	0	0	0	0	107.6	R896 S937 T943 Y944 A947 I1006 E1009	R896-V939 PolarHBondContact NH1-O 3.13Å; S937-V939 PolarHBondContact O-N 2.79Å; S937-V939 WeakPolarHBondContact OG-CB 3.46Å; S937-V939 WeakPolarHBondContact OG-CG2 3.08Å; S937-V939 PolarHBondContact OG-N 3.08Å; S937-V939 VanDerWaalsContact OG-N 3.16Å; V939-T943 WeakPolarHBondContact CG1-OG1 3.46Å; V939-Y944 HydrophobicContact CB-CD1 4.42Å; V939-Y944 HydrophobicContact CB-CE1 4.26Å; V939-Y944 HydrophobicContact CG1-CD1 3.86Å; V939-Y944 HydrophobicContact CG1-CE1 4.18Å; V939-Y944 WeakPolarHBondContact O-CE1 3.48Å; V939-A947 HydrophobicContact CG1-CB 4.41Å; V939-I1006 HydrophobicContact CG1-CD1 4.46Å; V939-I1006 HydrophobicContact CG1-CG1 4.15Å; V939-I1006 HydrophobicContact CG2-CG1 4.16Å; V939-I1006 HydrophobicContact CG2-CG2 4.28Å; V939-E1009 HydrophobicContact CG2-CG 4.41Å
940	H	92.8	Very high	85	Confident	1 Å²	1	26.5 Å²	26.5	1%	0.005	14%	0.14	C	C	.	.			trans	-75.6	140.5	179.7	-173.2	-92.7	0	0	0	109.8	F259 Y263 M911 S914 R938 S942 T943 Y944	F259-H940 AromaticContact CE2-CD2 3.76Å; F259-H940 AromaticContact CE2-NE2 3.55Å; Y263-H940 HydrophobicContact CD1-CB 3.74Å; Y263-H940 HydrophobicContact CE1-CB 3.74Å; Y263-H940 HydrophobicContact CG-CB 4.23Å; M911-H940 PolarHBondContact O-NE2 3.43Å; S914-H940 PolarHBondContact OG-CD2 3.5Å; S914-H940 PolarHBondContact OG-NE2 2.84Å; S914-H940 VanDerWaalsContact OG-NE2 3.07Å; R938-H940 PolarHBondContact O-N 2.73Å; H940-S942 PolarHBondContact CE1-OG 3.16Å; H940-S942 WeakPolarHBondContact ND1-CB 3.26Å; H940-S942 PolarHBondContact ND1-N 3.17Å; H940-S942 VanDerWaalsContact ND1-N 3.16Å; H940-S942 PolarHBondContact ND1-OG 2.56Å; H940-S942 PolarHBondContact O-N 3.07Å; H940-S942 VanDerWaalsContact O-N 3.09Å; H940-T943 PolarHBondContact O-N 3.28Å; H940-T943 PolarHBondContact O-OG1 3.25Å; H940-T943 VanDerWaalsContact O-OG1 3.05Å; H940-Y944 VanDerWaalsContact O-CD1 3.31Å; H940-Y944 WeakPolarHBondContact O-CD1 3.34Å
941	P	89.5	Confident	86.4	Confident	9 Å²	9	22.7 Å²	22.7	6%	0.058	11%	0.109	C	C	.	.	G	3₁₀ helix	trans	-50.9	-36.1	179.8	-31.6	37.8	0	0	0	114.7	L97 F910 S914 T943 Y944	L97-P941 HydrophobicContact CD1-CB 3.73Å; L97-P941 WeakPolarHBondContact CD1-O 3.36Å; L97-P941 HydrophobicContact CD2-CB 3.52Å; L97-P941 HydrophobicContact CG-CB 4.24Å; F910-P941 HydrophobicContact CE1-CG 4.43Å; F910-P941 HydrophobicContact CZ-CG 4.17Å; S914-P941 WeakPolarHBondContact OG-CD 3.32Å; P941-T943 PolarHBondContact O-N 3.49Å; P941-T943 VanDerWaalsContact O-N 3.08Å; P941-Y944 HydrophobicContact CB-CE1 4.5Å; P941-Y944 HydrophobicContact CB-CE2 4.49Å; P941-Y944 HydrophobicContact CG-CE1 4.45Å; P941-Y944 PolarHBondContact O-N 3.01Å
942	S	86.4	Confident	87.3	Confident	40 Å²	40	23.5 Å²	23.5	28%	0.28	11%	0.113	S	C	.	.	G	3₁₀ helix	trans	-66.3	-8.6	177.4	73.3	0	0	0	0	114.9	H940	H940-S942 PolarHBondContact CE1-OG 3.16Å; H940-S942 WeakPolarHBondContact ND1-CB 3.26Å; H940-S942 PolarHBondContact ND1-N 3.17Å; H940-S942 VanDerWaalsContact ND1-N 3.16Å; H940-S942 PolarHBondContact ND1-OG 2.56Å; H940-S942 PolarHBondContact O-N 3.07Å; H940-S942 VanDerWaalsContact O-N 3.09Å
943	T	89.2	Confident	87.8	Confident	11 Å²	11	25.9 Å²	25.9	7%	0.067	13%	0.126	C	C	.	.	G	3₁₀ helix	trans	-119.3	10.1	178.3	63.7	0	0	0	0	113.5	V939 H940 P941 E945 W946 A947 M999 T1002	V939-T943 WeakPolarHBondContact CG1-OG1 3.46Å; H940-T943 PolarHBondContact O-N 3.28Å; H940-T943 PolarHBondContact O-OG1 3.25Å; H940-T943 VanDerWaalsContact O-OG1 3.05Å; P941-T943 PolarHBondContact O-N 3.49Å; P941-T943 VanDerWaalsContact O-N 3.08Å; T943-E945 VanDerWaalsContact C-N 3.31Å; T943-E945 PolarHBondContact O-N 3.12Å; T943-W946 WeakPolarHBondContact O-CB 3.3Å; T943-W946 PolarHBondContact O-N 2.9Å; T943-W946 VanDerWaalsContact O-N 3.12Å; T943-A947 PolarHBondContact O-N 2.78Å; T943-M999 HydrophobicContact CG2-CE 3.83Å; T943-T1002 HydrophobicContact CG2-CG2 4.21Å
944	Y	89.3	Confident	88	Confident	15 Å²	15	25.7 Å²	25.7	6%	0.059	13%	0.126	C	C	.	.	H	α-helix	trans	-58.5	-40.5	178.2	-79.5	8.4	0	0	0	113.1	R896 D932 L934 D935 V939 H940 P941 W946 A947 R948	R896-Y944 PolarHBondContact NH1-OH 2.93Å; D932-Y944 HydrophobicContact CB-CE2 4.26Å; D932-Y944 WeakPolarHBondContact OD2-CD2 3.47Å; L934-Y944 HydrophobicContact CB-CD1 3.89Å; L934-Y944 HydrophobicContact CB-CD2 4.2Å; L934-Y944 HydrophobicContact CB-CE1 3.61Å; L934-Y944 HydrophobicContact CB-CE2 3.96Å; L934-Y944 HydrophobicContact CB-CG 4.17Å; L934-Y944 HydrophobicContact CD1-CD1 3.71Å; L934-Y944 HydrophobicContact CD1-CD2 4.19Å; L934-Y944 HydrophobicContact CD1-CE1 4.32Å; L934-Y944 HydrophobicContact CD1-CG 3.63Å; L934-Y944 HydrophobicContact CG-CD1 4.46Å; L934-Y944 PolarHBondContact O-OH 3.15Å; D935-Y944 WeakPolarHBondContact CA-OH 2.94Å; D935-Y944 PolarHBondContact N-OH 2.55Å; D935-Y944 WeakPolarHBondContact OD1-CE2 3.08Å; D935-Y944 PolarHBondContact OD1-OH 2.99Å; V939-Y944 HydrophobicContact CB-CD1 4.42Å; V939-Y944 HydrophobicContact CB-CE1 4.26Å; V939-Y944 HydrophobicContact CG1-CD1 3.86Å; V939-Y944 HydrophobicContact CG1-CE1 4.18Å; V939-Y944 WeakPolarHBondContact O-CE1 3.48Å; H940-Y944 VanDerWaalsContact O-CD1 3.31Å; H940-Y944 WeakPolarHBondContact O-CD1 3.34Å; P941-Y944 HydrophobicContact CB-CE1 4.5Å; P941-Y944 HydrophobicContact CB-CE2 4.49Å; P941-Y944 HydrophobicContact CG-CE1 4.45Å; P941-Y944 PolarHBondContact O-N 3.01Å; Y944-W946 PolarHBondContact O-N 2.88Å; Y944-A947 PolarHBondContact O-N 3.43Å; Y944-A947 VanDerWaalsContact O-N 3.16Å; Y944-R948 WeakPolarHBondContact O-CG 3.46Å; Y944-R948 PolarHBondContact O-N 3.34Å
945	E	86.7	Confident	87.9	Confident	98 Å²	98	27 Å²	27	46%	0.458	13%	0.133	S	C	.	.	H	α-helix	trans	-57.9	-38.8	177.5	-169.5	-172.1	155.1	0	0	111.7	T943 R948 K949	T943-E945 VanDerWaalsContact C-N 3.31Å; T943-E945 PolarHBondContact O-N 3.12Å; E945-R948 PolarHBondContact O-N 2.81Å; E945-K949 HydrophobicContact CG-CD 4.45Å; E945-K949 PolarHBondContact O-N 3.34Å; E945-K949 WeakPolarHBondContact OE1-CE 3.38Å; E945-K949 IonicContact OE1-NZ 3.02Å; E945-K949 PolarHBondContact OE1-NZ 2.98Å
946	W	88.5	Confident	87.5	Confident	23 Å²	23	35.1 Å²	35.1	9%	0.087	17%	0.171	C	C	.	.	H	α-helix	trans	-69.7	-39.5	177.9	-52.9	128	0	0	0	112.1	T943 Y944 R948 K949 M950 L991 F996	T943-W946 WeakPolarHBondContact O-CB 3.3Å; T943-W946 PolarHBondContact O-N 2.9Å; T943-W946 VanDerWaalsContact O-N 3.12Å; Y944-W946 PolarHBondContact O-N 2.88Å; W946-R948 VanDerWaalsContact C-N 3.3Å; W946-R948 PolarHBondContact O-N 3.34Å; W946-K949 HydrophobicContact CE3-CD 3.84Å; W946-K949 HydrophobicContact CZ3-CD 3.76Å; W946-K949 PolarHBondContact O-N 3.48Å; W946-M950 WeakPolarHBondContact O-CB 3.37Å; W946-M950 WeakPolarHBondContact O-CG 3.32Å; W946-M950 PolarHBondContact O-N 3.39Å; W946-L991 HydrophobicContact CD2-CD1 4.29Å; W946-L991 HydrophobicContact CE3-CD1 4.06Å; W946-L991 HydrophobicContact CE3-CD2 3.63Å; W946-L991 HydrophobicContact CH2-CD2 3.94Å; W946-L991 HydrophobicContact CZ3-CD1 4.49Å; W946-L991 HydrophobicContact CZ3-CD2 3.3Å; W946-F996 HydrophobicContact CH2-CB 4.21Å; W946-F996 AromaticContact CH2-CD1 3.59Å; W946-F996 HydrophobicContact CH2-CD1 3.59Å; W946-F996 AromaticContact CH2-CD2 3.59Å; W946-F996 HydrophobicContact CH2-CD2 3.59Å; W946-F996 AromaticContact CH2-CE1 3.75Å; W946-F996 HydrophobicContact CH2-CE1 3.75Å; W946-F996 AromaticContact CH2-CE2 3.75Å; W946-F996 HydrophobicContact CH2-CE2 3.75Å; W946-F996 AromaticContact CH2-CG 3.51Å; W946-F996 HydrophobicContact CH2-CG 3.51Å; W946-F996 AromaticContact CH2-CZ 3.83Å; W946-F996 HydrophobicContact CH2-CZ 3.83Å; W946-F996 HydrophobicContact CZ2-CB 4.05Å; W946-F996 AromaticContact CZ2-CD1 3.6Å; W946-F996 HydrophobicContact CZ2-CD1 3.6Å; W946-F996 HydrophobicContact CZ2-CD2 4.26Å; W946-F996 HydrophobicContact CZ2-CE1 4.08Å; W946-F996 AromaticContact CZ2-CG 3.71Å; W946-F996 HydrophobicContact CZ2-CG 3.71Å; W946-F996 HydrophobicContact CZ3-CD2 4.36Å; W946-F996 HydrophobicContact CZ3-CE2 4.46Å
947	A	88.4	Confident	87	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-62.2	-37.9	174.1	0	0	0	0	0	112.1	L934 V939 T943 Y944 A951 I1006	L934-A947 HydrophobicContact CD1-CB 3.8Å; L934-A947 HydrophobicContact CD2-CB 4.19Å; V939-A947 HydrophobicContact CG1-CB 4.41Å; T943-A947 PolarHBondContact O-N 2.78Å; Y944-A947 PolarHBondContact O-N 3.43Å; Y944-A947 VanDerWaalsContact O-N 3.16Å; A947-A951 PolarHBondContact O-N 3.34Å; A947-A951 VanDerWaalsContact O-N 3.13Å; A947-I1006 HydrophobicContact CB-CG2 3.84Å
948	R	88	Confident	86	Confident	65 Å²	65	46 Å²	46	25%	0.245	22%	0.218	C	C	.	.	H	α-helix	trans	-65.6	-50.6	174.8	-68.5	-176	-151.3	115.6	-2.4	112	D932 Y944 E945 W946 M950 A951 E952 S965 L969	D932-R948 IonicContact OD2-CZ 3.45Å; D932-R948 IonicContact OD2-NH2 3.87Å; D932-R948 PolarHBondContact OD2-NH2 3.25Å; Y944-R948 WeakPolarHBondContact O-CG 3.46Å; Y944-R948 PolarHBondContact O-N 3.34Å; E945-R948 PolarHBondContact O-N 2.81Å; W946-R948 VanDerWaalsContact C-N 3.3Å; W946-R948 PolarHBondContact O-N 3.34Å; R948-M950 VanDerWaalsContact C-N 3.3Å; R948-M950 PolarHBondContact O-N 3.38Å; R948-A951 WeakPolarHBondContact O-CA 3.3Å; R948-A951 WeakPolarHBondContact O-CB 3.41Å; R948-A951 PolarHBondContact O-N 2.96Å; R948-E952 WeakPolarHBondContact O-CG 3.2Å; R948-E952 PolarHBondContact O-N 3.14Å; R948-S965 WeakPolarHBondContact CD-OG 3.44Å; R948-L969 HydrophobicContact CG-CD1 3.57Å; R948-L969 HydrophobicContact CG-CG 4.25Å
949	K	86.7	Confident	84.5	Confident	61 Å²	61	50.6 Å²	50.6	27%	0.265	25%	0.252	S	S	.	.	H	α-helix	trans	-58.9	-40.2	176.3	-74.8	174.5	170.8	167.3	0	112.5	E945 W946 A951 E952 D953 F987	E945-K949 HydrophobicContact CG-CD 4.45Å; E945-K949 PolarHBondContact O-N 3.34Å; E945-K949 WeakPolarHBondContact OE1-CE 3.38Å; E945-K949 IonicContact OE1-NZ 3.02Å; E945-K949 PolarHBondContact OE1-NZ 2.98Å; W946-K949 HydrophobicContact CE3-CD 3.84Å; W946-K949 HydrophobicContact CZ3-CD 3.76Å; W946-K949 PolarHBondContact O-N 3.48Å; K949-A951 VanDerWaalsContact C-N 3.29Å; K949-A951 PolarHBondContact O-N 3.13Å; K949-E952 PolarHBondContact O-N 3.47Å; K949-D953 WeakPolarHBondContact O-CB 3.3Å; K949-D953 PolarHBondContact O-N 3.14Å; K949-F987 HydrophobicContact CB-CZ 4.04Å
950	M	88.6	Confident	82.9	Confident	1 Å²	1	55.2 Å²	55.2	1%	0.005	28%	0.276	C	S	.	.	H	α-helix	trans	-60.1	-39.3	173.7	-75.7	172.5	65.3	0	0	112.3	W946 R948 A954 L982 L984 F987 L1003 I1006 R1007	W946-M950 WeakPolarHBondContact O-CB 3.37Å; W946-M950 WeakPolarHBondContact O-CG 3.32Å; W946-M950 PolarHBondContact O-N 3.39Å; R948-M950 VanDerWaalsContact C-N 3.3Å; R948-M950 PolarHBondContact O-N 3.38Å; M950-A954 WeakPolarHBondContact O-CB 3.48Å; M950-A954 PolarHBondContact O-N 3.38Å; M950-A954 VanDerWaalsContact O-N 3.07Å; M950-L982 HydrophobicContact CB-CD2 4.2Å; M950-L982 HydrophobicContact CG-CD2 4.34Å; M950-L984 HydrophobicContact CE-CD2 3.71Å; M950-F987 HydrophobicContact CG-CD1 4.29Å; M950-F987 HydrophobicContact CG-CE1 3.7Å; M950-F987 HydrophobicContact CG-CZ 3.99Å; M950-L1003 HydrophobicContact CG-CD2 3.95Å; M950-L1003 HydrophobicContact SD-CB 4.31Å; M950-L1003 HydrophobicContact SD-CD2 3.31Å; M950-L1003 WeakPolarHBondContact SD-CD2 3.39Å; M950-L1003 HydrophobicContact SD-CG 4.4Å; M950-I1006 HydrophobicContact CE-CB 4.35Å; M950-I1006 HydrophobicContact CE-CG2 4Å; M950-I1006 HydrophobicContact SD-CB 4.17Å; M950-I1006 HydrophobicContact SD-CD1 4.34Å; M950-I1006 HydrophobicContact SD-CG2 3.78Å; M950-R1007 HydrophobicContact CE-CB 4.23Å
951	A	86.4	Confident	81.1	Confident	0 Å²	0	65 Å²	65	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-71.3	-44.1	177.8	0	0	0	0	0	112	A947 R948 K949 A954 L955 P968 L969 I972	A947-A951 PolarHBondContact O-N 3.34Å; A947-A951 VanDerWaalsContact O-N 3.13Å; R948-A951 WeakPolarHBondContact O-CA 3.3Å; R948-A951 WeakPolarHBondContact O-CB 3.41Å; R948-A951 PolarHBondContact O-N 2.96Å; K949-A951 VanDerWaalsContact C-N 3.29Å; K949-A951 PolarHBondContact O-N 3.13Å; A951-A954 PolarHBondContact O-N 3.08Å; A951-L955 WeakPolarHBondContact O-CB 3.44Å; A951-L955 WeakPolarHBondContact O-CG 3.27Å; A951-L955 PolarHBondContact O-N 2.92Å; A951-P968 HydrophobicContact CB-CB 3.99Å; A951-L969 HydrophobicContact CB-CD2 3.84Å; A951-L969 HydrophobicContact CB-CG 4.24Å; A951-I972 HydrophobicContact CB-CB 4.39Å; A951-I972 HydrophobicContact CB-CG1 3.79Å
952	E	86.2	Confident	79.5	Confident	63 Å²	63	69.5 Å²	69.5	29%	0.294	35%	0.349	S	S	.	.	H	α-helix	trans	-57.5	-49.8	175.6	-72.2	167	-174.8	0	0	111.4	R948 K949 L955 E956 Y957 P968	R948-E952 WeakPolarHBondContact O-CG 3.2Å; R948-E952 PolarHBondContact O-N 3.14Å; K949-E952 PolarHBondContact O-N 3.47Å; E952-L955 PolarHBondContact O-N 2.95Å; E952-E956 PolarHBondContact O-N 3.14Å; E952-Y957 PolarHBondContact O-N 2.89Å; E952-P968 HydrophobicContact CG-CB 4.05Å; E952-P968 HydrophobicContact CG-CG 3.79Å
953	D	85.6	Confident	77.9	Confident	86 Å²	86	75.3 Å²	75.3	46%	0.46	38%	0.378	S	S	.	.	H	α-helix	trans	-65.7	-39.6	178.7	-80.4	7.5	0	0	0	112.2	K949 L955 E956 L982 F987	K949-D953 WeakPolarHBondContact O-CB 3.3Å; K949-D953 PolarHBondContact O-N 3.14Å; D953-L955 VanDerWaalsContact C-N 3.25Å; D953-L955 PolarHBondContact O-N 3.3Å; D953-E956 PolarHBondContact O-N 2.69Å; D953-L982 HydrophobicContact CB-CD1 4.05Å; D953-F987 WeakPolarHBondContact OD2-CD2 3.45Å; D953-F987 WeakPolarHBondContact OD2-CE2 3.18Å
954	A	85.2	Confident	76.3	Confident	15 Å²	15	76.5 Å²	76.5	12%	0.124	39%	0.386	C	S	.	.	H	α-helix	trans	-67.7	-26.1	178.8	0	0	0	0	0	113.1	M950 A951 I972 L979 L982	M950-A954 WeakPolarHBondContact O-CB 3.48Å; M950-A954 PolarHBondContact O-N 3.38Å; M950-A954 VanDerWaalsContact O-N 3.07Å; A951-A954 PolarHBondContact O-N 3.08Å; A954-I972 HydrophobicContact CB-CD1 4.11Å; A954-L979 HydrophobicContact CB-CD2 3.96Å; A954-L982 HydrophobicContact CB-CB 4.41Å
955	L	83.9	Confident	75	Confident	27 Å²	27	78.1 Å²	78.1	14%	0.141	40%	0.4	C	S	.	.	H	α-helix	trans	-95.5	-3.7	176.9	-66.2	177.9	0	0	0	113.5	A951 E952 D953 Y957 P968 E971 I972 R978	A951-L955 WeakPolarHBondContact O-CB 3.44Å; A951-L955 WeakPolarHBondContact O-CG 3.27Å; A951-L955 PolarHBondContact O-N 2.92Å; E952-L955 PolarHBondContact O-N 2.95Å; D953-L955 VanDerWaalsContact C-N 3.25Å; D953-L955 PolarHBondContact O-N 3.3Å; L955-Y957 PolarHBondContact O-N 2.6Å; L955-P968 HydrophobicContact CD1-CB 3.92Å; L955-P968 WeakPolarHBondContact CD1-O 3.42Å; L955-E971 HydrophobicContact CD1-CB 3.97Å; L955-E971 HydrophobicContact CD1-CG 4.15Å; L955-E971 HydrophobicContact CD2-CG 4.14Å; L955-I972 HydrophobicContact CD1-CD1 4.39Å; L955-I972 HydrophobicContact CD1-CG1 3.97Å; L955-I972 HydrophobicContact CD2-CD1 3.89Å; L955-I972 HydrophobicContact CD2-CG1 4.34Å; L955-I972 HydrophobicContact CG-CD1 3.9Å; L955-I972 HydrophobicContact CG-CG1 4Å; L955-R978 VanDerWaalsContact CD2-CD 3.46Å
956	E	79.5	Confident	73.9	Confident	176 Å²	176	78.9 Å²	78.9	82%	0.822	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.2	38.5	-170.1	-58.9	179.7	-174.4	0	0	111.4	E952 D953 E958	E952-E956 PolarHBondContact O-N 3.14Å; D953-E956 PolarHBondContact O-N 2.69Å; E956-E958 PolarHBondContact O-N 3.29Å
957	Y	73.1	Confident	73.1	Confident	85 Å²	85	81.7 Å²	81.7	33%	0.333	41%	0.414	S	S	.	.			trans	-66.6	120.6	-173.4	-149.4	-88.3	0	0	0	109.7	E952 L955 L967 P968	E952-Y957 PolarHBondContact O-N 2.89Å; L955-Y957 PolarHBondContact O-N 2.6Å; Y957-L967 WeakPolarHBondContact OH-CD1 3.46Å; Y957-P968 HydrophobicContact CD1-CG 4.36Å; Y957-P968 HydrophobicContact CD2-CG 4.12Å; Y957-P968 HydrophobicContact CE2-CG 4.44Å; Y957-P968 HydrophobicContact CG-CG 4.08Å
958	E	68.2	Low	72.7	Confident	152 Å²	152	81.8 Å²	81.8	71%	0.71	42%	0.415	S	S	*	.			trans	-74.6	135.8	171.8	-68.8	-169.6	170.9	0	0	108.8	E956 D960	E956-E958 PolarHBondContact O-N 3.29Å; E958-D960 PolarHBondContact O-N 3.28Å
959	P	59.4	Low	72.4	Confident	129 Å²	129	78.8 Å²	78.8	84%	0.838	40%	0.404	S	S	*	.			trans	-70	80.5	176	28.5	-33.2	0	0	0	109.4
960	D	60.1	Low	72.2	Confident	103 Å²	103	78.9 Å²	78.9	55%	0.551	41%	0.408	S	S	*	.			trans	-63.5	140.7	163.4	-69.3	-21.6	0	0	0	108	E958 T962	E958-D960 PolarHBondContact O-N 3.28Å; D960-T962 PolarHBondContact O-N 3.26Å
961	E	54.8	Low	71.9	Confident	205 Å²	205	81.9 Å²	81.9	96%	0.958	42%	0.422	S	S	*	.	S	Bend	trans	-58.1	-4.3	-179.5	-67.7	-165.5	164.8	0	0	114.6	D963	E961-D963 PolarHBondContact O-N 3.43Å
962	T	55.4	Low	71.8	Confident	104 Å²	104	81.9 Å²	81.9	64%	0.638	42%	0.422	S	S	*	.	S	Bend	trans	-82.8	101.4	176.6	-29.3	0	0	0	0	108.2	D960 S964	D960-T962 PolarHBondContact O-N 3.26Å; T962-S964 WeakPolarHBondContact O-CA 3.21Å; T962-S964 VanDerWaalsContact O-CB 3.29Å; T962-S964 WeakPolarHBondContact O-CB 3.44Å; T962-S964 PolarHBondContact O-N 3.4Å; T962-S964 PolarHBondContact O-OG 3Å
963	D	53.2	Low	71.6	Confident	163 Å²	163	80.8 Å²	80.8	87%	0.872	42%	0.418	S	S	*	.			trans	-44.3	55.4	179.8	-161	13.3	0	0	0	116.6	E961	E961-D963 PolarHBondContact O-N 3.43Å
964	S	55.6	Low	71.6	Confident	35 Å²	35	84.5 Å²	84.5	25%	0.245	43%	0.432	C	S	.	.			trans	-111.6	41.8	-163.4	-47.8	0	0	0	0	111.1	T962 R966 L967 P968	T962-S964 WeakPolarHBondContact O-CA 3.21Å; T962-S964 VanDerWaalsContact O-CB 3.29Å; T962-S964 WeakPolarHBondContact O-CB 3.44Å; T962-S964 PolarHBondContact O-N 3.4Å; T962-S964 PolarHBondContact O-OG 3Å; S964-R966 PolarHBondContact O-N 3.38Å; S964-L967 PolarHBondContact O-N 2.67Å; S964-P968 VanDerWaalsContact O-CD 3.32Å; S964-P968 WeakPolarHBondContact O-CD 3.23Å
965	S	60.7	Low	71.6	Confident	49 Å²	49	85 Å²	85	34%	0.343	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.7	-14.8	177.6	-170.5	0	0	0	0	113.7	R948	R948-S965 WeakPolarHBondContact CD-OG 3.44Å
966	R	64.3	Low	71.6	Confident	114 Å²	114	85 Å²	85	43%	0.43	44%	0.437	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-38.8	172.2	-67.2	-177.8	170	150.2	-4.7	114.6	T929 H931 S964 P968 L969 D970	T929-R966 VanDerWaalsContact O-CZ 3.25Å; T929-R966 PolarHBondContact O-NH1 2.93Å; T929-R966 PolarHBondContact O-NH2 3.45Å; H931-R966 PolarHBondContact O-NH2 2.95Å; S964-R966 PolarHBondContact O-N 3.38Å; R966-P968 VanDerWaalsContact C-CD 3.49Å; R966-L969 PolarHBondContact O-N 2.7Å; R966-L969 VanDerWaalsContact O-N 3.09Å; R966-D970 PolarHBondContact O-N 3.11Å; R966-D970 VanDerWaalsContact O-N 3.1Å
967	L	73.1	Confident	71.8	Confident	82 Å²	82	81.5 Å²	81.5	43%	0.429	42%	0.42	S	S	.	.	H	α-helix	trans	-57.1	-41.5	-172	-67.2	175.2	0	0	0	113.3	Y957 S964 L969 D970 E971	Y957-L967 WeakPolarHBondContact OH-CD1 3.46Å; S964-L967 PolarHBondContact O-N 2.67Å; L967-L969 VanDerWaalsContact C-N 3.33Å; L967-L969 PolarHBondContact O-N 3.23Å; L967-D970 PolarHBondContact O-N 3.43Å; L967-E971 PolarHBondContact O-N 3.36Å
968	P	78.9	Confident	72.4	Confident	2 Å²	2	82 Å²	82	1%	0.013	42%	0.421	C	S	.	.	H	α-helix	trans	-61.3	-40.5	177.8	-25.9	35.9	0	0	0	113.1	A951 E952 L955 Y957 S964 R966 I972	A951-P968 HydrophobicContact CB-CB 3.99Å; E952-P968 HydrophobicContact CG-CB 4.05Å; E952-P968 HydrophobicContact CG-CG 3.79Å; L955-P968 HydrophobicContact CD1-CB 3.92Å; L955-P968 WeakPolarHBondContact CD1-O 3.42Å; Y957-P968 HydrophobicContact CD1-CG 4.36Å; Y957-P968 HydrophobicContact CD2-CG 4.12Å; Y957-P968 HydrophobicContact CE2-CG 4.44Å; Y957-P968 HydrophobicContact CG-CG 4.08Å; S964-P968 VanDerWaalsContact O-CD 3.32Å; S964-P968 WeakPolarHBondContact O-CD 3.23Å; R966-P968 VanDerWaalsContact C-CD 3.49Å; P968-I972 WeakPolarHBondContact O-CB 3.35Å; P968-I972 WeakPolarHBondContact O-CG1 3.15Å; P968-I972 PolarHBondContact O-N 2.76Å
969	L	81.7	Confident	73.1	Confident	2 Å²	2	74.8 Å²	74.8	1%	0.01	39%	0.388	C	S	.	.	H	α-helix	trans	-70	-42.9	-179.7	-79.8	174.6	0	0	0	111.8	L934 R948 A951 R966 L967 E971 I972 L973	L934-L969 HydrophobicContact CD1-CD1 3.88Å; L934-L969 HydrophobicContact CD2-CD1 4Å; L934-L969 HydrophobicContact CD2-CD2 3.96Å; L934-L969 HydrophobicContact CG-CD1 3.73Å; R948-L969 HydrophobicContact CG-CD1 3.57Å; R948-L969 HydrophobicContact CG-CG 4.25Å; A951-L969 HydrophobicContact CB-CD2 3.84Å; A951-L969 HydrophobicContact CB-CG 4.24Å; R966-L969 PolarHBondContact O-N 2.7Å; R966-L969 VanDerWaalsContact O-N 3.09Å; L967-L969 VanDerWaalsContact C-N 3.33Å; L967-L969 PolarHBondContact O-N 3.23Å; L969-E971 VanDerWaalsContact C-N 3.34Å; L969-E971 PolarHBondContact O-N 3.38Å; L969-I972 PolarHBondContact O-N 2.56Å; L969-L973 WeakPolarHBondContact O-CG 3.14Å; L969-L973 PolarHBondContact O-N 3.43Å
970	D	81.5	Confident	74.3	Confident	64 Å²	64	75.7 Å²	75.7	34%	0.342	38%	0.378	S	S	.	.	H	α-helix	trans	-60.2	-45.7	177	-69.9	-35.5	0	0	0	110.7	V933 R966 L967 I972 L973 E974	V933-D970 VanDerWaalsContact CG2-OD1 3.26Å; V933-D970 WeakPolarHBondContact CG2-OD1 3.35Å; R966-D970 PolarHBondContact O-N 3.11Å; R966-D970 VanDerWaalsContact O-N 3.1Å; L967-D970 PolarHBondContact O-N 3.43Å; D970-I972 PolarHBondContact O-N 3.14Å; D970-L973 PolarHBondContact O-N 2.74Å; D970-E974 WeakPolarHBondContact O-CG 3.45Å; D970-E974 PolarHBondContact O-N 3.03Å
971	E	83.3	Confident	75.4	Confident	64 Å²	64	75.4 Å²	75.4	30%	0.299	39%	0.385	S	S	.	.	H	α-helix	trans	-65.3	-36.9	177.1	-176.8	171.8	-175.7	0	0	112.4	L955 L967 L969 E974 S975 R978	L955-E971 HydrophobicContact CD1-CB 3.97Å; L955-E971 HydrophobicContact CD1-CG 4.15Å; L955-E971 HydrophobicContact CD2-CG 4.14Å; L967-E971 PolarHBondContact O-N 3.36Å; L969-E971 VanDerWaalsContact C-N 3.34Å; L969-E971 PolarHBondContact O-N 3.38Å; E971-E974 PolarHBondContact O-N 3.28Å; E971-S975 PolarHBondContact O-N 3.3Å; E971-R978 IonicContact OE1-CZ 3.9Å; E971-R978 IonicContact OE1-NH1 2.92Å; E971-R978 PolarHBondContact OE1-NH1 3.03Å; E971-R978 IonicContact OE1-NH2 3.75Å; E971-R978 PolarHBondContact OE1-NH2 2.83Å
972	I	84.1	Confident	76.9	Confident	0 Å²	0	67 Å²	67	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-68.5	-36.5	174.8	-74.7	-67.2	0	0	0	112.1	A951 A954 L955 P968 L969 D970 E974 S975 P976 R978 L979	A951-I972 HydrophobicContact CB-CB 4.39Å; A951-I972 HydrophobicContact CB-CG1 3.79Å; A954-I972 HydrophobicContact CB-CD1 4.11Å; L955-I972 HydrophobicContact CD1-CD1 4.39Å; L955-I972 HydrophobicContact CD1-CG1 3.97Å; L955-I972 HydrophobicContact CD2-CD1 3.89Å; L955-I972 HydrophobicContact CD2-CG1 4.34Å; L955-I972 HydrophobicContact CG-CD1 3.9Å; L955-I972 HydrophobicContact CG-CG1 4Å; P968-I972 WeakPolarHBondContact O-CB 3.35Å; P968-I972 WeakPolarHBondContact O-CG1 3.15Å; P968-I972 PolarHBondContact O-N 2.76Å; L969-I972 PolarHBondContact O-N 2.56Å; D970-I972 PolarHBondContact O-N 3.14Å; I972-E974 VanDerWaalsContact C-N 3.32Å; I972-S975 CarbonylContact O-C 3.55Å; I972-S975 PolarHBondContact O-N 3.34Å; I972-P976 WeakPolarHBondContact O-CA 3.36Å; I972-R978 HydrophobicContact CD1-CB 3.87Å; I972-L979 HydrophobicContact CD1-CD2 4.02Å; I972-L979 HydrophobicContact CD1-CG 4.11Å; I972-L979 HydrophobicContact CG1-CD2 4.47Å; I972-L979 HydrophobicContact CG2-CD1 3.59Å; I972-L979 HydrophobicContact CG2-CD2 3.96Å; I972-L979 HydrophobicContact CG2-CG 3.66Å
973	L	82.4	Confident	78.6	Confident	40 Å²	40	66.8 Å²	66.8	21%	0.209	34%	0.341	C	S	.	.	H	α-helix	trans	-69.2	-31.6	175.9	-73.2	-177.6	0	0	0	112.3	V933 L969 D970 L1010 R1013	V933-L973 HydrophobicContact CG1-CD1 3.25Å; L969-L973 WeakPolarHBondContact O-CG 3.14Å; L969-L973 PolarHBondContact O-N 3.43Å; D970-L973 PolarHBondContact O-N 2.74Å; L973-L1010 HydrophobicContact CD2-CD2 4Å; L973-R1013 HydrophobicContact CD2-CG 4.5Å
974	E	84.6	Confident	80.3	Confident	163 Å²	163	59.2 Å²	59.2	76%	0.762	30%	0.3	S	S	*	.	H	α-helix	trans	-71	-36.8	170.7	-70.6	-175.4	174.1	0	0	112.2	D970 E971 I972	D970-E974 WeakPolarHBondContact O-CG 3.45Å; D970-E974 PolarHBondContact O-N 3.03Å; E971-E974 PolarHBondContact O-N 3.28Å; I972-E974 VanDerWaalsContact C-N 3.32Å
975	S	85.3	Confident	82	Confident	27 Å²	27	60.4 Å²	60.4	19%	0.189	30%	0.304	C	S	.	.			trans	-129.5	67.8	-175.6	-60.3	0	0	0	0	112.6	E971 I972 E977 R978	E971-S975 PolarHBondContact O-N 3.3Å; I972-S975 CarbonylContact O-C 3.55Å; I972-S975 PolarHBondContact O-N 3.34Å; S975-E977 VanDerWaalsContact C-OE2 3.29Å; S975-E977 WeakPolarHBondContact CB-OE1 3.41Å; S975-E977 PolarHBondContact O-N 3.4Å; S975-E977 VanDerWaalsContact O-N 3.13Å; S975-R978 PolarHBondContact O-N 2.72Å
976	P	83.7	Confident	83.4	Confident	27 Å²	27	60.5 Å²	60.5	18%	0.175	31%	0.308	C	S	.	.	G	3₁₀ helix	trans	-67.9	-16.7	-172.1	26.1	-35	0	0	0	113.8	I972 R978 L979 N1011	I972-P976 WeakPolarHBondContact O-CA 3.36Å; P976-R978 PolarHBondContact O-N 3.1Å; P976-L979 PolarHBondContact O-N 2.96Å; P976-N1011 HydrophobicContact CB-CB 4.28Å
977	E	84.6	Confident	84.6	Confident	102 Å²	102	56.2 Å²	56.2	48%	0.477	29%	0.292	S	S	.	.	G	3₁₀ helix	trans	-62.4	-22.7	174.7	70.1	-74	173	0	0	113.5	S975 L979 K980	S975-E977 VanDerWaalsContact C-OE2 3.29Å; S975-E977 WeakPolarHBondContact CB-OE1 3.41Å; S975-E977 PolarHBondContact O-N 3.4Å; S975-E977 VanDerWaalsContact O-N 3.13Å; E977-L979 VanDerWaalsContact C-N 3.25Å; E977-L979 PolarHBondContact O-N 3.42Å; E977-K980 VanDerWaalsContact O-CB 3.26Å; E977-K980 WeakPolarHBondContact O-CB 3.21Å; E977-K980 WeakPolarHBondContact O-CG 3.37Å; E977-K980 PolarHBondContact O-N 3.28Å
978	R	85.5	Confident	85.4	Confident	94 Å²	94	52.5 Å²	52.5	36%	0.355	27%	0.273	S	S	.	.	G	3₁₀ helix	trans	-65.9	-26.3	175.9	-63.5	-168.6	-173.1	-176.1	18.4	112.6	L955 E971 I972 S975 P976 K980 S981	L955-R978 VanDerWaalsContact CD2-CD 3.46Å; E971-R978 IonicContact OE1-CZ 3.9Å; E971-R978 IonicContact OE1-NH1 2.92Å; E971-R978 PolarHBondContact OE1-NH1 3.03Å; E971-R978 IonicContact OE1-NH2 3.75Å; E971-R978 PolarHBondContact OE1-NH2 2.83Å; I972-R978 HydrophobicContact CD1-CB 3.87Å; S975-R978 PolarHBondContact O-N 2.72Å; P976-R978 PolarHBondContact O-N 3.1Å; R978-K980 PolarHBondContact O-N 3.13Å; R978-K980 VanDerWaalsContact O-N 3.13Å; R978-S981 PolarHBondContact O-N 2.83Å; R978-S981 PolarHBondContact O-OG 3.33Å
979	L	83.7	Confident	86	Confident	2 Å²	2	59.2 Å²	59.2	1%	0.01	31%	0.305	C	S	.	.	G	3₁₀ helix	trans	-67.2	-12.5	172.5	-66.8	173.9	0	0	0	113.4	A954 I972 P976 E977 R1007 L1010	A954-L979 HydrophobicContact CB-CD2 3.96Å; I972-L979 HydrophobicContact CD1-CD2 4.02Å; I972-L979 HydrophobicContact CD1-CG 4.11Å; I972-L979 HydrophobicContact CG1-CD2 4.47Å; I972-L979 HydrophobicContact CG2-CD1 3.59Å; I972-L979 HydrophobicContact CG2-CD2 3.96Å; I972-L979 HydrophobicContact CG2-CG 3.66Å; P976-L979 PolarHBondContact O-N 2.96Å; E977-L979 VanDerWaalsContact C-N 3.25Å; E977-L979 PolarHBondContact O-N 3.42Å; L979-R1007 HydrophobicContact CB-CG 3.93Å; L979-R1007 HydrophobicContact CD1-CG 4.25Å; L979-L1010 HydrophobicContact CD1-CB 3.75Å; L979-L1010 HydrophobicContact CD1-CD1 3.89Å; L979-L1010 HydrophobicContact CD1-CG 4.49Å
980	K	84.6	Confident	86.3	Confident	147 Å²	147	63.2 Å²	63.2	64%	0.639	32%	0.323	S	S	*	.	G	3₁₀ helix	trans	-77.7	-21.5	178.4	-63.1	175.4	-177.4	163.5	0	113	E977 R978 L982	E977-K980 VanDerWaalsContact O-CB 3.26Å; E977-K980 WeakPolarHBondContact O-CB 3.21Å; E977-K980 WeakPolarHBondContact O-CG 3.37Å; E977-K980 PolarHBondContact O-N 3.28Å; R978-K980 PolarHBondContact O-N 3.13Å; R978-K980 VanDerWaalsContact O-N 3.13Å; K980-L982 VanDerWaalsContact C-N 3.32Å
981	S	83	Confident	86.5	Confident	98 Å²	98	60.5 Å²	60.5	69%	0.685	31%	0.309	S	S	*	.	S	Bend	trans	-79.3	-17.3	176	43.8	0	0	0	0	113	R978	R978-S981 PolarHBondContact O-N 2.83Å; R978-S981 PolarHBondContact O-OG 3.33Å
982	L	86.9	Confident	86.7	Confident	28 Å²	28	62 Å²	62	15%	0.147	32%	0.317	C	S	.	.	S	Bend	trans	-76.3	125.7	178.5	-172.1	65.5	0	0	0	111.3	M950 D953 A954 K980 L984	M950-L982 HydrophobicContact CB-CD2 4.2Å; M950-L982 HydrophobicContact CG-CD2 4.34Å; D953-L982 HydrophobicContact CB-CD1 4.05Å; A954-L982 HydrophobicContact CB-CB 4.41Å; K980-L982 VanDerWaalsContact C-N 3.32Å; L982-L984 HydrophobicContact CD2-CD2 3.77Å; L982-L984 HydrophobicContact CG-CD2 4.09Å; L982-L984 PolarHBondContact O-N 2.83Å
983	D	90.4	Very high	87	Confident	100 Å²	100	71.9 Å²	71.9	54%	0.535	35%	0.354	S	S	.	.			trans	-79.3	95	171.7	-170.6	-21	0	0	0	110	D985 A986 F987	D983-D985 VanDerWaalsContact C-N 3.25Å; D983-D985 PolarHBondContact O-N 3.4Å; D983-D985 PolarHBondContact OD1-N 3.34Å; D983-D985 VanDerWaalsContact OD1-N 3.09Å; D983-A986 HydrophobicContact CB-CB 4.08Å; D983-A986 PolarHBondContact O-N 3.21Å; D983-A986 PolarHBondContact OD1-N 3.04Å; D983-A986 VanDerWaalsContact OD1-N 3.15Å; D983-F987 WeakPolarHBondContact O-CB 3.37Å; D983-F987 PolarHBondContact O-N 2.99Å
984	L	88.7	Confident	87.3	Confident	3 Å²	3	75 Å²	75	2%	0.016	37%	0.367	C	S	.	.	H	α-helix	trans	-67	-25.4	-178.4	-61.5	-175.4	0	0	0	113.3	M950 L982 A988 Y1004 R1007	M950-L984 HydrophobicContact CE-CD2 3.71Å; L982-L984 HydrophobicContact CD2-CD2 3.77Å; L982-L984 HydrophobicContact CG-CD2 4.09Å; L982-L984 PolarHBondContact O-N 2.83Å; L984-A988 VanDerWaalsContact O-CB 3.27Å; L984-A988 WeakPolarHBondContact O-CB 3.39Å; L984-A988 PolarHBondContact O-N 2.84Å; L984-Y1004 HydrophobicContact CB-CE1 4.43Å; L984-Y1004 HydrophobicContact CB-CE2 4.3Å; L984-Y1004 HydrophobicContact CD1-CD1 3.68Å; L984-Y1004 HydrophobicContact CD1-CE1 3.84Å; L984-Y1004 HydrophobicContact CD1-CG 4.03Å; L984-R1007 HydrophobicContact CD1-CB 4.06Å
985	D	91.1	Very high	87.2	Confident	61 Å²	61	70 Å²	70	33%	0.326	36%	0.361	S	S	.	.	H	α-helix	trans	-73.4	-45.3	179.7	-64.2	-19.7	0	0	0	109.3	D983 A988 E989 Q1000 Y1004	D983-D985 VanDerWaalsContact C-N 3.25Å; D983-D985 PolarHBondContact O-N 3.4Å; D983-D985 PolarHBondContact OD1-N 3.34Å; D983-D985 VanDerWaalsContact OD1-N 3.09Å; D985-A988 PolarHBondContact O-N 2.91Å; D985-E989 WeakPolarHBondContact O-CG 3.42Å; D985-E989 PolarHBondContact O-N 2.96Å; D985-Q1000 PolarHBondContact OD1-NE2 3.42Å; D985-Y1004 VanDerWaalsContact OD1-CE2 3.29Å; D985-Y1004 WeakPolarHBondContact OD1-CE2 3.49Å; D985-Y1004 PolarHBondContact OD1-OH 3.35Å; D985-Y1004 PolarHBondContact OD2-OH 3.28Å
986	A	91	Very high	87	Confident	50 Å²	50	73.7 Å²	73.7	41%	0.413	37%	0.373	S	S	.	.	H	α-helix	trans	-63.2	-41	173.5	0	0	0	0	0	112.3	D983 E989 E990	D983-A986 HydrophobicContact CB-CB 4.08Å; D983-A986 PolarHBondContact O-N 3.21Å; D983-A986 PolarHBondContact OD1-N 3.04Å; D983-A986 VanDerWaalsContact OD1-N 3.15Å; A986-E989 PolarHBondContact O-N 3.46Å; A986-E990 PolarHBondContact O-N 3.01Å; A986-E990 VanDerWaalsContact O-N 3.13Å
987	F	89.5	Confident	86.9	Confident	24 Å²	24	73.7 Å²	73.7	11%	0.105	38%	0.378	C	S	.	.	H	α-helix	trans	-62.2	-42.9	175.7	-173.8	-97	0	0	0	111.7	K949 M950 D953 D983 E990 L991 L1003	K949-F987 HydrophobicContact CB-CZ 4.04Å; M950-F987 HydrophobicContact CG-CD1 4.29Å; M950-F987 HydrophobicContact CG-CE1 3.7Å; M950-F987 HydrophobicContact CG-CZ 3.99Å; D953-F987 WeakPolarHBondContact OD2-CD2 3.45Å; D953-F987 WeakPolarHBondContact OD2-CE2 3.18Å; D983-F987 WeakPolarHBondContact O-CB 3.37Å; D983-F987 PolarHBondContact O-N 2.99Å; F987-E990 PolarHBondContact O-N 3.29Å; F987-L991 HydrophobicContact CD1-CD1 4.03Å; F987-L991 HydrophobicContact CD1-CG 4.38Å; F987-L991 HydrophobicContact CE1-CD1 3.64Å; F987-L991 HydrophobicContact CE1-CG 4.14Å; F987-L991 HydrophobicContact CZ-CD1 4.41Å; F987-L991 PolarHBondContact O-N 3.02Å; F987-L991 VanDerWaalsContact O-N 3.08Å; F987-L1003 HydrophobicContact CD1-CD1 3.7Å; F987-L1003 HydrophobicContact CD1-CD2 3.85Å; F987-L1003 HydrophobicContact CD1-CG 4.41Å; F987-L1003 HydrophobicContact CE1-CD1 4.29Å; F987-L1003 HydrophobicContact CE1-CD2 3.66Å
988	A	88.7	Confident	86.9	Confident	4 Å²	4	71.9 Å²	71.9	3%	0.033	37%	0.372	C	S	.	.	H	α-helix	trans	-63.9	-40.4	176.5	0	0	0	0	0	112.8	L984 D985 E990 L991 M992 Q1000 L1003	L984-A988 VanDerWaalsContact O-CB 3.27Å; L984-A988 WeakPolarHBondContact O-CB 3.39Å; L984-A988 PolarHBondContact O-N 2.84Å; D985-A988 PolarHBondContact O-N 2.91Å; A988-E990 VanDerWaalsContact C-N 3.32Å; A988-E990 PolarHBondContact O-N 3.5Å; A988-L991 PolarHBondContact O-N 3.34Å; A988-M992 PolarHBondContact O-N 3.22Å; A988-Q1000 HydrophobicContact CB-CB 3.98Å; A988-Q1000 HydrophobicContact CB-CG 4.32Å; A988-L1003 HydrophobicContact CB-CD1 3.69Å
989	E	91.1	Very high	86.9	Confident	144 Å²	144	68.9 Å²	68.9	67%	0.673	36%	0.362	S	S	*	.	H	α-helix	trans	-62.3	-38.7	176.1	-75.9	-175.7	179.7	0	0	112	D985 A986 M992 R993	D985-E989 WeakPolarHBondContact O-CG 3.42Å; D985-E989 PolarHBondContact O-N 2.96Å; A986-E989 PolarHBondContact O-N 3.46Å; E989-M992 PolarHBondContact O-N 3Å; E989-R993 WeakPolarHBondContact O-CB 3.4Å; E989-R993 PolarHBondContact O-N 3.48Å
990	E	88.1	Confident	87.2	Confident	86 Å²	86	72.4 Å²	72.4	40%	0.402	38%	0.379	S	S	.	.	H	α-helix	trans	-68.8	-41.9	176.8	-173.7	55	-148	0	0	111.8	A986 F987 A988 M992 R993 Q994	A986-E990 PolarHBondContact O-N 3.01Å; A986-E990 VanDerWaalsContact O-N 3.13Å; F987-E990 PolarHBondContact O-N 3.29Å; A988-E990 VanDerWaalsContact C-N 3.32Å; A988-E990 PolarHBondContact O-N 3.5Å; E990-M992 VanDerWaalsContact C-N 3.29Å; E990-M992 PolarHBondContact O-N 2.89Å; E990-R993 WeakPolarHBondContact O-CB 3.28Å; E990-R993 PolarHBondContact O-N 3.25Å; E990-R993 VanDerWaalsContact O-N 3.13Å; E990-Q994 WeakPolarHBondContact O-CG 3.06Å; E990-Q994 PolarHBondContact O-N 3Å; E990-Q994 PolarHBondContact OE1-NE2 3.5Å; E990-Q994 VanDerWaalsContact OE1-NE2 3.08Å
991	L	87	Confident	87.5	Confident	6 Å²	6	67.6 Å²	67.6	3%	0.031	36%	0.359	C	S	.	.	H	α-helix	trans	-59.1	-41.3	172.4	-70.6	-176.8	0	0	0	112.1	W946 F987 A988 R993 Q994 G995 F996 M999 L1003	W946-L991 HydrophobicContact CD2-CD1 4.29Å; W946-L991 HydrophobicContact CE3-CD1 4.06Å; W946-L991 HydrophobicContact CE3-CD2 3.63Å; W946-L991 HydrophobicContact CH2-CD2 3.94Å; W946-L991 HydrophobicContact CZ3-CD1 4.49Å; W946-L991 HydrophobicContact CZ3-CD2 3.3Å; F987-L991 HydrophobicContact CD1-CD1 4.03Å; F987-L991 HydrophobicContact CD1-CG 4.38Å; F987-L991 HydrophobicContact CE1-CD1 3.64Å; F987-L991 HydrophobicContact CE1-CG 4.14Å; F987-L991 HydrophobicContact CZ-CD1 4.41Å; F987-L991 PolarHBondContact O-N 3.02Å; F987-L991 VanDerWaalsContact O-N 3.08Å; A988-L991 PolarHBondContact O-N 3.34Å; L991-R993 VanDerWaalsContact C-N 3.34Å; L991-Q994 PolarHBondContact O-N 3.47Å; L991-G995 PolarHBondContact O-N 3.29Å; L991-F996 HydrophobicContact CD2-CD2 4.19Å; L991-F996 PolarHBondContact O-N 3.39Å; L991-M999 HydrophobicContact CD1-CB 4.48Å; L991-L1003 HydrophobicContact CD1-CD1 4.33Å; L991-L1003 HydrophobicContact CD1-CD2 4.42Å
992	M	87.3	Confident	87.9	Confident	95 Å²	95	63.5 Å²	63.5	47%	0.468	33%	0.33	S	S	.	.	H	α-helix	trans	-63.7	-41.5	175.4	-175.7	179.9	-65.7	0	0	111.4	A988 E989 E990 Q994 G995 G997 N998	A988-M992 PolarHBondContact O-N 3.22Å; E989-M992 PolarHBondContact O-N 3Å; E990-M992 VanDerWaalsContact C-N 3.29Å; E990-M992 PolarHBondContact O-N 2.89Å; M992-Q994 VanDerWaalsContact C-N 3.3Å; M992-Q994 PolarHBondContact O-N 2.8Å; M992-G995 PolarHBondContact O-N 3.23Å; M992-G995 VanDerWaalsContact O-N 3.08Å; M992-G997 WeakPolarHBondContact CA-O 3.38Å; M992-N998 HydrophobicContact CE-CB 3.4Å; M992-N998 VanDerWaalsContact CE-CB 3.4Å
993	R	90.5	Very high	88.1	Confident	208 Å²	208	62.2 Å²	62.2	79%	0.785	32%	0.323	S	S	*	.	H	α-helix	trans	-63.4	-35.1	177.5	-173.9	-178.2	179.6	156.6	-1.5	112.6	E989 E990 L991 G995	E989-R993 WeakPolarHBondContact O-CB 3.4Å; E989-R993 PolarHBondContact O-N 3.48Å; E990-R993 WeakPolarHBondContact O-CB 3.28Å; E990-R993 PolarHBondContact O-N 3.25Å; E990-R993 VanDerWaalsContact O-N 3.13Å; L991-R993 VanDerWaalsContact C-N 3.34Å; R993-G995 PolarHBondContact O-N 2.92Å
994	Q	87.5	Confident	88.2	Confident	105 Å²	105	61.1 Å²	61.1	49%	0.491	31%	0.312	S	S	.	.	H	α-helix	trans	-75	-10.2	175.6	-68.1	175.3	8.9	0	0	113.2	E990 L991 M992 F996	E990-Q994 WeakPolarHBondContact O-CG 3.06Å; E990-Q994 PolarHBondContact O-N 3Å; E990-Q994 PolarHBondContact OE1-NE2 3.5Å; E990-Q994 VanDerWaalsContact OE1-NE2 3.08Å; L991-Q994 PolarHBondContact O-N 3.47Å; M992-Q994 VanDerWaalsContact C-N 3.3Å; M992-Q994 PolarHBondContact O-N 2.8Å; Q994-F996 HydrophobicContact CB-CD2 3.66Å; Q994-F996 HydrophobicContact CB-CE2 3.67Å
995	G	84.2	Confident	88.4	Confident	60 Å²	60	63.7 Å²	63.7	62%	0.619	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	95.1	11.5	175.5	0	0	0	0	0	114.8	L991 M992 R993 G997	L991-G995 PolarHBondContact O-N 3.29Å; M992-G995 PolarHBondContact O-N 3.23Å; M992-G995 VanDerWaalsContact O-N 3.08Å; R993-G995 PolarHBondContact O-N 2.92Å; G995-G997 VanDerWaalsContact C-N 3.29Å; G995-G997 PolarHBondContact O-N 2.93Å
996	F	81.2	Confident	88.4	Confident	103 Å²	103	61 Å²	61	45%	0.452	31%	0.312	S	S	.	.	S	Bend	trans	-80.7	-7.4	177.9	-63.4	-70	0	0	0	113.8	W946 L991 Q994	W946-F996 HydrophobicContact CH2-CB 4.21Å; W946-F996 AromaticContact CH2-CD1 3.59Å; W946-F996 HydrophobicContact CH2-CD1 3.59Å; W946-F996 AromaticContact CH2-CD2 3.59Å; W946-F996 HydrophobicContact CH2-CD2 3.59Å; W946-F996 AromaticContact CH2-CE1 3.75Å; W946-F996 HydrophobicContact CH2-CE1 3.75Å; W946-F996 AromaticContact CH2-CE2 3.75Å; W946-F996 HydrophobicContact CH2-CE2 3.75Å; W946-F996 AromaticContact CH2-CG 3.51Å; W946-F996 HydrophobicContact CH2-CG 3.51Å; W946-F996 AromaticContact CH2-CZ 3.83Å; W946-F996 HydrophobicContact CH2-CZ 3.83Å; W946-F996 HydrophobicContact CZ2-CB 4.05Å; W946-F996 AromaticContact CZ2-CD1 3.6Å; W946-F996 HydrophobicContact CZ2-CD1 3.6Å; W946-F996 HydrophobicContact CZ2-CD2 4.26Å; W946-F996 HydrophobicContact CZ2-CE1 4.08Å; W946-F996 AromaticContact CZ2-CG 3.71Å; W946-F996 HydrophobicContact CZ2-CG 3.71Å; W946-F996 HydrophobicContact CZ3-CD2 4.36Å; W946-F996 HydrophobicContact CZ3-CE2 4.46Å; L991-F996 HydrophobicContact CD2-CD2 4.19Å; L991-F996 PolarHBondContact O-N 3.39Å; Q994-F996 HydrophobicContact CB-CD2 3.66Å; Q994-F996 HydrophobicContact CB-CE2 3.67Å
997	G	81.3	Confident	88.5	Confident	27 Å²	27	62.1 Å²	62.1	28%	0.278	31%	0.305	S	S	.	.			trans	93.7	-175.8	179.6	0	0	0	0	0	113.6	M992 G995	M992-G997 WeakPolarHBondContact CA-O 3.38Å; G995-G997 VanDerWaalsContact C-N 3.29Å; G995-G997 PolarHBondContact O-N 2.93Å
998	N	83.9	Confident	88.5	Confident	64 Å²	64	63.8 Å²	63.8	34%	0.342	32%	0.324	S	S	.	.			trans	-82.9	122.3	176.6	-168.7	-3.1	0	0	0	109.6	E266 M992 Q1000	E266-N998 WeakPolarHBondContact CG-O 3.21Å; M992-N998 HydrophobicContact CE-CB 3.4Å; M992-N998 VanDerWaalsContact CE-CB 3.4Å; N998-Q1000 WeakPolarHBondContact OD1-CB 3.45Å; N998-Q1000 PolarHBondContact OD1-N 2.82Å; N998-Q1000 VanDerWaalsContact OD1-N 3.13Å
999	M	85.5	Confident	88.7	Confident	32 Å²	32	64.3 Å²	64.3	16%	0.158	33%	0.325	C	S	.	.			trans	-125.6	13.4	179.2	-66.1	-63.4	-73.8	0	0	112.8	T943 L991 I1001 T1002 L1003	T943-M999 HydrophobicContact CG2-CE 3.83Å; L991-M999 HydrophobicContact CD1-CB 4.48Å; M999-I1001 PolarHBondContact O-N 3.22Å; M999-T1002 HydrophobicContact CE-CG2 3.65Å; M999-T1002 PolarHBondContact O-N 3.14Å; M999-L1003 HydrophobicContact CB-CD1 4.37Å; M999-L1003 HydrophobicContact CB-CG 4.34Å; M999-L1003 VanDerWaalsContact O-CG 3.26Å; M999-L1003 WeakPolarHBondContact O-CG 3.41Å; M999-L1003 PolarHBondContact O-N 3.29Å
1000	Q	89.8	Confident	88.6	Confident	76 Å²	76	57.8 Å²	57.8	36%	0.355	30%	0.295	S	S	.	.	H	α-helix	trans	-53.5	-49.1	-170.5	-170.7	-179.9	10	0	0	112.6	D985 A988 N998 L1003 Y1004	D985-Q1000 PolarHBondContact OD1-NE2 3.42Å; A988-Q1000 HydrophobicContact CB-CB 3.98Å; A988-Q1000 HydrophobicContact CB-CG 4.32Å; N998-Q1000 WeakPolarHBondContact OD1-CB 3.45Å; N998-Q1000 PolarHBondContact OD1-N 2.82Å; N998-Q1000 VanDerWaalsContact OD1-N 3.13Å; Q1000-L1003 PolarHBondContact O-N 3.49Å; Q1000-Y1004 HydrophobicContact CG-CD2 4.3Å; Q1000-Y1004 HydrophobicContact CG-CE2 3.98Å; Q1000-Y1004 WeakPolarHBondContact O-CD2 3.38Å; Q1000-Y1004 PolarHBondContact O-N 3.46Å
1001	I	91.4	Very high	88.6	Confident	45 Å²	45	56.7 Å²	56.7	23%	0.231	29%	0.292	C	S	.	.	H	α-helix	trans	-66.1	-45.8	-178.5	-57.4	178.2	0	0	0	110.7	K265 E266 Q269 M999 L1003 Y1004 D1005	K265-I1001 HydrophobicContact CB-CB 4.38Å; K265-I1001 HydrophobicContact CB-CD1 4.27Å; K265-I1001 HydrophobicContact CB-CG2 3.84Å; K265-I1001 HydrophobicContact CD-CG2 3.82Å; E266-I1001 HydrophobicContact CG-CB 4.23Å; E266-I1001 HydrophobicContact CG-CG1 4.4Å; Q269-I1001 HydrophobicContact CB-CD1 4.2Å; M999-I1001 PolarHBondContact O-N 3.22Å; I1001-L1003 VanDerWaalsContact C-N 3.28Å; I1001-L1003 PolarHBondContact O-N 2.85Å; I1001-Y1004 WeakPolarHBondContact O-CB 3.06Å; I1001-Y1004 PolarHBondContact O-N 2.94Å; I1001-Y1004 VanDerWaalsContact O-N 3.11Å; I1001-D1005 PolarHBondContact O-N 2.95Å
1002	T	90.3	Very high	88.6	Confident	12 Å²	12	61 Å²	61	7%	0.074	31%	0.312	C	S	.	.	H	α-helix	trans	-56.8	-40.9	177.6	-66.8	0	0	0	0	111.8	E266 T943 M999 Y1004 D1005 I1006	E266-T1002 WeakPolarHBondContact OE1-CB 3.43Å; E266-T1002 PolarHBondContact OE1-N 3.35Å; E266-T1002 PolarHBondContact OE1-OG1 3.19Å; T943-T1002 HydrophobicContact CG2-CG2 4.21Å; M999-T1002 HydrophobicContact CE-CG2 3.65Å; M999-T1002 PolarHBondContact O-N 3.14Å; T1002-Y1004 PolarHBondContact O-N 3.42Å; T1002-D1005 PolarHBondContact O-N 3.06Å; T1002-I1006 HydrophobicContact CG2-CD1 3.84Å; T1002-I1006 HydrophobicContact CG2-CG1 4.28Å; T1002-I1006 VanDerWaalsContact O-CG1 3.27Å; T1002-I1006 WeakPolarHBondContact O-CG1 3.47Å; T1002-I1006 PolarHBondContact O-N 2.83Å
1003	L	92.1	Very high	88.6	Confident	1 Å²	1	60.5 Å²	60.5	1%	0.005	31%	0.305	C	S	.	.	H	α-helix	trans	-64.9	-38.8	177.6	-63.9	164.4	0	0	0	112.2	M950 F987 A988 L991 M999 Q1000 I1001 D1005 I1006 R1007	M950-L1003 HydrophobicContact CG-CD2 3.95Å; M950-L1003 HydrophobicContact SD-CB 4.31Å; M950-L1003 HydrophobicContact SD-CD2 3.31Å; M950-L1003 WeakPolarHBondContact SD-CD2 3.39Å; M950-L1003 HydrophobicContact SD-CG 4.4Å; F987-L1003 HydrophobicContact CD1-CD1 3.7Å; F987-L1003 HydrophobicContact CD1-CD2 3.85Å; F987-L1003 HydrophobicContact CD1-CG 4.41Å; F987-L1003 HydrophobicContact CE1-CD1 4.29Å; F987-L1003 HydrophobicContact CE1-CD2 3.66Å; A988-L1003 HydrophobicContact CB-CD1 3.69Å; L991-L1003 HydrophobicContact CD1-CD1 4.33Å; L991-L1003 HydrophobicContact CD1-CD2 4.42Å; M999-L1003 HydrophobicContact CB-CD1 4.37Å; M999-L1003 HydrophobicContact CB-CG 4.34Å; M999-L1003 VanDerWaalsContact O-CG 3.26Å; M999-L1003 WeakPolarHBondContact O-CG 3.41Å; M999-L1003 PolarHBondContact O-N 3.29Å; Q1000-L1003 PolarHBondContact O-N 3.49Å; I1001-L1003 VanDerWaalsContact C-N 3.28Å; I1001-L1003 PolarHBondContact O-N 2.85Å; L1003-D1005 VanDerWaalsContact C-N 3.35Å; L1003-I1006 PolarHBondContact O-N 3.26Å; L1003-R1007 WeakPolarHBondContact O-CB 3.2Å; L1003-R1007 PolarHBondContact O-N 2.84Å
1004	Y	92.9	Very high	88.5	Confident	78 Å²	78	52.4 Å²	52.4	31%	0.306	28%	0.275	S	S	.	.	H	α-helix	trans	-65	-38.5	173.2	-81	-73.9	0	0	0	112.3	L984 D985 Q1000 I1001 T1002 R1007 A1008	L984-Y1004 HydrophobicContact CB-CE1 4.43Å; L984-Y1004 HydrophobicContact CB-CE2 4.3Å; L984-Y1004 HydrophobicContact CD1-CD1 3.68Å; L984-Y1004 HydrophobicContact CD1-CE1 3.84Å; L984-Y1004 HydrophobicContact CD1-CG 4.03Å; D985-Y1004 VanDerWaalsContact OD1-CE2 3.29Å; D985-Y1004 WeakPolarHBondContact OD1-CE2 3.49Å; D985-Y1004 PolarHBondContact OD1-OH 3.35Å; D985-Y1004 PolarHBondContact OD2-OH 3.28Å; Q1000-Y1004 HydrophobicContact CG-CD2 4.3Å; Q1000-Y1004 HydrophobicContact CG-CE2 3.98Å; Q1000-Y1004 WeakPolarHBondContact O-CD2 3.38Å; Q1000-Y1004 PolarHBondContact O-N 3.46Å; I1001-Y1004 WeakPolarHBondContact O-CB 3.06Å; I1001-Y1004 PolarHBondContact O-N 2.94Å; I1001-Y1004 VanDerWaalsContact O-N 3.11Å; T1002-Y1004 PolarHBondContact O-N 3.42Å; Y1004-R1007 VanDerWaalsContact CE1-NH2 3.31Å; Y1004-A1008 WeakPolarHBondContact O-CB 3.4Å; Y1004-A1008 PolarHBondContact O-N 3.48Å
1005	D	91.9	Very high	88.5	Confident	57 Å²	57	51.9 Å²	51.9	31%	0.305	27%	0.271	S	S	.	.	H	α-helix	trans	-66.7	-44	175.4	-74.9	-30	0	0	0	111.5	K265 I1001 T1002 L1003 R1007 A1008 E1009	K265-D1005 WeakPolarHBondContact CD-OD2 3.45Å; K265-D1005 WeakPolarHBondContact CE-OD2 3.17Å; K265-D1005 IonicContact NZ-OD1 2.69Å; K265-D1005 PolarHBondContact NZ-OD1 3.08Å; K265-D1005 IonicContact NZ-OD2 2.76Å; K265-D1005 PolarHBondContact NZ-OD2 3.27Å; I1001-D1005 PolarHBondContact O-N 2.95Å; T1002-D1005 PolarHBondContact O-N 3.06Å; L1003-D1005 VanDerWaalsContact C-N 3.35Å; D1005-R1007 PolarHBondContact O-N 3.43Å; D1005-A1008 PolarHBondContact O-N 2.93Å; D1005-E1009 WeakPolarHBondContact O-CB 3.42Å; D1005-E1009 PolarHBondContact O-N 3.35Å
1006	I	91.5	Very high	88.8	Confident	5 Å²	5	51.5 Å²	51.5	3%	0.026	25%	0.254	C	S	.	.	H	α-helix	trans	-57.5	-50.7	174.3	-70.1	167.7	0	0	0	109.8	V939 A947 M950 T1002 L1003 A1008 E1009 L1010	V939-I1006 HydrophobicContact CG1-CD1 4.46Å; V939-I1006 HydrophobicContact CG1-CG1 4.15Å; V939-I1006 HydrophobicContact CG2-CG1 4.16Å; V939-I1006 HydrophobicContact CG2-CG2 4.28Å; A947-I1006 HydrophobicContact CB-CG2 3.84Å; M950-I1006 HydrophobicContact CE-CB 4.35Å; M950-I1006 HydrophobicContact CE-CG2 4Å; M950-I1006 HydrophobicContact SD-CB 4.17Å; M950-I1006 HydrophobicContact SD-CD1 4.34Å; M950-I1006 HydrophobicContact SD-CG2 3.78Å; T1002-I1006 HydrophobicContact CG2-CD1 3.84Å; T1002-I1006 HydrophobicContact CG2-CG1 4.28Å; T1002-I1006 VanDerWaalsContact O-CG1 3.27Å; T1002-I1006 WeakPolarHBondContact O-CG1 3.47Å; T1002-I1006 PolarHBondContact O-N 2.83Å; L1003-I1006 PolarHBondContact O-N 3.26Å; I1006-A1008 VanDerWaalsContact C-N 3.3Å; I1006-A1008 PolarHBondContact O-N 3.34Å; I1006-E1009 PolarHBondContact O-N 2.83Å; I1006-L1010 HydrophobicContact CG2-CD1 3.86Å; I1006-L1010 HydrophobicContact CG2-CG 4.22Å; I1006-L1010 WeakPolarHBondContact O-CG 3.37Å; I1006-L1010 PolarHBondContact O-N 3.43Å
1007	R	92.6	Very high	89.2	Confident	73 Å²	73	51.2 Å²	51.2	28%	0.275	26%	0.257	S	S	.	.	H	α-helix	trans	-58.2	-42.9	177.3	-177.4	-177.5	68.7	-177.8	6	112	M950 L979 L984 L1003 Y1004 D1005 E1009 N1011	M950-R1007 HydrophobicContact CE-CB 4.23Å; L979-R1007 HydrophobicContact CB-CG 3.93Å; L979-R1007 HydrophobicContact CD1-CG 4.25Å; L984-R1007 HydrophobicContact CD1-CB 4.06Å; L1003-R1007 WeakPolarHBondContact O-CB 3.2Å; L1003-R1007 PolarHBondContact O-N 2.84Å; Y1004-R1007 VanDerWaalsContact CE1-NH2 3.31Å; D1005-R1007 PolarHBondContact O-N 3.43Å; R1007-E1009 VanDerWaalsContact C-N 3.34Å; R1007-N1011 VanDerWaalsContact O-CB 3.29Å; R1007-N1011 WeakPolarHBondContact O-CB 3.11Å; R1007-N1011 PolarHBondContact O-N 2.75Å
1008	A	90.8	Very high	89.8	Confident	59 Å²	59	50.7 Å²	50.7	49%	0.488	25%	0.247	S	C	.	.	H	α-helix	trans	-64.6	-40	179.8	0	0	0	0	0	112	Y1004 D1005 I1006 Q1012	Y1004-A1008 WeakPolarHBondContact O-CB 3.4Å; Y1004-A1008 PolarHBondContact O-N 3.48Å; D1005-A1008 PolarHBondContact O-N 2.93Å; I1006-A1008 VanDerWaalsContact C-N 3.3Å; I1006-A1008 PolarHBondContact O-N 3.34Å; A1008-Q1012 PolarHBondContact O-N 3.21Å
1009	E	91.6	Very high	90.2	Very high	15 Å²	15	51.2 Å²	51.2	7%	0.07	25%	0.247	C	C	.	.	H	α-helix	trans	-70.9	-44.3	178.5	-173.5	65.3	-169.2	0	0	112	R938 V939 D1005 I1006 R1007 N1011 Q1012 R1013 Y1014	R938-E1009 HydrophobicContact CB-CG 4.14Å; R938-E1009 IonicContact CZ-OE2 2.71Å; R938-E1009 VanDerWaalsContact CZ-OE2 3.27Å; R938-E1009 PolarHBondContact N-OE1 2.94Å; R938-E1009 IonicContact NE-OE1 2.62Å; R938-E1009 PolarHBondContact NE-OE1 2.89Å; R938-E1009 IonicContact NE-OE2 3.81Å; R938-E1009 PolarHBondContact NE-OE2 3.08Å; R938-E1009 IonicContact NH2-OE1 3.58Å; R938-E1009 IonicContact NH2-OE2 3.56Å; R938-E1009 PolarHBondContact NH2-OE2 2.94Å; V939-E1009 HydrophobicContact CG2-CG 4.41Å; D1005-E1009 WeakPolarHBondContact O-CB 3.42Å; D1005-E1009 PolarHBondContact O-N 3.35Å; I1006-E1009 PolarHBondContact O-N 2.83Å; R1007-E1009 VanDerWaalsContact C-N 3.34Å; E1009-N1011 PolarHBondContact O-N 2.98Å; E1009-Q1012 CarbonylContact O-C 3.57Å; E1009-Q1012 PolarHBondContact O-N 3.41Å; E1009-R1013 VanDerWaalsContact O-CA 3.3Å; E1009-R1013 WeakPolarHBondContact O-CA 3.23Å; E1009-R1013 PolarHBondContact O-N 3.36Å; E1009-Y1014 PolarHBondContact OE1-N 3.3Å
1010	L	89.1	Confident	90.4	Very high	6 Å²	6	53.9 Å²	53.9	3%	0.031	27%	0.267	C	S	.	.	H	α-helix	trans	-62.8	-33.1	175.2	-68.1	179.5	0	0	0	112.1	L934 L973 L979 I1006	L934-L1010 HydrophobicContact CD2-CD2 3.85Å; L973-L1010 HydrophobicContact CD2-CD2 4Å; L979-L1010 HydrophobicContact CD1-CB 3.75Å; L979-L1010 HydrophobicContact CD1-CD1 3.89Å; L979-L1010 HydrophobicContact CD1-CG 4.49Å; I1006-L1010 HydrophobicContact CG2-CD1 3.86Å; I1006-L1010 HydrophobicContact CG2-CG 4.22Å; I1006-L1010 WeakPolarHBondContact O-CG 3.37Å; I1006-L1010 PolarHBondContact O-N 3.43Å
1011	N	88.7	Confident	90.5	Very high	64 Å²	64	52.9 Å²	52.9	34%	0.342	26%	0.261	S	S	.	.	H	α-helix	trans	-70.8	-34.4	176.1	178.4	71.8	0	0	0	113.1	P976 R1007 E1009	P976-N1011 HydrophobicContact CB-CB 4.28Å; R1007-N1011 VanDerWaalsContact O-CB 3.29Å; R1007-N1011 WeakPolarHBondContact O-CB 3.11Å; R1007-N1011 PolarHBondContact O-N 2.75Å; E1009-N1011 PolarHBondContact O-N 2.98Å
1012	Q	86.8	Confident	90.4	Very high	95 Å²	95	59.9 Å²	59.9	44%	0.444	29%	0.285	S	S	.	.	S	Bend	trans	-149	89	176.4	-66.5	-171.4	-54	0	0	110.9	A1008 E1009 K1015	A1008-Q1012 PolarHBondContact O-N 3.21Å; E1009-Q1012 CarbonylContact O-C 3.57Å; E1009-Q1012 PolarHBondContact O-N 3.41Å; Q1012-K1015 HydrophobicContact CB-CB 4.07Å; Q1012-K1015 HydrophobicContact CB-CD 4.23Å; Q1012-K1015 WeakPolarHBondContact O-CB 3.45Å; Q1012-K1015 PolarHBondContact O-N 2.92Å; Q1012-K1015 VanDerWaalsContact OE1-CD 3.3Å
1013	R	87.2	Confident	90.3	Very high	85 Å²	85	62.7 Å²	62.7	32%	0.321	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	136	-177.8	-65.3	-177.7	-71.2	154.6	0.6	111.4	S921 S936 L973 E1009 K1015	S921-R1013 PolarHBondContact OG-NH1 3.02Å; S936-R1013 WeakPolarHBondContact O-CD 3.37Å; S936-R1013 PolarHBondContact OG-NH1 3.28Å; L973-R1013 HydrophobicContact CD2-CG 4.5Å; E1009-R1013 VanDerWaalsContact O-CA 3.3Å; E1009-R1013 WeakPolarHBondContact O-CA 3.23Å; E1009-R1013 PolarHBondContact O-N 3.36Å; R1013-K1015 PolarHBondContact O-N 2.96Å
1014	Y	87.6	Confident	90.1	Very high	39 Å²	39	63.7 Å²	63.7	15%	0.153	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	51.5	21.2	178.3	-58.6	-55.6	0	0	0	116.3	K918 I919 D935 S936 S937 R938 E1009 D1016	K918-Y1014 WeakPolarHBondContact CA-OH 3.3Å; K918-Y1014 HydrophobicContact CB-CD1 4.31Å; K918-Y1014 HydrophobicContact CB-CE1 3.84Å; K918-Y1014 HydrophobicContact CB-CE2 4.19Å; K918-Y1014 HydrophobicContact CD-CD1 3.67Å; K918-Y1014 HydrophobicContact CD-CD2 4.42Å; K918-Y1014 HydrophobicContact CD-CE1 4.05Å; K918-Y1014 HydrophobicContact CD-CG 3.89Å; K918-Y1014 HydrophobicContact CG-CD1 3.64Å; K918-Y1014 HydrophobicContact CG-CE1 3.5Å; K918-Y1014 HydrophobicContact CG-CG 4.27Å; I919-Y1014 PolarHBondContact N-OH 2.95Å; D935-Y1014 PolarHBondContact O-OH 2.85Å; S936-Y1014 VanDerWaalsContact C-CZ 3.41Å; S936-Y1014 WeakPolarHBondContact CA-OH 3.3Å; S936-Y1014 WeakPolarHBondContact O-CE2 3.21Å; S937-Y1014 PolarHBondContact N-OH 3.13Å; S937-Y1014 VanDerWaalsContact N-OH 3.15Å; S937-Y1014 PolarHBondContact O-OH 2.8Å; R938-Y1014 HydrophobicContact CG-CD1 3.65Å; R938-Y1014 HydrophobicContact CG-CE1 3.71Å; R938-Y1014 VanDerWaalsContact NH2-C 3.32Å; E1009-Y1014 PolarHBondContact OE1-N 3.3Å; Y1014-D1016 PolarHBondContact O-N 2.97Å; Y1014-D1016 VanDerWaalsContact O-N 3.09Å
1015	K	88.8	Confident	90	Very high	94 Å²	94	62.5 Å²	62.5	41%	0.409	31%	0.314	S	S	.	.			trans	-50.7	121.9	176.6	-177.6	-177.2	-171.5	165.6	0	110.8	R938 Q1012 R1013 L1017	R938-K1015 PolarHBondContact NH1-O 3.01Å; R938-K1015 VanDerWaalsContact NH1-O 3.16Å; R938-K1015 PolarHBondContact NH2-O 3.43Å; Q1012-K1015 HydrophobicContact CB-CB 4.07Å; Q1012-K1015 HydrophobicContact CB-CD 4.23Å; Q1012-K1015 WeakPolarHBondContact O-CB 3.45Å; Q1012-K1015 PolarHBondContact O-N 2.92Å; Q1012-K1015 VanDerWaalsContact OE1-CD 3.3Å; R1013-K1015 PolarHBondContact O-N 2.96Å; K1015-L1017 HydrophobicContact CD-CD2 4.1Å; K1015-L1017 HydrophobicContact CG-CD2 4.28Å; K1015-L1017 PolarHBondContact O-N 2.93Å
1016	D	90	Very high	89.7	Confident	51 Å²	51	66.9 Å²	66.9	27%	0.273	33%	0.327	S	S	.	.			trans	-71	121.4	171.3	-163.5	-25.8	0	0	0	109.3	Y1014 R1018	Y1014-D1016 PolarHBondContact O-N 2.97Å; Y1014-D1016 VanDerWaalsContact O-N 3.09Å; D1016-R1018 WeakPolarHBondContact OD1-CB 3.4Å; D1016-R1018 WeakPolarHBondContact OD1-CG 3.4Å; D1016-R1018 PolarHBondContact OD1-N 3.01Å; D1016-R1018 IonicContact OD1-NE 3.14Å; D1016-R1018 PolarHBondContact OD1-NE 3.26Å; D1016-R1018 VanDerWaalsContact OD1-NE 3.17Å; D1016-R1018 IonicContact OD2-CZ 3.29Å; D1016-R1018 IonicContact OD2-NE 2.74Å; D1016-R1018 PolarHBondContact OD2-NE 3.1Å; D1016-R1018 IonicContact OD2-NH2 3.68Å; D1016-R1018 PolarHBondContact OD2-NH2 3.41Å
1017	L	89.6	Confident	89.6	Confident	98 Å²	98	70.4 Å²	70.4	51%	0.513	34%	0.343	S	S	.	.			trans	-91.9	-0.2	-178.9	-61.1	-179.3	0	0	0	112.8	K1015	K1015-L1017 HydrophobicContact CD-CD2 4.1Å; K1015-L1017 HydrophobicContact CG-CD2 4.28Å; K1015-L1017 PolarHBondContact O-N 2.93Å
1018	R	93.8	Very high	89.4	Confident	15 Å²	15	72.5 Å²	72.5	6%	0.057	36%	0.356	C	S	.	.	S	Bend	trans	-63.5	158	174.7	-71.3	-175.2	-70.1	178.7	-10.2	112	L624 R625 V626 D804 V851 D1016	L624-R1018 WeakPolarHBondContact O-CD 3.35Å; R625-R1018 VanDerWaalsContact O-CB 3.27Å; R625-R1018 WeakPolarHBondContact O-CB 3.48Å; V626-R1018 PolarHBondContact O-NH1 3.39Å; D804-R1018 IonicContact OD1-CZ 2.6Å; D804-R1018 IonicContact OD1-NH1 3.9Å; D804-R1018 PolarHBondContact OD1-NH1 2.9Å; D804-R1018 IonicContact OD1-NH2 3.06Å; D804-R1018 PolarHBondContact OD1-NH2 2.9Å; D804-R1018 IonicContact OD2-CZ 3.07Å; D804-R1018 IonicContact OD2-NH1 2.82Å; D804-R1018 IonicContact OD2-NH2 2.91Å; D804-R1018 PolarHBondContact OD2-NH2 3.36Å; V851-R1018 HydrophobicContact CG2-CG 4.26Å; D1016-R1018 WeakPolarHBondContact OD1-CB 3.4Å; D1016-R1018 WeakPolarHBondContact OD1-CG 3.4Å; D1016-R1018 PolarHBondContact OD1-N 3.01Å; D1016-R1018 IonicContact OD1-NE 3.14Å; D1016-R1018 PolarHBondContact OD1-NE 3.26Å; D1016-R1018 VanDerWaalsContact OD1-NE 3.17Å; D1016-R1018 IonicContact OD2-CZ 3.29Å; D1016-R1018 IonicContact OD2-NE 2.74Å; D1016-R1018 PolarHBondContact OD2-NE 3.1Å; D1016-R1018 IonicContact OD2-NH2 3.68Å; D1016-R1018 PolarHBondContact OD2-NH2 3.41Å
1019	E	92.1	Very high	89.1	Confident	76 Å²	76	70.8 Å²	70.8	36%	0.355	34%	0.338	S	S	.	.	B	Isolated β-bridge	trans	-72	129.8	176.4	-66.3	-174.1	-177.7	0	0	109.9	R625 G627	R625-E1019 HydrophobicContact CG-CG 4.19Å; R625-E1019 IonicContact CZ-OE1 2.68Å; R625-E1019 IonicContact NE-OE1 2.58Å; R625-E1019 PolarHBondContact NE-OE1 3.4Å; R625-E1019 IonicContact NH1-OE1 3.45Å; R625-E1019 PolarHBondContact NH1-OE1 3.41Å; R625-E1019 VanDerWaalsContact NH1-OE1 3.14Å; R625-E1019 IonicContact NH2-OE1 3.74Å; R625-E1019 PolarHBondContact NH2-OE1 3.1Å; R625-E1019 PolarHBondContact O-N 3.06Å; G627-E1019 PolarHBondContact N-O 3.47Å
1020	P	90.3	Very high	88.8	Confident	87 Å²	87	70.1 Å²	70.1	57%	0.565	34%	0.335	S	S	*	.	P	Polyproline II helix	trans	-62.2	146.6	176.4	26.4	-34.2	0	0	0	110.4	R1022	P1020-R1022 PolarHBondContact O-N 3.08Å
1021	F	90.6	Very high	88.6	Confident	56 Å²	56	71 Å²	71	25%	0.246	34%	0.338	C	S	.	.	P	Polyproline II helix	trans	-52	138.5	179.1	176.8	-90.2	0	0	0	112.3	V626 Y629 E765 L802	V626-F1021 HydrophobicContact CG1-CB 4.33Å; V626-F1021 HydrophobicContact CG1-CD2 4.26Å; Y629-F1021 HydrophobicContact CD2-CB 4.29Å; Y629-F1021 AromaticContact CD2-CD1 3.67Å; Y629-F1021 HydrophobicContact CD2-CD1 3.67Å; Y629-F1021 HydrophobicContact CD2-CE1 4.3Å; Y629-F1021 HydrophobicContact CD2-CG 4.12Å; Y629-F1021 HydrophobicContact CE2-CD1 4.01Å; Y629-F1021 HydrophobicContact CE2-CE1 4.43Å; E765-F1021 HydrophobicContact CB-CZ 4.48Å; E765-F1021 HydrophobicContact CG-CE1 3.96Å; E765-F1021 HydrophobicContact CG-CZ 4.31Å; L802-F1021 HydrophobicContact CD1-CD1 4.18Å; L802-F1021 HydrophobicContact CD1-CD2 3.56Å; L802-F1021 HydrophobicContact CD1-CE1 4.11Å; L802-F1021 HydrophobicContact CD1-CE2 3.46Å; L802-F1021 VanDerWaalsContact CD1-CE2 3.46Å; L802-F1021 HydrophobicContact CD1-CG 3.93Å; L802-F1021 HydrophobicContact CD1-CZ 3.75Å
1022	R	90.1	Very high	88.4	Confident	191 Å²	191	69.8 Å²	69.8	72%	0.721	33%	0.331	S	S	*	.			trans	-126.5	134.3	175.4	-62.8	-173.7	-178.1	-177.6	2	110.6	P1020	P1020-R1022 PolarHBondContact O-N 3.08Å
1023	S	88.7	Confident	88.1	Confident	72 Å²	72	65.4 Å²	65.4	50%	0.503	31%	0.31	S	S	.	.	P	Polyproline II helix	trans	-58.6	136.5	175.2	-44	0	0	0	0	110.5	E765	E765-S1023 VanDerWaalsContact CD-OG 3.29Å; E765-S1023 WeakPolarHBondContact OE1-CB 3.27Å; E765-S1023 PolarHBondContact OE1-OG 3.47Å; E765-S1023 VanDerWaalsContact OE2-CB 3.26Å; E765-S1023 WeakPolarHBondContact OE2-CB 3.31Å; E765-S1023 PolarHBondContact OE2-OG 3.05Å
1024	P	88.5	Confident	87.7	Confident	21 Å²	21	61.9 Å²	61.9	14%	0.136	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-63.8	139.1	-176.9	25.5	-34.2	0	0	0	111.5	Q1028 M1029 M1032	P1024-Q1028 HydrophobicContact CB-CB 4.11Å; P1024-M1029 HydrophobicContact CB-CG 3.82Å; P1024-M1029 HydrophobicContact CG-CG 3.65Å; P1024-M1032 HydrophobicContact CB-CE 4.14Å; P1024-M1032 HydrophobicContact CG-CE 4.31Å
1025	S	90.4	Very high	87.3	Confident	53 Å²	53	63.1 Å²	63.1	37%	0.371	30%	0.304	S	S	.	.	P	Polyproline II helix	trans	-62.8	160.2	173.7	84.3	0	0	0	0	111.1	E1027 Q1028 M1029	S1025-E1027 PolarHBondContact O-N 3.46Å; S1025-E1027 VanDerWaalsContact O-N 3.16Å; S1025-E1027 PolarHBondContact OG-N 3.2Å; S1025-Q1028 PolarHBondContact O-N 3.49Å; S1025-Q1028 WeakPolarHBondContact OG-CG 3.38Å; S1025-Q1028 PolarHBondContact OG-N 2.88Å; S1025-Q1028 VanDerWaalsContact OG-N 3.09Å; S1025-M1029 WeakPolarHBondContact O-CB 3.35Å; S1025-M1029 WeakPolarHBondContact O-CG 3.36Å; S1025-M1029 PolarHBondContact O-N 3.34Å
1026	R	86	Confident	86.8	Confident	149 Å²	149	62.6 Å²	62.6	56%	0.562	30%	0.303	S	S	*	.	H	α-helix	trans	-57.9	-32.8	177.6	-65.9	-62.4	-174.1	-163.5	-3.3	112.9	F1030	R1026-F1030 VanDerWaalsContact O-CB 3.3Å; R1026-F1030 WeakPolarHBondContact O-CB 3.48Å; R1026-F1030 PolarHBondContact O-N 2.94Å
1027	E	88.7	Confident	86.4	Confident	80 Å²	80	63.4 Å²	63.4	37%	0.374	31%	0.308	S	S	.	.	H	α-helix	trans	-71.9	-44.8	174.5	178.6	167.1	-146.2	0	0	111.8	S1025 M1029 F1030 Y1031 Y1154	S1025-E1027 PolarHBondContact O-N 3.46Å; S1025-E1027 VanDerWaalsContact O-N 3.16Å; S1025-E1027 PolarHBondContact OG-N 3.2Å; E1027-M1029 PolarHBondContact O-N 3.09Å; E1027-F1030 WeakPolarHBondContact O-CB 3.45Å; E1027-F1030 PolarHBondContact O-N 3.41Å; E1027-F1030 VanDerWaalsContact O-N 3.15Å; E1027-Y1031 HydrophobicContact CG-CD2 3.78Å; E1027-Y1031 HydrophobicContact CG-CE2 3.53Å; E1027-Y1031 WeakPolarHBondContact O-CD2 3.21Å; E1027-Y1031 PolarHBondContact O-N 3.32Å; E1027-Y1154 HydrophobicContact CB-CD1 4.22Å; E1027-Y1154 HydrophobicContact CB-CD2 4.5Å; E1027-Y1154 HydrophobicContact CB-CE1 4.18Å; E1027-Y1154 HydrophobicContact CB-CE2 4.46Å; E1027-Y1154 HydrophobicContact CB-CG 4.37Å; E1027-Y1154 HydrophobicContact CG-CD1 4.31Å; E1027-Y1154 HydrophobicContact CG-CE1 3.79Å; E1027-Y1154 HydrophobicContact CG-CE2 4.46Å; E1027-Y1154 PolarHBondContact OE1-OH 3.04Å
1028	Q	88.4	Confident	86	Confident	117 Å²	117	61.9 Å²	61.9	55%	0.547	30%	0.303	S	S	.	.	H	α-helix	trans	-62	-44	175.4	-72.6	169.5	-27.4	0	0	111.3	P1024 S1025 F1030 Y1031 M1032	P1024-Q1028 HydrophobicContact CB-CB 4.11Å; S1025-Q1028 PolarHBondContact O-N 3.49Å; S1025-Q1028 WeakPolarHBondContact OG-CG 3.38Å; S1025-Q1028 PolarHBondContact OG-N 2.88Å; S1025-Q1028 VanDerWaalsContact OG-N 3.09Å; Q1028-F1030 VanDerWaalsContact C-N 3.32Å; Q1028-F1030 PolarHBondContact O-N 3.5Å; Q1028-Y1031 PolarHBondContact O-N 3.14Å; Q1028-M1032 WeakPolarHBondContact O-CB 3.25Å; Q1028-M1032 PolarHBondContact O-N 2.91Å
1029	M	85	Confident	85.2	Confident	23 Å²	23	68 Å²	68	11%	0.113	33%	0.332	C	S	.	.	H	α-helix	trans	-58.6	-43	172.3	-70	-177.1	78.6	0	0	111.4	L739 V766 P1024 S1025 E1027 L1033	L739-M1029 HydrophobicContact CD2-CE 4.25Å; V766-M1029 HydrophobicContact CB-CE 4.16Å; V766-M1029 HydrophobicContact CG2-CE 3.81Å; P1024-M1029 HydrophobicContact CB-CG 3.82Å; P1024-M1029 HydrophobicContact CG-CG 3.65Å; S1025-M1029 WeakPolarHBondContact O-CB 3.35Å; S1025-M1029 WeakPolarHBondContact O-CG 3.36Å; S1025-M1029 PolarHBondContact O-N 3.34Å; E1027-M1029 PolarHBondContact O-N 3.09Å; M1029-L1033 VanDerWaalsContact O-CB 3.31Å; M1029-L1033 WeakPolarHBondContact O-CB 3.36Å; M1029-L1033 WeakPolarHBondContact O-CG 3.41Å; M1029-L1033 PolarHBondContact O-N 3.37Å
1030	F	84.5	Confident	84.6	Confident	0 Å²	0	67.8 Å²	67.8	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-57.3	-53.6	177.8	174.7	-89.6	0	0	0	110.7	R1026 E1027 Q1028 L1033 I1034 F1041 L1118 I1152 Y1154 M1157	R1026-F1030 VanDerWaalsContact O-CB 3.3Å; R1026-F1030 WeakPolarHBondContact O-CB 3.48Å; R1026-F1030 PolarHBondContact O-N 2.94Å; E1027-F1030 WeakPolarHBondContact O-CB 3.45Å; E1027-F1030 PolarHBondContact O-N 3.41Å; E1027-F1030 VanDerWaalsContact O-N 3.15Å; Q1028-F1030 VanDerWaalsContact C-N 3.32Å; Q1028-F1030 PolarHBondContact O-N 3.5Å; F1030-L1033 PolarHBondContact O-N 3.12Å; F1030-I1034 HydrophobicContact CD1-CD1 3.93Å; F1030-I1034 HydrophobicContact CE1-CD1 3.41Å; F1030-I1034 VanDerWaalsContact CE1-CD1 3.41Å; F1030-I1034 HydrophobicContact CZ-CD1 3.88Å; F1030-I1034 WeakPolarHBondContact O-CG1 3.49Å; F1030-I1034 PolarHBondContact O-N 3.49Å; F1030-F1041 AromaticContact CE1-CD1 4Å; F1030-F1041 HydrophobicContact CE1-CD1 4Å; F1030-F1041 HydrophobicContact CE1-CE1 4.24Å; F1030-F1041 AromaticContact CZ-CD1 4Å; F1030-F1041 HydrophobicContact CZ-CD1 4Å; F1030-F1041 AromaticContact CZ-CE1 3.76Å; F1030-F1041 HydrophobicContact CZ-CE1 3.76Å; F1030-L1118 HydrophobicContact CE2-CD1 3.78Å; F1030-L1118 HydrophobicContact CE2-CD2 4.06Å; F1030-L1118 HydrophobicContact CZ-CD1 3.59Å; F1030-I1152 HydrophobicContact CE1-CG2 4.17Å; F1030-I1152 HydrophobicContact CE2-CG2 4.07Å; F1030-I1152 HydrophobicContact CZ-CG2 3.82Å; F1030-Y1154 HydrophobicContact CB-CD1 3.88Å; F1030-Y1154 HydrophobicContact CD1-CD1 4.05Å; F1030-Y1154 HydrophobicContact CD1-CE1 4.12Å; F1030-Y1154 HydrophobicContact CD2-CD1 4.2Å; F1030-Y1154 AromaticContact CG-CD1 3.8Å; F1030-Y1154 HydrophobicContact CG-CD1 3.8Å; F1030-Y1154 HydrophobicContact CG-CE1 4.34Å; F1030-M1157 HydrophobicContact CB-SD 4.14Å; F1030-M1157 HydrophobicContact CD2-CE 3.81Å; F1030-M1157 HydrophobicContact CD2-SD 3.54Å; F1030-M1157 VanDerWaalsContact CD2-SD 3.54Å; F1030-M1157 HydrophobicContact CE2-CE 4.41Å; F1030-M1157 HydrophobicContact CE2-SD 4.43Å; F1030-M1157 HydrophobicContact CG-SD 4.29Å
1031	Y	85.5	Confident	84.2	Confident	25 Å²	25	64.2 Å²	64.2	10%	0.098	31%	0.312	C	S	.	.	H	α-helix	trans	-68.9	-38.7	-179.6	-71	-61.3	0	0	0	113.4	E1027 Q1028 L1033 I1034 K1035 E1036 N1037 P1038 F1041 Y1154	E1027-Y1031 HydrophobicContact CG-CD2 3.78Å; E1027-Y1031 HydrophobicContact CG-CE2 3.53Å; E1027-Y1031 WeakPolarHBondContact O-CD2 3.21Å; E1027-Y1031 PolarHBondContact O-N 3.32Å; Q1028-Y1031 PolarHBondContact O-N 3.14Å; Y1031-L1033 VanDerWaalsContact C-N 3.3Å; Y1031-L1033 PolarHBondContact O-N 2.97Å; Y1031-I1034 HydrophobicContact CD1-CD1 4.02Å; Y1031-I1034 HydrophobicContact CD1-CG1 4.45Å; Y1031-I1034 HydrophobicContact CE1-CD1 4.42Å; Y1031-I1034 PolarHBondContact O-N 2.99Å; Y1031-K1035 WeakPolarHBondContact O-CA 3.18Å; Y1031-K1035 PolarHBondContact O-N 3.45Å; Y1031-E1036 WeakPolarHBondContact CB-O 3.44Å; Y1031-E1036 VanDerWaalsContact CD1-O 3.28Å; Y1031-E1036 WeakPolarHBondContact CD1-O 3.47Å; Y1031-N1037 VanDerWaalsContact CE1-C 3.47Å; Y1031-P1038 HydrophobicContact CD2-CG 4.23Å; Y1031-P1038 HydrophobicContact CE1-CG 4.19Å; Y1031-P1038 HydrophobicContact CE2-CB 4.49Å; Y1031-P1038 HydrophobicContact CE2-CG 3.59Å; Y1031-F1041 WeakPolarHBondContact CE1-O 3.26Å; Y1031-F1041 PolarHBondContact OH-O 3.26Å; Y1031-Y1154 HydrophobicContact CE2-CE1 4.29Å
1032	M	84.4	Confident	84	Confident	38 Å²	38	61.8 Å²	61.8	19%	0.187	30%	0.302	C	S	.	.	H	α-helix	trans	-57.7	-41.9	173.9	-179.2	-166.8	-65.1	0	0	112	V766 D768 P1024 Q1028 K1035	V766-M1032 HydrophobicContact CG1-SD 4.04Å; D768-M1032 HydrophobicContact CB-CE 4.11Å; D768-M1032 HydrophobicContact CB-CG 3.93Å; D768-M1032 HydrophobicContact CB-SD 4.07Å; P1024-M1032 HydrophobicContact CB-CE 4.14Å; P1024-M1032 HydrophobicContact CG-CE 4.31Å; Q1028-M1032 WeakPolarHBondContact O-CB 3.25Å; Q1028-M1032 PolarHBondContact O-N 2.91Å; M1032-K1035 VanDerWaalsContact O-CD 3.25Å; M1032-K1035 WeakPolarHBondContact O-CD 3.46Å; M1032-K1035 WeakPolarHBondContact O-CE 3.35Å; M1032-K1035 PolarHBondContact O-NZ 2.91Å
1033	L	80.5	Confident	83.9	Confident	3 Å²	3	57.7 Å²	57.7	2%	0.016	29%	0.294	C	S	.	.	H	α-helix	trans	-81.4	-19	-177.7	-71.1	176.1	0	0	0	114.4	S720 A738 L739 V766 M1029 F1030 Y1031 M1157	S720-L1033 WeakPolarHBondContact CB-O 3.49Å; S720-L1033 PolarHBondContact OG-O 3.42Å; A738-L1033 HydrophobicContact CB-CD2 3.79Å; L739-L1033 HydrophobicContact CD2-CD1 4.39Å; L739-L1033 HydrophobicContact CG-CD1 4.39Å; V766-L1033 HydrophobicContact CG1-CD2 4.23Å; M1029-L1033 VanDerWaalsContact O-CB 3.31Å; M1029-L1033 WeakPolarHBondContact O-CB 3.36Å; M1029-L1033 WeakPolarHBondContact O-CG 3.41Å; M1029-L1033 PolarHBondContact O-N 3.37Å; F1030-L1033 PolarHBondContact O-N 3.12Å; Y1031-L1033 VanDerWaalsContact C-N 3.3Å; Y1031-L1033 PolarHBondContact O-N 2.97Å; L1033-M1157 HydrophobicContact CB-CE 4.42Å; L1033-M1157 HydrophobicContact CD1-CE 4.28Å
1034	I	78.7	Confident	83.7	Confident	11 Å²	11	54.4 Å²	54.4	6%	0.056	27%	0.271	C	S	.	.	H	α-helix	trans	-99.5	-16.2	174.1	66.8	175.5	0	0	0	112.4	S720 F1030 Y1031 E1036 F1041 L1118	S720-I1034 PolarHBondContact OG-O 3.23Å; F1030-I1034 HydrophobicContact CD1-CD1 3.93Å; F1030-I1034 HydrophobicContact CE1-CD1 3.41Å; F1030-I1034 VanDerWaalsContact CE1-CD1 3.41Å; F1030-I1034 HydrophobicContact CZ-CD1 3.88Å; F1030-I1034 WeakPolarHBondContact O-CG1 3.49Å; F1030-I1034 PolarHBondContact O-N 3.49Å; Y1031-I1034 HydrophobicContact CD1-CD1 4.02Å; Y1031-I1034 HydrophobicContact CD1-CG1 4.45Å; Y1031-I1034 HydrophobicContact CE1-CD1 4.42Å; Y1031-I1034 PolarHBondContact O-N 2.99Å; I1034-E1036 HydrophobicContact CB-CG 4.49Å; I1034-E1036 HydrophobicContact CD1-CB 3.67Å; I1034-E1036 HydrophobicContact CD1-CG 4.13Å; I1034-E1036 HydrophobicContact CG1-CB 3.74Å; I1034-E1036 HydrophobicContact CG1-CG 4.11Å; I1034-E1036 PolarHBondContact O-N 2.84Å; I1034-F1041 HydrophobicContact CD1-CB 4.3Å; I1034-F1041 HydrophobicContact CD1-CD1 3.93Å; I1034-F1041 HydrophobicContact CD1-CG 4.14Å; I1034-L1118 HydrophobicContact CG2-CD1 4.23Å; I1034-L1118 HydrophobicContact CG2-CD2 4.27Å; I1034-L1118 HydrophobicContact CG2-CG 4.33Å
1035	K	79.8	Confident	83.6	Confident	66 Å²	66	56.2 Å²	56.2	29%	0.287	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.2	30.9	-174.2	-54.6	-70.2	-177.5	-164.4	0	113.4	G718 D768 D769 Y1031 M1032	G718-K1035 PolarHBondContact O-NZ 2.83Å; D768-K1035 IonicContact OD1-NZ 2.71Å; D768-K1035 PolarHBondContact OD1-NZ 2.84Å; D769-K1035 VanDerWaalsContact OD1-CE 3.25Å; D769-K1035 WeakPolarHBondContact OD1-CE 3.37Å; D769-K1035 IonicContact OD1-NZ 2.66Å; D769-K1035 PolarHBondContact OD1-NZ 3.06Å; Y1031-K1035 WeakPolarHBondContact O-CA 3.18Å; Y1031-K1035 PolarHBondContact O-N 3.45Å; M1032-K1035 VanDerWaalsContact O-CD 3.25Å; M1032-K1035 WeakPolarHBondContact O-CD 3.46Å; M1032-K1035 WeakPolarHBondContact O-CE 3.35Å; M1032-K1035 PolarHBondContact O-NZ 2.91Å
1036	E	77.9	Confident	83.5	Confident	83 Å²	83	56.9 Å²	56.9	39%	0.388	28%	0.279	S	S	.	.			trans	-113.7	172.3	171.2	-61.8	-69.4	174.5	0	0	108.5	Y1031 I1034 T1040 F1041	Y1031-E1036 WeakPolarHBondContact CB-O 3.44Å; Y1031-E1036 VanDerWaalsContact CD1-O 3.28Å; Y1031-E1036 WeakPolarHBondContact CD1-O 3.47Å; I1034-E1036 HydrophobicContact CB-CG 4.49Å; I1034-E1036 HydrophobicContact CD1-CB 3.67Å; I1034-E1036 HydrophobicContact CD1-CG 4.13Å; I1034-E1036 HydrophobicContact CG1-CB 3.74Å; I1034-E1036 HydrophobicContact CG1-CG 4.11Å; I1034-E1036 PolarHBondContact O-N 2.84Å; E1036-T1040 WeakPolarHBondContact OE2-CB 3.48Å; E1036-T1040 PolarHBondContact OE2-OG1 3.1Å; E1036-F1041 HydrophobicContact CB-CB 3.7Å; E1036-F1041 HydrophobicContact CG-CB 4.11Å
1037	N	80.8	Confident	83.5	Confident	68 Å²	68	50.8 Å²	50.8	36%	0.364	26%	0.258	S	S	.	.			trans	-128.9	169	176.2	62.4	61.3	0	0	0	110.2	Y1031 H1039 T1040 F1041	Y1031-N1037 VanDerWaalsContact CE1-C 3.47Å; N1037-H1039 PolarHBondContact O-N 2.83Å; N1037-H1039 WeakPolarHBondContact OD1-CA 3.5Å; N1037-H1039 VanDerWaalsContact OD1-CB 3.28Å; N1037-H1039 WeakPolarHBondContact OD1-CB 3.35Å; N1037-H1039 PolarHBondContact OD1-N 3.36Å; N1037-T1040 PolarHBondContact N-OG1 2.85Å; N1037-T1040 VanDerWaalsContact N-OG1 3.07Å; N1037-T1040 PolarHBondContact O-N 2.91Å; N1037-T1040 VanDerWaalsContact O-N 3.1Å; N1037-T1040 PolarHBondContact O-OG1 2.83Å; N1037-T1040 PolarHBondContact OD1-N 3.47Å; N1037-F1041 PolarHBondContact O-N 2.92Å
1038	P	81.2	Confident	83.5	Confident	65 Å²	65	50.9 Å²	50.9	42%	0.422	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-21.7	179.7	-25.2	31	0	0	0	115.1	Y1031 G1042	Y1031-P1038 HydrophobicContact CD2-CG 4.23Å; Y1031-P1038 HydrophobicContact CE1-CG 4.19Å; Y1031-P1038 HydrophobicContact CE2-CB 4.49Å; Y1031-P1038 HydrophobicContact CE2-CG 3.59Å; P1038-G1042 VanDerWaalsContact O-CA 3.3Å; P1038-G1042 WeakPolarHBondContact O-CA 3.41Å; P1038-G1042 PolarHBondContact O-N 3.09Å
1039	H	78	Confident	83.4	Confident	145 Å²	145	45.3 Å²	45.3	67%	0.671	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.4	-29.7	179.9	-56	-69	0	0	0	113	N1037 K1045	N1037-H1039 PolarHBondContact O-N 2.83Å; N1037-H1039 WeakPolarHBondContact OD1-CA 3.5Å; N1037-H1039 VanDerWaalsContact OD1-CB 3.28Å; N1037-H1039 WeakPolarHBondContact OD1-CB 3.35Å; N1037-H1039 PolarHBondContact OD1-N 3.36Å; H1039-K1045 WeakPolarHBondContact O-CE 3.41Å; H1039-K1045 PolarHBondContact O-NZ 3.34Å; H1039-K1045 VanDerWaalsContact O-NZ 3.08Å
1040	T	78.8	Confident	83.5	Confident	70 Å²	70	49 Å²	49	43%	0.429	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-41.9	175.4	58.1	0	0	0	0	111.5	E1036 N1037	E1036-T1040 WeakPolarHBondContact OE2-CB 3.48Å; E1036-T1040 PolarHBondContact OE2-OG1 3.1Å; N1037-T1040 PolarHBondContact N-OG1 2.85Å; N1037-T1040 VanDerWaalsContact N-OG1 3.07Å; N1037-T1040 PolarHBondContact O-N 2.91Å; N1037-T1040 VanDerWaalsContact O-N 3.1Å; N1037-T1040 PolarHBondContact O-OG1 2.83Å; N1037-T1040 PolarHBondContact OD1-N 3.47Å
1041	F	82.7	Confident	83.7	Confident	12 Å²	12	49 Å²	49	5%	0.053	25%	0.248	C	C	.	.	S	Bend	trans	-126.9	79.2	-179.3	-164	-85.1	0	0	0	110.7	F1030 Y1031 I1034 E1036 N1037 V1047 L1114 A1116 L1118 I1149 V1159	F1030-F1041 AromaticContact CE1-CD1 4Å; F1030-F1041 HydrophobicContact CE1-CD1 4Å; F1030-F1041 HydrophobicContact CE1-CE1 4.24Å; F1030-F1041 AromaticContact CZ-CD1 4Å; F1030-F1041 HydrophobicContact CZ-CD1 4Å; F1030-F1041 AromaticContact CZ-CE1 3.76Å; F1030-F1041 HydrophobicContact CZ-CE1 3.76Å; Y1031-F1041 WeakPolarHBondContact CE1-O 3.26Å; Y1031-F1041 PolarHBondContact OH-O 3.26Å; I1034-F1041 HydrophobicContact CD1-CB 4.3Å; I1034-F1041 HydrophobicContact CD1-CD1 3.93Å; I1034-F1041 HydrophobicContact CD1-CG 4.14Å; E1036-F1041 HydrophobicContact CB-CB 3.7Å; E1036-F1041 HydrophobicContact CG-CB 4.11Å; N1037-F1041 PolarHBondContact O-N 2.92Å; F1041-V1047 HydrophobicContact CD2-CG1 4.24Å; F1041-V1047 HydrophobicContact CE2-CG1 3.9Å; F1041-L1114 HydrophobicContact CE2-CD1 4.15Å; F1041-L1114 HydrophobicContact CZ-CD1 3.87Å; F1041-A1116 HydrophobicContact CE2-CB 4.44Å; F1041-L1118 HydrophobicContact CD1-CD1 4.48Å; F1041-L1118 HydrophobicContact CE1-CD1 3.6Å; F1041-L1118 HydrophobicContact CE2-CD1 4.35Å; F1041-L1118 HydrophobicContact CZ-CD1 3.51Å; F1041-I1149 HydrophobicContact CD1-CD1 4.29Å; F1041-I1149 HydrophobicContact CD2-CD1 4.34Å; F1041-I1149 HydrophobicContact CE1-CD1 3.91Å; F1041-I1149 HydrophobicContact CE2-CD1 4.01Å; F1041-I1149 HydrophobicContact CG-CD1 4.47Å; F1041-I1149 HydrophobicContact CZ-CD1 3.76Å; F1041-V1159 HydrophobicContact CE1-CG1 3.87Å; F1041-V1159 HydrophobicContact CZ-CG1 4.07Å
1042	G	85.5	Confident	83.7	Confident	5 Å²	5	51.3 Å²	51.3	5%	0.052	26%	0.26	C	S	.	.			trans	-132.9	174.5	-177.5	0	0	0	0	0	113.8	P1038 G1044 K1045	P1038-G1042 VanDerWaalsContact O-CA 3.3Å; P1038-G1042 WeakPolarHBondContact O-CA 3.41Å; P1038-G1042 PolarHBondContact O-N 3.09Å; G1042-G1044 PolarHBondContact O-N 2.94Å; G1042-K1045 WeakPolarHBondContact O-CB 3.49Å; G1042-K1045 PolarHBondContact O-N 2.78Å
1043	I	87.6	Confident	83.8	Confident	106 Å²	106	55.7 Å²	55.7	54%	0.544	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	133.9	172.3	-63	172	0	0	0	109	I1150 I1152 F1175	I1043-I1150 WeakPolarHBondContact CG2-O 3.28Å; I1043-I1152 HydrophobicContact CG1-CD1 4.4Å; I1043-I1152 HydrophobicContact CG1-CG1 4.24Å; I1043-F1175 HydrophobicContact CG2-CE1 4.26Å
1044	G	84.8	Confident	84.1	Confident	3 Å²	3	56.4 Å²	56.4	3%	0.031	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	89.6	-12.8	-175.8	0	0	0	0	0	114.4	G1042 R1148 I1149	G1042-G1044 PolarHBondContact O-N 2.94Å; G1044-R1148 WeakPolarHBondContact O-CD 3.46Å; G1044-R1148 VanDerWaalsContact O-CG 3.24Å; G1044-R1148 WeakPolarHBondContact O-CG 3.33Å; G1044-R1148 PolarHBondContact O-NH1 2.8Å; G1044-I1149 WeakPolarHBondContact CA-O 3.44Å; G1044-I1149 PolarHBondContact N-O 3.43Å
1045	K	87.2	Confident	84.5	Confident	58 Å²	58	57.4 Å²	57.4	25%	0.252	29%	0.285	S	S	.	.			trans	-75.1	144	178.6	-62.1	-70.7	169.7	163.1	0	111.6	H1039 G1042 R1148 I1149	H1039-K1045 WeakPolarHBondContact O-CE 3.41Å; H1039-K1045 PolarHBondContact O-NZ 3.34Å; H1039-K1045 VanDerWaalsContact O-NZ 3.08Å; G1042-K1045 WeakPolarHBondContact O-CB 3.49Å; G1042-K1045 PolarHBondContact O-N 2.78Å; K1045-R1148 WeakPolarHBondContact O-CA 3.46Å; K1045-I1149 HydrophobicContact CB-CD1 4.49Å; K1045-I1149 PolarHBondContact O-N 3.06Å
1046	V	87.7	Confident	84.7	Confident	68 Å²	68	58.2 Å²	58.2	41%	0.412	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	128.8	174.9	-179.3	0	0	0	0	108.5	A1146 R1148 M1168	V1046-A1146 HydrophobicContact CG1-CB 4.23Å; V1046-R1148 HydrophobicContact CG2-CB 4.29Å; V1046-R1148 HydrophobicContact CG2-CG 4.29Å; V1046-M1168 HydrophobicContact CG1-CE 3.99Å
1047	V	86.6	Confident	84.9	Confident	20 Å²	20	62.6 Å²	62.6	12%	0.121	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	149	-178.8	-67	0	0	0	0	110.4	F1041 L1114 A1147 I1149 L1161	F1041-V1047 HydrophobicContact CD2-CG1 4.24Å; F1041-V1047 HydrophobicContact CE2-CG1 3.9Å; V1047-L1114 HydrophobicContact CB-CD2 4.17Å; V1047-L1114 HydrophobicContact CG2-CD1 3.97Å; V1047-L1114 HydrophobicContact CG2-CD2 3.57Å; V1047-L1114 HydrophobicContact CG2-CG 4.42Å; V1047-A1147 WeakPolarHBondContact CG2-O 3.43Å; V1047-A1147 PolarHBondContact N-O 2.89Å; V1047-A1147 PolarHBondContact O-N 2.91Å; V1047-I1149 HydrophobicContact CG1-CD1 3.8Å; V1047-I1149 HydrophobicContact CG1-CG1 4.26Å; V1047-I1149 HydrophobicContact CG2-CD1 4.35Å; V1047-I1149 HydrophobicContact CG2-CG1 3.98Å; V1047-L1161 HydrophobicContact CG2-CD2 3.86Å
1048	L	88.4	Confident	84.5	Confident	82 Å²	82	68.4 Å²	68.4	43%	0.429	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	132.1	173.9	-60.5	179.9	0	0	0	109.7	E1115 T1144 A1146	L1048-E1115 HydrophobicContact CB-CG 4.5Å; L1048-T1144 HydrophobicContact CB-CG2 4.17Å; L1048-A1146 HydrophobicContact CD2-CB 3.74Å
1049	G	86	Confident	84	Confident	0 Å²	0	67.1 Å²	67.1	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	137.1	179.5	0	0	0	0	0	113.5	R1113 T1144 L1145	G1049-R1113 CarbonylContact C-O 3.53Å; G1049-R1113 WeakPolarHBondContact CA-O 3.26Å; G1049-T1144 CarbonylContact O-C 3.57Å; G1049-T1144 WeakPolarHBondContact O-CA 3.32Å; G1049-L1145 PolarHBondContact N-O 3.16Å; G1049-L1145 PolarHBondContact O-N 3.33Å
1050	R	88	Confident	83.7	Confident	100 Å²	100	66.9 Å²	66.9	38%	0.377	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	130.9	174.3	-169.7	175.3	-172.5	-175.2	-2.7	111	W728 M1052 L1112 R1113 G1142 T1143	W728-R1050 HydrophobicContact CD2-CB 4.37Å; W728-R1050 HydrophobicContact CE3-CB 3.66Å; W728-R1050 HydrophobicContact CE3-CG 4.39Å; W728-R1050 HydrophobicContact CH2-CB 3.3Å; W728-R1050 VanDerWaalsContact CH2-N 3.34Å; W728-R1050 HydrophobicContact CZ2-CB 4.01Å; W728-R1050 HydrophobicContact CZ3-CB 3.07Å; W728-R1050 HydrophobicContact CZ3-CG 4.23Å; R1050-M1052 PolarHBondContact O-N 2.99Å; R1050-L1112 CarbonylContact O-C 3.38Å; R1050-L1112 VanDerWaalsContact O-CA 3.28Å; R1050-L1112 WeakPolarHBondContact O-CA 3.2Å; R1050-R1113 PolarHBondContact N-O 3.48Å; R1050-R1113 PolarHBondContact O-N 3.44Å; R1050-G1142 WeakPolarHBondContact CG-O 3.26Å; R1050-G1142 PolarHBondContact NE-O 3.47Å; R1050-T1143 CarbonylContact C-O 3.47Å; R1050-T1143 WeakPolarHBondContact CA-O 3.36Å
1051	V	88.4	Confident	83.2	Confident	2 Å²	2	71.6 Å²	71.6	1%	0.012	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	115.3	179.8	177.5	0	0	0	0	109.3	V1110 L1112 I1139 G1142 T1143 L1145	V1051-V1110 HydrophobicContact CB-CG1 4.41Å; V1051-V1110 HydrophobicContact CG1-CG1 3.52Å; V1051-V1110 HydrophobicContact CG2-CG1 4.23Å; V1051-L1112 HydrophobicContact CG2-CD2 4.11Å; V1051-L1112 HydrophobicContact CG2-CG 4.43Å; V1051-I1139 HydrophobicContact CB-CG2 4.12Å; V1051-I1139 HydrophobicContact CG1-CG2 3.86Å; V1051-I1139 HydrophobicContact CG2-CG2 3.49Å; V1051-I1139 VanDerWaalsContact CG2-CG2 3.49Å; V1051-G1142 WeakPolarHBondContact O-CA 3.49Å; V1051-G1142 PolarHBondContact O-N 3.27Å; V1051-T1143 PolarHBondContact N-O 3.38Å; V1051-L1145 HydrophobicContact CG2-CB 4.3Å
1052	M	85.1	Confident	82.5	Confident	73 Å²	73	76.8 Å²	76.8	36%	0.36	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	-47.4	-178.3	-67.1	-61.5	-51.9	0	0	111.8	R1050 R1111 R1113 I1141	R1050-M1052 PolarHBondContact O-N 2.99Å; M1052-R1111 PolarHBondContact N-O 3.29Å; M1052-R1113 HydrophobicContact CG-CB 3.84Å; M1052-R1113 HydrophobicContact SD-CB 3.99Å; M1052-I1141 WeakPolarHBondContact O-CG2 3.3Å
1053	R	86.6	Confident	81.6	Confident	130 Å²	130	83.3 Å²	83.3	49%	0.491	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.2	159.5	179.4	65.1	-176.7	-177.1	114.1	-5.1	111.6	R1111	R1053-R1111 HydrophobicContact CG-CB 4.37Å; R1053-R1111 PolarHBondContact N-O 2.97Å; R1053-R1111 PolarHBondContact O-N 3.02Å
1054	I	86.1	Confident	80.3	Confident	18 Å²	18	80.2 Å²	80.2	9%	0.092	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	135.4	165.8	-55.9	167	0	0	0	108.2	Y1056 A1107 V1110 P1135	I1054-Y1056 HydrophobicContact CB-CE2 3.73Å; I1054-Y1056 HydrophobicContact CG2-CD2 4.26Å; I1054-Y1056 HydrophobicContact CG2-CE1 4.1Å; I1054-Y1056 HydrophobicContact CG2-CE2 3.62Å; I1054-A1107 HydrophobicContact CG2-CB 4.34Å; I1054-V1110 HydrophobicContact CG1-CG2 4.37Å; I1054-P1135 HydrophobicContact CD1-CB 4.13Å; I1054-P1135 HydrophobicContact CG1-CB 4.42Å; I1054-P1135 HydrophobicContact CG2-CB 4.2Å; I1054-P1135 HydrophobicContact CG2-CG 4.13Å
1055	V	87.1	Confident	79.2	Confident	31 Å²	31	85.9 Å²	85.9	19%	0.188	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	120.9	-179	-177.3	0	0	0	0	108.7	V1108 G1109 R1111 F1121	V1055-V1108 PolarHBondContact O-N 3.18Å; V1055-G1109 PolarHBondContact N-O 2.8Å; V1055-G1109 PolarHBondContact O-N 2.82Å; V1055-R1111 HydrophobicContact CG2-CB 4.08Å; V1055-F1121 HydrophobicContact CB-CE2 4.16Å; V1055-F1121 HydrophobicContact CG2-CE2 4.06Å
1056	Y	84.2	Confident	78.3	Confident	84 Å²	84	91.6 Å²	91.6	33%	0.329	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	146.5	178.5	-57.9	-94.7	0	0	0	111.2	I1054 P1104 G1105 Q1106 A1107	I1054-Y1056 HydrophobicContact CB-CE2 3.73Å; I1054-Y1056 HydrophobicContact CG2-CD2 4.26Å; I1054-Y1056 HydrophobicContact CG2-CE1 4.1Å; I1054-Y1056 HydrophobicContact CG2-CE2 3.62Å; Y1056-P1104 WeakPolarHBondContact CB-O 3.24Å; Y1056-P1104 HydrophobicContact CD1-CB 3.9Å; Y1056-P1104 HydrophobicContact CD1-CG 4.33Å; Y1056-P1104 HydrophobicContact CD2-CB 4.12Å; Y1056-P1104 HydrophobicContact CE1-CB 4.26Å; Y1056-P1104 HydrophobicContact CE1-CG 4.38Å; Y1056-P1104 HydrophobicContact CE2-CB 4.46Å; Y1056-P1104 HydrophobicContact CG-CB 3.83Å; Y1056-G1105 WeakPolarHBondContact CD1-O 3.49Å; Y1056-Q1106 CarbonylContact C-O 3.56Å; Y1056-Q1106 WeakPolarHBondContact CA-O 3.41Å; Y1056-A1107 HydrophobicContact CD1-CB 3.91Å; Y1056-A1107 HydrophobicContact CE1-CB 3.86Å
1057	R	81.1	Confident	77.4	Confident	175 Å²	175	90.5 Å²	90.5	66%	0.66	41%	0.413	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.4	110.7	171.2	175.8	178.5	-80.5	179.5	-6.1	108.2	G1105 Q1106 V1108	R1057-G1105 WeakPolarHBondContact O-CA 3.44Å; R1057-Q1106 PolarHBondContact N-O 3.2Å; R1057-Q1106 PolarHBondContact O-N 2.65Å; R1057-V1108 HydrophobicContact CB-CG2 3.48Å; R1057-V1108 VanDerWaalsContact CB-CG2 3.48Å
1058	R	74.3	Confident	76.7	Confident	190 Å²	190	96.4 Å²	96.4	72%	0.717	44%	0.443	S	S	*	.	P	Polyproline II helix	trans	-63.8	137.6	174.6	-75.1	-175.7	174.2	-173.2	-5.6	110.9
1059	P	69.7	Low	75.9	Confident	37 Å²	37	92.8 Å²	92.8	24%	0.24	42%	0.424	C	S	.	.	P	Polyproline II helix	trans	-64.5	144.3	172.7	-13.4	28.1	0	0	0	110.5	I1064 F1082	P1059-I1064 HydrophobicContact CB-CG1 4.29Å; P1059-F1082 HydrophobicContact CB-CB 4.46Å; P1059-F1082 HydrophobicContact CB-CD1 4.08Å; P1059-F1082 HydrophobicContact CB-CD2 3.69Å; P1059-F1082 HydrophobicContact CB-CE1 4.27Å; P1059-F1082 HydrophobicContact CB-CE2 4.02Å; P1059-F1082 HydrophobicContact CB-CG 3.82Å; P1059-F1082 HydrophobicContact CB-CZ 4.28Å; P1059-F1082 HydrophobicContact CG-CB 3.61Å; P1059-F1082 HydrophobicContact CG-CD1 4.15Å; P1059-F1082 HydrophobicContact CG-CD2 3.47Å; P1059-F1082 VanDerWaalsContact CG-CD2 3.47Å; P1059-F1082 HydrophobicContact CG-CE2 4.27Å; P1059-F1082 HydrophobicContact CG-CG 3.47Å; P1059-F1082 VanDerWaalsContact CG-CG 3.47Å
1060	Q	70.9	Confident	75.5	Confident	140 Å²	140	97.4 Å²	97.4	65%	0.654	45%	0.452	S	S	*	.	P	Polyproline II helix	trans	-82.4	142.8	169.9	-69.2	-143.5	-25.3	0	0	110.6	D1062 K1063	Q1060-D1062 PolarHBondContact O-N 2.82Å; Q1060-D1062 VanDerWaalsContact O-N 3.13Å; Q1060-K1063 PolarHBondContact O-N 2.8Å
1061	K	68.2	Low	75.1	Confident	170 Å²	170	99.3 Å²	99.3	74%	0.739	46%	0.459	S	S	*	.	H	α-helix	trans	-51.4	-39.3	-176.7	-67.3	-172.3	176	-173.2	0	112.7	K1063 I1064	K1061-K1063 VanDerWaalsContact C-N 3.3Å; K1061-K1063 PolarHBondContact O-N 3.12Å; K1061-I1064 WeakPolarHBondContact O-CB 3.27Å; K1061-I1064 PolarHBondContact O-N 3.23Å
1062	D	69.4	Low	74.4	Confident	121 Å²	121	102.4 Å²	102.4	65%	0.647	48%	0.476	S	S	*	.	H	α-helix	trans	-66.5	-24	178.7	-65.4	-18.4	0	0	0	115.1	Q1060 T1065	Q1060-D1062 PolarHBondContact O-N 2.82Å; Q1060-D1062 VanDerWaalsContact O-N 3.13Å; D1062-T1065 PolarHBondContact O-OG1 3.49Å
1063	K	65.6	Low	73.9	Confident	142 Å²	142	103.7 Å²	103.7	62%	0.617	50%	0.498	S	S	*	.	H	α-helix	trans	-83	-26.4	177.4	-71.4	-165.8	176.5	-172	0	112.2	Q1060 K1061 T1065 K1066 T1067	Q1060-K1063 PolarHBondContact O-N 2.8Å; K1061-K1063 VanDerWaalsContact C-N 3.3Å; K1061-K1063 PolarHBondContact O-N 3.12Å; K1063-T1065 VanDerWaalsContact C-N 3.34Å; K1063-T1065 PolarHBondContact O-N 2.99Å; K1063-K1066 PolarHBondContact O-N 2.99Å; K1063-T1067 PolarHBondContact O-N 3.34Å; K1063-T1067 PolarHBondContact O-OG1 3.28Å
1064	I	61	Low	73.3	Confident	41 Å²	41	102 Å²	102	21%	0.21	51%	0.512	C	S	.	.	H	α-helix	trans	-62	-43.9	-177.9	-57.8	177.9	0	0	0	110.4	P1059 K1061 K1066 T1067 F1082 W1095	P1059-I1064 HydrophobicContact CB-CG1 4.29Å; K1061-I1064 WeakPolarHBondContact O-CB 3.27Å; K1061-I1064 PolarHBondContact O-N 3.23Å; I1064-K1066 PolarHBondContact O-N 3.35Å; I1064-K1066 VanDerWaalsContact O-N 3.17Å; I1064-T1067 PolarHBondContact O-N 2.95Å; I1064-T1067 PolarHBondContact O-OG1 3.44Å; I1064-F1082 HydrophobicContact CB-CE2 4.28Å; I1064-F1082 HydrophobicContact CG1-CE2 3.79Å; I1064-F1082 HydrophobicContact CG1-CZ 4.18Å; I1064-F1082 HydrophobicContact CG2-CE2 4.44Å; I1064-W1095 HydrophobicContact CG2-CZ3 4.01Å
1065	T	62.3	Low	72.8	Confident	121 Å²	121	104.8 Å²	104.8	74%	0.742	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-14.7	179.6	53.4	0	0	0	0	114.1	D1062 K1063	D1062-T1065 PolarHBondContact O-OG1 3.49Å; K1063-T1065 VanDerWaalsContact C-N 3.34Å; K1063-T1065 PolarHBondContact O-N 2.99Å
1066	K	68.1	Low	72.4	Confident	178 Å²	178	104.1 Å²	104.1	77%	0.774	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.8	-13.8	-176.3	-67.4	-177.2	178.8	178.8	0	114.3	K1063 I1064	K1063-K1066 PolarHBondContact O-N 2.99Å; I1064-K1066 PolarHBondContact O-N 3.35Å; I1064-K1066 VanDerWaalsContact O-N 3.17Å
1067	T	67.7	Low	72.3	Confident	45 Å²	45	103.1 Å²	103.1	28%	0.276	53%	0.528	S	S	.	.	P	Polyproline II helix	trans	-103.3	133.2	-174.8	46.8	0	0	0	0	111.9	K1063 I1064 F1082	K1063-T1067 PolarHBondContact O-N 3.34Å; K1063-T1067 PolarHBondContact O-OG1 3.28Å; I1064-T1067 PolarHBondContact O-N 2.95Å; I1064-T1067 PolarHBondContact O-OG1 3.44Å; T1067-F1082 HydrophobicContact CG2-CE1 3.98Å; T1067-F1082 HydrophobicContact CG2-CZ 4Å; T1067-F1082 WeakPolarHBondContact OG1-CZ 3.15Å
1068	I	71.7	Confident	72.4	Confident	145 Å²	145	97.6 Å²	97.6	74%	0.744	51%	0.508	S	S	*	.	P	Polyproline II helix	trans	-100.7	125.4	176.5	-55.3	171.6	0	0	0	108.2
1069	P	73.1	Confident	72.7	Confident	5 Å²	5	91.4 Å²	91.4	3%	0.032	49%	0.487	C	S	.	.	P	Polyproline II helix	trans	-57.3	143.8	172.4	-25.2	35.6	0	0	0	111.9	W1078 L1091 V1094 W1095	P1069-W1078 HydrophobicContact CB-CE3 4.11Å; P1069-W1078 WeakPolarHBondContact O-CZ3 3.13Å; P1069-L1091 HydrophobicContact CB-CD1 3.67Å; P1069-L1091 HydrophobicContact CG-CD1 3.65Å; P1069-V1094 HydrophobicContact CB-CG1 4Å; P1069-V1094 HydrophobicContact CB-CG2 4.49Å; P1069-V1094 HydrophobicContact CG-CB 4.35Å; P1069-V1094 HydrophobicContact CG-CG1 3.78Å; P1069-W1095 HydrophobicContact CG-CZ2 4.05Å
1070	V	76.6	Confident	73.1	Confident	98 Å²	98	89.7 Å²	89.7	59%	0.594	48%	0.475	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.5	135.4	-178.5	-179.3	0	0	0	0	108.8	Q1079	V1070-Q1079 WeakPolarHBondContact O-CB 3.47Å; V1070-Q1079 PolarHBondContact O-N 2.92Å
1071	R	79.2	Confident	73.2	Confident	139 Å²	139	85 Å²	85	53%	0.525	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	126.6	173	-168.2	175.8	-174.7	-99.8	4.1	109.9	A1073 G1076 W1078	R1071-A1073 PolarHBondContact O-N 2.96Å; R1071-G1076 PolarHBondContact NE-O 3.33Å; R1071-G1076 PolarHBondContact NH2-O 3.34Å; R1071-W1078 HydrophobicContact CB-CD2 4.04Å; R1071-W1078 HydrophobicContact CB-CE3 3.9Å; R1071-W1078 HydrophobicContact CB-CH2 4.32Å; R1071-W1078 HydrophobicContact CB-CZ2 4.42Å; R1071-W1078 HydrophobicContact CB-CZ3 4.05Å; R1071-W1078 HydrophobicContact CG-CD2 4.32Å
1072	N	73.5	Confident	73.6	Confident	67 Å²	67	78.4 Å²	78.4	36%	0.358	43%	0.429	S	S	.	.			trans	-72.5	120.8	175.7	-174.3	-19.7	0	0	0	109.5	A1074 G1076 M1077	N1072-A1074 VanDerWaalsContact C-N 3.26Å; N1072-A1074 PolarHBondContact O-N 3.13Å; N1072-A1074 PolarHBondContact OD1-N 3.39Å; N1072-G1076 VanDerWaalsContact O-CA 3.31Å; N1072-G1076 WeakPolarHBondContact O-CA 3.42Å; N1072-G1076 PolarHBondContact O-N 2.85Å; N1072-M1077 PolarHBondContact N-O 2.83Å
1073	A	75.5	Confident	73.8	Confident	101 Å²	101	73.8 Å²	73.8	84%	0.835	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-29.5	-177.6	0	0	0	0	0	113.2	R1071	R1071-A1073 PolarHBondContact O-N 2.96Å
1074	A	74.5	Confident	74	Confident	94 Å²	94	70.5 Å²	70.5	78%	0.777	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-42.4	-175.8	0	0	0	0	0	113	N1072	N1072-A1074 VanDerWaalsContact C-N 3.26Å; N1072-A1074 PolarHBondContact O-N 3.13Å; N1072-A1074 PolarHBondContact OD1-N 3.39Å
1075	T	76.2	Confident	74.5	Confident	77 Å²	77	70.8 Å²	70.8	47%	0.472	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.7	-20	-179.4	59.2	0	0	0	0	112.8	M1077	T1075-M1077 HydrophobicContact CG2-CE 4.25Å; T1075-M1077 PolarHBondContact O-N 3.3Å; T1075-M1077 PolarHBondContact OG1-N 2.82Å
1076	G	78.3	Confident	74.9	Confident	16 Å²	16	66 Å²	66	17%	0.165	37%	0.374	C	S	.	.			trans	70.1	7.9	-170.1	0	0	0	0	0	114.1	R1071 N1072	R1071-G1076 PolarHBondContact NE-O 3.33Å; R1071-G1076 PolarHBondContact NH2-O 3.34Å; N1072-G1076 VanDerWaalsContact O-CA 3.31Å; N1072-G1076 WeakPolarHBondContact O-CA 3.42Å; N1072-G1076 PolarHBondContact O-N 2.85Å
1077	M	81.9	Confident	75	Confident	64 Å²	64	63.8 Å²	63.8	32%	0.315	37%	0.371	S	S	.	.			trans	-94.1	149.2	178.7	-59.5	-167.9	-73.2	0	0	111	N1072 T1075 G1086 F1088	N1072-M1077 PolarHBondContact N-O 2.83Å; T1075-M1077 HydrophobicContact CG2-CE 4.25Å; T1075-M1077 PolarHBondContact O-N 3.3Å; T1075-M1077 PolarHBondContact OG1-N 2.82Å; M1077-G1086 WeakPolarHBondContact CB-O 3.5Å; M1077-G1086 WeakPolarHBondContact CE-O 3.47Å; M1077-F1088 CarbonylContact C-O 3.53Å; M1077-F1088 WeakPolarHBondContact CA-O 3.12Å
1078	W	83.2	Confident	75.6	Confident	59 Å²	59	62.9 Å²	62.9	22%	0.223	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	142	172.4	-68.7	93.2	0	0	0	110.9	P1069 R1071 G1086 F1088 E1090 L1091 V1094	P1069-W1078 HydrophobicContact CB-CE3 4.11Å; P1069-W1078 WeakPolarHBondContact O-CZ3 3.13Å; R1071-W1078 HydrophobicContact CB-CD2 4.04Å; R1071-W1078 HydrophobicContact CB-CE3 3.9Å; R1071-W1078 HydrophobicContact CB-CH2 4.32Å; R1071-W1078 HydrophobicContact CB-CZ2 4.42Å; R1071-W1078 HydrophobicContact CB-CZ3 4.05Å; R1071-W1078 HydrophobicContact CG-CD2 4.32Å; W1078-G1086 CarbonylContact O-C 3.56Å; W1078-G1086 WeakPolarHBondContact O-CA 3.44Å; W1078-F1088 HydrophobicContact CB-CB 3.96Å; W1078-F1088 PolarHBondContact N-O 3.48Å; W1078-F1088 WeakPolarHBondContact O-CD2 3.39Å; W1078-E1090 VanDerWaalsContact CD1-C 3.42Å; W1078-L1091 HydrophobicContact CD2-CB 4.05Å; W1078-L1091 HydrophobicContact CD2-CD1 4.05Å; W1078-L1091 HydrophobicContact CE3-CB 4.49Å; W1078-L1091 HydrophobicContact CE3-CD1 3.69Å; W1078-L1091 HydrophobicContact CG-CB 4.49Å; W1078-L1091 HydrophobicContact CH2-CB 4.36Å; W1078-L1091 HydrophobicContact CH2-CD1 4.17Å; W1078-L1091 HydrophobicContact CH2-CD2 4.15Å; W1078-L1091 HydrophobicContact CH2-CG 4.47Å; W1078-L1091 HydrophobicContact CZ2-CB 3.91Å; W1078-L1091 HydrophobicContact CZ2-CD2 4.39Å; W1078-L1091 HydrophobicContact CZ2-CG 4.5Å; W1078-L1091 HydrophobicContact CZ3-CD1 3.76Å; W1078-V1094 HydrophobicContact CB-CG2 3.61Å; W1078-V1094 HydrophobicContact CG-CG2 4.48Å
1079	Q	80.9	Confident	76.1	Confident	60 Å²	60	59.5 Å²	59.5	28%	0.28	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	130	179.4	-169.1	175.2	17.1	0	0	110.6	V1070 P1081 L1084 S1085	V1070-Q1079 WeakPolarHBondContact O-CB 3.47Å; V1070-Q1079 PolarHBondContact O-N 2.92Å; Q1079-P1081 WeakPolarHBondContact O-CD 2.98Å; Q1079-L1084 WeakPolarHBondContact CG-O 3.42Å; Q1079-L1084 PolarHBondContact NE2-O 2.98Å; Q1079-S1085 WeakPolarHBondContact CA-O 3.45Å
1080	C	77.7	Confident	76.5	Confident	0 Å²	0	64.9 Å²	64.9	0%	0	38%	0.378	C	S	.	.			trans	-66.3	121.4	173.1	170	0	0	0	0	110.2	F1082 C1083 L1084 S1085 F1088 V1094 Y1098	C1080-F1082 PolarHBondContact O-N 3.28Å; C1080-C1083 VanDerWaalsContact CB-SG 3.6Å; C1080-C1083 PolarHBondContact SG-N 2.87Å; C1080-C1083 PolarHBondContact SG-SG 3.5Å; C1080-L1084 WeakPolarHBondContact O-CA 3.45Å; C1080-L1084 PolarHBondContact O-N 3.5Å; C1080-S1085 PolarHBondContact N-O 3.03Å; C1080-F1088 HydrophobicContact CB-CD2 4.43Å; C1080-F1088 HydrophobicContact CB-CE2 3.69Å; C1080-F1088 HydrophobicContact CB-CZ 4.46Å; C1080-V1094 HydrophobicContact CB-CG1 4.3Å; C1080-Y1098 PolarHBondContact SG-OH 3.12Å
1081	P	73.1	Confident	76.6	Confident	43 Å²	43	63.2 Å²	63.2	28%	0.279	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-16.5	-176.8	23.3	-33.5	0	0	0	114.4	Q1079 Y1098	Q1079-P1081 WeakPolarHBondContact O-CD 2.98Å; P1081-Y1098 WeakPolarHBondContact CD-OH 3.39Å; P1081-Y1098 WeakPolarHBondContact CG-OH 2.87Å
1082	F	75.5	Confident	76.6	Confident	31 Å²	31	59.3 Å²	59.3	14%	0.136	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.5	-48.3	-177.7	-58.3	-50.6	0	0	0	114.4	P1059 I1064 T1067 C1080 Y1098 G1105 Q1106	P1059-F1082 HydrophobicContact CB-CB 4.46Å; P1059-F1082 HydrophobicContact CB-CD1 4.08Å; P1059-F1082 HydrophobicContact CB-CD2 3.69Å; P1059-F1082 HydrophobicContact CB-CE1 4.27Å; P1059-F1082 HydrophobicContact CB-CE2 4.02Å; P1059-F1082 HydrophobicContact CB-CG 3.82Å; P1059-F1082 HydrophobicContact CB-CZ 4.28Å; P1059-F1082 HydrophobicContact CG-CB 3.61Å; P1059-F1082 HydrophobicContact CG-CD1 4.15Å; P1059-F1082 HydrophobicContact CG-CD2 3.47Å; P1059-F1082 VanDerWaalsContact CG-CD2 3.47Å; P1059-F1082 HydrophobicContact CG-CE2 4.27Å; P1059-F1082 HydrophobicContact CG-CG 3.47Å; P1059-F1082 VanDerWaalsContact CG-CG 3.47Å; I1064-F1082 HydrophobicContact CB-CE2 4.28Å; I1064-F1082 HydrophobicContact CG1-CE2 3.79Å; I1064-F1082 HydrophobicContact CG1-CZ 4.18Å; I1064-F1082 HydrophobicContact CG2-CE2 4.44Å; T1067-F1082 HydrophobicContact CG2-CE1 3.98Å; T1067-F1082 HydrophobicContact CG2-CZ 4Å; T1067-F1082 WeakPolarHBondContact OG1-CZ 3.15Å; C1080-F1082 PolarHBondContact O-N 3.28Å; F1082-Y1098 HydrophobicContact CB-CE1 4.3Å; F1082-Y1098 HydrophobicContact CD2-CD1 4.24Å; F1082-Y1098 AromaticContact CD2-CE1 3.3Å; F1082-Y1098 HydrophobicContact CD2-CE1 3.3Å; F1082-Y1098 HydrophobicContact CD2-CE2 4.33Å; F1082-Y1098 AromaticContact CD2-CZ 3.29Å; F1082-Y1098 WeakPolarHBondContact CD2-OH 3.21Å; F1082-Y1098 AromaticContact CE2-CE1 3.99Å; F1082-Y1098 HydrophobicContact CE2-CE1 3.99Å; F1082-Y1098 HydrophobicContact CE2-CE2 4.4Å; F1082-Y1098 AromaticContact CE2-CZ 3.74Å; F1082-Y1098 WeakPolarHBondContact CE2-OH 3.42Å; F1082-Y1098 HydrophobicContact CG-CE1 4.25Å; F1082-Y1098 PolarHBondContact N-OH 2.98Å; F1082-G1105 CarbonylContact O-C 3.58Å; F1082-Q1106 WeakPolarHBondContact O-CA 3.45Å; F1082-Q1106 PolarHBondContact O-N 2.99Å
1083	C	73.3	Confident	77	Confident	23 Å²	23	59.7 Å²	59.7	16%	0.155	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95	-8.6	176.7	68.3	0	0	0	0	113.9	C1080 S1085 H1097 P1104	C1080-C1083 VanDerWaalsContact CB-SG 3.6Å; C1080-C1083 PolarHBondContact SG-N 2.87Å; C1080-C1083 PolarHBondContact SG-SG 3.5Å; C1083-S1085 PolarHBondContact O-N 3.04Å; C1083-S1085 VanDerWaalsContact O-N 3.17Å; C1083-S1085 VanDerWaalsContact SG-CB 3.57Å; C1083-S1085 PolarHBondContact SG-OG 2.79Å; C1083-H1097 PolarHBondContact SG-NE2 3.46Å; C1083-P1104 HydrophobicContact CB-CG 4.11Å
1084	L	71.8	Confident	76.9	Confident	73 Å²	73	54.9 Å²	54.9	38%	0.382	32%	0.319	S	S	.	.			trans	63	10.3	-177.9	-56.8	176.4	0	0	0	115.1	Q1079 C1080 G1086	Q1079-L1084 WeakPolarHBondContact CG-O 3.42Å; Q1079-L1084 PolarHBondContact NE2-O 2.98Å; C1080-L1084 WeakPolarHBondContact O-CA 3.45Å; C1080-L1084 PolarHBondContact O-N 3.5Å; L1084-G1086 PolarHBondContact O-N 3.27Å
1085	S	71	Confident	76.8	Confident	47 Å²	47	54.7 Å²	54.7	33%	0.329	30%	0.298	S	S	.	.			trans	-59.3	127.3	169.5	-62.2	0	0	0	0	109.8	Q1079 C1080 C1083 F1088	Q1079-S1085 WeakPolarHBondContact CA-O 3.45Å; C1080-S1085 PolarHBondContact N-O 3.03Å; C1083-S1085 PolarHBondContact O-N 3.04Å; C1083-S1085 VanDerWaalsContact O-N 3.17Å; C1083-S1085 VanDerWaalsContact SG-CB 3.57Å; C1083-S1085 PolarHBondContact SG-OG 2.79Å; S1085-F1088 WeakPolarHBondContact O-CD2 3.32Å; S1085-F1088 VanDerWaalsContact O-CE2 3.26Å; S1085-F1088 WeakPolarHBondContact O-CE2 3.41Å
1086	G	70.2	Confident	76.9	Confident	20 Å²	20	54.3 Å²	54.3	21%	0.206	30%	0.295	C	S	.	.			trans	-112.1	17.6	-170.9	0	0	0	0	0	114.4	M1077 W1078 L1084 F1088	M1077-G1086 WeakPolarHBondContact CB-O 3.5Å; M1077-G1086 WeakPolarHBondContact CE-O 3.47Å; W1078-G1086 CarbonylContact O-C 3.56Å; W1078-G1086 WeakPolarHBondContact O-CA 3.44Å; L1084-G1086 PolarHBondContact O-N 3.27Å; G1086-F1088 VanDerWaalsContact C-N 3.35Å
1087	D	69.7	Low	76.9	Confident	132 Å²	132	54.8 Å²	54.8	71%	0.706	29%	0.294	S	S	*	.			trans	-97.2	19.2	-170.1	-53.7	-32.5	0	0	0	112.8
1088	F	81.2	Confident	76.3	Confident	26 Å²	26	52.8 Å²	52.8	11%	0.114	28%	0.282	C	S	.	.	B	Isolated β-bridge	trans	-95	117.8	-175.8	-55.8	-73.8	0	0	0	109.9	M1077 W1078 C1080 S1085 G1086 E1093 V1094 H1097	M1077-F1088 CarbonylContact C-O 3.53Å; M1077-F1088 WeakPolarHBondContact CA-O 3.12Å; W1078-F1088 HydrophobicContact CB-CB 3.96Å; W1078-F1088 PolarHBondContact N-O 3.48Å; W1078-F1088 WeakPolarHBondContact O-CD2 3.39Å; C1080-F1088 HydrophobicContact CB-CD2 4.43Å; C1080-F1088 HydrophobicContact CB-CE2 3.69Å; C1080-F1088 HydrophobicContact CB-CZ 4.46Å; S1085-F1088 WeakPolarHBondContact O-CD2 3.32Å; S1085-F1088 VanDerWaalsContact O-CE2 3.26Å; S1085-F1088 WeakPolarHBondContact O-CE2 3.41Å; G1086-F1088 VanDerWaalsContact C-N 3.35Å; F1088-E1093 WeakPolarHBondContact CA-OE2 3.4Å; F1088-E1093 HydrophobicContact CB-CB 4.25Å; F1088-E1093 HydrophobicContact CD1-CB 3.83Å; F1088-E1093 HydrophobicContact CG-CB 4.48Å; F1088-V1094 HydrophobicContact CB-CG2 3.65Å; F1088-V1094 HydrophobicContact CD1-CG2 4.47Å; F1088-V1094 HydrophobicContact CD2-CG2 3.83Å; F1088-V1094 HydrophobicContact CG-CG2 3.73Å; F1088-H1097 HydrophobicContact CE1-CB 3.76Å; F1088-H1097 AromaticContact CE1-CG 3.98Å; F1088-H1097 HydrophobicContact CZ-CB 3.87Å; F1088-H1097 AromaticContact CZ-CD2 3.8Å; F1088-H1097 AromaticContact CZ-CG 3.61Å; F1088-H1097 AromaticContact CZ-ND1 3.93Å
1089	S	81.6	Confident	75.7	Confident	75 Å²	75	56.2 Å²	56.2	52%	0.524	31%	0.305	S	S	.	.	S	Bend	trans	-75.3	-37	-179.6	67.7	0	0	0	0	111.7	E1093	S1089-E1093 PolarHBondContact N-OE2 2.83Å; S1089-E1093 PolarHBondContact OG-OE1 3.12Å; S1089-E1093 PolarHBondContact OG-OE2 3.29Å; S1089-E1093 VanDerWaalsContact OG-OE2 3.12Å
1090	E	81	Confident	75.3	Confident	118 Å²	118	60.1 Å²	60.1	55%	0.551	33%	0.325	S	S	*	.	S	Bend	trans	-117	151.3	178.8	-64.2	-174.8	175.2	0	0	112.1	W1078 S1092 E1093	W1078-E1090 VanDerWaalsContact CD1-C 3.42Å; E1090-S1092 WeakPolarHBondContact CB-OG 3.32Å; E1090-S1092 PolarHBondContact O-N 3.34Å; E1090-S1092 PolarHBondContact OE2-OG 3.04Å; E1090-E1093 HydrophobicContact CB-CG 4.27Å; E1090-E1093 PolarHBondContact N-OE2 3.33Å; E1090-E1093 PolarHBondContact O-N 3.38Å
1091	L	79.4	Confident	74.8	Confident	63 Å²	63	67.2 Å²	67.2	33%	0.33	36%	0.359	S	S	.	.	H	α-helix	trans	-62.6	-32.6	176.1	178.6	60.3	0	0	0	111.8	P1069 W1078 E1093 V1094 W1095	P1069-L1091 HydrophobicContact CB-CD1 3.67Å; P1069-L1091 HydrophobicContact CG-CD1 3.65Å; W1078-L1091 HydrophobicContact CD2-CB 4.05Å; W1078-L1091 HydrophobicContact CD2-CD1 4.05Å; W1078-L1091 HydrophobicContact CE3-CB 4.49Å; W1078-L1091 HydrophobicContact CE3-CD1 3.69Å; W1078-L1091 HydrophobicContact CG-CB 4.49Å; W1078-L1091 HydrophobicContact CH2-CB 4.36Å; W1078-L1091 HydrophobicContact CH2-CD1 4.17Å; W1078-L1091 HydrophobicContact CH2-CD2 4.15Å; W1078-L1091 HydrophobicContact CH2-CG 4.47Å; W1078-L1091 HydrophobicContact CZ2-CB 3.91Å; W1078-L1091 HydrophobicContact CZ2-CD2 4.39Å; W1078-L1091 HydrophobicContact CZ2-CG 4.5Å; W1078-L1091 HydrophobicContact CZ3-CD1 3.76Å; L1091-E1093 VanDerWaalsContact C-N 3.31Å; L1091-E1093 PolarHBondContact O-N 2.91Å; L1091-V1094 WeakPolarHBondContact O-CB 3.41Å; L1091-V1094 PolarHBondContact O-N 3.45Å; L1091-W1095 PolarHBondContact O-N 3.49Å
1092	S	78.8	Confident	74.9	Confident	57 Å²	57	68 Å²	68	40%	0.399	37%	0.368	S	S	.	.	H	α-helix	trans	-55.2	-45	174.9	47.6	0	0	0	0	111.3	E1090 V1094 W1095 T1096	E1090-S1092 WeakPolarHBondContact CB-OG 3.32Å; E1090-S1092 PolarHBondContact O-N 3.34Å; E1090-S1092 PolarHBondContact OE2-OG 3.04Å; S1092-V1094 VanDerWaalsContact C-N 3.27Å; S1092-V1094 PolarHBondContact O-N 3.49Å; S1092-W1095 PolarHBondContact O-N 2.74Å; S1092-T1096 PolarHBondContact O-N 2.9Å; S1092-T1096 PolarHBondContact O-OG1 3.38Å
1093	E	81.7	Confident	74.9	Confident	75 Å²	75	67.2 Å²	67.2	35%	0.35	37%	0.366	S	S	.	.	H	α-helix	trans	-61.3	-33.3	-179.6	-62.1	177.7	158.3	0	0	112.8	F1088 S1089 E1090 L1091 W1095 T1096 H1097	F1088-E1093 WeakPolarHBondContact CA-OE2 3.4Å; F1088-E1093 HydrophobicContact CB-CB 4.25Å; F1088-E1093 HydrophobicContact CD1-CB 3.83Å; F1088-E1093 HydrophobicContact CG-CB 4.48Å; S1089-E1093 PolarHBondContact N-OE2 2.83Å; S1089-E1093 PolarHBondContact OG-OE1 3.12Å; S1089-E1093 PolarHBondContact OG-OE2 3.29Å; S1089-E1093 VanDerWaalsContact OG-OE2 3.12Å; E1090-E1093 HydrophobicContact CB-CG 4.27Å; E1090-E1093 PolarHBondContact N-OE2 3.33Å; E1090-E1093 PolarHBondContact O-N 3.38Å; L1091-E1093 VanDerWaalsContact C-N 3.31Å; L1091-E1093 PolarHBondContact O-N 2.91Å; E1093-W1095 VanDerWaalsContact C-N 3.33Å; E1093-T1096 PolarHBondContact O-N 2.9Å; E1093-H1097 WeakPolarHBondContact O-CB 3.44Å; E1093-H1097 PolarHBondContact O-N 3.5Å
1094	V	74.1	Confident	74.8	Confident	0 Å²	0	68.5 Å²	68.5	0%	0	38%	0.375	C	S	.	.	H	α-helix	trans	-64.8	-39.8	175.1	-175	0	0	0	0	111	P1069 W1078 C1080 F1088 L1091 S1092 H1097 Y1098	P1069-V1094 HydrophobicContact CB-CG1 4Å; P1069-V1094 HydrophobicContact CB-CG2 4.49Å; P1069-V1094 HydrophobicContact CG-CB 4.35Å; P1069-V1094 HydrophobicContact CG-CG1 3.78Å; W1078-V1094 HydrophobicContact CB-CG2 3.61Å; W1078-V1094 HydrophobicContact CG-CG2 4.48Å; C1080-V1094 HydrophobicContact CB-CG1 4.3Å; F1088-V1094 HydrophobicContact CB-CG2 3.65Å; F1088-V1094 HydrophobicContact CD1-CG2 4.47Å; F1088-V1094 HydrophobicContact CD2-CG2 3.83Å; F1088-V1094 HydrophobicContact CG-CG2 3.73Å; L1091-V1094 WeakPolarHBondContact O-CB 3.41Å; L1091-V1094 PolarHBondContact O-N 3.45Å; S1092-V1094 VanDerWaalsContact C-N 3.27Å; S1092-V1094 PolarHBondContact O-N 3.49Å; V1094-H1097 WeakPolarHBondContact O-CB 3.38Å; V1094-Y1098 HydrophobicContact CG1-CE2 3.91Å; V1094-Y1098 WeakPolarHBondContact O-CD2 3.47Å; V1094-Y1098 WeakPolarHBondContact O-CE2 3.44Å
1095	W	72.2	Confident	75.1	Confident	90 Å²	90	65 Å²	65	34%	0.341	36%	0.357	S	S	.	.	H	α-helix	trans	-71.7	-40.9	176.8	-64.4	110.8	0	0	0	111.5	I1064 P1069 L1091 S1092 E1093 H1097 Y1098 D1099	I1064-W1095 HydrophobicContact CG2-CZ3 4.01Å; P1069-W1095 HydrophobicContact CG-CZ2 4.05Å; L1091-W1095 PolarHBondContact O-N 3.49Å; S1092-W1095 PolarHBondContact O-N 2.74Å; E1093-W1095 VanDerWaalsContact C-N 3.33Å; W1095-H1097 VanDerWaalsContact C-N 3.27Å; W1095-H1097 PolarHBondContact O-N 2.78Å; W1095-Y1098 HydrophobicContact CE3-CD2 4.13Å; W1095-Y1098 WeakPolarHBondContact O-CA 3.24Å; W1095-Y1098 WeakPolarHBondContact O-CB 3.5Å; W1095-Y1098 PolarHBondContact O-N 3.19Å; W1095-D1099 PolarHBondContact O-N 2.86Å
1096	T	78.5	Confident	75.6	Confident	68 Å²	68	68.8 Å²	68.8	42%	0.417	37%	0.369	S	S	.	.	H	α-helix	trans	-60.5	-37.3	174.5	-34.3	0	0	0	0	112.1	S1092 E1093 Y1098 D1099 M1100	S1092-T1096 PolarHBondContact O-N 2.9Å; S1092-T1096 PolarHBondContact O-OG1 3.38Å; E1093-T1096 PolarHBondContact O-N 2.9Å; T1096-Y1098 PolarHBondContact O-N 3.08Å; T1096-D1099 PolarHBondContact O-N 3.09Å; T1096-M1100 HydrophobicContact CG2-CE 4.43Å; T1096-M1100 HydrophobicContact CG2-CG 4.07Å; T1096-M1100 WeakPolarHBondContact O-CB 3.46Å; T1096-M1100 WeakPolarHBondContact O-CG 3.33Å; T1096-M1100 PolarHBondContact O-N 3.44Å
1097	H	77.7	Confident	76.2	Confident	27 Å²	27	68.6 Å²	68.6	13%	0.125	37%	0.366	C	S	.	.	H	α-helix	trans	-59.9	-27.5	173.8	174.7	71.3	0	0	0	112.9	C1083 F1088 E1093 V1094 W1095 A1102 C1103	C1083-H1097 PolarHBondContact SG-NE2 3.46Å; F1088-H1097 HydrophobicContact CE1-CB 3.76Å; F1088-H1097 AromaticContact CE1-CG 3.98Å; F1088-H1097 HydrophobicContact CZ-CB 3.87Å; F1088-H1097 AromaticContact CZ-CD2 3.8Å; F1088-H1097 AromaticContact CZ-CG 3.61Å; F1088-H1097 AromaticContact CZ-ND1 3.93Å; E1093-H1097 WeakPolarHBondContact O-CB 3.44Å; E1093-H1097 PolarHBondContact O-N 3.5Å; V1094-H1097 WeakPolarHBondContact O-CB 3.38Å; W1095-H1097 VanDerWaalsContact C-N 3.27Å; W1095-H1097 PolarHBondContact O-N 2.78Å; H1097-A1102 PolarHBondContact CE1-O 3.49Å; H1097-A1102 CarbonylContact O-C 3.52Å; H1097-A1102 WeakPolarHBondContact O-CB 3.26Å; H1097-A1102 PolarHBondContact O-N 3.4Å; H1097-A1102 VanDerWaalsContact O-N 3.1Å; H1097-C1103 VanDerWaalsContact CE1-CA 3.44Å; H1097-C1103 WeakPolarHBondContact CE1-CA 3.39Å; H1097-C1103 WeakPolarHBondContact NE2-CA 3.46Å; H1097-C1103 WeakPolarHBondContact NE2-CB 3.47Å; H1097-C1103 PolarHBondContact NE2-SG 3.07Å; H1097-C1103 VanDerWaalsContact NE2-SG 3.35Å; H1097-C1103 PolarHBondContact O-N 3.28Å
1098	Y	69.6	Low	77	Confident	21 Å²	21	65 Å²	65	8%	0.082	35%	0.349	C	S	.	.	H	α-helix	trans	-85.5	-48	171.8	-64.8	-55.9	0	0	0	113.3	C1080 P1081 F1082 V1094 W1095 T1096 M1100 E1101 C1103	C1080-Y1098 PolarHBondContact SG-OH 3.12Å; P1081-Y1098 WeakPolarHBondContact CD-OH 3.39Å; P1081-Y1098 WeakPolarHBondContact CG-OH 2.87Å; F1082-Y1098 HydrophobicContact CB-CE1 4.3Å; F1082-Y1098 HydrophobicContact CD2-CD1 4.24Å; F1082-Y1098 AromaticContact CD2-CE1 3.3Å; F1082-Y1098 HydrophobicContact CD2-CE1 3.3Å; F1082-Y1098 HydrophobicContact CD2-CE2 4.33Å; F1082-Y1098 AromaticContact CD2-CZ 3.29Å; F1082-Y1098 WeakPolarHBondContact CD2-OH 3.21Å; F1082-Y1098 AromaticContact CE2-CE1 3.99Å; F1082-Y1098 HydrophobicContact CE2-CE1 3.99Å; F1082-Y1098 HydrophobicContact CE2-CE2 4.4Å; F1082-Y1098 AromaticContact CE2-CZ 3.74Å; F1082-Y1098 WeakPolarHBondContact CE2-OH 3.42Å; F1082-Y1098 HydrophobicContact CG-CE1 4.25Å; F1082-Y1098 PolarHBondContact N-OH 2.98Å; V1094-Y1098 HydrophobicContact CG1-CE2 3.91Å; V1094-Y1098 WeakPolarHBondContact O-CD2 3.47Å; V1094-Y1098 WeakPolarHBondContact O-CE2 3.44Å; W1095-Y1098 HydrophobicContact CE3-CD2 4.13Å; W1095-Y1098 WeakPolarHBondContact O-CA 3.24Å; W1095-Y1098 WeakPolarHBondContact O-CB 3.5Å; W1095-Y1098 PolarHBondContact O-N 3.19Å; T1096-Y1098 PolarHBondContact O-N 3.08Å; Y1098-M1100 PolarHBondContact O-N 2.98Å; Y1098-E1101 WeakPolarHBondContact O-CA 3.45Å; Y1098-E1101 PolarHBondContact O-N 3.28Å; Y1098-C1103 HydrophobicContact CD1-CB 3.56Å; Y1098-C1103 HydrophobicContact CE1-CB 3.64Å; Y1098-C1103 VanDerWaalsContact CE1-SG 3.53Å
1099	D	72	Confident	77.3	Confident	132 Å²	132	63.8 Å²	63.8	71%	0.706	34%	0.343	S	S	*	.	H	α-helix	trans	-62.4	-32.3	-175.2	-70.2	-21.6	0	0	0	111.8	W1095 T1096 E1101	W1095-D1099 PolarHBondContact O-N 2.86Å; T1096-D1099 PolarHBondContact O-N 3.09Å; D1099-E1101 PolarHBondContact O-N 3.31Å
1100	M	72.6	Confident	77.8	Confident	142 Å²	142	60.2 Å²	60.2	70%	0.7	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	9.7	174.1	-64.1	-66.2	176.1	0	0	113.7	T1096 Y1098 A1102	T1096-M1100 HydrophobicContact CG2-CE 4.43Å; T1096-M1100 HydrophobicContact CG2-CG 4.07Å; T1096-M1100 WeakPolarHBondContact O-CB 3.46Å; T1096-M1100 WeakPolarHBondContact O-CG 3.33Å; T1096-M1100 PolarHBondContact O-N 3.44Å; Y1098-M1100 PolarHBondContact O-N 2.98Å; M1100-A1102 HydrophobicContact CB-CB 4.49Å; M1100-A1102 PolarHBondContact O-N 2.86Å
1101	E	67	Low	78.2	Confident	149 Å²	149	59 Å²	59	70%	0.696	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.2	22.3	-173.9	-56.7	-165.3	156.8	0	0	114.1	Y1098 D1099 C1103	Y1098-E1101 WeakPolarHBondContact O-CA 3.45Å; Y1098-E1101 PolarHBondContact O-N 3.28Å; D1099-E1101 PolarHBondContact O-N 3.31Å; E1101-C1103 VanDerWaalsContact C-N 3.29Å; E1101-C1103 PolarHBondContact O-N 3.44Å
1102	A	73.8	Confident	78.7	Confident	59 Å²	59	56.1 Å²	56.1	49%	0.488	29%	0.293	S	S	.	.			trans	-77.2	-15.8	-176.3	0	0	0	0	0	112.6	H1097 M1100 P1104	H1097-A1102 PolarHBondContact CE1-O 3.49Å; H1097-A1102 CarbonylContact O-C 3.52Å; H1097-A1102 WeakPolarHBondContact O-CB 3.26Å; H1097-A1102 PolarHBondContact O-N 3.4Å; H1097-A1102 VanDerWaalsContact O-N 3.1Å; M1100-A1102 HydrophobicContact CB-CB 4.49Å; M1100-A1102 PolarHBondContact O-N 2.86Å; A1102-P1104 VanDerWaalsContact O-CD 3.24Å; A1102-P1104 WeakPolarHBondContact O-CD 3.3Å
1103	C	76.1	Confident	79	Confident	14 Å²	14	54.6 Å²	54.6	10%	0.095	28%	0.279	C	S	.	.			trans	-74.8	114.8	178.7	-167.7	0	0	0	0	112.8	H1097 Y1098 E1101 G1105	H1097-C1103 VanDerWaalsContact CE1-CA 3.44Å; H1097-C1103 WeakPolarHBondContact CE1-CA 3.39Å; H1097-C1103 WeakPolarHBondContact NE2-CA 3.46Å; H1097-C1103 WeakPolarHBondContact NE2-CB 3.47Å; H1097-C1103 PolarHBondContact NE2-SG 3.07Å; H1097-C1103 VanDerWaalsContact NE2-SG 3.35Å; H1097-C1103 PolarHBondContact O-N 3.28Å; Y1098-C1103 HydrophobicContact CD1-CB 3.56Å; Y1098-C1103 HydrophobicContact CE1-CB 3.64Å; Y1098-C1103 VanDerWaalsContact CE1-SG 3.53Å; E1101-C1103 VanDerWaalsContact C-N 3.29Å; E1101-C1103 PolarHBondContact O-N 3.44Å; C1103-G1105 PolarHBondContact O-N 3.48Å; C1103-G1105 PolarHBondContact SG-N 2.96Å
1104	P	70.7	Confident	79	Confident	50 Å²	50	51.1 Å²	51.1	33%	0.325	26%	0.263	S	S	.	.			trans	-68.7	-24	175.1	28.8	-34.2	0	0	0	112.2	Y1056 C1083 A1102	Y1056-P1104 WeakPolarHBondContact CB-O 3.24Å; Y1056-P1104 HydrophobicContact CD1-CB 3.9Å; Y1056-P1104 HydrophobicContact CD1-CG 4.33Å; Y1056-P1104 HydrophobicContact CD2-CB 4.12Å; Y1056-P1104 HydrophobicContact CE1-CB 4.26Å; Y1056-P1104 HydrophobicContact CE1-CG 4.38Å; Y1056-P1104 HydrophobicContact CE2-CB 4.46Å; Y1056-P1104 HydrophobicContact CG-CB 3.83Å; C1083-P1104 HydrophobicContact CB-CG 4.11Å; A1102-P1104 VanDerWaalsContact O-CD 3.24Å; A1102-P1104 WeakPolarHBondContact O-CD 3.3Å
1105	G	79.3	Confident	78.9	Confident	1 Å²	1	56.3 Å²	56.3	1%	0.01	29%	0.287	C	S	.	.			trans	85.3	-163.5	-171.6	0	0	0	0	0	113	Y1056 R1057 F1082 C1103	Y1056-G1105 WeakPolarHBondContact CD1-O 3.49Å; R1057-G1105 WeakPolarHBondContact O-CA 3.44Å; F1082-G1105 CarbonylContact O-C 3.58Å; C1103-G1105 PolarHBondContact O-N 3.48Å; C1103-G1105 PolarHBondContact SG-N 2.96Å
1106	Q	81.4	Confident	78.6	Confident	126 Å²	126	53.7 Å²	53.7	59%	0.589	29%	0.285	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.6	131.6	-175.7	-169.6	179.7	7.5	0	0	110.9	Y1056 R1057 F1082 V1108	Y1056-Q1106 CarbonylContact C-O 3.56Å; Y1056-Q1106 WeakPolarHBondContact CA-O 3.41Å; R1057-Q1106 PolarHBondContact N-O 3.2Å; R1057-Q1106 PolarHBondContact O-N 2.65Å; F1082-Q1106 WeakPolarHBondContact O-CA 3.45Å; F1082-Q1106 PolarHBondContact O-N 2.99Å; Q1106-V1108 PolarHBondContact O-N 3.33Å
1107	A	81.7	Confident	78.1	Confident	16 Å²	16	50.5 Å²	50.5	13%	0.132	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	128.7	175.3	0	0	0	0	0	111.2	I1054 Y1056 V1124 P1135	I1054-A1107 HydrophobicContact CG2-CB 4.34Å; Y1056-A1107 HydrophobicContact CD1-CB 3.91Å; Y1056-A1107 HydrophobicContact CE1-CB 3.86Å; A1107-V1124 HydrophobicContact CB-CG2 4.02Å; A1107-V1124 WeakPolarHBondContact O-CG2 3.44Å; A1107-P1135 HydrophobicContact CB-CG 3.64Å
1108	V	86.3	Confident	78.1	Confident	57 Å²	57	49.2 Å²	49.2	35%	0.345	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	-36.8	-179.5	-173.9	0	0	0	0	111.1	V1055 R1057 Q1106 F1121 V1124	V1055-V1108 PolarHBondContact O-N 3.18Å; R1057-V1108 HydrophobicContact CB-CG2 3.48Å; R1057-V1108 VanDerWaalsContact CB-CG2 3.48Å; Q1106-V1108 PolarHBondContact O-N 3.33Å; V1108-F1121 HydrophobicContact CG1-CZ 4.1Å; V1108-V1124 PolarHBondContact O-N 3.5Å
1109	G	88.8	Confident	78.7	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	174	-175.5	177.2	0	0	0	0	0	113.1	V1055 I1122	V1055-G1109 PolarHBondContact N-O 2.8Å; V1055-G1109 PolarHBondContact O-N 2.82Å; G1109-I1122 CarbonylContact C-O 3.48Å; G1109-I1122 WeakPolarHBondContact CA-O 3.34Å
1110	V	90.7	Very high	79.5	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	133.8	179.3	-179.3	0	0	0	0	108.9	V1051 I1054 L1112 F1121 I1122 L1127 P1135 I1139	V1051-V1110 HydrophobicContact CB-CG1 4.41Å; V1051-V1110 HydrophobicContact CG1-CG1 3.52Å; V1051-V1110 HydrophobicContact CG2-CG1 4.23Å; I1054-V1110 HydrophobicContact CG1-CG2 4.37Å; V1110-L1112 HydrophobicContact CG1-CD1 4.32Å; V1110-L1112 HydrophobicContact CG1-CG 4.48Å; V1110-F1121 WeakPolarHBondContact O-CA 3.4Å; V1110-F1121 WeakPolarHBondContact O-CD2 3.44Å; V1110-I1122 PolarHBondContact N-O 2.7Å; V1110-I1122 PolarHBondContact O-N 3.19Å; V1110-L1127 HydrophobicContact CB-CD2 4.42Å; V1110-L1127 HydrophobicContact CG2-CD1 4.14Å; V1110-L1127 HydrophobicContact CG2-CD2 3.83Å; V1110-P1135 HydrophobicContact CG2-CB 4.13Å; V1110-I1139 HydrophobicContact CG2-CD1 4.37Å
1111	R	90.7	Very high	80.5	Confident	93 Å²	93	38.4 Å²	38.4	35%	0.351	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	128.2	174.4	-167.6	171.1	-170.6	140.5	2.6	110.1	M1052 R1053 V1055 T1119	M1052-R1111 PolarHBondContact N-O 3.29Å; R1053-R1111 HydrophobicContact CG-CB 4.37Å; R1053-R1111 PolarHBondContact N-O 2.97Å; R1053-R1111 PolarHBondContact O-N 3.02Å; V1055-R1111 HydrophobicContact CG2-CB 4.08Å; R1111-T1119 PolarHBondContact NH2-OG1 3.2Å; R1111-T1119 VanDerWaalsContact NH2-OG1 3.08Å
1112	L	89.3	Confident	81.8	Confident	2 Å²	2	31.3 Å²	31.3	1%	0.01	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	158.7	180	-57.6	95.5	0	0	0	111.3	R1050 V1051 V1110 G1120 I1122 L1145 L1161	R1050-L1112 CarbonylContact O-C 3.38Å; R1050-L1112 VanDerWaalsContact O-CA 3.28Å; R1050-L1112 WeakPolarHBondContact O-CA 3.2Å; V1051-L1112 HydrophobicContact CG2-CD2 4.11Å; V1051-L1112 HydrophobicContact CG2-CG 4.43Å; V1110-L1112 HydrophobicContact CG1-CD1 4.32Å; V1110-L1112 HydrophobicContact CG1-CG 4.48Å; L1112-G1120 PolarHBondContact N-O 3.47Å; L1112-G1120 PolarHBondContact O-N 3.03Å; L1112-I1122 HydrophobicContact CD1-CB 4.15Å; L1112-I1122 HydrophobicContact CD1-CD1 3.36Å; L1112-I1122 HydrophobicContact CD1-CG1 3.43Å; L1112-I1122 VanDerWaalsContact CD1-CG1 3.43Å; L1112-I1122 HydrophobicContact CD2-CD1 3.98Å; L1112-I1122 HydrophobicContact CG-CD1 4.32Å; L1112-L1145 HydrophobicContact CD2-CB 3.93Å; L1112-L1145 HydrophobicContact CD2-CD2 3.95Å; L1112-L1161 HydrophobicContact CD1-CD1 4.27Å
1113	R	85.1	Confident	82.6	Confident	24 Å²	24	29.5 Å²	29.5	9%	0.091	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	119.1	169.4	176.5	168.4	-65.8	163.2	0.9	108.6	W728 G1049 R1050 M1052	W728-R1113 HydrophobicContact CE3-CG 4.29Å; W728-R1113 WeakPolarHBondContact CH2-O 3.48Å; W728-R1113 HydrophobicContact CZ3-CB 4.02Å; W728-R1113 HydrophobicContact CZ3-CG 3.86Å; W728-R1113 VanDerWaalsContact CZ3-O 3.26Å; W728-R1113 WeakPolarHBondContact CZ3-O 3.32Å; G1049-R1113 CarbonylContact C-O 3.53Å; G1049-R1113 WeakPolarHBondContact CA-O 3.26Å; R1050-R1113 PolarHBondContact N-O 3.48Å; R1050-R1113 PolarHBondContact O-N 3.44Å; M1052-R1113 HydrophobicContact CG-CB 3.84Å; M1052-R1113 HydrophobicContact SD-CB 3.99Å
1114	L	81.4	Confident	83.1	Confident	3 Å²	3	30.1 Å²	30.1	2%	0.016	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	161.5	177.7	-59.9	-176	0	0	0	111.1	F1041 V1047 A1116 G1117 L1118 V1159 L1161	F1041-L1114 HydrophobicContact CE2-CD1 4.15Å; F1041-L1114 HydrophobicContact CZ-CD1 3.87Å; V1047-L1114 HydrophobicContact CB-CD2 4.17Å; V1047-L1114 HydrophobicContact CG2-CD1 3.97Å; V1047-L1114 HydrophobicContact CG2-CD2 3.57Å; V1047-L1114 HydrophobicContact CG2-CG 4.42Å; L1114-A1116 VanDerWaalsContact C-N 3.28Å; L1114-A1116 PolarHBondContact O-N 3.37Å; L1114-G1117 PolarHBondContact O-N 3.18Å; L1114-L1118 HydrophobicContact CD1-CB 4.4Å; L1114-L1118 PolarHBondContact N-O 3.25Å; L1114-V1159 HydrophobicContact CD1-CG2 3.39Å; L1114-L1161 HydrophobicContact CD2-CD1 3.92Å
1115	E	72.9	Confident	83.9	Confident	108 Å²	108	34.8 Å²	34.8	51%	0.505	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-38	177.6	-63.4	-168	153.6	0	0	112.2	N731 L1048 G1117	N731-E1115 PolarHBondContact ND2-O 3.09Å; L1048-E1115 HydrophobicContact CB-CG 4.5Å; E1115-G1117 PolarHBondContact O-N 3.39Å
1116	A	64.6	Low	84.4	Confident	36 Å²	36	36.9 Å²	36.9	30%	0.298	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	4.2	172	0	0	0	0	0	114.3	F1041 L1114 L1118	F1041-A1116 HydrophobicContact CE2-CB 4.44Å; L1114-A1116 VanDerWaalsContact C-N 3.28Å; L1114-A1116 PolarHBondContact O-N 3.37Å; A1116-L1118 PolarHBondContact O-N 2.91Å; A1116-L1118 VanDerWaalsContact O-N 3.16Å
1117	G	67.7	Low	84.6	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.155	C	C	.	.	S	Bend	trans	79.8	-12	179.7	0	0	0	0	0	114.9	N731 L1114 E1115	N731-G1117 WeakPolarHBondContact O-CA 3.48Å; L1114-G1117 PolarHBondContact O-N 3.18Å; E1115-G1117 PolarHBondContact O-N 3.39Å
1118	L	77.9	Confident	84.6	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	16%	0.161	C	C	.	.	P	Polyproline II helix	trans	-64	151.1	177.2	-64.3	173.8	0	0	0	112.2	Y735 F1030 I1034 F1041 L1114 A1116 M1157	Y735-L1118 HydrophobicContact CD1-CD2 4.38Å; Y735-L1118 HydrophobicContact CE1-CD2 4.07Å; F1030-L1118 HydrophobicContact CE2-CD1 3.78Å; F1030-L1118 HydrophobicContact CE2-CD2 4.06Å; F1030-L1118 HydrophobicContact CZ-CD1 3.59Å; I1034-L1118 HydrophobicContact CG2-CD1 4.23Å; I1034-L1118 HydrophobicContact CG2-CD2 4.27Å; I1034-L1118 HydrophobicContact CG2-CG 4.33Å; F1041-L1118 HydrophobicContact CD1-CD1 4.48Å; F1041-L1118 HydrophobicContact CE1-CD1 3.6Å; F1041-L1118 HydrophobicContact CE2-CD1 4.35Å; F1041-L1118 HydrophobicContact CZ-CD1 3.51Å; L1114-L1118 HydrophobicContact CD1-CB 4.4Å; L1114-L1118 PolarHBondContact N-O 3.25Å; A1116-L1118 PolarHBondContact O-N 2.91Å; A1116-L1118 VanDerWaalsContact O-N 3.16Å; L1118-M1157 HydrophobicContact CD2-CB 4.23Å; L1118-M1157 HydrophobicContact CD2-CE 4.24Å; L1118-M1157 WeakPolarHBondContact CD2-O 3.42Å
1119	T	82.2	Confident	84.4	Confident	13 Å²	13	32.6 Å²	32.6	8%	0.08	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	120.7	173	66.3	0	0	0	0	110.9	F732 R1111 S1158 V1159	F732-T1119 HydrophobicContact CD2-CG2 4.11Å; F732-T1119 HydrophobicContact CE2-CG2 3.66Å; R1111-T1119 PolarHBondContact NH2-OG1 3.2Å; R1111-T1119 VanDerWaalsContact NH2-OG1 3.08Å; T1119-S1158 WeakPolarHBondContact O-CA 3.45Å; T1119-S1158 WeakPolarHBondContact O-CB 3.21Å; T1119-V1159 PolarHBondContact O-N 2.95Å; T1119-V1159 VanDerWaalsContact O-N 3.12Å
1120	G	89.4	Confident	84.1	Confident	1 Å²	1	36.8 Å²	36.8	1%	0.01	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	148.6	172.1	0	0	0	0	0	111.7	L1112 V1159	L1112-G1120 PolarHBondContact N-O 3.47Å; L1112-G1120 PolarHBondContact O-N 3.03Å; G1120-V1159 CarbonylContact C-O 3.59Å; G1120-V1159 VanDerWaalsContact CA-O 3.28Å; G1120-V1159 WeakPolarHBondContact CA-O 3.17Å
1121	F	93.3	Very high	83.4	Confident	54 Å²	54	48.3 Å²	48.3	24%	0.237	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	127.4	172.9	-176.9	-108.4	0	0	0	110.7	V1055 V1108 V1110 P1123 V1159 D1160 L1161	V1055-F1121 HydrophobicContact CB-CE2 4.16Å; V1055-F1121 HydrophobicContact CG2-CE2 4.06Å; V1108-F1121 HydrophobicContact CG1-CZ 4.1Å; V1110-F1121 WeakPolarHBondContact O-CA 3.4Å; V1110-F1121 WeakPolarHBondContact O-CD2 3.44Å; F1121-P1123 HydrophobicContact CD1-CG 4.02Å; F1121-P1123 HydrophobicContact CE1-CB 4.3Å; F1121-P1123 HydrophobicContact CE1-CG 3.86Å; F1121-P1123 WeakPolarHBondContact O-CD 3.3Å; F1121-V1159 PolarHBondContact N-O 2.72Å; F1121-D1160 CarbonylContact O-C 3.54Å; F1121-D1160 WeakPolarHBondContact O-CA 3.49Å; F1121-L1161 PolarHBondContact O-N 3.19Å
1122	I	93.8	Very high	82.5	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	104.5	173	-61	169.1	0	0	0	108.2	G1109 V1110 L1112 F1126 L1127 L1145 A1147 L1161 C1163	G1109-I1122 CarbonylContact C-O 3.48Å; G1109-I1122 WeakPolarHBondContact CA-O 3.34Å; V1110-I1122 PolarHBondContact N-O 2.7Å; V1110-I1122 PolarHBondContact O-N 3.19Å; L1112-I1122 HydrophobicContact CD1-CB 4.15Å; L1112-I1122 HydrophobicContact CD1-CD1 3.36Å; L1112-I1122 HydrophobicContact CD1-CG1 3.43Å; L1112-I1122 VanDerWaalsContact CD1-CG1 3.43Å; L1112-I1122 HydrophobicContact CD2-CD1 3.98Å; L1112-I1122 HydrophobicContact CG-CD1 4.32Å; I1122-F1126 HydrophobicContact CG2-CB 4.1Å; I1122-F1126 WeakPolarHBondContact CG2-O 3.38Å; I1122-L1127 HydrophobicContact CB-CD2 4.27Å; I1122-L1127 HydrophobicContact CG2-CD2 3.62Å; I1122-L1127 HydrophobicContact CG2-CG 4.03Å; I1122-L1145 HydrophobicContact CD1-CD2 3.58Å; I1122-A1147 HydrophobicContact CD1-CB 3.87Å; I1122-L1161 HydrophobicContact CD1-CB 4.29Å; I1122-L1161 HydrophobicContact CG1-CB 3.56Å; I1122-C1163 HydrophobicContact CD1-CB 4.28Å
1123	P	91.4	Very high	81.5	Confident	21 Å²	21	49.1 Å²	49.1	14%	0.136	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-52.6	145.3	168.6	-25.1	32.9	0	0	0	111.9	F1121 K1125 F1126	F1121-P1123 HydrophobicContact CD1-CG 4.02Å; F1121-P1123 HydrophobicContact CE1-CB 4.3Å; F1121-P1123 HydrophobicContact CE1-CG 3.86Å; F1121-P1123 WeakPolarHBondContact O-CD 3.3Å; P1123-K1125 HydrophobicContact CB-CG 3.89Å; P1123-K1125 PolarHBondContact O-N 3.12Å; P1123-K1125 VanDerWaalsContact O-N 3.08Å; P1123-F1126 HydrophobicContact CB-CD2 4.01Å; P1123-F1126 HydrophobicContact CG-CD2 3.78Å; P1123-F1126 HydrophobicContact CG-CE2 4.29Å; P1123-F1126 WeakPolarHBondContact O-CA 3.47Å; P1123-F1126 PolarHBondContact O-N 3.18Å
1124	V	86.9	Confident	80.8	Confident	27 Å²	27	51.2 Å²	51.2	16%	0.164	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-54	-36.2	-178.1	169.5	0	0	0	0	112.9	A1107 V1108 F1126 L1127 V1132 P1135	A1107-V1124 HydrophobicContact CB-CG2 4.02Å; A1107-V1124 WeakPolarHBondContact O-CG2 3.44Å; V1108-V1124 PolarHBondContact O-N 3.5Å; V1124-F1126 PolarHBondContact O-N 3.47Å; V1124-F1126 VanDerWaalsContact O-N 3.13Å; V1124-L1127 HydrophobicContact CB-CD1 4.32Å; V1124-L1127 HydrophobicContact CG1-CD1 4.36Å; V1124-L1127 HydrophobicContact CG2-CD1 4.18Å; V1124-L1127 WeakPolarHBondContact O-CB 3.44Å; V1124-L1127 PolarHBondContact O-N 3.35Å; V1124-V1132 HydrophobicContact CG1-CB 4.42Å; V1124-V1132 WeakPolarHBondContact CG1-O 3.37Å; V1124-P1135 HydrophobicContact CG2-CG 3.76Å
1125	K	86.9	Confident	80.5	Confident	148 Å²	148	51 Å²	51	64%	0.643	27%	0.265	S	S	*	.	G	3₁₀ helix	trans	-62.1	-15.3	176	62.4	172.7	-177.6	171.5	0	114.8	P1123	P1123-K1125 HydrophobicContact CB-CG 3.89Å; P1123-K1125 PolarHBondContact O-N 3.12Å; P1123-K1125 VanDerWaalsContact O-N 3.08Å
1126	F	89	Confident	80.5	Confident	45 Å²	45	47.6 Å²	47.6	20%	0.197	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-112.2	16.8	-179.1	-63.7	-38.5	0	0	0	112.5	I1122 P1123 V1124 I1150 S1162 C1163 R1164	I1122-F1126 HydrophobicContact CG2-CB 4.1Å; I1122-F1126 WeakPolarHBondContact CG2-O 3.38Å; P1123-F1126 HydrophobicContact CB-CD2 4.01Å; P1123-F1126 HydrophobicContact CG-CD2 3.78Å; P1123-F1126 HydrophobicContact CG-CE2 4.29Å; P1123-F1126 WeakPolarHBondContact O-CA 3.47Å; P1123-F1126 PolarHBondContact O-N 3.18Å; V1124-F1126 PolarHBondContact O-N 3.47Å; V1124-F1126 VanDerWaalsContact O-N 3.13Å; F1126-I1150 HydrophobicContact CD2-CD1 3.95Å; F1126-I1150 HydrophobicContact CE2-CD1 3.98Å; F1126-I1150 HydrophobicContact CG-CD1 4.24Å; F1126-I1150 HydrophobicContact CZ-CD1 4.29Å; F1126-S1162 PolarHBondContact O-OG 2.86Å; F1126-C1163 PolarHBondContact O-N 2.81Å; F1126-R1164 PolarHBondContact O-N 3.42Å
1127	L	86	Confident	80.9	Confident	9 Å²	9	52 Å²	52	5%	0.047	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-42.8	175.6	-72.7	173.4	0	0	0	113.3	V1110 I1122 V1124 V1132 P1135 I1139 C1163	V1110-L1127 HydrophobicContact CB-CD2 4.42Å; V1110-L1127 HydrophobicContact CG2-CD1 4.14Å; V1110-L1127 HydrophobicContact CG2-CD2 3.83Å; I1122-L1127 HydrophobicContact CB-CD2 4.27Å; I1122-L1127 HydrophobicContact CG2-CD2 3.62Å; I1122-L1127 HydrophobicContact CG2-CG 4.03Å; V1124-L1127 HydrophobicContact CB-CD1 4.32Å; V1124-L1127 HydrophobicContact CG1-CD1 4.36Å; V1124-L1127 HydrophobicContact CG2-CD1 4.18Å; V1124-L1127 WeakPolarHBondContact O-CB 3.44Å; V1124-L1127 PolarHBondContact O-N 3.35Å; L1127-V1132 HydrophobicContact CB-CG2 4.49Å; L1127-P1135 HydrophobicContact CD1-CB 3.72Å; L1127-P1135 HydrophobicContact CD1-CG 3.9Å; L1127-I1139 HydrophobicContact CD2-CD1 3.47Å; L1127-I1139 VanDerWaalsContact CD2-CD1 3.47Å; L1127-C1163 VanDerWaalsContact CA-SG 3.53Å; L1127-C1163 PolarHBondContact O-SG 3.24Å
1128	S	82.8	Confident	81.4	Confident	35 Å²	35	56.9 Å²	56.9	25%	0.245	30%	0.302	C	S	.	.			trans	-149.5	156.4	-177.9	-177.7	0	0	0	0	109.4	S1130	S1128-S1130 PolarHBondContact O-N 3.31Å; S1128-S1130 PolarHBondContact OG-N 2.76Å
1129	D	82.1	Confident	81.6	Confident	66 Å²	66	57.5 Å²	57.5	35%	0.353	31%	0.305	S	S	.	.	S	Bend	trans	-66.6	-26.9	170.4	-68.8	-39.6	0	0	0	112.2	R1164 T1165 S1166	D1129-R1164 IonicContact OD1-CZ 2.76Å; D1129-R1164 IonicContact OD1-NE 3.28Å; D1129-R1164 PolarHBondContact OD1-NE 2.62Å; D1129-R1164 IonicContact OD1-NH2 3.93Å; D1129-R1164 PolarHBondContact OD1-NH2 3.37Å; D1129-T1165 PolarHBondContact OD2-OG1 3.45Å; D1129-S1166 WeakPolarHBondContact OD1-CB 2.95Å; D1129-S1166 PolarHBondContact OD1-OG 2.84Å; D1129-S1166 PolarHBondContact OD2-N 2.88Å
1130	S	82.5	Confident	81.6	Confident	87 Å²	87	63.8 Å²	63.8	61%	0.608	33%	0.334	S	S	*	.	S	Bend	trans	-86.3	153.3	174.5	-65.5	0	0	0	0	111.6	S1128 V1132	S1128-S1130 PolarHBondContact O-N 3.31Å; S1128-S1130 PolarHBondContact OG-N 2.76Å; S1130-V1132 WeakPolarHBondContact O-CG2 3.42Å; S1130-V1132 PolarHBondContact O-N 3.44Å; S1130-V1132 VanDerWaalsContact O-N 3.12Å
1131	R	75.6	Confident	81.4	Confident	243 Å²	243	68.9 Å²	68.9	92%	0.917	36%	0.36	S	S	*	.			trans	-64.7	115.1	178.3	-171.9	-179.3	-172.4	-172.9	2.1	110.4
1132	V	71	Confident	80.9	Confident	27 Å²	27	67.6 Å²	67.6	16%	0.164	36%	0.362	C	S	.	.			trans	-99.7	118.4	176.2	-172.4	0	0	0	0	109.7	V1124 L1127 S1130 L1138	V1124-V1132 HydrophobicContact CG1-CB 4.42Å; V1124-V1132 WeakPolarHBondContact CG1-O 3.37Å; L1127-V1132 HydrophobicContact CB-CG2 4.49Å; S1130-V1132 WeakPolarHBondContact O-CG2 3.42Å; S1130-V1132 PolarHBondContact O-N 3.44Å; S1130-V1132 VanDerWaalsContact O-N 3.12Å; V1132-L1138 HydrophobicContact CB-CD1 4.32Å; V1132-L1138 HydrophobicContact CG1-CD1 3.85Å; V1132-L1138 HydrophobicContact CG1-CG 4.48Å; V1132-L1138 HydrophobicContact CG2-CD1 3.45Å; V1132-L1138 VanDerWaalsContact CG2-CD1 3.45Å
1133	S	67.9	Low	80.6	Confident	84 Å²	84	70.1 Å²	70.1	59%	0.587	38%	0.377	S	S	*	.	S	Bend	trans	-85.6	-45.5	174.2	-56.3	0	0	0	0	111.2
1134	N	72.1	Confident	80.5	Confident	68 Å²	68	73 Å²	73	36%	0.364	39%	0.394	S	S	.	.			trans	-120.1	111.2	179.6	-172.1	16.8	0	0	0	111	G1136 D1137	N1134-G1136 PolarHBondContact O-N 2.95Å; N1134-D1137 PolarHBondContact ND2-OD1 3.09Å; N1134-D1137 VanDerWaalsContact ND2-OD1 3.13Å; N1134-D1137 PolarHBondContact O-N 3.39Å
1135	P	73.5	Confident	80.5	Confident	0 Å²	0	73.6 Å²	73.6	0%	0	40%	0.396	C	S	.	.	G	3₁₀ helix	trans	-62.5	-24.4	-179.7	-26.1	36.5	0	0	0	114.5	I1054 A1107 V1110 V1124 L1127 D1137 L1138 I1139	I1054-P1135 HydrophobicContact CD1-CB 4.13Å; I1054-P1135 HydrophobicContact CG1-CB 4.42Å; I1054-P1135 HydrophobicContact CG2-CB 4.2Å; I1054-P1135 HydrophobicContact CG2-CG 4.13Å; A1107-P1135 HydrophobicContact CB-CG 3.64Å; V1110-P1135 HydrophobicContact CG2-CB 4.13Å; V1124-P1135 HydrophobicContact CG2-CG 3.76Å; L1127-P1135 HydrophobicContact CD1-CB 3.72Å; L1127-P1135 HydrophobicContact CD1-CG 3.9Å; P1135-D1137 PolarHBondContact O-N 3.01Å; P1135-L1138 PolarHBondContact O-N 3.5Å; P1135-I1139 PolarHBondContact O-N 3.09Å
1136	G	73.8	Confident	80.6	Confident	36 Å²	36	68.3 Å²	68.3	37%	0.371	38%	0.381	S	S	.	.	G	3₁₀ helix	trans	-63.4	-23.4	-179	0	0	0	0	0	113.8	N1134 L1138	N1134-G1136 PolarHBondContact O-N 2.95Å; G1136-L1138 VanDerWaalsContact C-N 3.29Å; G1136-L1138 PolarHBondContact O-N 3.15Å
1137	D	73.7	Confident	80.7	Confident	129 Å²	129	66.2 Å²	66.2	69%	0.69	37%	0.372	S	S	*	.	G	3₁₀ helix	trans	-74.6	-23.6	-179.8	-54.4	-14.6	0	0	0	111.8	N1134 P1135	N1134-D1137 PolarHBondContact ND2-OD1 3.09Å; N1134-D1137 VanDerWaalsContact ND2-OD1 3.13Å; N1134-D1137 PolarHBondContact O-N 3.39Å; P1135-D1137 PolarHBondContact O-N 3.01Å
1138	L	77.1	Confident	80.9	Confident	102 Å²	102	65.9 Å²	65.9	53%	0.534	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.2	-33.6	179.4	-65.4	179	0	0	0	112.7	V1132 P1135 G1136	V1132-L1138 HydrophobicContact CB-CD1 4.32Å; V1132-L1138 HydrophobicContact CG1-CD1 3.85Å; V1132-L1138 HydrophobicContact CG1-CG 4.48Å; V1132-L1138 HydrophobicContact CG2-CD1 3.45Å; V1132-L1138 VanDerWaalsContact CG2-CD1 3.45Å; P1135-L1138 PolarHBondContact O-N 3.5Å; G1136-L1138 VanDerWaalsContact C-N 3.29Å; G1136-L1138 PolarHBondContact O-N 3.15Å
1139	I	81.9	Confident	81.3	Confident	12 Å²	12	64.2 Å²	64.2	6%	0.062	36%	0.358	C	S	.	.			trans	-133.9	120.6	-168.4	-58.2	179.5	0	0	0	110.1	V1051 V1110 L1127 P1135 L1145	V1051-I1139 HydrophobicContact CB-CG2 4.12Å; V1051-I1139 HydrophobicContact CG1-CG2 3.86Å; V1051-I1139 HydrophobicContact CG2-CG2 3.49Å; V1051-I1139 VanDerWaalsContact CG2-CG2 3.49Å; V1110-I1139 HydrophobicContact CG2-CD1 4.37Å; L1127-I1139 HydrophobicContact CD2-CD1 3.47Å; L1127-I1139 VanDerWaalsContact CD2-CD1 3.47Å; P1135-I1139 PolarHBondContact O-N 3.09Å; I1139-L1145 HydrophobicContact CD1-CD2 3.93Å
1140	Q	83	Confident	81.7	Confident	146 Å²	146	63.5 Å²	63.5	68%	0.682	35%	0.354	S	S	*	.			trans	-87.5	143	171.8	-170.1	175.3	13	0	0	111.4	G1142 T1143	Q1140-G1142 PolarHBondContact O-N 3.34Å; Q1140-T1143 HydrophobicContact CB-CG2 3.91Å; Q1140-T1143 PolarHBondContact O-N 3.05Å; Q1140-T1143 PolarHBondContact O-OG1 3.08Å
1141	I	84.8	Confident	82.2	Confident	107 Å²	107	64.8 Å²	64.8	55%	0.549	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	135.3	175.2	-62.8	171.9	0	0	0	109.7	M1052	M1052-I1141 WeakPolarHBondContact O-CG2 3.3Å
1142	G	82.8	Confident	82.9	Confident	27 Å²	27	53.9 Å²	53.9	28%	0.278	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	92.3	-7.6	178	0	0	0	0	0	115	R1050 V1051 Q1140	R1050-G1142 WeakPolarHBondContact CG-O 3.26Å; R1050-G1142 PolarHBondContact NE-O 3.47Å; V1051-G1142 WeakPolarHBondContact O-CA 3.49Å; V1051-G1142 PolarHBondContact O-N 3.27Å; Q1140-G1142 PolarHBondContact O-N 3.34Å
1143	T	88.4	Confident	83.8	Confident	54 Å²	54	54.5 Å²	54.5	33%	0.331	31%	0.311	S	S	.	.			trans	-73.9	151.9	173.6	61.1	0	0	0	0	111.3	R1050 V1051 Q1140	R1050-T1143 CarbonylContact C-O 3.47Å; R1050-T1143 WeakPolarHBondContact CA-O 3.36Å; V1051-T1143 PolarHBondContact N-O 3.38Å; Q1140-T1143 HydrophobicContact CB-CG2 3.91Å; Q1140-T1143 PolarHBondContact O-N 3.05Å; Q1140-T1143 PolarHBondContact O-OG1 3.08Å
1144	T	87.8	Confident	84.6	Confident	81 Å²	81	53.6 Å²	53.6	50%	0.497	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	126.3	171.4	-55.7	0	0	0	0	108.7	L1048 G1049	L1048-T1144 HydrophobicContact CB-CG2 4.17Å; G1049-T1144 CarbonylContact O-C 3.57Å; G1049-T1144 WeakPolarHBondContact O-CA 3.32Å
1145	L	87.2	Confident	85.2	Confident	39 Å²	39	56.4 Å²	56.4	20%	0.204	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	133.6	-178.8	-173.1	72.5	0	0	0	109	G1049 V1051 L1112 I1122 I1139 C1163	G1049-L1145 PolarHBondContact N-O 3.16Å; G1049-L1145 PolarHBondContact O-N 3.33Å; V1051-L1145 HydrophobicContact CG2-CB 4.3Å; L1112-L1145 HydrophobicContact CD2-CB 3.93Å; L1112-L1145 HydrophobicContact CD2-CD2 3.95Å; I1122-L1145 HydrophobicContact CD1-CD2 3.58Å; I1139-L1145 HydrophobicContact CD1-CD2 3.93Å; L1145-C1163 HydrophobicContact CD1-CB 4.45Å; L1145-C1163 HydrophobicContact CD2-CB 3.84Å; L1145-C1163 HydrophobicContact CG-CB 4.27Å
1146	A	89.6	Confident	85.5	Confident	38 Å²	38	65.7 Å²	65.7	31%	0.314	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	128.5	165.8	0	0	0	0	0	108.8	V1046 L1048 M1168	V1046-A1146 HydrophobicContact CG1-CB 4.23Å; L1048-A1146 HydrophobicContact CD2-CB 3.74Å; A1146-M1168 HydrophobicContact CB-CE 3.72Å; A1146-M1168 VanDerWaalsContact O-CE 3.24Å; A1146-M1168 WeakPolarHBondContact O-CE 3.05Å
1147	A	90.8	Very high	85.7	Confident	1 Å²	1	64.4 Å²	64.4	1%	0.008	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	147.9	179.6	0	0	0	0	0	110.9	V1047 I1122 L1161 S1162 C1163	V1047-A1147 WeakPolarHBondContact CG2-O 3.43Å; V1047-A1147 PolarHBondContact N-O 2.89Å; V1047-A1147 PolarHBondContact O-N 2.91Å; I1122-A1147 HydrophobicContact CD1-CB 3.87Å; A1147-L1161 HydrophobicContact CB-CB 3.94Å; A1147-L1161 HydrophobicContact CB-CD1 4.24Å; A1147-S1162 CarbonylContact C-O 3.58Å; A1147-S1162 VanDerWaalsContact CA-O 3.3Å; A1147-S1162 WeakPolarHBondContact CA-O 3.48Å; A1147-S1162 WeakPolarHBondContact CB-O 3.37Å; A1147-C1163 HydrophobicContact CB-CB 4.45Å
1148	R	91.5	Very high	86.3	Confident	2 Å²	2	59.3 Å²	59.3	1%	0.008	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	136.4	-179.4	-167.1	174.8	-67.7	-97.4	6.1	111.5	E505 G1044 K1045 V1046 I1150 L1161 S1162 D1167 M1168	E505-R1148 IonicContact OE1-CZ 3Å; E505-R1148 IonicContact OE1-NH1 3.62Å; E505-R1148 PolarHBondContact OE1-NH1 3.23Å; E505-R1148 IonicContact OE1-NH2 2.68Å; E505-R1148 PolarHBondContact OE1-NH2 3.46Å; E505-R1148 IonicContact OE2-CZ 2.74Å; E505-R1148 IonicContact OE2-NH1 2.75Å; E505-R1148 IonicContact OE2-NH2 3.86Å; E505-R1148 PolarHBondContact OE2-NH2 3.45Å; G1044-R1148 WeakPolarHBondContact O-CD 3.46Å; G1044-R1148 VanDerWaalsContact O-CG 3.24Å; G1044-R1148 WeakPolarHBondContact O-CG 3.33Å; G1044-R1148 PolarHBondContact O-NH1 2.8Å; K1045-R1148 WeakPolarHBondContact O-CA 3.46Å; V1046-R1148 HydrophobicContact CG2-CB 4.29Å; V1046-R1148 HydrophobicContact CG2-CG 4.29Å; R1148-I1150 PolarHBondContact O-N 3.03Å; R1148-L1161 CarbonylContact O-C 3.46Å; R1148-L1161 WeakPolarHBondContact O-CA 3.41Å; R1148-S1162 PolarHBondContact N-O 2.89Å; R1148-S1162 PolarHBondContact O-N 2.86Å; R1148-D1167 VanDerWaalsContact CD-O 3.32Å; R1148-D1167 WeakPolarHBondContact CD-O 3.35Å; R1148-D1167 PolarHBondContact NE-O 3.41Å; R1148-M1168 HydrophobicContact CB-SD 4.11Å; R1148-M1168 PolarHBondContact NH2-O 3.34Å
1149	I	91.2	Very high	86.9	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	122.2	176.8	-60	170.7	0	0	0	109.9	F1041 G1044 K1045 V1047 I1152 V1159 L1161	F1041-I1149 HydrophobicContact CD1-CD1 4.29Å; F1041-I1149 HydrophobicContact CD2-CD1 4.34Å; F1041-I1149 HydrophobicContact CE1-CD1 3.91Å; F1041-I1149 HydrophobicContact CE2-CD1 4.01Å; F1041-I1149 HydrophobicContact CG-CD1 4.47Å; F1041-I1149 HydrophobicContact CZ-CD1 3.76Å; G1044-I1149 WeakPolarHBondContact CA-O 3.44Å; G1044-I1149 PolarHBondContact N-O 3.43Å; K1045-I1149 HydrophobicContact CB-CD1 4.49Å; K1045-I1149 PolarHBondContact O-N 3.06Å; V1047-I1149 HydrophobicContact CG1-CD1 3.8Å; V1047-I1149 HydrophobicContact CG1-CG1 4.26Å; V1047-I1149 HydrophobicContact CG2-CD1 4.35Å; V1047-I1149 HydrophobicContact CG2-CG1 3.98Å; I1149-I1152 HydrophobicContact CG2-CD1 4.37Å; I1149-I1152 HydrophobicContact CG2-CG1 3.81Å; I1149-V1159 HydrophobicContact CG2-CB 4.41Å; I1149-L1161 HydrophobicContact CB-CD2 4.19Å; I1149-L1161 HydrophobicContact CG1-CD2 3.59Å
1150	I	90.4	Very high	87.5	Confident	50 Å²	50	56.5 Å²	56.5	26%	0.256	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	-39.6	174.6	-65.2	173.7	0	0	0	110.8	I1043 F1126 R1148 D1160	I1043-I1150 WeakPolarHBondContact CG2-O 3.28Å; F1126-I1150 HydrophobicContact CD2-CD1 3.95Å; F1126-I1150 HydrophobicContact CE2-CD1 3.98Å; F1126-I1150 HydrophobicContact CG-CD1 4.24Å; F1126-I1150 HydrophobicContact CZ-CD1 4.29Å; R1148-I1150 PolarHBondContact O-N 3.03Å; I1150-D1160 PolarHBondContact N-O 3.05Å
1151	K	91.9	Very high	88	Confident	115 Å²	115	49.6 Å²	49.6	50%	0.5	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	141.2	-175.6	-175.9	-177	175.7	-174.4	0	110.7	V1159 D1160	K1151-V1159 CarbonylContact O-C 3.56Å; K1151-V1159 WeakPolarHBondContact O-CA 3.31Å; K1151-D1160 HydrophobicContact CB-CB 4.18Å; K1151-D1160 PolarHBondContact N-O 3.32Å; K1151-D1160 PolarHBondContact O-N 2.7Å
1152	I	90	Very high	88.3	Confident	13 Å²	13	44.5 Å²	44.5	7%	0.067	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	130.2	172.8	-55	178.3	0	0	0	108.2	F1030 I1043 I1149 Y1154 V1159	F1030-I1152 HydrophobicContact CE1-CG2 4.17Å; F1030-I1152 HydrophobicContact CE2-CG2 4.07Å; F1030-I1152 HydrophobicContact CZ-CG2 3.82Å; I1043-I1152 HydrophobicContact CG1-CD1 4.4Å; I1043-I1152 HydrophobicContact CG1-CG1 4.24Å; I1149-I1152 HydrophobicContact CG2-CD1 4.37Å; I1149-I1152 HydrophobicContact CG2-CG1 3.81Å; I1152-Y1154 HydrophobicContact CB-CE1 4.31Å; I1152-Y1154 HydrophobicContact CG2-CD1 3.77Å; I1152-Y1154 HydrophobicContact CG2-CE1 3.63Å; I1152-Y1154 HydrophobicContact CG2-CG 4.46Å; I1152-V1159 HydrophobicContact CB-CG1 4.41Å; I1152-V1159 HydrophobicContact CG1-CG1 4.03Å; I1152-V1159 HydrophobicContact CG2-CG1 4.24Å
1153	D	89.7	Confident	88.7	Confident	41 Å²	41	44.2 Å²	44.2	22%	0.219	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	97.7	170.5	-174.2	-24.7	0	0	0	108.8	N1155 R1156 M1157 S1158	D1153-N1155 VanDerWaalsContact C-N 3.25Å; D1153-N1155 PolarHBondContact O-N 2.96Å; D1153-N1155 WeakPolarHBondContact OD1-CB 2.84Å; D1153-N1155 PolarHBondContact OD1-N 3.14Å; D1153-R1156 HydrophobicContact CB-CB 4.32Å; D1153-R1156 PolarHBondContact O-N 3.35Å; D1153-R1156 PolarHBondContact OD1-N 3.02Å; D1153-R1156 VanDerWaalsContact OD2-CD 3.32Å; D1153-R1156 WeakPolarHBondContact OD2-CD 3.2Å; D1153-R1156 WeakPolarHBondContact OD2-CG 3.44Å; D1153-R1156 IonicContact OD2-NE 2.91Å; D1153-M1157 WeakPolarHBondContact O-CA 3.5Å; D1153-M1157 PolarHBondContact O-N 3.3Å; D1153-S1158 PolarHBondContact N-O 2.78Å; D1153-S1158 PolarHBondContact O-N 2.9Å
1154	Y	86.4	Confident	88.7	Confident	64 Å²	64	44.8 Å²	44.8	25%	0.251	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-28.3	179.9	-54.5	-67	0	0	0	112.8	E1027 F1030 Y1031 I1152	E1027-Y1154 HydrophobicContact CB-CD1 4.22Å; E1027-Y1154 HydrophobicContact CB-CD2 4.5Å; E1027-Y1154 HydrophobicContact CB-CE1 4.18Å; E1027-Y1154 HydrophobicContact CB-CE2 4.46Å; E1027-Y1154 HydrophobicContact CB-CG 4.37Å; E1027-Y1154 HydrophobicContact CG-CD1 4.31Å; E1027-Y1154 HydrophobicContact CG-CE1 3.79Å; E1027-Y1154 HydrophobicContact CG-CE2 4.46Å; E1027-Y1154 PolarHBondContact OE1-OH 3.04Å; F1030-Y1154 HydrophobicContact CB-CD1 3.88Å; F1030-Y1154 HydrophobicContact CD1-CD1 4.05Å; F1030-Y1154 HydrophobicContact CD1-CE1 4.12Å; F1030-Y1154 HydrophobicContact CD2-CD1 4.2Å; F1030-Y1154 AromaticContact CG-CD1 3.8Å; F1030-Y1154 HydrophobicContact CG-CD1 3.8Å; F1030-Y1154 HydrophobicContact CG-CE1 4.34Å; Y1031-Y1154 HydrophobicContact CE2-CE1 4.29Å; I1152-Y1154 HydrophobicContact CB-CE1 4.31Å; I1152-Y1154 HydrophobicContact CG2-CD1 3.77Å; I1152-Y1154 HydrophobicContact CG2-CE1 3.63Å; I1152-Y1154 HydrophobicContact CG2-CG 4.46Å
1155	N	83.1	Confident	88.6	Confident	128 Å²	128	44.6 Å²	44.6	68%	0.684	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.1	-39	-179.5	-66.2	-49.3	0	0	0	111.5	D1153	D1153-N1155 VanDerWaalsContact C-N 3.25Å; D1153-N1155 PolarHBondContact O-N 2.96Å; D1153-N1155 WeakPolarHBondContact OD1-CB 2.84Å; D1153-N1155 PolarHBondContact OD1-N 3.14Å
1156	R	81.2	Confident	88.5	Confident	194 Å²	194	43.8 Å²	43.8	73%	0.732	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.2	-8.3	179.6	-65	-174.4	177	-167.7	-1	113.5	D1153 S1158	D1153-R1156 HydrophobicContact CB-CB 4.32Å; D1153-R1156 PolarHBondContact O-N 3.35Å; D1153-R1156 PolarHBondContact OD1-N 3.02Å; D1153-R1156 VanDerWaalsContact OD2-CD 3.32Å; D1153-R1156 WeakPolarHBondContact OD2-CD 3.2Å; D1153-R1156 WeakPolarHBondContact OD2-CG 3.44Å; D1153-R1156 IonicContact OD2-NE 2.91Å; R1156-S1158 VanDerWaalsContact C-N 3.28Å; R1156-S1158 WeakPolarHBondContact CB-OG 3.5Å; R1156-S1158 PolarHBondContact O-N 2.92Å
1157	M	78.4	Confident	88.2	Confident	9 Å²	9	43 Å²	43	4%	0.044	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	52	49.9	-172.3	-58.7	-76.7	-63	0	0	110.5	Y735 L739 F1030 L1033 L1118 D1153	Y735-M1157 HydrophobicContact CD2-CB 4.06Å; Y735-M1157 HydrophobicContact CD2-CE 3.74Å; Y735-M1157 HydrophobicContact CD2-CG 4.13Å; Y735-M1157 HydrophobicContact CE2-CB 3.5Å; Y735-M1157 HydrophobicContact CE2-CE 4.33Å; Y735-M1157 HydrophobicContact CE2-CG 4.01Å; Y735-M1157 HydrophobicContact CG-CE 4.15Å; L739-M1157 HydrophobicContact CD1-CG 3.95Å; F1030-M1157 HydrophobicContact CB-SD 4.14Å; F1030-M1157 HydrophobicContact CD2-CE 3.81Å; F1030-M1157 HydrophobicContact CD2-SD 3.54Å; F1030-M1157 VanDerWaalsContact CD2-SD 3.54Å; F1030-M1157 HydrophobicContact CE2-CE 4.41Å; F1030-M1157 HydrophobicContact CE2-SD 4.43Å; F1030-M1157 HydrophobicContact CG-SD 4.29Å; L1033-M1157 HydrophobicContact CB-CE 4.42Å; L1033-M1157 HydrophobicContact CD1-CE 4.28Å; L1118-M1157 HydrophobicContact CD2-CB 4.23Å; L1118-M1157 HydrophobicContact CD2-CE 4.24Å; L1118-M1157 WeakPolarHBondContact CD2-O 3.42Å; D1153-M1157 WeakPolarHBondContact O-CA 3.5Å; D1153-M1157 PolarHBondContact O-N 3.3Å
1158	S	84.6	Confident	87.9	Confident	23 Å²	23	45.2 Å²	45.2	16%	0.161	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	156.4	-177.8	61.7	0	0	0	0	111.3	T1119 D1153 R1156	T1119-S1158 WeakPolarHBondContact O-CA 3.45Å; T1119-S1158 WeakPolarHBondContact O-CB 3.21Å; D1153-S1158 PolarHBondContact N-O 2.78Å; D1153-S1158 PolarHBondContact O-N 2.9Å; R1156-S1158 VanDerWaalsContact C-N 3.28Å; R1156-S1158 WeakPolarHBondContact CB-OG 3.5Å; R1156-S1158 PolarHBondContact O-N 2.92Å
1159	V	90.5	Very high	87.3	Confident	0 Å²	0	50 Å²	50	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	140.4	179.3	-59.9	0	0	0	0	111.5	F1041 L1114 T1119 G1120 F1121 I1149 K1151 I1152 L1161	F1041-V1159 HydrophobicContact CE1-CG1 3.87Å; F1041-V1159 HydrophobicContact CZ-CG1 4.07Å; L1114-V1159 HydrophobicContact CD1-CG2 3.39Å; T1119-V1159 PolarHBondContact O-N 2.95Å; T1119-V1159 VanDerWaalsContact O-N 3.12Å; G1120-V1159 CarbonylContact C-O 3.59Å; G1120-V1159 VanDerWaalsContact CA-O 3.28Å; G1120-V1159 WeakPolarHBondContact CA-O 3.17Å; F1121-V1159 PolarHBondContact N-O 2.72Å; I1149-V1159 HydrophobicContact CG2-CB 4.41Å; K1151-V1159 CarbonylContact O-C 3.56Å; K1151-V1159 WeakPolarHBondContact O-CA 3.31Å; I1152-V1159 HydrophobicContact CB-CG1 4.41Å; I1152-V1159 HydrophobicContact CG1-CG1 4.03Å; I1152-V1159 HydrophobicContact CG2-CG1 4.24Å; V1159-L1161 HydrophobicContact CB-CD2 4.34Å; V1159-L1161 HydrophobicContact CG2-CD1 4.35Å; V1159-L1161 HydrophobicContact CG2-CD2 3.67Å; V1159-L1161 HydrophobicContact CG2-CG 3.99Å
1160	D	93.6	Very high	86.7	Confident	55 Å²	55	50.1 Å²	50.1	29%	0.294	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	133.5	168.5	-66.2	-35.4	0	0	0	109	F1121 I1150 K1151	F1121-D1160 CarbonylContact O-C 3.54Å; F1121-D1160 WeakPolarHBondContact O-CA 3.49Å; I1150-D1160 PolarHBondContact N-O 3.05Å; K1151-D1160 HydrophobicContact CB-CB 4.18Å; K1151-D1160 PolarHBondContact N-O 3.32Å; K1151-D1160 PolarHBondContact O-N 2.7Å
1161	L	94.4	Very high	85.7	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	162	-170	-57.4	173.7	0	0	0	111.1	V1047 L1112 L1114 F1121 I1122 A1147 R1148 I1149 V1159	V1047-L1161 HydrophobicContact CG2-CD2 3.86Å; L1112-L1161 HydrophobicContact CD1-CD1 4.27Å; L1114-L1161 HydrophobicContact CD2-CD1 3.92Å; F1121-L1161 PolarHBondContact O-N 3.19Å; I1122-L1161 HydrophobicContact CD1-CB 4.29Å; I1122-L1161 HydrophobicContact CG1-CB 3.56Å; A1147-L1161 HydrophobicContact CB-CB 3.94Å; A1147-L1161 HydrophobicContact CB-CD1 4.24Å; R1148-L1161 CarbonylContact O-C 3.46Å; R1148-L1161 WeakPolarHBondContact O-CA 3.41Å; I1149-L1161 HydrophobicContact CB-CD2 4.19Å; I1149-L1161 HydrophobicContact CG1-CD2 3.59Å; V1159-L1161 HydrophobicContact CB-CD2 4.34Å; V1159-L1161 HydrophobicContact CG2-CD1 4.35Å; V1159-L1161 HydrophobicContact CG2-CD2 3.67Å; V1159-L1161 HydrophobicContact CG2-CG 3.99Å
1162	S	91.8	Very high	84.8	Confident	0 Å²	0	54 Å²	54	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	142.8	168.4	177	0	0	0	0	111.8	F1126 A1147 R1148 R1164 D1167	F1126-S1162 PolarHBondContact O-OG 2.86Å; A1147-S1162 CarbonylContact C-O 3.58Å; A1147-S1162 VanDerWaalsContact CA-O 3.3Å; A1147-S1162 WeakPolarHBondContact CA-O 3.48Å; A1147-S1162 WeakPolarHBondContact CB-O 3.37Å; R1148-S1162 PolarHBondContact N-O 2.89Å; R1148-S1162 PolarHBondContact O-N 2.86Å; S1162-R1164 PolarHBondContact OG-N 2.96Å; S1162-D1167 VanDerWaalsContact CB-OD2 3.29Å; S1162-D1167 WeakPolarHBondContact CB-OD2 3.33Å; S1162-D1167 PolarHBondContact OG-OD2 2.88Å
1163	C	90	Very high	83.8	Confident	21 Å²	21	60 Å²	60	14%	0.142	29%	0.287	C	S	.	.			trans	-119.9	17	171.2	64.8	0	0	0	0	112.3	I1122 F1126 L1127 L1145 A1147 T1165	I1122-C1163 HydrophobicContact CD1-CB 4.28Å; F1126-C1163 PolarHBondContact O-N 2.81Å; L1127-C1163 VanDerWaalsContact CA-SG 3.53Å; L1127-C1163 PolarHBondContact O-SG 3.24Å; L1145-C1163 HydrophobicContact CD1-CB 4.45Å; L1145-C1163 HydrophobicContact CD2-CB 3.84Å; L1145-C1163 HydrophobicContact CG-CB 4.27Å; A1147-C1163 HydrophobicContact CB-CB 4.45Å; C1163-T1165 PolarHBondContact O-N 3.32Å
1164	R	88.6	Confident	83.1	Confident	67 Å²	67	64.6 Å²	64.6	25%	0.253	31%	0.305	S	S	.	.			trans	-60.2	137.2	171.7	-67.5	178.1	61.3	-164.4	0.5	109.7	F1126 D1129 S1162 S1166 D1167 M1168	F1126-R1164 PolarHBondContact O-N 3.42Å; D1129-R1164 IonicContact OD1-CZ 2.76Å; D1129-R1164 IonicContact OD1-NE 3.28Å; D1129-R1164 PolarHBondContact OD1-NE 2.62Å; D1129-R1164 IonicContact OD1-NH2 3.93Å; D1129-R1164 PolarHBondContact OD1-NH2 3.37Å; S1162-R1164 PolarHBondContact OG-N 2.96Å; R1164-S1166 PolarHBondContact NE-OG 3.42Å; R1164-S1166 PolarHBondContact NH2-OG 2.96Å; R1164-S1166 PolarHBondContact O-N 3.33Å; R1164-D1167 HydrophobicContact CB-CB 4.23Å; R1164-D1167 PolarHBondContact O-N 2.89Å; R1164-M1168 WeakPolarHBondContact O-CB 3.4Å; R1164-M1168 VanDerWaalsContact O-CG 3.24Å; R1164-M1168 WeakPolarHBondContact O-CG 3.17Å; R1164-M1168 PolarHBondContact O-N 3.42Å
1165	T	85.2	Confident	82.4	Confident	77 Å²	77	64.3 Å²	64.3	47%	0.472	31%	0.305	S	S	.	.	H	α-helix	trans	-53.5	-41.1	173.4	29	0	0	0	0	111.3	D1129 C1163 D1167 M1168 E1169	D1129-T1165 PolarHBondContact OD2-OG1 3.45Å; C1163-T1165 PolarHBondContact O-N 3.32Å; T1165-D1167 VanDerWaalsContact C-N 3.34Å; T1165-D1167 PolarHBondContact O-N 2.95Å; T1165-M1168 PolarHBondContact O-N 3.22Å; T1165-E1169 WeakPolarHBondContact O-CB 3.48Å; T1165-E1169 WeakPolarHBondContact O-CG 3.47Å; T1165-E1169 PolarHBondContact O-N 3.22Å
1166	S	85.1	Confident	82	Confident	21 Å²	21	61.9 Å²	61.9	15%	0.147	29%	0.287	C	S	.	.	H	α-helix	trans	-57.9	-40.1	175.2	70.6	0	0	0	0	115.2	D1129 R1164 D1170 H1171	D1129-S1166 WeakPolarHBondContact OD1-CB 2.95Å; D1129-S1166 PolarHBondContact OD1-OG 2.84Å; D1129-S1166 PolarHBondContact OD2-N 2.88Å; R1164-S1166 PolarHBondContact NE-OG 3.42Å; R1164-S1166 PolarHBondContact NH2-OG 2.96Å; R1164-S1166 PolarHBondContact O-N 3.33Å; S1166-D1170 WeakPolarHBondContact O-CA 3.19Å; S1166-D1170 PolarHBondContact O-N 3.09Å; S1166-D1170 VanDerWaalsContact O-N 3.15Å; S1166-H1171 PolarHBondContact O-N 2.9Å; S1166-H1171 VanDerWaalsContact O-N 3.12Å
1167	D	84.7	Confident	81.6	Confident	21 Å²	21	54.9 Å²	54.9	11%	0.112	27%	0.266	C	S	.	.	H	α-helix	trans	-84.8	-32.6	-175.6	-59.7	-11	0	0	0	110.6	R1148 S1162 R1164 T1165 D1170	R1148-D1167 VanDerWaalsContact CD-O 3.32Å; R1148-D1167 WeakPolarHBondContact CD-O 3.35Å; R1148-D1167 PolarHBondContact NE-O 3.41Å; S1162-D1167 VanDerWaalsContact CB-OD2 3.29Å; S1162-D1167 WeakPolarHBondContact CB-OD2 3.33Å; S1162-D1167 PolarHBondContact OG-OD2 2.88Å; R1164-D1167 HydrophobicContact CB-CB 4.23Å; R1164-D1167 PolarHBondContact O-N 2.89Å; T1165-D1167 VanDerWaalsContact C-N 3.34Å; T1165-D1167 PolarHBondContact O-N 2.95Å; D1167-D1170 PolarHBondContact O-N 3.08Å
1168	M	84.8	Confident	81.8	Confident	48 Å²	48	63.3 Å²	63.3	24%	0.236	31%	0.306	C	S	.	.	H	α-helix	trans	-69.9	-45.2	176.2	-68.1	-64.6	-78.6	0	0	111.1	V1046 A1146 R1148 R1164 T1165 D1170	V1046-M1168 HydrophobicContact CG1-CE 3.99Å; A1146-M1168 HydrophobicContact CB-CE 3.72Å; A1146-M1168 VanDerWaalsContact O-CE 3.24Å; A1146-M1168 WeakPolarHBondContact O-CE 3.05Å; R1148-M1168 HydrophobicContact CB-SD 4.11Å; R1148-M1168 PolarHBondContact NH2-O 3.34Å; R1164-M1168 WeakPolarHBondContact O-CB 3.4Å; R1164-M1168 VanDerWaalsContact O-CG 3.24Å; R1164-M1168 WeakPolarHBondContact O-CG 3.17Å; R1164-M1168 PolarHBondContact O-N 3.42Å; T1165-M1168 PolarHBondContact O-N 3.22Å; M1168-D1170 PolarHBondContact O-N 3Å
1169	E	77.6	Confident	81.9	Confident	104 Å²	104	65.8 Å²	65.8	49%	0.486	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-8	176.1	-64.4	-172.8	-175.2	0	0	113.4	T1165 H1171 R1176	T1165-E1169 WeakPolarHBondContact O-CB 3.48Å; T1165-E1169 WeakPolarHBondContact O-CG 3.47Å; T1165-E1169 PolarHBondContact O-N 3.22Å; E1169-H1171 PolarHBondContact O-N 3.24Å; E1169-H1171 IonicContact OE2-CE1 3.94Å; E1169-H1171 PolarHBondContact OE2-CE1 3.09Å; E1169-H1171 IonicContact OE2-NE2 2.78Å; E1169-R1176 PolarHBondContact O-NH1 3.45Å; E1169-R1176 PolarHBondContact O-NH2 3.33Å
1170	D	78.6	Confident	81.9	Confident	2 Å²	2	66.5 Å²	66.5	1%	0.011	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	49.9	53.3	-179	-169.3	31	0	0	0	112.5	S1166 D1167 M1168 E1172 H1173 K1174 F1175 R1176	S1166-D1170 WeakPolarHBondContact O-CA 3.19Å; S1166-D1170 PolarHBondContact O-N 3.09Å; S1166-D1170 VanDerWaalsContact O-N 3.15Å; D1167-D1170 PolarHBondContact O-N 3.08Å; M1168-D1170 PolarHBondContact O-N 3Å; D1170-E1172 PolarHBondContact O-N 3.49Å; D1170-E1172 VanDerWaalsContact O-N 3.14Å; D1170-H1173 PolarHBondContact O-N 2.85Å; D1170-H1173 PolarHBondContact OD1-N 3.32Å; D1170-H1173 WeakPolarHBondContact OD2-CA 3.49Å; D1170-K1174 PolarHBondContact OD1-N 2.93Å; D1170-K1174 PolarHBondContact OD2-N 2.71Å; D1170-F1175 WeakPolarHBondContact OD1-CD2 3.43Å; D1170-F1175 PolarHBondContact OD1-N 2.86Å; D1170-F1175 PolarHBondContact OD2-N 3.49Å; D1170-R1176 HydrophobicContact CB-CG 4.24Å; D1170-R1176 WeakPolarHBondContact OD2-CB 3.36Å; D1170-R1176 WeakPolarHBondContact OD2-CG 3.31Å; D1170-R1176 PolarHBondContact OD2-N 2.89Å
1171	H	70.4	Confident	81.8	Confident	113 Å²	113	69.2 Å²	69.2	52%	0.523	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-27.1	-179.1	-72.3	-41.1	0	0	0	113.6	S1166 E1169 H1173	S1166-H1171 PolarHBondContact O-N 2.9Å; S1166-H1171 VanDerWaalsContact O-N 3.12Å; E1169-H1171 PolarHBondContact O-N 3.24Å; E1169-H1171 IonicContact OE2-CE1 3.94Å; E1169-H1171 PolarHBondContact OE2-CE1 3.09Å; E1169-H1171 IonicContact OE2-NE2 2.78Å; H1171-H1173 VanDerWaalsContact C-N 3.34Å
1172	E	71.6	Confident	81.7	Confident	132 Å²	132	72.5 Å²	72.5	62%	0.617	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	1.4	179.2	-62.1	-178.4	149.9	0	0	112.9	D1170 K1174	D1170-E1172 PolarHBondContact O-N 3.49Å; D1170-E1172 VanDerWaalsContact O-N 3.14Å; E1172-K1174 HydrophobicContact CB-CD 4.02Å; E1172-K1174 HydrophobicContact CB-CG 3.92Å; E1172-K1174 PolarHBondContact O-N 3.21Å; E1172-K1174 WeakPolarHBondContact OE2-CD 3.42Å; E1172-K1174 WeakPolarHBondContact OE2-CE 3.04Å; E1172-K1174 IonicContact OE2-NZ 3.45Å; E1172-K1174 PolarHBondContact OE2-NZ 2.92Å
1173	H	69.5	Low	81.8	Confident	140 Å²	140	73.2 Å²	73.2	65%	0.648	35%	0.351	S	S	*	.			trans	52.2	39.1	-179.7	-60.5	-59	0	0	0	113.7	D1170 H1171	D1170-H1173 PolarHBondContact O-N 2.85Å; D1170-H1173 PolarHBondContact OD1-N 3.32Å; D1170-H1173 WeakPolarHBondContact OD2-CA 3.49Å; H1171-H1173 VanDerWaalsContact C-N 3.34Å
1174	K	74.3	Confident	82	Confident	138 Å²	138	73.7 Å²	73.7	60%	0.6	35%	0.353	S	S	*	.	S	Bend	trans	-86.1	-27.7	-176.3	-74	178.7	172.4	172.5	0	112.8	D1170 E1172	D1170-K1174 PolarHBondContact OD1-N 2.93Å; D1170-K1174 PolarHBondContact OD2-N 2.71Å; E1172-K1174 HydrophobicContact CB-CD 4.02Å; E1172-K1174 HydrophobicContact CB-CG 3.92Å; E1172-K1174 PolarHBondContact O-N 3.21Å; E1172-K1174 WeakPolarHBondContact OE2-CD 3.42Å; E1172-K1174 WeakPolarHBondContact OE2-CE 3.04Å; E1172-K1174 IonicContact OE2-NZ 3.45Å; E1172-K1174 PolarHBondContact OE2-NZ 2.92Å
1175	F	72.8	Confident	82.1	Confident	57 Å²	57	75.8 Å²	75.8	25%	0.25	37%	0.365	C	S	.	.	S	Bend	trans	-115.6	-33.1	-166.5	-58	-63.1	0	0	0	113.3	I1043 D1170	I1043-F1175 HydrophobicContact CG2-CE1 4.26Å; D1170-F1175 WeakPolarHBondContact OD1-CD2 3.43Å; D1170-F1175 PolarHBondContact OD1-N 2.86Å; D1170-F1175 PolarHBondContact OD2-N 3.49Å
1176	R	73.7	Confident	82.5	Confident	78 Å²	78	79.7 Å²	79.7	29%	0.294	38%	0.376	S	S	.	.	S	Bend	trans	-59	136.9	-179.2	-80.3	173	176.5	170.6	12.3	110.6	E505 E1169 D1170 Q1178	E505-R1176 HydrophobicContact CG-CG 4Å; E505-R1176 VanDerWaalsContact OE1-CG 3.25Å; E505-R1176 WeakPolarHBondContact OE1-CG 3.48Å; E505-R1176 IonicContact OE2-NE 3.18Å; E505-R1176 PolarHBondContact OE2-NE 3.23Å; E1169-R1176 PolarHBondContact O-NH1 3.45Å; E1169-R1176 PolarHBondContact O-NH2 3.33Å; D1170-R1176 HydrophobicContact CB-CG 4.24Å; D1170-R1176 WeakPolarHBondContact OD2-CB 3.36Å; D1170-R1176 WeakPolarHBondContact OD2-CG 3.31Å; D1170-R1176 PolarHBondContact OD2-N 2.89Å; R1176-Q1178 PolarHBondContact O-N 3.36Å
1177	P	74.3	Confident	82.8	Confident	46 Å²	46	79.3 Å²	79.3	30%	0.299	37%	0.373	S	S	.	.	P	Polyproline II helix	trans	-52	139.8	168.7	-26	34.8	0	0	0	110.7	P511 R1179	P511-P1177 HydrophobicContact CG-CB 3.84Å; P1177-R1179 PolarHBondContact O-N 3.23Å
1178	Q	81.5	Confident	83.2	Confident	187 Å²	187	79.4 Å²	79.4	87%	0.874	37%	0.373	S	S	*	.	P	Polyproline II helix	trans	-61	128.1	173.6	-68.2	-174.1	1.5	0	0	109	R1176	R1176-Q1178 PolarHBondContact O-N 3.36Å
1179	R	86.4	Confident	83.5	Confident	75 Å²	75	80.9 Å²	80.9	28%	0.283	38%	0.38	S	S	.	.	P	Polyproline II helix	trans	-68.6	152.2	176.1	-66.9	179.5	176	-160.6	-6.4	109.8	P1177 Y1183 H1185 E1188	P1177-R1179 PolarHBondContact O-N 3.23Å; R1179-Y1183 HydrophobicContact CB-CD2 3.98Å; R1179-Y1183 HydrophobicContact CB-CG 4.15Å; R1179-Y1183 HydrophobicContact CG-CD2 4.2Å; R1179-Y1183 HydrophobicContact CG-CE2 4.25Å; R1179-Y1183 HydrophobicContact CG-CG 4.48Å; R1179-H1185 PolarHBondContact NH1-CE1 3.47Å; R1179-H1185 VanDerWaalsContact NH1-CE1 3.34Å; R1179-H1185 PolarHBondContact NH1-ND1 3.19Å; R1179-E1188 IonicContact CZ-OE2 3.85Å; R1179-E1188 IonicContact NH1-OE2 3.38Å; R1179-E1188 PolarHBondContact NH1-OE2 3.28Å; R1179-E1188 IonicContact NH2-OE1 2.67Å; R1179-E1188 PolarHBondContact NH2-OE1 3.45Å; R1179-E1188 IonicContact NH2-OE2 3.11Å; R1179-E1188 PolarHBondContact NH2-OE2 2.92Å
1180	D	91.2	Very high	84.2	Confident	15 Å²	15	81.1 Å²	81.1	8%	0.08	38%	0.381	C	S	.	.	P	Polyproline II helix	trans	-60.3	146.8	176.6	-170.7	-87.7	0	0	0	111.4	P511 Y512 I515 K518 Y1182 Y1183	P511-D1180 PolarHBondContact O-N 3.37Å; Y512-D1180 HydrophobicContact CD1-CB 3.92Å; Y512-D1180 HydrophobicContact CE1-CB 4.21Å; I515-D1180 HydrophobicContact CD1-CB 3.5Å; K518-D1180 IonicContact NZ-OD1 3.2Å; K518-D1180 IonicContact NZ-OD2 3.88Å; K518-D1180 PolarHBondContact NZ-OD2 3.27Å; D1180-Y1182 PolarHBondContact O-N 2.84Å; D1180-Y1182 VanDerWaalsContact O-N 3.1Å; D1180-Y1182 WeakPolarHBondContact OD1-CB 3.38Å; D1180-Y1182 WeakPolarHBondContact OD1-CD2 3.48Å; D1180-Y1182 PolarHBondContact OD1-N 2.79Å; D1180-Y1183 VanDerWaalsContact O-CB 3.28Å; D1180-Y1183 WeakPolarHBondContact O-CB 3.3Å; D1180-Y1183 PolarHBondContact O-N 3.43Å; D1180-Y1183 VanDerWaalsContact O-N 3.11Å
1181	P	90.7	Very high	84.8	Confident	111 Å²	111	82.3 Å²	82.3	72%	0.721	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-24.3	176.4	-27.7	36.3	0	0	0	115
1182	Y	92.6	Very high	85.7	Confident	69 Å²	69	81.3 Å²	81.3	27%	0.271	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.2	21.4	-179.6	-64.5	-91.2	0	0	0	113.2	K516 K518 P519 E522 D1180 D1184	K516-Y1182 PolarHBondContact N-O 3.02Å; K518-Y1182 HydrophobicContact CB-CD1 4.24Å; K518-Y1182 HydrophobicContact CB-CD2 4.1Å; K518-Y1182 HydrophobicContact CB-CG 3.8Å; K518-Y1182 HydrophobicContact CD-CD2 4.09Å; K518-Y1182 HydrophobicContact CG-CD2 3.77Å; K518-Y1182 HydrophobicContact CG-CE2 4.24Å; K518-Y1182 HydrophobicContact CG-CG 4.02Å; P519-Y1182 VanDerWaalsContact CD-CE1 3.47Å; P519-Y1182 VanDerWaalsContact CD-CZ 3.43Å; P519-Y1182 HydrophobicContact CG-CE1 4.39Å; E522-Y1182 HydrophobicContact CB-CE2 4.33Å; E522-Y1182 HydrophobicContact CG-CE2 4.28Å; D1180-Y1182 PolarHBondContact O-N 2.84Å; D1180-Y1182 VanDerWaalsContact O-N 3.1Å; D1180-Y1182 WeakPolarHBondContact OD1-CB 3.38Å; D1180-Y1182 WeakPolarHBondContact OD1-CD2 3.48Å; D1180-Y1182 PolarHBondContact OD1-N 2.79Å; Y1182-D1184 PolarHBondContact O-N 3.42Å
1183	Y	93.7	Very high	86.6	Confident	15 Å²	15	81.6 Å²	81.6	6%	0.059	37%	0.374	C	S	.	.	B	Isolated β-bridge	trans	-67.2	125.9	-177.1	-159.9	-86.2	0	0	0	112.9	P511 K513 Y514 R1179 D1180 H1185	P511-Y1183 VanDerWaalsContact O-CD2 3.22Å; P511-Y1183 WeakPolarHBondContact O-CD2 3.33Å; P511-Y1183 WeakPolarHBondContact O-CE2 3.43Å; K513-Y1183 HydrophobicContact CB-CE2 4.36Å; Y514-Y1183 HydrophobicContact CD2-CE1 4.12Å; Y514-Y1183 AromaticContact CD2-CZ 3.85Å; Y514-Y1183 WeakPolarHBondContact CD2-OH 3.5Å; Y514-Y1183 VanDerWaalsContact O-CA 3.24Å; Y514-Y1183 WeakPolarHBondContact O-CA 2.81Å; Y514-Y1183 VanDerWaalsContact O-CD2 3.29Å; Y514-Y1183 WeakPolarHBondContact O-CD2 3.41Å; R1179-Y1183 HydrophobicContact CB-CD2 3.98Å; R1179-Y1183 HydrophobicContact CB-CG 4.15Å; R1179-Y1183 HydrophobicContact CG-CD2 4.2Å; R1179-Y1183 HydrophobicContact CG-CE2 4.25Å; R1179-Y1183 HydrophobicContact CG-CG 4.48Å; D1180-Y1183 VanDerWaalsContact O-CB 3.28Å; D1180-Y1183 WeakPolarHBondContact O-CB 3.3Å; D1180-Y1183 PolarHBondContact O-N 3.43Å; D1180-Y1183 VanDerWaalsContact O-N 3.11Å; Y1183-H1185 AromaticContact CD1-CE1 3.89Å; Y1183-H1185 AromaticContact CD1-ND1 3.9Å; Y1183-H1185 PolarHBondContact O-N 3.44Å; Y1183-H1185 VanDerWaalsContact O-N 3.15Å
1184	D	94.2	Very high	87.5	Confident	32 Å²	32	78.4 Å²	78.4	17%	0.171	36%	0.364	C	S	.	.			trans	-86.9	87.2	-179.9	-165.9	-13.3	0	0	0	112.3	Y514 K516 Y1182 K1186 A1187 E1188	Y514-D1184 PolarHBondContact O-N 3.39Å; K516-D1184 HydrophobicContact CB-CB 3.85Å; K516-D1184 VanDerWaalsContact CD-OD2 3.29Å; K516-D1184 WeakPolarHBondContact CD-OD2 3.49Å; Y1182-D1184 PolarHBondContact O-N 3.42Å; D1184-K1186 PolarHBondContact O-N 3.11Å; D1184-K1186 WeakPolarHBondContact OD1-CA 3.27Å; D1184-K1186 WeakPolarHBondContact OD1-CB 3.34Å; D1184-K1186 PolarHBondContact OD1-N 3.35Å; D1184-A1187 HydrophobicContact CB-CB 4.05Å; D1184-A1187 PolarHBondContact O-N 3.49Å; D1184-A1187 PolarHBondContact OD1-N 2.92Å; D1184-E1188 PolarHBondContact O-N 2.99Å
1185	H	92.1	Very high	88	Confident	110 Å²	110	76.7 Å²	76.7	51%	0.509	36%	0.359	S	S	.	.	H	α-helix	trans	-63.3	-25.6	174.8	-66.1	-75	0	0	0	113.9	R1179 Y1183 E1189	R1179-H1185 PolarHBondContact NH1-CE1 3.47Å; R1179-H1185 VanDerWaalsContact NH1-CE1 3.34Å; R1179-H1185 PolarHBondContact NH1-ND1 3.19Å; Y1183-H1185 AromaticContact CD1-CE1 3.89Å; Y1183-H1185 AromaticContact CD1-ND1 3.9Å; Y1183-H1185 PolarHBondContact O-N 3.44Å; Y1183-H1185 VanDerWaalsContact O-N 3.15Å; H1185-E1189 PolarHBondContact O-N 3.4Å
1186	K	92.5	Very high	88.7	Confident	160 Å²	160	80.2 Å²	80.2	70%	0.696	37%	0.37	S	S	*	.	H	α-helix	trans	-73.9	-46.4	-179.3	-65.8	-178.4	179.5	177.8	0	109.9	D1184 E1188 E1189 E1190	D1184-K1186 PolarHBondContact O-N 3.11Å; D1184-K1186 WeakPolarHBondContact OD1-CA 3.27Å; D1184-K1186 WeakPolarHBondContact OD1-CB 3.34Å; D1184-K1186 PolarHBondContact OD1-N 3.35Å; K1186-E1188 VanDerWaalsContact C-N 3.33Å; K1186-E1188 PolarHBondContact O-N 2.87Å; K1186-E1189 PolarHBondContact O-N 3.04Å; K1186-E1190 WeakPolarHBondContact O-CG 3.33Å; K1186-E1190 PolarHBondContact O-N 2.89Å
1187	A	92.1	Very high	89.3	Confident	12 Å²	12	81.4 Å²	81.4	10%	0.099	38%	0.382	C	S	.	.	H	α-helix	trans	-59.3	-43.7	175.4	0	0	0	0	0	111.8	Y514 D1184 E1189 E1190 D1191	Y514-A1187 HydrophobicContact CD1-CB 3.92Å; Y514-A1187 HydrophobicContact CE1-CB 4.48Å; D1184-A1187 HydrophobicContact CB-CB 4.05Å; D1184-A1187 PolarHBondContact O-N 3.49Å; D1184-A1187 PolarHBondContact OD1-N 2.92Å; A1187-E1189 PolarHBondContact O-N 2.84Å; A1187-E1190 PolarHBondContact O-N 3.33Å; A1187-D1191 PolarHBondContact O-N 3.41Å
1188	E	92.5	Very high	89.6	Confident	24 Å²	24	84.1 Å²	84.1	11%	0.112	39%	0.394	C	S	.	.	H	α-helix	trans	-58.3	-46.1	176.3	-176	-174.8	-168.6	0	0	112.2	Y514 R1179 D1184 K1186 D1191 R1192	Y514-E1188 HydrophobicContact CD1-CB 4.41Å; Y514-E1188 HydrophobicContact CD2-CB 3.8Å; Y514-E1188 HydrophobicContact CD2-CG 4.09Å; Y514-E1188 HydrophobicContact CE1-CB 4.35Å; Y514-E1188 HydrophobicContact CE2-CB 3.72Å; Y514-E1188 HydrophobicContact CE2-CG 3.65Å; Y514-E1188 HydrophobicContact CG-CB 4.16Å; R1179-E1188 IonicContact CZ-OE2 3.85Å; R1179-E1188 IonicContact NH1-OE2 3.38Å; R1179-E1188 PolarHBondContact NH1-OE2 3.28Å; R1179-E1188 IonicContact NH2-OE1 2.67Å; R1179-E1188 PolarHBondContact NH2-OE1 3.45Å; R1179-E1188 IonicContact NH2-OE2 3.11Å; R1179-E1188 PolarHBondContact NH2-OE2 2.92Å; D1184-E1188 PolarHBondContact O-N 2.99Å; K1186-E1188 VanDerWaalsContact C-N 3.33Å; K1186-E1188 PolarHBondContact O-N 2.87Å; E1188-D1191 PolarHBondContact O-N 2.84Å; E1188-R1192 VanDerWaalsContact CD-NH2 3.28Å; E1188-R1192 VanDerWaalsContact O-CB 3.31Å; E1188-R1192 WeakPolarHBondContact O-CB 3.37Å; E1188-R1192 PolarHBondContact O-N 2.86Å; E1188-R1192 IonicContact OE1-NH2 3.84Å; E1188-R1192 PolarHBondContact OE1-NH2 3.13Å; E1188-R1192 IonicContact OE2-NH2 2.76Å
1189	E	91.7	Very high	89.5	Confident	79 Å²	79	80.8 Å²	80.8	37%	0.369	38%	0.378	S	S	.	.	H	α-helix	trans	-71.1	-32.5	-179.6	-173.3	57.6	-153.3	0	0	112.3	H1185 K1186 A1187 R1192 R1193 R1196	H1185-E1189 PolarHBondContact O-N 3.4Å; K1186-E1189 PolarHBondContact O-N 3.04Å; A1187-E1189 PolarHBondContact O-N 2.84Å; E1189-R1192 PolarHBondContact O-N 2.62Å; E1189-R1192 IonicContact OE2-CZ 2.86Å; E1189-R1192 IonicContact OE2-NE 3.54Å; E1189-R1192 IonicContact OE2-NH1 3.17Å; E1189-R1192 PolarHBondContact OE2-NH1 3.4Å; E1189-R1193 WeakPolarHBondContact O-CB 3.44Å; E1189-R1193 PolarHBondContact O-N 3.04Å; E1189-R1196 IonicContact OE1-NH1 3.21Å; E1189-R1196 PolarHBondContact OE1-NH1 2.64Å
1190	E	92.2	Very high	89.1	Confident	109 Å²	109	79.1 Å²	79.1	51%	0.509	38%	0.381	S	S	.	.	H	α-helix	trans	-64.5	-44.9	173.5	-75.5	179.6	178.9	0	0	112.1	K1186 A1187 R1193 T1194	K1186-E1190 WeakPolarHBondContact O-CG 3.33Å; K1186-E1190 PolarHBondContact O-N 2.89Å; A1187-E1190 PolarHBondContact O-N 3.33Å; E1190-R1193 PolarHBondContact O-N 3.45Å; E1190-T1194 WeakPolarHBondContact O-CB 3.4Å; E1190-T1194 PolarHBondContact O-N 3.11Å; E1190-T1194 PolarHBondContact O-OG1 2.89Å
1191	D	91.5	Very high	88.1	Confident	27 Å²	27	82.2 Å²	82.2	14%	0.144	40%	0.404	C	S	.	.	H	α-helix	trans	-62.5	-46	174.6	-93.8	-1.9	0	0	0	110.9	H494 R500 Y514 A1187 E1188 R1193 T1194 E1195	H494-D1191 IonicContact CE1-OD1 2.72Å; H494-D1191 IonicContact CE1-OD2 2.74Å; H494-D1191 PolarHBondContact CE1-OD2 3.29Å; H494-D1191 IonicContact NE2-OD2 3.19Å; R500-D1191 WeakPolarHBondContact CD-OD2 3.3Å; R500-D1191 IonicContact CZ-OD2 3.14Å; R500-D1191 IonicContact NE-OD2 3.46Å; R500-D1191 IonicContact NH1-OD1 3.73Å; R500-D1191 IonicContact NH1-OD2 3.19Å; R500-D1191 PolarHBondContact NH1-OD2 2.83Å; Y514-D1191 HydrophobicContact CE1-CB 4.5Å; Y514-D1191 PolarHBondContact OH-OD2 3Å; A1187-D1191 PolarHBondContact O-N 3.41Å; E1188-D1191 PolarHBondContact O-N 2.84Å; D1191-R1193 VanDerWaalsContact C-N 3.34Å; D1191-R1193 PolarHBondContact O-N 3.43Å; D1191-T1194 WeakPolarHBondContact O-CB 3.49Å; D1191-T1194 PolarHBondContact O-N 2.8Å; D1191-T1194 VanDerWaalsContact O-N 3.17Å; D1191-E1195 PolarHBondContact O-N 3.41Å
1192	R	88.3	Confident	87	Confident	92 Å²	92	86.2 Å²	86.2	35%	0.347	40%	0.404	S	S	.	.	H	α-helix	trans	-62.7	-40.4	177.8	-167.5	-175.9	-61.4	153.3	-7.5	112.2	E1188 E1189 T1194 E1195 R1196	E1188-R1192 VanDerWaalsContact CD-NH2 3.28Å; E1188-R1192 VanDerWaalsContact O-CB 3.31Å; E1188-R1192 WeakPolarHBondContact O-CB 3.37Å; E1188-R1192 PolarHBondContact O-N 2.86Å; E1188-R1192 IonicContact OE1-NH2 3.84Å; E1188-R1192 PolarHBondContact OE1-NH2 3.13Å; E1188-R1192 IonicContact OE2-NH2 2.76Å; E1189-R1192 PolarHBondContact O-N 2.62Å; E1189-R1192 IonicContact OE2-CZ 2.86Å; E1189-R1192 IonicContact OE2-NE 3.54Å; E1189-R1192 IonicContact OE2-NH1 3.17Å; E1189-R1192 PolarHBondContact OE2-NH1 3.4Å; R1192-T1194 VanDerWaalsContact C-N 3.35Å; R1192-E1195 PolarHBondContact O-N 2.94Å; R1192-R1196 WeakPolarHBondContact O-CB 3.43Å; R1192-R1196 WeakPolarHBondContact O-CG 3.44Å; R1192-R1196 PolarHBondContact O-N 2.93Å
1193	R	91.3	Very high	85.6	Confident	138 Å²	138	90 Å²	90	52%	0.521	43%	0.425	S	S	.	.	H	α-helix	trans	-63.9	-42.2	174.8	-176.3	-179.6	66.6	-176.6	-3.5	110.8	E1189 E1190 D1191 R1196 N1197	E1189-R1193 WeakPolarHBondContact O-CB 3.44Å; E1189-R1193 PolarHBondContact O-N 3.04Å; E1190-R1193 PolarHBondContact O-N 3.45Å; D1191-R1193 VanDerWaalsContact C-N 3.34Å; D1191-R1193 PolarHBondContact O-N 3.43Å; R1193-R1196 PolarHBondContact O-N 2.76Å; R1193-N1197 VanDerWaalsContact O-CB 3.3Å; R1193-N1197 WeakPolarHBondContact O-CB 2.9Å; R1193-N1197 PolarHBondContact O-N 3.11Å; R1193-N1197 PolarHBondContact O-ND2 2.75Å
1194	T	88.7	Confident	84	Confident	72 Å²	72	97.3 Å²	97.3	44%	0.442	46%	0.456	S	S	.	.	H	α-helix	trans	-62.4	-43.7	177.2	-57.2	0	0	0	0	111	E1190 D1191 R1192 N1197 L1198	E1190-T1194 WeakPolarHBondContact O-CB 3.4Å; E1190-T1194 PolarHBondContact O-N 3.11Å; E1190-T1194 PolarHBondContact O-OG1 2.89Å; D1191-T1194 WeakPolarHBondContact O-CB 3.49Å; D1191-T1194 PolarHBondContact O-N 2.8Å; D1191-T1194 VanDerWaalsContact O-N 3.17Å; R1192-T1194 VanDerWaalsContact C-N 3.35Å; T1194-N1197 PolarHBondContact O-N 3.36Å; T1194-L1198 HydrophobicContact CG2-CD1 4.27Å; T1194-L1198 VanDerWaalsContact O-CG 3.3Å; T1194-L1198 WeakPolarHBondContact O-CG 3.49Å; T1194-L1198 PolarHBondContact O-N 2.99Å
1195	E	85.1	Confident	82.2	Confident	103 Å²	103	100.9 Å²	100.9	48%	0.481	47%	0.472	S	S	.	.	H	α-helix	trans	-66.3	-44.8	177.3	-171.2	163.8	-149.6	0	0	112.5	D1191 R1192 N1197 L1198 Q1199	D1191-E1195 PolarHBondContact O-N 3.41Å; R1192-E1195 PolarHBondContact O-N 2.94Å; E1195-N1197 VanDerWaalsContact C-N 3.31Å; E1195-N1197 PolarHBondContact O-N 3.31Å; E1195-L1198 PolarHBondContact O-N 2.99Å; E1195-Q1199 WeakPolarHBondContact O-CB 3.35Å; E1195-Q1199 PolarHBondContact O-N 3Å
1196	R	86.6	Confident	80.7	Confident	131 Å²	131	103.3 Å²	103.3	49%	0.494	48%	0.484	S	S	.	.	H	α-helix	trans	-58.6	-42.6	172.6	-74.9	178.3	-171.4	143.9	-3.3	111.7	E1189 R1192 R1193 Q1199 A1200	E1189-R1196 IonicContact OE1-NH1 3.21Å; E1189-R1196 PolarHBondContact OE1-NH1 2.64Å; R1192-R1196 WeakPolarHBondContact O-CB 3.43Å; R1192-R1196 WeakPolarHBondContact O-CG 3.44Å; R1192-R1196 PolarHBondContact O-N 2.93Å; R1193-R1196 PolarHBondContact O-N 2.76Å; R1196-Q1199 PolarHBondContact O-N 3.35Å; R1196-A1200 VanDerWaalsContact O-CB 3.27Å; R1196-A1200 WeakPolarHBondContact O-CB 3.39Å; R1196-A1200 PolarHBondContact O-N 2.6Å
1197	N	86.1	Confident	79.5	Confident	102 Å²	102	96.9 Å²	96.9	55%	0.545	46%	0.455	S	S	.	.	H	α-helix	trans	-64.5	-41.4	177.8	-73.6	-15.2	0	0	0	111.7	R1193 T1194 E1195 S1201	R1193-N1197 VanDerWaalsContact O-CB 3.3Å; R1193-N1197 WeakPolarHBondContact O-CB 2.9Å; R1193-N1197 PolarHBondContact O-N 3.11Å; R1193-N1197 PolarHBondContact O-ND2 2.75Å; T1194-N1197 PolarHBondContact O-N 3.36Å; E1195-N1197 VanDerWaalsContact C-N 3.31Å; E1195-N1197 PolarHBondContact O-N 3.31Å; N1197-S1201 VanDerWaalsContact O-CB 3.3Å; N1197-S1201 WeakPolarHBondContact O-CB 3.36Å; N1197-S1201 PolarHBondContact O-N 3.31Å
1198	L	81.3	Confident	78.5	Confident	104 Å²	104	99.9 Å²	99.9	55%	0.545	47%	0.472	S	S	.	.	H	α-helix	trans	-64.3	-42.3	174.8	-72.8	169.1	0	0	0	111.5	T1194 E1195 S1201 R1202	T1194-L1198 HydrophobicContact CG2-CD1 4.27Å; T1194-L1198 VanDerWaalsContact O-CG 3.3Å; T1194-L1198 WeakPolarHBondContact O-CG 3.49Å; T1194-L1198 PolarHBondContact O-N 2.99Å; E1195-L1198 PolarHBondContact O-N 2.99Å; L1198-S1201 PolarHBondContact O-N 3.22Å; L1198-R1202 WeakPolarHBondContact O-CG 3.4Å; L1198-R1202 PolarHBondContact O-N 3.1Å
1199	Q	78.2	Confident	77.6	Confident	116 Å²	116	105.1 Å²	105.1	54%	0.542	50%	0.495	S	S	.	.	H	α-helix	trans	-66.7	-43.6	177.7	-166.9	174.7	16.8	0	0	111.8	E1195 R1196 S1201 R1202 Q1203	E1195-Q1199 WeakPolarHBondContact O-CB 3.35Å; E1195-Q1199 PolarHBondContact O-N 3Å; R1196-Q1199 PolarHBondContact O-N 3.35Å; Q1199-S1201 VanDerWaalsContact C-N 3.32Å; Q1199-S1201 PolarHBondContact O-N 3.25Å; Q1199-R1202 PolarHBondContact O-N 3.02Å; Q1199-Q1203 PolarHBondContact O-N 3.47Å; Q1199-Q1203 VanDerWaalsContact O-N 3.1Å
1200	A	78.2	Confident	77	Confident	41 Å²	41	101.6 Å²	101.6	34%	0.339	48%	0.478	S	S	.	.	H	α-helix	trans	-64.2	-36.3	174.9	0	0	0	0	0	112.1	R1196 Q1203 K1204	R1196-A1200 VanDerWaalsContact O-CB 3.27Å; R1196-A1200 WeakPolarHBondContact O-CB 3.39Å; R1196-A1200 PolarHBondContact O-N 2.6Å; A1200-Q1203 PolarHBondContact O-N 3.15Å; A1200-K1204 WeakPolarHBondContact O-CG 3.47Å; A1200-K1204 PolarHBondContact O-N 3.19Å
1201	S	70.4	Confident	76.3	Confident	80 Å²	80	103.1 Å²	103.1	56%	0.559	49%	0.494	S	S	*	.	H	α-helix	trans	-63.3	-43.4	174.1	-170.2	0	0	0	0	111.6	N1197 L1198 Q1199 Q1203 K1204	N1197-S1201 VanDerWaalsContact O-CB 3.3Å; N1197-S1201 WeakPolarHBondContact O-CB 3.36Å; N1197-S1201 PolarHBondContact O-N 3.31Å; L1198-S1201 PolarHBondContact O-N 3.22Å; Q1199-S1201 VanDerWaalsContact C-N 3.32Å; Q1199-S1201 PolarHBondContact O-N 3.25Å; S1201-Q1203 VanDerWaalsContact C-N 3.33Å; S1201-Q1203 PolarHBondContact O-N 3.34Å; S1201-K1204 PolarHBondContact O-N 3.18Å
1202	R	68.2	Low	75.8	Confident	195 Å²	195	102.7 Å²	102.7	74%	0.736	49%	0.492	S	S	*	.	H	α-helix	trans	-63.5	-34.7	176	-71.9	174.9	178.5	-177	-0.3	113.2	L1198 Q1199 K1204	L1198-R1202 WeakPolarHBondContact O-CG 3.4Å; L1198-R1202 PolarHBondContact O-N 3.1Å; Q1199-R1202 PolarHBondContact O-N 3.02Å; R1202-K1204 VanDerWaalsContact C-N 3.35Å
1203	Q	62.5	Low	75.4	Confident	149 Å²	149	103.7 Å²	103.7	70%	0.696	52%	0.52	S	S	*	.	H	α-helix	trans	-75.4	-21.3	177.7	-71.3	178.6	2.5	0	0	113.5	Q1199 A1200 S1201 E1205	Q1199-Q1203 PolarHBondContact O-N 3.47Å; Q1199-Q1203 VanDerWaalsContact O-N 3.1Å; A1200-Q1203 PolarHBondContact O-N 3.15Å; S1201-Q1203 VanDerWaalsContact C-N 3.33Å; S1201-Q1203 PolarHBondContact O-N 3.34Å; Q1203-E1205 VanDerWaalsContact C-N 3.28Å; Q1203-E1205 PolarHBondContact O-N 2.79Å
1204	K	60.3	Low	75.2	Confident	167 Å²	167	98.2 Å²	98.2	73%	0.726	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.2	3.3	-179.1	-80	179.8	-179.7	-178.8	0	114.7	A1200 S1201 R1202 Q1206	A1200-K1204 WeakPolarHBondContact O-CG 3.47Å; A1200-K1204 PolarHBondContact O-N 3.19Å; S1201-K1204 PolarHBondContact O-N 3.18Å; R1202-K1204 VanDerWaalsContact C-N 3.35Å; K1204-Q1206 VanDerWaalsContact C-N 3.29Å; K1204-Q1206 PolarHBondContact O-N 2.75Å
1205	E	56.3	Low	75	Confident	107 Å²	107	100.1 Å²	100.1	50%	0.5	51%	0.514	S	S	.	.			trans	-66.9	87.6	171.4	-65.7	-173.7	173.4	0	0	109.9	Q1203 Y1207	Q1203-E1205 VanDerWaalsContact C-N 3.28Å; Q1203-E1205 PolarHBondContact O-N 2.79Å; E1205-Y1207 VanDerWaalsContact C-N 3.31Å; E1205-Y1207 PolarHBondContact O-N 2.99Å; E1205-Y1207 VanDerWaalsContact O-N 3.15Å
1206	Q	60	Low	75.2	Confident	161 Å²	161	99.8 Å²	99.8	75%	0.752	51%	0.509	S	S	*	.			trans	-78.5	9.6	-159.2	-161	174.1	1.8	0	0	116.3	K1204	K1204-Q1206 VanDerWaalsContact C-N 3.29Å; K1204-Q1206 PolarHBondContact O-N 2.75Å
1207	Y	68.7	Low	75.4	Confident	25 Å²	25	94.5 Å²	94.5	10%	0.098	49%	0.489	C	S	.	.	S	Bend	trans	-106	139.5	177.3	71.4	-90	0	0	0	111.1	E1205 K1209 N1219 P1241	E1205-Y1207 VanDerWaalsContact C-N 3.31Å; E1205-Y1207 PolarHBondContact O-N 2.99Å; E1205-Y1207 VanDerWaalsContact O-N 3.15Å; Y1207-K1209 HydrophobicContact CD2-CG 4.42Å; Y1207-K1209 HydrophobicContact CE2-CG 3.74Å; Y1207-K1209 PolarHBondContact O-N 3.14Å; Y1207-N1219 HydrophobicContact CE2-CB 3.8Å; Y1207-N1219 PolarHBondContact OH-O 3.21Å; Y1207-P1241 HydrophobicContact CD2-CB 4.21Å; Y1207-P1241 HydrophobicContact CD2-CG 4.04Å
1208	V	70.4	Confident	75.4	Confident	76 Å²	76	93.5 Å²	93.5	46%	0.461	48%	0.481	S	S	.	.			trans	-73.2	117.7	173.2	-178.9	0	0	0	0	107.6	R1210 Y1275	V1208-R1210 PolarHBondContact O-N 3.11Å; V1208-Y1275 HydrophobicContact CG1-CE1 4.03Å
1209	K	73.9	Confident	75.5	Confident	133 Å²	133	91.4 Å²	91.4	58%	0.578	47%	0.47	S	S	*	.			trans	-63.4	132	173.9	-69.6	179.8	-179.8	178.8	0	109.3	Y1207 N1219	Y1207-K1209 HydrophobicContact CD2-CG 4.42Å; Y1207-K1209 HydrophobicContact CE2-CG 3.74Å; Y1207-K1209 PolarHBondContact O-N 3.14Å; K1209-N1219 WeakPolarHBondContact CA-OD1 3.45Å; K1209-N1219 HydrophobicContact CG-CB 4.45Å
1210	R	79.7	Confident	75.8	Confident	5 Å²	5	86.2 Å²	86.2	2%	0.019	45%	0.447	C	S	.	.			trans	-130.4	155.7	179.6	-61	-177.5	69.9	-167.9	-5.8	110.3	V1208 I1212 F1217 N1219 P1247 E1268 K1271 P1274 Y1275 S1276	V1208-R1210 PolarHBondContact O-N 3.11Å; R1210-I1212 HydrophobicContact CB-CG1 4.37Å; R1210-F1217 HydrophobicContact CB-CZ 4.05Å; R1210-F1217 WeakPolarHBondContact O-CE1 3.22Å; R1210-N1219 PolarHBondContact N-OD1 2.89Å; R1210-N1219 PolarHBondContact O-ND2 3.46Å; R1210-N1219 PolarHBondContact O-OD1 3.15Å; R1210-P1247 PolarHBondContact NH1-O 3.05Å; R1210-E1268 IonicContact CZ-OE2 2.66Å; R1210-E1268 IonicContact NH1-OE1 2.71Å; R1210-E1268 IonicContact NH1-OE2 3.41Å; R1210-E1268 PolarHBondContact NH1-OE2 2.94Å; R1210-E1268 IonicContact NH2-OE1 3.44Å; R1210-E1268 IonicContact NH2-OE2 2.96Å; R1210-K1271 VanDerWaalsContact NH1-NZ 3.14Å; R1210-K1271 VanDerWaalsContact NH2-NZ 3.11Å; R1210-P1274 PolarHBondContact NE-O 2.92Å; R1210-P1274 PolarHBondContact NH2-O 2.96Å; R1210-Y1275 PolarHBondContact NE-O 3.18Å; R1210-Y1275 VanDerWaalsContact NE-O 3.14Å; R1210-Y1275 VanDerWaalsContact NH2-C 3.32Å; R1210-Y1275 PolarHBondContact NH2-O 3.01Å; R1210-S1276 VanDerWaalsContact NH2-C 3.28Å; R1210-S1276 PolarHBondContact NH2-O 3.42Å
1211	V	77.4	Confident	76.1	Confident	141 Å²	141	85.8 Å²	85.8	86%	0.855	44%	0.442	S	S	*	.			trans	-113.7	91.8	177.5	-175	0	0	0	0	107
1212	I	80.2	Confident	76.7	Confident	19 Å²	19	83.7 Å²	83.7	10%	0.097	43%	0.427	C	S	.	.			trans	-109	119.4	175.5	-55.9	-178.2	0	0	0	106.5	R1210 H1214 F1217 L1250 L1277 L1291	R1210-I1212 HydrophobicContact CB-CG1 4.37Å; I1212-H1214 VanDerWaalsContact C-N 3.31Å; I1212-H1214 HydrophobicContact CG2-CB 4.3Å; I1212-H1214 PolarHBondContact O-N 3.37Å; I1212-F1217 HydrophobicContact CB-CB 4.44Å; I1212-F1217 HydrophobicContact CB-CD1 3.79Å; I1212-F1217 HydrophobicContact CB-CD2 4.04Å; I1212-F1217 HydrophobicContact CB-CE1 4.02Å; I1212-F1217 HydrophobicContact CB-CE2 4.25Å; I1212-F1217 HydrophobicContact CB-CG 3.8Å; I1212-F1217 HydrophobicContact CB-CZ 4.24Å; I1212-F1217 HydrophobicContact CD1-CD2 3.98Å; I1212-F1217 HydrophobicContact CD1-CE2 3.63Å; I1212-F1217 HydrophobicContact CD1-CZ 3.98Å; I1212-F1217 HydrophobicContact CG1-CD1 4.46Å; I1212-F1217 HydrophobicContact CG1-CD2 4.36Å; I1212-F1217 HydrophobicContact CG1-CE1 4.21Å; I1212-F1217 HydrophobicContact CG1-CE2 4.1Å; I1212-F1217 HydrophobicContact CG1-CZ 4.02Å; I1212-F1217 HydrophobicContact CG2-CG 4.42Å; I1212-F1217 WeakPolarHBondContact O-CD1 3.49Å; I1212-L1250 HydrophobicContact CD1-CD1 3.91Å; I1212-L1250 HydrophobicContact CD1-CD2 3.87Å; I1212-L1250 HydrophobicContact CD1-CG 4.48Å; I1212-L1277 HydrophobicContact CD1-CD1 4.12Å; I1212-L1277 HydrophobicContact CG2-CB 4.47Å; I1212-L1277 HydrophobicContact CG2-CD1 4.32Å; I1212-L1291 HydrophobicContact CG2-CD1 4.21Å
1213	A	80.8	Confident	77.5	Confident	112 Å²	112	82.7 Å²	82.7	93%	0.926	43%	0.428	S	S	*	.			trans	-77.7	80.4	-178.7	0	0	0	0	0	110.2
1214	H	86.1	Confident	78.6	Confident	23 Å²	23	79.9 Å²	79.9	11%	0.106	42%	0.415	C	S	.	.			trans	-145.5	135.4	178.7	-174.4	-87.2	0	0	0	110.2	I1212 Y1216 F1217 I1239 L1291 D1292	I1212-H1214 VanDerWaalsContact C-N 3.31Å; I1212-H1214 HydrophobicContact CG2-CB 4.3Å; I1212-H1214 PolarHBondContact O-N 3.37Å; H1214-Y1216 VanDerWaalsContact C-N 3.27Å; H1214-Y1216 AromaticContact CE1-CD2 3.65Å; H1214-Y1216 PolarHBondContact ND1-N 3.24Å; H1214-Y1216 PolarHBondContact O-N 3.28Å; H1214-F1217 HydrophobicContact CB-CB 3.97Å; H1214-F1217 WeakPolarHBondContact O-CB 3.47Å; H1214-F1217 PolarHBondContact O-N 3.49Å; H1214-I1239 VanDerWaalsContact CE1-CD1 3.42Å; H1214-I1239 WeakPolarHBondContact CE1-CD1 3.28Å; H1214-L1291 HydrophobicContact CB-CD1 4.24Å; H1214-L1291 WeakPolarHBondContact NE2-CB 3.26Å; H1214-D1292 IonicContact CD2-OD1 3.72Å; H1214-D1292 IonicContact NE2-OD1 2.74Å; H1214-D1292 PolarHBondContact NE2-OD1 2.99Å
1215	P	85.4	Confident	79.8	Confident	112 Å²	112	72 Å²	72	73%	0.727	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-38	-172.3	-25	33.4	0	0	0	114
1216	Y	89.2	Confident	81.4	Confident	97 Å²	97	69.9 Å²	69.9	38%	0.38	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-1.4	-180	-60.4	-73.6	0	0	0	113.7	H1214 T1237 I1239 L1295	H1214-Y1216 VanDerWaalsContact C-N 3.27Å; H1214-Y1216 AromaticContact CE1-CD2 3.65Å; H1214-Y1216 PolarHBondContact ND1-N 3.24Å; H1214-Y1216 PolarHBondContact O-N 3.28Å; Y1216-T1237 WeakPolarHBondContact CD1-O 3.41Å; Y1216-I1239 PolarHBondContact O-N 3.43Å; Y1216-L1295 HydrophobicContact CD2-CD1 3.38Å; Y1216-L1295 HydrophobicContact CE2-CD1 3.77Å; Y1216-L1295 HydrophobicContact CG-CD1 4.17Å
1217	F	90.5	Very high	82.7	Confident	19 Å²	19	64.2 Å²	64.2	8%	0.083	36%	0.356	C	S	.	.	B	Isolated β-bridge	trans	-85.6	125.2	-179.1	179.6	-92.1	0	0	0	112.1	R1210 I1212 H1214 I1239 P1241 L1250	R1210-F1217 HydrophobicContact CB-CZ 4.05Å; R1210-F1217 WeakPolarHBondContact O-CE1 3.22Å; I1212-F1217 HydrophobicContact CB-CB 4.44Å; I1212-F1217 HydrophobicContact CB-CD1 3.79Å; I1212-F1217 HydrophobicContact CB-CD2 4.04Å; I1212-F1217 HydrophobicContact CB-CE1 4.02Å; I1212-F1217 HydrophobicContact CB-CE2 4.25Å; I1212-F1217 HydrophobicContact CB-CG 3.8Å; I1212-F1217 HydrophobicContact CB-CZ 4.24Å; I1212-F1217 HydrophobicContact CD1-CD2 3.98Å; I1212-F1217 HydrophobicContact CD1-CE2 3.63Å; I1212-F1217 HydrophobicContact CD1-CZ 3.98Å; I1212-F1217 HydrophobicContact CG1-CD1 4.46Å; I1212-F1217 HydrophobicContact CG1-CD2 4.36Å; I1212-F1217 HydrophobicContact CG1-CE1 4.21Å; I1212-F1217 HydrophobicContact CG1-CE2 4.1Å; I1212-F1217 HydrophobicContact CG1-CZ 4.02Å; I1212-F1217 HydrophobicContact CG2-CG 4.42Å; I1212-F1217 WeakPolarHBondContact O-CD1 3.49Å; H1214-F1217 HydrophobicContact CB-CB 3.97Å; H1214-F1217 WeakPolarHBondContact O-CB 3.47Å; H1214-F1217 PolarHBondContact O-N 3.49Å; F1217-I1239 CarbonylContact C-O 3.59Å; F1217-I1239 VanDerWaalsContact CA-O 3.26Å; F1217-I1239 WeakPolarHBondContact CA-O 3.43Å; F1217-I1239 HydrophobicContact CB-CB 4.41Å; F1217-I1239 HydrophobicContact CD2-CB 4.29Å; F1217-I1239 HydrophobicContact CD2-CG2 3.97Å; F1217-P1241 HydrophobicContact CE2-CG 4.12Å; F1217-P1241 HydrophobicContact CZ-CG 3.81Å; F1217-L1250 HydrophobicContact CD2-CD2 4.45Å; F1217-L1250 HydrophobicContact CE2-CD2 3.82Å
1218	Q	85.5	Confident	83.6	Confident	82 Å²	82	67 Å²	67	38%	0.383	37%	0.372	S	S	.	.			trans	-134.6	137.8	175	-79.4	171.4	-8.5	0	0	112.1	C1220 I1238 I1239 R1240 P1241	Q1218-C1220 VanDerWaalsContact C-N 3.31Å; Q1218-C1220 PolarHBondContact O-N 3.18Å; Q1218-I1238 HydrophobicContact CB-CG2 4.19Å; Q1218-I1239 PolarHBondContact N-O 2.91Å; Q1218-R1240 WeakPolarHBondContact O-CA 3.32Å; Q1218-P1241 WeakPolarHBondContact O-CD 3.44Å
1219	N	84.3	Confident	84.5	Confident	59 Å²	59	63.4 Å²	63.4	32%	0.316	35%	0.35	S	S	.	.			trans	-75.4	84.5	169.1	-81.3	-46.1	0	0	0	109.6	Y1207 K1209 R1210	Y1207-N1219 HydrophobicContact CE2-CB 3.8Å; Y1207-N1219 PolarHBondContact OH-O 3.21Å; K1209-N1219 WeakPolarHBondContact CA-OD1 3.45Å; K1209-N1219 HydrophobicContact CG-CB 4.45Å; R1210-N1219 PolarHBondContact N-OD1 2.89Å; R1210-N1219 PolarHBondContact O-ND2 3.46Å; R1210-N1219 PolarHBondContact O-OD1 3.15Å
1220	C	85	Confident	85.1	Confident	7 Å²	7	61.6 Å²	61.6	5%	0.047	35%	0.346	C	S	.	.			trans	-144.9	155.6	179.5	63.4	0	0	0	0	111.6	Q1218 Q1224	Q1218-C1220 VanDerWaalsContact C-N 3.31Å; Q1218-C1220 PolarHBondContact O-N 3.18Å; C1220-Q1224 HydrophobicContact CB-CB 3.82Å
1221	S	82.6	Confident	85.5	Confident	33 Å²	33	69.5 Å²	69.5	23%	0.231	38%	0.383	C	S	.	.			trans	-75.2	167	172.9	66.7	0	0	0	0	111.8	K1223 Q1224 A1225	S1221-K1223 VanDerWaalsContact C-N 3.29Å; S1221-K1223 PolarHBondContact O-N 3.26Å; S1221-Q1224 PolarHBondContact O-N 3.32Å; S1221-Q1224 VanDerWaalsContact O-N 3.15Å; S1221-Q1224 WeakPolarHBondContact OG-CG 3.39Å; S1221-Q1224 PolarHBondContact OG-N 3.47Å; S1221-Q1224 PolarHBondContact OG-OE1 3.23Å; S1221-A1225 PolarHBondContact O-N 2.95Å
1222	C	84.7	Confident	86.1	Confident	36 Å²	36	65.9 Å²	65.9	24%	0.243	36%	0.357	C	S	.	.	H	α-helix	trans	-50.3	-47.2	175	-164.8	0	0	0	0	113	A1225 E1226 R1240 H1263	C1222-A1225 PolarHBondContact O-N 2.81Å; C1222-E1226 WeakPolarHBondContact O-CG 3.39Å; C1222-E1226 PolarHBondContact O-N 3.05Å; C1222-E1226 PolarHBondContact SG-OE1 2.96Å; C1222-R1240 PolarHBondContact SG-NH2 3.13Å; C1222-H1263 PolarHBondContact SG-CE1 2.9Å
1223	K	84	Confident	86.6	Confident	174 Å²	174	72.2 Å²	72.2	76%	0.757	39%	0.387	S	S	*	.	H	α-helix	trans	-67	-38.8	-179.8	-70.3	-172.9	175.3	-175.5	0	113	S1221 G1227	S1221-K1223 VanDerWaalsContact C-N 3.29Å; S1221-K1223 PolarHBondContact O-N 3.26Å; K1223-G1227 PolarHBondContact O-N 3.14Å
1224	Q	85.4	Confident	87	Confident	90 Å²	90	68.4 Å²	68.4	42%	0.421	35%	0.35	S	S	.	.	H	α-helix	trans	-66.9	-40.7	176.7	-75.6	167.2	-23.7	0	0	110.8	C1220 S1221 G1227 L1228	C1220-Q1224 HydrophobicContact CB-CB 3.82Å; S1221-Q1224 PolarHBondContact O-N 3.32Å; S1221-Q1224 VanDerWaalsContact O-N 3.15Å; S1221-Q1224 WeakPolarHBondContact OG-CG 3.39Å; S1221-Q1224 PolarHBondContact OG-N 3.47Å; S1221-Q1224 PolarHBondContact OG-OE1 3.23Å; Q1224-G1227 PolarHBondContact O-N 3.38Å; Q1224-L1228 WeakPolarHBondContact O-CG 3.31Å; Q1224-L1228 PolarHBondContact O-N 3.45Å
1225	A	86.6	Confident	87.1	Confident	0 Å²	0	67.9 Å²	67.9	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-63.7	-43.9	175.4	0	0	0	0	0	112.4	S1221 C1222 G1227 L1228 L1229 I1238	S1221-A1225 PolarHBondContact O-N 2.95Å; C1222-A1225 PolarHBondContact O-N 2.81Å; A1225-G1227 VanDerWaalsContact C-N 3.29Å; A1225-G1227 PolarHBondContact O-N 3.46Å; A1225-L1228 PolarHBondContact O-N 2.98Å; A1225-L1229 WeakPolarHBondContact O-CB 3.47Å; A1225-L1229 WeakPolarHBondContact O-CG 3.46Å; A1225-L1229 PolarHBondContact O-N 2.66Å; A1225-I1238 HydrophobicContact CB-CG2 4.28Å
1226	E	88.5	Confident	87.4	Confident	63 Å²	63	65 Å²	65	29%	0.294	33%	0.329	S	S	.	.	H	α-helix	trans	-61.1	-37.8	173.8	-72.5	168	-148.3	0	0	112.2	C1222 L1230 Y1261 H1263	C1222-E1226 WeakPolarHBondContact O-CG 3.39Å; C1222-E1226 PolarHBondContact O-N 3.05Å; C1222-E1226 PolarHBondContact SG-OE1 2.96Å; E1226-L1230 PolarHBondContact O-N 3.48Å; E1226-Y1261 HydrophobicContact CB-CD2 4.15Å; E1226-Y1261 HydrophobicContact CB-CE2 4.21Å; E1226-Y1261 HydrophobicContact CG-CD2 3.78Å; E1226-Y1261 HydrophobicContact CG-CE2 4.34Å; E1226-Y1261 HydrophobicContact CG-CG 4.2Å; E1226-H1263 IonicContact OE1-CE1 3.71Å; E1226-H1263 IonicContact OE1-NE2 3.76Å
1227	G	87.7	Confident	87.6	Confident	43 Å²	43	60.7 Å²	60.7	44%	0.443	31%	0.313	S	S	.	.	H	α-helix	trans	-66.3	-40.7	175.1	0	0	0	0	0	113	K1223 Q1224 A1225 L1230	K1223-G1227 PolarHBondContact O-N 3.14Å; Q1224-G1227 PolarHBondContact O-N 3.38Å; A1225-G1227 VanDerWaalsContact C-N 3.29Å; A1225-G1227 PolarHBondContact O-N 3.46Å; G1227-L1230 WeakPolarHBondContact O-CB 3.48Å; G1227-L1230 PolarHBondContact O-N 2.86Å
1228	L	87.8	Confident	87.7	Confident	83 Å²	83	60 Å²	60	44%	0.435	31%	0.31	S	S	.	.	H	α-helix	trans	-68.5	-41.6	176.1	-70.5	169.7	0	0	0	111.7	Q1224 A1225 L1230 M1232 I1238	Q1224-L1228 WeakPolarHBondContact O-CG 3.31Å; Q1224-L1228 PolarHBondContact O-N 3.45Å; A1225-L1228 PolarHBondContact O-N 2.98Å; L1228-L1230 PolarHBondContact O-N 3.41Å; L1228-M1232 WeakPolarHBondContact O-CG 3.5Å; L1228-I1238 HydrophobicContact CB-CD1 3.52Å; L1228-I1238 HydrophobicContact CD1-CD1 4.16Å; L1228-I1238 HydrophobicContact CG-CD1 4.5Å
1229	L	90.3	Very high	88	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-68.8	-19	176.9	-75	165.3	0	0	0	113.2	A1225 E1231 M1232 D1236 I1238 T1253 K1255 Y1261	A1225-L1229 WeakPolarHBondContact O-CB 3.47Å; A1225-L1229 WeakPolarHBondContact O-CG 3.46Å; A1225-L1229 PolarHBondContact O-N 2.66Å; L1229-E1231 VanDerWaalsContact C-N 3.28Å; L1229-E1231 PolarHBondContact O-N 2.88Å; L1229-M1232 HydrophobicContact CD2-CB 4.47Å; L1229-M1232 HydrophobicContact CD2-SD 3.92Å; L1229-M1232 PolarHBondContact O-N 3.24Å; L1229-D1236 HydrophobicContact CD2-CB 4.25Å; L1229-D1236 WeakPolarHBondContact CD2-O 3.5Å; L1229-I1238 HydrophobicContact CD1-CD1 4.42Å; L1229-I1238 HydrophobicContact CD1-CG1 4.41Å; L1229-I1238 HydrophobicContact CD2-CD1 4.2Å; L1229-I1238 HydrophobicContact CD2-CG1 3.97Å; L1229-I1238 HydrophobicContact CG-CD1 3.75Å; L1229-I1238 HydrophobicContact CG-CG1 3.96Å; L1229-T1253 HydrophobicContact CD1-CG2 3.56Å; L1229-T1253 WeakPolarHBondContact CD1-O 3.42Å; L1229-K1255 HydrophobicContact CD2-CB 4.5Å; L1229-K1255 WeakPolarHBondContact O-CD 3.32Å; L1229-Y1261 HydrophobicContact CB-CD1 3.92Å; L1229-Y1261 HydrophobicContact CB-CE1 3.57Å; L1229-Y1261 HydrophobicContact CD1-CD1 4.07Å
1230	L	86.4	Confident	88.3	Confident	95 Å²	95	53.8 Å²	53.8	50%	0.497	28%	0.279	S	S	.	.	H	α-helix	trans	-58	-44.6	177.7	-171.6	68.2	0	0	0	111.3	E1226 G1227 L1228 M1232 K1255 Y1261	E1226-L1230 PolarHBondContact O-N 3.48Å; G1227-L1230 WeakPolarHBondContact O-CB 3.48Å; G1227-L1230 PolarHBondContact O-N 2.86Å; L1228-L1230 PolarHBondContact O-N 3.41Å; L1230-M1232 VanDerWaalsContact C-N 3.3Å; L1230-M1232 PolarHBondContact O-N 3.08Å; L1230-K1255 PolarHBondContact O-NZ 3Å; L1230-K1255 VanDerWaalsContact O-NZ 3.08Å; L1230-Y1261 VanDerWaalsContact CA-OH 3.31Å; L1230-Y1261 WeakPolarHBondContact CA-OH 3.24Å; L1230-Y1261 WeakPolarHBondContact CD1-OH 3.42Å
1231	E	86.4	Confident	88.3	Confident	171 Å²	171	53.7 Å²	53.7	80%	0.799	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	-4.9	-179.7	-59.7	-63.9	148.6	0	0	113.6	L1229	L1229-E1231 VanDerWaalsContact C-N 3.28Å; L1229-E1231 PolarHBondContact O-N 2.88Å
1232	M	90.5	Very high	88.3	Confident	65 Å²	65	52.9 Å²	52.9	32%	0.32	27%	0.272	S	S	.	.	S	Bend	trans	-96.8	166.7	-175.9	-67.3	-177.4	84.2	0	0	112.7	L1228 L1229 L1230 D1236 I1238 K1255	L1228-M1232 WeakPolarHBondContact O-CG 3.5Å; L1229-M1232 HydrophobicContact CD2-CB 4.47Å; L1229-M1232 HydrophobicContact CD2-SD 3.92Å; L1229-M1232 PolarHBondContact O-N 3.24Å; L1230-M1232 VanDerWaalsContact C-N 3.3Å; L1230-M1232 PolarHBondContact O-N 3.08Å; M1232-D1236 HydrophobicContact CB-CB 3.87Å; M1232-D1236 WeakPolarHBondContact CB-OD2 3.36Å; M1232-D1236 HydrophobicContact CE-CB 3.82Å; M1232-D1236 HydrophobicContact SD-CB 4.4Å; M1232-I1238 HydrophobicContact SD-CD1 4.34Å; M1232-I1238 HydrophobicContact SD-CG1 4.47Å; M1232-K1255 WeakPolarHBondContact O-CD 3.38Å; M1232-K1255 PolarHBondContact O-NZ 3.41Å
1233	E	90.8	Very high	87.6	Confident	153 Å²	153	52.4 Å²	52.4	72%	0.715	27%	0.269	S	S	*	.	P	Polyproline II helix	trans	-78.6	159.3	-177.7	-67.3	-169.2	172.5	0	0	112.4	G1235 D1236	E1233-G1235 PolarHBondContact O-N 3.21Å; E1233-D1236 PolarHBondContact N-OD2 3.42Å; E1233-D1236 VanDerWaalsContact O-CB 3.31Å; E1233-D1236 WeakPolarHBondContact O-CB 3.3Å; E1233-D1236 PolarHBondContact O-N 2.92Å
1234	Q	90.4	Very high	86.9	Confident	32 Å²	32	53.8 Å²	53.8	15%	0.15	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	126	175.3	-180	-83.1	-36.3	0	0	111	V1256 A1303 R1307 L1310	Q1234-V1256 WeakPolarHBondContact CG-O 3.49Å; Q1234-A1303 PolarHBondContact NE2-O 3.27Å; Q1234-A1303 VanDerWaalsContact NE2-O 3.17Å; Q1234-R1307 PolarHBondContact O-NH2 2.9Å; Q1234-L1310 HydrophobicContact CG-CD1 3.67Å
1235	G	86.7	Confident	85.9	Confident	12 Å²	12	52.7 Å²	52.7	12%	0.124	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	101.7	-15.2	-173.3	0	0	0	0	0	114.1	E1233 T1237 K1255	E1233-G1235 PolarHBondContact O-N 3.21Å; G1235-T1237 PolarHBondContact O-OG1 3.45Å; G1235-K1255 PolarHBondContact N-O 3.4Å
1236	D	92.4	Very high	85.1	Confident	50 Å²	50	55 Å²	55	27%	0.267	30%	0.298	S	S	.	.			trans	-65.8	153.6	177.2	-76.6	-20.3	0	0	0	112.2	L1229 M1232 E1233 W1254 K1255	L1229-D1236 HydrophobicContact CD2-CB 4.25Å; L1229-D1236 WeakPolarHBondContact CD2-O 3.5Å; M1232-D1236 HydrophobicContact CB-CB 3.87Å; M1232-D1236 WeakPolarHBondContact CB-OD2 3.36Å; M1232-D1236 HydrophobicContact CE-CB 3.82Å; M1232-D1236 HydrophobicContact SD-CB 4.4Å; E1233-D1236 PolarHBondContact N-OD2 3.42Å; E1233-D1236 VanDerWaalsContact O-CB 3.31Å; E1233-D1236 WeakPolarHBondContact O-CB 3.3Å; E1233-D1236 PolarHBondContact O-N 2.92Å; D1236-W1254 CarbonylContact O-C 3.56Å; D1236-W1254 VanDerWaalsContact O-CA 3.27Å; D1236-W1254 WeakPolarHBondContact O-CA 3.48Å; D1236-W1254 WeakPolarHBondContact O-CB 3.41Å; D1236-K1255 PolarHBondContact O-N 3.32Å
1237	T	93	Very high	84.4	Confident	7 Å²	7	54.4 Å²	54.4	4%	0.043	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	140.8	-166	-60.1	0	0	0	0	112	Y1216 G1235 I1252 T1253 W1254 L1295 I1299	Y1216-T1237 WeakPolarHBondContact CD1-O 3.41Å; G1235-T1237 PolarHBondContact O-OG1 3.45Å; T1237-I1252 HydrophobicContact CG2-CG2 3.28Å; T1237-T1253 CarbonylContact C-O 3.5Å; T1237-T1253 WeakPolarHBondContact CA-O 3.31Å; T1237-W1254 HydrophobicContact CG2-CB 4.16Å; T1237-W1254 VanDerWaalsContact OG1-CB 3.3Å; T1237-W1254 WeakPolarHBondContact OG1-CB 3.11Å; T1237-L1295 HydrophobicContact CG2-CD2 3.74Å; T1237-I1299 WeakPolarHBondContact OG1-CG2 3.17Å
1238	I	92.4	Very high	84.1	Confident	5 Å²	5	55.9 Å²	55.9	3%	0.026	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	125.1	169.7	-63	179.3	0	0	0	108.7	Q1218 A1225 L1228 L1229 M1232 T1253	Q1218-I1238 HydrophobicContact CB-CG2 4.19Å; A1225-I1238 HydrophobicContact CB-CG2 4.28Å; L1228-I1238 HydrophobicContact CB-CD1 3.52Å; L1228-I1238 HydrophobicContact CD1-CD1 4.16Å; L1228-I1238 HydrophobicContact CG-CD1 4.5Å; L1229-I1238 HydrophobicContact CD1-CD1 4.42Å; L1229-I1238 HydrophobicContact CD1-CG1 4.41Å; L1229-I1238 HydrophobicContact CD2-CD1 4.2Å; L1229-I1238 HydrophobicContact CD2-CG1 3.97Å; L1229-I1238 HydrophobicContact CG-CD1 3.75Å; L1229-I1238 HydrophobicContact CG-CG1 3.96Å; M1232-I1238 HydrophobicContact SD-CD1 4.34Å; M1232-I1238 HydrophobicContact SD-CG1 4.47Å; I1238-T1253 PolarHBondContact N-O 3.16Å; I1238-T1253 PolarHBondContact O-N 2.58Å
1239	I	92.4	Very high	84	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	126.1	171.6	-48.8	-176.1	0	0	0	107.4	H1214 Y1216 F1217 Q1218 L1250 I1252 L1291	H1214-I1239 VanDerWaalsContact CE1-CD1 3.42Å; H1214-I1239 WeakPolarHBondContact CE1-CD1 3.28Å; Y1216-I1239 PolarHBondContact O-N 3.43Å; F1217-I1239 CarbonylContact C-O 3.59Å; F1217-I1239 VanDerWaalsContact CA-O 3.26Å; F1217-I1239 WeakPolarHBondContact CA-O 3.43Å; F1217-I1239 HydrophobicContact CB-CB 4.41Å; F1217-I1239 HydrophobicContact CD2-CB 4.29Å; F1217-I1239 HydrophobicContact CD2-CG2 3.97Å; Q1218-I1239 PolarHBondContact N-O 2.91Å; I1239-L1250 HydrophobicContact CG2-CB 4.49Å; I1239-L1250 HydrophobicContact CG2-CD1 4.44Å; I1239-I1252 HydrophobicContact CG1-CG1 4.19Å; I1239-I1252 HydrophobicContact CG2-CG1 4.31Å; I1239-L1291 HydrophobicContact CD1-CB 4.03Å; I1239-L1291 HydrophobicContact CD1-CD1 3.98Å; I1239-L1291 HydrophobicContact CD1-CD2 4.18Å; I1239-L1291 HydrophobicContact CD1-CG 4.29Å
1240	R	90.5	Very high	83.9	Confident	11 Å²	11	55.5 Å²	55.5	4%	0.042	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	156.8	-178.3	57.1	170.8	178.4	77.4	-1	111.9	Q1218 C1222 T1251 T1253 H1263	Q1218-R1240 WeakPolarHBondContact O-CA 3.32Å; C1222-R1240 PolarHBondContact SG-NH2 3.13Å; R1240-T1251 VanDerWaalsContact CG-O 3.31Å; R1240-T1251 WeakPolarHBondContact CG-O 3.41Å; R1240-T1251 PolarHBondContact N-O 3.25Å; R1240-T1251 PolarHBondContact O-N 3.24Å; R1240-T1253 PolarHBondContact NE-OG1 3.34Å; R1240-H1263 PolarHBondContact NH2-ND1 3.45Å
1241	P	85.5	Confident	84.1	Confident	5 Å²	5	51.2 Å²	51.2	3%	0.032	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.3	145	166.1	-22.6	33.6	0	0	0	111.3	Y1207 F1217 Q1218 S1243	Y1207-P1241 HydrophobicContact CD2-CB 4.21Å; Y1207-P1241 HydrophobicContact CD2-CG 4.04Å; F1217-P1241 HydrophobicContact CE2-CG 4.12Å; F1217-P1241 HydrophobicContact CZ-CG 3.81Å; Q1218-P1241 WeakPolarHBondContact O-CD 3.44Å; P1241-S1243 PolarHBondContact O-N 2.9Å
1242	S	81.5	Confident	84.4	Confident	15 Å²	15	43.1 Å²	43.1	11%	0.105	23%	0.231	C	C	.	.			trans	-65.1	131.5	170.6	-176.9	0	0	0	0	110.1	K1244 V1245 Y1249	S1242-K1244 VanDerWaalsContact C-N 3.34Å; S1242-K1244 PolarHBondContact OG-N 3Å; S1242-V1245 WeakPolarHBondContact CB-O 3.42Å; S1242-V1245 PolarHBondContact OG-N 3.28Å; S1242-V1245 VanDerWaalsContact OG-N 3.12Å; S1242-V1245 PolarHBondContact OG-O 3.35Å; S1242-Y1249 VanDerWaalsContact CB-O 3.29Å; S1242-Y1249 WeakPolarHBondContact CB-O 3.43Å; S1242-Y1249 PolarHBondContact N-O 3.09Å
1243	S	71.3	Confident	84.6	Confident	27 Å²	27	40 Å²	40	19%	0.189	22%	0.216	C	C	.	.	S	Bend	trans	-85.6	-8.8	175.6	-44.3	0	0	0	0	112.9	P1241	P1241-S1243 PolarHBondContact O-N 2.9Å
1244	K	67.7	Low	84.7	Confident	202 Å²	202	32.7 Å²	32.7	88%	0.878	18%	0.182	S	C	*	.	S	Bend	trans	-123	-24.5	-170	-67.8	-173.6	179.1	-179.3	0	114.1	S1242	S1242-K1244 VanDerWaalsContact C-N 3.34Å; S1242-K1244 PolarHBondContact OG-N 3Å
1245	V	66	Low	84.9	Confident	68 Å²	68	31.5 Å²	31.5	41%	0.412	18%	0.176	S	C	.	.	S	Bend	trans	-126	144.5	-173.9	-162.1	0	0	0	0	106.8	S1242 Y1249	S1242-V1245 WeakPolarHBondContact CB-O 3.42Å; S1242-V1245 PolarHBondContact OG-N 3.28Å; S1242-V1245 VanDerWaalsContact OG-N 3.12Å; S1242-V1245 PolarHBondContact OG-O 3.35Å; V1245-Y1249 HydrophobicContact CB-CD2 3.86Å; V1245-Y1249 HydrophobicContact CB-CE2 4.45Å; V1245-Y1249 HydrophobicContact CB-CG 3.98Å; V1245-Y1249 HydrophobicContact CG1-CD1 4.41Å; V1245-Y1249 HydrophobicContact CG1-CD2 3.2Å; V1245-Y1249 HydrophobicContact CG1-CE2 3.38Å; V1245-Y1249 HydrophobicContact CG1-CG 3.77Å
1246	G	69.7	Low	85.1	Confident	47 Å²	47	31 Å²	31	49%	0.485	17%	0.17	S	C	.	.			trans	-56.1	-169.9	-169.2	0	0	0	0	0	115.9	D1248 Y1249	G1246-D1248 PolarHBondContact O-N 3.49Å; G1246-Y1249 PolarHBondContact O-N 3.33Å
1247	P	73.1	Confident	84.8	Confident	52 Å²	52	28.9 Å²	28.9	34%	0.338	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-20.7	-169.8	24.2	-33.7	0	0	0	113.6	R1210 Y1249 K1271 P1274	R1210-P1247 PolarHBondContact NH1-O 3.05Å; P1247-Y1249 PolarHBondContact O-N 3.38Å; P1247-K1271 VanDerWaalsContact C-NZ 3.35Å; P1247-K1271 PolarHBondContact O-NZ 3.49Å; P1247-P1274 HydrophobicContact CB-CB 4.37Å; P1247-P1274 HydrophobicContact CG-CB 4.43Å
1248	D	81.4	Confident	84.5	Confident	74 Å²	74	34 Å²	34	40%	0.396	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	9.1	-175.4	-53.4	-33.9	0	0	0	115.3	G1246 E1268 K1271	G1246-D1248 PolarHBondContact O-N 3.49Å; D1248-E1268 PolarHBondContact O-N 3.3Å; D1248-K1271 IonicContact OD1-NZ 2.79Å; D1248-K1271 PolarHBondContact OD1-NZ 3.28Å
1249	Y	86	Confident	84.2	Confident	74 Å²	74	35.5 Å²	35.5	29%	0.29	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	128.7	179.2	-69.5	-96.1	0	0	0	112.3	S1242 V1245 G1246 P1247 V1266 R1267	S1242-Y1249 VanDerWaalsContact CB-O 3.29Å; S1242-Y1249 WeakPolarHBondContact CB-O 3.43Å; S1242-Y1249 PolarHBondContact N-O 3.09Å; V1245-Y1249 HydrophobicContact CB-CD2 3.86Å; V1245-Y1249 HydrophobicContact CB-CE2 4.45Å; V1245-Y1249 HydrophobicContact CB-CG 3.98Å; V1245-Y1249 HydrophobicContact CG1-CD1 4.41Å; V1245-Y1249 HydrophobicContact CG1-CD2 3.2Å; V1245-Y1249 HydrophobicContact CG1-CE2 3.38Å; V1245-Y1249 HydrophobicContact CG1-CG 3.77Å; G1246-Y1249 PolarHBondContact O-N 3.33Å; P1247-Y1249 PolarHBondContact O-N 3.38Å; Y1249-V1266 WeakPolarHBondContact CA-O 3.46Å; Y1249-R1267 HydrophobicContact CD1-CB 4.23Å; Y1249-R1267 HydrophobicContact CE1-CB 3.82Å; Y1249-R1267 HydrophobicContact CE1-CG 3.91Å
1250	L	88.9	Confident	84.1	Confident	0 Å²	0	36 Å²	36	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	154.8	163.2	-68.3	172.6	0	0	0	109.6	I1212 F1217 I1239 V1266 E1268 L1277 L1291	I1212-L1250 HydrophobicContact CD1-CD1 3.91Å; I1212-L1250 HydrophobicContact CD1-CD2 3.87Å; I1212-L1250 HydrophobicContact CD1-CG 4.48Å; F1217-L1250 HydrophobicContact CD2-CD2 4.45Å; F1217-L1250 HydrophobicContact CE2-CD2 3.82Å; I1239-L1250 HydrophobicContact CG2-CB 4.49Å; I1239-L1250 HydrophobicContact CG2-CD1 4.44Å; L1250-V1266 HydrophobicContact CB-CB 4.31Å; L1250-V1266 PolarHBondContact N-O 3.3Å; L1250-V1266 PolarHBondContact O-N 2.96Å; L1250-E1268 HydrophobicContact CD1-CG 4.35Å; L1250-E1268 HydrophobicContact CG-CG 4.43Å; L1250-L1277 HydrophobicContact CD1-CD1 3.53Å; L1250-L1291 HydrophobicContact CD1-CD2 4.18Å
1251	T	90.6	Very high	84.2	Confident	6 Å²	6	36.5 Å²	36.5	4%	0.037	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	119.2	172.1	-51.9	0	0	0	0	109.2	R1240 H1263 I1264	R1240-T1251 VanDerWaalsContact CG-O 3.31Å; R1240-T1251 WeakPolarHBondContact CG-O 3.41Å; R1240-T1251 PolarHBondContact N-O 3.25Å; R1240-T1251 PolarHBondContact O-N 3.24Å; T1251-H1263 HydrophobicContact CG2-CB 3.78Å; T1251-I1264 CarbonylContact C-O 3.5Å; T1251-I1264 WeakPolarHBondContact CA-O 3.16Å
1252	I	92.5	Very high	84.5	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	115.8	172.5	-59.9	-179	0	0	0	107	T1237 I1239 H1263 I1264 V1266 I1294 I1299	T1237-I1252 HydrophobicContact CG2-CG2 3.28Å; I1239-I1252 HydrophobicContact CG1-CG1 4.19Å; I1239-I1252 HydrophobicContact CG2-CG1 4.31Å; I1252-H1263 CarbonylContact O-C 3.55Å; I1252-H1263 WeakPolarHBondContact O-CA 3.1Å; I1252-I1264 HydrophobicContact CB-CB 4.42Å; I1252-I1264 PolarHBondContact N-O 3.47Å; I1252-I1264 PolarHBondContact O-N 2.94Å; I1252-V1266 HydrophobicContact CD1-CG2 3.56Å; I1252-V1266 HydrophobicContact CG1-CG2 3.78Å; I1252-I1294 HydrophobicContact CD1-CB 4.42Å; I1252-I1294 HydrophobicContact CD1-CG2 3.58Å; I1252-I1299 HydrophobicContact CG2-CD1 4.22Å; I1252-I1299 HydrophobicContact CG2-CG1 4.35Å
1253	T	93	Very high	84.9	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	123.3	175.2	-54.1	0	0	0	0	108.4	L1229 T1237 I1238 R1240 Q1262 H1263	L1229-T1253 HydrophobicContact CD1-CG2 3.56Å; L1229-T1253 WeakPolarHBondContact CD1-O 3.42Å; T1237-T1253 CarbonylContact C-O 3.5Å; T1237-T1253 WeakPolarHBondContact CA-O 3.31Å; I1238-T1253 PolarHBondContact N-O 3.16Å; I1238-T1253 PolarHBondContact O-N 2.58Å; R1240-T1253 PolarHBondContact NE-OG1 3.34Å; T1253-Q1262 WeakPolarHBondContact CA-O 3.41Å; T1253-H1263 WeakPolarHBondContact CG2-CE1 3.5Å; T1253-H1263 WeakPolarHBondContact CG2-ND1 3.44Å; T1253-H1263 PolarHBondContact OG1-ND1 3.35Å
1254	W	93.6	Very high	85.8	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	154.1	179.5	76.2	-79.5	0	0	0	111.9	D1236 T1237 V1256 Y1261 Q1262 I1299 M1302 A1303 A1306	D1236-W1254 CarbonylContact O-C 3.56Å; D1236-W1254 VanDerWaalsContact O-CA 3.27Å; D1236-W1254 WeakPolarHBondContact O-CA 3.48Å; D1236-W1254 WeakPolarHBondContact O-CB 3.41Å; T1237-W1254 HydrophobicContact CG2-CB 4.16Å; T1237-W1254 VanDerWaalsContact OG1-CB 3.3Å; T1237-W1254 WeakPolarHBondContact OG1-CB 3.11Å; W1254-V1256 HydrophobicContact CD2-CG2 4.32Å; W1254-V1256 HydrophobicContact CE3-CG2 4.47Å; W1254-V1256 HydrophobicContact CH2-CB 4.22Å; W1254-V1256 HydrophobicContact CH2-CG1 4.2Å; W1254-V1256 HydrophobicContact CH2-CG2 3.88Å; W1254-V1256 HydrophobicContact CZ2-CG2 3.68Å; W1254-V1256 HydrophobicContact CZ3-CB 4.42Å; W1254-V1256 HydrophobicContact CZ3-CG2 4.27Å; W1254-V1256 PolarHBondContact O-N 3.39Å; W1254-Y1261 WeakPolarHBondContact O-CA 3.17Å; W1254-Q1262 PolarHBondContact N-O 3.29Å; W1254-Q1262 PolarHBondContact O-N 3.39Å; W1254-I1299 HydrophobicContact CB-CG2 4.17Å; W1254-I1299 HydrophobicContact CD2-CG2 4.27Å; W1254-I1299 HydrophobicContact CG-CD1 4.41Å; W1254-I1299 HydrophobicContact CG-CG2 4.13Å; W1254-M1302 HydrophobicContact CH2-CB 4.37Å; W1254-M1302 HydrophobicContact CZ2-CB 4.31Å; W1254-M1302 HydrophobicContact CZ2-CE 4Å; W1254-A1303 HydrophobicContact CE3-CB 4.44Å; W1254-A1303 HydrophobicContact CZ3-CB 4.01Å; W1254-A1306 HydrophobicContact CH2-CB 4.25Å
1255	K	93.9	Very high	86.8	Confident	6 Å²	6	34.5 Å²	34.5	3%	0.026	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	104.8	-176.5	-172.2	174.3	-171	178.6	0	111.1	L1229 L1230 M1232 G1235 D1236 D1258 Y1261	L1229-K1255 HydrophobicContact CD2-CB 4.5Å; L1229-K1255 WeakPolarHBondContact O-CD 3.32Å; L1230-K1255 PolarHBondContact O-NZ 3Å; L1230-K1255 VanDerWaalsContact O-NZ 3.08Å; M1232-K1255 WeakPolarHBondContact O-CD 3.38Å; M1232-K1255 PolarHBondContact O-NZ 3.41Å; G1235-K1255 PolarHBondContact N-O 3.4Å; D1236-K1255 PolarHBondContact O-N 3.32Å; K1255-D1258 WeakPolarHBondContact CE-OD1 3.35Å; K1255-D1258 IonicContact NZ-OD1 2.85Å; K1255-D1258 PolarHBondContact NZ-OD1 3.07Å; K1255-Y1261 HydrophobicContact CB-CD1 4.1Å; K1255-Y1261 HydrophobicContact CB-CE1 4.1Å; K1255-Y1261 HydrophobicContact CD-CE1 4.2Å; K1255-Y1261 HydrophobicContact CG-CD1 4.18Å; K1255-Y1261 HydrophobicContact CG-CE1 3.8Å
1256	V	91	Very high	87.9	Confident	1 Å²	1	31.2 Å²	31.2	1%	0.006	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75	-48	177.6	-174.6	0	0	0	0	110.2	Q1234 W1254 I1260 Q1262 F1355	Q1234-V1256 WeakPolarHBondContact CG-O 3.49Å; W1254-V1256 HydrophobicContact CD2-CG2 4.32Å; W1254-V1256 HydrophobicContact CE3-CG2 4.47Å; W1254-V1256 HydrophobicContact CH2-CB 4.22Å; W1254-V1256 HydrophobicContact CH2-CG1 4.2Å; W1254-V1256 HydrophobicContact CH2-CG2 3.88Å; W1254-V1256 HydrophobicContact CZ2-CG2 3.68Å; W1254-V1256 HydrophobicContact CZ3-CB 4.42Å; W1254-V1256 HydrophobicContact CZ3-CG2 4.27Å; W1254-V1256 PolarHBondContact O-N 3.39Å; V1256-I1260 HydrophobicContact CB-CG2 4.24Å; V1256-I1260 WeakPolarHBondContact CB-O 3.38Å; V1256-I1260 PolarHBondContact N-O 3.21Å; V1256-Q1262 HydrophobicContact CG2-CB 3.66Å; V1256-F1355 HydrophobicContact CG1-CE2 3.98Å; V1256-F1355 HydrophobicContact CG1-CZ 4.44Å
1257	A	87.8	Confident	88.8	Confident	6 Å²	6	34.5 Å²	34.5	5%	0.05	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	171.9	175.6	0	0	0	0	0	108.4	G1259 I1260 L1310 A1347	A1257-G1259 PolarHBondContact O-N 3.26Å; A1257-I1260 HydrophobicContact CB-CB 4.37Å; A1257-I1260 HydrophobicContact CB-CD1 4.32Å; A1257-I1260 PolarHBondContact N-O 3.36Å; A1257-I1260 PolarHBondContact O-N 3.01Å; A1257-I1260 VanDerWaalsContact O-O 3.07Å; A1257-L1310 HydrophobicContact CB-CD1 4.37Å; A1257-L1310 HydrophobicContact CB-CD2 4.05Å; A1257-A1347 HydrophobicContact CB-CB 3.95Å
1258	D	86.6	Confident	89.4	Confident	114 Å²	114	32.3 Å²	32.3	61%	0.61	17%	0.169	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.1	125	177.2	-71.1	-34.2	0	0	0	111.4	K1255 I1260	K1255-D1258 WeakPolarHBondContact CE-OD1 3.35Å; K1255-D1258 IonicContact NZ-OD1 2.85Å; K1255-D1258 PolarHBondContact NZ-OD1 3.07Å; D1258-I1260 PolarHBondContact O-N 3.29Å
1259	G	85.7	Confident	89.6	Confident	38 Å²	38	31.9 Å²	31.9	39%	0.392	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	71.6	7.1	-176.1	0	0	0	0	0	115.9	A1257	A1257-G1259 PolarHBondContact O-N 3.26Å
1260	I	90	Very high	89.3	Confident	9 Å²	9	33.6 Å²	33.6	5%	0.046	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	109.2	179	-54	174.4	0	0	0	109.7	V1256 A1257 D1258 A1347 K1349 P1352	V1256-I1260 HydrophobicContact CB-CG2 4.24Å; V1256-I1260 WeakPolarHBondContact CB-O 3.38Å; V1256-I1260 PolarHBondContact N-O 3.21Å; A1257-I1260 HydrophobicContact CB-CB 4.37Å; A1257-I1260 HydrophobicContact CB-CD1 4.32Å; A1257-I1260 PolarHBondContact N-O 3.36Å; A1257-I1260 PolarHBondContact O-N 3.01Å; A1257-I1260 VanDerWaalsContact O-O 3.07Å; D1258-I1260 PolarHBondContact O-N 3.29Å; I1260-A1347 HydrophobicContact CD1-CB 3.65Å; I1260-K1349 HydrophobicContact CD1-CB 4.34Å; I1260-K1349 HydrophobicContact CG1-CB 4.27Å; I1260-P1352 HydrophobicContact CG2-CB 4.17Å; I1260-P1352 HydrophobicContact CG2-CG 4.49Å
1261	Y	91.7	Very high	88.7	Confident	22 Å²	22	35.7 Å²	35.7	9%	0.086	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	136.2	-178.4	-49.6	-77.8	0	0	0	110	E1226 L1229 L1230 W1254 K1255 P1352	E1226-Y1261 HydrophobicContact CB-CD2 4.15Å; E1226-Y1261 HydrophobicContact CB-CE2 4.21Å; E1226-Y1261 HydrophobicContact CG-CD2 3.78Å; E1226-Y1261 HydrophobicContact CG-CE2 4.34Å; E1226-Y1261 HydrophobicContact CG-CG 4.2Å; L1229-Y1261 HydrophobicContact CB-CD1 3.92Å; L1229-Y1261 HydrophobicContact CB-CE1 3.57Å; L1229-Y1261 HydrophobicContact CD1-CD1 4.07Å; L1230-Y1261 VanDerWaalsContact CA-OH 3.31Å; L1230-Y1261 WeakPolarHBondContact CA-OH 3.24Å; L1230-Y1261 WeakPolarHBondContact CD1-OH 3.42Å; W1254-Y1261 WeakPolarHBondContact O-CA 3.17Å; K1255-Y1261 HydrophobicContact CB-CD1 4.1Å; K1255-Y1261 HydrophobicContact CB-CE1 4.1Å; K1255-Y1261 HydrophobicContact CD-CE1 4.2Å; K1255-Y1261 HydrophobicContact CG-CD1 4.18Å; K1255-Y1261 HydrophobicContact CG-CE1 3.8Å; Y1261-P1352 WeakPolarHBondContact O-CB 3.41Å
1262	Q	91.7	Very high	87.8	Confident	43 Å²	43	41.6 Å²	41.6	20%	0.201	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	134.6	174.6	-176.2	-177.5	38.2	0	0	109.3	T1253 W1254 V1256 I1264 P1352	T1253-Q1262 WeakPolarHBondContact CA-O 3.41Å; W1254-Q1262 PolarHBondContact N-O 3.29Å; W1254-Q1262 PolarHBondContact O-N 3.39Å; V1256-Q1262 HydrophobicContact CG2-CB 3.66Å; Q1262-I1264 HydrophobicContact CG-CG1 4.34Å; Q1262-P1352 HydrophobicContact CB-CB 3.97Å; Q1262-P1352 HydrophobicContact CG-CB 4.38Å; Q1262-P1352 PolarHBondContact NE2-O 3.12Å
1263	H	90.8	Very high	86.8	Confident	75 Å²	75	47.5 Å²	47.5	35%	0.347	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	117.5	177.6	-47.9	-75.4	0	0	0	109.3	C1222 E1226 R1240 T1251 I1252 T1253	C1222-H1263 PolarHBondContact SG-CE1 2.9Å; E1226-H1263 IonicContact OE1-CE1 3.71Å; E1226-H1263 IonicContact OE1-NE2 3.76Å; R1240-H1263 PolarHBondContact NH2-ND1 3.45Å; T1251-H1263 HydrophobicContact CG2-CB 3.78Å; I1252-H1263 CarbonylContact O-C 3.55Å; I1252-H1263 WeakPolarHBondContact O-CA 3.1Å; T1253-H1263 WeakPolarHBondContact CG2-CE1 3.5Å; T1253-H1263 WeakPolarHBondContact CG2-ND1 3.44Å; T1253-H1263 PolarHBondContact OG1-ND1 3.35Å
1264	I	89.5	Confident	85.7	Confident	16 Å²	16	51 Å²	51	8%	0.082	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	122.2	178.8	-63.5	163.7	0	0	0	107.4	T1251 I1252 Q1262 I1283 I1299	T1251-I1264 CarbonylContact C-O 3.5Å; T1251-I1264 WeakPolarHBondContact CA-O 3.16Å; I1252-I1264 HydrophobicContact CB-CB 4.42Å; I1252-I1264 PolarHBondContact N-O 3.47Å; I1252-I1264 PolarHBondContact O-N 2.94Å; Q1262-I1264 HydrophobicContact CG-CG1 4.34Å; I1264-I1283 HydrophobicContact CG2-CD1 4.11Å; I1264-I1283 HydrophobicContact CG2-CG2 3.69Å; I1264-I1299 HydrophobicContact CD1-CD1 3.4Å; I1264-I1299 VanDerWaalsContact CD1-CD1 3.4Å
1265	S	89.2	Confident	84.7	Confident	73 Å²	73	58.1 Å²	58.1	51%	0.51	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	126.6	176.5	-66.3	0	0	0	0	110
1266	V	88.6	Confident	83.8	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	118.3	175.5	-176.1	0	0	0	0	107.3	Y1249 L1250 I1252 L1281 I1283 I1294	Y1249-V1266 WeakPolarHBondContact CA-O 3.46Å; L1250-V1266 HydrophobicContact CB-CB 4.31Å; L1250-V1266 PolarHBondContact N-O 3.3Å; L1250-V1266 PolarHBondContact O-N 2.96Å; I1252-V1266 HydrophobicContact CD1-CG2 3.56Å; I1252-V1266 HydrophobicContact CG1-CG2 3.78Å; V1266-L1281 HydrophobicContact CG1-CB 3.82Å; V1266-L1281 HydrophobicContact CG1-CD2 4.13Å; V1266-L1281 HydrophobicContact CG1-CG 4.44Å; V1266-I1283 HydrophobicContact CG1-CG1 4.38Å; V1266-I1283 HydrophobicContact CG2-CD1 3.88Å; V1266-I1283 HydrophobicContact CG2-CG1 4.02Å; V1266-I1294 HydrophobicContact CG1-CD1 3.99Å; V1266-I1294 HydrophobicContact CG2-CD1 4.32Å
1267	R	88.7	Confident	83.4	Confident	115 Å²	115	62.6 Å²	62.6	43%	0.434	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	126.6	174.2	-176	178.6	178.1	-148.1	-13.6	108.7	Y1249 E1269 L1282	Y1249-R1267 HydrophobicContact CD1-CB 4.23Å; Y1249-R1267 HydrophobicContact CE1-CB 3.82Å; Y1249-R1267 HydrophobicContact CE1-CG 3.91Å; R1267-E1269 IonicContact CZ-OE1 3.58Å; R1267-E1269 IonicContact NE-OE1 2.69Å; R1267-E1269 IonicContact NH1-OE1 3.45Å; R1267-E1269 PolarHBondContact NH1-OE1 3.21Å; R1267-E1269 IonicContact NH2-OE1 2.81Å; R1267-E1269 PolarHBondContact NH2-OE1 3.3Å; R1267-L1282 HydrophobicContact CB-CB 4.49Å; R1267-L1282 PolarHBondContact N-O 3.36Å; R1267-L1282 PolarHBondContact O-N 3.31Å
1268	E	86.6	Confident	83.1	Confident	6 Å²	6	62.5 Å²	62.5	3%	0.028	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	130	178.3	-60.2	177.3	80.6	0	0	110.1	R1210 D1248 L1250 K1271 L1277 G1278 L1281	R1210-E1268 IonicContact CZ-OE2 2.66Å; R1210-E1268 IonicContact NH1-OE1 2.71Å; R1210-E1268 IonicContact NH1-OE2 3.41Å; R1210-E1268 PolarHBondContact NH1-OE2 2.94Å; R1210-E1268 IonicContact NH2-OE1 3.44Å; R1210-E1268 IonicContact NH2-OE2 2.96Å; D1248-E1268 PolarHBondContact O-N 3.3Å; L1250-E1268 HydrophobicContact CD1-CG 4.35Å; L1250-E1268 HydrophobicContact CG-CG 4.43Å; E1268-K1271 WeakPolarHBondContact OE1-CE 3.47Å; E1268-K1271 IonicContact OE1-NZ 3.63Å; E1268-K1271 VanDerWaalsContact OE2-CE 3.25Å; E1268-K1271 WeakPolarHBondContact OE2-CE 3.27Å; E1268-K1271 IonicContact OE2-NZ 3.91Å; E1268-K1271 PolarHBondContact OE2-NZ 3.43Å; E1268-L1277 WeakPolarHBondContact OE1-CA 3.26Å; E1268-L1277 WeakPolarHBondContact OE1-CD1 3.35Å; E1268-G1278 PolarHBondContact OE1-N 3.19Å; E1268-L1281 HydrophobicContact CB-CD2 4.33Å; E1268-L1281 HydrophobicContact CG-CD2 3.74Å
1269	E	84.6	Confident	82.9	Confident	66 Å²	66	63.2 Å²	63.2	31%	0.308	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	160.7	171.7	-67.1	-168.8	162.1	0	0	111	R1267 G1278 K1279 S1280 L1282	R1267-E1269 IonicContact CZ-OE1 3.58Å; R1267-E1269 IonicContact NE-OE1 2.69Å; R1267-E1269 IonicContact NH1-OE1 3.45Å; R1267-E1269 PolarHBondContact NH1-OE1 3.21Å; R1267-E1269 IonicContact NH2-OE1 2.81Å; R1267-E1269 PolarHBondContact NH2-OE1 3.3Å; E1269-G1278 CarbonylContact O-C 3.56Å; E1269-G1278 WeakPolarHBondContact O-CA 3.14Å; E1269-K1279 PolarHBondContact O-N 3.23Å; E1269-K1279 VanDerWaalsContact O-N 3.08Å; E1269-S1280 PolarHBondContact N-O 3.03Å; E1269-S1280 PolarHBondContact O-N 3.46Å; E1269-L1282 HydrophobicContact CB-CD1 4.19Å; E1269-L1282 HydrophobicContact CG-CD1 3.83Å
1270	N	79.9	Confident	82.8	Confident	110 Å²	110	62.8 Å²	62.8	59%	0.588	31%	0.309	S	S	*	.	S	Bend	trans	58.7	53.1	179	-59.1	-42.2	0	0	0	114.8	K1279 S1280	N1270-K1279 HydrophobicContact CB-CB 4.12Å; N1270-K1279 PolarHBondContact O-N 2.64Å; N1270-S1280 PolarHBondContact ND2-OG 2.88Å
1271	K	76.2	Confident	82.8	Confident	44 Å²	44	62.4 Å²	62.4	19%	0.191	31%	0.306	C	S	.	.			trans	-83	137.1	175.3	-74.1	-176.1	168.2	179	0	113	R1210 P1247 D1248 E1268 S1276	R1210-K1271 VanDerWaalsContact NH1-NZ 3.14Å; R1210-K1271 VanDerWaalsContact NH2-NZ 3.11Å; P1247-K1271 VanDerWaalsContact C-NZ 3.35Å; P1247-K1271 PolarHBondContact O-NZ 3.49Å; D1248-K1271 IonicContact OD1-NZ 2.79Å; D1248-K1271 PolarHBondContact OD1-NZ 3.28Å; E1268-K1271 WeakPolarHBondContact OE1-CE 3.47Å; E1268-K1271 IonicContact OE1-NZ 3.63Å; E1268-K1271 VanDerWaalsContact OE2-CE 3.25Å; E1268-K1271 WeakPolarHBondContact OE2-CE 3.27Å; E1268-K1271 IonicContact OE2-NZ 3.91Å; E1268-K1271 PolarHBondContact OE2-NZ 3.43Å; K1271-S1276 VanDerWaalsContact CE-O 3.27Å; K1271-S1276 WeakPolarHBondContact CE-O 3.35Å
1272	E	71.6	Confident	82.6	Confident	130 Å²	130	63.1 Å²	63.1	61%	0.607	31%	0.312	S	S	*	.	S	Bend	trans	-73.7	-40.1	171	-65.2	-176.6	173	0	0	111.7	K1279	E1272-K1279 VanDerWaalsContact OE1-CE 3.26Å; E1272-K1279 WeakPolarHBondContact OE1-CE 3.21Å; E1272-K1279 IonicContact OE1-NZ 3.44Å; E1272-K1279 PolarHBondContact OE1-NZ 3.42Å
1273	H	71.5	Confident	82.4	Confident	124 Å²	124	61.2 Å²	61.2	57%	0.574	30%	0.303	S	S	*	.	S	Bend	trans	-139.9	154.8	173.4	-67.2	-49.7	0	0	0	110.4	Y1275 S1276	H1273-Y1275 PolarHBondContact O-N 2.92Å; H1273-S1276 PolarHBondContact O-N 3.43Å
1274	P	69.9	Low	81.8	Confident	74 Å²	74	63.8 Å²	63.8	48%	0.481	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.1	-27.8	179.1	-26.3	34	0	0	0	114.1	R1210 P1247	R1210-P1274 PolarHBondContact NE-O 2.92Å; R1210-P1274 PolarHBondContact NH2-O 2.96Å; P1247-P1274 HydrophobicContact CB-CB 4.37Å; P1247-P1274 HydrophobicContact CG-CB 4.43Å
1275	Y	72.3	Confident	81.3	Confident	149 Å²	149	70.5 Å²	70.5	58%	0.584	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.6	-25.4	179.7	-56.8	-74.9	0	0	0	113.7	V1208 R1210 H1273	V1208-Y1275 HydrophobicContact CG1-CE1 4.03Å; R1210-Y1275 PolarHBondContact NE-O 3.18Å; R1210-Y1275 VanDerWaalsContact NE-O 3.14Å; R1210-Y1275 VanDerWaalsContact NH2-C 3.32Å; R1210-Y1275 PolarHBondContact NH2-O 3.01Å; H1273-Y1275 PolarHBondContact O-N 2.92Å
1276	S	76.4	Confident	81	Confident	43 Å²	43	71.4 Å²	71.4	30%	0.301	35%	0.351	S	S	.	.	S	Bend	trans	-75.8	147.5	-179.2	-55.4	0	0	0	0	112.1	R1210 K1271 H1273	R1210-S1276 VanDerWaalsContact NH2-C 3.28Å; R1210-S1276 PolarHBondContact NH2-O 3.42Å; K1271-S1276 VanDerWaalsContact CE-O 3.27Å; K1271-S1276 WeakPolarHBondContact CE-O 3.35Å; H1273-S1276 PolarHBondContact O-N 3.43Å
1277	L	81.9	Confident	81	Confident	58 Å²	58	75.5 Å²	75.5	30%	0.304	38%	0.376	S	S	.	.	P	Polyproline II helix	trans	-61.2	138.1	173	-172.6	71.5	0	0	0	110	I1212 L1250 E1268 L1281 L1291	I1212-L1277 HydrophobicContact CD1-CD1 4.12Å; I1212-L1277 HydrophobicContact CG2-CB 4.47Å; I1212-L1277 HydrophobicContact CG2-CD1 4.32Å; L1250-L1277 HydrophobicContact CD1-CD1 3.53Å; E1268-L1277 WeakPolarHBondContact OE1-CA 3.26Å; E1268-L1277 WeakPolarHBondContact OE1-CD1 3.35Å; L1277-L1281 HydrophobicContact CD1-CD2 4.24Å; L1277-L1291 HydrophobicContact CD1-CD1 3.94Å; L1277-L1291 HydrophobicContact CD1-CD2 4.35Å; L1277-L1291 HydrophobicContact CD1-CG 4.17Å; L1277-L1291 HydrophobicContact CD2-CD1 4.09Å; L1277-L1291 HydrophobicContact CD2-CG 4.14Å
1278	G	81.5	Confident	81	Confident	4 Å²	4	70.2 Å²	70.2	4%	0.041	36%	0.356	C	S	.	.	P	Polyproline II helix	trans	-66.2	148.1	175.2	0	0	0	0	0	112.8	E1268 E1269 S1280	E1268-G1278 PolarHBondContact OE1-N 3.19Å; E1269-G1278 CarbonylContact O-C 3.56Å; E1269-G1278 WeakPolarHBondContact O-CA 3.14Å; G1278-S1280 VanDerWaalsContact C-N 3.26Å; G1278-S1280 PolarHBondContact O-N 2.93Å
1279	K	83	Confident	80.8	Confident	128 Å²	128	77.5 Å²	77.5	56%	0.557	39%	0.391	S	S	*	.	S	Bend	trans	-75.2	-15.2	176.9	-66.7	-178.8	-179	176.2	0	113.3	E1269 N1270 E1272	E1269-K1279 PolarHBondContact O-N 3.23Å; E1269-K1279 VanDerWaalsContact O-N 3.08Å; N1270-K1279 HydrophobicContact CB-CB 4.12Å; N1270-K1279 PolarHBondContact O-N 2.64Å; E1272-K1279 VanDerWaalsContact OE1-CE 3.26Å; E1272-K1279 WeakPolarHBondContact OE1-CE 3.21Å; E1272-K1279 IonicContact OE1-NZ 3.44Å; E1272-K1279 PolarHBondContact OE1-NZ 3.42Å
1280	S	84	Confident	81	Confident	30 Å²	30	77.8 Å²	77.8	21%	0.21	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	124.4	177.2	-52.3	0	0	0	0	108.7	E1269 N1270 G1278	E1269-S1280 PolarHBondContact N-O 3.03Å; E1269-S1280 PolarHBondContact O-N 3.46Å; N1270-S1280 PolarHBondContact ND2-OG 2.88Å; G1278-S1280 VanDerWaalsContact C-N 3.26Å; G1278-S1280 PolarHBondContact O-N 2.93Å
1281	L	89.9	Confident	81.4	Confident	0 Å²	0	72.7 Å²	72.7	0%	0	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	119.1	-177.5	-57.2	177.7	0	0	0	109.2	V1266 E1268 L1277 Y1288 D1290 L1291 I1294	V1266-L1281 HydrophobicContact CG1-CB 3.82Å; V1266-L1281 HydrophobicContact CG1-CD2 4.13Å; V1266-L1281 HydrophobicContact CG1-CG 4.44Å; E1268-L1281 HydrophobicContact CB-CD2 4.33Å; E1268-L1281 HydrophobicContact CG-CD2 3.74Å; L1277-L1281 HydrophobicContact CD1-CD2 4.24Å; L1281-Y1288 PolarHBondContact N-O 3.08Å; L1281-Y1288 PolarHBondContact O-N 3.31Å; L1281-D1290 VanDerWaalsContact CD1-C 3.49Å; L1281-L1291 HydrophobicContact CD1-CD2 3.73Å; L1281-L1291 HydrophobicContact CD1-CG 4.03Å; L1281-I1294 HydrophobicContact CB-CD1 3.9Å; L1281-I1294 HydrophobicContact CD1-CD1 3.77Å
1282	L	87.3	Confident	82	Confident	37 Å²	37	74.8 Å²	74.8	19%	0.194	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	134.2	-175.5	-66.9	96.9	0	0	0	112.4	R1267 E1269 E1286 V1287	R1267-L1282 HydrophobicContact CB-CB 4.49Å; R1267-L1282 PolarHBondContact N-O 3.36Å; R1267-L1282 PolarHBondContact O-N 3.31Å; E1269-L1282 HydrophobicContact CB-CD1 4.19Å; E1269-L1282 HydrophobicContact CG-CD1 3.83Å; L1282-E1286 WeakPolarHBondContact CA-O 3.37Å; L1282-V1287 HydrophobicContact CD2-CG2 4.11Å; L1282-V1287 HydrophobicContact CG-CG2 4.22Å
1283	I	86	Confident	82.8	Confident	3 Å²	3	70.7 Å²	70.7	2%	0.015	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	115.6	171.8	-47.4	175.8	0	0	0	109.3	I1264 V1266 D1285 E1286 Y1288 I1294 R1298	I1264-I1283 HydrophobicContact CG2-CD1 4.11Å; I1264-I1283 HydrophobicContact CG2-CG2 3.69Å; V1266-I1283 HydrophobicContact CG1-CG1 4.38Å; V1266-I1283 HydrophobicContact CG2-CD1 3.88Å; V1266-I1283 HydrophobicContact CG2-CG1 4.02Å; I1283-D1285 VanDerWaalsContact C-N 3.27Å; I1283-D1285 PolarHBondContact O-N 3.41Å; I1283-E1286 PolarHBondContact N-O 2.97Å; I1283-E1286 PolarHBondContact O-N 3.33Å; I1283-Y1288 HydrophobicContact CB-CE2 4.1Å; I1283-Y1288 HydrophobicContact CD1-CD2 4.37Å; I1283-Y1288 HydrophobicContact CD1-CE2 4.1Å; I1283-Y1288 HydrophobicContact CG1-CD2 4.32Å; I1283-Y1288 HydrophobicContact CG1-CE2 4.16Å; I1283-I1294 HydrophobicContact CD1-CB 4.45Å; I1283-I1294 HydrophobicContact CD1-CD1 4Å; I1283-I1294 HydrophobicContact CD1-CG1 4.04Å; I1283-I1294 HydrophobicContact CD1-CG2 3.54Å; I1283-R1298 PolarHBondContact O-NH1 2.76Å
1284	D	78.7	Confident	83.7	Confident	130 Å²	130	64.8 Å²	64.8	70%	0.695	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.4	42.4	179.4	-52.3	-40.6	0	0	0	114	E1286 R1298	D1284-E1286 VanDerWaalsContact C-N 3.31Å; D1284-E1286 PolarHBondContact O-N 3.32Å; D1284-R1298 IonicContact OD2-CZ 3.8Å; D1284-R1298 IonicContact OD2-NH1 3.22Å; D1284-R1298 IonicContact OD2-NH2 3.98Å; D1284-R1298 PolarHBondContact OD2-NH2 3.38Å
1285	D	79.2	Confident	84.6	Confident	157 Å²	157	61.8 Å²	61.8	84%	0.84	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.1	0.5	-177.8	-51.4	-43.3	0	0	0	116.8	I1283	I1283-D1285 VanDerWaalsContact C-N 3.27Å; I1283-D1285 PolarHBondContact O-N 3.41Å
1286	E	84.3	Confident	85.3	Confident	91 Å²	91	61.5 Å²	61.5	43%	0.425	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	133.2	167.8	-67.7	-179.3	168.2	0	0	110.9	L1282 I1283 D1284 Y1288 R1298	L1282-E1286 WeakPolarHBondContact CA-O 3.37Å; I1283-E1286 PolarHBondContact N-O 2.97Å; I1283-E1286 PolarHBondContact O-N 3.33Å; D1284-E1286 VanDerWaalsContact C-N 3.31Å; D1284-E1286 PolarHBondContact O-N 3.32Å; E1286-Y1288 HydrophobicContact CB-CD2 4.47Å; E1286-Y1288 HydrophobicContact CB-CE2 3.67Å; E1286-Y1288 PolarHBondContact OE2-OH 3.37Å; E1286-R1298 IonicContact OE2-NH1 3.82Å
1287	V	87.6	Confident	85.8	Confident	87 Å²	87	65.4 Å²	65.4	53%	0.527	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	132.6	177.3	-174.5	0	0	0	0	109.5	L1282	L1282-V1287 HydrophobicContact CD2-CG2 4.11Å; L1282-V1287 HydrophobicContact CG-CG2 4.22Å
1288	Y	87.8	Confident	86.2	Confident	3 Å²	3	64.4 Å²	64.4	1%	0.012	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	144.4	175.5	-60.5	-100.5	0	0	0	109.3	L1281 I1283 E1286 E1293 I1294 R1297 R1298	L1281-Y1288 PolarHBondContact N-O 3.08Å; L1281-Y1288 PolarHBondContact O-N 3.31Å; I1283-Y1288 HydrophobicContact CB-CE2 4.1Å; I1283-Y1288 HydrophobicContact CD1-CD2 4.37Å; I1283-Y1288 HydrophobicContact CD1-CE2 4.1Å; I1283-Y1288 HydrophobicContact CG1-CD2 4.32Å; I1283-Y1288 HydrophobicContact CG1-CE2 4.16Å; E1286-Y1288 HydrophobicContact CB-CD2 4.47Å; E1286-Y1288 HydrophobicContact CB-CE2 3.67Å; E1286-Y1288 PolarHBondContact OE2-OH 3.37Å; Y1288-E1293 WeakPolarHBondContact CA-OE2 3.22Å; Y1288-E1293 HydrophobicContact CD1-CG 4.3Å; Y1288-I1294 HydrophobicContact CD1-CB 4.2Å; Y1288-I1294 HydrophobicContact CD1-CG1 3.47Å; Y1288-I1294 VanDerWaalsContact CD1-CG1 3.47Å; Y1288-I1294 HydrophobicContact CD2-CD1 4.5Å; Y1288-I1294 HydrophobicContact CD2-CG1 3.88Å; Y1288-I1294 HydrophobicContact CE1-CG1 4.1Å; Y1288-I1294 HydrophobicContact CE2-CG1 4.5Å; Y1288-I1294 HydrophobicContact CG-CB 4.5Å; Y1288-I1294 HydrophobicContact CG-CD1 4.2Å; Y1288-I1294 HydrophobicContact CG-CG1 3.34Å; Y1288-R1297 HydrophobicContact CE1-CB 4.15Å; Y1288-R1298 WeakPolarHBondContact OH-CD 3.39Å
1289	E	84.1	Confident	86.7	Confident	160 Å²	160	64.4 Å²	64.4	75%	0.748	32%	0.315	S	S	*	.	S	Bend	trans	-80.8	-38	-178.2	-62.9	-171.6	171.5	0	0	111.8	E1293	E1289-E1293 PolarHBondContact N-OE2 2.92Å
1290	D	88.9	Confident	87.1	Confident	71 Å²	71	63.4 Å²	63.4	38%	0.38	31%	0.312	S	S	.	.	S	Bend	trans	-148	176.1	178.5	66.3	43.2	0	0	0	113.3	L1281 D1292 E1293 I1294	L1281-D1290 VanDerWaalsContact CD1-C 3.49Å; D1290-D1292 WeakPolarHBondContact OD1-CA 3.43Å; D1290-D1292 WeakPolarHBondContact OD1-CB 3.45Å; D1290-D1292 PolarHBondContact OD1-N 2.93Å; D1290-E1293 WeakPolarHBondContact OD1-CB 3.39Å; D1290-E1293 PolarHBondContact OD1-N 3.42Å; D1290-I1294 PolarHBondContact O-N 2.93Å
1291	L	87.9	Confident	87.5	Confident	3 Å²	3	63.8 Å²	63.8	2%	0.016	31%	0.314	C	S	.	.	H	α-helix	trans	-70.7	-32.3	-178.4	-65.8	172.4	0	0	0	112.2	I1212 H1214 I1239 L1250 L1277 L1281 E1293 I1294 L1295	I1212-L1291 HydrophobicContact CG2-CD1 4.21Å; H1214-L1291 HydrophobicContact CB-CD1 4.24Å; H1214-L1291 WeakPolarHBondContact NE2-CB 3.26Å; I1239-L1291 HydrophobicContact CD1-CB 4.03Å; I1239-L1291 HydrophobicContact CD1-CD1 3.98Å; I1239-L1291 HydrophobicContact CD1-CD2 4.18Å; I1239-L1291 HydrophobicContact CD1-CG 4.29Å; L1250-L1291 HydrophobicContact CD1-CD2 4.18Å; L1277-L1291 HydrophobicContact CD1-CD1 3.94Å; L1277-L1291 HydrophobicContact CD1-CD2 4.35Å; L1277-L1291 HydrophobicContact CD1-CG 4.17Å; L1277-L1291 HydrophobicContact CD2-CD1 4.09Å; L1277-L1291 HydrophobicContact CD2-CG 4.14Å; L1281-L1291 HydrophobicContact CD1-CD2 3.73Å; L1281-L1291 HydrophobicContact CD1-CG 4.03Å; L1291-E1293 VanDerWaalsContact C-N 3.34Å; L1291-I1294 HydrophobicContact CD2-CD1 4.36Å; L1291-I1294 PolarHBondContact O-N 3.44Å; L1291-L1295 WeakPolarHBondContact O-CG 3.3Å; L1291-L1295 PolarHBondContact O-N 3.46Å
1292	D	88.5	Confident	87.5	Confident	89 Å²	89	64.1 Å²	64.1	48%	0.476	32%	0.316	S	S	.	.	H	α-helix	trans	-68.9	-36.4	179.8	-75.5	-44.9	0	0	0	110.7	H1214 D1290 I1294 L1295 F1296	H1214-D1292 IonicContact CD2-OD1 3.72Å; H1214-D1292 IonicContact NE2-OD1 2.74Å; H1214-D1292 PolarHBondContact NE2-OD1 2.99Å; D1290-D1292 WeakPolarHBondContact OD1-CA 3.43Å; D1290-D1292 WeakPolarHBondContact OD1-CB 3.45Å; D1290-D1292 PolarHBondContact OD1-N 2.93Å; D1292-I1294 VanDerWaalsContact C-N 3.35Å; D1292-I1294 PolarHBondContact O-N 3.32Å; D1292-L1295 PolarHBondContact O-N 3.43Å; D1292-F1296 VanDerWaalsContact O-CB 3.32Å; D1292-F1296 WeakPolarHBondContact O-CB 3.42Å; D1292-F1296 PolarHBondContact O-N 2.95Å
1293	E	89.1	Confident	87.7	Confident	43 Å²	43	62.6 Å²	62.6	20%	0.201	31%	0.308	C	S	.	.	H	α-helix	trans	-62	-41.7	173.8	-162.3	-164.3	174.2	0	0	111.3	Y1288 E1289 D1290 L1291 F1296 R1297	Y1288-E1293 WeakPolarHBondContact CA-OE2 3.22Å; Y1288-E1293 HydrophobicContact CD1-CG 4.3Å; E1289-E1293 PolarHBondContact N-OE2 2.92Å; D1290-E1293 WeakPolarHBondContact OD1-CB 3.39Å; D1290-E1293 PolarHBondContact OD1-N 3.42Å; L1291-E1293 VanDerWaalsContact C-N 3.34Å; E1293-F1296 PolarHBondContact O-N 3.42Å; E1293-R1297 HydrophobicContact CG-CG 4.15Å; E1293-R1297 VanDerWaalsContact O-CB 3.27Å; E1293-R1297 WeakPolarHBondContact O-CB 3.3Å; E1293-R1297 PolarHBondContact O-N 2.97Å; E1293-R1297 WeakPolarHBondContact OE1-CD 3.32Å; E1293-R1297 IonicContact OE1-CZ 3.64Å; E1293-R1297 IonicContact OE1-NE 2.64Å; E1293-R1297 IonicContact OE1-NH1 2.78Å; E1293-R1297 PolarHBondContact OE1-NH1 3.37Å
1294	I	88.8	Confident	88	Confident	0 Å²	0	65.8 Å²	65.8	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-62.4	-46.3	174.4	-65.4	164.3	0	0	0	110.5	I1252 V1266 L1281 I1283 Y1288 D1290 L1291 D1292 F1296 R1298 I1299	I1252-I1294 HydrophobicContact CD1-CB 4.42Å; I1252-I1294 HydrophobicContact CD1-CG2 3.58Å; V1266-I1294 HydrophobicContact CG1-CD1 3.99Å; V1266-I1294 HydrophobicContact CG2-CD1 4.32Å; L1281-I1294 HydrophobicContact CB-CD1 3.9Å; L1281-I1294 HydrophobicContact CD1-CD1 3.77Å; I1283-I1294 HydrophobicContact CD1-CB 4.45Å; I1283-I1294 HydrophobicContact CD1-CD1 4Å; I1283-I1294 HydrophobicContact CD1-CG1 4.04Å; I1283-I1294 HydrophobicContact CD1-CG2 3.54Å; Y1288-I1294 HydrophobicContact CD1-CB 4.2Å; Y1288-I1294 HydrophobicContact CD1-CG1 3.47Å; Y1288-I1294 VanDerWaalsContact CD1-CG1 3.47Å; Y1288-I1294 HydrophobicContact CD2-CD1 4.5Å; Y1288-I1294 HydrophobicContact CD2-CG1 3.88Å; Y1288-I1294 HydrophobicContact CE1-CG1 4.1Å; Y1288-I1294 HydrophobicContact CE2-CG1 4.5Å; Y1288-I1294 HydrophobicContact CG-CB 4.5Å; Y1288-I1294 HydrophobicContact CG-CD1 4.2Å; Y1288-I1294 HydrophobicContact CG-CG1 3.34Å; D1290-I1294 PolarHBondContact O-N 2.93Å; L1291-I1294 HydrophobicContact CD2-CD1 4.36Å; L1291-I1294 PolarHBondContact O-N 3.44Å; D1292-I1294 VanDerWaalsContact C-N 3.35Å; D1292-I1294 PolarHBondContact O-N 3.32Å; I1294-F1296 VanDerWaalsContact C-N 3.32Å; I1294-F1296 PolarHBondContact O-N 3.24Å; I1294-R1298 WeakPolarHBondContact O-CA 3.25Å; I1294-R1298 VanDerWaalsContact O-CB 3.31Å; I1294-R1298 WeakPolarHBondContact O-CB 3.43Å; I1294-R1298 PolarHBondContact O-N 2.97Å; I1294-I1299 PolarHBondContact O-N 3.07Å
1295	L	88.5	Confident	88.6	Confident	11 Å²	11	60.2 Å²	60.2	6%	0.058	30%	0.302	C	S	.	.	I	π-helix	trans	-61.6	-42.8	179.2	-66.8	-176.1	0	0	0	111.1	Y1216 T1237 L1291 D1292 I1299 Q1300	Y1216-L1295 HydrophobicContact CD2-CD1 3.38Å; Y1216-L1295 HydrophobicContact CE2-CD1 3.77Å; Y1216-L1295 HydrophobicContact CG-CD1 4.17Å; T1237-L1295 HydrophobicContact CG2-CD2 3.74Å; L1291-L1295 WeakPolarHBondContact O-CG 3.3Å; L1291-L1295 PolarHBondContact O-N 3.46Å; D1292-L1295 PolarHBondContact O-N 3.43Å; L1295-I1299 HydrophobicContact CD2-CB 4.24Å; L1295-I1299 HydrophobicContact CD2-CG1 3.89Å; L1295-I1299 PolarHBondContact O-N 2.92Å; L1295-Q1300 WeakPolarHBondContact O-CB 3.44Å; L1295-Q1300 WeakPolarHBondContact O-CG 3.38Å; L1295-Q1300 PolarHBondContact O-N 3.25Å
1296	F	87.5	Confident	89.2	Confident	144 Å²	144	52.7 Å²	52.7	63%	0.632	26%	0.262	S	S	*	.	I	π-helix	trans	-77.1	-44.8	-176.9	-171.5	-97.7	0	0	0	113.7	D1292 E1293 I1294 Q1300 P1301	D1292-F1296 VanDerWaalsContact O-CB 3.32Å; D1292-F1296 WeakPolarHBondContact O-CB 3.42Å; D1292-F1296 PolarHBondContact O-N 2.95Å; E1293-F1296 PolarHBondContact O-N 3.42Å; I1294-F1296 VanDerWaalsContact C-N 3.32Å; I1294-F1296 PolarHBondContact O-N 3.24Å; F1296-Q1300 VanDerWaalsContact CD2-OE1 3.3Å; F1296-P1301 WeakPolarHBondContact O-CD 3.45Å; F1296-P1301 WeakPolarHBondContact O-CG 3.38Å
1297	R	88.2	Confident	89.6	Confident	125 Å²	125	54.4 Å²	54.4	47%	0.472	26%	0.264	S	S	.	.	I	π-helix	trans	-81	-27.5	-177.6	-71.6	179.1	64.7	-173.5	-8.1	113.4	Y1288 E1293 P1374	Y1288-R1297 HydrophobicContact CE1-CB 4.15Å; E1293-R1297 HydrophobicContact CG-CG 4.15Å; E1293-R1297 VanDerWaalsContact O-CB 3.27Å; E1293-R1297 WeakPolarHBondContact O-CB 3.3Å; E1293-R1297 PolarHBondContact O-N 2.97Å; E1293-R1297 WeakPolarHBondContact OE1-CD 3.32Å; E1293-R1297 IonicContact OE1-CZ 3.64Å; E1293-R1297 IonicContact OE1-NE 2.64Å; E1293-R1297 IonicContact OE1-NH1 2.78Å; E1293-R1297 PolarHBondContact OE1-NH1 3.37Å; R1297-P1374 WeakPolarHBondContact O-CB 3.19Å
1298	R	90.4	Very high	89.8	Confident	37 Å²	37	53 Å²	53	14%	0.14	25%	0.252	C	S	.	.	I	π-helix	trans	-116.7	-59.9	-173.3	-168.7	151.8	-173.6	169.3	-0.3	113.1	I1283 D1284 E1286 Y1288 I1294 M1302 P1374	I1283-R1298 PolarHBondContact O-NH1 2.76Å; D1284-R1298 IonicContact OD2-CZ 3.8Å; D1284-R1298 IonicContact OD2-NH1 3.22Å; D1284-R1298 IonicContact OD2-NH2 3.98Å; D1284-R1298 PolarHBondContact OD2-NH2 3.38Å; E1286-R1298 IonicContact OE2-NH1 3.82Å; Y1288-R1298 WeakPolarHBondContact OH-CD 3.39Å; I1294-R1298 WeakPolarHBondContact O-CA 3.25Å; I1294-R1298 VanDerWaalsContact O-CB 3.31Å; I1294-R1298 WeakPolarHBondContact O-CB 3.43Å; I1294-R1298 PolarHBondContact O-N 2.97Å; R1298-M1302 HydrophobicContact CG-SD 3.72Å; R1298-M1302 WeakPolarHBondContact O-CB 3.29Å; R1298-M1302 WeakPolarHBondContact O-CG 3.32Å; R1298-M1302 PolarHBondContact O-N 3.39Å; R1298-P1374 HydrophobicContact CB-CG 4.34Å; R1298-P1374 HydrophobicContact CG-CG 3.92Å
1299	I	91.3	Very high	89.9	Confident	3 Å²	3	52.8 Å²	52.8	2%	0.015	25%	0.251	C	S	.	.	I	π-helix	trans	-69.8	-49.1	-170.9	-54.9	-59.9	0	0	0	112.4	T1237 I1252 W1254 I1264 I1294 L1295 M1302 A1303	T1237-I1299 WeakPolarHBondContact OG1-CG2 3.17Å; I1252-I1299 HydrophobicContact CG2-CD1 4.22Å; I1252-I1299 HydrophobicContact CG2-CG1 4.35Å; W1254-I1299 HydrophobicContact CB-CG2 4.17Å; W1254-I1299 HydrophobicContact CD2-CG2 4.27Å; W1254-I1299 HydrophobicContact CG-CD1 4.41Å; W1254-I1299 HydrophobicContact CG-CG2 4.13Å; I1264-I1299 HydrophobicContact CD1-CD1 3.4Å; I1264-I1299 VanDerWaalsContact CD1-CD1 3.4Å; I1294-I1299 PolarHBondContact O-N 3.07Å; L1295-I1299 HydrophobicContact CD2-CB 4.24Å; L1295-I1299 HydrophobicContact CD2-CG1 3.89Å; L1295-I1299 PolarHBondContact O-N 2.92Å; I1299-M1302 PolarHBondContact O-N 2.81Å; I1299-A1303 VanDerWaalsContact O-CB 3.3Å; I1299-A1303 WeakPolarHBondContact O-CB 3.34Å; I1299-A1303 PolarHBondContact O-N 3.12Å
1300	Q	91.2	Very high	90.2	Very high	108 Å²	108	47.2 Å²	47.2	51%	0.505	23%	0.226	S	C	.	.	H	α-helix	trans	-61.7	-44.9	-178	-75.1	-179.7	-4.4	0	0	113.2	L1295 F1296 M1302 A1303 S1304	L1295-Q1300 WeakPolarHBondContact O-CB 3.44Å; L1295-Q1300 WeakPolarHBondContact O-CG 3.38Å; L1295-Q1300 PolarHBondContact O-N 3.25Å; F1296-Q1300 VanDerWaalsContact CD2-OE1 3.3Å; Q1300-M1302 VanDerWaalsContact C-N 3.35Å; Q1300-M1302 PolarHBondContact O-N 3.45Å; Q1300-A1303 PolarHBondContact O-N 2.86Å; Q1300-S1304 WeakPolarHBondContact O-CB 3.28Å; Q1300-S1304 PolarHBondContact O-N 3.37Å
1301	P	91.5	Very high	90.3	Very high	38 Å²	38	48.4 Å²	48.4	25%	0.247	24%	0.24	C	C	.	.	H	α-helix	trans	-63.2	-39	174.3	-26.1	36.2	0	0	0	112.9	F1296 S1304 S1305 P1374	F1296-P1301 WeakPolarHBondContact O-CD 3.45Å; F1296-P1301 WeakPolarHBondContact O-CG 3.38Å; P1301-S1304 PolarHBondContact O-N 2.95Å; P1301-S1305 WeakPolarHBondContact O-CB 3.42Å; P1301-S1305 PolarHBondContact O-N 3.3Å; P1301-S1305 PolarHBondContact O-OG 2.8Å; P1301-P1374 HydrophobicContact CB-CB 4.37Å; P1301-P1374 WeakPolarHBondContact CB-O 3.27Å
1302	M	90.7	Very high	90.5	Very high	7 Å²	7	49.9 Å²	49.9	3%	0.034	25%	0.246	C	C	.	.	H	α-helix	trans	-66.4	-41.3	175.1	-70.3	175.9	59.8	0	0	111.7	W1254 R1298 I1299 Q1300 S1305 A1306 I1372 P1374	W1254-M1302 HydrophobicContact CH2-CB 4.37Å; W1254-M1302 HydrophobicContact CZ2-CB 4.31Å; W1254-M1302 HydrophobicContact CZ2-CE 4Å; R1298-M1302 HydrophobicContact CG-SD 3.72Å; R1298-M1302 WeakPolarHBondContact O-CB 3.29Å; R1298-M1302 WeakPolarHBondContact O-CG 3.32Å; R1298-M1302 PolarHBondContact O-N 3.39Å; I1299-M1302 PolarHBondContact O-N 2.81Å; Q1300-M1302 VanDerWaalsContact C-N 3.35Å; Q1300-M1302 PolarHBondContact O-N 3.45Å; M1302-S1305 PolarHBondContact O-N 3.27Å; M1302-A1306 WeakPolarHBondContact O-CB 3.49Å; M1302-A1306 PolarHBondContact O-N 3.46Å; M1302-I1372 HydrophobicContact CB-CG2 3.71Å; M1302-I1372 HydrophobicContact CE-CG2 4.49Å; M1302-I1372 HydrophobicContact CG-CG2 3.89Å; M1302-I1372 WeakPolarHBondContact O-CG2 3.5Å; M1302-P1374 HydrophobicContact CG-CG 4.24Å; M1302-P1374 HydrophobicContact SD-CG 4.33Å
1303	A	91.7	Very high	90.5	Very high	5 Å²	5	53 Å²	53	4%	0.041	26%	0.255	C	S	.	.	H	α-helix	trans	-63.7	-41.9	176.4	0	0	0	0	0	111.5	Q1234 W1254 I1299 Q1300 A1306 R1307	Q1234-A1303 PolarHBondContact NE2-O 3.27Å; Q1234-A1303 VanDerWaalsContact NE2-O 3.17Å; W1254-A1303 HydrophobicContact CE3-CB 4.44Å; W1254-A1303 HydrophobicContact CZ3-CB 4.01Å; I1299-A1303 VanDerWaalsContact O-CB 3.3Å; I1299-A1303 WeakPolarHBondContact O-CB 3.34Å; I1299-A1303 PolarHBondContact O-N 3.12Å; Q1300-A1303 PolarHBondContact O-N 2.86Å; A1303-A1306 PolarHBondContact O-N 3.16Å; A1303-R1307 WeakPolarHBondContact O-CB 3.49Å; A1303-R1307 PolarHBondContact O-N 2.97Å
1304	S	92.2	Very high	90.5	Very high	70 Å²	70	53.4 Å²	53.4	49%	0.49	26%	0.255	S	S	.	.	H	α-helix	trans	-62.4	-45	174.2	-173.4	0	0	0	0	111.7	Q1300 P1301 R1307 E1308	Q1300-S1304 WeakPolarHBondContact O-CB 3.28Å; Q1300-S1304 PolarHBondContact O-N 3.37Å; P1301-S1304 PolarHBondContact O-N 2.95Å; S1304-R1307 WeakPolarHBondContact O-CB 3.33Å; S1304-R1307 PolarHBondContact O-N 3.14Å; S1304-E1308 PolarHBondContact O-N 3.37Å
1305	S	91.8	Very high	90.6	Very high	12 Å²	12	56 Å²	56	8%	0.084	27%	0.266	C	S	.	.	H	α-helix	trans	-63.6	-42.2	176.5	-60.1	0	0	0	0	111.7	P1301 M1302 R1307 E1308 L1309 F1377	P1301-S1305 WeakPolarHBondContact O-CB 3.42Å; P1301-S1305 PolarHBondContact O-N 3.3Å; P1301-S1305 PolarHBondContact O-OG 2.8Å; M1302-S1305 PolarHBondContact O-N 3.27Å; S1305-R1307 VanDerWaalsContact C-N 3.33Å; S1305-R1307 PolarHBondContact O-N 3.16Å; S1305-E1308 PolarHBondContact O-N 3.03Å; S1305-L1309 PolarHBondContact O-N 3.17Å; S1305-F1377 WeakPolarHBondContact O-CE1 3.44Å; S1305-F1377 WeakPolarHBondContact O-CZ 3.16Å
1306	A	91.5	Very high	90.5	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-59.1	-45.5	173.3	0	0	0	0	0	111.2	W1254 M1302 A1303 E1308 L1309 L1310 F1355 I1372	W1254-A1306 HydrophobicContact CH2-CB 4.25Å; M1302-A1306 WeakPolarHBondContact O-CB 3.49Å; M1302-A1306 PolarHBondContact O-N 3.46Å; A1303-A1306 PolarHBondContact O-N 3.16Å; A1306-E1308 VanDerWaalsContact C-N 3.34Å; A1306-E1308 PolarHBondContact O-N 3.22Å; A1306-L1309 PolarHBondContact O-N 3.35Å; A1306-L1309 VanDerWaalsContact O-N 3.15Å; A1306-L1310 VanDerWaalsContact O-CG 3.26Å; A1306-L1310 WeakPolarHBondContact O-CG 3.35Å; A1306-L1310 PolarHBondContact O-N 3.36Å; A1306-F1355 HydrophobicContact CB-CE2 4.28Å; A1306-F1355 HydrophobicContact CB-CZ 4.34Å; A1306-I1372 HydrophobicContact CB-CD1 3.65Å
1307	R	92.1	Very high	90.2	Very high	126 Å²	126	59.8 Å²	59.8	48%	0.475	28%	0.281	S	S	.	.	H	α-helix	trans	-62.7	-38.9	179.2	-162.7	178.3	-59.9	148.9	-2.7	112.5	Q1234 A1303 S1304 S1305 L1309 L1310 S1311	Q1234-R1307 PolarHBondContact O-NH2 2.9Å; A1303-R1307 WeakPolarHBondContact O-CB 3.49Å; A1303-R1307 PolarHBondContact O-N 2.97Å; S1304-R1307 WeakPolarHBondContact O-CB 3.33Å; S1304-R1307 PolarHBondContact O-N 3.14Å; S1305-R1307 VanDerWaalsContact C-N 3.33Å; S1305-R1307 PolarHBondContact O-N 3.16Å; R1307-L1309 VanDerWaalsContact C-N 3.32Å; R1307-L1309 PolarHBondContact O-N 3.43Å; R1307-L1310 PolarHBondContact O-N 3.16Å; R1307-S1311 WeakPolarHBondContact O-CB 3.39Å; R1307-S1311 PolarHBondContact O-N 3.37Å; R1307-S1311 PolarHBondContact O-OG 2.83Å
1308	E	92.4	Very high	89.8	Confident	57 Å²	57	53.8 Å²	53.8	27%	0.266	26%	0.259	S	S	.	.	H	α-helix	trans	-61.6	-40.7	174.5	-168.1	-171.2	163.2	0	0	111.3	S1304 S1305 A1306 S1311 Y1312 F1377 N1386 V1387	S1304-E1308 PolarHBondContact O-N 3.37Å; S1305-E1308 PolarHBondContact O-N 3.03Å; A1306-E1308 VanDerWaalsContact C-N 3.34Å; A1306-E1308 PolarHBondContact O-N 3.22Å; E1308-S1311 PolarHBondContact O-OG 2.86Å; E1308-Y1312 WeakPolarHBondContact O-CB 3.24Å; E1308-Y1312 PolarHBondContact O-N 2.86Å; E1308-F1377 HydrophobicContact CB-CZ 4.18Å; E1308-F1377 WeakPolarHBondContact OE2-CE2 3.39Å; E1308-N1386 WeakPolarHBondContact OE1-CB 3.3Å; E1308-V1387 HydrophobicContact CB-CG2 4.3Å; E1308-V1387 HydrophobicContact CG-CB 4.39Å; E1308-V1387 HydrophobicContact CG-CG2 3.75Å; E1308-V1387 WeakPolarHBondContact OE1-CB 3.33Å; E1308-V1387 WeakPolarHBondContact OE1-CG2 3.38Å; E1308-V1387 PolarHBondContact OE1-N 2.68Å
1309	L	90.1	Very high	89.4	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-70.2	-41.7	175	-84.8	174	0	0	0	113	S1305 A1306 R1307 S1311 Y1312 Y1315 F1345 F1355 I1370 F1377 V1387	S1305-L1309 PolarHBondContact O-N 3.17Å; A1306-L1309 PolarHBondContact O-N 3.35Å; A1306-L1309 VanDerWaalsContact O-N 3.15Å; R1307-L1309 VanDerWaalsContact C-N 3.32Å; R1307-L1309 PolarHBondContact O-N 3.43Å; L1309-S1311 VanDerWaalsContact C-N 3.34Å; L1309-Y1312 WeakPolarHBondContact O-CB 3.39Å; L1309-Y1312 PolarHBondContact O-N 3.26Å; L1309-Y1315 WeakPolarHBondContact O-CB 3.41Å; L1309-F1345 HydrophobicContact CD2-CD1 3.75Å; L1309-F1345 HydrophobicContact CD2-CD2 4.38Å; L1309-F1345 HydrophobicContact CD2-CE1 3.9Å; L1309-F1345 HydrophobicContact CD2-CG 3.98Å; L1309-F1345 HydrophobicContact CD2-CZ 4.28Å; L1309-F1355 HydrophobicContact CB-CD1 3.93Å; L1309-F1355 HydrophobicContact CB-CE1 3.89Å; L1309-F1355 HydrophobicContact CB-CG 4.42Å; L1309-F1355 HydrophobicContact CB-CZ 4.39Å; L1309-F1355 HydrophobicContact CD1-CB 3.77Å; L1309-F1355 HydrophobicContact CD1-CD1 3.94Å; L1309-F1355 HydrophobicContact CD1-CD2 3.93Å; L1309-F1355 HydrophobicContact CD1-CG 3.6Å; L1309-I1370 HydrophobicContact CD1-CG2 4.43Å; L1309-F1377 HydrophobicContact CB-CE1 4.48Å; L1309-F1377 HydrophobicContact CD1-CD1 3.65Å; L1309-F1377 HydrophobicContact CD1-CE1 3.37Å; L1309-F1377 HydrophobicContact CD1-CZ 4.44Å; L1309-F1377 HydrophobicContact CD2-CE1 4.48Å; L1309-F1377 HydrophobicContact CG-CD1 4.11Å; L1309-F1377 HydrophobicContact CG-CE1 3.47Å; L1309-F1377 VanDerWaalsContact CG-CE1 3.47Å; L1309-F1377 HydrophobicContact CG-CZ 4.09Å; L1309-V1387 HydrophobicContact CD2-CG1 4.14Å; L1309-V1387 HydrophobicContact CD2-CG2 3.69Å; L1309-V1387 HydrophobicContact CG-CG2 3.86Å
1310	L	90.7	Very high	88.8	Confident	42 Å²	42	59.2 Å²	59.2	22%	0.22	30%	0.295	C	S	.	.	H	α-helix	trans	-64.7	-38.1	179.5	-70.8	170.4	0	0	0	112.1	Q1234 A1257 A1306 R1307 Y1312 Y1315 F1355	Q1234-L1310 HydrophobicContact CG-CD1 3.67Å; A1257-L1310 HydrophobicContact CB-CD1 4.37Å; A1257-L1310 HydrophobicContact CB-CD2 4.05Å; A1306-L1310 VanDerWaalsContact O-CG 3.26Å; A1306-L1310 WeakPolarHBondContact O-CG 3.35Å; A1306-L1310 PolarHBondContact O-N 3.36Å; R1307-L1310 PolarHBondContact O-N 3.16Å; L1310-Y1312 VanDerWaalsContact C-N 3.32Å; L1310-Y1315 HydrophobicContact CD2-CD2 4.34Å; L1310-Y1315 HydrophobicContact CD2-CE1 3.89Å; L1310-Y1315 HydrophobicContact CD2-CE2 3.6Å; L1310-Y1315 VanDerWaalsContact CD2-OH 3.31Å; L1310-Y1315 WeakPolarHBondContact CD2-OH 3.39Å; L1310-Y1315 WeakPolarHBondContact O-CD1 3.46Å; L1310-F1355 HydrophobicContact CD2-CE1 3.78Å; L1310-F1355 HydrophobicContact CD2-CZ 3.97Å; L1310-F1355 HydrophobicContact CG-CE1 4.02Å; L1310-F1355 HydrophobicContact CG-CZ 3.96Å
1311	S	90.4	Very high	88.2	Confident	96 Å²	96	54.5 Å²	54.5	67%	0.671	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-4.2	177.6	60.8	0	0	0	0	113.7	R1307 E1308 L1309	R1307-S1311 WeakPolarHBondContact O-CB 3.39Å; R1307-S1311 PolarHBondContact O-N 3.37Å; R1307-S1311 PolarHBondContact O-OG 2.83Å; E1308-S1311 PolarHBondContact O-OG 2.86Å; L1309-S1311 VanDerWaalsContact C-N 3.34Å
1312	Y	92.2	Very high	87.9	Confident	35 Å²	35	56 Å²	56	14%	0.137	28%	0.281	C	S	.	.	S	Bend	trans	-69.1	139.7	-178.4	-156.1	-101	0	0	0	111.4	E1308 L1309 L1310 Y1314 Y1315 F1345 V1387 N1388 L1391	E1308-Y1312 WeakPolarHBondContact O-CB 3.24Å; E1308-Y1312 PolarHBondContact O-N 2.86Å; L1309-Y1312 WeakPolarHBondContact O-CB 3.39Å; L1309-Y1312 PolarHBondContact O-N 3.26Å; L1310-Y1312 VanDerWaalsContact C-N 3.32Å; Y1312-Y1314 HydrophobicContact CD1-CD2 4.28Å; Y1312-Y1314 AromaticContact CE1-CD2 3.79Å; Y1312-Y1314 HydrophobicContact CE1-CD2 3.79Å; Y1312-Y1314 PolarHBondContact O-N 3.47Å; Y1312-Y1315 WeakPolarHBondContact O-CB 3.4Å; Y1312-Y1315 PolarHBondContact O-N 3Å; Y1312-F1345 HydrophobicContact CD1-CD2 4.09Å; Y1312-F1345 AromaticContact CD1-CE2 3.7Å; Y1312-F1345 HydrophobicContact CD1-CE2 3.7Å; Y1312-F1345 HydrophobicContact CE1-CE2 4.1Å; Y1312-F1345 HydrophobicContact CG-CE2 4.48Å; Y1312-V1387 HydrophobicContact CD1-CG1 4.23Å; Y1312-V1387 HydrophobicContact CD2-CB 4.06Å; Y1312-V1387 HydrophobicContact CD2-CG1 3.59Å; Y1312-V1387 HydrophobicContact CE1-CG1 4.27Å; Y1312-V1387 HydrophobicContact CE2-CB 4.14Å; Y1312-V1387 HydrophobicContact CE2-CG1 3.64Å; Y1312-V1387 HydrophobicContact CG-CG1 3.91Å; Y1312-N1388 PolarHBondContact OH-OD1 3.3Å; Y1312-L1391 HydrophobicContact CD1-CD1 4.26Å; Y1312-L1391 HydrophobicContact CE1-CD1 3.3Å; Y1312-L1391 HydrophobicContact CE2-CD1 4.28Å; Y1312-L1391 WeakPolarHBondContact OH-CD1 3.41Å
1313	K	88.3	Confident	87.7	Confident	154 Å²	154	60.7 Å²	60.7	67%	0.67	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-17.4	-175.7	70.5	-175.8	179.1	-173.4	0	116.6
1314	Y	88.5	Confident	87.5	Confident	52 Å²	52	65.2 Å²	65.2	20%	0.204	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.1	10.3	177.2	-61.7	-55.9	0	0	0	112.8	Y1312 Y1343 S1344 F1345	Y1312-Y1314 HydrophobicContact CD1-CD2 4.28Å; Y1312-Y1314 AromaticContact CE1-CD2 3.79Å; Y1312-Y1314 HydrophobicContact CE1-CD2 3.79Å; Y1312-Y1314 PolarHBondContact O-N 3.47Å; Y1314-Y1343 HydrophobicContact CD2-CD2 4.28Å; Y1314-Y1343 HydrophobicContact CD2-CE1 4.41Å; Y1314-Y1343 AromaticContact CD2-CE2 3.4Å; Y1314-Y1343 HydrophobicContact CD2-CE2 3.4Å; Y1314-Y1343 AromaticContact CD2-CZ 3.48Å; Y1314-Y1343 VanDerWaalsContact CD2-CZ 3.48Å; Y1314-Y1343 WeakPolarHBondContact CD2-OH 3.25Å; Y1314-Y1343 HydrophobicContact CE2-CE1 4.27Å; Y1314-Y1343 AromaticContact CE2-CE2 3.98Å; Y1314-Y1343 HydrophobicContact CE2-CE2 3.98Å; Y1314-Y1343 AromaticContact CE2-CZ 3.53Å; Y1314-Y1343 WeakPolarHBondContact CE2-OH 3.4Å; Y1314-Y1343 HydrophobicContact CG-CE2 4.08Å; Y1314-S1344 CarbonylContact O-C 3.52Å; Y1314-S1344 VanDerWaalsContact O-CA 3.23Å; Y1314-S1344 WeakPolarHBondContact O-CA 3.42Å; Y1314-S1344 WeakPolarHBondContact O-CB 3.36Å; Y1314-F1345 PolarHBondContact O-N 3.13Å
1315	Y	90.7	Very high	87.2	Confident	55 Å²	55	64.7 Å²	64.7	22%	0.216	32%	0.319	C	S	.	.	B	Isolated β-bridge	trans	-66.1	138.2	167.2	-175.4	-101.6	0	0	0	110.3	L1309 L1310 Y1312 E1317 F1345 A1347 F1355	L1309-Y1315 WeakPolarHBondContact O-CB 3.41Å; L1310-Y1315 HydrophobicContact CD2-CD2 4.34Å; L1310-Y1315 HydrophobicContact CD2-CE1 3.89Å; L1310-Y1315 HydrophobicContact CD2-CE2 3.6Å; L1310-Y1315 VanDerWaalsContact CD2-OH 3.31Å; L1310-Y1315 WeakPolarHBondContact CD2-OH 3.39Å; L1310-Y1315 WeakPolarHBondContact O-CD1 3.46Å; Y1312-Y1315 WeakPolarHBondContact O-CB 3.4Å; Y1312-Y1315 PolarHBondContact O-N 3Å; Y1315-E1317 HydrophobicContact CE1-CB 4.49Å; Y1315-F1345 CarbonylContact C-O 3.58Å; Y1315-F1345 WeakPolarHBondContact CA-O 3.38Å; Y1315-F1345 HydrophobicContact CD2-CB 4.19Å; Y1315-A1347 HydrophobicContact CE2-CB 4.46Å; Y1315-F1355 HydrophobicContact CD2-CE1 4.34Å; Y1315-F1355 HydrophobicContact CE2-CD1 4.13Å; Y1315-F1355 AromaticContact CE2-CE1 3.77Å; Y1315-F1355 HydrophobicContact CE2-CE1 3.77Å
1316	R	86.4	Confident	87	Confident	79 Å²	79	64.1 Å²	64.1	30%	0.298	32%	0.315	S	S	.	.			trans	-132.8	129.1	173.3	-70	-168.1	178.9	159.4	7.3	108.8	A1318 L1326 A1329 E1333 F1345 S1346	R1316-A1318 PolarHBondContact O-N 3.48Å; R1316-L1326 HydrophobicContact CB-CD2 4.32Å; R1316-A1329 PolarHBondContact NH1-O 3.34Å; R1316-E1333 IonicContact CZ-OE2 3.67Å; R1316-E1333 IonicContact NH2-OE2 3.19Å; R1316-E1333 PolarHBondContact NH2-OE2 3.37Å; R1316-F1345 PolarHBondContact N-O 2.96Å; R1316-S1346 WeakPolarHBondContact O-CB 3.44Å; R1316-S1346 PolarHBondContact O-OG 3.39Å
1317	E	81.9	Confident	86.9	Confident	154 Å²	154	67.8 Å²	67.8	72%	0.72	33%	0.332	S	S	*	.			trans	-74	107.3	168.6	-166.1	174.2	-172.8	0	0	108.6	Y1315	Y1315-E1317 HydrophobicContact CE1-CB 4.49Å
1318	A	80.1	Confident	86.6	Confident	0 Å²	0	68.3 Å²	68.3	0%	0	34%	0.338	C	S	.	.			trans	-120.2	53.1	-175.5	0	0	0	0	0	110.3	R1316 G1320 G1321 D1322 V1325 L1326 S1346	R1316-A1318 PolarHBondContact O-N 3.48Å; A1318-G1320 PolarHBondContact O-N 3.46Å; A1318-G1320 VanDerWaalsContact O-N 3.08Å; A1318-G1321 PolarHBondContact O-N 2.84Å; A1318-D1322 WeakPolarHBondContact O-CB 3.49Å; A1318-D1322 PolarHBondContact O-N 3.49Å; A1318-V1325 HydrophobicContact CB-CB 4.11Å; A1318-V1325 HydrophobicContact CB-CG1 3.95Å; A1318-L1326 HydrophobicContact CB-CD1 4.23Å; A1318-L1326 HydrophobicContact CB-CD2 3.78Å; A1318-L1326 HydrophobicContact CB-CG 3.7Å; A1318-S1346 WeakPolarHBondContact CB-OG 3.44Å; A1318-S1346 PolarHBondContact N-OG 3.12Å
1319	N	80.9	Confident	86.3	Confident	135 Å²	135	66.7 Å²	66.7	72%	0.722	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.9	41.6	-179.9	-64.8	-17.1	0	0	0	113.8
1320	G	78.9	Confident	86.3	Confident	19 Å²	19	66.7 Å²	66.7	20%	0.196	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	81.3	34	-175.3	0	0	0	0	0	115	A1318 A1347 S1348 K1349	A1318-G1320 PolarHBondContact O-N 3.46Å; A1318-G1320 VanDerWaalsContact O-N 3.08Å; G1320-A1347 CarbonylContact C-O 3.59Å; G1320-A1347 WeakPolarHBondContact CA-O 3.4Å; G1320-S1348 WeakPolarHBondContact O-CA 3.39Å; G1320-K1349 PolarHBondContact O-N 3.46Å
1321	G	79.7	Confident	86.1	Confident	8 Å²	8	68.6 Å²	68.6	8%	0.082	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	84	28.3	173.1	0	0	0	0	0	113.8	A1318 R1323 A1347	A1318-G1321 PolarHBondContact O-N 2.84Å; G1321-R1323 PolarHBondContact O-N 3.21Å; G1321-R1323 VanDerWaalsContact O-N 3.16Å; G1321-A1347 WeakPolarHBondContact CA-O 3.49Å; G1321-A1347 PolarHBondContact N-O 3.13Å
1322	D	84.8	Confident	85.9	Confident	69 Å²	69	68.5 Å²	68.5	37%	0.369	33%	0.333	S	S	.	.			trans	-55.4	117.4	172.5	-174	-12.1	0	0	0	110.1	A1318 V1324 V1325 L1326	A1318-D1322 WeakPolarHBondContact O-CB 3.49Å; A1318-D1322 PolarHBondContact O-N 3.49Å; D1322-V1324 PolarHBondContact O-N 3.01Å; D1322-V1324 WeakPolarHBondContact OD1-CB 3.3Å; D1322-V1324 PolarHBondContact OD1-N 2.97Å; D1322-V1325 HydrophobicContact CB-CB 4.37Å; D1322-V1325 HydrophobicContact CB-CG2 4.02Å; D1322-V1325 PolarHBondContact O-N 2.87Å; D1322-L1326 WeakPolarHBondContact O-CG 2.88Å; D1322-L1326 PolarHBondContact O-N 2.7Å
1323	R	86.4	Confident	85.6	Confident	107 Å²	107	68.6 Å²	68.6	40%	0.404	34%	0.335	S	S	.	.	H	α-helix	trans	-61.5	-36.7	-176.6	-58.3	-179.1	-167.3	171	9.6	110.5	G1321 V1325 L1326 E1327 E1350 I1356 Y1369	G1321-R1323 PolarHBondContact O-N 3.21Å; G1321-R1323 VanDerWaalsContact O-N 3.16Å; R1323-V1325 PolarHBondContact O-N 3.46Å; R1323-L1326 PolarHBondContact O-N 2.74Å; R1323-E1327 WeakPolarHBondContact O-CB 3.46Å; R1323-E1327 VanDerWaalsContact O-CG 3.26Å; R1323-E1327 WeakPolarHBondContact O-CG 3.41Å; R1323-E1327 PolarHBondContact O-N 3.32Å; R1323-E1350 IonicContact NH2-OE1 3.39Å; R1323-E1350 IonicContact NH2-OE2 2.82Å; R1323-E1350 PolarHBondContact NH2-OE2 3.12Å; R1323-E1350 VanDerWaalsContact NH2-OE2 3.07Å; R1323-I1356 HydrophobicContact CG-CD1 4.05Å; R1323-Y1369 PolarHBondContact NH2-OH 3.34Å
1324	V	86.6	Confident	85.5	Confident	99 Å²	99	63.1 Å²	63.1	60%	0.6	31%	0.311	S	S	*	.	H	α-helix	trans	-65.6	-43.3	-177.5	-177.7	0	0	0	0	111.2	D1322 L1326 E1327 K1328	D1322-V1324 PolarHBondContact O-N 3.01Å; D1322-V1324 WeakPolarHBondContact OD1-CB 3.3Å; D1322-V1324 PolarHBondContact OD1-N 2.97Å; V1324-L1326 VanDerWaalsContact C-N 3.34Å; V1324-L1326 PolarHBondContact O-N 3.27Å; V1324-E1327 PolarHBondContact O-N 3.12Å; V1324-K1328 WeakPolarHBondContact O-CB 3.27Å; V1324-K1328 PolarHBondContact O-N 3.35Å
1325	V	87	Confident	85.4	Confident	59 Å²	59	69.1 Å²	69.1	36%	0.358	34%	0.338	S	S	.	.	H	α-helix	trans	-63.5	-43.2	177.9	178	0	0	0	0	110.4	A1318 D1322 R1323 A1329	A1318-V1325 HydrophobicContact CB-CB 4.11Å; A1318-V1325 HydrophobicContact CB-CG1 3.95Å; D1322-V1325 HydrophobicContact CB-CB 4.37Å; D1322-V1325 HydrophobicContact CB-CG2 4.02Å; D1322-V1325 PolarHBondContact O-N 2.87Å; R1323-V1325 PolarHBondContact O-N 3.46Å; V1325-A1329 VanDerWaalsContact O-CB 3.3Å; V1325-A1329 WeakPolarHBondContact O-CB 3.33Å; V1325-A1329 PolarHBondContact O-N 3.49Å; V1325-A1329 VanDerWaalsContact O-N 3.13Å
1326	L	86.9	Confident	85.2	Confident	1 Å²	1	75 Å²	75	1%	0.005	37%	0.365	C	S	.	.	H	α-helix	trans	-67.2	-44	178.6	-67.1	166.9	0	0	0	112.1	R1316 A1318 D1322 R1323 V1324 A1329 L1330 I1356 S1358	R1316-L1326 HydrophobicContact CB-CD2 4.32Å; A1318-L1326 HydrophobicContact CB-CD1 4.23Å; A1318-L1326 HydrophobicContact CB-CD2 3.78Å; A1318-L1326 HydrophobicContact CB-CG 3.7Å; D1322-L1326 WeakPolarHBondContact O-CG 2.88Å; D1322-L1326 PolarHBondContact O-N 2.7Å; R1323-L1326 PolarHBondContact O-N 2.74Å; V1324-L1326 VanDerWaalsContact C-N 3.34Å; V1324-L1326 PolarHBondContact O-N 3.27Å; L1326-A1329 PolarHBondContact O-N 3.27Å; L1326-L1330 WeakPolarHBondContact O-CB 3.09Å; L1326-L1330 VanDerWaalsContact O-CG 3.26Å; L1326-L1330 WeakPolarHBondContact O-CG 3.42Å; L1326-L1330 PolarHBondContact O-N 2.72Å; L1326-I1356 HydrophobicContact CD1-CD1 4.28Å; L1326-I1356 HydrophobicContact CD1-CG2 3.51Å; L1326-S1358 WeakPolarHBondContact CD1-OG 3.23Å
1327	E	89.1	Confident	85	Confident	77 Å²	77	73.8 Å²	73.8	36%	0.36	37%	0.368	S	S	.	.	H	α-helix	trans	-59.5	-49.3	177.7	-76.3	-174.2	172.1	0	0	111.8	R1323 V1324 A1329 L1330 L1331 V1365 H1367	R1323-E1327 WeakPolarHBondContact O-CB 3.46Å; R1323-E1327 VanDerWaalsContact O-CG 3.26Å; R1323-E1327 WeakPolarHBondContact O-CG 3.41Å; R1323-E1327 PolarHBondContact O-N 3.32Å; V1324-E1327 PolarHBondContact O-N 3.12Å; E1327-A1329 VanDerWaalsContact C-N 3.31Å; E1327-A1329 PolarHBondContact O-N 2.91Å; E1327-L1330 PolarHBondContact O-N 3.46Å; E1327-L1331 WeakPolarHBondContact O-CG 3.28Å; E1327-L1331 PolarHBondContact O-N 2.9Å; E1327-V1365 HydrophobicContact CB-CG2 4.26Å; E1327-V1365 HydrophobicContact CG-CB 3.86Å; E1327-V1365 HydrophobicContact CG-CG1 3.9Å; E1327-V1365 HydrophobicContact CG-CG2 4.02Å; E1327-H1367 WeakPolarHBondContact CG-NE2 3.41Å; E1327-H1367 IonicContact OE1-NE2 2.75Å; E1327-H1367 PolarHBondContact OE1-NE2 2.68Å
1328	K	87.5	Confident	84.7	Confident	137 Å²	137	71 Å²	71	60%	0.596	37%	0.366	S	S	*	.	H	α-helix	trans	-57.6	-46.4	177.9	-174.6	179.8	177.4	-176	0	111.1	V1324 L1330 L1331 E1332	V1324-K1328 WeakPolarHBondContact O-CB 3.27Å; V1324-K1328 PolarHBondContact O-N 3.35Å; K1328-L1330 VanDerWaalsContact C-N 3.34Å; K1328-L1330 PolarHBondContact O-N 2.93Å; K1328-L1331 PolarHBondContact O-N 3.16Å; K1328-E1332 WeakPolarHBondContact CE-OE1 3.25Å; K1328-E1332 WeakPolarHBondContact O-CG 3.44Å; K1328-E1332 PolarHBondContact O-N 3.43Å; K1328-E1332 VanDerWaalsContact O-N 3.08Å
1329	A	86	Confident	84.8	Confident	23 Å²	23	75.7 Å²	75.7	19%	0.19	40%	0.404	C	S	.	.	H	α-helix	trans	-72	-27.3	-176	0	0	0	0	0	112.9	R1316 V1325 L1326 E1327 E1333	R1316-A1329 PolarHBondContact NH1-O 3.34Å; V1325-A1329 VanDerWaalsContact O-CB 3.3Å; V1325-A1329 WeakPolarHBondContact O-CB 3.33Å; V1325-A1329 PolarHBondContact O-N 3.49Å; V1325-A1329 VanDerWaalsContact O-N 3.13Å; L1326-A1329 PolarHBondContact O-N 3.27Å; E1327-A1329 VanDerWaalsContact C-N 3.31Å; E1327-A1329 PolarHBondContact O-N 2.91Å; A1329-E1333 PolarHBondContact O-N 2.93Å
1330	L	88.4	Confident	84.9	Confident	0 Å²	0	72.9 Å²	72.9	0%	0	39%	0.386	C	S	.	.	H	α-helix	trans	-76.2	-38.1	172.8	-71.4	171.7	0	0	0	112.2	L1326 E1327 K1328 E1332 E1333 K1334 P1342 L1360 V1365	L1326-L1330 WeakPolarHBondContact O-CB 3.09Å; L1326-L1330 VanDerWaalsContact O-CG 3.26Å; L1326-L1330 WeakPolarHBondContact O-CG 3.42Å; L1326-L1330 PolarHBondContact O-N 2.72Å; E1327-L1330 PolarHBondContact O-N 3.46Å; K1328-L1330 VanDerWaalsContact C-N 3.34Å; K1328-L1330 PolarHBondContact O-N 2.93Å; L1330-E1332 VanDerWaalsContact C-N 3.35Å; L1330-E1333 PolarHBondContact O-N 3.21Å; L1330-K1334 WeakPolarHBondContact O-CB 3.24Å; L1330-K1334 PolarHBondContact O-N 3.27Å; L1330-P1342 HydrophobicContact CD2-CB 3.86Å; L1330-P1342 HydrophobicContact CD2-CG 4.3Å; L1330-P1342 WeakPolarHBondContact O-CG 3.47Å; L1330-L1360 HydrophobicContact CB-CB 4.35Å; L1330-V1365 HydrophobicContact CB-CG2 4.49Å; L1330-V1365 HydrophobicContact CD1-CG1 3.62Å
1331	L	87.2	Confident	85.2	Confident	81 Å²	81	74.2 Å²	74.2	42%	0.424	39%	0.388	S	S	.	.	H	α-helix	trans	-62	-41.6	174.3	-78.2	163.1	0	0	0	111.7	E1327 K1328 K1334 K1335 L1360	E1327-L1331 WeakPolarHBondContact O-CG 3.28Å; E1327-L1331 PolarHBondContact O-N 2.9Å; K1328-L1331 PolarHBondContact O-N 3.16Å; L1331-K1334 PolarHBondContact O-N 3.43Å; L1331-K1335 WeakPolarHBondContact O-CG 3.34Å; L1331-K1335 PolarHBondContact O-N 3.13Å; L1331-L1360 HydrophobicContact CD2-CD2 3.87Å; L1331-L1360 HydrophobicContact CG-CD2 4.22Å
1332	E	87	Confident	85.7	Confident	95 Å²	95	73.9 Å²	73.9	44%	0.444	38%	0.384	S	S	.	.	H	α-helix	trans	-64.2	-40.4	175.3	-73.3	176.2	-169.5	0	0	112.6	K1328 L1330 K1334 K1335 K1336	K1328-E1332 WeakPolarHBondContact CE-OE1 3.25Å; K1328-E1332 WeakPolarHBondContact O-CG 3.44Å; K1328-E1332 PolarHBondContact O-N 3.43Å; K1328-E1332 VanDerWaalsContact O-N 3.08Å; L1330-E1332 VanDerWaalsContact C-N 3.35Å; E1332-K1334 VanDerWaalsContact C-N 3.35Å; E1332-K1335 PolarHBondContact O-N 2.91Å; E1332-K1336 PolarHBondContact O-N 3.49Å
1333	E	86.1	Confident	86	Confident	36 Å²	36	71.3 Å²	71.3	17%	0.168	37%	0.369	C	S	.	.	H	α-helix	trans	-69	-34.8	177.1	-160.6	177.7	161.1	0	0	111.8	R1316 A1329 L1330 K1336 S1337 K1340 P1342	R1316-E1333 IonicContact CZ-OE2 3.67Å; R1316-E1333 IonicContact NH2-OE2 3.19Å; R1316-E1333 PolarHBondContact NH2-OE2 3.37Å; A1329-E1333 PolarHBondContact O-N 2.93Å; L1330-E1333 PolarHBondContact O-N 3.21Å; E1333-K1336 PolarHBondContact O-N 2.92Å; E1333-S1337 PolarHBondContact O-N 3Å; E1333-K1340 IonicContact OE1-NZ 3.54Å; E1333-K1340 PolarHBondContact OE1-NZ 3.39Å; E1333-P1342 HydrophobicContact CB-CB 3.82Å; E1333-P1342 HydrophobicContact CB-CG 4.39Å; E1333-P1342 HydrophobicContact CG-CB 3.92Å
1334	K	86.3	Confident	86.2	Confident	39 Å²	39	66.2 Å²	66.2	17%	0.17	35%	0.35	C	S	.	.	H	α-helix	trans	-66	-36.2	173.7	-167.9	71.1	-179.4	-178.5	0	112.4	L1330 L1331 E1332 K1336 S1337 S1338 K1340 P1342 L1360 P1361	L1330-K1334 WeakPolarHBondContact O-CB 3.24Å; L1330-K1334 PolarHBondContact O-N 3.27Å; L1331-K1334 PolarHBondContact O-N 3.43Å; E1332-K1334 VanDerWaalsContact C-N 3.35Å; K1334-K1336 VanDerWaalsContact C-N 3.32Å; K1334-S1337 CarbonylContact O-C 3.24Å; K1334-S1337 VanDerWaalsContact O-C 3.25Å; K1334-S1337 PolarHBondContact O-N 3.23Å; K1334-S1338 WeakPolarHBondContact CE-O 3.46Å; K1334-S1338 PolarHBondContact NZ-O 3.14Å; K1334-S1338 VanDerWaalsContact O-CA 3.31Å; K1334-S1338 WeakPolarHBondContact O-CA 3.29Å; K1334-S1338 PolarHBondContact O-N 3.25Å; K1334-K1340 WeakPolarHBondContact CD-O 3.29Å; K1334-K1340 PolarHBondContact NZ-O 2.9Å; K1334-P1342 HydrophobicContact CB-CG 4.07Å; K1334-P1342 HydrophobicContact CD-CG 4.25Å; K1334-L1360 HydrophobicContact CB-CD2 3.79Å; K1334-L1360 HydrophobicContact CG-CD2 4.02Å; K1334-P1361 PolarHBondContact NZ-O 3.31Å
1335	K	85.5	Confident	86.5	Confident	178 Å²	178	61.5 Å²	61.5	77%	0.774	32%	0.322	S	S	*	.	H	α-helix	trans	-63.8	-37.1	173.3	-73.5	177.2	-177.7	-178.7	0	112	L1331 E1332	L1331-K1335 WeakPolarHBondContact O-CG 3.34Å; L1331-K1335 PolarHBondContact O-N 3.13Å; E1332-K1335 PolarHBondContact O-N 2.91Å
1336	K	86.8	Confident	86.7	Confident	180 Å²	180	58.8 Å²	58.8	78%	0.783	31%	0.305	S	S	*	.	H	α-helix	trans	-73.8	-34.3	178	-68.1	175.9	-178.1	177.4	0	113	E1332 E1333 K1334	E1332-K1336 PolarHBondContact O-N 3.49Å; E1333-K1336 PolarHBondContact O-N 2.92Å; K1334-K1336 VanDerWaalsContact C-N 3.32Å
1337	S	81.3	Confident	86.9	Confident	52 Å²	52	58.8 Å²	58.8	36%	0.364	31%	0.305	S	S	.	.			trans	-141	87.6	178.8	-169.7	0	0	0	0	110.7	E1333 K1334 A1339 K1340	E1333-S1337 PolarHBondContact O-N 3Å; K1334-S1337 CarbonylContact O-C 3.24Å; K1334-S1337 VanDerWaalsContact O-C 3.25Å; K1334-S1337 PolarHBondContact O-N 3.23Å; S1337-A1339 VanDerWaalsContact C-N 3.29Å; S1337-A1339 PolarHBondContact O-N 3.35Å; S1337-K1340 PolarHBondContact O-N 3.35Å; S1337-K1340 WeakPolarHBondContact OG-CB 3.47Å
1338	S	76.9	Confident	87	Confident	96 Å²	96	55.2 Å²	55.2	67%	0.671	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-32.6	-175.5	58	0	0	0	0	113.3	K1334	K1334-S1338 WeakPolarHBondContact CE-O 3.46Å; K1334-S1338 PolarHBondContact NZ-O 3.14Å; K1334-S1338 VanDerWaalsContact O-CA 3.31Å; K1334-S1338 WeakPolarHBondContact O-CA 3.29Å; K1334-S1338 PolarHBondContact O-N 3.25Å
1339	A	80.6	Confident	87	Confident	98 Å²	98	55.5 Å²	55.5	81%	0.81	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-27.3	178.2	0	0	0	0	0	113.3	S1337	S1337-A1339 VanDerWaalsContact C-N 3.29Å; S1337-A1339 PolarHBondContact O-N 3.35Å
1340	K	83.5	Confident	86.9	Confident	77 Å²	77	59.5 Å²	59.5	34%	0.335	31%	0.305	S	S	.	.	S	Bend	trans	-83.8	149.9	-178.8	-170.2	-178.1	172.9	-155.6	0	110.8	E1333 K1334 S1337 P1342	E1333-K1340 IonicContact OE1-NZ 3.54Å; E1333-K1340 PolarHBondContact OE1-NZ 3.39Å; K1334-K1340 WeakPolarHBondContact CD-O 3.29Å; K1334-K1340 PolarHBondContact NZ-O 2.9Å; S1337-K1340 PolarHBondContact O-N 3.35Å; S1337-K1340 WeakPolarHBondContact OG-CB 3.47Å; K1340-P1342 WeakPolarHBondContact O-CD 3.36Å
1341	I	86.2	Confident	86.9	Confident	47 Å²	47	64 Å²	64	24%	0.241	32%	0.323	C	S	.	.			trans	-95	104.8	167.9	-63.8	166.6	0	0	0	107.1	F1398	I1341-F1398 HydrophobicContact CD1-CD2 4.15Å; I1341-F1398 HydrophobicContact CD1-CE1 3.92Å; I1341-F1398 HydrophobicContact CD1-CE2 3.43Å; I1341-F1398 VanDerWaalsContact CD1-CE2 3.43Å; I1341-F1398 HydrophobicContact CD1-CZ 3.29Å
1342	P	89.6	Confident	86.8	Confident	1 Å²	1	62.4 Å²	62.4	1%	0.006	32%	0.317	C	S	.	.			trans	-73.4	143	176.2	31.1	-33.1	0	0	0	109.8	L1330 E1333 K1334 K1340 Y1359 L1360	L1330-P1342 HydrophobicContact CD2-CB 3.86Å; L1330-P1342 HydrophobicContact CD2-CG 4.3Å; L1330-P1342 WeakPolarHBondContact O-CG 3.47Å; E1333-P1342 HydrophobicContact CB-CB 3.82Å; E1333-P1342 HydrophobicContact CB-CG 4.39Å; E1333-P1342 HydrophobicContact CG-CB 3.92Å; K1334-P1342 HydrophobicContact CB-CG 4.07Å; K1334-P1342 HydrophobicContact CD-CG 4.25Å; K1340-P1342 WeakPolarHBondContact O-CD 3.36Å; P1342-Y1359 WeakPolarHBondContact O-CA 3.43Å; P1342-L1360 HydrophobicContact CG-CB 4.07Å; P1342-L1360 PolarHBondContact O-N 2.66Å
1343	Y	91.2	Very high	86.8	Confident	14 Å²	14	57.9 Å²	57.9	6%	0.055	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	150.8	174.3	63.2	-83.4	0	0	0	110.2	Y1314 F1345 L1357 S1358 L1391 F1394 K1395	Y1314-Y1343 HydrophobicContact CD2-CD2 4.28Å; Y1314-Y1343 HydrophobicContact CD2-CE1 4.41Å; Y1314-Y1343 AromaticContact CD2-CE2 3.4Å; Y1314-Y1343 HydrophobicContact CD2-CE2 3.4Å; Y1314-Y1343 AromaticContact CD2-CZ 3.48Å; Y1314-Y1343 VanDerWaalsContact CD2-CZ 3.48Å; Y1314-Y1343 WeakPolarHBondContact CD2-OH 3.25Å; Y1314-Y1343 HydrophobicContact CE2-CE1 4.27Å; Y1314-Y1343 AromaticContact CE2-CE2 3.98Å; Y1314-Y1343 HydrophobicContact CE2-CE2 3.98Å; Y1314-Y1343 AromaticContact CE2-CZ 3.53Å; Y1314-Y1343 WeakPolarHBondContact CE2-OH 3.4Å; Y1314-Y1343 HydrophobicContact CG-CE2 4.08Å; Y1343-F1345 HydrophobicContact CD2-CE2 4.43Å; Y1343-F1345 HydrophobicContact CE2-CE2 4.32Å; Y1343-L1357 HydrophobicContact CD2-CD1 4.26Å; Y1343-S1358 CarbonylContact C-O 3.48Å; Y1343-S1358 WeakPolarHBondContact CA-O 3.23Å; Y1343-L1391 HydrophobicContact CD2-CD2 3.94Å; Y1343-L1391 HydrophobicContact CE2-CD1 4.04Å; Y1343-L1391 HydrophobicContact CE2-CD2 3.38Å; Y1343-L1391 HydrophobicContact CE2-CG 4.37Å; Y1343-F1394 HydrophobicContact CG-CE1 4.34Å; Y1343-K1395 WeakPolarHBondContact OH-CE 3.24Å; Y1343-K1395 PolarHBondContact OH-NZ 3.42Å
1344	S	91.5	Very high	87.1	Confident	1 Å²	1	59.7 Å²	59.7	1%	0.007	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	155.5	178.9	56.2	0	0	0	0	111.9	Y1314 S1358	Y1314-S1344 CarbonylContact O-C 3.52Å; Y1314-S1344 VanDerWaalsContact O-CA 3.23Å; Y1314-S1344 WeakPolarHBondContact O-CA 3.42Å; Y1314-S1344 WeakPolarHBondContact O-CB 3.36Å; S1344-S1358 PolarHBondContact N-O 3.34Å; S1344-S1358 PolarHBondContact O-N 2.9Å
1345	F	91.6	Very high	87.4	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	149.5	172.7	-57.5	-81.3	0	0	0	110.4	L1309 Y1312 Y1314 Y1315 R1316 Y1343 I1356 L1357 I1370 V1387 L1391	L1309-F1345 HydrophobicContact CD2-CD1 3.75Å; L1309-F1345 HydrophobicContact CD2-CD2 4.38Å; L1309-F1345 HydrophobicContact CD2-CE1 3.9Å; L1309-F1345 HydrophobicContact CD2-CG 3.98Å; L1309-F1345 HydrophobicContact CD2-CZ 4.28Å; Y1312-F1345 HydrophobicContact CD1-CD2 4.09Å; Y1312-F1345 AromaticContact CD1-CE2 3.7Å; Y1312-F1345 HydrophobicContact CD1-CE2 3.7Å; Y1312-F1345 HydrophobicContact CE1-CE2 4.1Å; Y1312-F1345 HydrophobicContact CG-CE2 4.48Å; Y1314-F1345 PolarHBondContact O-N 3.13Å; Y1315-F1345 CarbonylContact C-O 3.58Å; Y1315-F1345 WeakPolarHBondContact CA-O 3.38Å; Y1315-F1345 HydrophobicContact CD2-CB 4.19Å; R1316-F1345 PolarHBondContact N-O 2.96Å; Y1343-F1345 HydrophobicContact CD2-CE2 4.43Å; Y1343-F1345 HydrophobicContact CE2-CE2 4.32Å; F1345-I1356 CarbonylContact C-O 3.4Å; F1345-I1356 VanDerWaalsContact CA-O 3.29Å; F1345-I1356 WeakPolarHBondContact CA-O 3.34Å; F1345-L1357 HydrophobicContact CD1-CB 4.25Å; F1345-L1357 HydrophobicContact CD1-CD1 3.98Å; F1345-L1357 HydrophobicContact CE1-CB 4.27Å; F1345-L1357 HydrophobicContact CE1-CD1 3.65Å; F1345-L1357 HydrophobicContact CE1-CD2 4.49Å; F1345-L1357 HydrophobicContact CE1-CG 4.34Å; F1345-L1357 HydrophobicContact CZ-CD1 4.11Å; F1345-I1370 HydrophobicContact CD1-CD1 3.87Å; F1345-I1370 HydrophobicContact CE1-CD1 3.53Å; F1345-V1387 HydrophobicContact CE2-CG1 4.32Å; F1345-V1387 HydrophobicContact CZ-CG1 4.12Å; F1345-L1391 HydrophobicContact CE2-CD1 4.04Å; F1345-L1391 HydrophobicContact CE2-CD2 4.24Å; F1345-L1391 HydrophobicContact CE2-CG 4.46Å; F1345-L1391 HydrophobicContact CZ-CD1 3.98Å; F1345-L1391 HydrophobicContact CZ-CD2 3.64Å; F1345-L1391 HydrophobicContact CZ-CG 3.91Å
1346	S	91.8	Very high	87.8	Confident	1 Å²	1	49.4 Å²	49.4	1%	0.007	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	150.5	166.6	-157.7	0	0	0	0	110.9	R1316 A1318 F1355 I1356	R1316-S1346 WeakPolarHBondContact O-CB 3.44Å; R1316-S1346 PolarHBondContact O-OG 3.39Å; A1318-S1346 WeakPolarHBondContact CB-OG 3.44Å; A1318-S1346 PolarHBondContact N-OG 3.12Å; S1346-F1355 CarbonylContact O-C 3.49Å; S1346-F1355 VanDerWaalsContact O-CA 3.3Å; S1346-F1355 WeakPolarHBondContact O-CA 3.49Å; S1346-I1356 PolarHBondContact N-O 3.22Å; S1346-I1356 WeakPolarHBondContact O-CG2 3.29Å; S1346-I1356 PolarHBondContact O-N 3.44Å
1347	A	91.7	Very high	88.1	Confident	1 Å²	1	40.9 Å²	40.9	1%	0.008	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	136.1	174.7	0	0	0	0	0	110	A1257 I1260 Y1315 G1320 G1321 F1355	A1257-A1347 HydrophobicContact CB-CB 3.95Å; I1260-A1347 HydrophobicContact CD1-CB 3.65Å; Y1315-A1347 HydrophobicContact CE2-CB 4.46Å; G1320-A1347 CarbonylContact C-O 3.59Å; G1320-A1347 WeakPolarHBondContact CA-O 3.4Å; G1321-A1347 WeakPolarHBondContact CA-O 3.49Å; G1321-A1347 PolarHBondContact N-O 3.13Å; A1347-F1355 HydrophobicContact CB-CD1 4.17Å; A1347-F1355 HydrophobicContact CB-CE1 3.74Å; A1347-F1355 HydrophobicContact CB-CE2 4.49Å; A1347-F1355 HydrophobicContact CB-CZ 3.91Å
1348	S	89.6	Confident	88.6	Confident	3 Å²	3	38.4 Å²	38.4	2%	0.021	21%	0.205	C	C	.	.			trans	-93	122.2	-178.5	-172.5	0	0	0	0	111.9	G1320 E1350 Y1351 K1354	G1320-S1348 WeakPolarHBondContact O-CA 3.39Å; S1348-E1350 PolarHBondContact OG-N 2.96Å; S1348-Y1351 CarbonylContact O-C 2.89Å; S1348-Y1351 PolarHBondContact OG-N 3.03Å; S1348-K1354 VanDerWaalsContact CB-O 3.3Å; S1348-K1354 WeakPolarHBondContact CB-O 3.38Å; S1348-K1354 PolarHBondContact N-O 2.99Å
1349	K	87.2	Confident	89.3	Confident	142 Å²	142	33.8 Å²	33.8	62%	0.617	17%	0.173	S	C	*	.	S	Bend	trans	-76.4	-29.4	168.8	-172	174.3	-175.6	175.1	0	112	I1260 G1320	I1260-K1349 HydrophobicContact CD1-CB 4.34Å; I1260-K1349 HydrophobicContact CG1-CB 4.27Å; G1320-K1349 PolarHBondContact O-N 3.46Å
1350	E	85.7	Confident	89.8	Confident	108 Å²	108	29.2 Å²	29.2	51%	0.505	13%	0.134	S	C	.	.	S	Bend	trans	-66	-39.4	177	-171.2	-179.4	-164	0	0	111.7	R1323 S1348 Y1369	R1323-E1350 IonicContact NH2-OE1 3.39Å; R1323-E1350 IonicContact NH2-OE2 2.82Å; R1323-E1350 PolarHBondContact NH2-OE2 3.12Å; R1323-E1350 VanDerWaalsContact NH2-OE2 3.07Å; S1348-E1350 PolarHBondContact OG-N 2.96Å; E1350-Y1369 PolarHBondContact OE2-OH 3.3Å
1351	Y	88.2	Confident	89.8	Confident	93 Å²	93	26.8 Å²	26.8	37%	0.365	13%	0.127	S	C	.	.	S	Bend	trans	-128.3	83.6	176.1	-57	-72	0	0	0	110.9	S1348 G1353 K1354 Y1369	S1348-Y1351 CarbonylContact O-C 2.89Å; S1348-Y1351 PolarHBondContact OG-N 3.03Å; Y1351-G1353 PolarHBondContact O-N 2.98Å; Y1351-K1354 HydrophobicContact CG-CD 4.48Å; Y1351-K1354 WeakPolarHBondContact O-CB 3.48Å; Y1351-K1354 PolarHBondContact O-N 3.17Å; Y1351-Y1369 HydrophobicContact CD2-CD1 4.34Å; Y1351-Y1369 AromaticContact CD2-CE1 3.74Å; Y1351-Y1369 HydrophobicContact CD2-CE1 3.74Å; Y1351-Y1369 AromaticContact CD2-CZ 3.83Å; Y1351-Y1369 HydrophobicContact CE2-CE1 4.3Å; Y1351-Y1369 HydrophobicContact CE2-CE2 4.35Å; Y1351-Y1369 AromaticContact CE2-CZ 3.9Å
1352	P	85.5	Confident	89.6	Confident	48 Å²	48	28.5 Å²	28.5	31%	0.312	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54	130.3	177.9	-25.9	34.8	0	0	0	112.1	I1260 Y1261 Q1262	I1260-P1352 HydrophobicContact CG2-CB 4.17Å; I1260-P1352 HydrophobicContact CG2-CG 4.49Å; Y1261-P1352 WeakPolarHBondContact O-CB 3.41Å; Q1262-P1352 HydrophobicContact CB-CB 3.97Å; Q1262-P1352 HydrophobicContact CG-CB 4.38Å; Q1262-P1352 PolarHBondContact NE2-O 3.12Å
1353	G	85.7	Confident	89.1	Confident	1 Å²	1	33.4 Å²	33.4	1%	0.01	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	92.3	-1.2	-172.1	0	0	0	0	0	114.8	Y1351 I1372	Y1351-G1353 PolarHBondContact O-N 2.98Å; G1353-I1372 PolarHBondContact O-N 3.2Å
1354	K	92.6	Very high	88.8	Confident	74 Å²	74	42.3 Å²	42.3	32%	0.322	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	147.7	172.9	-56.1	-171.3	-177.7	175.7	0	111.8	S1348 Y1351 Y1369 I1370 T1371	S1348-K1354 VanDerWaalsContact CB-O 3.3Å; S1348-K1354 WeakPolarHBondContact CB-O 3.38Å; S1348-K1354 PolarHBondContact N-O 2.99Å; Y1351-K1354 HydrophobicContact CG-CD 4.48Å; Y1351-K1354 WeakPolarHBondContact O-CB 3.48Å; Y1351-K1354 PolarHBondContact O-N 3.17Å; K1354-Y1369 HydrophobicContact CB-CD1 4.27Å; K1354-I1370 CarbonylContact C-O 3.58Å; K1354-I1370 VanDerWaalsContact CA-O 3.28Å; K1354-I1370 WeakPolarHBondContact CA-O 3.46Å; K1354-T1371 HydrophobicContact CG-CG2 4.29Å
1355	F	93.6	Very high	88.6	Confident	0 Å²	0	43 Å²	43	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	139	175.4	-79	-111.1	0	0	0	109.8	V1256 A1306 L1309 L1310 Y1315 S1346 A1347 Y1369 I1370 I1372	V1256-F1355 HydrophobicContact CG1-CE2 3.98Å; V1256-F1355 HydrophobicContact CG1-CZ 4.44Å; A1306-F1355 HydrophobicContact CB-CE2 4.28Å; A1306-F1355 HydrophobicContact CB-CZ 4.34Å; L1309-F1355 HydrophobicContact CB-CD1 3.93Å; L1309-F1355 HydrophobicContact CB-CE1 3.89Å; L1309-F1355 HydrophobicContact CB-CG 4.42Å; L1309-F1355 HydrophobicContact CB-CZ 4.39Å; L1309-F1355 HydrophobicContact CD1-CB 3.77Å; L1309-F1355 HydrophobicContact CD1-CD1 3.94Å; L1309-F1355 HydrophobicContact CD1-CD2 3.93Å; L1309-F1355 HydrophobicContact CD1-CG 3.6Å; L1310-F1355 HydrophobicContact CD2-CE1 3.78Å; L1310-F1355 HydrophobicContact CD2-CZ 3.97Å; L1310-F1355 HydrophobicContact CG-CE1 4.02Å; L1310-F1355 HydrophobicContact CG-CZ 3.96Å; Y1315-F1355 HydrophobicContact CD2-CE1 4.34Å; Y1315-F1355 HydrophobicContact CE2-CD1 4.13Å; Y1315-F1355 AromaticContact CE2-CE1 3.77Å; Y1315-F1355 HydrophobicContact CE2-CE1 3.77Å; S1346-F1355 CarbonylContact O-C 3.49Å; S1346-F1355 VanDerWaalsContact O-CA 3.3Å; S1346-F1355 WeakPolarHBondContact O-CA 3.49Å; A1347-F1355 HydrophobicContact CB-CD1 4.17Å; A1347-F1355 HydrophobicContact CB-CE1 3.74Å; A1347-F1355 HydrophobicContact CB-CE2 4.49Å; A1347-F1355 HydrophobicContact CB-CZ 3.91Å; F1355-Y1369 CarbonylContact O-C 3.48Å; F1355-Y1369 WeakPolarHBondContact O-CA 3.33Å; F1355-I1370 HydrophobicContact CB-CB 4.5Å; F1355-I1370 PolarHBondContact N-O 2.95Å; F1355-I1370 PolarHBondContact O-N 3.18Å; F1355-I1372 HydrophobicContact CD2-CD1 3.41Å; F1355-I1372 VanDerWaalsContact CD2-CD1 3.41Å; F1355-I1372 HydrophobicContact CD2-CG1 4.16Å; F1355-I1372 HydrophobicContact CE2-CD1 3.23Å; F1355-I1372 HydrophobicContact CE2-CG1 4.4Å; F1355-I1372 HydrophobicContact CZ-CD1 4.32Å
1356	I	92.8	Very high	88.4	Confident	1 Å²	1	47.4 Å²	47.4	1%	0.005	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	121.4	177.7	-166.6	173.8	0	0	0	109.5	R1323 L1326 F1345 S1346 H1367 E1368 Y1369	R1323-I1356 HydrophobicContact CG-CD1 4.05Å; L1326-I1356 HydrophobicContact CD1-CD1 4.28Å; L1326-I1356 HydrophobicContact CD1-CG2 3.51Å; F1345-I1356 CarbonylContact C-O 3.4Å; F1345-I1356 VanDerWaalsContact CA-O 3.29Å; F1345-I1356 WeakPolarHBondContact CA-O 3.34Å; S1346-I1356 PolarHBondContact N-O 3.22Å; S1346-I1356 WeakPolarHBondContact O-CG2 3.29Å; S1346-I1356 PolarHBondContact O-N 3.44Å; I1356-H1367 HydrophobicContact CD1-CB 3.89Å; I1356-H1367 HydrophobicContact CG1-CB 4.09Å; I1356-E1368 CarbonylContact C-O 3.51Å; I1356-E1368 WeakPolarHBondContact CA-O 3.09Å; I1356-Y1369 HydrophobicContact CB-CD1 4.44Å; I1356-Y1369 HydrophobicContact CB-CE1 4.32Å; I1356-Y1369 HydrophobicContact CG1-CE1 4.44Å
1357	L	92.4	Very high	88.3	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	111.2	167.8	171.5	58.6	0	0	0	108.2	Y1343 F1345 Y1359 E1368 I1370 F1379 F1394	Y1343-L1357 HydrophobicContact CD2-CD1 4.26Å; F1345-L1357 HydrophobicContact CD1-CB 4.25Å; F1345-L1357 HydrophobicContact CD1-CD1 3.98Å; F1345-L1357 HydrophobicContact CE1-CB 4.27Å; F1345-L1357 HydrophobicContact CE1-CD1 3.65Å; F1345-L1357 HydrophobicContact CE1-CD2 4.49Å; F1345-L1357 HydrophobicContact CE1-CG 4.34Å; F1345-L1357 HydrophobicContact CZ-CD1 4.11Å; L1357-Y1359 HydrophobicContact CG-CD1 4.37Å; L1357-E1368 PolarHBondContact N-O 3.24Å; L1357-E1368 PolarHBondContact O-N 2.9Å; L1357-I1370 HydrophobicContact CB-CD1 3.93Å; L1357-I1370 HydrophobicContact CB-CG1 4.31Å; L1357-I1370 HydrophobicContact CD2-CD1 4.41Å; L1357-F1379 HydrophobicContact CD2-CE1 4.42Å; L1357-F1379 HydrophobicContact CD2-CE2 4.1Å; L1357-F1379 HydrophobicContact CD2-CZ 3.88Å; L1357-F1394 HydrophobicContact CD2-CD1 4.48Å; L1357-F1394 HydrophobicContact CD2-CD2 3.86Å; L1357-F1394 HydrophobicContact CD2-CE2 3.96Å; L1357-F1394 HydrophobicContact CD2-CG 4.13Å; L1357-F1394 HydrophobicContact CD2-CZ 4.33Å
1358	S	92.9	Very high	88.2	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	130.5	-179.5	-54.5	0	0	0	0	109.9	L1326 Y1343 S1344 R1366 H1367	L1326-S1358 WeakPolarHBondContact CD1-OG 3.23Å; Y1343-S1358 CarbonylContact C-O 3.48Å; Y1343-S1358 WeakPolarHBondContact CA-O 3.23Å; S1344-S1358 PolarHBondContact N-O 3.34Å; S1344-S1358 PolarHBondContact O-N 2.9Å; S1358-R1366 CarbonylContact C-O 3.56Å; S1358-R1366 VanDerWaalsContact CA-O 3.25Å; S1358-R1366 WeakPolarHBondContact CA-O 3.35Å; S1358-H1367 WeakPolarHBondContact CB-ND1 3.4Å; S1358-H1367 PolarHBondContact OG-CE1 2.91Å; S1358-H1367 PolarHBondContact OG-ND1 2.84Å
1359	Y	92.3	Very high	88.3	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	149.7	-177.4	65	-81.4	0	0	0	113.1	P1342 L1357 P1361 V1365 R1366 E1368 R1380 F1394 F1398	P1342-Y1359 WeakPolarHBondContact O-CA 3.43Å; L1357-Y1359 HydrophobicContact CG-CD1 4.37Å; Y1359-P1361 HydrophobicContact CD2-CG 4.33Å; Y1359-P1361 HydrophobicContact CE2-CG 4.31Å; Y1359-P1361 WeakPolarHBondContact O-CD 3.46Å; Y1359-V1365 WeakPolarHBondContact O-CA 3.47Å; Y1359-R1366 HydrophobicContact CD1-CB 4.1Å; Y1359-R1366 HydrophobicContact CD2-CB 4.43Å; Y1359-R1366 HydrophobicContact CE1-CB 3.64Å; Y1359-R1366 HydrophobicContact CE2-CB 4Å; Y1359-R1366 HydrophobicContact CE2-CG 4.34Å; Y1359-R1366 HydrophobicContact CG-CB 4.46Å; Y1359-R1366 PolarHBondContact N-O 2.79Å; Y1359-R1366 PolarHBondContact O-N 2.65Å; Y1359-R1366 WeakPolarHBondContact OH-CD 3.45Å; Y1359-E1368 HydrophobicContact CE1-CG 4.37Å; Y1359-E1368 VanDerWaalsContact CE1-OE1 3.27Å; Y1359-E1368 WeakPolarHBondContact CE1-OE1 3.49Å; Y1359-E1368 PolarHBondContact OH-OE1 3.01Å; Y1359-R1380 PolarHBondContact OH-NH2 3.27Å; Y1359-F1394 AromaticContact CD1-CE2 3.76Å; Y1359-F1394 HydrophobicContact CD1-CE2 3.76Å; Y1359-F1394 AromaticContact CD1-CZ 3.7Å; Y1359-F1394 HydrophobicContact CD1-CZ 3.7Å; Y1359-F1394 HydrophobicContact CD2-CE2 4.05Å; Y1359-F1394 AromaticContact CD2-CZ 3.68Å; Y1359-F1394 HydrophobicContact CD2-CZ 3.68Å; Y1359-F1394 AromaticContact CE1-CE2 3.73Å; Y1359-F1394 HydrophobicContact CE1-CE2 3.73Å; Y1359-F1394 HydrophobicContact CE1-CZ 4.14Å; Y1359-F1394 HydrophobicContact CE2-CE2 4.03Å; Y1359-F1394 HydrophobicContact CE2-CZ 4.12Å; Y1359-F1394 AromaticContact CG-CE2 3.94Å; Y1359-F1394 HydrophobicContact CG-CE2 3.94Å; Y1359-F1394 AromaticContact CG-CZ 3.46Å; Y1359-F1394 HydrophobicContact CG-CZ 3.46Å; Y1359-F1394 VanDerWaalsContact CG-CZ 3.46Å; Y1359-F1394 AromaticContact CZ-CE2 3.88Å; Y1359-F1398 HydrophobicContact CE2-CB 4.38Å
1360	L	90.3	Very high	88.6	Confident	1 Å²	1	47.1 Å²	47.1	1%	0.005	23%	0.229	C	C	.	.			trans	-123	88.9	-175	179.5	56.3	0	0	0	111.6	L1330 L1331 K1334 P1342 S1362 S1363 R1364 V1365	L1330-L1360 HydrophobicContact CB-CB 4.35Å; L1331-L1360 HydrophobicContact CD2-CD2 3.87Å; L1331-L1360 HydrophobicContact CG-CD2 4.22Å; K1334-L1360 HydrophobicContact CB-CD2 3.79Å; K1334-L1360 HydrophobicContact CG-CD2 4.02Å; P1342-L1360 HydrophobicContact CG-CB 4.07Å; P1342-L1360 PolarHBondContact O-N 2.66Å; L1360-S1362 WeakPolarHBondContact CD1-O 3.47Å; L1360-S1363 VanDerWaalsContact CD1-C 3.5Å; L1360-R1364 WeakPolarHBondContact CD1-O 3.43Å; L1360-V1365 HydrophobicContact CB-CG2 4.23Å; L1360-V1365 HydrophobicContact CD1-CG2 3.91Å; L1360-V1365 HydrophobicContact CD2-CG2 4.28Å; L1360-V1365 HydrophobicContact CG-CG2 4.37Å
1361	P	83.7	Confident	88.9	Confident	27 Å²	27	44 Å²	44	18%	0.175	22%	0.217	C	C	.	.	S	Bend	trans	-70.1	-46.1	-177.9	24.5	-29.8	0	0	0	112.7	K1334 Y1359 F1398	K1334-P1361 PolarHBondContact NZ-O 3.31Å; Y1359-P1361 HydrophobicContact CD2-CG 4.33Å; Y1359-P1361 HydrophobicContact CE2-CG 4.31Å; Y1359-P1361 WeakPolarHBondContact O-CD 3.46Å; P1361-F1398 HydrophobicContact CB-CD2 4Å; P1361-F1398 HydrophobicContact CB-CE2 3.81Å
1362	S	81	Confident	89.1	Confident	83 Å²	83	39.8 Å²	39.8	58%	0.58	20%	0.201	S	C	*	.	S	Bend	trans	-127.5	-100.3	178.6	57.8	0	0	0	0	111.1	L1360	L1360-S1362 WeakPolarHBondContact CD1-O 3.47Å
1363	S	79.6	Confident	89.3	Confident	104 Å²	104	38 Å²	38	73%	0.727	19%	0.19	S	C	*	.	S	Bend	trans	-105.2	-26.9	-176.4	53.3	0	0	0	0	113.9	L1360	L1360-S1363 VanDerWaalsContact CD1-C 3.5Å
1364	R	84.4	Confident	89.3	Confident	201 Å²	201	40.2 Å²	40.2	76%	0.758	20%	0.204	S	C	*	.	S	Bend	trans	-106.5	126.7	-177	-171.1	175.3	179.1	-179.9	1.1	111.2	L1360	L1360-R1364 WeakPolarHBondContact CD1-O 3.43Å
1365	V	87.3	Confident	89.1	Confident	15 Å²	15	43.2 Å²	43.2	9%	0.091	22%	0.219	C	C	.	.			trans	-70	139.2	172.3	-177.5	0	0	0	0	108.9	E1327 L1330 Y1359 L1360	E1327-V1365 HydrophobicContact CB-CG2 4.26Å; E1327-V1365 HydrophobicContact CG-CB 3.86Å; E1327-V1365 HydrophobicContact CG-CG1 3.9Å; E1327-V1365 HydrophobicContact CG-CG2 4.02Å; L1330-V1365 HydrophobicContact CB-CG2 4.49Å; L1330-V1365 HydrophobicContact CD1-CG1 3.62Å; Y1359-V1365 WeakPolarHBondContact O-CA 3.47Å; L1360-V1365 HydrophobicContact CB-CG2 4.23Å; L1360-V1365 HydrophobicContact CD1-CG2 3.91Å; L1360-V1365 HydrophobicContact CD2-CG2 4.28Å; L1360-V1365 HydrophobicContact CG-CG2 4.37Å
1366	R	87.9	Confident	89	Confident	93 Å²	93	43.3 Å²	43.3	35%	0.351	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	138.9	174.6	-66.4	-175.4	179.1	-176	-0.1	108.9	S1358 Y1359	S1358-R1366 CarbonylContact C-O 3.56Å; S1358-R1366 VanDerWaalsContact CA-O 3.25Å; S1358-R1366 WeakPolarHBondContact CA-O 3.35Å; Y1359-R1366 HydrophobicContact CD1-CB 4.1Å; Y1359-R1366 HydrophobicContact CD2-CB 4.43Å; Y1359-R1366 HydrophobicContact CE1-CB 3.64Å; Y1359-R1366 HydrophobicContact CE2-CB 4Å; Y1359-R1366 HydrophobicContact CE2-CG 4.34Å; Y1359-R1366 HydrophobicContact CG-CB 4.46Å; Y1359-R1366 PolarHBondContact N-O 2.79Å; Y1359-R1366 PolarHBondContact O-N 2.65Å; Y1359-R1366 WeakPolarHBondContact OH-CD 3.45Å
1367	H	89.6	Confident	89	Confident	46 Å²	46	43.3 Å²	43.3	21%	0.213	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	127.3	176.5	-59.8	-73.8	0	0	0	108.9	E1327 I1356 S1358	E1327-H1367 WeakPolarHBondContact CG-NE2 3.41Å; E1327-H1367 IonicContact OE1-NE2 2.75Å; E1327-H1367 PolarHBondContact OE1-NE2 2.68Å; I1356-H1367 HydrophobicContact CD1-CB 3.89Å; I1356-H1367 HydrophobicContact CG1-CB 4.09Å; S1358-H1367 WeakPolarHBondContact CB-ND1 3.4Å; S1358-H1367 PolarHBondContact OG-CE1 2.91Å; S1358-H1367 PolarHBondContact OG-ND1 2.84Å
1368	E	90.4	Very high	89	Confident	34 Å²	34	48.7 Å²	48.7	16%	0.159	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	155.5	175.9	-65.5	179.3	-131.9	0	0	109.7	I1356 L1357 Y1359 F1379 R1380	I1356-E1368 CarbonylContact C-O 3.51Å; I1356-E1368 WeakPolarHBondContact CA-O 3.09Å; L1357-E1368 PolarHBondContact N-O 3.24Å; L1357-E1368 PolarHBondContact O-N 2.9Å; Y1359-E1368 HydrophobicContact CE1-CG 4.37Å; Y1359-E1368 VanDerWaalsContact CE1-OE1 3.27Å; Y1359-E1368 WeakPolarHBondContact CE1-OE1 3.49Å; Y1359-E1368 PolarHBondContact OH-OE1 3.01Å; E1368-F1379 HydrophobicContact CB-CE2 3.66Å; E1368-F1379 HydrophobicContact CB-CZ 4.25Å; E1368-F1379 WeakPolarHBondContact OE2-CE2 3.39Å; E1368-F1379 WeakPolarHBondContact OE2-CZ 3.33Å; E1368-R1380 IonicContact OE1-CZ 3.53Å; E1368-R1380 IonicContact OE1-NE 3.27Å; E1368-R1380 IonicContact OE1-NH2 2.97Å; E1368-R1380 PolarHBondContact OE1-NH2 3.17Å; E1368-R1380 IonicContact OE2-CZ 3.63Å; E1368-R1380 IonicContact OE2-NE 3.71Å; E1368-R1380 PolarHBondContact OE2-NE 3.42Å; E1368-R1380 IonicContact OE2-NH2 3.83Å; E1368-R1380 PolarHBondContact OE2-NH2 2.89Å
1369	Y	91.7	Very high	89	Confident	61 Å²	61	48.8 Å²	48.8	24%	0.239	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	133.2	-177.1	-66.7	-87.4	0	0	0	111.4	R1323 E1350 Y1351 K1354 F1355 I1356	R1323-Y1369 PolarHBondContact NH2-OH 3.34Å; E1350-Y1369 PolarHBondContact OE2-OH 3.3Å; Y1351-Y1369 HydrophobicContact CD2-CD1 4.34Å; Y1351-Y1369 AromaticContact CD2-CE1 3.74Å; Y1351-Y1369 HydrophobicContact CD2-CE1 3.74Å; Y1351-Y1369 AromaticContact CD2-CZ 3.83Å; Y1351-Y1369 HydrophobicContact CE2-CE1 4.3Å; Y1351-Y1369 HydrophobicContact CE2-CE2 4.35Å; Y1351-Y1369 AromaticContact CE2-CZ 3.9Å; K1354-Y1369 HydrophobicContact CB-CD1 4.27Å; F1355-Y1369 CarbonylContact O-C 3.48Å; F1355-Y1369 WeakPolarHBondContact O-CA 3.33Å; I1356-Y1369 HydrophobicContact CB-CD1 4.44Å; I1356-Y1369 HydrophobicContact CB-CE1 4.32Å; I1356-Y1369 HydrophobicContact CG1-CE1 4.44Å
1370	I	92.6	Very high	88.7	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	121.7	168.6	-59.6	170.3	0	0	0	106.2	L1309 F1345 K1354 F1355 L1357 F1377 F1379 L1390	L1309-I1370 HydrophobicContact CD1-CG2 4.43Å; F1345-I1370 HydrophobicContact CD1-CD1 3.87Å; F1345-I1370 HydrophobicContact CE1-CD1 3.53Å; K1354-I1370 CarbonylContact C-O 3.58Å; K1354-I1370 VanDerWaalsContact CA-O 3.28Å; K1354-I1370 WeakPolarHBondContact CA-O 3.46Å; F1355-I1370 HydrophobicContact CB-CB 4.5Å; F1355-I1370 PolarHBondContact N-O 2.95Å; F1355-I1370 PolarHBondContact O-N 3.18Å; L1357-I1370 HydrophobicContact CB-CD1 3.93Å; L1357-I1370 HydrophobicContact CB-CG1 4.31Å; L1357-I1370 HydrophobicContact CD2-CD1 4.41Å; I1370-F1377 HydrophobicContact CG2-CB 3.82Å; I1370-F1377 HydrophobicContact CG2-CD1 3.93Å; I1370-F1377 HydrophobicContact CG2-CG 4.32Å; I1370-F1379 HydrophobicContact CG1-CB 4.32Å; I1370-F1379 HydrophobicContact CG1-CD2 3.72Å; I1370-F1379 HydrophobicContact CG1-CE2 4.4Å; I1370-F1379 HydrophobicContact CG1-CG 4.27Å; I1370-L1390 HydrophobicContact CD1-CD1 3.9Å; I1370-L1390 HydrophobicContact CD1-CD2 4.04Å; I1370-L1390 HydrophobicContact CG1-CD1 4.2Å; I1370-L1390 HydrophobicContact CG2-CD1 4.03Å
1371	T	92.4	Very high	88.4	Confident	41 Å²	41	54 Å²	54	25%	0.252	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	129	174.7	-53.2	0	0	0	0	108.6	K1354 V1373 R1378	K1354-T1371 HydrophobicContact CG-CG2 4.29Å; T1371-V1373 HydrophobicContact CG2-CG1 4.31Å; T1371-R1378 PolarHBondContact N-O 3.39Å; T1371-R1378 PolarHBondContact O-N 3.27Å
1372	I	91.8	Very high	88.7	Confident	6 Å²	6	59.3 Å²	59.3	3%	0.031	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	126.3	172.7	-65.4	168.4	0	0	0	108	M1302 A1306 G1353 F1355	M1302-I1372 HydrophobicContact CB-CG2 3.71Å; M1302-I1372 HydrophobicContact CE-CG2 4.49Å; M1302-I1372 HydrophobicContact CG-CG2 3.89Å; M1302-I1372 WeakPolarHBondContact O-CG2 3.5Å; A1306-I1372 HydrophobicContact CB-CD1 3.65Å; G1353-I1372 PolarHBondContact O-N 3.2Å; F1355-I1372 HydrophobicContact CD2-CD1 3.41Å; F1355-I1372 VanDerWaalsContact CD2-CD1 3.41Å; F1355-I1372 HydrophobicContact CD2-CG1 4.16Å; F1355-I1372 HydrophobicContact CE2-CD1 3.23Å; F1355-I1372 HydrophobicContact CE2-CG1 4.4Å; F1355-I1372 HydrophobicContact CZ-CD1 4.32Å
1373	V	90.3	Very high	89.2	Confident	11 Å²	11	58.2 Å²	58.2	7%	0.067	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	160.9	176.5	-68.3	0	0	0	0	108.4	T1371 E1375 G1376 R1378 V1383	T1371-V1373 HydrophobicContact CG2-CG1 4.31Å; V1373-E1375 HydrophobicContact CG2-CB 4.4Å; V1373-E1375 PolarHBondContact O-N 3.46Å; V1373-E1375 VanDerWaalsContact O-N 3.14Å; V1373-G1376 WeakPolarHBondContact CG2-O 3.32Å; V1373-G1376 PolarHBondContact N-O 3.3Å; V1373-G1376 PolarHBondContact O-N 2.77Å; V1373-R1378 HydrophobicContact CG1-CB 4.22Å; V1373-R1378 HydrophobicContact CG2-CB 4.1Å; V1373-V1383 HydrophobicContact CG2-CG1 4.23Å
1374	P	86.6	Confident	89.9	Confident	46 Å²	46	54.1 Å²	54.1	30%	0.299	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-31.8	-179.6	-29.6	38.5	0	0	0	114.3	R1297 R1298 P1301 M1302 G1376	R1297-P1374 WeakPolarHBondContact O-CB 3.19Å; R1298-P1374 HydrophobicContact CB-CG 4.34Å; R1298-P1374 HydrophobicContact CG-CG 3.92Å; P1301-P1374 HydrophobicContact CB-CB 4.37Å; P1301-P1374 WeakPolarHBondContact CB-O 3.27Å; M1302-P1374 HydrophobicContact CG-CG 4.24Å; M1302-P1374 HydrophobicContact SD-CG 4.33Å; P1374-G1376 PolarHBondContact O-N 3.45Å
1375	E	88.4	Confident	90.2	Very high	138 Å²	138	48.4 Å²	48.4	65%	0.645	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	-2.9	178.9	-59.3	167.2	163	0	0	113.8	V1373 V1383	V1373-E1375 HydrophobicContact CG2-CB 4.4Å; V1373-E1375 PolarHBondContact O-N 3.46Å; V1373-E1375 VanDerWaalsContact O-N 3.14Å; E1375-V1383 HydrophobicContact CB-CG1 3.74Å
1376	G	90.5	Very high	90.3	Very high	2 Å²	2	50.8 Å²	50.8	2%	0.021	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	124.3	-127.9	-179.3	0	0	0	0	0	113.3	V1373 P1374	V1373-G1376 WeakPolarHBondContact CG2-O 3.32Å; V1373-G1376 PolarHBondContact N-O 3.3Å; V1373-G1376 PolarHBondContact O-N 2.77Å; P1374-G1376 PolarHBondContact O-N 3.45Å
1377	F	93.2	Very high	90.4	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	115.3	-173.5	-55.2	-76.8	0	0	0	111.6	S1305 E1308 L1309 I1370 V1383 F1384 V1387 L1390	S1305-F1377 WeakPolarHBondContact O-CE1 3.44Å; S1305-F1377 WeakPolarHBondContact O-CZ 3.16Å; E1308-F1377 HydrophobicContact CB-CZ 4.18Å; E1308-F1377 WeakPolarHBondContact OE2-CE2 3.39Å; L1309-F1377 HydrophobicContact CB-CE1 4.48Å; L1309-F1377 HydrophobicContact CD1-CD1 3.65Å; L1309-F1377 HydrophobicContact CD1-CE1 3.37Å; L1309-F1377 HydrophobicContact CD1-CZ 4.44Å; L1309-F1377 HydrophobicContact CD2-CE1 4.48Å; L1309-F1377 HydrophobicContact CG-CD1 4.11Å; L1309-F1377 HydrophobicContact CG-CE1 3.47Å; L1309-F1377 VanDerWaalsContact CG-CE1 3.47Å; L1309-F1377 HydrophobicContact CG-CZ 4.09Å; I1370-F1377 HydrophobicContact CG2-CB 3.82Å; I1370-F1377 HydrophobicContact CG2-CD1 3.93Å; I1370-F1377 HydrophobicContact CG2-CG 4.32Å; F1377-V1383 CarbonylContact O-C 3.59Å; F1377-V1383 WeakPolarHBondContact O-CA 3.33Å; F1377-F1384 HydrophobicContact CB-CB 4.49Å; F1377-F1384 PolarHBondContact N-O 3.5Å; F1377-F1384 WeakPolarHBondContact O-CD2 3.44Å; F1377-F1384 PolarHBondContact O-N 2.92Å; F1377-V1387 HydrophobicContact CD2-CG2 4.23Å; F1377-V1387 HydrophobicContact CE1-CG2 4.12Å; F1377-V1387 HydrophobicContact CE2-CG2 3.56Å; F1377-V1387 HydrophobicContact CZ-CG2 3.48Å; F1377-V1387 VanDerWaalsContact CZ-CG2 3.48Å; F1377-L1390 HydrophobicContact CB-CD1 3.57Å; F1377-L1390 HydrophobicContact CG-CD1 4.3Å
1378	R	92.8	Very high	90.5	Very high	113 Å²	113	48.7 Å²	48.7	43%	0.426	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	114.7	172.2	-171.1	-179.1	-66.2	157.4	-0.3	110	T1371 V1373 R1382 V1383	T1371-R1378 PolarHBondContact N-O 3.39Å; T1371-R1378 PolarHBondContact O-N 3.27Å; V1373-R1378 HydrophobicContact CG1-CB 4.22Å; V1373-R1378 HydrophobicContact CG2-CB 4.1Å; R1378-R1382 CarbonylContact C-O 3.49Å; R1378-R1382 VanDerWaalsContact CA-O 3.32Å; R1378-R1382 WeakPolarHBondContact CA-O 3.41Å; R1378-V1383 HydrophobicContact CB-CG2 4.39Å; R1378-V1383 HydrophobicContact CG-CG2 4.35Å
1379	F	91.8	Very high	90.5	Very high	2 Å²	2	49 Å²	49	1%	0.009	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	128	177.9	-179.6	-111.7	0	0	0	110.1	L1357 E1368 I1370 G1381 R1382 F1384 L1390 W1393 F1394	L1357-F1379 HydrophobicContact CD2-CE1 4.42Å; L1357-F1379 HydrophobicContact CD2-CE2 4.1Å; L1357-F1379 HydrophobicContact CD2-CZ 3.88Å; E1368-F1379 HydrophobicContact CB-CE2 3.66Å; E1368-F1379 HydrophobicContact CB-CZ 4.25Å; E1368-F1379 WeakPolarHBondContact OE2-CE2 3.39Å; E1368-F1379 WeakPolarHBondContact OE2-CZ 3.33Å; I1370-F1379 HydrophobicContact CG1-CB 4.32Å; I1370-F1379 HydrophobicContact CG1-CD2 3.72Å; I1370-F1379 HydrophobicContact CG1-CE2 4.4Å; I1370-F1379 HydrophobicContact CG1-CG 4.27Å; F1379-G1381 PolarHBondContact O-N 3.44Å; F1379-R1382 PolarHBondContact N-O 3.49Å; F1379-R1382 PolarHBondContact O-N 3.32Å; F1379-F1384 HydrophobicContact CB-CD2 4.26Å; F1379-F1384 HydrophobicContact CB-CE2 4Å; F1379-F1384 HydrophobicContact CD1-CE2 4.46Å; F1379-L1390 HydrophobicContact CB-CD1 3.75Å; F1379-L1390 HydrophobicContact CB-CG 4.35Å; F1379-L1390 HydrophobicContact CG-CD1 4.35Å; F1379-W1393 HydrophobicContact CD1-CE3 4.3Å; F1379-W1393 AromaticContact CD1-CZ3 3.96Å; F1379-W1393 HydrophobicContact CD1-CZ3 3.96Å; F1379-W1393 HydrophobicContact CE1-CE3 4.46Å; F1379-W1393 AromaticContact CE1-CZ3 3.95Å; F1379-W1393 HydrophobicContact CE1-CZ3 3.95Å; F1379-F1394 HydrophobicContact CE1-CD2 4.17Å; F1379-F1394 HydrophobicContact CZ-CD2 4.33Å
1380	R	85.7	Confident	90.5	Very high	38 Å²	38	46.1 Å²	46.1	14%	0.143	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	48.3	41	-175.7	-62.4	-175.2	-179.8	174.9	-3.3	114.3	Y1359 E1368 R1382 W1393 H1397 D1400	Y1359-R1380 PolarHBondContact OH-NH2 3.27Å; E1368-R1380 IonicContact OE1-CZ 3.53Å; E1368-R1380 IonicContact OE1-NE 3.27Å; E1368-R1380 IonicContact OE1-NH2 2.97Å; E1368-R1380 PolarHBondContact OE1-NH2 3.17Å; E1368-R1380 IonicContact OE2-CZ 3.63Å; E1368-R1380 IonicContact OE2-NE 3.71Å; E1368-R1380 PolarHBondContact OE2-NE 3.42Å; E1368-R1380 IonicContact OE2-NH2 3.83Å; E1368-R1380 PolarHBondContact OE2-NH2 2.89Å; R1380-R1382 PolarHBondContact O-N 3.36Å; R1380-W1393 HydrophobicContact CB-CH2 4.29Å; R1380-W1393 HydrophobicContact CB-CZ3 4.42Å; R1380-H1397 PolarHBondContact NH1-O 3.31Å; R1380-D1400 PolarHBondContact NH1-O 2.86Å
1381	G	84.4	Confident	90.4	Very high	72 Å²	72	46.2 Å²	46.2	74%	0.742	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.1	-5.4	178.4	0	0	0	0	0	115.5	F1379	F1379-G1381 PolarHBondContact O-N 3.44Å
1382	R	89.6	Confident	90.3	Very high	139 Å²	139	50.8 Å²	50.8	53%	0.525	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	147.8	172.5	-66.3	-174.3	179.6	-165.6	-0.7	110.4	R1378 F1379 R1380 F1384 W1393	R1378-R1382 CarbonylContact C-O 3.49Å; R1378-R1382 VanDerWaalsContact CA-O 3.32Å; R1378-R1382 WeakPolarHBondContact CA-O 3.41Å; F1379-R1382 PolarHBondContact N-O 3.49Å; F1379-R1382 PolarHBondContact O-N 3.32Å; R1380-R1382 PolarHBondContact O-N 3.36Å; R1382-F1384 HydrophobicContact CB-CE2 3.76Å; R1382-F1384 HydrophobicContact CB-CZ 3.75Å; R1382-W1393 VanDerWaalsContact NH1-NE1 3.12Å
1383	V	92.3	Very high	90.2	Very high	60 Å²	60	52.1 Å²	52.1	36%	0.364	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	131.4	174.5	-177.3	0	0	0	0	108.6	V1373 E1375 F1377 R1378	V1373-V1383 HydrophobicContact CG2-CG1 4.23Å; E1375-V1383 HydrophobicContact CB-CG1 3.74Å; F1377-V1383 CarbonylContact O-C 3.59Å; F1377-V1383 WeakPolarHBondContact O-CA 3.33Å; R1378-V1383 HydrophobicContact CB-CG2 4.39Å; R1378-V1383 HydrophobicContact CG-CG2 4.35Å
1384	F	94.3	Very high	90.2	Very high	19 Å²	19	51.8 Å²	51.8	8%	0.083	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	129.8	179.9	-58.9	-85	0	0	0	109.1	F1377 F1379 R1382 N1386 A1389 L1390 W1393	F1377-F1384 HydrophobicContact CB-CB 4.49Å; F1377-F1384 PolarHBondContact N-O 3.5Å; F1377-F1384 WeakPolarHBondContact O-CD2 3.44Å; F1377-F1384 PolarHBondContact O-N 2.92Å; F1379-F1384 HydrophobicContact CB-CD2 4.26Å; F1379-F1384 HydrophobicContact CB-CE2 4Å; F1379-F1384 HydrophobicContact CD1-CE2 4.46Å; R1382-F1384 HydrophobicContact CB-CE2 3.76Å; R1382-F1384 HydrophobicContact CB-CZ 3.75Å; F1384-N1386 VanDerWaalsContact C-N 3.29Å; F1384-N1386 PolarHBondContact O-N 3.06Å; F1384-A1389 HydrophobicContact CD1-CB 4.46Å; F1384-L1390 HydrophobicContact CB-CB 3.82Å; F1384-L1390 HydrophobicContact CD1-CB 4.36Å; F1384-L1390 HydrophobicContact CD2-CB 4Å; F1384-L1390 HydrophobicContact CD2-CD1 4.01Å; F1384-L1390 HydrophobicContact CD2-CG 4Å; F1384-L1390 HydrophobicContact CE2-CG 4.44Å; F1384-L1390 HydrophobicContact CG-CB 3.8Å; F1384-L1390 HydrophobicContact CG-CG 4.33Å; F1384-W1393 HydrophobicContact CD1-CB 4.45Å; F1384-W1393 HydrophobicContact CE1-CB 3.53Å; F1384-W1393 HydrophobicContact CE1-CD2 4.02Å; F1384-W1393 HydrophobicContact CE1-CE3 4.37Å; F1384-W1393 AromaticContact CE1-CG 3.63Å; F1384-W1393 HydrophobicContact CE1-CG 3.63Å; F1384-W1393 HydrophobicContact CE2-CE3 4.34Å; F1384-W1393 HydrophobicContact CZ-CB 3.97Å; F1384-W1393 AromaticContact CZ-CD2 3.59Å; F1384-W1393 HydrophobicContact CZ-CD2 3.59Å; F1384-W1393 AromaticContact CZ-CE3 3.6Å; F1384-W1393 HydrophobicContact CZ-CE3 3.6Å; F1384-W1393 AromaticContact CZ-CG 3.73Å; F1384-W1393 HydrophobicContact CZ-CG 3.73Å; F1384-W1393 HydrophobicContact CZ-CZ3 4.35Å
1385	A	89.7	Confident	90.3	Very high	81 Å²	81	54.9 Å²	54.9	67%	0.669	29%	0.288	S	S	*	.	S	Bend	trans	-67.6	-25.9	-176.4	0	0	0	0	0	114
1386	N	90.5	Very high	90.2	Very high	65 Å²	65	54 Å²	54	35%	0.348	28%	0.284	S	S	.	.	S	Bend	trans	-149.4	163.6	178.9	57.5	54.7	0	0	0	111.3	E1308 F1384 N1388 A1389 L1390	E1308-N1386 WeakPolarHBondContact OE1-CB 3.3Å; F1384-N1386 VanDerWaalsContact C-N 3.29Å; F1384-N1386 PolarHBondContact O-N 3.06Å; N1386-N1388 PolarHBondContact O-N 3.09Å; N1386-N1388 PolarHBondContact OD1-N 2.73Å; N1386-A1389 PolarHBondContact O-N 3.42Å; N1386-A1389 WeakPolarHBondContact OD1-CB 3.3Å; N1386-A1389 PolarHBondContact OD1-N 2.84Å; N1386-L1390 PolarHBondContact O-N 2.86Å
1387	V	90.2	Very high	89.9	Confident	0 Å²	0	56 Å²	56	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-63.3	-31.9	-177	177.9	0	0	0	0	111.3	E1308 L1309 Y1312 F1345 F1377 L1390 L1391	E1308-V1387 HydrophobicContact CB-CG2 4.3Å; E1308-V1387 HydrophobicContact CG-CB 4.39Å; E1308-V1387 HydrophobicContact CG-CG2 3.75Å; E1308-V1387 WeakPolarHBondContact OE1-CB 3.33Å; E1308-V1387 WeakPolarHBondContact OE1-CG2 3.38Å; E1308-V1387 PolarHBondContact OE1-N 2.68Å; L1309-V1387 HydrophobicContact CD2-CG1 4.14Å; L1309-V1387 HydrophobicContact CD2-CG2 3.69Å; L1309-V1387 HydrophobicContact CG-CG2 3.86Å; Y1312-V1387 HydrophobicContact CD1-CG1 4.23Å; Y1312-V1387 HydrophobicContact CD2-CB 4.06Å; Y1312-V1387 HydrophobicContact CD2-CG1 3.59Å; Y1312-V1387 HydrophobicContact CE1-CG1 4.27Å; Y1312-V1387 HydrophobicContact CE2-CB 4.14Å; Y1312-V1387 HydrophobicContact CE2-CG1 3.64Å; Y1312-V1387 HydrophobicContact CG-CG1 3.91Å; F1345-V1387 HydrophobicContact CE2-CG1 4.32Å; F1345-V1387 HydrophobicContact CZ-CG1 4.12Å; F1377-V1387 HydrophobicContact CD2-CG2 4.23Å; F1377-V1387 HydrophobicContact CE1-CG2 4.12Å; F1377-V1387 HydrophobicContact CE2-CG2 3.56Å; F1377-V1387 HydrophobicContact CZ-CG2 3.48Å; F1377-V1387 VanDerWaalsContact CZ-CG2 3.48Å; V1387-L1390 PolarHBondContact O-N 3.1Å; V1387-L1391 HydrophobicContact CG1-CD1 3.82Å; V1387-L1391 HydrophobicContact CG1-CG 4.23Å; V1387-L1391 VanDerWaalsContact O-CB 3.31Å; V1387-L1391 WeakPolarHBondContact O-CB 3.46Å; V1387-L1391 WeakPolarHBondContact O-CG 3.49Å; V1387-L1391 PolarHBondContact O-N 2.93Å
1388	N	91	Very high	89.3	Confident	95 Å²	95	57.3 Å²	57.3	51%	0.508	30%	0.298	S	S	.	.	H	α-helix	trans	-68.3	-40.1	178.9	-71.5	-38.6	0	0	0	112.8	Y1312 N1386 L1391 K1392	Y1312-N1388 PolarHBondContact OH-OD1 3.3Å; N1386-N1388 PolarHBondContact O-N 3.09Å; N1386-N1388 PolarHBondContact OD1-N 2.73Å; N1388-L1391 PolarHBondContact O-N 3.13Å; N1388-K1392 WeakPolarHBondContact O-CB 3.42Å; N1388-K1392 PolarHBondContact O-N 3.01Å
1389	A	90.7	Very high	88.5	Confident	39 Å²	39	60.9 Å²	60.9	32%	0.322	31%	0.312	S	S	.	.	H	α-helix	trans	-65.2	-44.2	174.3	0	0	0	0	0	111.1	F1384 N1386 L1391 K1392 W1393	F1384-A1389 HydrophobicContact CD1-CB 4.46Å; N1386-A1389 PolarHBondContact O-N 3.42Å; N1386-A1389 WeakPolarHBondContact OD1-CB 3.3Å; N1386-A1389 PolarHBondContact OD1-N 2.84Å; A1389-L1391 VanDerWaalsContact C-N 3.32Å; A1389-L1391 PolarHBondContact O-N 2.66Å; A1389-K1392 PolarHBondContact O-N 3.32Å; A1389-W1393 WeakPolarHBondContact O-CB 3.37Å; A1389-W1393 PolarHBondContact O-N 2.89Å
1390	L	92.3	Very high	87.7	Confident	1 Å²	1	64.6 Å²	64.6	1%	0.005	33%	0.332	C	S	.	.	H	α-helix	trans	-56.9	-46.9	173.2	-177.9	151.2	0	0	0	110.9	I1370 F1377 F1379 F1384 N1386 V1387 W1393 F1394	I1370-L1390 HydrophobicContact CD1-CD1 3.9Å; I1370-L1390 HydrophobicContact CD1-CD2 4.04Å; I1370-L1390 HydrophobicContact CG1-CD1 4.2Å; I1370-L1390 HydrophobicContact CG2-CD1 4.03Å; F1377-L1390 HydrophobicContact CB-CD1 3.57Å; F1377-L1390 HydrophobicContact CG-CD1 4.3Å; F1379-L1390 HydrophobicContact CB-CD1 3.75Å; F1379-L1390 HydrophobicContact CB-CG 4.35Å; F1379-L1390 HydrophobicContact CG-CD1 4.35Å; F1384-L1390 HydrophobicContact CB-CB 3.82Å; F1384-L1390 HydrophobicContact CD1-CB 4.36Å; F1384-L1390 HydrophobicContact CD2-CB 4Å; F1384-L1390 HydrophobicContact CD2-CD1 4.01Å; F1384-L1390 HydrophobicContact CD2-CG 4Å; F1384-L1390 HydrophobicContact CE2-CG 4.44Å; F1384-L1390 HydrophobicContact CG-CB 3.8Å; F1384-L1390 HydrophobicContact CG-CG 4.33Å; N1386-L1390 PolarHBondContact O-N 2.86Å; V1387-L1390 PolarHBondContact O-N 3.1Å; L1390-W1393 PolarHBondContact O-N 3.21Å; L1390-F1394 VanDerWaalsContact O-CB 3.23Å; L1390-F1394 WeakPolarHBondContact O-CB 3.16Å; L1390-F1394 PolarHBondContact O-N 2.79Å
1391	L	90.3	Very high	86	Confident	2 Å²	2	70.7 Å²	70.7	1%	0.01	36%	0.362	C	S	.	.	H	α-helix	trans	-72.3	-35.8	-178.1	-80	174.7	0	0	0	113.9	Y1312 Y1343 F1345 V1387 N1388 A1389 W1393 F1394 K1395	Y1312-L1391 HydrophobicContact CD1-CD1 4.26Å; Y1312-L1391 HydrophobicContact CE1-CD1 3.3Å; Y1312-L1391 HydrophobicContact CE2-CD1 4.28Å; Y1312-L1391 WeakPolarHBondContact OH-CD1 3.41Å; Y1343-L1391 HydrophobicContact CD2-CD2 3.94Å; Y1343-L1391 HydrophobicContact CE2-CD1 4.04Å; Y1343-L1391 HydrophobicContact CE2-CD2 3.38Å; Y1343-L1391 HydrophobicContact CE2-CG 4.37Å; F1345-L1391 HydrophobicContact CE2-CD1 4.04Å; F1345-L1391 HydrophobicContact CE2-CD2 4.24Å; F1345-L1391 HydrophobicContact CE2-CG 4.46Å; F1345-L1391 HydrophobicContact CZ-CD1 3.98Å; F1345-L1391 HydrophobicContact CZ-CD2 3.64Å; F1345-L1391 HydrophobicContact CZ-CG 3.91Å; V1387-L1391 HydrophobicContact CG1-CD1 3.82Å; V1387-L1391 HydrophobicContact CG1-CG 4.23Å; V1387-L1391 VanDerWaalsContact O-CB 3.31Å; V1387-L1391 WeakPolarHBondContact O-CB 3.46Å; V1387-L1391 WeakPolarHBondContact O-CG 3.49Å; V1387-L1391 PolarHBondContact O-N 2.93Å; N1388-L1391 PolarHBondContact O-N 3.13Å; A1389-L1391 VanDerWaalsContact C-N 3.32Å; A1389-L1391 PolarHBondContact O-N 2.66Å; L1391-W1393 VanDerWaalsContact C-N 3.33Å; L1391-F1394 HydrophobicContact CD2-CD1 4.05Å; L1391-F1394 PolarHBondContact O-N 3.07Å; L1391-K1395 WeakPolarHBondContact O-CB 3.47Å; L1391-K1395 WeakPolarHBondContact O-CG 3.4Å; L1391-K1395 PolarHBondContact O-N 3.03Å
1392	K	90.3	Very high	84.5	Confident	138 Å²	138	72.5 Å²	72.5	60%	0.6	35%	0.351	S	S	*	.	H	α-helix	trans	-59.6	-50.4	173	-177	-177.1	177.5	-174.2	0	109.4	N1388 A1389 K1395 E1396	N1388-K1392 WeakPolarHBondContact O-CB 3.42Å; N1388-K1392 PolarHBondContact O-N 3.01Å; A1389-K1392 PolarHBondContact O-N 3.32Å; K1392-K1395 PolarHBondContact O-N 3.23Å; K1392-E1396 WeakPolarHBondContact CE-OE1 3.36Å; K1392-E1396 PolarHBondContact O-N 3.24Å
1393	W	90	Very high	82.1	Confident	33 Å²	33	68.8 Å²	68.8	13%	0.125	36%	0.356	C	S	.	.	H	α-helix	trans	-62.2	-47.7	177.8	-173.4	81.1	0	0	0	111.8	F1379 R1380 R1382 F1384 A1389 L1390 L1391 K1395 E1396 H1397	F1379-W1393 HydrophobicContact CD1-CE3 4.3Å; F1379-W1393 AromaticContact CD1-CZ3 3.96Å; F1379-W1393 HydrophobicContact CD1-CZ3 3.96Å; F1379-W1393 HydrophobicContact CE1-CE3 4.46Å; F1379-W1393 AromaticContact CE1-CZ3 3.95Å; F1379-W1393 HydrophobicContact CE1-CZ3 3.95Å; R1380-W1393 HydrophobicContact CB-CH2 4.29Å; R1380-W1393 HydrophobicContact CB-CZ3 4.42Å; R1382-W1393 VanDerWaalsContact NH1-NE1 3.12Å; F1384-W1393 HydrophobicContact CD1-CB 4.45Å; F1384-W1393 HydrophobicContact CE1-CB 3.53Å; F1384-W1393 HydrophobicContact CE1-CD2 4.02Å; F1384-W1393 HydrophobicContact CE1-CE3 4.37Å; F1384-W1393 AromaticContact CE1-CG 3.63Å; F1384-W1393 HydrophobicContact CE1-CG 3.63Å; F1384-W1393 HydrophobicContact CE2-CE3 4.34Å; F1384-W1393 HydrophobicContact CZ-CB 3.97Å; F1384-W1393 AromaticContact CZ-CD2 3.59Å; F1384-W1393 HydrophobicContact CZ-CD2 3.59Å; F1384-W1393 AromaticContact CZ-CE3 3.6Å; F1384-W1393 HydrophobicContact CZ-CE3 3.6Å; F1384-W1393 AromaticContact CZ-CG 3.73Å; F1384-W1393 HydrophobicContact CZ-CG 3.73Å; F1384-W1393 HydrophobicContact CZ-CZ3 4.35Å; A1389-W1393 WeakPolarHBondContact O-CB 3.37Å; A1389-W1393 PolarHBondContact O-N 2.89Å; L1390-W1393 PolarHBondContact O-N 3.21Å; L1391-W1393 VanDerWaalsContact C-N 3.33Å; W1393-K1395 VanDerWaalsContact C-N 3.32Å; W1393-K1395 PolarHBondContact O-N 3.05Å; W1393-E1396 PolarHBondContact O-N 2.64Å; W1393-E1396 VanDerWaalsContact O-N 3.13Å; W1393-H1397 AromaticContact CD1-CE1 3.44Å; W1393-H1397 VanDerWaalsContact CD1-CE1 3.44Å; W1393-H1397 AromaticContact CD1-ND1 3.53Å; W1393-H1397 AromaticContact CD1-NE2 3.92Å; W1393-H1397 HydrophobicContact CD2-CB 4.25Å; W1393-H1397 AromaticContact CD2-ND1 3.98Å; W1393-H1397 AromaticContact CE2-CD2 3.7Å; W1393-H1397 AromaticContact CE2-CG 3.56Å; W1393-H1397 AromaticContact CE2-ND1 3.73Å; W1393-H1397 AromaticContact CE2-NE2 3.97Å; W1393-H1397 HydrophobicContact CE3-CB 4.37Å; W1393-H1397 AromaticContact CG-ND1 3.88Å; W1393-H1397 HydrophobicContact CH2-CB 4.05Å; W1393-H1397 HydrophobicContact CZ2-CB 3.88Å; W1393-H1397 AromaticContact CZ2-CD2 3.75Å; W1393-H1397 AromaticContact CZ2-CG 3.78Å; W1393-H1397 HydrophobicContact CZ3-CB 4.29Å; W1393-H1397 AromaticContact NE1-CD2 3.49Å; W1393-H1397 PolarHBondContact NE1-CD2 2.78Å; W1393-H1397 AromaticContact NE1-CE1 3.25Å; W1393-H1397 PolarHBondContact NE1-CE1 2.88Å; W1393-H1397 VanDerWaalsContact NE1-CE1 3.25Å; W1393-H1397 AromaticContact NE1-CG 3.58Å; W1393-H1397 AromaticContact NE1-ND1 3.38Å; W1393-H1397 PolarHBondContact NE1-ND1 3.3Å; W1393-H1397 AromaticContact NE1-NE2 3.26Å; W1393-H1397 PolarHBondContact NE1-NE2 3.16Å; W1393-H1397 WeakPolarHBondContact O-CB 3.23Å; W1393-H1397 PolarHBondContact O-N 3.47Å; W1393-H1397 PolarHBondContact O-ND1 2.77Å
1394	F	90.5	Very high	79.3	Confident	4 Å²	4	77 Å²	77	2%	0.018	38%	0.38	C	S	.	.	H	α-helix	trans	-56.8	-42.5	176.4	166.2	-103.5	0	0	0	112.2	Y1343 L1357 Y1359 F1379 L1390 L1391 E1396 H1397 F1398	Y1343-F1394 HydrophobicContact CG-CE1 4.34Å; L1357-F1394 HydrophobicContact CD2-CD1 4.48Å; L1357-F1394 HydrophobicContact CD2-CD2 3.86Å; L1357-F1394 HydrophobicContact CD2-CE2 3.96Å; L1357-F1394 HydrophobicContact CD2-CG 4.13Å; L1357-F1394 HydrophobicContact CD2-CZ 4.33Å; Y1359-F1394 AromaticContact CD1-CE2 3.76Å; Y1359-F1394 HydrophobicContact CD1-CE2 3.76Å; Y1359-F1394 AromaticContact CD1-CZ 3.7Å; Y1359-F1394 HydrophobicContact CD1-CZ 3.7Å; Y1359-F1394 HydrophobicContact CD2-CE2 4.05Å; Y1359-F1394 AromaticContact CD2-CZ 3.68Å; Y1359-F1394 HydrophobicContact CD2-CZ 3.68Å; Y1359-F1394 AromaticContact CE1-CE2 3.73Å; Y1359-F1394 HydrophobicContact CE1-CE2 3.73Å; Y1359-F1394 HydrophobicContact CE1-CZ 4.14Å; Y1359-F1394 HydrophobicContact CE2-CE2 4.03Å; Y1359-F1394 HydrophobicContact CE2-CZ 4.12Å; Y1359-F1394 AromaticContact CG-CE2 3.94Å; Y1359-F1394 HydrophobicContact CG-CE2 3.94Å; Y1359-F1394 AromaticContact CG-CZ 3.46Å; Y1359-F1394 HydrophobicContact CG-CZ 3.46Å; Y1359-F1394 VanDerWaalsContact CG-CZ 3.46Å; Y1359-F1394 AromaticContact CZ-CE2 3.88Å; F1379-F1394 HydrophobicContact CE1-CD2 4.17Å; F1379-F1394 HydrophobicContact CZ-CD2 4.33Å; L1390-F1394 VanDerWaalsContact O-CB 3.23Å; L1390-F1394 WeakPolarHBondContact O-CB 3.16Å; L1390-F1394 PolarHBondContact O-N 2.79Å; L1391-F1394 HydrophobicContact CD2-CD1 4.05Å; L1391-F1394 PolarHBondContact O-N 3.07Å; F1394-E1396 VanDerWaalsContact C-N 3.3Å; F1394-E1396 PolarHBondContact O-N 3.5Å; F1394-H1397 CarbonylContact O-C 3.57Å; F1394-H1397 PolarHBondContact O-N 2.79Å; F1394-F1398 HydrophobicContact CD2-CB 4.27Å; F1394-F1398 HydrophobicContact CE2-CB 3.85Å; F1394-F1398 HydrophobicContact CZ-CB 4.02Å; F1394-F1398 VanDerWaalsContact O-CA 3.3Å; F1394-F1398 WeakPolarHBondContact O-CA 3.29Å; F1394-F1398 VanDerWaalsContact O-CB 3.26Å; F1394-F1398 WeakPolarHBondContact O-CB 3.37Å; F1394-F1398 PolarHBondContact O-N 3Å
1395	K	87.4	Confident	76.2	Confident	111 Å²	111	81 Å²	81	48%	0.483	41%	0.411	S	S	.	.	H	α-helix	trans	-66	-31.4	178.5	-74.8	168.9	-173.5	171.9	0	113.3	Y1343 L1391 K1392 W1393 F1398	Y1343-K1395 WeakPolarHBondContact OH-CE 3.24Å; Y1343-K1395 PolarHBondContact OH-NZ 3.42Å; L1391-K1395 WeakPolarHBondContact O-CB 3.47Å; L1391-K1395 WeakPolarHBondContact O-CG 3.4Å; L1391-K1395 PolarHBondContact O-N 3.03Å; K1392-K1395 PolarHBondContact O-N 3.23Å; W1393-K1395 VanDerWaalsContact C-N 3.32Å; W1393-K1395 PolarHBondContact O-N 3.05Å; K1395-F1398 WeakPolarHBondContact O-CD1 3.29Å
1396	E	86.5	Confident	73.5	Confident	120 Å²	120	81.1 Å²	81.1	56%	0.561	40%	0.403	S	S	*	.	H	α-helix	trans	-78.2	-31	174.9	-70	167.2	-171.2	0	0	111.6	K1392 W1393 F1394	K1392-E1396 WeakPolarHBondContact CE-OE1 3.36Å; K1392-E1396 PolarHBondContact O-N 3.24Å; W1393-E1396 PolarHBondContact O-N 2.64Å; W1393-E1396 VanDerWaalsContact O-N 3.13Å; F1394-E1396 VanDerWaalsContact C-N 3.3Å; F1394-E1396 PolarHBondContact O-N 3.5Å
1397	H	84.3	Confident	70.6	Confident	43 Å²	43	82.7 Å²	82.7	20%	0.199	42%	0.417	C	S	.	.	H	α-helix	trans	-119	16.4	-169.1	-55.9	68.9	0	0	0	113.6	R1380 W1393 F1394 R1399 D1400	R1380-H1397 PolarHBondContact NH1-O 3.31Å; W1393-H1397 AromaticContact CD1-CE1 3.44Å; W1393-H1397 VanDerWaalsContact CD1-CE1 3.44Å; W1393-H1397 AromaticContact CD1-ND1 3.53Å; W1393-H1397 AromaticContact CD1-NE2 3.92Å; W1393-H1397 HydrophobicContact CD2-CB 4.25Å; W1393-H1397 AromaticContact CD2-ND1 3.98Å; W1393-H1397 AromaticContact CE2-CD2 3.7Å; W1393-H1397 AromaticContact CE2-CG 3.56Å; W1393-H1397 AromaticContact CE2-ND1 3.73Å; W1393-H1397 AromaticContact CE2-NE2 3.97Å; W1393-H1397 HydrophobicContact CE3-CB 4.37Å; W1393-H1397 AromaticContact CG-ND1 3.88Å; W1393-H1397 HydrophobicContact CH2-CB 4.05Å; W1393-H1397 HydrophobicContact CZ2-CB 3.88Å; W1393-H1397 AromaticContact CZ2-CD2 3.75Å; W1393-H1397 AromaticContact CZ2-CG 3.78Å; W1393-H1397 HydrophobicContact CZ3-CB 4.29Å; W1393-H1397 AromaticContact NE1-CD2 3.49Å; W1393-H1397 PolarHBondContact NE1-CD2 2.78Å; W1393-H1397 AromaticContact NE1-CE1 3.25Å; W1393-H1397 PolarHBondContact NE1-CE1 2.88Å; W1393-H1397 VanDerWaalsContact NE1-CE1 3.25Å; W1393-H1397 AromaticContact NE1-CG 3.58Å; W1393-H1397 AromaticContact NE1-ND1 3.38Å; W1393-H1397 PolarHBondContact NE1-ND1 3.3Å; W1393-H1397 AromaticContact NE1-NE2 3.26Å; W1393-H1397 PolarHBondContact NE1-NE2 3.16Å; W1393-H1397 WeakPolarHBondContact O-CB 3.23Å; W1393-H1397 PolarHBondContact O-N 3.47Å; W1393-H1397 PolarHBondContact O-ND1 2.77Å; F1394-H1397 CarbonylContact O-C 3.57Å; F1394-H1397 PolarHBondContact O-N 2.79Å; H1397-R1399 PolarHBondContact O-N 3.09Å; H1397-D1400 HydrophobicContact CB-CB 4.19Å; H1397-D1400 WeakPolarHBondContact CB-OD2 3.37Å; H1397-D1400 IonicContact CD2-OD2 2.8Å; H1397-D1400 PolarHBondContact CD2-OD2 3.16Å; H1397-D1400 IonicContact CG-OD2 3.3Å; H1397-D1400 WeakPolarHBondContact O-CB 3.46Å; H1397-D1400 PolarHBondContact O-N 2.8Å; H1397-D1400 VanDerWaalsContact O-N 3.09Å
1398	F	80.2	Confident	67.7	Low	28 Å²	28	90.7 Å²	90.7	12%	0.123	46%	0.458	C	S	.	.	S	Bend	trans	-65.4	-26.2	-176.4	74.2	-84.2	0	0	0	112.3	I1341 Y1359 P1361 F1394 K1395	I1341-F1398 HydrophobicContact CD1-CD2 4.15Å; I1341-F1398 HydrophobicContact CD1-CE1 3.92Å; I1341-F1398 HydrophobicContact CD1-CE2 3.43Å; I1341-F1398 VanDerWaalsContact CD1-CE2 3.43Å; I1341-F1398 HydrophobicContact CD1-CZ 3.29Å; Y1359-F1398 HydrophobicContact CE2-CB 4.38Å; P1361-F1398 HydrophobicContact CB-CD2 4Å; P1361-F1398 HydrophobicContact CB-CE2 3.81Å; F1394-F1398 HydrophobicContact CD2-CB 4.27Å; F1394-F1398 HydrophobicContact CE2-CB 3.85Å; F1394-F1398 HydrophobicContact CZ-CB 4.02Å; F1394-F1398 VanDerWaalsContact O-CA 3.3Å; F1394-F1398 WeakPolarHBondContact O-CA 3.29Å; F1394-F1398 VanDerWaalsContact O-CB 3.26Å; F1394-F1398 WeakPolarHBondContact O-CB 3.37Å; F1394-F1398 PolarHBondContact O-N 3Å; K1395-F1398 WeakPolarHBondContact O-CD1 3.29Å
1399	R	77.1	Confident	64.9	Low	189 Å²	189	90.4 Å²	90.4	71%	0.713	46%	0.46	S	S	*	.	S	Bend	trans	-83	-25.6	176.1	-66.5	-170.6	179.6	178.1	0.5	112.8	H1397 Q1401	H1397-R1399 PolarHBondContact O-N 3.09Å; R1399-Q1401 VanDerWaalsContact C-N 3.34Å; R1399-Q1401 PolarHBondContact O-N 3.15Å
1400	D	73.7	Confident	62.2	Low	80 Å²	80	92.9 Å²	92.9	43%	0.428	48%	0.475	S	S	.	.			trans	-56.5	105	-178.6	-65.8	3.9	0	0	0	107.2	R1380 H1397 Q1402	R1380-D1400 PolarHBondContact NH1-O 2.86Å; H1397-D1400 HydrophobicContact CB-CB 4.19Å; H1397-D1400 WeakPolarHBondContact CB-OD2 3.37Å; H1397-D1400 IonicContact CD2-OD2 2.8Å; H1397-D1400 PolarHBondContact CD2-OD2 3.16Å; H1397-D1400 IonicContact CG-OD2 3.3Å; H1397-D1400 WeakPolarHBondContact O-CB 3.46Å; H1397-D1400 PolarHBondContact O-N 2.8Å; H1397-D1400 VanDerWaalsContact O-N 3.09Å; D1400-Q1402 PolarHBondContact O-N 2.89Å; D1400-Q1402 VanDerWaalsContact O-N 3.14Å
1401	Q	50.8	Low	59.6	Low	166 Å²	166	96.8 Å²	96.8	78%	0.776	50%	0.503	S	S	*	.			trans	-64.6	117.9	173	-81.7	-176.6	-37.4	0	0	104.9	R1399 G1403	R1399-Q1401 VanDerWaalsContact C-N 3.34Å; R1399-Q1401 PolarHBondContact O-N 3.15Å; Q1401-G1403 VanDerWaalsContact C-N 3.28Å; Q1401-G1403 PolarHBondContact O-N 3.28Å
1402	Q	53.3	Low	56.9	Low	110 Å²	110	105.3 Å²	105.3	51%	0.514	54%	0.535	S	S	.	.			trans	-55.7	107.3	153	-115.4	176.9	-13.9	0	0	105.6	D1400 W1404	D1400-Q1402 PolarHBondContact O-N 2.89Å; D1400-Q1402 VanDerWaalsContact O-N 3.14Å; Q1402-W1404 PolarHBondContact O-N 2.75Å
1403	G	39.3	Very low	54.4	Low	60 Å²	60	103.4 Å²	103.4	62%	0.619	53%	0.534	S	S	*	.			trans	-48.4	117.3	147.3	0	0	0	0	0	104.8	Q1401 S1405	Q1401-G1403 VanDerWaalsContact C-N 3.28Å; Q1401-G1403 PolarHBondContact O-N 3.28Å; G1403-S1405 PolarHBondContact O-N 3.29Å
1404	W	32.8	Very low	51.9	Low	232 Å²	232	107.1 Å²	107.1	88%	0.879	56%	0.556	S	S	*	*			trans	-60.3	83.2	175.3	-87.2	49.7	0	0	0	107.9	Q1402 V1406	Q1402-W1404 PolarHBondContact O-N 2.75Å; W1404-V1406 HydrophobicContact CD2-CG2 4.19Å; W1404-V1406 HydrophobicContact CE3-CG2 3.42Å; W1404-V1406 VanDerWaalsContact CE3-CG2 3.42Å; W1404-V1406 HydrophobicContact CZ3-CG2 3.89Å; W1404-V1406 PolarHBondContact O-N 2.98Å
1405	S	29.7	Very low	49.4	Very low	104 Å²	104	108.9 Å²	108.9	73%	0.727	57%	0.572	S	S	*	*			trans	-84.7	69.7	151.5	66.9	0	0	0	0	105.5	G1403 P1407	G1403-S1405 PolarHBondContact O-N 3.29Å; S1405-P1407 WeakPolarHBondContact O-CD 3.49Å
1406	V	32.1	Very low	46.8	Very low	84 Å²	84	110.9 Å²	110.9	51%	0.509	58%	0.576	S	S	.	*			trans	-61.1	120.9	149.3	-177.5	0	0	0	0	103	W1404 L1408	W1404-V1406 HydrophobicContact CD2-CG2 4.19Å; W1404-V1406 HydrophobicContact CE3-CG2 3.42Å; W1404-V1406 VanDerWaalsContact CE3-CG2 3.42Å; W1404-V1406 HydrophobicContact CZ3-CG2 3.89Å; W1404-V1406 PolarHBondContact O-N 2.98Å; V1406-L1408 PolarHBondContact O-N 3.05Å
1407	P	30.8	Very low	44.7	Very low	97 Å²	97	109.1 Å²	109.1	63%	0.63	57%	0.57	S	S	*	*			trans	-50.2	119.5	168.6	-18.9	30	0	0	0	105.7	S1405 T1409	S1405-P1407 WeakPolarHBondContact O-CD 3.49Å; P1407-T1409 PolarHBondContact O-N 3.5Å
1408	L	27.9	Very low	42.6	Very low	168 Å²	168	111.8 Å²	111.8	88%	0.88	59%	0.586	S	S	*	*			trans	-63.4	73.5	166.3	-76.4	162.8	0	0	0	107.2	V1406	V1406-L1408 PolarHBondContact O-N 3.05Å
1409	T	32.9	Very low	40.6	Very low	89 Å²	89	115.3 Å²	115.3	55%	0.546	61%	0.605	S	S	.	*			trans	-103.4	78.3	148.6	59.6	0	0	0	0	104.2	P1407 S1411	P1407-T1409 PolarHBondContact O-N 3.5Å; T1409-S1411 PolarHBondContact O-N 2.91Å
1410	S	33.4	Very low	38.6	Very low	91 Å²	91	111.1 Å²	111.1	64%	0.636	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.1	23.2	175.5	54.8	0	0	0	0	113.9
1411	S	38.8	Very low	37.2	Very low	83 Å²	83	111.3 Å²	111.3	58%	0.58	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.2	-24	178.2	-168.4	0	0	0	0	113.2	T1409 A1415	T1409-S1411 PolarHBondContact O-N 2.91Å; S1411-A1415 WeakPolarHBondContact O-CB 3.48Å; S1411-A1415 PolarHBondContact O-N 3.5Å
1412	W	33	Very low	36.6	Very low	181 Å²	181	110 Å²	110	69%	0.686	59%	0.59	S	S	*	*	H	α-helix	trans	-94.5	-29.7	-174.9	-67.6	100.7	0	0	0	114	L1414 A1415 W1416	W1412-L1414 VanDerWaalsContact C-N 3.33Å; W1412-A1415 PolarHBondContact O-N 2.91Å; W1412-W1416 WeakPolarHBondContact O-CB 3.3Å; W1412-W1416 PolarHBondContact O-N 2.87Å
1413	V	38.8	Very low	35.9	Very low	98 Å²	98	109 Å²	109	59%	0.594	59%	0.587	S	S	*	*	H	α-helix	trans	-69	-34.3	176.2	178.6	0	0	0	0	111.2	I1417	V1413-I1417 HydrophobicContact CG1-CD1 4.02Å; V1413-I1417 WeakPolarHBondContact O-CB 3.36Å; V1413-I1417 VanDerWaalsContact O-CG1 3.26Å; V1413-I1417 WeakPolarHBondContact O-CG1 3.36Å; V1413-I1417 PolarHBondContact O-N 3.32Å
1414	L	37.1	Very low	35.6	Very low	111 Å²	111	111.5 Å²	111.5	58%	0.581	59%	0.585	S	S	*	*	H	α-helix	trans	-72.6	-40.9	172.5	-73	169.6	0	0	0	111.6	W1412 W1416 I1417 D1418	W1412-L1414 VanDerWaalsContact C-N 3.33Å; L1414-W1416 VanDerWaalsContact C-N 3.3Å; L1414-W1416 PolarHBondContact O-N 3.43Å; L1414-I1417 PolarHBondContact O-N 3.24Å; L1414-D1418 WeakPolarHBondContact O-CB 3.15Å; L1414-D1418 PolarHBondContact O-N 3.35Å
1415	A	38.3	Very low	35.6	Very low	42 Å²	42	108.1 Å²	108.1	35%	0.347	58%	0.579	S	S	.	*	H	α-helix	trans	-64.5	-32.7	175.6	0	0	0	0	0	113.2	S1411 W1412 L1419	S1411-A1415 WeakPolarHBondContact O-CB 3.48Å; S1411-A1415 PolarHBondContact O-N 3.5Å; W1412-A1415 PolarHBondContact O-N 2.91Å; A1415-L1419 WeakPolarHBondContact O-CB 3.44Å; A1415-L1419 PolarHBondContact O-N 3.37Å
1416	W	32.4	Very low	36	Very low	152 Å²	152	108.7 Å²	108.7	58%	0.576	58%	0.578	S	S	*	*	H	α-helix	trans	-79.2	-32.9	177.4	-119.9	72.8	0	0	0	113.2	W1412 L1414 L1419 Q1420	W1412-W1416 WeakPolarHBondContact O-CB 3.3Å; W1412-W1416 PolarHBondContact O-N 2.87Å; L1414-W1416 VanDerWaalsContact C-N 3.3Å; L1414-W1416 PolarHBondContact O-N 3.43Å; W1416-L1419 PolarHBondContact O-N 3.34Å; W1416-Q1420 HydrophobicContact CE3-CG 4.38Å; W1416-Q1420 HydrophobicContact CZ3-CG 4.42Å; W1416-Q1420 WeakPolarHBondContact O-CB 3.5Å; W1416-Q1420 PolarHBondContact O-N 2.94Å
1417	I	42.9	Very low	35.9	Very low	84 Å²	84	110.8 Å²	110.8	43%	0.431	59%	0.587	S	S	.	*	H	α-helix	trans	-67	-41.4	169.7	-70.2	169.4	0	0	0	109.6	V1413 L1414 L1419 Q1420 I1421	V1413-I1417 HydrophobicContact CG1-CD1 4.02Å; V1413-I1417 WeakPolarHBondContact O-CB 3.36Å; V1413-I1417 VanDerWaalsContact O-CG1 3.26Å; V1413-I1417 WeakPolarHBondContact O-CG1 3.36Å; V1413-I1417 PolarHBondContact O-N 3.32Å; L1414-I1417 PolarHBondContact O-N 3.24Å; I1417-L1419 PolarHBondContact O-N 3.33Å; I1417-Q1420 PolarHBondContact O-N 3.23Å; I1417-I1421 HydrophobicContact CG2-CD1 3.63Å; I1417-I1421 HydrophobicContact CG2-CG1 4.26Å; I1417-I1421 WeakPolarHBondContact O-CB 3.47Å; I1417-I1421 VanDerWaalsContact O-CG1 3.23Å; I1417-I1421 WeakPolarHBondContact O-CG1 2.97Å; I1417-I1421 PolarHBondContact O-N 3.32Å
1418	D	39.2	Very low	35.8	Very low	99 Å²	99	110.8 Å²	110.8	53%	0.529	59%	0.588	S	S	.	*	H	α-helix	trans	-66.6	-37.2	175.1	-76.4	-22	0	0	0	112.1	L1414 I1421 M1422	L1414-D1418 WeakPolarHBondContact O-CB 3.15Å; L1414-D1418 PolarHBondContact O-N 3.35Å; D1418-I1421 PolarHBondContact O-N 3.48Å; D1418-M1422 WeakPolarHBondContact O-CB 3.4Å; D1418-M1422 WeakPolarHBondContact O-CG 3.46Å; D1418-M1422 PolarHBondContact O-N 3Å
1419	L	38.4	Very low	35.8	Very low	101 Å²	101	111.5 Å²	111.5	53%	0.529	59%	0.586	S	S	.	*	H	α-helix	trans	-71.3	-35.8	175.4	-141.2	94.9	0	0	0	112.2	A1415 W1416 I1417 M1422 I1423	A1415-L1419 WeakPolarHBondContact O-CB 3.44Å; A1415-L1419 PolarHBondContact O-N 3.37Å; W1416-L1419 PolarHBondContact O-N 3.34Å; I1417-L1419 PolarHBondContact O-N 3.33Å; L1419-M1422 PolarHBondContact O-N 3.36Å; L1419-I1423 HydrophobicContact CD2-CD1 3.98Å; L1419-I1423 HydrophobicContact CG-CD1 4.33Å; L1419-I1423 WeakPolarHBondContact O-CB 3.39Å; L1419-I1423 WeakPolarHBondContact O-CG1 3.44Å; L1419-I1423 PolarHBondContact O-N 3.41Å
1420	Q	35.8	Very low	35.7	Very low	101 Å²	101	115.3 Å²	115.3	47%	0.472	60%	0.602	S	S	.	*	H	α-helix	trans	-73.7	-32.7	174	-94.2	-157.4	-34.4	0	0	112.7	W1416 I1417 M1422 I1423 L1424	W1416-Q1420 HydrophobicContact CE3-CG 4.38Å; W1416-Q1420 HydrophobicContact CZ3-CG 4.42Å; W1416-Q1420 WeakPolarHBondContact O-CB 3.5Å; W1416-Q1420 PolarHBondContact O-N 2.94Å; I1417-Q1420 PolarHBondContact O-N 3.23Å; Q1420-M1422 VanDerWaalsContact C-N 3.34Å; Q1420-I1423 PolarHBondContact O-N 3.5Å; Q1420-L1424 VanDerWaalsContact O-CB 3.23Å; Q1420-L1424 WeakPolarHBondContact O-CB 3.43Å; Q1420-L1424 PolarHBondContact O-N 3.22Å
1421	I	42.8	Very low	35.3	Very low	84 Å²	84	122.5 Å²	122.5	43%	0.431	62%	0.615	S	S	.	*	H	α-helix	trans	-66.4	-40.8	171.2	-70.6	171.5	0	0	0	109.2	I1417 D1418 I1423 L1424 E1425	I1417-I1421 HydrophobicContact CG2-CD1 3.63Å; I1417-I1421 HydrophobicContact CG2-CG1 4.26Å; I1417-I1421 WeakPolarHBondContact O-CB 3.47Å; I1417-I1421 VanDerWaalsContact O-CG1 3.23Å; I1417-I1421 WeakPolarHBondContact O-CG1 2.97Å; I1417-I1421 PolarHBondContact O-N 3.32Å; D1418-I1421 PolarHBondContact O-N 3.48Å; I1421-I1423 VanDerWaalsContact C-N 3.34Å; I1421-I1423 PolarHBondContact O-N 3.28Å; I1421-L1424 PolarHBondContact O-N 3.28Å; I1421-E1425 WeakPolarHBondContact O-CB 3.28Å; I1421-E1425 PolarHBondContact O-N 3.18Å
1422	M	38.4	Very low	34.7	Very low	139 Å²	139	125.9 Å²	125.9	69%	0.685	62%	0.621	S	S	*	*	H	α-helix	trans	-64.5	-35.3	171.8	-76.4	-156.9	-176.4	0	0	113.3	D1418 L1419 Q1420 V1426	D1418-M1422 WeakPolarHBondContact O-CB 3.4Å; D1418-M1422 WeakPolarHBondContact O-CG 3.46Å; D1418-M1422 PolarHBondContact O-N 3Å; L1419-M1422 PolarHBondContact O-N 3.36Å; Q1420-M1422 VanDerWaalsContact C-N 3.34Å; M1422-V1426 VanDerWaalsContact O-CG2 3.25Å; M1422-V1426 WeakPolarHBondContact O-CG2 3.25Å
1423	I	39.8	Very low	34.5	Very low	90 Å²	90	123.1 Å²	123.1	46%	0.462	63%	0.626	S	S	.	*	H	α-helix	trans	-81.6	-29.4	-179.4	-68.8	167.6	0	0	0	112.2	L1419 Q1420 I1421 N1427	L1419-I1423 HydrophobicContact CD2-CD1 3.98Å; L1419-I1423 HydrophobicContact CG-CD1 4.33Å; L1419-I1423 WeakPolarHBondContact O-CB 3.39Å; L1419-I1423 WeakPolarHBondContact O-CG1 3.44Å; L1419-I1423 PolarHBondContact O-N 3.41Å; Q1420-I1423 PolarHBondContact O-N 3.5Å; I1421-I1423 VanDerWaalsContact C-N 3.34Å; I1421-I1423 PolarHBondContact O-N 3.28Å; I1423-N1427 PolarHBondContact O-N 3.12Å
1424	L	31.5	Very low	33.9	Very low	112 Å²	112	125.2 Å²	125.2	59%	0.586	63%	0.633	S	S	*	*	H	α-helix	trans	-81.5	-29.1	176.1	-83.8	155.8	0	0	0	112.8	Q1420 I1421 V1426	Q1420-L1424 VanDerWaalsContact O-CB 3.23Å; Q1420-L1424 WeakPolarHBondContact O-CB 3.43Å; Q1420-L1424 PolarHBondContact O-N 3.22Å; I1421-L1424 PolarHBondContact O-N 3.28Å; L1424-V1426 PolarHBondContact O-N 2.86Å
1425	E	33.2	Very low	33.3	Very low	160 Å²	160	127.7 Å²	127.7	75%	0.748	65%	0.646	S	S	*	*	H	α-helix	trans	-72	-18.5	170.1	-77.3	-169.6	155.6	0	0	113	I1421	I1421-E1425 WeakPolarHBondContact O-CB 3.28Å; I1421-E1425 PolarHBondContact O-N 3.18Å
1426	V	38.7	Very low	32.7	Very low	116 Å²	116	134.8 Å²	134.8	70%	0.703	67%	0.672	S	S	*	*	H	α-helix	trans	-90.3	-18.3	177.8	177.3	0	0	0	0	113.4	M1422 L1424	M1422-V1426 VanDerWaalsContact O-CG2 3.25Å; M1422-V1426 WeakPolarHBondContact O-CG2 3.25Å; L1424-V1426 PolarHBondContact O-N 2.86Å
1427	N	30.8	Very low	32.2	Very low	129 Å²	129	139.1 Å²	139.1	69%	0.69	69%	0.689	S	S	*	*	H	α-helix	trans	-109.1	5.8	-172.8	-86.6	-38.1	0	0	0	117.1	I1423	I1423-N1427 PolarHBondContact O-N 3.12Å
1428	C	27.9	Very low	31.6	Very low	96 Å²	96	143 Å²	143	65%	0.649	71%	0.71	S	S	*	*	S	Bend	trans	-113.6	86	164.6	-87.1	0	0	0	0	108.4
1429	H	28.4	Very low	30.9	Very low	184 Å²	184	141.5 Å²	141.5	85%	0.852	72%	0.718	S	S	*	*			trans	174	49.7	146.7	-91.6	31.6	0	0	0	112
1430	I	30.3	Very low	30.4	Very low	169 Å²	169	148.2 Å²	148.2	87%	0.867	74%	0.736	S	S	*	*			trans	-134.5	66	158.9	-48.8	177.8	0	0	0	108.4
1431	R	25.8	Very low	30	Very low	242 Å²	242	149.8 Å²	149.8	91%	0.913	76%	0.755	S	S	*	*			trans	-97.6	116.5	152.3	-85.8	-170.4	-179	-170.5	1.4	107.3	P1433	R1431-P1433 WeakPolarHBondContact O-CD 3.41Å
1432	H	26.5	Very low	29.3	Very low	154 Å²	154	148.8 Å²	148.8	71%	0.713	77%	0.766	S	S	*	*			trans	-55.8	134.7	172.7	-141.8	-98	0	0	0	111
1433	P	28.5	Very low	28.6	Very low	122 Å²	122	154 Å²	154	79%	0.792	78%	0.778	S	S	*	*			trans	-141.2	96.9	140.3	28.4	-7.5	0	0	0	110.9	R1431	R1431-P1433 WeakPolarHBondContact O-CD 3.41Å
1434	L	24.7	Very low	27.9	Very low	142 Å²	142	159.7 Å²	159.7	74%	0.743	80%	0.799	S	S	*	*			trans	-76.7	109.1	147.8	-81.3	171.8	0	0	0	106
1435	L	24.7	Very low	27.5	Very low	163 Å²	163	165.4 Å²	165.4	85%	0.853	81%	0.813	S	S	*	*			trans	165.1	96.8	149	-90.8	162	0	0	0	108.4
1436	Q	27.3	Very low	27.1	Very low	192 Å²	192	166.2 Å²	166.2	90%	0.897	82%	0.822	S	S	*	*				-176.2	115.8	128	-101.4	169.5	0.3	0	0	110.1
1437	R	22	Very low	26.4	Very low	243 Å²	243	171.7 Å²	171.7	92%	0.917	83%	0.83	S	S	*	*			trans	-54.2	129.9	158.3	-97.1	170.2	157	171.6	-5.6	108.3
1438	D	30.1	Very low	26	Very low	165 Å²	165	170.2 Å²	170.2	88%	0.882	84%	0.836	S	S	*	*			trans	-157.4	131	139.6	-97.4	-30.5	0	0	0	110.9
1439	G	24.5	Very low	26	Very low	67 Å²	67	172 Å²	172	69%	0.691	84%	0.843	S	S	*	*			trans	-80.2	141.6	-173.7	0	0	0	0	0	113
1440	R	27.7	Very low	26	Very low	242 Å²	242	168.7 Å²	168.7	91%	0.913	84%	0.838	S	S	*	*				169.6	142.3	123.9	-88.9	164.6	-162.8	-160	6.4	110.1	G1442	R1440-G1442 PolarHBondContact O-N 3.41Å
1441	P	27.7	Very low	25.8	Very low	135 Å²	135	164.3 Å²	164.3	88%	0.877	84%	0.835	S	S	*	*			trans	-82.7	109.3	-172.2	32.3	-31.7	0	0	0	111.3
1442	G	27.4	Very low	25.9	Very low	63 Å²	63	161.6 Å²	161.6	65%	0.649	83%	0.832	S	S	*	*			trans	-102.2	120.3	173.8	0	0	0	0	0	111.7	R1440 F1444	R1440-G1442 PolarHBondContact O-N 3.41Å; G1442-F1444 PolarHBondContact O-N 3.5Å
1443	R	22.8	Very low	25.9	Very low	249 Å²	249	161 Å²	161	94%	0.94	84%	0.84	S	S	*	*			trans	-52.1	122.9	173.9	-70.8	171.2	168.5	178.5	-5	112.2
1444	F	26.5	Very low	25.8	Very low	208 Å²	208	164.4 Å²	164.4	91%	0.912	85%	0.845	S	S	*	*			trans	-113.7	127.1	160.9	-87.3	-85.1	0	0	0	110.8	G1442	G1442-F1444 PolarHBondContact O-N 3.5Å
1445	R	22.4	Very low	25.8	Very low	233 Å²	233	162 Å²	162	88%	0.879	85%	0.846	S	S	*	*			trans	-77.3	127.9	179.1	-69.1	173.4	173.5	175.4	-3.2	109.5
1446	L	24.1	Very low	26	Very low	176 Å²	176	159.9 Å²	159.9	92%	0.921	84%	0.842	S	S	*	*			trans	-115.3	132.9	160.9	-115.8	144.2	0	0	0	108.4
1447	W	24.2	Very low	25.9	Very low	231 Å²	231	159.3 Å²	159.3	88%	0.875	84%	0.84	S	S	*	*			trans	-73.5	133.1	-169.9	-73.5	32.1	0	0	0	111
1448	A	23.6	Very low	26	Very low	99 Å²	99	155.4 Å²	155.4	82%	0.818	84%	0.836	S	S	*	*			trans	-110.6	133.8	165.7	0	0	0	0	0	108
1449	V	26.7	Very low	25.8	Very low	132 Å²	132	153.5 Å²	153.5	80%	0.8	83%	0.83	S	S	*	*			trans	-122.5	139.4	163.8	176.5	0	0	0	0	107.6
1450	P	29.4	Very low	26	Very low	116 Å²	116	154.5 Å²	154.5	75%	0.753	83%	0.832	S	S	*	*			trans	-101.4	140.3	-148.9	35.1	-26.7	0	0	0	113.6
1451	G	26	Very low	25.9	Very low	77 Å²	77	148.3 Å²	148.3	79%	0.794	82%	0.821	S	S	*	*			trans	-110.8	108.2	161.1	0	0	0	0	0	109.4
1452	Q	26.4	Very low	26	Very low	184 Å²	184	147.8 Å²	147.8	86%	0.86	82%	0.818	S	S	*	*			trans	-73.5	123.7	170	-70.4	176.5	-26.4	0	0	109.6
1453	T	27.7	Very low	26	Very low	143 Å²	143	153.1 Å²	153.1	88%	0.877	83%	0.826	S	S	*	*			trans	-151.4	118.3	145.8	34.2	0	0	0	0	108.7
1454	Q	26.2	Very low	26.1	Very low	192 Å²	192	149.7 Å²	149.7	90%	0.897	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-66.7	124.4	-173.3	-67	163.5	-9.7	0	0	110.8
1455	A	25.1	Very low	26.2	Very low	93 Å²	93	145 Å²	145	77%	0.769	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-81	121.3	161.5	0	0	0	0	0	108.2
1456	P	28.6	Very low	26.3	Very low	117 Å²	117	139.2 Å²	139.2	76%	0.76	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-74.8	132	179.1	19.6	-14.4	0	0	0	110.8	L1458	P1456-L1458 PolarHBondContact O-N 3.21Å
1457	Q	24.3	Very low	26.3	Very low	181 Å²	181	138.7 Å²	138.7	85%	0.846	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-63.5	116.7	164.9	-70.8	177.6	-26.8	0	0	109.3
1458	L	24.7	Very low	26.5	Very low	160 Å²	160	132.8 Å²	132.8	84%	0.838	80%	0.795	S	S	*	*			trans	-115	95.2	158	-103.2	153.9	0	0	0	107.4	P1456 A1460	P1456-L1458 PolarHBondContact O-N 3.21Å; L1458-A1460 PolarHBondContact O-N 2.92Å
1459	V	25.7	Very low	26.7	Very low	125 Å²	125	134.6 Å²	134.6	76%	0.758	80%	0.796	S	S	*	*			trans	-67	105.4	163.1	175.4	0	0	0	0	106.5
1460	A	27.7	Very low	26.7	Very low	89 Å²	89	136.1 Å²	136.1	74%	0.736	80%	0.799	S	S	*	*			trans	-119.3	100.7	165.8	0	0	0	0	0	107.6	L1458	L1458-A1460 PolarHBondContact O-N 2.92Å
1461	T	26.7	Very low	26.6	Very low	111 Å²	111	139.1 Å²	139.1	68%	0.681	81%	0.805	S	S	*	*			trans	-56.1	142	172.4	30.9	0	0	0	0	111.5	Q1463	T1461-Q1463 PolarHBondContact O-N 3.32Å; T1461-Q1463 VanDerWaalsContact O-N 3.16Å
1462	P	29	Very low	26.8	Very low	125 Å²	125	140.6 Å²	140.6	81%	0.812	80%	0.801	S	S	*	*			trans	-77.3	101.3	175.7	30.2	-30.1	0	0	0	109.2	L1464	P1462-L1464 PolarHBondContact O-N 3.5Å
1463	Q	27.6	Very low	27	Very low	174 Å²	174	137.8 Å²	137.8	81%	0.813	80%	0.798	S	S	*	*			trans	-84.4	109.2	163.2	-82.1	-162.8	-25.5	0	0	109.5	T1461 V1465	T1461-Q1463 PolarHBondContact O-N 3.32Å; T1461-Q1463 VanDerWaalsContact O-N 3.16Å; Q1463-V1465 PolarHBondContact O-N 3.33Å
1464	L	25.1	Very low	27.1	Very low	178 Å²	178	137.6 Å²	137.6	93%	0.932	80%	0.797	S	S	*	*			trans	-49.7	103.2	158.6	-79.9	131.5	0	0	0	109.7	P1462	P1462-L1464 PolarHBondContact O-N 3.5Å
1465	V	28	Very low	27.1	Very low	110 Å²	110	136.9 Å²	136.9	67%	0.667	79%	0.794	S	S	*	*			trans	-117.9	101.1	158.9	-178.9	0	0	0	0	107	Q1463 M1467	Q1463-V1465 PolarHBondContact O-N 3.33Å; V1465-M1467 PolarHBondContact O-N 3.44Å
1466	S	24.5	Very low	27.3	Very low	111 Å²	111	138.2 Å²	138.2	78%	0.776	79%	0.794	S	S	*	*			trans	-55.6	111.5	167	51.1	0	0	0	0	110.2
1467	M	25.9	Very low	27.3	Very low	164 Å²	164	138 Å²	138	81%	0.808	80%	0.796	S	S	*	*			trans	-108.2	117.9	160.7	-88.3	-81.7	166.3	0	0	107.7	V1465 T1469	V1465-M1467 PolarHBondContact O-N 3.44Å; M1467-T1469 PolarHBondContact O-N 3.12Å
1468	P	28.3	Very low	27.5	Very low	108 Å²	108	138.2 Å²	138.2	70%	0.701	80%	0.799	S	S	*	*			trans	-79.6	106.5	-176	30.1	-30.3	0	0	0	109.9	L1470	P1468-L1470 PolarHBondContact O-N 3.29Å; P1468-L1470 VanDerWaalsContact O-N 3.08Å
1469	T	27.3	Very low	27.6	Very low	137 Å²	137	135.2 Å²	135.2	84%	0.84	80%	0.797	S	S	*	*			trans	-76.7	94.5	165.2	-5.4	0	0	0	0	108.4	M1467 M1471	M1467-T1469 PolarHBondContact O-N 3.12Å; T1469-M1471 PolarHBondContact O-N 3.11Å
1470	L	27.1	Very low	27.7	Very low	163 Å²	163	133.4 Å²	133.4	85%	0.853	79%	0.79	S	S	*	*			trans	-52.9	95.2	163.9	-76.2	145.7	0	0	0	109.4	P1468	P1468-L1470 PolarHBondContact O-N 3.29Å; P1468-L1470 VanDerWaalsContact O-N 3.08Å
1471	M	25.9	Very low	27.7	Very low	179 Å²	179	134.6 Å²	134.6	88%	0.882	79%	0.79	S	S	*	*			trans	-82.3	127.4	156.6	-84.5	-163.1	147.4	0	0	108.2	T1469	T1469-M1471 PolarHBondContact O-N 3.11Å
1472	P	31.7	Very low	27.7	Very low	109 Å²	109	139.6 Å²	139.6	71%	0.708	80%	0.798	S	S	*	*			trans	-64.8	149.4	-176.2	25.4	-32.5	0	0	0	111.5	T1474	P1472-T1474 PolarHBondContact O-N 3.3Å; P1472-T1474 VanDerWaalsContact O-N 3.11Å
1473	P	30.7	Very low	27.5	Very low	125 Å²	125	138.1 Å²	138.1	81%	0.812	80%	0.797	S	S	*	*			trans	-67.5	110.7	-176.8	27.3	-32.5	0	0	0	110	Q1475	P1473-Q1475 PolarHBondContact O-N 3.26Å; P1473-Q1475 VanDerWaalsContact O-N 3.14Å
1474	T	28.2	Very low	27.4	Very low	138 Å²	138	136 Å²	136	85%	0.847	80%	0.796	S	S	*	*			trans	-67.4	106.7	162.2	48.1	0	0	0	0	107.4	P1472	P1472-T1474 PolarHBondContact O-N 3.3Å; P1472-T1474 VanDerWaalsContact O-N 3.11Å
1475	Q	26.7	Very low	27.5	Very low	177 Å²	177	140 Å²	140	83%	0.827	81%	0.806	S	S	*	*			trans	-53.8	139	171.8	-80.8	-175.6	-38.7	0	0	110.1	P1473 S1477	P1473-Q1475 PolarHBondContact O-N 3.26Å; P1473-Q1475 VanDerWaalsContact O-N 3.14Å; Q1475-S1477 PolarHBondContact O-N 3.38Å
1476	P	30.2	Very low	27.5	Very low	121 Å²	121	141.6 Å²	141.6	79%	0.786	81%	0.813	S	S	*	*			trans	-69.3	102.8	175.3	28.4	-30.4	0	0	0	108.1	M1478	P1476-M1478 PolarHBondContact O-N 3.36Å; P1476-M1478 VanDerWaalsContact O-N 3.15Å
1477	S	27.7	Very low	27.6	Very low	113 Å²	113	143.2 Å²	143.2	79%	0.79	82%	0.815	S	S	*	*			trans	-64.1	115.1	165.4	58.2	0	0	0	0	107.2	Q1475 A1479	Q1475-S1477 PolarHBondContact O-N 3.38Å; S1477-A1479 PolarHBondContact O-N 3.43Å
1478	M	29	Very low	27.7	Very low	186 Å²	186	142 Å²	142	92%	0.916	82%	0.815	S	S	*	*			trans	-49.4	115.6	175.1	-62.2	-153.4	-153.1	0	0	109.7	P1476 S1480	P1476-M1478 PolarHBondContact O-N 3.36Å; P1476-M1478 VanDerWaalsContact O-N 3.15Å; M1478-S1480 PolarHBondContact O-N 3.05Å
1479	A	27.1	Very low	27.7	Very low	96 Å²	96	144 Å²	144	79%	0.793	82%	0.822	S	S	*	*			trans	-65.9	103.7	165.8	0	0	0	0	0	107.2	S1477	S1477-A1479 PolarHBondContact O-N 3.43Å
1480	S	27.1	Very low	27.7	Very low	87 Å²	87	144.4 Å²	144.4	61%	0.608	82%	0.821	S	S	*	*			trans	-64.5	128.4	165.7	176.2	0	0	0	0	108.2	M1478 Y1482	M1478-S1480 PolarHBondContact O-N 3.05Å; S1480-Y1482 PolarHBondContact O-N 3.31Å; S1480-Y1482 VanDerWaalsContact O-N 3.09Å
1481	P	27.9	Very low	27.8	Very low	114 Å²	114	143.2 Å²	143.2	74%	0.74	82%	0.819	S	S	*	*	S	Bend	trans	-77.1	13.7	-171.8	22.1	-20.2	0	0	0	115.4	A1483	P1481-A1483 VanDerWaalsContact C-N 3.31Å; P1481-A1483 PolarHBondContact O-N 3.31Å; P1481-A1483 VanDerWaalsContact O-N 3.1Å
1482	Y	27.3	Very low	27.9	Very low	216 Å²	216	140.6 Å²	140.6	85%	0.847	81%	0.814	S	S	*	*			trans	-88.6	66.1	175.9	-75.1	-83.8	0	0	0	111.9	S1480	S1480-Y1482 PolarHBondContact O-N 3.31Å; S1480-Y1482 VanDerWaalsContact O-N 3.09Å
1483	A	24.8	Very low	27.6	Very low	95 Å²	95	143.1 Å²	143.1	79%	0.785	82%	0.822	S	S	*	*			trans	-136.9	50.6	166.9	0	0	0	0	0	110.4	P1481	P1481-A1483 VanDerWaalsContact C-N 3.31Å; P1481-A1483 PolarHBondContact O-N 3.31Å; P1481-A1483 VanDerWaalsContact O-N 3.1Å
1484	T	25.3	Very low	27.3	Very low	130 Å²	130	144.6 Å²	144.6	80%	0.798	82%	0.823	S	S	*	*			trans	-116.9	87.8	158.3	28.1	0	0	0	0	107.3
1485	K	26.8	Very low	27.3	Very low	262 Å²	262	145.2 Å²	145.2	100%	1.139	82%	0.821	S	S	*	*			trans	-168.1	0	149.5	-110.3	-177	-177.7	-171.9	0	110

Retrieved 1,485 of 1,485 residues in 2742.4 ms (Link to these results)

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