A0A087Y7E1_POEFO Loading...

Arf-GAP with GTPase, ANK repeat and PH domain-containing protein 3

GTPase-activating protein for the ADP ribosylation factor family. GTPase which may be involved in the degradation of expanded polyglutamine proteins through the ubiquitin-proteasome pathway.

AlphaFold DB , UniProt , Accession A0A087Y7E1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 926 aa.

						>A0A087Y7E1_POEFO|A0A087Y7E1
MNFQSSVPVSGISQQSQPAMPTPGTVPAPVPVPVPQSIPSQFGSGSSASSGAGQFGSGTVSGQAAQSGPAGSQFVLSNSAAIRAEIHRFESVHPNIYAIYDLIERIDDLALQNQIREHVISIEDSFVNSQEWTLSRSVPELKVGIVGNLSSGKSALVHRYLTGTYVQEESPEGGRFKKEIVVDGQSYLLLIRDEGGPPELQFAAWVDAVVFVFSLEDEISFQTVYNYFLRLSSYRNTAEVPMVLVGTQDAISAANPRVIDDSRARKLSNDLKRCTYYETCSTYGLNVERVFQDVAQKVVAMRKKQQLSIGPCKSLPNSPSHSSVPAASIPSVHLNQAANGGGAFSDYSSSVPSTPSISQREMRIETIAASNTPTPIRKQSKRRSNIFTSRKGSEQGKSVDSKTDSIGSGRAIPIKQGILLKRSGKSLNKEWKKKYVTLCDNGVLTYHPSLHDYMQNVHGKEIDLLRTTVKVPGKRPPRAVATVAPSASPKTNGLTKDRSALQLGIGNTGATHSNSSISLQAGGSAFGGSKDGMHQRSFSVSSADQWNEAINTSTNSAAPNGMTDPATSSMGSATSPKLEPPPSPHANRKKHRRKKSTGITKPDGLSAGNDEQEDSFEFIIVSLTGQTWNFEASTYEERELWVQAIESQIFASLQSCESIKNKSRLGSQSDAMAIQSIRNVRGNSFCVDCDAPNPDWASLNLGALMCIECSGMHRNLGTHLSRVRSLDLDDWPVELSMVMTAIGNAMANSVWEGCLEGYTKPGNDSTREEKERWIRAKYEQKLFLVGLPQSDVPLGQQLLRAVVEDDLRLVVLLLAHGTKEEVNETYGDGDGRTALHLSCAMANVVITQLLIWYGVDVKSRDARSQTPLSYARRAGSQECADILLQHGCPNDSSSLSSVPTSSVSLRNPNINNNNAQCELNRSISIM
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.7	Very low	34.7	Very low	228 Å²	228	129.4 Å²	129.4	100%	1.123	77%	0.765	S	S	*	*				0	148	0	-56.3	171.2	-173.3	0	0	107.5
2	N	32.3	Very low	34.5	Very low	134 Å²	134	132.8 Å²	132.8	72%	0.717	77%	0.774	S	S	*	*			cis	-170.2	149.5	-18.6	-91.7	-0.5	0	0	0	103.1
3	F	32.2	Very low	34.2	Very low	155 Å²	155	129.7 Å²	129.7	68%	0.68	77%	0.765	S	S	*	*			cis	-147.1	157.9	8.5	-119.4	-153.5	0	0	0	107.1
4	Q	34.7	Very low	34.1	Very low	151 Å²	151	133.3 Å²	133.3	71%	0.706	77%	0.77	S	S	*	*				42.4	141.1	94.9	-63.8	-173.2	-11.7	0	0	116.3
5	S	36.4	Very low	34.2	Very low	92 Å²	92	136.8 Å²	136.8	64%	0.643	78%	0.777	S	S	*	*			cis	-176.7	153.5	-12.3	49.2	0	0	0	0	111.3
6	S	34.3	Very low	34	Very low	101 Å²	101	134.4 Å²	134.4	71%	0.706	77%	0.772	S	S	*	*			trans	36.2	137.8	143.7	64.6	0	0	0	0	122.7
7	V	31	Very low	33.7	Very low	137 Å²	137	137.6 Å²	137.6	83%	0.83	78%	0.778	S	S	*	*				-169.1	149.7	108.1	139.8	0	0	0	0	111.6
8	P	48.5	Very low	35	Very low	108 Å²	108	136.1 Å²	136.1	70%	0.701	77%	0.774	S	S	*	*			trans	-137.6	-167	-160.6	29.9	-3.4	0	0	0	116.6
9	V	35.4	Very low	34.7	Very low	128 Å²	128	134.3 Å²	134.3	78%	0.776	78%	0.778	S	S	*	*			trans	89.4	111.6	154.2	-168.8	0	0	0	0	120.5
10	S	30.9	Very low	34.8	Very low	124 Å²	124	136.5 Å²	136.5	87%	0.867	78%	0.783	S	S	*	*				167	147.8	119.8	43.5	0	0	0	0	110.5
11	G	32.3	Very low	35.1	Very low	65 Å²	65	135.9 Å²	135.9	67%	0.67	78%	0.784	S	S	*	*			cis	167.2	161.6	-11.4	0	0	0	0	0	111.7
12	I	32	Very low	35.3	Very low	170 Å²	170	131.2 Å²	131.2	87%	0.872	77%	0.768	S	S	*	*			trans	73.2	136.6	163.8	-57.6	169	0	0	0	116.2
13	S	30.8	Very low	36	Very low	93 Å²	93	130.6 Å²	130.6	65%	0.65	77%	0.772	S	S	*	*			cis	-165.8	152.3	-17.1	-99.6	0	0	0	0	114.1
14	Q	32.4	Very low	36	Very low	180 Å²	180	126.9 Å²	126.9	84%	0.841	78%	0.777	S	S	*	*			trans	64.7	117.2	145.9	-66.1	179	4.5	0	0	124.9
15	Q	35.5	Very low	35.8	Very low	186 Å²	186	126.7 Å²	126.7	87%	0.869	79%	0.787	S	S	*	*			trans	-7.2	159.7	133.4	-77.7	166.9	-11.8	0	0	121.1
16	S	32.5	Very low	35.8	Very low	99 Å²	99	128.5 Å²	128.5	69%	0.692	79%	0.793	S	S	*	*			cis	-173.7	146.5	-0.6	46.2	0	0	0	0	116.3
17	Q	28.7	Very low	35.8	Very low	188 Å²	188	129.5 Å²	129.5	88%	0.879	80%	0.797	S	S	*	*			trans	67.7	162.3	142.7	-73.8	-100.4	-24.3	0	0	121.1
18	P	55.8	Low	35.8	Very low	110 Å²	110	127.5 Å²	127.5	71%	0.714	80%	0.796	S	S	*	*			trans	-121.9	177.7	-143.2	45	-37.3	0	0	0	118.5
19	A	29.5	Very low	35.6	Very low	102 Å²	102	128.2 Å²	128.2	84%	0.843	80%	0.8	S	S	*	*			trans	-152.3	164.6	164.1	0	0	0	0	0	113.2
20	M	36.9	Very low	35.4	Very low	178 Å²	178	128.8 Å²	128.8	88%	0.877	80%	0.804	S	S	*	*			trans	-103.4	165.5	179.4	-54.8	-165.6	-52.9	0	0	113.7
21	P	41.4	Very low	35.8	Very low	125 Å²	125	128.4 Å²	128.4	81%	0.812	80%	0.798	S	S	*	*			trans	-123.8	152.8	163.3	38.9	-27.4	0	0	0	115.8
22	T	37	Very low	35.8	Very low	129 Å²	129	131.4 Å²	131.4	79%	0.791	80%	0.803	S	S	*	*			trans	-151.6	169.3	166.3	55.1	0	0	0	0	108.6
23	P	46.9	Very low	36	Very low	122 Å²	122	129 Å²	129	79%	0.792	80%	0.799	S	S	*	*			cis	-134.2	147.8	-42.1	35.3	-19.6	0	0	0	114.9
24	G	32.3	Very low	36.1	Very low	77 Å²	77	130.5 Å²	130.5	79%	0.794	80%	0.804	S	S	*	*			trans	80	135.9	143.3	0	0	0	0	0	121.7
25	T	30.7	Very low	36.2	Very low	147 Å²	147	127.6 Å²	127.6	90%	0.902	80%	0.8	S	S	*	*			trans	-176.8	160	138.2	-74.1	0	0	0	0	109.1
26	V	37.6	Very low	35.8	Very low	129 Å²	129	127.5 Å²	127.5	78%	0.782	80%	0.8	S	S	*	*			trans	-115.2	146.4	-164.3	177.5	0	0	0	0	113.4
27	P	34.4	Very low	35.6	Very low	122 Å²	122	127.9 Å²	127.9	79%	0.792	80%	0.803	S	S	*	*			trans	-120.7	173.6	148.3	16.8	4.4	0	0	0	114
28	A	31.5	Very low	35.6	Very low	96 Å²	96	126.4 Å²	126.4	79%	0.793	80%	0.799	S	S	*	*			trans	-105.1	169.2	-156.6	0	0	0	0	0	116.9
29	P	43.3	Very low	34.5	Very low	123 Å²	123	126.7 Å²	126.7	80%	0.799	80%	0.801	S	S	*	*			trans	-113.8	137.1	-170.1	38.8	-28.3	0	0	0	116.4
30	V	32	Very low	34.3	Very low	139 Å²	139	127 Å²	127	84%	0.842	80%	0.797	S	S	*	*			trans	-161	151.2	176	-171.8	0	0	0	0	109.2
31	P	38.5	Very low	33.9	Very low	116 Å²	116	127.6 Å²	127.6	75%	0.753	80%	0.797	S	S	*	*			cis	-122.2	-175.9	-27.9	36.9	-20.7	0	0	0	113.4
32	V	32.1	Very low	33.2	Very low	128 Å²	128	131.9 Å²	131.9	78%	0.776	80%	0.804	S	S	*	*			trans	-118.6	138.9	164.3	177	0	0	0	0	109.3
33	P	35.8	Very low	32.6	Very low	121 Å²	121	128.9 Å²	128.9	79%	0.786	80%	0.798	S	S	*	*			trans	-80.7	161.4	-179.9	32.7	-36.2	0	0	0	114.1
34	V	34.3	Very low	31.6	Very low	123 Å²	123	129.2 Å²	129.2	75%	0.745	80%	0.804	S	S	*	*			trans	-131.1	133.2	-174.6	174.6	0	0	0	0	111.6
35	P	32.8	Very low	31.2	Very low	119 Å²	119	128.7 Å²	128.7	77%	0.773	80%	0.798	S	S	*	*			trans	-109.1	113.9	146.6	28.6	-15.2	0	0	0	109
36	Q	28.4	Very low	30.9	Very low	184 Å²	184	127.5 Å²	127.5	86%	0.86	80%	0.796	S	S	*	*				69.1	138.5	79.1	-68.6	-162	-2.3	0	0	114.5
37	S	27.4	Very low	30.3	Very low	107 Å²	107	126.3 Å²	126.3	75%	0.748	79%	0.794	S	S	*	*			trans	-116.1	-162	-162.8	56.6	0	0	0	0	112.2
38	I	29.1	Very low	29.9	Very low	158 Å²	158	125 Å²	125	81%	0.81	79%	0.792	S	S	*	*			trans	102.2	130.3	169.6	-56.8	154.5	0	0	0	114
39	P	31.9	Very low	29.6	Very low	115 Å²	115	125.1 Å²	125.1	75%	0.747	79%	0.788	S	S	*	*			cis	-130.6	-159.1	-37.2	38.6	-18.7	0	0	0	110.7
40	S	26.7	Very low	28.7	Very low	108 Å²	108	124.8 Å²	124.8	76%	0.755	79%	0.789	S	S	*	*			trans	-120.4	150.2	160.3	55.8	0	0	0	0	111.2
41	Q	27.9	Very low	28.4	Very low	191 Å²	191	121.8 Å²	121.8	89%	0.893	79%	0.785	S	S	*	*			trans	-132.1	161.2	170.4	-81.8	-163.5	-11.2	0	0	111.5
42	F	26	Very low	27.7	Very low	215 Å²	215	121.4 Å²	121.4	94%	0.943	79%	0.792	S	S	*	*			trans	-107	152.8	-169.8	-95.4	-108.4	0	0	0	112.7
43	G	25.7	Very low	27.4	Very low	66 Å²	66	118.9 Å²	118.9	68%	0.68	79%	0.792	S	S	*	*			trans	161.6	114.7	161.7	0	0	0	0	0	110.1
44	S	25.3	Very low	26.9	Very low	129 Å²	129	121.2 Å²	121.2	90%	0.902	79%	0.792	S	S	*	*			cis	93.1	125.1	30.1	86.4	0	0	0	0	114.5
45	G	24.8	Very low	26.4	Very low	66 Å²	66	124.6 Å²	124.6	68%	0.68	80%	0.797	S	S	*	*			trans	121.2	125	-171.3	0	0	0	0	0	110.4
46	S	24.6	Very low	26	Very low	123 Å²	123	122.6 Å²	122.6	86%	0.86	80%	0.799	S	S	*	*			cis	71.2	138.4	43	-53.4	0	0	0	0	112.8
47	S	24.9	Very low	25.8	Very low	104 Å²	104	119.8 Å²	119.8	73%	0.727	80%	0.799	S	S	*	*			cis	-174.4	171	-12.2	46.8	0	0	0	0	108.7
48	A	24.7	Very low	25.7	Very low	93 Å²	93	118.4 Å²	118.4	77%	0.769	80%	0.801	S	S	*	*			trans	68.1	159.6	163.3	0	0	0	0	0	116.6
49	S	25.2	Very low	25.5	Very low	99 Å²	99	117.2 Å²	117.2	69%	0.692	80%	0.802	S	S	*	*			cis	-168.7	149	-19.1	47.4	0	0	0	0	113.3
50	S	24.3	Very low	25.3	Very low	117 Å²	117	118.8 Å²	118.8	82%	0.818	81%	0.809	S	S	*	*			trans	54.9	139.8	138.1	65.8	0	0	0	0	123.7
51	G	25.7	Very low	25.2	Very low	75 Å²	75	119.3 Å²	119.3	77%	0.773	81%	0.813	S	S	*	*			trans	119.4	103.8	166.1	0	0	0	0	0	111.9
52	A	24.3	Very low	25.1	Very low	109 Å²	109	114 Å²	114	90%	0.901	81%	0.809	S	S	*	*			cis	88.3	132.4	22.8	0	0	0	0	0	115.5
53	G	25.6	Very low	25	Very low	74 Å²	74	113.4 Å²	113.4	76%	0.763	81%	0.809	S	S	*	*			trans	95.8	106.6	-167.3	0	0	0	0	0	111.5
54	Q	25.2	Very low	25	Very low	170 Å²	170	115.2 Å²	115.2	79%	0.794	82%	0.818	S	S	*	*			cis	90.6	124.4	14.3	-143.2	-167.3	22.1	0	0	116.3
55	F	23.4	Very low	25	Very low	194 Å²	194	114 Å²	114	85%	0.851	82%	0.816	S	S	*	*			trans	68.4	141.4	173	-69.9	-68.7	0	0	0	120
56	G	25	Very low	25.2	Very low	78 Å²	78	120.5 Å²	120.5	80%	0.804	83%	0.828	S	S	*	*			trans	158.8	73	179.4	0	0	0	0	0	112.4
57	S	24.3	Very low	25.5	Very low	125 Å²	125	120.7 Å²	120.7	87%	0.874	83%	0.83	S	S	*	*			trans	-86	144.8	176.8	-169.9	0	0	0	0	111.5
58	G	25.5	Very low	25.7	Very low	77 Å²	77	118.9 Å²	118.9	79%	0.794	83%	0.827	S	S	*	*			trans	-168.4	80.4	-177.5	0	0	0	0	0	114.3
59	T	25	Very low	26.1	Very low	134 Å²	134	120.6 Å²	120.6	82%	0.822	83%	0.83	S	S	*	*			trans	-94	121	174.9	51.6	0	0	0	0	112.3
60	V	26.7	Very low	26.2	Very low	148 Å²	148	119.5 Å²	119.5	90%	0.897	83%	0.828	S	S	*	*			trans	-134.4	145.4	156.4	179.4	0	0	0	0	108.6
61	S	25.6	Very low	26.6	Very low	119 Å²	119	116.2 Å²	116.2	83%	0.832	81%	0.812	S	S	*	*			trans	-91.6	154.9	-168.8	46.4	0	0	0	0	114.4
62	G	24.6	Very low	27	Very low	79 Å²	79	117.4 Å²	117.4	81%	0.814	81%	0.809	S	S	*	*			trans	-167.6	101.9	168.7	0	0	0	0	0	110.5
63	Q	25.1	Very low	27.4	Very low	203 Å²	203	120.3 Å²	120.3	95%	0.949	80%	0.804	S	S	*	*			trans	-85	134.8	-179.1	-72.8	179.4	-21.9	0	0	111.8
64	A	24.8	Very low	28	Very low	104 Å²	104	124 Å²	124	86%	0.86	80%	0.799	S	S	*	*			trans	-146.7	110	153.8	0	0	0	0	0	108.4
65	A	26.3	Very low	28.9	Very low	104 Å²	104	119.4 Å²	119.4	86%	0.86	78%	0.782	S	S	*	*			trans	-95.3	128.7	179.3	0	0	0	0	0	110.6
66	Q	27.8	Very low	30	Very low	202 Å²	202	116.9 Å²	116.9	94%	0.944	78%	0.777	S	S	*	*			trans	-133.5	137	158.8	-72.2	-165.9	-6	0	0	109.4
67	S	32.2	Very low	31.4	Very low	127 Å²	127	116.8 Å²	116.8	89%	0.888	76%	0.764	S	S	*	*			trans	-101.4	120.9	-168.5	51.8	0	0	0	0	112.2
68	G	28.2	Very low	33.4	Very low	65 Å²	65	112.1 Å²	112.1	67%	0.67	73%	0.729	S	S	*	*			trans	-119.4	154.1	166.5	0	0	0	0	0	111.1	A70	G68-A70 PolarHBondContact O-N 2.84Å
69	P	34.1	Very low	35.8	Very low	129 Å²	129	109.4 Å²	109.4	84%	0.838	70%	0.698	S	S	*	*			trans	-79.2	110.1	-165.1	29.9	-35.2	0	0	0	113.7	G71	P69-G71 PolarHBondContact O-N 3.38Å
70	A	27.3	Very low	38.1	Very low	77 Å²	77	105.7 Å²	105.7	64%	0.636	68%	0.681	S	S	*	*			trans	-74.8	39.8	171.2	0	0	0	0	0	113.5	G68	G68-A70 PolarHBondContact O-N 2.84Å
71	G	32.1	Very low	40.3	Very low	48 Å²	48	100.4 Å²	100.4	50%	0.495	65%	0.653	S	S	.	*			trans	-80.3	-34.7	-169.5	0	0	0	0	0	115.3	P69	P69-G71 PolarHBondContact O-N 3.38Å
72	S	34	Very low	42.7	Very low	100 Å²	100	94.7 Å²	94.7	70%	0.699	61%	0.613	S	S	*	*	H	α-helix	trans	-77.4	-30.3	-170.3	49.6	0	0	0	0	114.4
73	Q	32.8	Very low	45.4	Very low	169 Å²	169	97.3 Å²	97.3	79%	0.79	60%	0.598	S	S	*	*	H	α-helix	trans	-75.5	-25.3	-174.5	-120.3	174.7	-6.1	0	0	113.8
74	F	37.4	Very low	47.7	Very low	152 Å²	152	90.6 Å²	90.6	67%	0.667	58%	0.577	S	S	*	*	H	α-helix	trans	-75.6	-31.1	179.5	-89.4	-86.3	0	0	0	113.8	L76 S77	F74-L76 PolarHBondContact O-N 3.32Å; F74-S77 PolarHBondContact O-N 2.77Å
75	V	44.1	Very low	50.1	Low	73 Å²	73	86.6 Å²	86.6	44%	0.442	54%	0.541	S	S	.	.	H	α-helix	trans	-62.6	-42.5	-174.2	-175.5	0	0	0	0	111.6	S77	V75-S77 VanDerWaalsContact C-N 3.33Å; V75-S77 PolarHBondContact O-N 3.26Å
76	L	46.6	Very low	52.5	Low	142 Å²	142	82.5 Å²	82.5	74%	0.743	50%	0.504	S	S	*	.	H	α-helix	trans	-71.5	-24.9	179.7	-65.9	171.6	0	0	0	113.4	F74	F74-L76 PolarHBondContact O-N 3.32Å
77	S	54.8	Low	54.8	Low	75 Å²	75	79.3 Å²	79.3	52%	0.524	49%	0.489	S	S	.	.	H	α-helix	trans	-69.4	-36.6	-176.1	-167.5	0	0	0	0	113.1	F74 V75	F74-S77 PolarHBondContact O-N 2.77Å; V75-S77 VanDerWaalsContact C-N 3.33Å; V75-S77 PolarHBondContact O-N 3.26Å
78	N	65.8	Low	56.8	Low	27 Å²	27	76.7 Å²	76.7	14%	0.144	46%	0.46	C	S	.	.	H	α-helix	trans	-75.3	-37.9	-175	-74.7	-11	0	0	0	112.5	A80 A81 I82 S137	N78-A80 VanDerWaalsContact C-N 3.31Å; N78-A80 PolarHBondContact O-N 3.14Å; N78-A81 PolarHBondContact O-N 3.41Å; N78-A81 VanDerWaalsContact O-N 3.15Å; N78-I82 HydrophobicContact CB-CD1 4.47Å; N78-I82 WeakPolarHBondContact O-CD1 3.4Å; N78-I82 VanDerWaalsContact O-CG1 3.27Å; N78-I82 WeakPolarHBondContact O-CG1 3.39Å; N78-I82 PolarHBondContact O-N 3.25Å; N78-S137 PolarHBondContact ND2-O 3.33Å
79	S	75.4	Confident	59	Low	20 Å²	20	73.9 Å²	73.9	14%	0.14	43%	0.429	C	S	.	.	H	α-helix	trans	-60.3	-37.5	-178.3	-176.1	0	0	0	0	112.9	R83 E179	S79-R83 PolarHBondContact O-N 2.72Å; S79-R83 PolarHBondContact OG-NH1 3.07Å; S79-R83 PolarHBondContact OG-NH2 3.02Å; S79-E179 WeakPolarHBondContact CA-OE1 3.41Å; S79-E179 VanDerWaalsContact CB-OE1 3.31Å; S79-E179 WeakPolarHBondContact CB-OE1 3.48Å; S79-E179 PolarHBondContact OG-OE1 2.81Å
80	A	74.6	Confident	61.1	Low	57 Å²	57	72.8 Å²	72.8	47%	0.471	41%	0.413	S	S	.	.	H	α-helix	trans	-68	-41.6	174.6	0	0	0	0	0	112.8	N78 A84	N78-A80 VanDerWaalsContact C-N 3.31Å; N78-A80 PolarHBondContact O-N 3.14Å; A80-A84 PolarHBondContact O-N 2.89Å; A80-A84 VanDerWaalsContact O-N 3.11Å
81	A	71.9	Confident	63.4	Low	36 Å²	36	72.1 Å²	72.1	30%	0.298	40%	0.404	S	S	.	.	H	α-helix	trans	-66.3	-40	177.2	0	0	0	0	0	112.2	N78 A84 E85 V138	N78-A81 PolarHBondContact O-N 3.41Å; N78-A81 VanDerWaalsContact O-N 3.15Å; A81-A84 PolarHBondContact O-N 2.97Å; A81-E85 PolarHBondContact O-N 3.44Å; A81-E85 VanDerWaalsContact O-N 3.08Å; A81-V138 HydrophobicContact CB-CG2 4.07Å
82	I	77	Confident	65.4	Low	0 Å²	0	72 Å²	72	0%	0	39%	0.393	C	S	.	.	H	α-helix	trans	-59.2	-50.3	175.9	-70.4	162.6	0	0	0	110.6	N78 A84 E85 I86 V138 E179 L188	N78-I82 HydrophobicContact CB-CD1 4.47Å; N78-I82 WeakPolarHBondContact O-CD1 3.4Å; N78-I82 VanDerWaalsContact O-CG1 3.27Å; N78-I82 WeakPolarHBondContact O-CG1 3.39Å; N78-I82 PolarHBondContact O-N 3.25Å; I82-A84 VanDerWaalsContact C-N 3.34Å; I82-A84 PolarHBondContact O-N 3.46Å; I82-E85 PolarHBondContact O-N 3.19Å; I82-I86 HydrophobicContact CG2-CD1 3.66Å; I82-I86 HydrophobicContact CG2-CG1 4.5Å; I82-I86 WeakPolarHBondContact O-CG1 3.09Å; I82-I86 PolarHBondContact O-N 3.26Å; I82-V138 HydrophobicContact CD1-CG1 4.16Å; I82-V138 HydrophobicContact CG1-CG1 3.57Å; I82-V138 HydrophobicContact CG1-CG2 4.19Å; I82-E179 HydrophobicContact CG2-CB 3.73Å; I82-E179 HydrophobicContact CG2-CG 3.85Å; I82-L188 HydrophobicContact CG1-CB 4.39Å; I82-L188 HydrophobicContact CG2-CD1 4.23Å
83	R	80.4	Confident	67.4	Low	133 Å²	133	68.2 Å²	68.2	50%	0.502	36%	0.364	S	S	.	.	H	α-helix	trans	-63.5	-36.7	177.9	-75.7	-169.4	-68.6	-82.1	-2.9	113.5	S79 I86 H87 E179	S79-R83 PolarHBondContact O-N 2.72Å; S79-R83 PolarHBondContact OG-NH1 3.07Å; S79-R83 PolarHBondContact OG-NH2 3.02Å; R83-I86 PolarHBondContact O-N 3.02Å; R83-H87 WeakPolarHBondContact O-CB 3.47Å; R83-H87 PolarHBondContact O-N 3.42Å; R83-E179 WeakPolarHBondContact CG-OE2 3.29Å; R83-E179 IonicContact CZ-OE2 3.25Å; R83-E179 IonicContact NH1-OE1 2.66Å; R83-E179 IonicContact NH1-OE2 3.77Å; R83-E179 PolarHBondContact NH1-OE2 2.71Å
84	A	74.4	Confident	69.5	Low	62 Å²	62	64.2 Å²	64.2	51%	0.512	35%	0.353	S	S	.	.	H	α-helix	trans	-63	-42	176.1	0	0	0	0	0	111.9	A80 A81 I82 R88	A80-A84 PolarHBondContact O-N 2.89Å; A80-A84 VanDerWaalsContact O-N 3.11Å; A81-A84 PolarHBondContact O-N 2.97Å; I82-A84 VanDerWaalsContact C-N 3.34Å; I82-A84 PolarHBondContact O-N 3.46Å; A84-R88 VanDerWaalsContact O-CB 3.31Å; A84-R88 WeakPolarHBondContact O-CB 3.41Å; A84-R88 PolarHBondContact O-N 3.37Å
85	E	74.1	Confident	71.4	Confident	20 Å²	20	61.9 Å²	61.9	9%	0.093	35%	0.347	C	S	.	.	H	α-helix	trans	-72.4	-34.8	177.6	175.4	55.3	-163.4	0	0	112.9	A81 I82 R88 F89 T133 K177 L188	A81-E85 PolarHBondContact O-N 3.44Å; A81-E85 VanDerWaalsContact O-N 3.08Å; I82-E85 PolarHBondContact O-N 3.19Å; E85-R88 PolarHBondContact O-N 3.11Å; E85-R88 IonicContact OE1-NH2 2.75Å; E85-R88 PolarHBondContact OE1-NH2 3.24Å; E85-R88 IonicContact OE2-CZ 3.73Å; E85-R88 IonicContact OE2-NE 2.9Å; E85-R88 PolarHBondContact OE2-NE 3.4Å; E85-R88 IonicContact OE2-NH2 3.09Å; E85-R88 PolarHBondContact OE2-NH2 2.99Å; E85-F89 WeakPolarHBondContact O-CB 3.39Å; E85-F89 PolarHBondContact O-N 2.81Å; E85-T133 HydrophobicContact CG-CG2 4.28Å; E85-K177 IonicContact OE1-NZ 3.39Å; E85-K177 PolarHBondContact OE1-NZ 2.98Å; E85-L188 HydrophobicContact CG-CD2 4.49Å
86	I	76.9	Confident	73.1	Confident	18 Å²	18	59.1 Å²	59.1	9%	0.092	33%	0.33	C	S	.	.	H	α-helix	trans	-62.3	-53.1	172.9	-67.8	162	0	0	0	110.4	I82 R83 R88 F89 E90 K177 E179 L188	I82-I86 HydrophobicContact CG2-CD1 3.66Å; I82-I86 HydrophobicContact CG2-CG1 4.5Å; I82-I86 WeakPolarHBondContact O-CG1 3.09Å; I82-I86 PolarHBondContact O-N 3.26Å; R83-I86 PolarHBondContact O-N 3.02Å; I86-R88 PolarHBondContact O-N 2.91Å; I86-F89 WeakPolarHBondContact O-CB 3.35Å; I86-F89 PolarHBondContact O-N 3.31Å; I86-E90 HydrophobicContact CG2-CG 4.28Å; I86-E90 WeakPolarHBondContact CG2-OE1 3.37Å; I86-E90 WeakPolarHBondContact O-CG 3.49Å; I86-E90 PolarHBondContact O-N 2.94Å; I86-K177 HydrophobicContact CG1-CB 4.11Å; I86-E179 HydrophobicContact CD1-CB 4.01Å; I86-E179 VanDerWaalsContact CD1-N 3.29Å; I86-L188 HydrophobicContact CD1-CD1 4.3Å; I86-L188 HydrophobicContact CG1-CD1 3.99Å
87	H	77.7	Confident	74.6	Confident	135 Å²	135	58.4 Å²	58.4	63%	0.625	32%	0.318	S	S	*	.	H	α-helix	trans	-57.6	-37.3	177.1	177.3	-77.5	0	0	0	112	R83 S91	R83-H87 WeakPolarHBondContact O-CB 3.47Å; R83-H87 PolarHBondContact O-N 3.42Å; H87-S91 VanDerWaalsContact O-CB 3.29Å; H87-S91 WeakPolarHBondContact O-CB 3.21Å; H87-S91 PolarHBondContact O-N 2.86Å; H87-S91 PolarHBondContact O-OG 3.26Å
88	R	72.8	Confident	75.8	Confident	73 Å²	73	57 Å²	57	28%	0.275	31%	0.311	S	S	.	.	H	α-helix	trans	-67.6	-40.1	177.3	-157.5	179.9	73.7	79.9	14.3	112	A84 E85 I86 S91 W132	A84-R88 VanDerWaalsContact O-CB 3.31Å; A84-R88 WeakPolarHBondContact O-CB 3.41Å; A84-R88 PolarHBondContact O-N 3.37Å; E85-R88 PolarHBondContact O-N 3.11Å; E85-R88 IonicContact OE1-NH2 2.75Å; E85-R88 PolarHBondContact OE1-NH2 3.24Å; E85-R88 IonicContact OE2-CZ 3.73Å; E85-R88 IonicContact OE2-NE 2.9Å; E85-R88 PolarHBondContact OE2-NE 3.4Å; E85-R88 IonicContact OE2-NH2 3.09Å; E85-R88 PolarHBondContact OE2-NH2 2.99Å; I86-R88 PolarHBondContact O-N 2.91Å; R88-S91 PolarHBondContact O-OG 3.26Å; R88-W132 VanDerWaalsContact NH1-CZ3 3.28Å; R88-W132 PolarHBondContact NH2-O 3.19Å
89	F	74.8	Confident	76.7	Confident	5 Å²	5	59.2 Å²	59.2	2%	0.022	32%	0.322	C	S	.	.	H	α-helix	trans	-63.3	-52.6	173.1	179.4	-106.1	0	0	0	111.6	E85 I86 S91 V92 H93 F126 V127 R175 K177	E85-F89 WeakPolarHBondContact O-CB 3.39Å; E85-F89 PolarHBondContact O-N 2.81Å; I86-F89 WeakPolarHBondContact O-CB 3.35Å; I86-F89 PolarHBondContact O-N 3.31Å; F89-S91 VanDerWaalsContact C-N 3.31Å; F89-S91 PolarHBondContact O-N 3.08Å; F89-V92 PolarHBondContact O-N 3.45Å; F89-H93 AromaticContact CD1-CE1 3.57Å; F89-H93 AromaticContact CE1-CE1 3.27Å; F89-H93 WeakPolarHBondContact CE1-CE1 3.32Å; F89-H93 AromaticContact CE1-NE2 3.58Å; F89-H93 AromaticContact CE2-CE1 3.82Å; F89-H93 AromaticContact CG-CE1 3.96Å; F89-H93 AromaticContact CZ-CE1 3.41Å; F89-H93 VanDerWaalsContact CZ-CE1 3.41Å; F89-H93 WeakPolarHBondContact CZ-CE1 3.44Å; F89-H93 AromaticContact CZ-NE2 3.62Å; F89-H93 PolarHBondContact O-CE1 3.44Å; F89-H93 VanDerWaalsContact O-CE1 3.29Å; F89-H93 PolarHBondContact O-ND1 3.11Å; F89-F126 HydrophobicContact CD2-CD1 4.23Å; F89-F126 AromaticContact CD2-CE1 3.46Å; F89-F126 HydrophobicContact CD2-CE1 3.46Å; F89-F126 VanDerWaalsContact CD2-CE1 3.46Å; F89-F126 AromaticContact CD2-CZ 3.99Å; F89-F126 HydrophobicContact CD2-CZ 3.99Å; F89-F126 HydrophobicContact CE2-CD1 4.13Å; F89-F126 AromaticContact CE2-CE1 3.74Å; F89-F126 HydrophobicContact CE2-CE1 3.74Å; F89-F126 HydrophobicContact CG-CE1 4.42Å; F89-V127 HydrophobicContact CE2-CB 4.31Å; F89-V127 HydrophobicContact CE2-CG1 4.08Å; F89-V127 HydrophobicContact CE2-CG2 3.71Å; F89-V127 HydrophobicContact CZ-CG1 4.37Å; F89-V127 HydrophobicContact CZ-CG2 4.11Å; F89-R175 WeakPolarHBondContact CZ-O 3.18Å; F89-K177 HydrophobicContact CB-CD 3.9Å; F89-K177 HydrophobicContact CB-CG 4.46Å; F89-K177 HydrophobicContact CD1-CB 3.98Å; F89-K177 HydrophobicContact CD1-CD 4.06Å; F89-K177 HydrophobicContact CD1-CG 3.69Å; F89-K177 HydrophobicContact CD2-CD 4Å; F89-K177 VanDerWaalsContact CD2-CE 3.45Å; F89-K177 HydrophobicContact CD2-CG 4.29Å; F89-K177 HydrophobicContact CE1-CB 4.37Å; F89-K177 HydrophobicContact CE1-CG 3.91Å; F89-K177 HydrophobicContact CE2-CG 4.47Å; F89-K177 HydrophobicContact CG-CB 4.48Å; F89-K177 HydrophobicContact CG-CD 3.71Å; F89-K177 HydrophobicContact CG-CG 3.89Å; F89-K177 HydrophobicContact CZ-CG 4.29Å
90	E	77.4	Confident	77	Confident	107 Å²	107	60 Å²	60	50%	0.5	32%	0.322	S	S	.	.	H	α-helix	trans	-57.2	-40.9	178.4	-69.6	170.5	159.1	0	0	112.2	I86 V92 H93 P94	I86-E90 HydrophobicContact CG2-CG 4.28Å; I86-E90 WeakPolarHBondContact CG2-OE1 3.37Å; I86-E90 WeakPolarHBondContact O-CG 3.49Å; I86-E90 PolarHBondContact O-N 2.94Å; E90-V92 PolarHBondContact O-N 3.25Å; E90-H93 PolarHBondContact O-N 2.92Å; E90-P94 WeakPolarHBondContact O-CD 3.47Å
91	S	77.2	Confident	77.3	Confident	63 Å²	63	61.5 Å²	61.5	44%	0.441	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-18.7	-176.8	72.1	0	0	0	0	115.7	H87 R88 F89 N95	H87-S91 VanDerWaalsContact O-CB 3.29Å; H87-S91 WeakPolarHBondContact O-CB 3.21Å; H87-S91 PolarHBondContact O-N 2.86Å; H87-S91 PolarHBondContact O-OG 3.26Å; R88-S91 PolarHBondContact O-OG 3.26Å; F89-S91 VanDerWaalsContact C-N 3.31Å; F89-S91 PolarHBondContact O-N 3.08Å; S91-N95 PolarHBondContact O-ND2 3.25Å
92	V	73.1	Confident	78	Confident	44 Å²	44	64.7 Å²	64.7	27%	0.267	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-28.9	178.8	-174	0	0	0	0	112.1	F89 E90 N95 I96 F126	F89-V92 PolarHBondContact O-N 3.45Å; E90-V92 PolarHBondContact O-N 3.25Å; V92-N95 WeakPolarHBondContact O-CB 3.47Å; V92-N95 PolarHBondContact O-N 3.48Å; V92-I96 HydrophobicContact CG1-CD1 3.83Å; V92-I96 HydrophobicContact CG1-CG1 4.11Å; V92-I96 PolarHBondContact O-N 3.43Å; V92-F126 HydrophobicContact CB-CE1 4.08Å; V92-F126 HydrophobicContact CB-CE2 4.46Å; V92-F126 HydrophobicContact CB-CZ 3.79Å; V92-F126 HydrophobicContact CG1-CE1 4.39Å; V92-F126 HydrophobicContact CG1-CZ 4.27Å; V92-F126 HydrophobicContact CG2-CE1 4.29Å; V92-F126 HydrophobicContact CG2-CE2 3.88Å; V92-F126 HydrophobicContact CG2-CZ 3.5Å; V92-F126 VanDerWaalsContact CG2-CZ 3.5Å
93	H	75.7	Confident	78.5	Confident	22 Å²	22	64.8 Å²	64.8	10%	0.102	33%	0.334	C	S	.	.	H	α-helix	trans	-58.6	-41.8	-171.9	-69.2	65.8	0	0	0	114.5	F89 E90 N95 I96 Y97	F89-H93 AromaticContact CD1-CE1 3.57Å; F89-H93 AromaticContact CE1-CE1 3.27Å; F89-H93 WeakPolarHBondContact CE1-CE1 3.32Å; F89-H93 AromaticContact CE1-NE2 3.58Å; F89-H93 AromaticContact CE2-CE1 3.82Å; F89-H93 AromaticContact CG-CE1 3.96Å; F89-H93 AromaticContact CZ-CE1 3.41Å; F89-H93 VanDerWaalsContact CZ-CE1 3.41Å; F89-H93 WeakPolarHBondContact CZ-CE1 3.44Å; F89-H93 AromaticContact CZ-NE2 3.62Å; F89-H93 PolarHBondContact O-CE1 3.44Å; F89-H93 VanDerWaalsContact O-CE1 3.29Å; F89-H93 PolarHBondContact O-ND1 3.11Å; E90-H93 PolarHBondContact O-N 2.92Å; H93-N95 PolarHBondContact O-N 2.8Å; H93-N95 VanDerWaalsContact O-N 3.14Å; H93-I96 PolarHBondContact O-N 3.24Å; H93-Y97 HydrophobicContact CB-CD2 4.34Å; H93-Y97 HydrophobicContact CB-CE2 3.9Å; H93-Y97 VanDerWaalsContact O-CD2 3.22Å; H93-Y97 WeakPolarHBondContact O-CD2 3.48Å; H93-Y97 PolarHBondContact O-N 3.42Å
94	P	77.1	Confident	78.8	Confident	84 Å²	84	65.1 Å²	65.1	55%	0.545	34%	0.342	S	S	.	.	H	α-helix	trans	-58.9	-27.8	175.7	-25.8	35.7	0	0	0	113.9	E90 A98	E90-P94 WeakPolarHBondContact O-CD 3.47Å; P94-A98 VanDerWaalsContact O-CB 3.25Å; P94-A98 WeakPolarHBondContact O-CB 3.38Å; P94-A98 PolarHBondContact O-N 2.91Å
95	N	78.2	Confident	79.4	Confident	103 Å²	103	70.2 Å²	70.2	55%	0.551	35%	0.348	S	S	*	.	H	α-helix	trans	-81.4	-33.8	176.2	-55.4	-79.7	0	0	0	111.6	S91 V92 H93 I99	S91-N95 PolarHBondContact O-ND2 3.25Å; V92-N95 WeakPolarHBondContact O-CB 3.47Å; V92-N95 PolarHBondContact O-N 3.48Å; H93-N95 PolarHBondContact O-N 2.8Å; H93-N95 VanDerWaalsContact O-N 3.14Å; N95-I99 WeakPolarHBondContact O-CD1 3.49Å; N95-I99 VanDerWaalsContact O-CG1 3.27Å; N95-I99 WeakPolarHBondContact O-CG1 3.37Å; N95-I99 PolarHBondContact O-N 2.74Å; N95-I99 VanDerWaalsContact O-N 3.14Å
96	I	79.6	Confident	80.3	Confident	16 Å²	16	71.4 Å²	71.4	8%	0.082	35%	0.354	C	S	.	.	H	α-helix	trans	-66.6	-49.5	174.7	-68.9	171.7	0	0	0	110.1	V92 H93 A98 I99 Y100 V119 E123	V92-I96 HydrophobicContact CG1-CD1 3.83Å; V92-I96 HydrophobicContact CG1-CG1 4.11Å; V92-I96 PolarHBondContact O-N 3.43Å; H93-I96 PolarHBondContact O-N 3.24Å; I96-A98 VanDerWaalsContact C-N 3.32Å; I96-A98 PolarHBondContact O-N 3.39Å; I96-I99 WeakPolarHBondContact O-CA 3.47Å; I96-I99 WeakPolarHBondContact O-CB 3.26Å; I96-I99 PolarHBondContact O-N 3.11Å; I96-Y100 HydrophobicContact CG2-CD2 3.88Å; I96-Y100 HydrophobicContact CG2-CE2 3.46Å; I96-Y100 VanDerWaalsContact CG2-CE2 3.46Å; I96-Y100 WeakPolarHBondContact O-CD2 3.23Å; I96-Y100 PolarHBondContact O-N 3.38Å; I96-V119 HydrophobicContact CG2-CG1 4.42Å; I96-E123 HydrophobicContact CD1-CG 4.36Å
97	Y	77.6	Confident	80.9	Confident	127 Å²	127	78.7 Å²	78.7	50%	0.498	39%	0.393	S	S	.	.	H	α-helix	trans	-60	-40.8	174.7	-61.1	-47.4	0	0	0	112.1	H93 I99 Y100 D101	H93-Y97 HydrophobicContact CB-CD2 4.34Å; H93-Y97 HydrophobicContact CB-CE2 3.9Å; H93-Y97 VanDerWaalsContact O-CD2 3.22Å; H93-Y97 WeakPolarHBondContact O-CD2 3.48Å; H93-Y97 PolarHBondContact O-N 3.42Å; Y97-I99 PolarHBondContact O-N 3.2Å; Y97-Y100 HydrophobicContact CD1-CD2 4.5Å; Y97-Y100 PolarHBondContact O-N 3.48Å; Y97-Y100 VanDerWaalsContact O-N 3.1Å; Y97-D101 PolarHBondContact O-N 2.88Å
98	A	81.3	Confident	81.6	Confident	45 Å²	45	76.5 Å²	76.5	37%	0.372	39%	0.386	S	S	.	.	H	α-helix	trans	-63.5	-19.4	173.4	0	0	0	0	0	114.1	P94 I96 L102	P94-A98 VanDerWaalsContact O-CB 3.25Å; P94-A98 WeakPolarHBondContact O-CB 3.38Å; P94-A98 PolarHBondContact O-N 2.91Å; I96-A98 VanDerWaalsContact C-N 3.32Å; I96-A98 PolarHBondContact O-N 3.39Å; A98-L102 WeakPolarHBondContact O-CD1 3.36Å; A98-L102 VanDerWaalsContact O-CG 3.24Å; A98-L102 WeakPolarHBondContact O-CG 3.4Å
99	I	83	Confident	82.3	Confident	73 Å²	73	78.3 Å²	78.3	37%	0.374	40%	0.401	S	S	.	.	H	α-helix	trans	-82.5	-41.2	170.8	-66.2	160.2	0	0	0	110.4	N95 I96 Y97 D101 L102 I103 V119	N95-I99 WeakPolarHBondContact O-CD1 3.49Å; N95-I99 VanDerWaalsContact O-CG1 3.27Å; N95-I99 WeakPolarHBondContact O-CG1 3.37Å; N95-I99 PolarHBondContact O-N 2.74Å; N95-I99 VanDerWaalsContact O-N 3.14Å; I96-I99 WeakPolarHBondContact O-CA 3.47Å; I96-I99 WeakPolarHBondContact O-CB 3.26Å; I96-I99 PolarHBondContact O-N 3.11Å; Y97-I99 PolarHBondContact O-N 3.2Å; I99-D101 PolarHBondContact O-N 3.43Å; I99-L102 CarbonylContact O-C 3.56Å; I99-L102 WeakPolarHBondContact O-CA 3.47Å; I99-L102 WeakPolarHBondContact O-CB 3.42Å; I99-L102 PolarHBondContact O-N 3.04Å; I99-I103 HydrophobicContact CG2-CD1 3.97Å; I99-I103 HydrophobicContact CG2-CG1 4.35Å; I99-I103 WeakPolarHBondContact O-CG1 3.27Å; I99-I103 PolarHBondContact O-N 2.91Å; I99-V119 HydrophobicContact CG2-CG2 3.64Å
100	Y	82.6	Confident	83	Confident	38 Å²	38	81 Å²	81	15%	0.149	42%	0.424	C	S	.	.	H	α-helix	trans	-59.1	-44.5	171.9	-70.9	-70.8	0	0	0	111.6	I96 Y97 L102 I103 E104 R116 V119 I120 E123	I96-Y100 HydrophobicContact CG2-CD2 3.88Å; I96-Y100 HydrophobicContact CG2-CE2 3.46Å; I96-Y100 VanDerWaalsContact CG2-CE2 3.46Å; I96-Y100 WeakPolarHBondContact O-CD2 3.23Å; I96-Y100 PolarHBondContact O-N 3.38Å; Y97-Y100 HydrophobicContact CD1-CD2 4.5Å; Y97-Y100 PolarHBondContact O-N 3.48Å; Y97-Y100 VanDerWaalsContact O-N 3.1Å; Y100-L102 PolarHBondContact O-N 2.92Å; Y100-L102 VanDerWaalsContact O-N 3.07Å; Y100-I103 HydrophobicContact CD1-CD1 4.23Å; Y100-I103 WeakPolarHBondContact O-CB 3.35Å; Y100-I103 PolarHBondContact O-N 3.12Å; Y100-E104 PolarHBondContact O-N 2.72Å; Y100-R116 HydrophobicContact CE1-CG 4.25Å; Y100-V119 HydrophobicContact CE1-CG1 4.11Å; Y100-V119 HydrophobicContact CE2-CG1 3.93Å; Y100-I120 WeakPolarHBondContact OH-CG1 3.41Å; Y100-E123 PolarHBondContact OH-OE2 2.92Å; Y100-E123 VanDerWaalsContact OH-OE2 3.12Å
101	D	81.6	Confident	83.5	Confident	88 Å²	88	79.5 Å²	79.5	47%	0.471	42%	0.419	S	S	.	.	H	α-helix	trans	-51.7	-28.4	170.3	-93.6	26.5	0	0	0	114.4	Y97 I99 R105	Y97-D101 PolarHBondContact O-N 2.88Å; I99-D101 PolarHBondContact O-N 3.43Å; D101-R105 WeakPolarHBondContact O-CD 3.4Å; D101-R105 WeakPolarHBondContact O-CG 3.14Å; D101-R105 PolarHBondContact O-NE 2.73Å; D101-R105 IonicContact OD2-NH2 2.73Å
102	L	86	Confident	84	Confident	102 Å²	102	77.8 Å²	77.8	53%	0.534	40%	0.404	S	S	.	.	H	α-helix	trans	-92.8	-32.3	179.1	-71.8	170.2	0	0	0	111.9	A98 I99 Y100 R105	A98-L102 WeakPolarHBondContact O-CD1 3.36Å; A98-L102 VanDerWaalsContact O-CG 3.24Å; A98-L102 WeakPolarHBondContact O-CG 3.4Å; I99-L102 CarbonylContact O-C 3.56Å; I99-L102 WeakPolarHBondContact O-CA 3.47Å; I99-L102 WeakPolarHBondContact O-CB 3.42Å; I99-L102 PolarHBondContact O-N 3.04Å; Y100-L102 PolarHBondContact O-N 2.92Å; Y100-L102 VanDerWaalsContact O-N 3.07Å; L102-R105 PolarHBondContact O-N 3.26Å
103	I	87.8	Confident	84.5	Confident	2 Å²	2	79.2 Å²	79.2	1%	0.01	41%	0.41	C	S	.	.	H	α-helix	trans	-61.4	-43.9	171.6	-71.5	167.1	0	0	0	110	I99 Y100 R105 I106 Q112 I115 R116 V119	I99-I103 HydrophobicContact CG2-CD1 3.97Å; I99-I103 HydrophobicContact CG2-CG1 4.35Å; I99-I103 WeakPolarHBondContact O-CG1 3.27Å; I99-I103 PolarHBondContact O-N 2.91Å; Y100-I103 HydrophobicContact CD1-CD1 4.23Å; Y100-I103 WeakPolarHBondContact O-CB 3.35Å; Y100-I103 PolarHBondContact O-N 3.12Å; I103-R105 PolarHBondContact O-N 3.03Å; I103-I106 WeakPolarHBondContact O-CB 3.29Å; I103-I106 WeakPolarHBondContact O-CG1 3.22Å; I103-I106 PolarHBondContact O-N 3.43Å; I103-Q112 HydrophobicContact CG2-CG 3.38Å; I103-Q112 WeakPolarHBondContact O-CG 3.41Å; I103-Q112 PolarHBondContact O-NE2 2.89Å; I103-I115 HydrophobicContact CD1-CG2 3.83Å; I103-I115 HydrophobicContact CG1-CB 4.42Å; I103-I115 HydrophobicContact CG1-CG2 3.73Å; I103-R116 HydrophobicContact CG2-CB 4.36Å; I103-V119 HydrophobicContact CD1-CB 4.4Å; I103-V119 HydrophobicContact CD1-CG2 3.94Å
104	E	86	Confident	85.1	Confident	141 Å²	141	83.6 Å²	83.6	66%	0.659	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-16.1	177.1	-67.8	-165	159.8	0	0	114.3	Y100 I106	Y100-E104 PolarHBondContact O-N 2.72Å; E104-I106 VanDerWaalsContact C-N 3.33Å
105	R	87.9	Confident	85.4	Confident	169 Å²	169	82.2 Å²	82.2	64%	0.638	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.4	9.2	176.5	-57.1	173.9	-156.6	-172.8	3.5	113.1	D101 L102 I103	D101-R105 WeakPolarHBondContact O-CD 3.4Å; D101-R105 WeakPolarHBondContact O-CG 3.14Å; D101-R105 PolarHBondContact O-NE 2.73Å; D101-R105 IonicContact OD2-NH2 2.73Å; L102-R105 PolarHBondContact O-N 3.26Å; I103-R105 PolarHBondContact O-N 3.03Å
106	I	92	Very high	85.7	Confident	44 Å²	44	79.4 Å²	79.4	23%	0.226	40%	0.4	C	S	.	.			trans	-95.9	110.5	176	-56.8	179.4	0	0	0	108.6	I103 E104 D108 L111 Q112 I115	I103-I106 WeakPolarHBondContact O-CB 3.29Å; I103-I106 WeakPolarHBondContact O-CG1 3.22Å; I103-I106 PolarHBondContact O-N 3.43Å; E104-I106 VanDerWaalsContact C-N 3.33Å; I106-D108 VanDerWaalsContact C-N 3.27Å; I106-D108 HydrophobicContact CG2-CB 4.28Å; I106-D108 PolarHBondContact O-N 2.66Å; I106-L111 HydrophobicContact CG2-CB 4.42Å; I106-L111 HydrophobicContact CG2-CD2 4.27Å; I106-L111 HydrophobicContact CG2-CG 4.39Å; I106-Q112 HydrophobicContact CB-CB 4.26Å; I106-Q112 HydrophobicContact CB-CG 4.44Å; I106-Q112 HydrophobicContact CG2-CB 4.29Å; I106-Q112 PolarHBondContact O-NE2 3.46Å; I106-I115 HydrophobicContact CD1-CD1 3.65Å
107	D	89.9	Confident	85.8	Confident	172 Å²	172	85.1 Å²	85.1	92%	0.92	43%	0.426	S	S	*	.	S	Bend	trans	-66	-26.5	179.7	-58	-57.9	0	0	0	113.2	L109	D107-L109 PolarHBondContact O-N 3.33Å
108	D	93.3	Very high	86	Confident	88 Å²	88	85 Å²	85	47%	0.471	43%	0.43	S	S	.	.			trans	-79.1	100.2	174.5	179.8	-11.3	0	0	0	110.3	I106 A110 L111 Q112	I106-D108 VanDerWaalsContact C-N 3.27Å; I106-D108 HydrophobicContact CG2-CB 4.28Å; I106-D108 PolarHBondContact O-N 2.66Å; D108-A110 PolarHBondContact O-N 3.38Å; D108-A110 WeakPolarHBondContact OD1-CA 3.25Å; D108-A110 WeakPolarHBondContact OD1-CB 3.26Å; D108-A110 PolarHBondContact OD1-N 3.44Å; D108-L111 HydrophobicContact CB-CB 3.97Å; D108-L111 PolarHBondContact O-N 3.14Å; D108-L111 PolarHBondContact OD1-N 3.29Å; D108-L111 VanDerWaalsContact OD1-N 3.12Å; D108-Q112 VanDerWaalsContact O-CB 3.24Å; D108-Q112 WeakPolarHBondContact O-CB 3.46Å; D108-Q112 PolarHBondContact O-N 3.12Å
109	L	86.6	Confident	86.1	Confident	111 Å²	111	83.6 Å²	83.6	58%	0.581	42%	0.417	S	S	*	.	H	α-helix	trans	-60.2	-27.7	-179.9	-171.7	63.3	0	0	0	113.9	D107 N113	D107-L109 PolarHBondContact O-N 3.33Å; L109-N113 WeakPolarHBondContact O-CB 3.34Å; L109-N113 VanDerWaalsContact O-CG 3.29Å; L109-N113 PolarHBondContact O-N 2.72Å; L109-N113 VanDerWaalsContact O-N 3.13Å; L109-N113 PolarHBondContact O-ND2 2.73Å; L109-N113 VanDerWaalsContact O-ND2 3.17Å
110	A	88.7	Confident	85.7	Confident	62 Å²	62	83.1 Å²	83.1	51%	0.512	41%	0.414	S	S	.	.	H	α-helix	trans	-75.8	-46.1	178.5	0	0	0	0	0	110.7	D108 Q112 N113 Q114	D108-A110 PolarHBondContact O-N 3.38Å; D108-A110 WeakPolarHBondContact OD1-CA 3.25Å; D108-A110 WeakPolarHBondContact OD1-CB 3.26Å; D108-A110 PolarHBondContact OD1-N 3.44Å; A110-Q112 VanDerWaalsContact C-N 3.34Å; A110-N113 PolarHBondContact O-N 3.23Å; A110-Q114 WeakPolarHBondContact O-CG 3.41Å; A110-Q114 PolarHBondContact O-N 3.48Å; A110-Q114 VanDerWaalsContact O-N 3.09Å
111	L	88.8	Confident	85.3	Confident	75 Å²	75	84.5 Å²	84.5	39%	0.393	43%	0.43	S	S	.	.	H	α-helix	trans	-64.3	-40.2	173.1	-178.6	61.3	0	0	0	111.6	I106 D108 N113 Q114 I115	I106-L111 HydrophobicContact CG2-CB 4.42Å; I106-L111 HydrophobicContact CG2-CD2 4.27Å; I106-L111 HydrophobicContact CG2-CG 4.39Å; D108-L111 HydrophobicContact CB-CB 3.97Å; D108-L111 PolarHBondContact O-N 3.14Å; D108-L111 PolarHBondContact OD1-N 3.29Å; D108-L111 VanDerWaalsContact OD1-N 3.12Å; L111-N113 VanDerWaalsContact C-N 3.33Å; L111-N113 PolarHBondContact O-N 2.96Å; L111-Q114 PolarHBondContact O-N 3.17Å; L111-I115 HydrophobicContact CD1-CD1 3.83Å; L111-I115 HydrophobicContact CD1-CG1 4.16Å; L111-I115 HydrophobicContact CD2-CD1 4.5Å; L111-I115 HydrophobicContact CG-CD1 3.8Å; L111-I115 HydrophobicContact CG-CG1 4.48Å; L111-I115 WeakPolarHBondContact O-CG1 3.45Å; L111-I115 PolarHBondContact O-N 2.84Å
112	Q	87.3	Confident	85	Confident	28 Å²	28	85.8 Å²	85.8	13%	0.131	44%	0.435	C	S	.	.	H	α-helix	trans	-55.5	-48.5	175.6	-169.5	-171.5	107.9	0	0	111.1	I103 I106 D108 A110 I115 R116	I103-Q112 HydrophobicContact CG2-CG 3.38Å; I103-Q112 WeakPolarHBondContact O-CG 3.41Å; I103-Q112 PolarHBondContact O-NE2 2.89Å; I106-Q112 HydrophobicContact CB-CB 4.26Å; I106-Q112 HydrophobicContact CB-CG 4.44Å; I106-Q112 HydrophobicContact CG2-CB 4.29Å; I106-Q112 PolarHBondContact O-NE2 3.46Å; D108-Q112 VanDerWaalsContact O-CB 3.24Å; D108-Q112 WeakPolarHBondContact O-CB 3.46Å; D108-Q112 PolarHBondContact O-N 3.12Å; A110-Q112 VanDerWaalsContact C-N 3.34Å; Q112-I115 PolarHBondContact O-N 2.71Å; Q112-R116 VanDerWaalsContact O-CB 3.32Å; Q112-R116 WeakPolarHBondContact O-CB 3.11Å; Q112-R116 PolarHBondContact O-N 2.95Å
113	N	82.9	Confident	84.4	Confident	74 Å²	74	82.7 Å²	82.7	40%	0.396	42%	0.418	S	S	.	.	H	α-helix	trans	-69	-38.5	179.9	-73.9	-26.1	0	0	0	112.9	L109 A110 L111 I115 R116 E117	L109-N113 WeakPolarHBondContact O-CB 3.34Å; L109-N113 VanDerWaalsContact O-CG 3.29Å; L109-N113 PolarHBondContact O-N 2.72Å; L109-N113 VanDerWaalsContact O-N 3.13Å; L109-N113 PolarHBondContact O-ND2 2.73Å; L109-N113 VanDerWaalsContact O-ND2 3.17Å; A110-N113 PolarHBondContact O-N 3.23Å; L111-N113 VanDerWaalsContact C-N 3.33Å; L111-N113 PolarHBondContact O-N 2.96Å; N113-I115 PolarHBondContact O-N 2.92Å; N113-R116 PolarHBondContact O-N 2.72Å; N113-R116 PolarHBondContact OD1-NH1 3.32Å; N113-E117 PolarHBondContact O-N 3.46Å
114	Q	88.3	Confident	83.3	Confident	113 Å²	113	85.6 Å²	85.6	53%	0.528	43%	0.434	S	S	.	.	H	α-helix	trans	-62.8	-41.5	174.4	-73.3	-179.7	-4	0	0	112.4	A110 L111 H118	A110-Q114 WeakPolarHBondContact O-CG 3.41Å; A110-Q114 PolarHBondContact O-N 3.48Å; A110-Q114 VanDerWaalsContact O-N 3.09Å; L111-Q114 PolarHBondContact O-N 3.17Å; Q114-H118 PolarHBondContact O-CD2 2.96Å; Q114-H118 VanDerWaalsContact O-CD2 3.26Å; Q114-H118 PolarHBondContact O-N 2.83Å
115	I	84.5	Confident	82.4	Confident	56 Å²	56	82.4 Å²	82.4	29%	0.287	43%	0.426	S	S	.	.	H	α-helix	trans	-69.7	-37.7	176.8	-62	168.9	0	0	0	110.3	I103 I106 L111 Q112 N113 H118 V119	I103-I115 HydrophobicContact CD1-CG2 3.83Å; I103-I115 HydrophobicContact CG1-CB 4.42Å; I103-I115 HydrophobicContact CG1-CG2 3.73Å; I106-I115 HydrophobicContact CD1-CD1 3.65Å; L111-I115 HydrophobicContact CD1-CD1 3.83Å; L111-I115 HydrophobicContact CD1-CG1 4.16Å; L111-I115 HydrophobicContact CD2-CD1 4.5Å; L111-I115 HydrophobicContact CG-CD1 3.8Å; L111-I115 HydrophobicContact CG-CG1 4.48Å; L111-I115 WeakPolarHBondContact O-CG1 3.45Å; L111-I115 PolarHBondContact O-N 2.84Å; Q112-I115 PolarHBondContact O-N 2.71Å; N113-I115 PolarHBondContact O-N 2.92Å; I115-H118 PolarHBondContact O-N 3.47Å; I115-V119 WeakPolarHBondContact O-CG2 3.5Å; I115-V119 PolarHBondContact O-N 3.13Å
116	R	84.3	Confident	81.4	Confident	44 Å²	44	75.9 Å²	75.9	17%	0.166	40%	0.403	C	S	.	.	H	α-helix	trans	-59.2	-49.4	172.9	-172.5	178	-78.3	114.3	-2.5	111.5	Y100 I103 Q112 N113 H118 V119 I120	Y100-R116 HydrophobicContact CE1-CG 4.25Å; I103-R116 HydrophobicContact CG2-CB 4.36Å; Q112-R116 VanDerWaalsContact O-CB 3.32Å; Q112-R116 WeakPolarHBondContact O-CB 3.11Å; Q112-R116 PolarHBondContact O-N 2.95Å; N113-R116 PolarHBondContact O-N 2.72Å; N113-R116 PolarHBondContact OD1-NH1 3.32Å; R116-H118 VanDerWaalsContact C-N 3.32Å; R116-H118 PolarHBondContact O-N 3.29Å; R116-V119 PolarHBondContact O-N 3.41Å; R116-I120 HydrophobicContact CG-CD1 4Å; R116-I120 VanDerWaalsContact O-CG1 3.31Å; R116-I120 WeakPolarHBondContact O-CG1 3.34Å; R116-I120 PolarHBondContact O-N 3.42Å
117	E	80.8	Confident	80	Confident	136 Å²	136	75 Å²	75	64%	0.636	40%	0.4	S	S	*	.	H	α-helix	trans	-59.2	-39.9	174.3	-75.4	-173.2	160.8	0	0	112.6	N113 S121	N113-E117 PolarHBondContact O-N 3.46Å; E117-S121 VanDerWaalsContact O-CB 3.26Å; E117-S121 WeakPolarHBondContact O-CB 3.28Å; E117-S121 PolarHBondContact O-N 2.91Å
118	H	82.6	Confident	78.3	Confident	123 Å²	123	70 Å²	70	57%	0.569	37%	0.373	S	S	*	.	H	α-helix	trans	-67.1	-37.4	175.8	-73	-34.1	0	0	0	113.1	Q114 I115 R116 S121 I122	Q114-H118 PolarHBondContact O-CD2 2.96Å; Q114-H118 VanDerWaalsContact O-CD2 3.26Å; Q114-H118 PolarHBondContact O-N 2.83Å; I115-H118 PolarHBondContact O-N 3.47Å; R116-H118 VanDerWaalsContact C-N 3.32Å; R116-H118 PolarHBondContact O-N 3.29Å; H118-S121 PolarHBondContact O-N 3.2Å; H118-I122 WeakPolarHBondContact O-CD1 3.43Å; H118-I122 VanDerWaalsContact O-CG1 3.25Å; H118-I122 WeakPolarHBondContact O-CG1 3.34Å; H118-I122 PolarHBondContact O-N 3.27Å
119	V	82.9	Confident	76.5	Confident	16 Å²	16	67.8 Å²	67.8	10%	0.097	36%	0.364	C	S	.	.	H	α-helix	trans	-69.1	-44.1	175.2	172.6	0	0	0	0	111.1	I96 I99 Y100 I103 I115 R116 S121 I122 E123	I96-V119 HydrophobicContact CG2-CG1 4.42Å; I99-V119 HydrophobicContact CG2-CG2 3.64Å; Y100-V119 HydrophobicContact CE1-CG1 4.11Å; Y100-V119 HydrophobicContact CE2-CG1 3.93Å; I103-V119 HydrophobicContact CD1-CB 4.4Å; I103-V119 HydrophobicContact CD1-CG2 3.94Å; I115-V119 WeakPolarHBondContact O-CG2 3.5Å; I115-V119 PolarHBondContact O-N 3.13Å; R116-V119 PolarHBondContact O-N 3.41Å; V119-S121 VanDerWaalsContact C-N 3.28Å; V119-S121 PolarHBondContact O-N 3.39Å; V119-I122 PolarHBondContact O-N 3.02Å; V119-I122 VanDerWaalsContact O-N 3.13Å; V119-E123 WeakPolarHBondContact O-CB 3.43Å; V119-E123 PolarHBondContact O-N 2.87Å
120	I	75.3	Confident	74.7	Confident	64 Å²	64	69 Å²	69	33%	0.328	37%	0.367	S	S	.	.	H	α-helix	trans	-56.3	-44.1	172.3	-67.9	165.4	0	0	0	110.3	Y100 R116 I122 E123 D124	Y100-I120 WeakPolarHBondContact OH-CG1 3.41Å; R116-I120 HydrophobicContact CG-CD1 4Å; R116-I120 VanDerWaalsContact O-CG1 3.31Å; R116-I120 WeakPolarHBondContact O-CG1 3.34Å; R116-I120 PolarHBondContact O-N 3.42Å; I120-I122 PolarHBondContact O-N 3.36Å; I120-E123 PolarHBondContact O-N 2.9Å; I120-D124 WeakPolarHBondContact O-CB 3.25Å; I120-D124 PolarHBondContact O-N 3.29Å
121	S	74.8	Confident	72.5	Confident	67 Å²	67	74.5 Å²	74.5	47%	0.469	38%	0.382	S	S	.	.	H	α-helix	trans	-64.9	-36.2	177.4	-173	0	0	0	0	113.4	E117 H118 V119 S125	E117-S121 VanDerWaalsContact O-CB 3.26Å; E117-S121 WeakPolarHBondContact O-CB 3.28Å; E117-S121 PolarHBondContact O-N 2.91Å; H118-S121 PolarHBondContact O-N 3.2Å; V119-S121 VanDerWaalsContact C-N 3.28Å; V119-S121 PolarHBondContact O-N 3.39Å; S121-S125 VanDerWaalsContact O-CB 3.27Å; S121-S125 WeakPolarHBondContact O-CB 3.13Å; S121-S125 PolarHBondContact O-N 2.91Å; S121-S125 PolarHBondContact O-OG 3.32Å
122	I	75.4	Confident	70.6	Confident	115 Å²	115	77.6 Å²	77.6	59%	0.59	39%	0.388	S	S	*	.	H	α-helix	trans	-69.4	-41.8	173.6	-71.6	163.2	0	0	0	110.9	H118 V119 I120 S125 F126	H118-I122 WeakPolarHBondContact O-CD1 3.43Å; H118-I122 VanDerWaalsContact O-CG1 3.25Å; H118-I122 WeakPolarHBondContact O-CG1 3.34Å; H118-I122 PolarHBondContact O-N 3.27Å; V119-I122 PolarHBondContact O-N 3.02Å; V119-I122 VanDerWaalsContact O-N 3.13Å; I120-I122 PolarHBondContact O-N 3.36Å; I122-S125 PolarHBondContact O-N 3.45Å; I122-F126 VanDerWaalsContact O-CB 3.32Å; I122-F126 WeakPolarHBondContact O-CB 3.37Å; I122-F126 PolarHBondContact O-N 3.09Å
123	E	71.6	Confident	68.9	Low	37 Å²	37	77.9 Å²	77.9	17%	0.173	39%	0.392	C	S	.	.	H	α-helix	trans	-64.7	-47	177.5	-171.2	174.5	165.8	0	0	111.1	I96 Y100 V119 I120 S125 F126 V127	I96-E123 HydrophobicContact CD1-CG 4.36Å; Y100-E123 PolarHBondContact OH-OE2 2.92Å; Y100-E123 VanDerWaalsContact OH-OE2 3.12Å; V119-E123 WeakPolarHBondContact O-CB 3.43Å; V119-E123 PolarHBondContact O-N 2.87Å; I120-E123 PolarHBondContact O-N 2.9Å; E123-S125 VanDerWaalsContact C-N 3.33Å; E123-S125 PolarHBondContact O-N 2.97Å; E123-F126 WeakPolarHBondContact O-CB 3.39Å; E123-F126 PolarHBondContact O-N 3.43Å; E123-F126 VanDerWaalsContact O-N 3.17Å; E123-V127 HydrophobicContact CG-CG2 4.46Å; E123-V127 WeakPolarHBondContact O-CG2 3.38Å; E123-V127 PolarHBondContact O-N 3.13Å
124	D	65.5	Low	67	Low	63 Å²	63	82.1 Å²	82.1	34%	0.337	41%	0.414	S	S	.	.	H	α-helix	trans	-59.6	-42.5	172.2	-108.2	22.5	0	0	0	111.6	I120 F126 V127 N128 R175	I120-D124 WeakPolarHBondContact O-CB 3.25Å; I120-D124 PolarHBondContact O-N 3.29Å; D124-F126 VanDerWaalsContact C-N 3.34Å; D124-F126 PolarHBondContact O-N 3.41Å; D124-V127 PolarHBondContact O-N 3.49Å; D124-N128 VanDerWaalsContact O-CB 3.29Å; D124-N128 WeakPolarHBondContact O-CB 3.38Å; D124-N128 PolarHBondContact O-N 2.8Å; D124-N128 PolarHBondContact O-ND2 3.24Å; D124-R175 IonicContact OD1-CZ 2.73Å; D124-R175 IonicContact OD1-NE 3.55Å; D124-R175 PolarHBondContact OD1-NE 3.17Å; D124-R175 IonicContact OD1-NH2 3.95Å; D124-R175 PolarHBondContact OD1-NH2 2.98Å; D124-R175 IonicContact OD2-CZ 3.11Å; D124-R175 IonicContact OD2-NH2 2.66Å; D124-R175 PolarHBondContact OD2-NH2 3.25Å
125	S	66.9	Low	65.1	Low	73 Å²	73	78.8 Å²	78.8	51%	0.51	40%	0.403	S	S	.	.	H	α-helix	trans	-62.8	-41	175.4	-62.8	0	0	0	0	111.9	S121 I122 E123 S129	S121-S125 VanDerWaalsContact O-CB 3.27Å; S121-S125 WeakPolarHBondContact O-CB 3.13Å; S121-S125 PolarHBondContact O-N 2.91Å; S121-S125 PolarHBondContact O-OG 3.32Å; I122-S125 PolarHBondContact O-N 3.45Å; E123-S125 VanDerWaalsContact C-N 3.33Å; E123-S125 PolarHBondContact O-N 2.97Å; S125-S129 WeakPolarHBondContact O-CB 3.45Å; S125-S129 PolarHBondContact O-N 3.3Å; S125-S129 VanDerWaalsContact O-N 3.12Å
126	F	67.1	Low	63.7	Low	33 Å²	33	88.7 Å²	88.7	15%	0.145	44%	0.437	C	S	.	.	H	α-helix	trans	-66.4	-43.4	177.8	172.4	-110.7	0	0	0	112.3	F89 V92 I122 E123 D124 W132	F89-F126 HydrophobicContact CD2-CD1 4.23Å; F89-F126 AromaticContact CD2-CE1 3.46Å; F89-F126 HydrophobicContact CD2-CE1 3.46Å; F89-F126 VanDerWaalsContact CD2-CE1 3.46Å; F89-F126 AromaticContact CD2-CZ 3.99Å; F89-F126 HydrophobicContact CD2-CZ 3.99Å; F89-F126 HydrophobicContact CE2-CD1 4.13Å; F89-F126 AromaticContact CE2-CE1 3.74Å; F89-F126 HydrophobicContact CE2-CE1 3.74Å; F89-F126 HydrophobicContact CG-CE1 4.42Å; V92-F126 HydrophobicContact CB-CE1 4.08Å; V92-F126 HydrophobicContact CB-CE2 4.46Å; V92-F126 HydrophobicContact CB-CZ 3.79Å; V92-F126 HydrophobicContact CG1-CE1 4.39Å; V92-F126 HydrophobicContact CG1-CZ 4.27Å; V92-F126 HydrophobicContact CG2-CE1 4.29Å; V92-F126 HydrophobicContact CG2-CE2 3.88Å; V92-F126 HydrophobicContact CG2-CZ 3.5Å; V92-F126 VanDerWaalsContact CG2-CZ 3.5Å; I122-F126 VanDerWaalsContact O-CB 3.32Å; I122-F126 WeakPolarHBondContact O-CB 3.37Å; I122-F126 PolarHBondContact O-N 3.09Å; E123-F126 WeakPolarHBondContact O-CB 3.39Å; E123-F126 PolarHBondContact O-N 3.43Å; E123-F126 VanDerWaalsContact O-N 3.17Å; D124-F126 VanDerWaalsContact C-N 3.34Å; D124-F126 PolarHBondContact O-N 3.41Å; F126-W132 AromaticContact CD2-CE3 3.97Å; F126-W132 HydrophobicContact CD2-CE3 3.97Å; F126-W132 HydrophobicContact CD2-CZ3 4.15Å; F126-W132 AromaticContact CE2-CE3 3.75Å; F126-W132 HydrophobicContact CE2-CE3 3.75Å; F126-W132 AromaticContact CE2-CZ3 3.78Å; F126-W132 HydrophobicContact CE2-CZ3 3.78Å
127	V	62.8	Low	62.4	Low	26 Å²	26	90.1 Å²	90.1	16%	0.158	45%	0.454	C	S	.	.	H	α-helix	trans	-75.4	-35.8	-178.7	-169.3	0	0	0	0	112.1	F89 E123 D124 R175	F89-V127 HydrophobicContact CE2-CB 4.31Å; F89-V127 HydrophobicContact CE2-CG1 4.08Å; F89-V127 HydrophobicContact CE2-CG2 3.71Å; F89-V127 HydrophobicContact CZ-CG1 4.37Å; F89-V127 HydrophobicContact CZ-CG2 4.11Å; E123-V127 HydrophobicContact CG-CG2 4.46Å; E123-V127 WeakPolarHBondContact O-CG2 3.38Å; E123-V127 PolarHBondContact O-N 3.13Å; D124-V127 PolarHBondContact O-N 3.49Å; V127-R175 HydrophobicContact CG1-CB 3.9Å; V127-R175 HydrophobicContact CG1-CG 4.46Å; V127-R175 HydrophobicContact CG2-CB 4.18Å
128	N	54	Low	61.9	Low	66 Å²	66	85 Å²	85	35%	0.353	43%	0.431	S	S	.	.	H	α-helix	trans	-85.7	-9.3	-178.3	-61.2	-62.9	0	0	0	113.8	D124 Q130 R175	D124-N128 VanDerWaalsContact O-CB 3.29Å; D124-N128 WeakPolarHBondContact O-CB 3.38Å; D124-N128 PolarHBondContact O-N 2.8Å; D124-N128 PolarHBondContact O-ND2 3.24Å; N128-Q130 PolarHBondContact O-N 3.01Å; N128-Q130 VanDerWaalsContact O-N 3.14Å; N128-R175 PolarHBondContact ND2-NH1 2.9Å; N128-R175 PolarHBondContact ND2-NH2 2.89Å; N128-R175 PolarHBondContact OD1-NH1 3.43Å
129	S	56.1	Low	62	Low	41 Å²	41	80.4 Å²	80.4	29%	0.287	41%	0.413	S	S	.	.			trans	-72.9	104.4	-177.2	-178.3	0	0	0	0	114	S125 E131 W132	S125-S129 WeakPolarHBondContact O-CB 3.45Å; S125-S129 PolarHBondContact O-N 3.3Å; S125-S129 VanDerWaalsContact O-N 3.12Å; S129-E131 PolarHBondContact O-N 3.42Å; S129-E131 PolarHBondContact OG-N 2.98Å; S129-W132 PolarHBondContact O-N 3.12Å
130	Q	47.6	Very low	62.2	Low	138 Å²	138	81.4 Å²	81.4	65%	0.645	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-4.7	170.2	-65.1	-170.2	-52.6	0	0	113.9	N128 T133	N128-Q130 PolarHBondContact O-N 3.01Å; N128-Q130 VanDerWaalsContact O-N 3.14Å; Q130-T133 PolarHBondContact O-OG1 3.41Å
131	E	43.8	Very low	63	Low	177 Å²	177	78.4 Å²	78.4	83%	0.827	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.4	-13.7	171.5	-58	-163.4	144.2	0	0	112	S129	S129-E131 PolarHBondContact O-N 3.42Å; S129-E131 PolarHBondContact OG-N 2.98Å
132	W	49	Very low	63.9	Low	139 Å²	139	77.3 Å²	77.3	53%	0.527	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.4	-12.3	-179.1	-98.8	36	0	0	0	113.9	R88 F126 S129 L134	R88-W132 VanDerWaalsContact NH1-CZ3 3.28Å; R88-W132 PolarHBondContact NH2-O 3.19Å; F126-W132 AromaticContact CD2-CE3 3.97Å; F126-W132 HydrophobicContact CD2-CE3 3.97Å; F126-W132 HydrophobicContact CD2-CZ3 4.15Å; F126-W132 AromaticContact CE2-CE3 3.75Å; F126-W132 HydrophobicContact CE2-CE3 3.75Å; F126-W132 AromaticContact CE2-CZ3 3.78Å; F126-W132 HydrophobicContact CE2-CZ3 3.78Å; S129-W132 PolarHBondContact O-N 3.12Å; W132-L134 PolarHBondContact O-N 2.95Å; W132-L134 VanDerWaalsContact O-N 3.13Å
133	T	50	Low	64.8	Low	34 Å²	34	71.9 Å²	71.9	21%	0.209	36%	0.36	C	S	.	.	S	Bend	trans	-79.2	89.4	166	42	0	0	0	0	111.1	E85 Q130 S135	E85-T133 HydrophobicContact CG-CG2 4.28Å; Q130-T133 PolarHBondContact O-OG1 3.41Å; T133-S135 PolarHBondContact O-N 3.44Å
134	L	44.3	Very low	65.9	Low	163 Å²	163	70.1 Å²	70.1	85%	0.853	35%	0.352	S	S	*	.			trans	-75.3	55.7	-171.6	-109.8	171.7	0	0	0	115.3	W132	W132-L134 PolarHBondContact O-N 2.95Å; W132-L134 VanDerWaalsContact O-N 3.13Å
135	S	47.2	Very low	67.4	Low	44 Å²	44	67.1 Å²	67.1	31%	0.308	34%	0.336	S	S	.	.			trans	-176.9	134.1	143.5	48.3	0	0	0	0	111.9	T133 S137	T133-S135 PolarHBondContact O-N 3.44Å; S135-S137 WeakPolarHBondContact CB-OG 3.36Å; S135-S137 PolarHBondContact O-N 3.45Å
136	R	55	Low	68.7	Low	264 Å²	264	63.7 Å²	63.7	100%	0.996	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	25.1	175.3	-63.7	-172.3	176.3	-152.4	-1.7	113.9
137	S	58.8	Low	69.9	Low	73 Å²	73	62.1 Å²	62.1	51%	0.51	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-125.9	-10.2	-174.5	53.9	0	0	0	0	114.1	N78 S135	N78-S137 PolarHBondContact ND2-O 3.33Å; S135-S137 WeakPolarHBondContact CB-OG 3.36Å; S135-S137 PolarHBondContact O-N 3.45Å
138	V	70.3	Confident	71.3	Confident	28 Å²	28	61.7 Å²	61.7	17%	0.17	30%	0.302	C	S	.	.	S	Bend	trans	-77.5	126.2	172	170.7	0	0	0	0	109.3	A81 I82 L188	A81-V138 HydrophobicContact CB-CG2 4.07Å; I82-V138 HydrophobicContact CD1-CG1 4.16Å; I82-V138 HydrophobicContact CG1-CG1 3.57Å; I82-V138 HydrophobicContact CG1-CG2 4.19Å; V138-L188 HydrophobicContact CG1-CB 3.69Å; V138-L188 HydrophobicContact CG1-CD2 4.33Å
139	P	83.1	Confident	72.9	Confident	27 Å²	27	63.2 Å²	63.2	18%	0.175	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-84.4	119.7	177.7	33.7	-32.9	0	0	0	110.6	S186 Y187 L188	P139-S186 WeakPolarHBondContact CG-O 3.5Å; P139-Y187 HydrophobicContact CB-CD1 3.59Å; P139-Y187 HydrophobicContact CB-CE1 3.72Å; P139-Y187 HydrophobicContact CG-CD1 3.69Å; P139-Y187 HydrophobicContact CG-CE1 3.98Å; P139-Y187 HydrophobicContact CG-CG 4.17Å; P139-Y187 WeakPolarHBondContact O-CA 3.41Å; P139-L188 PolarHBondContact O-N 3.45Å
140	E	87.7	Confident	74.5	Confident	38 Å²	38	63.6 Å²	63.6	18%	0.178	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	148.4	-178.9	-60.3	-178.8	165.7	0	0	112.5	K142 L188 L190 R302	E140-K142 IonicContact OE2-NZ 2.74Å; E140-L188 CarbonylContact C-O 3.46Å; E140-L188 WeakPolarHBondContact CA-O 3.27Å; E140-L188 HydrophobicContact CG-CD2 4.45Å; E140-L190 HydrophobicContact CB-CD1 4.4Å; E140-L190 HydrophobicContact CG-CD1 4.43Å; E140-R302 VanDerWaalsContact O-CZ 3.31Å; E140-R302 PolarHBondContact O-NH1 3.17Å; E140-R302 PolarHBondContact O-NH2 3.16Å
141	L	92.4	Very high	76.6	Confident	0 Å²	0	57 Å²	57	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	125.1	169.4	-60.9	172.7	0	0	0	108.9	I180 Y187 L188 L189 L190 A295 V298 V299	L141-I180 HydrophobicContact CD1-CG2 3.98Å; L141-Y187 HydrophobicContact CD1-CD1 3.93Å; L141-Y187 HydrophobicContact CD1-CD2 4.36Å; L141-Y187 HydrophobicContact CD1-CG 3.73Å; L141-Y187 HydrophobicContact CD2-CD1 4.01Å; L141-Y187 HydrophobicContact CD2-CE1 4.41Å; L141-Y187 HydrophobicContact CG-CD1 3.77Å; L141-Y187 HydrophobicContact CG-CG 4.03Å; L141-L188 PolarHBondContact N-O 2.86Å; L141-L189 HydrophobicContact CB-CD1 4.04Å; L141-L190 PolarHBondContact O-N 3.19Å; L141-A295 HydrophobicContact CD1-CB 3.91Å; L141-V298 HydrophobicContact CD2-CB 4.08Å; L141-V298 HydrophobicContact CD2-CG1 3.48Å; L141-V298 VanDerWaalsContact CD2-CG1 3.48Å; L141-V299 HydrophobicContact CD1-CG2 4.35Å; L141-V299 HydrophobicContact CD2-CG2 4Å
142	K	92.9	Very high	78.8	Confident	44 Å²	44	49 Å²	49	19%	0.191	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	113.1	-176.4	-66.1	173.7	-175.9	179	0	111.1	E140 L190 W205 D207 A208	E140-K142 IonicContact OE2-NZ 2.74Å; K142-L190 WeakPolarHBondContact CA-O 3.49Å; K142-L190 HydrophobicContact CG-CB 4.23Å; K142-L190 HydrophobicContact CG-CD1 4.03Å; K142-W205 HydrophobicContact CB-CD2 4.35Å; K142-W205 HydrophobicContact CB-CE3 4.04Å; K142-W205 HydrophobicContact CB-CH2 3.88Å; K142-W205 HydrophobicContact CB-CZ2 4.21Å; K142-W205 HydrophobicContact CB-CZ3 3.8Å; K142-W205 HydrophobicContact CD-CD2 4.12Å; K142-W205 HydrophobicContact CD-CG 4.46Å; K142-W205 HydrophobicContact CD-CZ2 4.18Å; K142-W205 WeakPolarHBondContact CD-O 3.37Å; K142-W205 HydrophobicContact CG-CD2 4.47Å; K142-W205 HydrophobicContact CG-CH2 4.09Å; K142-W205 HydrophobicContact CG-CZ2 3.94Å; K142-W205 HydrophobicContact CG-CZ3 4.43Å; K142-D207 WeakPolarHBondContact CB-OD2 3.33Å; K142-D207 PolarHBondContact N-OD2 2.86Å; K142-D207 WeakPolarHBondContact O-CA 3.33Å; K142-D207 WeakPolarHBondContact O-CB 3.37Å; K142-D207 PolarHBondContact O-N 2.89Å; K142-A208 PolarHBondContact O-N 2.93Å
143	V	95.8	Very high	80.9	Confident	2 Å²	2	42.4 Å²	42.4	1%	0.012	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	118.1	-178.5	176.7	0	0	0	0	109.8	I145 L189 L190 I191 R192 V210 V294	V143-I145 HydrophobicContact CG1-CG1 4.29Å; V143-L189 HydrophobicContact CB-CD1 4.23Å; V143-L189 HydrophobicContact CG2-CD1 3.59Å; V143-L190 PolarHBondContact N-O 3.12Å; V143-I191 WeakPolarHBondContact O-CA 3.43Å; V143-R192 PolarHBondContact O-N 2.89Å; V143-V210 HydrophobicContact CG1-CG2 3.98Å; V143-V294 HydrophobicContact CB-CG1 4.37Å; V143-V294 HydrophobicContact CG1-CG1 3.93Å; V143-V294 HydrophobicContact CG2-CG1 3.47Å; V143-V294 VanDerWaalsContact CG2-CG1 3.47Å
144	G	94.6	Very high	82.9	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	141.7	170.3	0	0	0	0	0	111.2	R192 F202 A208 V209 V210	G144-R192 CarbonylContact C-O 3.59Å; G144-R192 WeakPolarHBondContact CA-O 3.39Å; G144-F202 VanDerWaalsContact CA-CZ 3.49Å; G144-A208 PolarHBondContact N-O 2.96Å; G144-V209 CarbonylContact O-C 3.57Å; G144-V209 WeakPolarHBondContact O-CA 3.47Å; G144-V210 PolarHBondContact O-N 3.42Å
145	I	95.9	Very high	85.1	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	128	178.1	-58.1	-177	0	0	0	107.4	V143 K153 V157 I191 R192 E194 V210 V212 F291	V143-I145 HydrophobicContact CG1-CG1 4.29Å; I145-K153 HydrophobicContact CG2-CB 4.22Å; I145-V157 HydrophobicContact CD1-CG2 3.52Å; I145-V157 HydrophobicContact CG2-CG2 4.32Å; I145-I191 HydrophobicContact CD1-CG2 3.55Å; I145-I191 HydrophobicContact CG1-CG2 4.14Å; I145-R192 PolarHBondContact N-O 3.28Å; I145-E194 PolarHBondContact O-N 2.84Å; I145-V210 WeakPolarHBondContact CA-O 3.29Å; I145-V210 HydrophobicContact CG1-CB 4.22Å; I145-V210 HydrophobicContact CG1-CG2 4.43Å; I145-V212 HydrophobicContact CG2-CG2 3.71Å; I145-F291 HydrophobicContact CD1-CE1 3.67Å; I145-F291 HydrophobicContact CD1-CZ 3.57Å
146	V	94.6	Very high	87.4	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	128.5	-170.5	-152.2	0	0	0	0	110.8	E194 F202 V209 V210 F211 V212 Y227	V146-E194 HydrophobicContact CG1-CB 4.3Å; V146-F202 HydrophobicContact CG2-CE1 3.7Å; V146-F202 HydrophobicContact CG2-CE2 4.26Å; V146-F202 HydrophobicContact CG2-CZ 3.33Å; V146-V209 HydrophobicContact CG2-CG1 3.92Å; V146-V210 PolarHBondContact N-O 3.01Å; V146-F211 WeakPolarHBondContact O-CA 3.48Å; V146-V212 PolarHBondContact O-N 3.45Å; V146-Y227 HydrophobicContact CB-CD2 4.3Å; V146-Y227 HydrophobicContact CG1-CD2 3.39Å; V146-Y227 HydrophobicContact CG1-CE2 3.76Å; V146-Y227 HydrophobicContact CG1-CG 4.29Å
147	G	93	Very high	89.2	Confident	0 Å²	0	19 Å²	19	0%	0	11%	0.114	C	C	.	.			trans	-168	176.4	176.4	0	0	0	0	0	109.3	V212	G147-V212 WeakPolarHBondContact CA-O 3.5Å
148	N	90.8	Very high	90.7	Very high	18 Å²	18	18.3 Å²	18.3	10%	0.096	10%	0.102	C	C	.	.			trans	-85.2	174.2	169.2	64.6	-19.1	0	0	0	111.2	S150 S151 D217 S220 T223	N148-S150 PolarHBondContact ND2-OG 2.92Å; N148-S150 PolarHBondContact O-N 2.92Å; N148-S150 PolarHBondContact OD1-OG 3Å; N148-S151 VanDerWaalsContact O-CB 3.29Å; N148-S151 WeakPolarHBondContact O-CB 3.47Å; N148-S151 PolarHBondContact O-N 3.48Å; N148-S151 PolarHBondContact O-OG 3.27Å; N148-S151 WeakPolarHBondContact OD1-CB 3.39Å; N148-S151 PolarHBondContact OD1-N 3.48Å; N148-D217 PolarHBondContact ND2-OD2 3.41Å; N148-S220 WeakPolarHBondContact ND2-CA 3.27Å; N148-S220 PolarHBondContact ND2-N 3.09Å; N148-S220 WeakPolarHBondContact OD1-CA 3.27Å; N148-S220 WeakPolarHBondContact OD1-CB 3.3Å; N148-T223 HydrophobicContact CB-CG2 4.27Å
149	L	88.2	Confident	91.7	Very high	97 Å²	97	19.8 Å²	19.8	51%	0.508	10%	0.104	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.5	17.4	-179.3	-59.6	80.4	0	0	0	114.6	E169 P171	L149-E169 WeakPolarHBondContact CA-OE2 3.45Å; L149-P171 HydrophobicContact CD2-CB 3.63Å
150	S	89.3	Confident	92.2	Very high	50 Å²	50	18.7 Å²	18.7	35%	0.35	10%	0.097	S	C	.	.	T	Hydrogen-bonded Turn	trans	-132.5	12.4	172.8	53.3	0	0	0	0	111.7	N148 S214 D217	N148-S150 PolarHBondContact ND2-OG 2.92Å; N148-S150 PolarHBondContact O-N 2.92Å; N148-S150 PolarHBondContact OD1-OG 3Å; S150-S214 WeakPolarHBondContact O-CB 3.27Å; S150-D217 PolarHBondContact OG-OD2 3.22Å
151	S	91.8	Very high	92.3	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	10%	0.101	C	C	.	.	S	Bend	trans	-85.8	-14.2	-177.4	61.1	0	0	0	0	113.6	N148 K153 E169 V212 T247	N148-S151 VanDerWaalsContact O-CB 3.29Å; N148-S151 WeakPolarHBondContact O-CB 3.47Å; N148-S151 PolarHBondContact O-N 3.48Å; N148-S151 PolarHBondContact O-OG 3.27Å; N148-S151 WeakPolarHBondContact OD1-CB 3.39Å; N148-S151 PolarHBondContact OD1-N 3.48Å; S151-K153 WeakPolarHBondContact OG-CB 3.14Å; S151-K153 WeakPolarHBondContact OG-CG 3.22Å; S151-K153 PolarHBondContact OG-N 2.75Å; S151-E169 PolarHBondContact N-OE1 3.47Å; S151-V212 WeakPolarHBondContact CB-O 3.27Å; S151-V212 WeakPolarHBondContact O-CG1 3.37Å; S151-T247 WeakPolarHBondContact O-CG2 3.17Å; S151-T247 PolarHBondContact O-OG1 3.01Å
152	G	91.1	Very high	91.9	Very high	9 Å²	9	23 Å²	23	9%	0.093	12%	0.123	C	C	.	.			trans	72.7	13.7	-168.6	0	0	0	0	0	113.5	S154 A155 L156 E169	G152-S154 PolarHBondContact O-N 2.95Å; G152-A155 PolarHBondContact O-N 3.18Å; G152-L156 WeakPolarHBondContact O-CB 3.41Å; G152-L156 PolarHBondContact O-N 2.79Å; G152-E169 VanDerWaalsContact CA-OE1 3.3Å; G152-E169 WeakPolarHBondContact CA-OE1 3.21Å; G152-E169 PolarHBondContact N-OE1 2.81Å
153	K	92.9	Very high	91.4	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-54.8	-48.8	-176.5	65.6	-174.1	-174.7	59.5	0	112.2	I145 S151 L156 V157 D193 E194 V212	I145-K153 HydrophobicContact CG2-CB 4.22Å; S151-K153 WeakPolarHBondContact OG-CB 3.14Å; S151-K153 WeakPolarHBondContact OG-CG 3.22Å; S151-K153 PolarHBondContact OG-N 2.75Å; K153-L156 WeakPolarHBondContact O-CB 3.48Å; K153-L156 PolarHBondContact O-N 2.95Å; K153-V157 WeakPolarHBondContact O-CG2 3.48Å; K153-V157 PolarHBondContact O-N 3.48Å; K153-D193 VanDerWaalsContact CD-OD1 3.27Å; K153-D193 WeakPolarHBondContact CD-OD1 3.34Å; K153-D193 WeakPolarHBondContact CE-OD1 3.46Å; K153-D193 VanDerWaalsContact NZ-CG 3.3Å; K153-D193 IonicContact NZ-OD1 3.97Å; K153-D193 PolarHBondContact NZ-OD1 2.61Å; K153-D193 IonicContact NZ-OD2 3.69Å; K153-D193 PolarHBondContact NZ-OD2 2.85Å; K153-D193 VanDerWaalsContact NZ-OD2 3.15Å; K153-E194 VanDerWaalsContact CE-O 3.22Å; K153-E194 WeakPolarHBondContact CE-O 2.97Å; K153-E194 PolarHBondContact NZ-O 3.04Å; K153-V212 HydrophobicContact CB-CB 4.12Å; K153-V212 HydrophobicContact CB-CG1 4.35Å; K153-V212 HydrophobicContact CB-CG2 4.22Å
154	S	91.5	Very high	90.8	Very high	9 Å²	9	26.5 Å²	26.5	6%	0.063	16%	0.157	C	C	.	.	H	α-helix	trans	-74.6	-33.2	-174.4	-53.6	0	0	0	0	111.3	G152 L156 V157 H158 D193	G152-S154 PolarHBondContact O-N 2.95Å; S154-L156 VanDerWaalsContact C-N 3.34Å; S154-L156 PolarHBondContact O-N 3.1Å; S154-V157 PolarHBondContact O-N 3.07Å; S154-H158 VanDerWaalsContact O-CB 3.28Å; S154-H158 WeakPolarHBondContact O-CB 3.32Å; S154-H158 PolarHBondContact O-N 2.83Å; S154-D193 WeakPolarHBondContact CB-OD2 3.29Å; S154-D193 PolarHBondContact OG-OD2 3.31Å
155	A	91.3	Very high	90.4	Very high	4 Å²	4	29.8 Å²	29.8	3%	0.033	17%	0.17	C	C	.	.	H	α-helix	trans	-62.8	-39.1	170	0	0	0	0	0	112.2	G152 R159 Y165 V166	G152-A155 PolarHBondContact O-N 3.18Å; A155-R159 VanDerWaalsContact O-CB 3.27Å; A155-R159 WeakPolarHBondContact O-CB 3.34Å; A155-R159 PolarHBondContact O-N 2.89Å; A155-Y165 HydrophobicContact CB-CD2 4.34Å; A155-Y165 HydrophobicContact CB-CE2 3.93Å; A155-V166 WeakPolarHBondContact CB-O 3.26Å
156	L	94	Very high	89.6	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-65.1	-43.6	174.8	179.2	71.4	0	0	0	111.6	G152 K153 S154 Y160 V212 V245 T279 S281 V287 F291	G152-L156 WeakPolarHBondContact O-CB 3.41Å; G152-L156 PolarHBondContact O-N 2.79Å; K153-L156 WeakPolarHBondContact O-CB 3.48Å; K153-L156 PolarHBondContact O-N 2.95Å; S154-L156 VanDerWaalsContact C-N 3.34Å; S154-L156 PolarHBondContact O-N 3.1Å; L156-Y160 PolarHBondContact O-N 3.45Å; L156-Y160 VanDerWaalsContact O-N 3.14Å; L156-V212 HydrophobicContact CD2-CG1 4.32Å; L156-V212 HydrophobicContact CD2-CG2 4.03Å; L156-V245 HydrophobicContact CD2-CG1 3.96Å; L156-T279 HydrophobicContact CD1-CG2 4.1Å; L156-S281 WeakPolarHBondContact CA-OG 3.41Å; L156-S281 PolarHBondContact N-OG 2.77Å; L156-V287 HydrophobicContact CD1-CB 4.24Å; L156-V287 HydrophobicContact CD1-CG1 3.91Å; L156-V287 HydrophobicContact CD1-CG2 3.84Å; L156-F291 HydrophobicContact CG-CE2 4.49Å
157	V	93.1	Very high	88.6	Confident	1 Å²	1	39.3 Å²	39.3	1%	0.006	22%	0.218	C	C	.	.	H	α-helix	trans	-64.6	-49.2	175.3	-170	0	0	0	0	110.8	I145 K153 S154 R159 Y160 L161 F176 I191 D193	I145-V157 HydrophobicContact CD1-CG2 3.52Å; I145-V157 HydrophobicContact CG2-CG2 4.32Å; K153-V157 WeakPolarHBondContact O-CG2 3.48Å; K153-V157 PolarHBondContact O-N 3.48Å; S154-V157 PolarHBondContact O-N 3.07Å; V157-R159 VanDerWaalsContact C-N 3.35Å; V157-R159 PolarHBondContact O-N 3.22Å; V157-Y160 WeakPolarHBondContact O-CB 3.24Å; V157-Y160 PolarHBondContact O-N 2.86Å; V157-Y160 VanDerWaalsContact O-N 3.14Å; V157-L161 HydrophobicContact CG1-CD1 3.82Å; V157-L161 HydrophobicContact CG1-CG 4.35Å; V157-L161 WeakPolarHBondContact O-CG 3.5Å; V157-L161 PolarHBondContact O-N 3.48Å; V157-F176 HydrophobicContact CG1-CD2 3.64Å; V157-F176 HydrophobicContact CG1-CE2 3.73Å; V157-F176 HydrophobicContact CG1-CG 4.43Å; V157-I191 HydrophobicContact CG1-CD1 4.5Å; V157-I191 HydrophobicContact CG1-CG2 4.03Å; V157-D193 HydrophobicContact CG2-CB 4.2Å
158	H	90.1	Very high	87.6	Confident	58 Å²	58	46.9 Å²	46.9	27%	0.269	25%	0.253	S	S	.	.	H	α-helix	trans	-57.9	-47.8	179.3	-173.5	-90.7	0	0	0	111	S154 Y160 L161 T162 T164 V166	S154-H158 VanDerWaalsContact O-CB 3.28Å; S154-H158 WeakPolarHBondContact O-CB 3.32Å; S154-H158 PolarHBondContact O-N 2.83Å; H158-Y160 VanDerWaalsContact C-N 3.26Å; H158-Y160 PolarHBondContact O-N 2.91Å; H158-L161 PolarHBondContact O-N 3.49Å; H158-T162 PolarHBondContact CE1-OG1 3.13Å; H158-T162 PolarHBondContact ND1-OG1 2.81Å; H158-T162 PolarHBondContact O-N 3.41Å; H158-T162 PolarHBondContact O-OG1 2.81Å; H158-T164 PolarHBondContact CE1-OG1 2.81Å; H158-T164 VanDerWaalsContact CE1-OG1 3.28Å; H158-T164 PolarHBondContact ND1-O 2.88Å; H158-V166 WeakPolarHBondContact CE1-CG2 3.31Å
159	R	92	Very high	86.7	Confident	58 Å²	58	48.1 Å²	48.1	22%	0.219	26%	0.258	C	S	.	.	H	α-helix	trans	-60.6	-35.1	178.3	-176.8	59.2	179.8	-123.9	17	112.8	A155 V157 G163 T164 S281 T282 V287	A155-R159 VanDerWaalsContact O-CB 3.27Å; A155-R159 WeakPolarHBondContact O-CB 3.34Å; A155-R159 PolarHBondContact O-N 2.89Å; V157-R159 VanDerWaalsContact C-N 3.35Å; V157-R159 PolarHBondContact O-N 3.22Å; R159-G163 VanDerWaalsContact CD-C 3.48Å; R159-G163 WeakPolarHBondContact CD-O 3.44Å; R159-G163 PolarHBondContact NE-O 2.85Å; R159-G163 PolarHBondContact NH2-O 2.96Å; R159-G163 VanDerWaalsContact O-CA 3.29Å; R159-G163 WeakPolarHBondContact O-CA 3.46Å; R159-G163 PolarHBondContact O-N 2.92Å; R159-G163 VanDerWaalsContact O-N 3.14Å; R159-T164 WeakPolarHBondContact CA-O 3.32Å; R159-S281 VanDerWaalsContact CD-O 3.24Å; R159-S281 WeakPolarHBondContact CD-O 3.45Å; R159-S281 VanDerWaalsContact CG-O 3.28Å; R159-S281 WeakPolarHBondContact CG-O 3.37Å; R159-S281 PolarHBondContact NH1-O 2.8Å; R159-T282 VanDerWaalsContact NH1-C 3.3Å; R159-T282 PolarHBondContact NH1-O 2.98Å; R159-V287 HydrophobicContact CB-CG1 4.44Å; R159-V287 HydrophobicContact CG-CG1 4.34Å; R159-V287 HydrophobicContact CG-CG2 4.15Å
160	Y	94.3	Very high	86	Confident	5 Å²	5	45.9 Å²	45.9	2%	0.02	25%	0.251	C	S	.	.	H	α-helix	trans	-70	-35.6	175.2	178.5	-111.6	0	0	0	113	L156 V157 H158 K178 L189 I191 V287 E288 F291	L156-Y160 PolarHBondContact O-N 3.45Å; L156-Y160 VanDerWaalsContact O-N 3.14Å; V157-Y160 WeakPolarHBondContact O-CB 3.24Å; V157-Y160 PolarHBondContact O-N 2.86Å; V157-Y160 VanDerWaalsContact O-N 3.14Å; H158-Y160 VanDerWaalsContact C-N 3.26Å; H158-Y160 PolarHBondContact O-N 2.91Å; Y160-K178 HydrophobicContact CD1-CD 4.09Å; Y160-K178 HydrophobicContact CE1-CD 3.56Å; Y160-K178 PolarHBondContact O-NZ 3.39Å; Y160-L189 HydrophobicContact CE1-CD2 3.71Å; Y160-L189 WeakPolarHBondContact OH-CD2 3.48Å; Y160-I191 HydrophobicContact CD1-CD1 3.82Å; Y160-I191 HydrophobicContact CE1-CD1 3.86Å; Y160-V287 HydrophobicContact CD2-CG1 4.45Å; Y160-E288 WeakPolarHBondContact CD2-OE2 3.2Å; Y160-E288 HydrophobicContact CE2-CG 4.41Å; Y160-E288 VanDerWaalsContact CE2-OE1 3.26Å; Y160-E288 WeakPolarHBondContact CE2-OE1 3.23Å; Y160-E288 VanDerWaalsContact CE2-OE2 3.25Å; Y160-E288 WeakPolarHBondContact CE2-OE2 3.34Å; Y160-F291 VanDerWaalsContact CB-CE2 3.47Å; Y160-F291 HydrophobicContact CD1-CB 4.46Å; Y160-F291 AromaticContact CD1-CD1 3.66Å; Y160-F291 HydrophobicContact CD1-CD1 3.66Å; Y160-F291 AromaticContact CD1-CD2 3.77Å; Y160-F291 HydrophobicContact CD1-CD2 3.77Å; Y160-F291 AromaticContact CD1-CE1 3.68Å; Y160-F291 HydrophobicContact CD1-CE1 3.68Å; Y160-F291 AromaticContact CD1-CE2 3.81Å; Y160-F291 HydrophobicContact CD1-CE2 3.81Å; Y160-F291 AromaticContact CD1-CG 3.69Å; Y160-F291 HydrophobicContact CD1-CG 3.69Å; Y160-F291 AromaticContact CD1-CZ 3.76Å; Y160-F291 HydrophobicContact CD1-CZ 3.76Å; Y160-F291 HydrophobicContact CD2-CB 3.93Å; Y160-F291 HydrophobicContact CD2-CD1 4.47Å; Y160-F291 AromaticContact CD2-CD2 3.36Å; Y160-F291 HydrophobicContact CD2-CD2 3.36Å; Y160-F291 AromaticContact CD2-CE2 3.94Å; Y160-F291 HydrophobicContact CD2-CE2 3.94Å; Y160-F291 AromaticContact CD2-CG 3.67Å; Y160-F291 HydrophobicContact CD2-CG 3.67Å; Y160-F291 HydrophobicContact CE1-CB 3.97Å; Y160-F291 AromaticContact CE1-CD1 3.53Å; Y160-F291 HydrophobicContact CE1-CD1 3.53Å; Y160-F291 HydrophobicContact CE1-CD2 4.15Å; Y160-F291 AromaticContact CE1-CE1 3.98Å; Y160-F291 HydrophobicContact CE1-CE1 3.98Å; Y160-F291 AromaticContact CE1-CG 3.62Å; Y160-F291 HydrophobicContact CE1-CG 3.62Å; Y160-F291 HydrophobicContact CE1-CZ 4.48Å; Y160-F291 HydrophobicContact CE2-CB 3.37Å; Y160-F291 HydrophobicContact CE2-CD1 4.36Å; Y160-F291 AromaticContact CE2-CD2 3.77Å; Y160-F291 HydrophobicContact CE2-CD2 3.77Å; Y160-F291 AromaticContact CE2-CG 3.58Å; Y160-F291 HydrophobicContact CE2-CG 3.58Å; Y160-F291 HydrophobicContact CG-CB 4.44Å; Y160-F291 HydrophobicContact CG-CD1 4.15Å; Y160-F291 AromaticContact CG-CD2 3.35Å; Y160-F291 HydrophobicContact CG-CD2 3.35Å; Y160-F291 HydrophobicContact CG-CE1 4.21Å; Y160-F291 AromaticContact CG-CE2 3.46Å; Y160-F291 HydrophobicContact CG-CE2 3.46Å; Y160-F291 VanDerWaalsContact CG-CE2 3.46Å; Y160-F291 AromaticContact CG-CG 3.73Å; Y160-F291 HydrophobicContact CG-CG 3.73Å; Y160-F291 AromaticContact CG-CZ 3.89Å; Y160-F291 HydrophobicContact CG-CZ 3.89Å; Y160-F291 VanDerWaalsContact CZ-CB 3.42Å; Y160-F291 AromaticContact CZ-CD1 3.93Å; Y160-F291 AromaticContact CZ-CG 3.58Å
161	L	89.1	Confident	84.8	Confident	52 Å²	52	47.3 Å²	47.3	27%	0.272	26%	0.259	S	S	.	.	H	α-helix	trans	-79.3	-53.4	-178.6	-68.3	170.6	0	0	0	112.7	V157 H158 F176 K178 I191	V157-L161 HydrophobicContact CG1-CD1 3.82Å; V157-L161 HydrophobicContact CG1-CG 4.35Å; V157-L161 WeakPolarHBondContact O-CG 3.5Å; V157-L161 PolarHBondContact O-N 3.48Å; H158-L161 PolarHBondContact O-N 3.49Å; L161-F176 HydrophobicContact CD1-CB 3.61Å; L161-F176 HydrophobicContact CD1-CD1 3.44Å; L161-F176 VanDerWaalsContact CD1-CD1 3.44Å; L161-F176 HydrophobicContact CD1-CD2 3.96Å; L161-F176 HydrophobicContact CD1-CE1 4.05Å; L161-F176 HydrophobicContact CD1-CG 3.38Å; L161-F176 HydrophobicContact CD2-CB 4.13Å; L161-K178 HydrophobicContact CD2-CB 4Å; L161-K178 HydrophobicContact CD2-CD 4.18Å; L161-I191 HydrophobicContact CD2-CD1 4.06Å
162	T	84.3	Confident	83.5	Confident	75 Å²	75	53.7 Å²	53.7	46%	0.46	29%	0.289	S	S	.	.	H	α-helix	trans	-100.1	-17.7	-168.8	65	0	0	0	0	113.6	H158 T164	H158-T162 PolarHBondContact CE1-OG1 3.13Å; H158-T162 PolarHBondContact ND1-OG1 2.81Å; H158-T162 PolarHBondContact O-N 3.41Å; H158-T162 PolarHBondContact O-OG1 2.81Å; T162-T164 PolarHBondContact O-N 2.95Å; T162-T164 PolarHBondContact OG1-N 2.68Å; T162-T164 PolarHBondContact OG1-OG1 3.46Å; T162-T164 VanDerWaalsContact OG1-OG1 3.09Å
163	G	82.3	Confident	82.7	Confident	41 Å²	41	53.8 Å²	53.8	42%	0.423	29%	0.29	S	S	.	.	S	Bend	trans	76.6	-0.6	-171.6	0	0	0	0	0	114.7	R159	R159-G163 VanDerWaalsContact CD-C 3.48Å; R159-G163 WeakPolarHBondContact CD-O 3.44Å; R159-G163 PolarHBondContact NE-O 2.85Å; R159-G163 PolarHBondContact NH2-O 2.96Å; R159-G163 VanDerWaalsContact O-CA 3.29Å; R159-G163 WeakPolarHBondContact O-CA 3.46Å; R159-G163 PolarHBondContact O-N 2.92Å; R159-G163 VanDerWaalsContact O-N 3.14Å
164	T	83.5	Confident	82.1	Confident	79 Å²	79	54.7 Å²	54.7	49%	0.485	30%	0.299	S	S	.	.	S	Bend	trans	-110.6	154.1	178.3	61.5	0	0	0	0	112.3	H158 R159 T162	H158-T164 PolarHBondContact CE1-OG1 2.81Å; H158-T164 VanDerWaalsContact CE1-OG1 3.28Å; H158-T164 PolarHBondContact ND1-O 2.88Å; R159-T164 WeakPolarHBondContact CA-O 3.32Å; T162-T164 PolarHBondContact O-N 2.95Å; T162-T164 PolarHBondContact OG1-N 2.68Å; T162-T164 PolarHBondContact OG1-OG1 3.46Å; T162-T164 VanDerWaalsContact OG1-OG1 3.09Å
165	Y	84.4	Confident	81.7	Confident	69 Å²	69	55.2 Å²	55.2	27%	0.271	30%	0.3	S	S	.	.			trans	-89.3	134.9	174.8	177.4	-116.8	0	0	0	110.6	A155 Q167 D249 T282	A155-Y165 HydrophobicContact CB-CD2 4.34Å; A155-Y165 HydrophobicContact CB-CE2 3.93Å; Y165-Q167 HydrophobicContact CE1-CB 4.02Å; Y165-D249 HydrophobicContact CE2-CB 4.35Å; Y165-T282 HydrophobicContact CD1-CG2 4.35Å
166	V	80.6	Confident	81.5	Confident	51 Å²	51	57.5 Å²	57.5	31%	0.309	31%	0.309	S	S	.	.			trans	-132.5	132.1	169	165.2	0	0	0	0	106.1	A155 H158 E168	A155-V166 WeakPolarHBondContact CB-O 3.26Å; H158-V166 WeakPolarHBondContact CE1-CG2 3.31Å; V166-E168 HydrophobicContact CG1-CB 3.64Å
167	Q	73	Confident	81.1	Confident	150 Å²	150	58.1 Å²	58.1	70%	0.701	31%	0.312	S	S	*	.			trans	-88.3	-7	-177.7	-173.5	167.8	2.2	0	0	112.8	Y165 E169	Y165-Q167 HydrophobicContact CE1-CB 4.02Å; Q167-E169 PolarHBondContact O-N 2.86Å
168	E	72.1	Confident	80.9	Confident	158 Å²	158	60 Å²	60	74%	0.738	32%	0.319	S	S	*	.			trans	-75.1	118.1	177.9	-166.2	163.3	-145.1	0	0	110.1	V166	V166-E168 HydrophobicContact CG1-CB 3.64Å
169	E	72.6	Confident	80.9	Confident	44 Å²	44	59.2 Å²	59.2	21%	0.206	32%	0.316	C	S	.	.			trans	-92.4	131.4	172.2	-75.5	-152.5	-143.7	0	0	110.8	L149 S151 G152 Q167 P171	L149-E169 WeakPolarHBondContact CA-OE2 3.45Å; S151-E169 PolarHBondContact N-OE1 3.47Å; G152-E169 VanDerWaalsContact CA-OE1 3.3Å; G152-E169 WeakPolarHBondContact CA-OE1 3.21Å; G152-E169 PolarHBondContact N-OE1 2.81Å; Q167-E169 PolarHBondContact O-N 2.86Å; E169-P171 VanDerWaalsContact O-CD 3.3Å; E169-P171 WeakPolarHBondContact O-CD 3Å
170	S	72.2	Confident	80.9	Confident	50 Å²	50	56.7 Å²	56.7	35%	0.35	31%	0.307	S	S	.	.			trans	-79.1	112.2	178.6	-52.7	0	0	0	0	110.1	E172 G173	S170-E172 VanDerWaalsContact C-N 3.26Å; S170-E172 PolarHBondContact O-N 3.12Å; S170-G173 VanDerWaalsContact CB-O 3.27Å; S170-G173 WeakPolarHBondContact CB-O 3.33Å; S170-G173 PolarHBondContact O-N 2.83Å
171	P	63.8	Low	80.8	Confident	80 Å²	80	60 Å²	60	52%	0.519	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-27.8	-175.7	28.3	-35.1	0	0	0	112.5	L149 E169 G173	L149-P171 HydrophobicContact CD2-CB 3.63Å; E169-P171 VanDerWaalsContact O-CD 3.3Å; E169-P171 WeakPolarHBondContact O-CD 3Å; P171-G173 VanDerWaalsContact C-N 3.33Å
172	E	64.9	Low	80.8	Confident	134 Å²	134	57.5 Å²	57.5	63%	0.626	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-5.5	179.6	-66.3	162.5	159.9	0	0	112.3	S170	S170-E172 VanDerWaalsContact C-N 3.26Å; S170-E172 PolarHBondContact O-N 3.12Å
173	G	74.6	Confident	81	Confident	12 Å²	12	59.1 Å²	59.1	12%	0.124	32%	0.32	C	S	.	.			trans	83.6	-152.4	-172.7	0	0	0	0	0	112.8	S170 P171 D193	S170-G173 VanDerWaalsContact CB-O 3.27Å; S170-G173 WeakPolarHBondContact CB-O 3.33Å; S170-G173 PolarHBondContact O-N 2.83Å; P171-G173 VanDerWaalsContact C-N 3.33Å; G173-D193 CarbonylContact C-O 3.58Å; G173-D193 WeakPolarHBondContact CA-O 3.32Å
174	G	80.1	Confident	80.9	Confident	18 Å²	18	59.9 Å²	59.9	19%	0.186	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-179.9	155.8	178.2	0	0	0	0	0	113.8	F176 D193	G174-F176 VanDerWaalsContact C-CE2 3.48Å; G174-D193 PolarHBondContact N-O 2.9Å; G174-D193 PolarHBondContact O-N 3.28Å
175	R	83.1	Confident	81	Confident	21 Å²	21	60 Å²	60	8%	0.079	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	130.8	-178.3	-57.7	173.7	173.3	-108.4	13.1	111	F89 D124 V127 N128 I191 R192	F89-R175 WeakPolarHBondContact CZ-O 3.18Å; D124-R175 IonicContact OD1-CZ 2.73Å; D124-R175 IonicContact OD1-NE 3.55Å; D124-R175 PolarHBondContact OD1-NE 3.17Å; D124-R175 IonicContact OD1-NH2 3.95Å; D124-R175 PolarHBondContact OD1-NH2 2.98Å; D124-R175 IonicContact OD2-CZ 3.11Å; D124-R175 IonicContact OD2-NH2 2.66Å; D124-R175 PolarHBondContact OD2-NH2 3.25Å; V127-R175 HydrophobicContact CG1-CB 3.9Å; V127-R175 HydrophobicContact CG1-CG 4.46Å; V127-R175 HydrophobicContact CG2-CB 4.18Å; N128-R175 PolarHBondContact ND2-NH1 2.9Å; N128-R175 PolarHBondContact ND2-NH2 2.89Å; N128-R175 PolarHBondContact OD1-NH1 3.43Å; R175-I191 CarbonylContact C-O 3.57Å; R175-I191 WeakPolarHBondContact CA-O 3.48Å; R175-R192 HydrophobicContact CG-CG 4.46Å
176	F	86.6	Confident	81.2	Confident	51 Å²	51	57.3 Å²	57.3	22%	0.224	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	156.6	-168.7	-46.6	-83.7	0	0	0	113.2	V157 L161 G174 I191 D193	V157-F176 HydrophobicContact CG1-CD2 3.64Å; V157-F176 HydrophobicContact CG1-CE2 3.73Å; V157-F176 HydrophobicContact CG1-CG 4.43Å; L161-F176 HydrophobicContact CD1-CB 3.61Å; L161-F176 HydrophobicContact CD1-CD1 3.44Å; L161-F176 VanDerWaalsContact CD1-CD1 3.44Å; L161-F176 HydrophobicContact CD1-CD2 3.96Å; L161-F176 HydrophobicContact CD1-CE1 4.05Å; L161-F176 HydrophobicContact CD1-CG 3.38Å; L161-F176 HydrophobicContact CD2-CB 4.13Å; G174-F176 VanDerWaalsContact C-CE2 3.48Å; F176-I191 HydrophobicContact CB-CB 4.28Å; F176-I191 HydrophobicContact CD2-CB 4.43Å; F176-I191 HydrophobicContact CD2-CG2 4.48Å; F176-I191 PolarHBondContact N-O 2.89Å; F176-I191 PolarHBondContact O-N 3.33Å; F176-D193 HydrophobicContact CE2-CB 4.41Å
177	K	86.4	Confident	81.6	Confident	14 Å²	14	55.7 Å²	55.7	6%	0.061	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	130.8	176.4	-58.2	-164.6	-172.1	-173.4	0	110.4	E85 I86 F89 L188 L189 L190	E85-K177 IonicContact OE1-NZ 3.39Å; E85-K177 PolarHBondContact OE1-NZ 2.98Å; I86-K177 HydrophobicContact CG1-CB 4.11Å; F89-K177 HydrophobicContact CB-CD 3.9Å; F89-K177 HydrophobicContact CB-CG 4.46Å; F89-K177 HydrophobicContact CD1-CB 3.98Å; F89-K177 HydrophobicContact CD1-CD 4.06Å; F89-K177 HydrophobicContact CD1-CG 3.69Å; F89-K177 HydrophobicContact CD2-CD 4Å; F89-K177 VanDerWaalsContact CD2-CE 3.45Å; F89-K177 HydrophobicContact CD2-CG 4.29Å; F89-K177 HydrophobicContact CE1-CB 4.37Å; F89-K177 HydrophobicContact CE1-CG 3.91Å; F89-K177 HydrophobicContact CE2-CG 4.47Å; F89-K177 HydrophobicContact CG-CB 4.48Å; F89-K177 HydrophobicContact CG-CD 3.71Å; F89-K177 HydrophobicContact CG-CG 3.89Å; F89-K177 HydrophobicContact CZ-CG 4.29Å; K177-L188 HydrophobicContact CB-CD1 4.15Å; K177-L188 HydrophobicContact CD-CD1 4.46Å; K177-L189 WeakPolarHBondContact CA-O 3.48Å; K177-L190 HydrophobicContact CD-CD2 3.94Å; K177-L190 HydrophobicContact CG-CD2 3.74Å
178	K	88.6	Confident	82.4	Confident	39 Å²	39	48.7 Å²	48.7	17%	0.17	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	152.1	174.6	179.4	169.4	160.9	-168.6	0	111.1	Y160 L161 L189 E288	Y160-K178 HydrophobicContact CD1-CD 4.09Å; Y160-K178 HydrophobicContact CE1-CD 3.56Å; Y160-K178 PolarHBondContact O-NZ 3.39Å; L161-K178 HydrophobicContact CD2-CB 4Å; L161-K178 HydrophobicContact CD2-CD 4.18Å; K178-L189 PolarHBondContact N-O 2.97Å; K178-L189 WeakPolarHBondContact O-CB 3.18Å; K178-L189 PolarHBondContact O-N 2.93Å; K178-E288 IonicContact NZ-OE1 3.45Å; K178-E288 PolarHBondContact NZ-OE1 3.06Å; K178-E288 IonicContact NZ-OE2 2.79Å; K178-E288 PolarHBondContact NZ-OE2 2.88Å
179	E	90.3	Very high	83.3	Confident	43 Å²	43	41.2 Å²	41.2	20%	0.201	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	128.1	169.6	-176.3	171.9	-163.9	0	0	109	S79 I82 R83 I86 S186	S79-E179 WeakPolarHBondContact CA-OE1 3.41Å; S79-E179 VanDerWaalsContact CB-OE1 3.31Å; S79-E179 WeakPolarHBondContact CB-OE1 3.48Å; S79-E179 PolarHBondContact OG-OE1 2.81Å; I82-E179 HydrophobicContact CG2-CB 3.73Å; I82-E179 HydrophobicContact CG2-CG 3.85Å; R83-E179 WeakPolarHBondContact CG-OE2 3.29Å; R83-E179 IonicContact CZ-OE2 3.25Å; R83-E179 IonicContact NH1-OE1 2.66Å; R83-E179 IonicContact NH1-OE2 3.77Å; R83-E179 PolarHBondContact NH1-OE2 2.71Å; I86-E179 HydrophobicContact CD1-CB 4.01Å; I86-E179 VanDerWaalsContact CD1-N 3.29Å; E179-S186 VanDerWaalsContact OE1-CB 3.24Å; E179-S186 WeakPolarHBondContact OE1-CB 3.41Å; E179-S186 PolarHBondContact OE1-OG 3.15Å
180	I	92.5	Very high	84.2	Confident	5 Å²	5	40 Å²	40	3%	0.026	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	142.3	172.1	-165.5	168.7	0	0	0	110.1	L141 V182 S186 Y187 L189 A295	L141-I180 HydrophobicContact CD1-CG2 3.98Å; I180-V182 HydrophobicContact CG1-CG2 4.49Å; I180-S186 WeakPolarHBondContact O-CA 3.47Å; I180-Y187 PolarHBondContact N-O 3.08Å; I180-Y187 VanDerWaalsContact N-O 3.09Å; I180-Y187 PolarHBondContact O-N 2.68Å; I180-L189 HydrophobicContact CB-CB 4.31Å; I180-L189 HydrophobicContact CB-CD2 4.38Å; I180-L189 HydrophobicContact CD1-CD2 4.11Å; I180-L189 HydrophobicContact CG2-CB 3.84Å; I180-L189 HydrophobicContact CG2-CD2 4.44Å; I180-A295 HydrophobicContact CD1-CB 3.6Å
181	V	90.8	Very high	85.1	Confident	73 Å²	73	37.8 Å²	37.8	44%	0.442	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	122	179.4	-177.4	0	0	0	0	109.5	Q185 Q292	V181-Q185 WeakPolarHBondContact CA-O 3.44Å; V181-Q292 PolarHBondContact O-NE2 3.28Å
182	V	91	Very high	86.4	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	129.7	178.6	-176.9	0	0	0	0	108.3	I180 G184 Q185 Y187 A295 Q296 V299	I180-V182 HydrophobicContact CG1-CG2 4.49Å; V182-G184 PolarHBondContact O-N 3.01Å; V182-G184 VanDerWaalsContact O-N 3.11Å; V182-Q185 PolarHBondContact N-O 3.09Å; V182-Q185 PolarHBondContact O-N 3.45Å; V182-Y187 HydrophobicContact CB-CD2 4.09Å; V182-Y187 HydrophobicContact CB-CE2 3.92Å; V182-Y187 HydrophobicContact CG2-CD2 4.37Å; V182-A295 HydrophobicContact CG2-CB 3.79Å; V182-Q296 HydrophobicContact CG1-CG 3.93Å; V182-V299 HydrophobicContact CB-CG2 4.26Å; V182-V299 HydrophobicContact CG1-CB 4.02Å; V182-V299 HydrophobicContact CG1-CG1 4.17Å; V182-V299 HydrophobicContact CG1-CG2 3.93Å
183	D	87.1	Confident	87.6	Confident	109 Å²	109	29.1 Å²	29.1	58%	0.583	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.9	32.6	-177.9	-53.8	-16.1	0	0	0	114.3	Q185 K303	D183-Q185 VanDerWaalsContact C-N 3.34Å; D183-K303 IonicContact OD2-NZ 3.83Å; D183-K303 PolarHBondContact OD2-NZ 2.92Å
184	G	81.1	Confident	88.1	Confident	58 Å²	58	29.9 Å²	29.9	60%	0.598	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	81.2	4.1	-177.7	0	0	0	0	0	115.5	V182	V182-G184 PolarHBondContact O-N 3.01Å; V182-G184 VanDerWaalsContact O-N 3.11Å
185	Q	85.4	Confident	88	Confident	80 Å²	80	29.7 Å²	29.7	37%	0.374	16%	0.164	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	132.6	178.7	178.1	175.1	2.8	0	0	110.8	V181 V182 D183 Y187	V181-Q185 WeakPolarHBondContact CA-O 3.44Å; V182-Q185 PolarHBondContact N-O 3.09Å; V182-Q185 PolarHBondContact O-N 3.45Å; D183-Q185 VanDerWaalsContact C-N 3.34Å; Q185-Y187 HydrophobicContact CB-CE2 3.85Å; Q185-Y187 HydrophobicContact CG-CD2 4.37Å; Q185-Y187 HydrophobicContact CG-CE2 3.77Å; Q185-Y187 WeakPolarHBondContact O-CD2 3.21Å; Q185-Y187 WeakPolarHBondContact O-CE2 3.33Å; Q185-Y187 PolarHBondContact OE1-OH 3.23Å; Q185-Y187 VanDerWaalsContact OE1-OH 3.14Å
186	S	87.7	Confident	88	Confident	13 Å²	13	29.6 Å²	29.6	9%	0.091	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	136.7	171.1	-64.1	0	0	0	0	111.8	P139 E179 I180	P139-S186 WeakPolarHBondContact CG-O 3.5Å; E179-S186 VanDerWaalsContact OE1-CB 3.24Å; E179-S186 WeakPolarHBondContact OE1-CB 3.41Å; E179-S186 PolarHBondContact OE1-OG 3.15Å; I180-S186 WeakPolarHBondContact O-CA 3.47Å
187	Y	89.5	Confident	88.1	Confident	17 Å²	17	29.6 Å²	29.6	7%	0.067	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	149.9	173.4	-66.7	-100.6	0	0	0	110.2	P139 L141 I180 V182 Q185 L189 V299	P139-Y187 HydrophobicContact CB-CD1 3.59Å; P139-Y187 HydrophobicContact CB-CE1 3.72Å; P139-Y187 HydrophobicContact CG-CD1 3.69Å; P139-Y187 HydrophobicContact CG-CE1 3.98Å; P139-Y187 HydrophobicContact CG-CG 4.17Å; P139-Y187 WeakPolarHBondContact O-CA 3.41Å; L141-Y187 HydrophobicContact CD1-CD1 3.93Å; L141-Y187 HydrophobicContact CD1-CD2 4.36Å; L141-Y187 HydrophobicContact CD1-CG 3.73Å; L141-Y187 HydrophobicContact CD2-CD1 4.01Å; L141-Y187 HydrophobicContact CD2-CE1 4.41Å; L141-Y187 HydrophobicContact CG-CD1 3.77Å; L141-Y187 HydrophobicContact CG-CG 4.03Å; I180-Y187 PolarHBondContact N-O 3.08Å; I180-Y187 VanDerWaalsContact N-O 3.09Å; I180-Y187 PolarHBondContact O-N 2.68Å; V182-Y187 HydrophobicContact CB-CD2 4.09Å; V182-Y187 HydrophobicContact CB-CE2 3.92Å; V182-Y187 HydrophobicContact CG2-CD2 4.37Å; Q185-Y187 HydrophobicContact CB-CE2 3.85Å; Q185-Y187 HydrophobicContact CG-CD2 4.37Å; Q185-Y187 HydrophobicContact CG-CE2 3.77Å; Q185-Y187 WeakPolarHBondContact O-CD2 3.21Å; Q185-Y187 WeakPolarHBondContact O-CE2 3.33Å; Q185-Y187 PolarHBondContact OE1-OH 3.23Å; Q185-Y187 VanDerWaalsContact OE1-OH 3.14Å; Y187-L189 PolarHBondContact O-N 2.72Å; Y187-V299 HydrophobicContact CE1-CG2 3.93Å; Y187-V299 HydrophobicContact CE2-CG2 4.08Å
188	L	89	Confident	88.2	Confident	4 Å²	4	29 Å²	29	2%	0.021	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	107	167.7	178.9	59.7	0	0	0	108.7	I82 E85 I86 V138 P139 E140 L141 K177 L190	I82-L188 HydrophobicContact CG1-CB 4.39Å; I82-L188 HydrophobicContact CG2-CD1 4.23Å; E85-L188 HydrophobicContact CG-CD2 4.49Å; I86-L188 HydrophobicContact CD1-CD1 4.3Å; I86-L188 HydrophobicContact CG1-CD1 3.99Å; V138-L188 HydrophobicContact CG1-CB 3.69Å; V138-L188 HydrophobicContact CG1-CD2 4.33Å; P139-L188 PolarHBondContact O-N 3.45Å; E140-L188 CarbonylContact C-O 3.46Å; E140-L188 WeakPolarHBondContact CA-O 3.27Å; E140-L188 HydrophobicContact CG-CD2 4.45Å; L141-L188 PolarHBondContact N-O 2.86Å; K177-L188 HydrophobicContact CB-CD1 4.15Å; K177-L188 HydrophobicContact CD-CD1 4.46Å; L188-L190 HydrophobicContact CD1-CD2 4.41Å; L188-L190 HydrophobicContact CD2-CD2 4.05Å; L188-L190 HydrophobicContact CG-CD2 3.88Å; L188-L190 HydrophobicContact CG-CG 4.43Å
189	L	92.1	Very high	88.2	Confident	1 Å²	1	31.5 Å²	31.5	1%	0.005	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	115.7	175.4	-176.5	61.8	0	0	0	109.4	L141 V143 Y160 K177 K178 I180 Y187 I191 F291	L141-L189 HydrophobicContact CB-CD1 4.04Å; V143-L189 HydrophobicContact CB-CD1 4.23Å; V143-L189 HydrophobicContact CG2-CD1 3.59Å; Y160-L189 HydrophobicContact CE1-CD2 3.71Å; Y160-L189 WeakPolarHBondContact OH-CD2 3.48Å; K177-L189 WeakPolarHBondContact CA-O 3.48Å; K178-L189 PolarHBondContact N-O 2.97Å; K178-L189 WeakPolarHBondContact O-CB 3.18Å; K178-L189 PolarHBondContact O-N 2.93Å; I180-L189 HydrophobicContact CB-CB 4.31Å; I180-L189 HydrophobicContact CB-CD2 4.38Å; I180-L189 HydrophobicContact CD1-CD2 4.11Å; I180-L189 HydrophobicContact CG2-CB 3.84Å; I180-L189 HydrophobicContact CG2-CD2 4.44Å; Y187-L189 PolarHBondContact O-N 2.72Å; L189-I191 HydrophobicContact CD2-CD1 4.25Å; L189-I191 HydrophobicContact CD2-CG1 4.22Å; L189-I191 HydrophobicContact CG-CD1 4.47Å; L189-I191 HydrophobicContact CG-CG1 3.95Å; L189-F291 HydrophobicContact CD2-CD1 4.23Å
190	L	90.4	Very high	88	Confident	19 Å²	19	34.4 Å²	34.4	10%	0.099	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	115.8	173.4	-56.2	179	0	0	0	107.9	E140 L141 K142 V143 K177 L188 W205	E140-L190 HydrophobicContact CB-CD1 4.4Å; E140-L190 HydrophobicContact CG-CD1 4.43Å; L141-L190 PolarHBondContact O-N 3.19Å; K142-L190 WeakPolarHBondContact CA-O 3.49Å; K142-L190 HydrophobicContact CG-CB 4.23Å; K142-L190 HydrophobicContact CG-CD1 4.03Å; V143-L190 PolarHBondContact N-O 3.12Å; K177-L190 HydrophobicContact CD-CD2 3.94Å; K177-L190 HydrophobicContact CG-CD2 3.74Å; L188-L190 HydrophobicContact CD1-CD2 4.41Å; L188-L190 HydrophobicContact CD2-CD2 4.05Å; L188-L190 HydrophobicContact CG-CD2 3.88Å; L188-L190 HydrophobicContact CG-CG 4.43Å; L190-W205 HydrophobicContact CB-CH2 4Å; L190-W205 HydrophobicContact CB-CZ2 4Å
191	I	92.4	Very high	87.7	Confident	2 Å²	2	40.8 Å²	40.8	1%	0.01	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	136.9	-179	-50.9	171.5	0	0	0	108.7	V143 I145 V157 Y160 L161 R175 F176 L189 F291	V143-I191 WeakPolarHBondContact O-CA 3.43Å; I145-I191 HydrophobicContact CD1-CG2 3.55Å; I145-I191 HydrophobicContact CG1-CG2 4.14Å; V157-I191 HydrophobicContact CG1-CD1 4.5Å; V157-I191 HydrophobicContact CG1-CG2 4.03Å; Y160-I191 HydrophobicContact CD1-CD1 3.82Å; Y160-I191 HydrophobicContact CE1-CD1 3.86Å; L161-I191 HydrophobicContact CD2-CD1 4.06Å; R175-I191 CarbonylContact C-O 3.57Å; R175-I191 WeakPolarHBondContact CA-O 3.48Å; F176-I191 HydrophobicContact CB-CB 4.28Å; F176-I191 HydrophobicContact CD2-CB 4.43Å; F176-I191 HydrophobicContact CD2-CG2 4.48Å; F176-I191 PolarHBondContact N-O 2.89Å; F176-I191 PolarHBondContact O-N 3.33Å; L189-I191 HydrophobicContact CD2-CD1 4.25Å; L189-I191 HydrophobicContact CD2-CG1 4.22Å; L189-I191 HydrophobicContact CG-CD1 4.47Å; L189-I191 HydrophobicContact CG-CG1 3.95Å; I191-F291 HydrophobicContact CD1-CD1 4.37Å; I191-F291 HydrophobicContact CD1-CE1 3.82Å; I191-F291 HydrophobicContact CG1-CE1 4.35Å; I191-F291 HydrophobicContact CG2-CE1 4.41Å
192	R	90.6	Very high	87.6	Confident	27 Å²	27	37.3 Å²	37.3	10%	0.102	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	103.6	174.7	-179.1	170.3	168.1	162.6	1.2	109.5	V143 G144 I145 R175 E194 F202 W205	V143-R192 PolarHBondContact O-N 2.89Å; G144-R192 CarbonylContact C-O 3.59Å; G144-R192 WeakPolarHBondContact CA-O 3.39Å; I145-R192 PolarHBondContact N-O 3.28Å; R175-R192 HydrophobicContact CG-CG 4.46Å; R192-E194 IonicContact CZ-OE1 3.2Å; R192-E194 IonicContact NE-OE1 3.97Å; R192-E194 PolarHBondContact NE-OE1 3.31Å; R192-E194 IonicContact NH2-OE1 3.34Å; R192-E194 PolarHBondContact NH2-OE1 3.01Å; R192-F202 HydrophobicContact CG-CD2 4.35Å; R192-F202 HydrophobicContact CG-CE2 4.45Å; R192-W205 HydrophobicContact CB-CE3 4.26Å; R192-W205 HydrophobicContact CB-CH2 3.72Å; R192-W205 HydrophobicContact CB-CZ3 3.53Å; R192-W205 HydrophobicContact CG-CZ3 4.48Å
193	D	90.9	Very high	87.6	Confident	5 Å²	5	37.3 Å²	37.3	3%	0.027	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	121.6	171.5	179	12.2	0	0	0	108.8	K153 S154 V157 G173 G174 F176	K153-D193 VanDerWaalsContact CD-OD1 3.27Å; K153-D193 WeakPolarHBondContact CD-OD1 3.34Å; K153-D193 WeakPolarHBondContact CE-OD1 3.46Å; K153-D193 VanDerWaalsContact NZ-CG 3.3Å; K153-D193 IonicContact NZ-OD1 3.97Å; K153-D193 PolarHBondContact NZ-OD1 2.61Å; K153-D193 IonicContact NZ-OD2 3.69Å; K153-D193 PolarHBondContact NZ-OD2 2.85Å; K153-D193 VanDerWaalsContact NZ-OD2 3.15Å; S154-D193 WeakPolarHBondContact CB-OD2 3.29Å; S154-D193 PolarHBondContact OG-OD2 3.31Å; V157-D193 HydrophobicContact CG2-CB 4.2Å; G173-D193 CarbonylContact C-O 3.58Å; G173-D193 WeakPolarHBondContact CA-O 3.32Å; G174-D193 PolarHBondContact N-O 2.9Å; G174-D193 PolarHBondContact O-N 3.28Å; F176-D193 HydrophobicContact CE2-CB 4.41Å
194	E	85.5	Confident	87.6	Confident	29 Å²	29	35.7 Å²	35.7	14%	0.136	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	127	176.4	-72.4	-70.6	152.2	0	0	110.5	I145 V146 K153 R192 G196 F202	I145-E194 PolarHBondContact O-N 2.84Å; V146-E194 HydrophobicContact CG1-CB 4.3Å; K153-E194 VanDerWaalsContact CE-O 3.22Å; K153-E194 WeakPolarHBondContact CE-O 2.97Å; K153-E194 PolarHBondContact NZ-O 3.04Å; R192-E194 IonicContact CZ-OE1 3.2Å; R192-E194 IonicContact NE-OE1 3.97Å; R192-E194 PolarHBondContact NE-OE1 3.31Å; R192-E194 IonicContact NH2-OE1 3.34Å; R192-E194 PolarHBondContact NH2-OE1 3.01Å; E194-G196 PolarHBondContact O-N 3.43Å; E194-F202 HydrophobicContact CG-CD2 3.43Å; E194-F202 VanDerWaalsContact CG-CD2 3.43Å; E194-F202 HydrophobicContact CG-CE2 3.45Å; E194-F202 VanDerWaalsContact CG-CE2 3.45Å; E194-F202 HydrophobicContact CG-CG 4.18Å; E194-F202 HydrophobicContact CG-CZ 4.22Å; E194-F202 WeakPolarHBondContact OE1-CD2 3.36Å
195	G	77.6	Confident	87.9	Confident	13 Å²	13	35.2 Å²	35.2	13%	0.134	19%	0.192	C	C	.	.	S	Bend	trans	-72.2	-11.2	169.3	0	0	0	0	0	114.3
196	G	83.2	Confident	88.3	Confident	20 Å²	20	31.6 Å²	31.6	21%	0.206	18%	0.175	C	C	.	.	S	Bend	trans	-138.7	-173.2	-169.4	0	0	0	0	0	115.5	E194	E194-G196 PolarHBondContact O-N 3.43Å
197	P	86.9	Confident	88.6	Confident	51 Å²	51	32.5 Å²	32.5	33%	0.331	18%	0.179	S	C	.	.	S	Bend	trans	-67.2	139.4	179.7	28.5	-34.9	0	0	0	111.5	E199 Y227	P197-E199 PolarHBondContact O-N 3.29Å; P197-Y227 HydrophobicContact CB-CD1 4.01Å; P197-Y227 HydrophobicContact CB-CE1 3.56Å
198	P	89.4	Confident	88.8	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	18%	0.176	C	C	.	.	P	Polyproline II helix	trans	-64.2	136.3	-171.1	25.9	-32.8	0	0	0	111.5	F202 Y227 R230 L231 Y234	P198-F202 HydrophobicContact CB-CD1 3.72Å; P198-F202 HydrophobicContact CB-CE1 3.96Å; P198-Y227 WeakPolarHBondContact CG-O 3.34Å; P198-R230 HydrophobicContact CG-CB 4.49Å; P198-R230 WeakPolarHBondContact O-CD 3.33Å; P198-R230 PolarHBondContact O-NE 3.32Å; P198-L231 HydrophobicContact CG-CB 4.3Å; P198-Y234 WeakPolarHBondContact O-CE2 3.5Å
199	E	89	Confident	89.2	Confident	93 Å²	93	31.5 Å²	31.5	44%	0.435	18%	0.175	S	C	.	.	P	Polyproline II helix	trans	-100.3	168.5	-179.9	-60	-153.9	141.1	0	0	113.3	P197 Q201 F202 A203	P197-E199 PolarHBondContact O-N 3.29Å; E199-Q201 VanDerWaalsContact C-N 3.29Å; E199-Q201 PolarHBondContact O-N 2.95Å; E199-F202 PolarHBondContact O-N 2.88Å; E199-A203 WeakPolarHBondContact O-CB 3.48Å; E199-A203 PolarHBondContact O-N 3.47Å
200	L	86.8	Confident	89.4	Confident	103 Å²	103	31.5 Å²	31.5	54%	0.539	18%	0.175	S	C	.	.	H	α-helix	trans	-57.8	-39.8	173.5	178.6	60.2	0	0	0	112.4	A203 A204 Y234	L200-A203 PolarHBondContact O-N 3.01Å; L200-A204 WeakPolarHBondContact O-CB 3.43Å; L200-A204 PolarHBondContact O-N 2.88Å; L200-Y234 HydrophobicContact CB-CD1 3.99Å; L200-Y234 HydrophobicContact CB-CE1 4.13Å; L200-Y234 HydrophobicContact CB-CG 4.19Å; L200-Y234 HydrophobicContact CD1-CD1 3.91Å; L200-Y234 HydrophobicContact CD1-CG 4.08Å; L200-Y234 HydrophobicContact CG-CD1 4.47Å
201	Q	85	Confident	89.7	Confident	139 Å²	139	30.6 Å²	30.6	65%	0.65	17%	0.17	S	C	*	.	H	α-helix	trans	-64.9	-44.6	177.8	-59.9	-167.3	35.2	0	0	111.7	E199 A204 W205	E199-Q201 VanDerWaalsContact C-N 3.29Å; E199-Q201 PolarHBondContact O-N 2.95Å; Q201-A204 PolarHBondContact O-N 2.91Å; Q201-W205 WeakPolarHBondContact O-CB 3.36Å; Q201-W205 PolarHBondContact O-N 3.49Å
202	F	89.5	Confident	89.9	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-61	-48.7	174.3	172.2	-89.8	0	0	0	111.1	G144 V146 R192 E194 P198 E199 A204 W205 V206 V209	G144-F202 VanDerWaalsContact CA-CZ 3.49Å; V146-F202 HydrophobicContact CG2-CE1 3.7Å; V146-F202 HydrophobicContact CG2-CE2 4.26Å; V146-F202 HydrophobicContact CG2-CZ 3.33Å; R192-F202 HydrophobicContact CG-CD2 4.35Å; R192-F202 HydrophobicContact CG-CE2 4.45Å; E194-F202 HydrophobicContact CG-CD2 3.43Å; E194-F202 VanDerWaalsContact CG-CD2 3.43Å; E194-F202 HydrophobicContact CG-CE2 3.45Å; E194-F202 VanDerWaalsContact CG-CE2 3.45Å; E194-F202 HydrophobicContact CG-CG 4.18Å; E194-F202 HydrophobicContact CG-CZ 4.22Å; E194-F202 WeakPolarHBondContact OE1-CD2 3.36Å; P198-F202 HydrophobicContact CB-CD1 3.72Å; P198-F202 HydrophobicContact CB-CE1 3.96Å; E199-F202 PolarHBondContact O-N 2.88Å; F202-A204 VanDerWaalsContact C-N 3.25Å; F202-A204 PolarHBondContact O-N 3.47Å; F202-W205 PolarHBondContact O-N 3.43Å; F202-V206 HydrophobicContact CD1-CG1 4.36Å; F202-V206 HydrophobicContact CD2-CG1 4.24Å; F202-V206 HydrophobicContact CE1-CG1 4.03Å; F202-V206 HydrophobicContact CE2-CG1 3.92Å; F202-V206 HydrophobicContact CG-CG1 4.46Å; F202-V206 HydrophobicContact CZ-CG1 3.81Å; F202-V206 PolarHBondContact O-N 2.69Å; F202-V206 VanDerWaalsContact O-N 3.12Å; F202-V209 HydrophobicContact CE1-CG2 4.07Å; F202-V209 HydrophobicContact CZ-CG2 4.33Å
203	A	89.9	Confident	90.1	Very high	1 Å²	1	29.2 Å²	29.2	1%	0.008	17%	0.165	C	C	.	.	H	α-helix	trans	-60	-32.8	179.4	0	0	0	0	0	113.1	E199 L200 L231 Y234 R235	E199-A203 WeakPolarHBondContact O-CB 3.48Å; E199-A203 PolarHBondContact O-N 3.47Å; L200-A203 PolarHBondContact O-N 3.01Å; A203-L231 HydrophobicContact CB-CD1 3.66Å; A203-Y234 HydrophobicContact CB-CD2 4.35Å; A203-Y234 HydrophobicContact CB-CG 4.46Å; A203-R235 WeakPolarHBondContact O-CD 3.43Å; A203-R235 PolarHBondContact O-NH1 3.16Å
204	A	87.1	Confident	90.4	Very high	75 Å²	75	29.2 Å²	29.2	62%	0.62	17%	0.166	S	C	*	.	H	α-helix	trans	-78.8	-29.4	174.1	0	0	0	0	0	113.5	L200 Q201 F202	L200-A204 WeakPolarHBondContact O-CB 3.43Å; L200-A204 PolarHBondContact O-N 2.88Å; Q201-A204 PolarHBondContact O-N 2.91Å; F202-A204 VanDerWaalsContact C-N 3.25Å; F202-A204 PolarHBondContact O-N 3.47Å
205	W	88.4	Confident	90.8	Very high	48 Å²	48	27.9 Å²	27.9	18%	0.182	16%	0.159	C	C	.	.	H	α-helix	trans	-79.7	-37.3	-176	179.5	95.6	0	0	0	113.9	K142 L190 R192 Q201 F202	K142-W205 HydrophobicContact CB-CD2 4.35Å; K142-W205 HydrophobicContact CB-CE3 4.04Å; K142-W205 HydrophobicContact CB-CH2 3.88Å; K142-W205 HydrophobicContact CB-CZ2 4.21Å; K142-W205 HydrophobicContact CB-CZ3 3.8Å; K142-W205 HydrophobicContact CD-CD2 4.12Å; K142-W205 HydrophobicContact CD-CG 4.46Å; K142-W205 HydrophobicContact CD-CZ2 4.18Å; K142-W205 WeakPolarHBondContact CD-O 3.37Å; K142-W205 HydrophobicContact CG-CD2 4.47Å; K142-W205 HydrophobicContact CG-CH2 4.09Å; K142-W205 HydrophobicContact CG-CZ2 3.94Å; K142-W205 HydrophobicContact CG-CZ3 4.43Å; L190-W205 HydrophobicContact CB-CH2 4Å; L190-W205 HydrophobicContact CB-CZ2 4Å; R192-W205 HydrophobicContact CB-CE3 4.26Å; R192-W205 HydrophobicContact CB-CH2 3.72Å; R192-W205 HydrophobicContact CB-CZ3 3.53Å; R192-W205 HydrophobicContact CG-CZ3 4.48Å; Q201-W205 WeakPolarHBondContact O-CB 3.36Å; Q201-W205 PolarHBondContact O-N 3.49Å; F202-W205 PolarHBondContact O-N 3.43Å
206	V	92.7	Very high	91.6	Very high	3 Å²	3	29.1 Å²	29.1	2%	0.018	16%	0.162	C	C	.	.			trans	-68.8	146.1	-174.4	-66.4	0	0	0	0	113.9	F202 V209 R235 V240	F202-V206 HydrophobicContact CD1-CG1 4.36Å; F202-V206 HydrophobicContact CD2-CG1 4.24Å; F202-V206 HydrophobicContact CE1-CG1 4.03Å; F202-V206 HydrophobicContact CE2-CG1 3.92Å; F202-V206 HydrophobicContact CG-CG1 4.46Å; F202-V206 HydrophobicContact CZ-CG1 3.81Å; F202-V206 PolarHBondContact O-N 2.69Å; F202-V206 VanDerWaalsContact O-N 3.12Å; V206-V209 HydrophobicContact CB-CG2 4.25Å; V206-V209 HydrophobicContact CG1-CG2 4.26Å; V206-V209 HydrophobicContact CG2-CG2 3.83Å; V206-R235 PolarHBondContact O-NH1 3.39Å; V206-R235 PolarHBondContact O-NH2 2.95Å; V206-V240 HydrophobicContact CG2-CG1 4.43Å
207	D	93.9	Very high	92.1	Very high	32 Å²	32	29.7 Å²	29.7	17%	0.171	16%	0.16	C	C	.	.	S	Bend	trans	-85.3	-40	156.8	-71.2	-79.3	0	0	0	110.9	K142 P241 V298 R302	K142-D207 WeakPolarHBondContact CB-OD2 3.33Å; K142-D207 PolarHBondContact N-OD2 2.86Å; K142-D207 WeakPolarHBondContact O-CA 3.33Å; K142-D207 WeakPolarHBondContact O-CB 3.37Å; K142-D207 PolarHBondContact O-N 2.89Å; D207-P241 WeakPolarHBondContact O-CD 3.37Å; D207-V298 HydrophobicContact CB-CB 4.38Å; D207-V298 HydrophobicContact CB-CG1 3.61Å; D207-V298 HydrophobicContact CB-CG2 3.76Å; D207-R302 IonicContact OD1-CZ 2.75Å; D207-R302 IonicContact OD1-NE 3.35Å; D207-R302 PolarHBondContact OD1-NE 3.14Å; D207-R302 IonicContact OD1-NH2 3.46Å; D207-R302 PolarHBondContact OD1-NH2 2.99Å; D207-R302 IonicContact OD2-CZ 3.04Å; D207-R302 IonicContact OD2-NH2 2.92Å; D207-R302 PolarHBondContact OD2-NH2 3.25Å
208	A	95.4	Very high	92.4	Very high	1 Å²	1	30.4 Å²	30.4	1%	0.008	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	161.4	-179.2	0	0	0	0	0	112.7	K142 G144 P241 V294 V298	K142-A208 PolarHBondContact O-N 2.93Å; G144-A208 PolarHBondContact N-O 2.96Å; A208-P241 WeakPolarHBondContact CA-O 3.35Å; A208-P241 HydrophobicContact CB-CB 4.04Å; A208-P241 HydrophobicContact CB-CG 4.21Å; A208-P241 WeakPolarHBondContact CB-O 3.37Å; A208-V294 HydrophobicContact CB-CG1 3.61Å; A208-V298 HydrophobicContact CB-CG2 3.47Å; A208-V298 VanDerWaalsContact CB-CG2 3.47Å
209	V	95.7	Very high	92.7	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	133.1	-178.6	177.5	0	0	0	0	112.1	G144 V146 F202 V206 F211 L231 V240 P241 M242 V243	G144-V209 CarbonylContact O-C 3.57Å; G144-V209 WeakPolarHBondContact O-CA 3.47Å; V146-V209 HydrophobicContact CG2-CG1 3.92Å; F202-V209 HydrophobicContact CE1-CG2 4.07Å; F202-V209 HydrophobicContact CZ-CG2 4.33Å; V206-V209 HydrophobicContact CB-CG2 4.25Å; V206-V209 HydrophobicContact CG1-CG2 4.26Å; V206-V209 HydrophobicContact CG2-CG2 3.83Å; V209-F211 HydrophobicContact CG1-CD2 4.17Å; V209-F211 HydrophobicContact CG1-CE1 4.21Å; V209-F211 HydrophobicContact CG1-CE2 3.84Å; V209-F211 HydrophobicContact CG1-CG 4.49Å; V209-F211 HydrophobicContact CG1-CZ 3.87Å; V209-L231 HydrophobicContact CB-CD2 4.21Å; V209-L231 HydrophobicContact CG1-CD2 4.23Å; V209-L231 HydrophobicContact CG2-CD2 3.85Å; V209-V240 HydrophobicContact CG2-CG1 4.02Å; V209-P241 PolarHBondContact N-O 3.03Å; V209-M242 WeakPolarHBondContact O-CA 3.5Å; V209-V243 PolarHBondContact O-N 3.48Å; V209-V243 VanDerWaalsContact O-N 3.16Å
210	V	96.9	Very high	92.9	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	120.6	168.1	-171.9	0	0	0	0	108.8	V143 G144 I145 V146 V212 V243 V245 V290 V294	V143-V210 HydrophobicContact CG1-CG2 3.98Å; G144-V210 PolarHBondContact O-N 3.42Å; I145-V210 WeakPolarHBondContact CA-O 3.29Å; I145-V210 HydrophobicContact CG1-CB 4.22Å; I145-V210 HydrophobicContact CG1-CG2 4.43Å; V146-V210 PolarHBondContact N-O 3.01Å; V210-V212 HydrophobicContact CG1-CG2 4.04Å; V210-V243 WeakPolarHBondContact CA-O 3.28Å; V210-V245 HydrophobicContact CG1-CB 4.39Å; V210-V245 HydrophobicContact CG1-CG2 3.54Å; V210-V290 HydrophobicContact CG1-CG1 4Å; V210-V290 HydrophobicContact CG2-CG1 4.31Å; V210-V294 HydrophobicContact CG2-CG2 3.65Å
211	F	96.4	Very high	93.3	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	125.8	170.7	-69.9	-76.4	0	0	0	109.6	V146 V209 V224 F228 L231 M242 V243 L244 V245	V146-F211 WeakPolarHBondContact O-CA 3.48Å; V209-F211 HydrophobicContact CG1-CD2 4.17Å; V209-F211 HydrophobicContact CG1-CE1 4.21Å; V209-F211 HydrophobicContact CG1-CE2 3.84Å; V209-F211 HydrophobicContact CG1-CG 4.49Å; V209-F211 HydrophobicContact CG1-CZ 3.87Å; F211-V224 HydrophobicContact CB-CG1 3.67Å; F211-V224 HydrophobicContact CB-CG2 4.13Å; F211-V224 HydrophobicContact CD1-CG1 4.05Å; F211-V224 HydrophobicContact CG-CG1 3.98Å; F211-F228 HydrophobicContact CE1-CB 4.23Å; F211-F228 HydrophobicContact CE2-CB 4.42Å; F211-F228 HydrophobicContact CE2-CD2 4.28Å; F211-F228 HydrophobicContact CZ-CB 3.91Å; F211-F228 HydrophobicContact CZ-CD2 4.3Å; F211-L231 HydrophobicContact CE2-CD2 4.38Å; F211-L231 HydrophobicContact CZ-CD2 3.78Å; F211-M242 HydrophobicContact CE2-CG 4.3Å; F211-M242 HydrophobicContact CE2-SD 3.91Å; F211-V243 PolarHBondContact N-O 2.89Å; F211-L244 HydrophobicContact CB-CD1 4.03Å; F211-V245 PolarHBondContact O-N 3Å
212	V	96.6	Very high	93.7	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	133.5	-177.3	-164.9	0	0	0	0	110	I145 V146 G147 S151 K153 L156 V210 V224 V245 T247	I145-V212 HydrophobicContact CG2-CG2 3.71Å; V146-V212 PolarHBondContact O-N 3.45Å; G147-V212 WeakPolarHBondContact CA-O 3.5Å; S151-V212 WeakPolarHBondContact CB-O 3.27Å; S151-V212 WeakPolarHBondContact O-CG1 3.37Å; K153-V212 HydrophobicContact CB-CB 4.12Å; K153-V212 HydrophobicContact CB-CG1 4.35Å; K153-V212 HydrophobicContact CB-CG2 4.22Å; L156-V212 HydrophobicContact CD2-CG1 4.32Å; L156-V212 HydrophobicContact CD2-CG2 4.03Å; V210-V212 HydrophobicContact CG1-CG2 4.04Å; V212-V224 VanDerWaalsContact O-CG2 3.32Å; V212-V224 WeakPolarHBondContact O-CG2 3.42Å; V212-V245 WeakPolarHBondContact CA-O 3.25Å; V212-V245 HydrophobicContact CG1-CB 4.45Å; V212-V245 HydrophobicContact CG1-CG1 4.39Å; V212-V245 HydrophobicContact CG2-CB 4.48Å; V212-T247 HydrophobicContact CG1-CG2 3.63Å
213	F	96.2	Very high	94	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	159.2	170.1	72.3	-87.1	0	0	0	109.7	L215 S220 F221 V224 L244 V245 G246 T247 I259 A264 Y276	F213-L215 HydrophobicContact CE2-CD2 3.73Å; F213-L215 HydrophobicContact CE2-CG 4.14Å; F213-L215 HydrophobicContact CZ-CD2 4.16Å; F213-S220 WeakPolarHBondContact CB-OG 3.37Å; F213-F221 HydrophobicContact CD1-CD2 4.28Å; F213-F221 HydrophobicContact CD2-CB 4.03Å; F213-F221 AromaticContact CD2-CD2 3.74Å; F213-F221 HydrophobicContact CD2-CD2 3.74Å; F213-F221 HydrophobicContact CD2-CG 4.38Å; F213-F221 HydrophobicContact CE1-CD2 4.19Å; F213-F221 AromaticContact CE2-CD2 3.64Å; F213-F221 HydrophobicContact CE2-CD2 3.64Å; F213-F221 HydrophobicContact CE2-CE2 4.31Å; F213-F221 HydrophobicContact CG-CB 4.4Å; F213-F221 HydrophobicContact CG-CD2 4.07Å; F213-F221 AromaticContact CZ-CD2 3.89Å; F213-F221 HydrophobicContact CZ-CD2 3.89Å; F213-F221 HydrophobicContact CZ-CE2 4.19Å; F213-V224 HydrophobicContact CB-CG2 3.97Å; F213-L244 HydrophobicContact CD1-CD1 3.77Å; F213-L244 HydrophobicContact CD1-CG 4.36Å; F213-L244 HydrophobicContact CE1-CD1 3.76Å; F213-L244 HydrophobicContact CE1-CD2 4.15Å; F213-L244 HydrophobicContact CE1-CG 3.85Å; F213-V245 WeakPolarHBondContact CD1-O 3.43Å; F213-V245 PolarHBondContact N-O 3.1Å; F213-G246 CarbonylContact O-C 3.56Å; F213-G246 WeakPolarHBondContact O-CA 3.31Å; F213-T247 PolarHBondContact O-N 3.29Å; F213-T247 PolarHBondContact O-OG1 3.44Å; F213-I259 HydrophobicContact CD2-CD1 4.06Å; F213-I259 HydrophobicContact CE2-CB 4.34Å; F213-I259 HydrophobicContact CE2-CD1 4.16Å; F213-I259 HydrophobicContact CE2-CG2 3.85Å; F213-I259 HydrophobicContact CZ-CG2 4.38Å; F213-A264 HydrophobicContact CZ-CB 3.94Å; F213-Y276 HydrophobicContact CE1-CE2 4.02Å; F213-Y276 AromaticContact CZ-CE2 3.88Å; F213-Y276 HydrophobicContact CZ-CE2 3.88Å
214	S	95.4	Very high	94.2	Very high	6 Å²	6	26.9 Å²	26.9	4%	0.042	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	137.1	174.6	173.6	0	0	0	0	111.1	S150 E216 D217 S220 T247 I259	S150-S214 WeakPolarHBondContact O-CB 3.27Å; S214-E216 PolarHBondContact O-N 3.17Å; S214-E216 WeakPolarHBondContact OG-CG 3.48Å; S214-D217 PolarHBondContact O-N 2.96Å; S214-D217 VanDerWaalsContact O-N 3.15Å; S214-S220 PolarHBondContact N-OG 2.86Å; S214-S220 PolarHBondContact O-OG 2.84Å; S214-T247 WeakPolarHBondContact CA-OG1 3.49Å; S214-I259 WeakPolarHBondContact O-CD1 3.35Å
215	L	95.7	Very high	94.4	Very high	0 Å²	0	28 Å²	28	0%	0	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-8.2	-174.1	-77.9	162.6	0	0	0	114.7	F213 T247 Q248 I251 R257 V258 I259 E278	F213-L215 HydrophobicContact CE2-CD2 3.73Å; F213-L215 HydrophobicContact CE2-CG 4.14Å; F213-L215 HydrophobicContact CZ-CD2 4.16Å; L215-T247 WeakPolarHBondContact CB-O 3.36Å; L215-T247 PolarHBondContact N-O 2.99Å; L215-Q248 HydrophobicContact CD1-CG 3.63Å; L215-I251 HydrophobicContact CB-CD1 3.93Å; L215-R257 HydrophobicContact CB-CG 4.4Å; L215-V258 PolarHBondContact O-N 3.45Å; L215-I259 HydrophobicContact CD2-CB 4.16Å; L215-I259 HydrophobicContact CD2-CG2 4.25Å; L215-I259 WeakPolarHBondContact CD2-O 3.47Å; L215-I259 PolarHBondContact O-N 2.67Å; L215-E278 HydrophobicContact CD1-CB 4.4Å; L215-E278 HydrophobicContact CD1-CG 4Å
216	E	93.9	Very high	94.6	Very high	40 Å²	40	29.8 Å²	29.8	19%	0.187	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100	-19.3	169	61.2	-179.3	-120.4	0	0	113.7	S214 A250 I251 N255 V258	S214-E216 PolarHBondContact O-N 3.17Å; S214-E216 WeakPolarHBondContact OG-CG 3.48Å; E216-A250 VanDerWaalsContact CD-CB 3.45Å; E216-A250 WeakPolarHBondContact OE1-CB 3.19Å; E216-A250 VanDerWaalsContact OE2-CB 3.29Å; E216-A250 WeakPolarHBondContact OE2-CB 3.42Å; E216-I251 WeakPolarHBondContact OE2-CA 3.33Å; E216-I251 PolarHBondContact OE2-N 2.86Å; E216-I251 VanDerWaalsContact OE2-N 3.1Å; E216-N255 PolarHBondContact OE1-ND2 3.39Å; E216-N255 VanDerWaalsContact OE2-CB 3.31Å; E216-N255 WeakPolarHBondContact OE2-CB 3.39Å; E216-V258 VanDerWaalsContact O-CG2 3.27Å; E216-V258 WeakPolarHBondContact O-CG2 3.34Å
217	D	93.1	Very high	94.7	Very high	31 Å²	31	31.1 Å²	31.1	17%	0.166	15%	0.15	C	C	.	.			trans	-104.7	100.7	-176.5	178.4	26.2	0	0	0	112.8	N148 S150 S214 I219 S220 F221	N148-D217 PolarHBondContact ND2-OD2 3.41Å; S150-D217 PolarHBondContact OG-OD2 3.22Å; S214-D217 PolarHBondContact O-N 2.96Å; S214-D217 VanDerWaalsContact O-N 3.15Å; D217-I219 PolarHBondContact O-N 3.2Å; D217-I219 WeakPolarHBondContact OD1-CA 3.45Å; D217-I219 VanDerWaalsContact OD1-CB 3.25Å; D217-I219 WeakPolarHBondContact OD1-CB 3.41Å; D217-I219 PolarHBondContact OD1-N 3.4Å; D217-S220 PolarHBondContact O-N 3.48Å; D217-S220 VanDerWaalsContact O-N 3.17Å; D217-S220 PolarHBondContact O-OG 2.65Å; D217-S220 VanDerWaalsContact OD2-CB 3.29Å; D217-S220 WeakPolarHBondContact OD2-CB 3.31Å; D217-S220 PolarHBondContact OD2-N 2.81Å; D217-F221 PolarHBondContact O-N 3.3Å
218	E	93.6	Very high	94.6	Very high	67 Å²	67	30.5 Å²	30.5	31%	0.313	15%	0.147	S	C	.	.	H	α-helix	trans	-55.5	-30.3	172.3	-171.9	63	-130.5	0	0	113.3	F221 Q222 V258 R263	E218-F221 PolarHBondContact O-N 3.07Å; E218-Q222 WeakPolarHBondContact O-CB 3.39Å; E218-Q222 PolarHBondContact O-N 3.41Å; E218-V258 HydrophobicContact CB-CG1 4.47Å; E218-R263 IonicContact OE1-CZ 2.68Å; E218-R263 IonicContact OE1-NH1 2.63Å; E218-R263 IonicContact OE1-NH2 2.81Å; E218-R263 PolarHBondContact OE1-NH2 2.89Å; E218-R263 IonicContact OE2-CZ 2.68Å; E218-R263 VanDerWaalsContact OE2-CZ 3.25Å; E218-R263 IonicContact OE2-NH1 3.08Å; E218-R263 PolarHBondContact OE2-NH1 2.93Å; E218-R263 IonicContact OE2-NH2 3.46Å; E218-R263 PolarHBondContact OE2-NH2 3.41Å
219	I	94.4	Very high	94.4	Very high	117 Å²	117	34 Å²	34	60%	0.6	17%	0.165	S	C	*	.	H	α-helix	trans	-69.3	-43	178.9	-54.5	178	0	0	0	110	D217 F221 Q222 T223	D217-I219 PolarHBondContact O-N 3.2Å; D217-I219 WeakPolarHBondContact OD1-CA 3.45Å; D217-I219 VanDerWaalsContact OD1-CB 3.25Å; D217-I219 WeakPolarHBondContact OD1-CB 3.41Å; D217-I219 PolarHBondContact OD1-N 3.4Å; I219-F221 VanDerWaalsContact C-N 3.34Å; I219-F221 PolarHBondContact O-N 2.96Å; I219-Q222 PolarHBondContact O-N 2.87Å; I219-T223 VanDerWaalsContact O-CB 3.27Å; I219-T223 WeakPolarHBondContact O-CB 3.42Å; I219-T223 PolarHBondContact O-N 2.91Å; I219-T223 PolarHBondContact O-OG1 2.95Å
220	S	94.6	Very high	94.3	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-59.3	-43.2	174.1	74.6	0	0	0	0	112.4	N148 F213 S214 D217 T223 V224	N148-S220 WeakPolarHBondContact ND2-CA 3.27Å; N148-S220 PolarHBondContact ND2-N 3.09Å; N148-S220 WeakPolarHBondContact OD1-CA 3.27Å; N148-S220 WeakPolarHBondContact OD1-CB 3.3Å; F213-S220 WeakPolarHBondContact CB-OG 3.37Å; S214-S220 PolarHBondContact N-OG 2.86Å; S214-S220 PolarHBondContact O-OG 2.84Å; D217-S220 PolarHBondContact O-N 3.48Å; D217-S220 VanDerWaalsContact O-N 3.17Å; D217-S220 PolarHBondContact O-OG 2.65Å; D217-S220 VanDerWaalsContact OD2-CB 3.29Å; D217-S220 WeakPolarHBondContact OD2-CB 3.31Å; D217-S220 PolarHBondContact OD2-N 2.81Å; S220-T223 PolarHBondContact O-N 3.15Å; S220-V224 PolarHBondContact O-N 3.33Å; S220-V224 VanDerWaalsContact O-N 3.07Å
221	F	95.1	Very high	94	Very high	21 Å²	21	38.6 Å²	38.6	9%	0.092	18%	0.182	C	C	.	.	H	α-helix	trans	-63.2	-46.8	178.5	-178.2	-103.9	0	0	0	112	F213 D217 E218 I219 T223 V224 I259 R263 L267	F213-F221 HydrophobicContact CD1-CD2 4.28Å; F213-F221 HydrophobicContact CD2-CB 4.03Å; F213-F221 AromaticContact CD2-CD2 3.74Å; F213-F221 HydrophobicContact CD2-CD2 3.74Å; F213-F221 HydrophobicContact CD2-CG 4.38Å; F213-F221 HydrophobicContact CE1-CD2 4.19Å; F213-F221 AromaticContact CE2-CD2 3.64Å; F213-F221 HydrophobicContact CE2-CD2 3.64Å; F213-F221 HydrophobicContact CE2-CE2 4.31Å; F213-F221 HydrophobicContact CG-CB 4.4Å; F213-F221 HydrophobicContact CG-CD2 4.07Å; F213-F221 AromaticContact CZ-CD2 3.89Å; F213-F221 HydrophobicContact CZ-CD2 3.89Å; F213-F221 HydrophobicContact CZ-CE2 4.19Å; D217-F221 PolarHBondContact O-N 3.3Å; E218-F221 PolarHBondContact O-N 3.07Å; I219-F221 VanDerWaalsContact C-N 3.34Å; I219-F221 PolarHBondContact O-N 2.96Å; F221-T223 VanDerWaalsContact C-N 3.29Å; F221-T223 PolarHBondContact O-N 3.45Å; F221-V224 PolarHBondContact O-N 3.41Å; F221-I259 HydrophobicContact CB-CD1 3.64Å; F221-I259 HydrophobicContact CB-CG1 4.08Å; F221-I259 HydrophobicContact CD2-CD1 4.47Å; F221-I259 HydrophobicContact CD2-CG1 4.39Å; F221-I259 HydrophobicContact CD2-CG2 3.78Å; F221-I259 HydrophobicContact CE2-CG2 3.79Å; F221-I259 HydrophobicContact CG-CD1 4.15Å; F221-I259 HydrophobicContact CG-CG1 4.09Å; F221-I259 HydrophobicContact CG-CG2 4.24Å; F221-I259 HydrophobicContact CZ-CG2 4.3Å; F221-R263 HydrophobicContact CZ-CB 4.26Å; F221-L267 HydrophobicContact CD2-CD2 3.8Å; F221-L267 HydrophobicContact CE2-CB 3.98Å; F221-L267 HydrophobicContact CE2-CD2 3.37Å; F221-L267 HydrophobicContact CE2-CG 4.31Å; F221-L267 HydrophobicContact CZ-CB 3.87Å; F221-L267 HydrophobicContact CZ-CD2 3.8Å; F221-L267 HydrophobicContact CZ-CG 4.43Å
222	Q	93.6	Very high	93.7	Very high	97 Å²	97	41 Å²	41	45%	0.453	20%	0.199	S	C	.	.	H	α-helix	trans	-68.7	-28.2	175.9	-171.9	54.9	66.9	0	0	112.5	E218 I219 N226	E218-Q222 WeakPolarHBondContact O-CB 3.39Å; E218-Q222 PolarHBondContact O-N 3.41Å; I219-Q222 PolarHBondContact O-N 2.87Å; Q222-N226 PolarHBondContact O-N 2.83Å; Q222-N226 PolarHBondContact O-ND2 2.59Å
223	T	94.3	Very high	93.5	Very high	27 Å²	27	45.2 Å²	45.2	17%	0.166	23%	0.229	C	C	.	.	H	α-helix	trans	-68.5	-42	176.9	-60.5	0	0	0	0	111.7	N148 I219 S220 F221 Y225 N226 Y227	N148-T223 HydrophobicContact CB-CG2 4.27Å; I219-T223 VanDerWaalsContact O-CB 3.27Å; I219-T223 WeakPolarHBondContact O-CB 3.42Å; I219-T223 PolarHBondContact O-N 2.91Å; I219-T223 PolarHBondContact O-OG1 2.95Å; S220-T223 PolarHBondContact O-N 3.15Å; F221-T223 VanDerWaalsContact C-N 3.29Å; F221-T223 PolarHBondContact O-N 3.45Å; T223-Y225 VanDerWaalsContact C-N 3.28Å; T223-Y225 PolarHBondContact O-N 2.89Å; T223-N226 WeakPolarHBondContact O-CB 3.46Å; T223-N226 PolarHBondContact O-N 3.15Å; T223-N226 VanDerWaalsContact O-N 3.1Å; T223-Y227 HydrophobicContact CG2-CD1 3.83Å; T223-Y227 HydrophobicContact CG2-CD2 4.04Å; T223-Y227 HydrophobicContact CG2-CE1 3.38Å; T223-Y227 HydrophobicContact CG2-CE2 3.66Å; T223-Y227 HydrophobicContact CG2-CG 4.15Å; T223-Y227 PolarHBondContact O-N 2.77Å
224	V	94.6	Very high	93.3	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-53.4	-43.7	174.7	160.8	0	0	0	0	112.3	F211 V212 F213 S220 F221 N226 Y227 F228 L244 L267 L271	F211-V224 HydrophobicContact CB-CG1 3.67Å; F211-V224 HydrophobicContact CB-CG2 4.13Å; F211-V224 HydrophobicContact CD1-CG1 4.05Å; F211-V224 HydrophobicContact CG-CG1 3.98Å; V212-V224 VanDerWaalsContact O-CG2 3.32Å; V212-V224 WeakPolarHBondContact O-CG2 3.42Å; F213-V224 HydrophobicContact CB-CG2 3.97Å; S220-V224 PolarHBondContact O-N 3.33Å; S220-V224 VanDerWaalsContact O-N 3.07Å; F221-V224 PolarHBondContact O-N 3.41Å; V224-N226 PolarHBondContact O-N 2.97Å; V224-Y227 PolarHBondContact O-N 3.34Å; V224-F228 PolarHBondContact O-N 3.08Å; V224-L244 HydrophobicContact CG1-CD1 3.82Å; V224-L267 HydrophobicContact CG1-CD2 4.07Å; V224-L271 HydrophobicContact CG1-CD1 4.17Å
225	Y	91.3	Very high	93	Very high	97 Å²	97	52.4 Å²	52.4	38%	0.38	26%	0.256	S	S	.	.	H	α-helix	trans	-62.7	-42.8	178.5	-176.2	-100.9	0	0	0	112.3	T223 F228 L229 L267	T223-Y225 VanDerWaalsContact C-N 3.28Å; T223-Y225 PolarHBondContact O-N 2.89Å; Y225-F228 PolarHBondContact O-N 2.88Å; Y225-L229 HydrophobicContact CD1-CD1 4.06Å; Y225-L229 HydrophobicContact CE1-CD1 3.59Å; Y225-L229 HydrophobicContact CE1-CG 4.26Å; Y225-L229 WeakPolarHBondContact O-CG 3.44Å; Y225-L229 PolarHBondContact O-N 3.39Å; Y225-L229 VanDerWaalsContact O-N 3.11Å; Y225-L267 HydrophobicContact CD2-CD1 3.86Å
226	N	93.1	Very high	92.5	Very high	86 Å²	86	56.1 Å²	56.1	46%	0.46	28%	0.275	S	S	.	.	H	α-helix	trans	-64.2	-39.7	175.2	-73.4	-72.2	0	0	0	112.1	Q222 T223 V224 L229 R230	Q222-N226 PolarHBondContact O-N 2.83Å; Q222-N226 PolarHBondContact O-ND2 2.59Å; T223-N226 WeakPolarHBondContact O-CB 3.46Å; T223-N226 PolarHBondContact O-N 3.15Å; T223-N226 VanDerWaalsContact O-N 3.1Å; V224-N226 PolarHBondContact O-N 2.97Å; N226-L229 PolarHBondContact O-N 2.92Å; N226-R230 PolarHBondContact O-N 3.28Å
227	Y	94.2	Very high	91.9	Very high	31 Å²	31	55 Å²	55	12%	0.122	27%	0.271	C	S	.	.	H	α-helix	trans	-67.8	-37.3	178.2	-72.5	4.8	0	0	0	112.1	V146 P197 P198 T223 V224 R230 L231	V146-Y227 HydrophobicContact CB-CD2 4.3Å; V146-Y227 HydrophobicContact CG1-CD2 3.39Å; V146-Y227 HydrophobicContact CG1-CE2 3.76Å; V146-Y227 HydrophobicContact CG1-CG 4.29Å; P197-Y227 HydrophobicContact CB-CD1 4.01Å; P197-Y227 HydrophobicContact CB-CE1 3.56Å; P198-Y227 WeakPolarHBondContact CG-O 3.34Å; T223-Y227 HydrophobicContact CG2-CD1 3.83Å; T223-Y227 HydrophobicContact CG2-CD2 4.04Å; T223-Y227 HydrophobicContact CG2-CE1 3.38Å; T223-Y227 HydrophobicContact CG2-CE2 3.66Å; T223-Y227 HydrophobicContact CG2-CG 4.15Å; T223-Y227 PolarHBondContact O-N 2.77Å; V224-Y227 PolarHBondContact O-N 3.34Å; Y227-R230 PolarHBondContact O-N 3.2Å; Y227-L231 WeakPolarHBondContact O-CB 3.24Å; Y227-L231 PolarHBondContact O-N 3.33Å
228	F	93.1	Very high	91.4	Very high	20 Å²	20	56.4 Å²	56.4	9%	0.088	29%	0.287	C	S	.	.	H	α-helix	trans	-62.8	-46	171.3	168.3	-101.6	0	0	0	112.5	F211 V224 Y225 R230 L231 S232 T237 M242 L271	F211-F228 HydrophobicContact CE1-CB 4.23Å; F211-F228 HydrophobicContact CE2-CB 4.42Å; F211-F228 HydrophobicContact CE2-CD2 4.28Å; F211-F228 HydrophobicContact CZ-CB 3.91Å; F211-F228 HydrophobicContact CZ-CD2 4.3Å; V224-F228 PolarHBondContact O-N 3.08Å; Y225-F228 PolarHBondContact O-N 2.88Å; F228-R230 VanDerWaalsContact C-N 3.3Å; F228-R230 PolarHBondContact O-N 2.86Å; F228-L231 PolarHBondContact O-N 2.98Å; F228-S232 WeakPolarHBondContact O-CB 3.48Å; F228-S232 PolarHBondContact O-N 3.29Å; F228-T237 HydrophobicContact CE2-CG2 4.16Å; F228-M242 HydrophobicContact CD2-CE 4.38Å; F228-M242 HydrophobicContact CD2-SD 3.85Å; F228-M242 HydrophobicContact CE2-CE 4.32Å; F228-M242 HydrophobicContact CE2-SD 3.73Å; F228-L271 HydrophobicContact CB-CD2 3.35Å; F228-L271 HydrophobicContact CD1-CD2 3.52Å; F228-L271 HydrophobicContact CD2-CD2 3.43Å; F228-L271 VanDerWaalsContact CD2-CD2 3.43Å; F228-L271 HydrophobicContact CE1-CD2 4.1Å; F228-L271 HydrophobicContact CE2-CD2 4.02Å; F228-L271 HydrophobicContact CG-CD2 3.13Å; F228-L271 HydrophobicContact CZ-CD2 4.32Å
229	L	91.6	Very high	91	Very high	75 Å²	75	57.7 Å²	57.7	39%	0.393	29%	0.293	S	S	.	.	H	α-helix	trans	-58.2	-44.3	176.7	-70.7	177.6	0	0	0	111	Y225 N226 S232 S233	Y225-L229 HydrophobicContact CD1-CD1 4.06Å; Y225-L229 HydrophobicContact CE1-CD1 3.59Å; Y225-L229 HydrophobicContact CE1-CG 4.26Å; Y225-L229 WeakPolarHBondContact O-CG 3.44Å; Y225-L229 PolarHBondContact O-N 3.39Å; Y225-L229 VanDerWaalsContact O-N 3.11Å; N226-L229 PolarHBondContact O-N 2.92Å; L229-S232 PolarHBondContact O-N 2.87Å; L229-S232 PolarHBondContact O-OG 2.77Å; L229-S233 PolarHBondContact O-N 3.22Å
230	R	92.3	Very high	90.8	Very high	93 Å²	93	52.4 Å²	52.4	35%	0.351	27%	0.266	S	S	.	.	H	α-helix	trans	-66.4	-38.1	176.8	-175.6	171.4	170.2	146	-4.5	113.3	P198 N226 Y227 F228 S232 S233 Y234	P198-R230 HydrophobicContact CG-CB 4.49Å; P198-R230 WeakPolarHBondContact O-CD 3.33Å; P198-R230 PolarHBondContact O-NE 3.32Å; N226-R230 PolarHBondContact O-N 3.28Å; Y227-R230 PolarHBondContact O-N 3.2Å; F228-R230 VanDerWaalsContact C-N 3.3Å; F228-R230 PolarHBondContact O-N 2.86Å; R230-S232 VanDerWaalsContact C-N 3.28Å; R230-S232 PolarHBondContact O-N 3.07Å; R230-S233 PolarHBondContact O-OG 3.36Å; R230-Y234 HydrophobicContact CG-CE2 3.84Å; R230-Y234 WeakPolarHBondContact O-CD2 3.27Å
231	L	91.4	Very high	90.7	Very high	2 Å²	2	53 Å²	53	1%	0.01	27%	0.27	C	S	.	.	H	α-helix	trans	-63.4	-37.4	171.6	-178.5	65	0	0	0	111.3	P198 A203 V209 F211 Y227 F228 S233 Y234 R235 M242	P198-L231 HydrophobicContact CG-CB 4.3Å; A203-L231 HydrophobicContact CB-CD1 3.66Å; V209-L231 HydrophobicContact CB-CD2 4.21Å; V209-L231 HydrophobicContact CG1-CD2 4.23Å; V209-L231 HydrophobicContact CG2-CD2 3.85Å; F211-L231 HydrophobicContact CE2-CD2 4.38Å; F211-L231 HydrophobicContact CZ-CD2 3.78Å; Y227-L231 WeakPolarHBondContact O-CB 3.24Å; Y227-L231 PolarHBondContact O-N 3.33Å; F228-L231 PolarHBondContact O-N 2.98Å; L231-S233 VanDerWaalsContact C-N 3.35Å; L231-S233 PolarHBondContact O-N 3.04Å; L231-Y234 PolarHBondContact O-N 2.99Å; L231-R235 PolarHBondContact O-N 2.91Å; L231-R235 VanDerWaalsContact O-N 3.11Å; L231-M242 HydrophobicContact CD2-CE 3.54Å; L231-M242 HydrophobicContact CG-CE 4.45Å
232	S	90.3	Very high	90.7	Very high	50 Å²	50	52.6 Å²	52.6	35%	0.35	27%	0.268	S	S	.	.	H	α-helix	trans	-72.5	-20.7	-176.9	79.3	0	0	0	0	115.2	F228 L229 R230	F228-S232 WeakPolarHBondContact O-CB 3.48Å; F228-S232 PolarHBondContact O-N 3.29Å; L229-S232 PolarHBondContact O-N 2.87Å; L229-S232 PolarHBondContact O-OG 2.77Å; R230-S232 VanDerWaalsContact C-N 3.28Å; R230-S232 PolarHBondContact O-N 3.07Å
233	S	92.8	Very high	90.8	Very high	90 Å²	90	48 Å²	48	63%	0.629	25%	0.247	S	C	*	.	H	α-helix	trans	-80.6	-20.7	171.8	61.6	0	0	0	0	113.2	L229 R230 L231	L229-S233 PolarHBondContact O-N 3.22Å; R230-S233 PolarHBondContact O-OG 3.36Å; L231-S233 VanDerWaalsContact C-N 3.35Å; L231-S233 PolarHBondContact O-N 3.04Å
234	Y	91	Very high	90.9	Very high	94 Å²	94	46.7 Å²	46.7	37%	0.369	24%	0.239	S	C	.	.	H	α-helix	trans	-93.1	-30	177.1	-61.3	-44.1	0	0	0	114	P198 L200 A203 R230 L231	P198-Y234 WeakPolarHBondContact O-CE2 3.5Å; L200-Y234 HydrophobicContact CB-CD1 3.99Å; L200-Y234 HydrophobicContact CB-CE1 4.13Å; L200-Y234 HydrophobicContact CB-CG 4.19Å; L200-Y234 HydrophobicContact CD1-CD1 3.91Å; L200-Y234 HydrophobicContact CD1-CG 4.08Å; L200-Y234 HydrophobicContact CG-CD1 4.47Å; A203-Y234 HydrophobicContact CB-CD2 4.35Å; A203-Y234 HydrophobicContact CB-CG 4.46Å; R230-Y234 HydrophobicContact CG-CE2 3.84Å; R230-Y234 WeakPolarHBondContact O-CD2 3.27Å; L231-Y234 PolarHBondContact O-N 2.99Å
235	R	88.1	Confident	91.1	Very high	63 Å²	63	46.7 Å²	46.7	24%	0.238	24%	0.239	C	C	.	.	S	Bend	trans	-149.8	146.8	-176.9	-172.7	165.9	170.9	-168.9	-9	113.2	A203 V206 L231 T237 E239 V240	A203-R235 WeakPolarHBondContact O-CD 3.43Å; A203-R235 PolarHBondContact O-NH1 3.16Å; V206-R235 PolarHBondContact O-NH1 3.39Å; V206-R235 PolarHBondContact O-NH2 2.95Å; L231-R235 PolarHBondContact O-N 2.91Å; L231-R235 VanDerWaalsContact O-N 3.11Å; R235-T237 PolarHBondContact O-N 3.05Å; R235-E239 PolarHBondContact NH2-O 3.07Å; R235-V240 HydrophobicContact CG-CG2 4.14Å; R235-V240 VanDerWaalsContact CZ-CG2 3.41Å; R235-V240 VanDerWaalsContact NE-CG2 3.3Å
236	N	86.4	Confident	91.3	Very high	78 Å²	78	42.1 Å²	42.1	42%	0.417	22%	0.221	S	C	.	.			trans	-61.1	108.2	173.4	179.7	9.1	0	0	0	111	A238 E239	N236-A238 PolarHBondContact O-N 2.87Å; N236-A238 WeakPolarHBondContact OD1-CB 3.32Å; N236-A238 PolarHBondContact OD1-N 3.19Å; N236-E239 HydrophobicContact CB-CG 4.43Å; N236-E239 WeakPolarHBondContact CB-OE1 3.42Å; N236-E239 PolarHBondContact ND2-OE1 3.14Å; N236-E239 PolarHBondContact O-N 3.06Å
237	T	81.8	Confident	91.5	Very high	16 Å²	16	38.1 Å²	38.1	10%	0.098	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.1	11.5	-179.4	56.8	0	0	0	0	114.3	F228 R235 M242 K272	F228-T237 HydrophobicContact CE2-CG2 4.16Å; R235-T237 PolarHBondContact O-N 3.05Å; T237-M242 HydrophobicContact CG2-CE 3.5Å; T237-K272 VanDerWaalsContact O-CD 3.23Å; T237-K272 WeakPolarHBondContact O-CD 3.07Å; T237-K272 PolarHBondContact O-NZ 3.42Å; T237-K272 WeakPolarHBondContact OG1-CD 3.39Å; T237-K272 VanDerWaalsContact OG1-CE 3.26Å; T237-K272 WeakPolarHBondContact OG1-CE 3.28Å; T237-K272 PolarHBondContact OG1-NZ 3.01Å
238	A	82.2	Confident	91.5	Very high	60 Å²	60	38.6 Å²	38.6	50%	0.496	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.8	-14.4	165.5	0	0	0	0	0	113.1	N236 K272 M301	N236-A238 PolarHBondContact O-N 2.87Å; N236-A238 WeakPolarHBondContact OD1-CB 3.32Å; N236-A238 PolarHBondContact OD1-N 3.19Å; A238-K272 VanDerWaalsContact N-NZ 3.17Å; A238-M301 WeakPolarHBondContact O-CE 3.36Å
239	E	84.6	Confident	91.3	Very high	95 Å²	95	38.8 Å²	38.8	44%	0.444	21%	0.205	S	C	.	.	S	Bend	trans	-104.7	10.6	-177.8	-65	161.1	-146.8	0	0	112.7	R235 N236	R235-E239 PolarHBondContact NH2-O 3.07Å; N236-E239 HydrophobicContact CB-CG 4.43Å; N236-E239 WeakPolarHBondContact CB-OE1 3.42Å; N236-E239 PolarHBondContact ND2-OE1 3.14Å; N236-E239 PolarHBondContact O-N 3.06Å
240	V	90.9	Very high	91	Very high	6 Å²	6	37.1 Å²	37.1	4%	0.036	20%	0.202	C	C	.	.	S	Bend	trans	-137	113.5	-179.2	-178.8	0	0	0	0	106.7	V206 V209 R235 M242	V206-V240 HydrophobicContact CG2-CG1 4.43Å; V209-V240 HydrophobicContact CG2-CG1 4.02Å; R235-V240 HydrophobicContact CG-CG2 4.14Å; R235-V240 VanDerWaalsContact CZ-CG2 3.41Å; R235-V240 VanDerWaalsContact NE-CG2 3.3Å; V240-M242 HydrophobicContact CB-CE 4.39Å; V240-M242 HydrophobicContact CG1-CE 4.36Å
241	P	93.3	Very high	90.8	Very high	11 Å²	11	35.6 Å²	35.6	7%	0.071	20%	0.2	C	C	.	.			trans	-62.4	142.4	170.8	-19.3	32.1	0	0	0	111	D207 A208 V209 K297 V298 M301	D207-P241 WeakPolarHBondContact O-CD 3.37Å; A208-P241 WeakPolarHBondContact CA-O 3.35Å; A208-P241 HydrophobicContact CB-CB 4.04Å; A208-P241 HydrophobicContact CB-CG 4.21Å; A208-P241 WeakPolarHBondContact CB-O 3.37Å; V209-P241 PolarHBondContact N-O 3.03Å; P241-K297 HydrophobicContact CB-CB 3.67Å; P241-K297 HydrophobicContact CB-CD 4.22Å; P241-K297 HydrophobicContact CG-CB 3.96Å; P241-V298 HydrophobicContact CG-CG2 4.12Å; P241-M301 HydrophobicContact CG-CE 3.83Å; P241-M301 HydrophobicContact CG-SD 4.1Å
242	M	93.1	Very high	90.6	Very high	13 Å²	13	38.3 Å²	38.3	6%	0.064	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	147.4	179.6	-63.9	-179.7	178.4	0	0	110.9	V209 F211 F228 L231 T237 V240 C274	V209-M242 WeakPolarHBondContact O-CA 3.5Å; F211-M242 HydrophobicContact CE2-CG 4.3Å; F211-M242 HydrophobicContact CE2-SD 3.91Å; F228-M242 HydrophobicContact CD2-CE 4.38Å; F228-M242 HydrophobicContact CD2-SD 3.85Å; F228-M242 HydrophobicContact CE2-CE 4.32Å; F228-M242 HydrophobicContact CE2-SD 3.73Å; L231-M242 HydrophobicContact CD2-CE 3.54Å; L231-M242 HydrophobicContact CG-CE 4.45Å; T237-M242 HydrophobicContact CG2-CE 3.5Å; V240-M242 HydrophobicContact CB-CE 4.39Å; V240-M242 HydrophobicContact CG1-CE 4.36Å; M242-C274 HydrophobicContact CB-CB 4.02Å; M242-C274 WeakPolarHBondContact O-CB 3.46Å
243	V	96.2	Very high	90.1	Very high	1 Å²	1	41.6 Å²	41.6	1%	0.006	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	139.9	172	-179.6	0	0	0	0	108.3	V209 V210 F211 V245 Y277 V290 D293 V294	V209-V243 PolarHBondContact O-N 3.48Å; V209-V243 VanDerWaalsContact O-N 3.16Å; V210-V243 WeakPolarHBondContact CA-O 3.28Å; F211-V243 PolarHBondContact N-O 2.89Å; V243-V245 HydrophobicContact CG1-CG2 4.25Å; V243-Y277 HydrophobicContact CG1-CD2 3.68Å; V243-Y277 HydrophobicContact CG1-CE2 3.96Å; V243-V290 HydrophobicContact CG1-CG1 4.24Å; V243-D293 WeakPolarHBondContact CG2-OD2 3.32Å; V243-V294 HydrophobicContact CB-CG2 4.04Å; V243-V294 HydrophobicContact CG2-CG2 3.5Å; V243-V294 VanDerWaalsContact CG2-CG2 3.5Å
244	L	97.1	Very high	89.5	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	132.8	176.1	-180	67.3	0	0	0	109.5	F211 F213 V224 L267 L271 T275 Y276 Y277	F211-L244 HydrophobicContact CB-CD1 4.03Å; F213-L244 HydrophobicContact CD1-CD1 3.77Å; F213-L244 HydrophobicContact CD1-CG 4.36Å; F213-L244 HydrophobicContact CE1-CD1 3.76Å; F213-L244 HydrophobicContact CE1-CD2 4.15Å; F213-L244 HydrophobicContact CE1-CG 3.85Å; V224-L244 HydrophobicContact CG1-CD1 3.82Å; L244-L267 HydrophobicContact CD1-CD2 4.18Å; L244-L267 HydrophobicContact CD2-CB 4.2Å; L244-L267 HydrophobicContact CD2-CD2 4.09Å; L244-L267 HydrophobicContact CD2-CG 4.01Å; L244-L271 HydrophobicContact CB-CD1 4.38Å; L244-L271 HydrophobicContact CD1-CD1 3.87Å; L244-L271 HydrophobicContact CD2-CD1 4.19Å; L244-L271 HydrophobicContact CG-CD1 4.37Å; L244-T275 PolarHBondContact N-O 3.46Å; L244-Y276 HydrophobicContact CB-CD2 4.34Å; L244-Y276 HydrophobicContact CD2-CD2 3.94Å; L244-Y276 HydrophobicContact CG-CD2 3.96Å; L244-Y276 WeakPolarHBondContact O-CA 3.49Å; L244-Y277 PolarHBondContact O-N 3.48Å
245	V	97.8	Very high	89.2	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	123.7	-176.6	-179.6	0	0	0	0	110.4	L156 V210 F211 V212 F213 V243 T247 Y277 T279 V290	L156-V245 HydrophobicContact CD2-CG1 3.96Å; V210-V245 HydrophobicContact CG1-CB 4.39Å; V210-V245 HydrophobicContact CG1-CG2 3.54Å; F211-V245 PolarHBondContact O-N 3Å; V212-V245 WeakPolarHBondContact CA-O 3.25Å; V212-V245 HydrophobicContact CG1-CB 4.45Å; V212-V245 HydrophobicContact CG1-CG1 4.39Å; V212-V245 HydrophobicContact CG2-CB 4.48Å; F213-V245 WeakPolarHBondContact CD1-O 3.43Å; F213-V245 PolarHBondContact N-O 3.1Å; V243-V245 HydrophobicContact CG1-CG2 4.25Å; V245-T247 HydrophobicContact CG1-CG2 4.4Å; V245-Y277 WeakPolarHBondContact CA-O 3.29Å; V245-T279 HydrophobicContact CG1-CG2 3.72Å; V245-T279 WeakPolarHBondContact CG1-OG1 3.45Å; V245-V290 HydrophobicContact CG2-CG1 3.77Å; V245-V290 HydrophobicContact CG2-CG2 3.89Å
246	G	96.8	Very high	89.3	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	114.5	167.8	0	0	0	0	0	110.5	F213 Y277 E278 T279	F213-G246 CarbonylContact O-C 3.56Å; F213-G246 WeakPolarHBondContact O-CA 3.31Å; G246-Y277 PolarHBondContact N-O 3.06Å; G246-E278 CarbonylContact O-C 3.56Å; G246-E278 VanDerWaalsContact O-CA 3.29Å; G246-E278 WeakPolarHBondContact O-CA 3.38Å; G246-T279 PolarHBondContact O-N 2.87Å
247	T	96	Very high	89.6	Confident	2 Å²	2	41.8 Å²	41.8	1%	0.012	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	144.7	177.2	62.5	0	0	0	0	111.3	S151 V212 F213 S214 L215 V245 T279	S151-T247 WeakPolarHBondContact O-CG2 3.17Å; S151-T247 PolarHBondContact O-OG1 3.01Å; V212-T247 HydrophobicContact CG1-CG2 3.63Å; F213-T247 PolarHBondContact O-N 3.29Å; F213-T247 PolarHBondContact O-OG1 3.44Å; S214-T247 WeakPolarHBondContact CA-OG1 3.49Å; L215-T247 WeakPolarHBondContact CB-O 3.36Å; L215-T247 PolarHBondContact N-O 2.99Å; V245-T247 HydrophobicContact CG1-CG2 4.4Å; T247-T279 CarbonylContact C-O 3.42Å; T247-T279 WeakPolarHBondContact CA-O 3.45Å
248	Q	94.3	Very high	90.2	Very high	42 Å²	42	44.3 Å²	44.3	20%	0.196	28%	0.28	C	S	.	.			trans	-107.9	9.1	178.3	-62.6	-178.9	-7.1	0	0	112.7	L215 A250 I251 E278 T279 C280 Y283	L215-Q248 HydrophobicContact CD1-CG 3.63Å; Q248-A250 PolarHBondContact O-N 3.05Å; Q248-I251 HydrophobicContact CB-CD1 3.79Å; Q248-I251 HydrophobicContact CB-CG1 4.39Å; Q248-I251 HydrophobicContact CG-CD1 3.93Å; Q248-I251 PolarHBondContact O-N 3.21Å; Q248-I251 VanDerWaalsContact O-N 3.16Å; Q248-E278 PolarHBondContact NE2-OE2 2.99Å; Q248-T279 PolarHBondContact N-O 3.42Å; Q248-C280 HydrophobicContact CB-CB 4.21Å; Q248-Y283 PolarHBondContact OE1-OH 3.18Å
249	D	89.8	Confident	90.8	Very high	23 Å²	23	41.4 Å²	41.4	12%	0.123	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-23	-158.3	-78.5	-54.4	0	0	0	116.3	Y165 C280 S281 T282	Y165-D249 HydrophobicContact CE2-CB 4.35Å; D249-C280 PolarHBondContact OD1-SG 3.14Å; D249-S281 WeakPolarHBondContact OD1-CA 3.42Å; D249-S281 WeakPolarHBondContact OD1-CB 3.45Å; D249-S281 PolarHBondContact OD1-N 3.19Å; D249-S281 WeakPolarHBondContact OD2-CB 3.31Å; D249-S281 PolarHBondContact OD2-N 2.71Å; D249-S281 PolarHBondContact OD2-OG 2.87Å; D249-T282 PolarHBondContact OD1-N 2.76Å; D249-T282 PolarHBondContact OD1-OG1 2.7Å
250	A	85.1	Confident	91.2	Very high	40 Å²	40	41.4 Å²	41.4	33%	0.331	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.2	-7.3	175.4	0	0	0	0	0	114	E216 Q248 S252	E216-A250 VanDerWaalsContact CD-CB 3.45Å; E216-A250 WeakPolarHBondContact OE1-CB 3.19Å; E216-A250 VanDerWaalsContact OE2-CB 3.29Å; E216-A250 WeakPolarHBondContact OE2-CB 3.42Å; Q248-A250 PolarHBondContact O-N 3.05Å; A250-S252 PolarHBondContact O-N 3.36Å; A250-S252 PolarHBondContact O-OG 2.85Å
251	I	87.9	Confident	91.2	Very high	62 Å²	62	43.8 Å²	43.8	32%	0.318	27%	0.272	S	S	.	.			trans	-61	124.2	-171.5	-59.5	179.1	0	0	0	109.9	L215 E216 Q248 R257	L215-I251 HydrophobicContact CB-CD1 3.93Å; E216-I251 WeakPolarHBondContact OE2-CA 3.33Å; E216-I251 PolarHBondContact OE2-N 2.86Å; E216-I251 VanDerWaalsContact OE2-N 3.1Å; Q248-I251 HydrophobicContact CB-CD1 3.79Å; Q248-I251 HydrophobicContact CB-CG1 4.39Å; Q248-I251 HydrophobicContact CG-CD1 3.93Å; Q248-I251 PolarHBondContact O-N 3.21Å; Q248-I251 VanDerWaalsContact O-N 3.16Å; I251-R257 HydrophobicContact CD1-CB 4.38Å
252	S	86.4	Confident	91.2	Very high	58 Å²	58	47.2 Å²	47.2	41%	0.406	30%	0.295	S	S	.	.	S	Bend	trans	-150.2	179.6	-173.2	62.5	0	0	0	0	111.8	A250 A254 N255	A250-S252 PolarHBondContact O-N 3.36Å; A250-S252 PolarHBondContact O-OG 2.85Å; S252-A254 PolarHBondContact O-N 3.08Å; S252-A254 PolarHBondContact OG-N 2.94Å; S252-N255 PolarHBondContact N-O 3.42Å; S252-N255 CarbonylContact O-C 3.56Å; S252-N255 VanDerWaalsContact O-C 3.29Å; S252-N255 PolarHBondContact OG-N 3.11Å
253	A	80.2	Confident	91.2	Very high	119 Å²	119	50.4 Å²	50.4	98%	0.983	31%	0.307	S	S	*	.	S	Bend	trans	-68.5	-14.1	171.3	0	0	0	0	0	113.3
254	A	81.7	Confident	91.1	Very high	82 Å²	82	50.4 Å²	50.4	68%	0.678	31%	0.307	S	S	*	.	S	Bend	trans	-94.7	-40.7	173.9	0	0	0	0	0	111.8	S252 P256	S252-A254 PolarHBondContact O-N 3.08Å; S252-A254 PolarHBondContact OG-N 2.94Å; A254-P256 WeakPolarHBondContact O-CD 3.07Å
255	N	84.3	Confident	90.9	Very high	75 Å²	75	57 Å²	57	40%	0.401	33%	0.332	S	S	.	.	S	Bend	trans	-109.7	88.6	177	-63.6	13.8	0	0	0	109.6	E216 S252	E216-N255 PolarHBondContact OE1-ND2 3.39Å; E216-N255 VanDerWaalsContact OE2-CB 3.31Å; E216-N255 WeakPolarHBondContact OE2-CB 3.39Å; S252-N255 PolarHBondContact N-O 3.42Å; S252-N255 CarbonylContact O-C 3.56Å; S252-N255 VanDerWaalsContact O-C 3.29Å; S252-N255 PolarHBondContact OG-N 3.11Å
256	P	88.7	Confident	90.7	Very high	88 Å²	88	63.6 Å²	63.6	57%	0.571	36%	0.36	S	S	*	.			trans	-73.1	155	176.4	31.2	-35.6	0	0	0	111.5	A254 V258	A254-P256 WeakPolarHBondContact O-CD 3.07Å; P256-V258 PolarHBondContact O-N 3.45Å
257	R	93.6	Very high	90.5	Very high	84 Å²	84	64 Å²	64	32%	0.317	36%	0.363	S	S	.	.			trans	-56.8	132.4	171.7	179.4	175.6	-180	143.6	4.8	111.5	L215 I251 I259 D261 E278	L215-R257 HydrophobicContact CB-CG 4.4Å; I251-R257 HydrophobicContact CD1-CB 4.38Å; R257-I259 VanDerWaalsContact CZ-O 3.32Å; R257-I259 PolarHBondContact NE-O 2.93Å; R257-I259 PolarHBondContact NH2-O 2.91Å; R257-D261 VanDerWaalsContact NH2-N 3.19Å; R257-E278 IonicContact CZ-OE1 3.51Å; R257-E278 VanDerWaalsContact CZ-OE1 3.3Å; R257-E278 IonicContact CZ-OE2 3.28Å; R257-E278 VanDerWaalsContact NH1-CD 3.28Å; R257-E278 IonicContact NH1-OE1 2.97Å; R257-E278 PolarHBondContact NH1-OE1 3.48Å; R257-E278 IonicContact NH1-OE2 3.76Å; R257-E278 PolarHBondContact NH1-OE2 3.04Å; R257-E278 IonicContact NH2-OE1 2.98Å; R257-E278 PolarHBondContact NH2-OE1 3.38Å; R257-E278 IonicContact NH2-OE2 3.37Å
258	V	94.1	Very high	90.3	Very high	69 Å²	69	64.4 Å²	64.4	42%	0.418	37%	0.365	S	S	.	.			trans	-110.2	-26.9	179.5	-179.9	0	0	0	0	112	L215 E216 E218 P256 R263	L215-V258 PolarHBondContact O-N 3.45Å; E216-V258 VanDerWaalsContact O-CG2 3.27Å; E216-V258 WeakPolarHBondContact O-CG2 3.34Å; E218-V258 HydrophobicContact CB-CG1 4.47Å; P256-V258 PolarHBondContact O-N 3.45Å; V258-R263 PolarHBondContact O-NH1 2.94Å
259	I	94.9	Very high	90.1	Very high	0 Å²	0	66.2 Å²	66.2	0%	0	38%	0.376	C	S	.	.	S	Bend	trans	-104.2	103.3	-176.4	-62.7	133.3	0	0	0	110.8	F213 S214 L215 F221 R257 R263 A264	F213-I259 HydrophobicContact CD2-CD1 4.06Å; F213-I259 HydrophobicContact CE2-CB 4.34Å; F213-I259 HydrophobicContact CE2-CD1 4.16Å; F213-I259 HydrophobicContact CE2-CG2 3.85Å; F213-I259 HydrophobicContact CZ-CG2 4.38Å; S214-I259 WeakPolarHBondContact O-CD1 3.35Å; L215-I259 HydrophobicContact CD2-CB 4.16Å; L215-I259 HydrophobicContact CD2-CG2 4.25Å; L215-I259 WeakPolarHBondContact CD2-O 3.47Å; L215-I259 PolarHBondContact O-N 2.67Å; F221-I259 HydrophobicContact CB-CD1 3.64Å; F221-I259 HydrophobicContact CB-CG1 4.08Å; F221-I259 HydrophobicContact CD2-CD1 4.47Å; F221-I259 HydrophobicContact CD2-CG1 4.39Å; F221-I259 HydrophobicContact CD2-CG2 3.78Å; F221-I259 HydrophobicContact CE2-CG2 3.79Å; F221-I259 HydrophobicContact CG-CD1 4.15Å; F221-I259 HydrophobicContact CG-CG1 4.09Å; F221-I259 HydrophobicContact CG-CG2 4.24Å; F221-I259 HydrophobicContact CZ-CG2 4.3Å; R257-I259 VanDerWaalsContact CZ-O 3.32Å; R257-I259 PolarHBondContact NE-O 2.93Å; R257-I259 PolarHBondContact NH2-O 2.91Å; I259-R263 HydrophobicContact CG2-CB 4.35Å; I259-A264 HydrophobicContact CG2-CB 4.41Å
260	D	92.4	Very high	90	Very high	95 Å²	95	69.2 Å²	69.2	51%	0.508	39%	0.393	S	S	.	.			trans	-62.4	148.6	174.9	-68	-47.6	0	0	0	113.1	S262 R263 A264	D260-S262 PolarHBondContact O-N 3.25Å; D260-R263 HydrophobicContact CB-CG 4.27Å; D260-R263 WeakPolarHBondContact O-CA 3.24Å; D260-R263 WeakPolarHBondContact O-CB 3.47Å; D260-R263 PolarHBondContact O-N 2.7Å; D260-A264 PolarHBondContact O-N 3.03Å; D260-A264 VanDerWaalsContact O-N 3.08Å
261	D	92	Very high	90.1	Very high	56 Å²	56	67.4 Å²	67.4	30%	0.299	38%	0.377	S	S	.	.	H	α-helix	trans	-52.7	-36.3	174.4	168.6	76.5	0	0	0	112.8	R257 R263 A264 R265	R257-D261 VanDerWaalsContact NH2-N 3.19Å; D261-R263 VanDerWaalsContact C-N 3.33Å; D261-R263 PolarHBondContact O-N 2.97Å; D261-A264 PolarHBondContact O-N 2.82Å; D261-R265 VanDerWaalsContact CG-NE 3.26Å; D261-R265 WeakPolarHBondContact O-CB 3.48Å; D261-R265 WeakPolarHBondContact O-CG 3.47Å; D261-R265 PolarHBondContact O-N 2.97Å; D261-R265 IonicContact OD1-CZ 2.61Å; D261-R265 IonicContact OD1-NE 2.86Å; D261-R265 PolarHBondContact OD1-NE 3.33Å; D261-R265 IonicContact OD1-NH1 2.89Å; D261-R265 IonicContact OD1-NH2 3.15Å; D261-R265 PolarHBondContact OD1-NH2 3.3Å; D261-R265 IonicContact OD2-CZ 2.69Å; D261-R265 IonicContact OD2-NE 2.77Å; D261-R265 PolarHBondContact OD2-NE 2.66Å; D261-R265 IonicContact OD2-NH2 3.96Å; D261-R265 PolarHBondContact OD2-NH2 2.85Å
262	S	92.6	Very high	89.7	Confident	82 Å²	82	69.6 Å²	69.6	57%	0.573	38%	0.384	S	S	*	.	H	α-helix	trans	-62.3	-37.4	175.5	60.7	0	0	0	0	112.8	D260 K266	D260-S262 PolarHBondContact O-N 3.25Å; S262-K266 WeakPolarHBondContact O-CB 3.37Å; S262-K266 PolarHBondContact O-N 3.24Å; S262-K266 VanDerWaalsContact O-N 3.09Å
263	R	94.3	Very high	89.5	Confident	81 Å²	81	76.3 Å²	76.3	31%	0.306	40%	0.401	S	S	.	.	H	α-helix	trans	-72.3	-43.8	177	-59.9	177.3	61.7	-152.6	-8.2	110.6	E218 F221 V258 I259 D260 D261 K266 L267	E218-R263 IonicContact OE1-CZ 2.68Å; E218-R263 IonicContact OE1-NH1 2.63Å; E218-R263 IonicContact OE1-NH2 2.81Å; E218-R263 PolarHBondContact OE1-NH2 2.89Å; E218-R263 IonicContact OE2-CZ 2.68Å; E218-R263 VanDerWaalsContact OE2-CZ 3.25Å; E218-R263 IonicContact OE2-NH1 3.08Å; E218-R263 PolarHBondContact OE2-NH1 2.93Å; E218-R263 IonicContact OE2-NH2 3.46Å; E218-R263 PolarHBondContact OE2-NH2 3.41Å; F221-R263 HydrophobicContact CZ-CB 4.26Å; V258-R263 PolarHBondContact O-NH1 2.94Å; I259-R263 HydrophobicContact CG2-CB 4.35Å; D260-R263 HydrophobicContact CB-CG 4.27Å; D260-R263 WeakPolarHBondContact O-CA 3.24Å; D260-R263 WeakPolarHBondContact O-CB 3.47Å; D260-R263 PolarHBondContact O-N 2.7Å; D261-R263 VanDerWaalsContact C-N 3.33Å; D261-R263 PolarHBondContact O-N 2.97Å; R263-K266 WeakPolarHBondContact O-CB 3.37Å; R263-K266 PolarHBondContact O-N 3.15Å; R263-L267 PolarHBondContact O-N 3.22Å
264	A	93.6	Very high	90	Very high	0 Å²	0	71.2 Å²	71.2	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-66.2	-42.3	178.3	0	0	0	0	0	112.7	F213 I259 D260 D261 K266 L267 S268 Y276	F213-A264 HydrophobicContact CZ-CB 3.94Å; I259-A264 HydrophobicContact CG2-CB 4.41Å; D260-A264 PolarHBondContact O-N 3.03Å; D260-A264 VanDerWaalsContact O-N 3.08Å; D261-A264 PolarHBondContact O-N 2.82Å; A264-K266 VanDerWaalsContact C-N 3.32Å; A264-K266 PolarHBondContact O-N 3.46Å; A264-L267 PolarHBondContact O-N 3Å; A264-S268 PolarHBondContact O-N 2.94Å; A264-Y276 HydrophobicContact CB-CD1 4.29Å; A264-Y276 HydrophobicContact CB-CD2 4.24Å; A264-Y276 HydrophobicContact CB-CE1 3.68Å; A264-Y276 HydrophobicContact CB-CE2 3.62Å; A264-Y276 WeakPolarHBondContact CB-OH 3.31Å
265	R	93.1	Very high	90.6	Very high	138 Å²	138	69.6 Å²	69.6	52%	0.521	34%	0.34	S	S	.	.	H	α-helix	trans	-65.5	-30.8	171.5	-69.8	-169.5	-141.2	-99.2	1.8	113	D261 N269 Y276	D261-R265 VanDerWaalsContact CG-NE 3.26Å; D261-R265 WeakPolarHBondContact O-CB 3.48Å; D261-R265 WeakPolarHBondContact O-CG 3.47Å; D261-R265 PolarHBondContact O-N 2.97Å; D261-R265 IonicContact OD1-CZ 2.61Å; D261-R265 IonicContact OD1-NE 2.86Å; D261-R265 PolarHBondContact OD1-NE 3.33Å; D261-R265 IonicContact OD1-NH1 2.89Å; D261-R265 IonicContact OD1-NH2 3.15Å; D261-R265 PolarHBondContact OD1-NH2 3.3Å; D261-R265 IonicContact OD2-CZ 2.69Å; D261-R265 IonicContact OD2-NE 2.77Å; D261-R265 PolarHBondContact OD2-NE 2.66Å; D261-R265 IonicContact OD2-NH2 3.96Å; D261-R265 PolarHBondContact OD2-NH2 2.85Å; R265-N269 PolarHBondContact O-N 2.8Å; R265-N269 VanDerWaalsContact O-N 3.15Å; R265-N269 PolarHBondContact O-ND2 3.36Å; R265-Y276 HydrophobicContact CG-CD1 4.19Å
266	K	92.9	Very high	91.1	Very high	139 Å²	139	67.6 Å²	67.6	60%	0.604	33%	0.327	S	S	*	.	H	α-helix	trans	-63.4	-53.2	171.3	-172	-166.4	168.3	-168.1	0	109.9	S262 R263 A264 S268 N269 D270	S262-K266 WeakPolarHBondContact O-CB 3.37Å; S262-K266 PolarHBondContact O-N 3.24Å; S262-K266 VanDerWaalsContact O-N 3.09Å; R263-K266 WeakPolarHBondContact O-CB 3.37Å; R263-K266 PolarHBondContact O-N 3.15Å; A264-K266 VanDerWaalsContact C-N 3.32Å; A264-K266 PolarHBondContact O-N 3.46Å; K266-S268 VanDerWaalsContact C-N 3.27Å; K266-S268 PolarHBondContact O-N 2.66Å; K266-N269 PolarHBondContact O-N 2.59Å; K266-D270 WeakPolarHBondContact CE-OD2 3.45Å; K266-D270 PolarHBondContact O-N 2.62Å
267	L	91.8	Very high	91.5	Very high	9 Å²	9	66 Å²	66	5%	0.047	31%	0.31	C	S	.	.	H	α-helix	trans	-55.4	-42.8	177	179.6	61.1	0	0	0	111.4	F221 V224 Y225 L244 R263 A264 N269 D270 L271	F221-L267 HydrophobicContact CD2-CD2 3.8Å; F221-L267 HydrophobicContact CE2-CB 3.98Å; F221-L267 HydrophobicContact CE2-CD2 3.37Å; F221-L267 HydrophobicContact CE2-CG 4.31Å; F221-L267 HydrophobicContact CZ-CB 3.87Å; F221-L267 HydrophobicContact CZ-CD2 3.8Å; F221-L267 HydrophobicContact CZ-CG 4.43Å; V224-L267 HydrophobicContact CG1-CD2 4.07Å; Y225-L267 HydrophobicContact CD2-CD1 3.86Å; L244-L267 HydrophobicContact CD1-CD2 4.18Å; L244-L267 HydrophobicContact CD2-CB 4.2Å; L244-L267 HydrophobicContact CD2-CD2 4.09Å; L244-L267 HydrophobicContact CD2-CG 4.01Å; R263-L267 PolarHBondContact O-N 3.22Å; A264-L267 PolarHBondContact O-N 3Å; L267-N269 VanDerWaalsContact C-N 3.3Å; L267-N269 PolarHBondContact O-N 3.34Å; L267-D270 PolarHBondContact O-N 3.33Å; L267-L271 HydrophobicContact CD1-CD1 4.03Å; L267-L271 HydrophobicContact CD1-CD2 4.33Å; L267-L271 HydrophobicContact CD1-CG 3.91Å; L267-L271 HydrophobicContact CD2-CD1 4.43Å; L267-L271 HydrophobicContact CG-CD1 3.8Å; L267-L271 HydrophobicContact CG-CG 4.13Å; L267-L271 WeakPolarHBondContact O-CB 3.3Å; L267-L271 WeakPolarHBondContact O-CG 3.21Å; L267-L271 PolarHBondContact O-N 2.74Å
268	S	93.1	Very high	91.7	Very high	10 Å²	10	63.5 Å²	63.5	7%	0.07	30%	0.302	C	S	.	.	H	α-helix	trans	-63.7	-31.7	177.9	115.5	0	0	0	0	113.4	A264 K266 R273 C274	A264-S268 PolarHBondContact O-N 2.94Å; K266-S268 VanDerWaalsContact C-N 3.27Å; K266-S268 PolarHBondContact O-N 2.66Å; S268-R273 CarbonylContact O-C 3.51Å; S268-R273 WeakPolarHBondContact O-CA 3.32Å; S268-R273 PolarHBondContact O-N 3.34Å; S268-R273 VanDerWaalsContact O-N 3.12Å; S268-C274 PolarHBondContact O-N 3.11Å; S268-C274 PolarHBondContact O-SG 3.02Å; S268-C274 PolarHBondContact OG-O 3.42Å
269	N	90.6	Very high	91.8	Very high	80 Å²	80	60.2 Å²	60.2	43%	0.428	28%	0.282	S	S	.	.	H	α-helix	trans	-71.6	-44.1	171.9	-80	-80.6	0	0	0	112	R265 K266 L267 L271 K272 R273	R265-N269 PolarHBondContact O-N 2.8Å; R265-N269 VanDerWaalsContact O-N 3.15Å; R265-N269 PolarHBondContact O-ND2 3.36Å; K266-N269 PolarHBondContact O-N 2.59Å; L267-N269 VanDerWaalsContact C-N 3.3Å; L267-N269 PolarHBondContact O-N 3.34Å; N269-L271 VanDerWaalsContact C-N 3.29Å; N269-L271 PolarHBondContact O-N 3.38Å; N269-K272 PolarHBondContact O-N 2.78Å; N269-R273 PolarHBondContact O-N 2.7Å
270	D	87.4	Confident	91.7	Very high	87 Å²	87	60.4 Å²	60.4	47%	0.465	28%	0.283	S	S	.	.	H	α-helix	trans	-61.8	-37.1	177.1	-62.7	-25.3	0	0	0	111.1	K266 L267 K272	K266-D270 WeakPolarHBondContact CE-OD2 3.45Å; K266-D270 PolarHBondContact O-N 2.62Å; L267-D270 PolarHBondContact O-N 3.33Å; D270-K272 PolarHBondContact O-N 3.14Å
271	L	87.1	Confident	91.7	Very high	1 Å²	1	55.9 Å²	55.9	1%	0.005	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.8	48.8	171.3	-64	177.2	0	0	0	112.9	V224 F228 L244 L267 N269 R273 C274	V224-L271 HydrophobicContact CG1-CD1 4.17Å; F228-L271 HydrophobicContact CB-CD2 3.35Å; F228-L271 HydrophobicContact CD1-CD2 3.52Å; F228-L271 HydrophobicContact CD2-CD2 3.43Å; F228-L271 VanDerWaalsContact CD2-CD2 3.43Å; F228-L271 HydrophobicContact CE1-CD2 4.1Å; F228-L271 HydrophobicContact CE2-CD2 4.02Å; F228-L271 HydrophobicContact CG-CD2 3.13Å; F228-L271 HydrophobicContact CZ-CD2 4.32Å; L244-L271 HydrophobicContact CB-CD1 4.38Å; L244-L271 HydrophobicContact CD1-CD1 3.87Å; L244-L271 HydrophobicContact CD2-CD1 4.19Å; L244-L271 HydrophobicContact CG-CD1 4.37Å; L267-L271 HydrophobicContact CD1-CD1 4.03Å; L267-L271 HydrophobicContact CD1-CD2 4.33Å; L267-L271 HydrophobicContact CD1-CG 3.91Å; L267-L271 HydrophobicContact CD2-CD1 4.43Å; L267-L271 HydrophobicContact CG-CD1 3.8Å; L267-L271 HydrophobicContact CG-CG 4.13Å; L267-L271 WeakPolarHBondContact O-CB 3.3Å; L267-L271 WeakPolarHBondContact O-CG 3.21Å; L267-L271 PolarHBondContact O-N 2.74Å; N269-L271 VanDerWaalsContact C-N 3.29Å; N269-L271 PolarHBondContact O-N 3.38Å; L271-R273 PolarHBondContact O-N 2.83Å; L271-C274 PolarHBondContact O-N 3.2Å
272	K	79.8	Confident	91.5	Very high	108 Å²	108	56.2 Å²	56.2	47%	0.47	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	54	32.5	-179.2	-81.6	-175.5	167.5	172.8	0	114.7	T237 A238 N269 D270	T237-K272 VanDerWaalsContact O-CD 3.23Å; T237-K272 WeakPolarHBondContact O-CD 3.07Å; T237-K272 PolarHBondContact O-NZ 3.42Å; T237-K272 WeakPolarHBondContact OG1-CD 3.39Å; T237-K272 VanDerWaalsContact OG1-CE 3.26Å; T237-K272 WeakPolarHBondContact OG1-CE 3.28Å; T237-K272 PolarHBondContact OG1-NZ 3.01Å; A238-K272 VanDerWaalsContact N-NZ 3.17Å; N269-K272 PolarHBondContact O-N 2.78Å; D270-K272 PolarHBondContact O-N 3.14Å
273	R	82.2	Confident	91.2	Very high	199 Å²	199	59.1 Å²	59.1	75%	0.751	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.6	43.3	179.5	-48.2	178.3	71.5	-160.1	0.9	112.6	S268 N269 L271	S268-R273 CarbonylContact O-C 3.51Å; S268-R273 WeakPolarHBondContact O-CA 3.32Å; S268-R273 PolarHBondContact O-N 3.34Å; S268-R273 VanDerWaalsContact O-N 3.12Å; N269-R273 PolarHBondContact O-N 2.7Å; L271-R273 PolarHBondContact O-N 2.83Å
274	C	89.3	Confident	90.8	Very high	13 Å²	13	56.7 Å²	56.7	9%	0.088	26%	0.262	C	S	.	.			trans	-63.8	156.8	171	68.5	0	0	0	0	111.4	M242 S268 L271	M242-C274 HydrophobicContact CB-CB 4.02Å; M242-C274 WeakPolarHBondContact O-CB 3.46Å; S268-C274 PolarHBondContact O-N 3.11Å; S268-C274 PolarHBondContact O-SG 3.02Å; S268-C274 PolarHBondContact OG-O 3.42Å; L271-C274 PolarHBondContact O-N 3.2Å
275	T	94.1	Very high	90.8	Very high	47 Å²	47	59.2 Å²	59.2	29%	0.288	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	140.5	170.9	44.3	0	0	0	0	109.3	L244 D293 K297	L244-T275 PolarHBondContact N-O 3.46Å; T275-D293 PolarHBondContact OG1-OD2 2.99Å; T275-K297 PolarHBondContact OG1-NZ 2.88Å
276	Y	96.5	Very high	90.8	Very high	34 Å²	34	53.9 Å²	53.9	13%	0.133	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	131.1	173.7	171.7	-121.1	0	0	0	109.5	F213 L244 A264 R265 E278	F213-Y276 HydrophobicContact CE1-CE2 4.02Å; F213-Y276 AromaticContact CZ-CE2 3.88Å; F213-Y276 HydrophobicContact CZ-CE2 3.88Å; L244-Y276 HydrophobicContact CB-CD2 4.34Å; L244-Y276 HydrophobicContact CD2-CD2 3.94Å; L244-Y276 HydrophobicContact CG-CD2 3.96Å; L244-Y276 WeakPolarHBondContact O-CA 3.49Å; A264-Y276 HydrophobicContact CB-CD1 4.29Å; A264-Y276 HydrophobicContact CB-CD2 4.24Å; A264-Y276 HydrophobicContact CB-CE1 3.68Å; A264-Y276 HydrophobicContact CB-CE2 3.62Å; A264-Y276 WeakPolarHBondContact CB-OH 3.31Å; R265-Y276 HydrophobicContact CG-CD1 4.19Å; Y276-E278 HydrophobicContact CE1-CG 3.87Å; Y276-E278 HydrophobicContact CE2-CG 4.37Å; Y276-E278 VanDerWaalsContact OH-CD 3.32Å; Y276-E278 WeakPolarHBondContact OH-CG 3.36Å; Y276-E278 PolarHBondContact OH-OE1 2.97Å
277	Y	97.3	Very high	90.8	Very high	53 Å²	53	47.5 Å²	47.5	21%	0.208	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	142.1	171.7	-65.3	-82.1	0	0	0	110.5	V243 L244 V245 G246 V290 D293	V243-Y277 HydrophobicContact CG1-CD2 3.68Å; V243-Y277 HydrophobicContact CG1-CE2 3.96Å; L244-Y277 PolarHBondContact O-N 3.48Å; V245-Y277 WeakPolarHBondContact CA-O 3.29Å; G246-Y277 PolarHBondContact N-O 3.06Å; Y277-V290 HydrophobicContact CD2-CG2 3.89Å; Y277-V290 HydrophobicContact CG-CG2 3.96Å; Y277-D293 HydrophobicContact CE2-CB 4.28Å; Y277-D293 WeakPolarHBondContact CE2-OD2 3.46Å
278	E	96.5	Very high	90.9	Very high	33 Å²	33	51.7 Å²	51.7	15%	0.154	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	131.5	160.7	-62.7	-165.4	-175.4	0	0	109.1	L215 G246 Q248 R257 Y276 N286	L215-E278 HydrophobicContact CD1-CB 4.4Å; L215-E278 HydrophobicContact CD1-CG 4Å; G246-E278 CarbonylContact O-C 3.56Å; G246-E278 VanDerWaalsContact O-CA 3.29Å; G246-E278 WeakPolarHBondContact O-CA 3.38Å; Q248-E278 PolarHBondContact NE2-OE2 2.99Å; R257-E278 IonicContact CZ-OE1 3.51Å; R257-E278 VanDerWaalsContact CZ-OE1 3.3Å; R257-E278 IonicContact CZ-OE2 3.28Å; R257-E278 VanDerWaalsContact NH1-CD 3.28Å; R257-E278 IonicContact NH1-OE1 2.97Å; R257-E278 PolarHBondContact NH1-OE1 3.48Å; R257-E278 IonicContact NH1-OE2 3.76Å; R257-E278 PolarHBondContact NH1-OE2 3.04Å; R257-E278 IonicContact NH2-OE1 2.98Å; R257-E278 PolarHBondContact NH2-OE1 3.38Å; R257-E278 IonicContact NH2-OE2 3.37Å; Y276-E278 HydrophobicContact CE1-CG 3.87Å; Y276-E278 HydrophobicContact CE2-CG 4.37Å; Y276-E278 VanDerWaalsContact OH-CD 3.32Å; Y276-E278 WeakPolarHBondContact OH-CG 3.36Å; Y276-E278 PolarHBondContact OH-OE1 2.97Å; E278-N286 WeakPolarHBondContact O-CB 3.38Å; E278-N286 PolarHBondContact O-ND2 3.22Å
279	T	95.9	Very high	91	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	155.3	-176.9	54	0	0	0	0	111.6	L156 V245 G246 T247 Q248 L285 N286 V290	L156-T279 HydrophobicContact CD1-CG2 4.1Å; V245-T279 HydrophobicContact CG1-CG2 3.72Å; V245-T279 WeakPolarHBondContact CG1-OG1 3.45Å; G246-T279 PolarHBondContact O-N 2.87Å; T247-T279 CarbonylContact C-O 3.42Å; T247-T279 WeakPolarHBondContact CA-O 3.45Å; Q248-T279 PolarHBondContact N-O 3.42Å; T279-L285 VanDerWaalsContact CA-O 3.23Å; T279-L285 WeakPolarHBondContact CA-O 3.22Å; T279-L285 WeakPolarHBondContact CB-O 3.25Å; T279-N286 HydrophobicContact CG2-CB 3.94Å; T279-V290 HydrophobicContact CG2-CG2 3.78Å
280	C	93.9	Very high	91.3	Very high	4 Å²	4	55 Å²	55	3%	0.027	25%	0.254	C	S	.	.	B	Isolated β-bridge	trans	-138.9	112.7	166.9	-175	0	0	0	0	108.9	Q248 D249 T282 Y283 G284 L285	Q248-C280 HydrophobicContact CB-CB 4.21Å; D249-C280 PolarHBondContact OD1-SG 3.14Å; C280-T282 PolarHBondContact O-N 3.05Å; C280-T282 VanDerWaalsContact SG-CB 3.58Å; C280-Y283 HydrophobicContact CB-CD1 3.97Å; C280-Y283 HydrophobicContact CB-CE1 3.49Å; C280-Y283 VanDerWaalsContact CB-CE1 3.49Å; C280-Y283 HydrophobicContact CB-CE2 4.26Å; C280-Y283 WeakPolarHBondContact SG-CD1 3.29Å; C280-Y283 WeakPolarHBondContact SG-CE1 3.13Å; C280-G284 CarbonylContact O-C 3.57Å; C280-G284 VanDerWaalsContact O-CA 3.27Å; C280-G284 WeakPolarHBondContact O-CA 3.42Å; C280-G284 PolarHBondContact O-N 2.76Å; C280-L285 HydrophobicContact CB-CB 4Å; C280-L285 PolarHBondContact N-O 2.88Å; C280-L285 PolarHBondContact O-N 2.78Å
281	S	91.8	Very high	91.7	Very high	0 Å²	0	51 Å²	51	0%	0	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-29	175.8	-44.6	0	0	0	0	112	L156 R159 D249	L156-S281 WeakPolarHBondContact CA-OG 3.41Å; L156-S281 PolarHBondContact N-OG 2.77Å; R159-S281 VanDerWaalsContact CD-O 3.24Å; R159-S281 WeakPolarHBondContact CD-O 3.45Å; R159-S281 VanDerWaalsContact CG-O 3.28Å; R159-S281 WeakPolarHBondContact CG-O 3.37Å; R159-S281 PolarHBondContact NH1-O 2.8Å; D249-S281 WeakPolarHBondContact OD1-CA 3.42Å; D249-S281 WeakPolarHBondContact OD1-CB 3.45Å; D249-S281 PolarHBondContact OD1-N 3.19Å; D249-S281 WeakPolarHBondContact OD2-CB 3.31Å; D249-S281 PolarHBondContact OD2-N 2.71Å; D249-S281 PolarHBondContact OD2-OG 2.87Å
282	T	87.4	Confident	92.1	Very high	63 Å²	63	53.4 Å²	53.4	39%	0.387	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-44.8	179.7	-54.8	0	0	0	0	112.7	R159 Y165 D249 C280	R159-T282 VanDerWaalsContact NH1-C 3.3Å; R159-T282 PolarHBondContact NH1-O 2.98Å; Y165-T282 HydrophobicContact CD1-CG2 4.35Å; D249-T282 PolarHBondContact OD1-N 2.76Å; D249-T282 PolarHBondContact OD1-OG1 2.7Å; C280-T282 PolarHBondContact O-N 3.05Å; C280-T282 VanDerWaalsContact SG-CB 3.58Å
283	Y	86.2	Confident	92.9	Very high	143 Å²	143	49.3 Å²	49.3	56%	0.561	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-119.7	7.6	179.3	59.2	-90.5	0	0	0	114.8	Q248 C280 L285	Q248-Y283 PolarHBondContact OE1-OH 3.18Å; C280-Y283 HydrophobicContact CB-CD1 3.97Å; C280-Y283 HydrophobicContact CB-CE1 3.49Å; C280-Y283 VanDerWaalsContact CB-CE1 3.49Å; C280-Y283 HydrophobicContact CB-CE2 4.26Å; C280-Y283 WeakPolarHBondContact SG-CD1 3.29Å; C280-Y283 WeakPolarHBondContact SG-CE1 3.13Å; Y283-L285 HydrophobicContact CD2-CB 4.08Å; Y283-L285 HydrophobicContact CE2-CB 3.59Å; Y283-L285 HydrophobicContact CE2-CD2 4.19Å; Y283-L285 HydrophobicContact CE2-CG 4.39Å
284	G	86.6	Confident	93.5	Very high	29 Å²	29	39.9 Å²	39.9	30%	0.299	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	80.5	19.4	172.6	0	0	0	0	0	115.4	C280 N286	C280-G284 CarbonylContact O-C 3.57Å; C280-G284 VanDerWaalsContact O-CA 3.27Å; C280-G284 WeakPolarHBondContact O-CA 3.42Å; C280-G284 PolarHBondContact O-N 2.76Å; G284-N286 PolarHBondContact O-N 2.77Å
285	L	92.9	Very high	93.8	Very high	53 Å²	53	39.3 Å²	39.3	28%	0.277	19%	0.188	S	C	.	.	B	Isolated β-bridge	trans	-61.6	123.3	179	175.6	64.1	0	0	0	110.8	T279 C280 Y283 V287	T279-L285 VanDerWaalsContact CA-O 3.23Å; T279-L285 WeakPolarHBondContact CA-O 3.22Å; T279-L285 WeakPolarHBondContact CB-O 3.25Å; C280-L285 HydrophobicContact CB-CB 4Å; C280-L285 PolarHBondContact N-O 2.88Å; C280-L285 PolarHBondContact O-N 2.78Å; Y283-L285 HydrophobicContact CD2-CB 4.08Å; Y283-L285 HydrophobicContact CE2-CB 3.59Å; Y283-L285 HydrophobicContact CE2-CD2 4.19Å; Y283-L285 HydrophobicContact CE2-CG 4.39Å; L285-V287 WeakPolarHBondContact O-CG2 3.45Å; L285-V287 PolarHBondContact O-N 3.05Å
286	N	93.5	Very high	93.9	Very high	27 Å²	27	41.3 Å²	41.3	14%	0.144	19%	0.194	C	C	.	.	S	Bend	trans	57.4	-4.9	175	-65	-32.4	0	0	0	117.5	E278 T279 G284 E288 R289 V290	E278-N286 WeakPolarHBondContact O-CB 3.38Å; E278-N286 PolarHBondContact O-ND2 3.22Å; T279-N286 HydrophobicContact CG2-CB 3.94Å; G284-N286 PolarHBondContact O-N 2.77Å; N286-E288 PolarHBondContact O-N 2.81Å; N286-R289 WeakPolarHBondContact O-CA 3.41Å; N286-R289 VanDerWaalsContact O-CB 3.31Å; N286-R289 WeakPolarHBondContact O-CB 3.27Å; N286-R289 PolarHBondContact O-N 3.46Å; N286-R289 WeakPolarHBondContact OD1-CD 3.26Å; N286-R289 PolarHBondContact OD1-NE 3.37Å; N286-R289 PolarHBondContact OD1-NH1 3.2Å; N286-V290 PolarHBondContact O-N 3.13Å; N286-V290 VanDerWaalsContact O-N 3.13Å
287	V	93.8	Very high	93.8	Very high	4 Å²	4	42.2 Å²	42.2	2%	0.024	20%	0.199	C	C	.	.	H	α-helix	trans	-49.4	-58.9	-175.8	-178.5	0	0	0	0	112.1	L156 R159 Y160 L285 R289 V290 F291	L156-V287 HydrophobicContact CD1-CB 4.24Å; L156-V287 HydrophobicContact CD1-CG1 3.91Å; L156-V287 HydrophobicContact CD1-CG2 3.84Å; R159-V287 HydrophobicContact CB-CG1 4.44Å; R159-V287 HydrophobicContact CG-CG1 4.34Å; R159-V287 HydrophobicContact CG-CG2 4.15Å; Y160-V287 HydrophobicContact CD2-CG1 4.45Å; L285-V287 WeakPolarHBondContact O-CG2 3.45Å; L285-V287 PolarHBondContact O-N 3.05Å; V287-R289 PolarHBondContact O-N 3.19Å; V287-V290 PolarHBondContact O-N 2.86Å; V287-F291 HydrophobicContact CG1-CE2 4.49Å; V287-F291 WeakPolarHBondContact O-CD2 3.39Å
288	E	94	Very high	93.6	Very high	98 Å²	98	39.9 Å²	39.9	46%	0.458	19%	0.19	S	C	.	.	H	α-helix	trans	-60.6	-30.9	179.8	-156.7	71	-160.6	0	0	112.5	Y160 K178 N286 Q292	Y160-E288 WeakPolarHBondContact CD2-OE2 3.2Å; Y160-E288 HydrophobicContact CE2-CG 4.41Å; Y160-E288 VanDerWaalsContact CE2-OE1 3.26Å; Y160-E288 WeakPolarHBondContact CE2-OE1 3.23Å; Y160-E288 VanDerWaalsContact CE2-OE2 3.25Å; Y160-E288 WeakPolarHBondContact CE2-OE2 3.34Å; K178-E288 IonicContact NZ-OE1 3.45Å; K178-E288 PolarHBondContact NZ-OE1 3.06Å; K178-E288 IonicContact NZ-OE2 2.79Å; K178-E288 PolarHBondContact NZ-OE2 2.88Å; N286-E288 PolarHBondContact O-N 2.81Å; E288-Q292 WeakPolarHBondContact O-CB 3.25Å; E288-Q292 PolarHBondContact O-N 2.85Å
289	R	93.6	Very high	93.5	Very high	160 Å²	160	38.5 Å²	38.5	60%	0.604	18%	0.183	S	C	*	.	H	α-helix	trans	-69.1	-36.8	-179.8	-53	-175.2	-167.5	168.8	5.4	112.2	N286 V287 Q292 D293	N286-R289 WeakPolarHBondContact O-CA 3.41Å; N286-R289 VanDerWaalsContact O-CB 3.31Å; N286-R289 WeakPolarHBondContact O-CB 3.27Å; N286-R289 PolarHBondContact O-N 3.46Å; N286-R289 WeakPolarHBondContact OD1-CD 3.26Å; N286-R289 PolarHBondContact OD1-NE 3.37Å; N286-R289 PolarHBondContact OD1-NH1 3.2Å; V287-R289 PolarHBondContact O-N 3.19Å; R289-Q292 PolarHBondContact O-N 2.95Å; R289-D293 VanDerWaalsContact O-CB 3.31Å; R289-D293 WeakPolarHBondContact O-CB 3.2Å; R289-D293 PolarHBondContact O-N 3.21Å
290	V	96.7	Very high	93.3	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-59.3	-54.6	176.9	171.3	0	0	0	0	109.6	V210 V243 V245 Y277 T279 N286 V287 Q292 D293 V294	V210-V290 HydrophobicContact CG1-CG1 4Å; V210-V290 HydrophobicContact CG2-CG1 4.31Å; V243-V290 HydrophobicContact CG1-CG1 4.24Å; V245-V290 HydrophobicContact CG2-CG1 3.77Å; V245-V290 HydrophobicContact CG2-CG2 3.89Å; Y277-V290 HydrophobicContact CD2-CG2 3.89Å; Y277-V290 HydrophobicContact CG-CG2 3.96Å; T279-V290 HydrophobicContact CG2-CG2 3.78Å; N286-V290 PolarHBondContact O-N 3.13Å; N286-V290 VanDerWaalsContact O-N 3.13Å; V287-V290 PolarHBondContact O-N 2.86Å; V290-Q292 VanDerWaalsContact C-N 3.33Å; V290-Q292 PolarHBondContact O-N 2.92Å; V290-D293 PolarHBondContact O-N 3.45Å; V290-V294 WeakPolarHBondContact O-CG2 3.45Å; V290-V294 PolarHBondContact O-N 3.14Å
291	F	96.8	Very high	93.1	Very high	2 Å²	2	43.5 Å²	43.5	1%	0.009	22%	0.217	C	C	.	.	H	α-helix	trans	-64.6	-36.4	-179.4	-72.2	-90	0	0	0	112.6	I145 L156 Y160 L189 I191 V287 A295	I145-F291 HydrophobicContact CD1-CE1 3.67Å; I145-F291 HydrophobicContact CD1-CZ 3.57Å; L156-F291 HydrophobicContact CG-CE2 4.49Å; Y160-F291 VanDerWaalsContact CB-CE2 3.47Å; Y160-F291 HydrophobicContact CD1-CB 4.46Å; Y160-F291 AromaticContact CD1-CD1 3.66Å; Y160-F291 HydrophobicContact CD1-CD1 3.66Å; Y160-F291 AromaticContact CD1-CD2 3.77Å; Y160-F291 HydrophobicContact CD1-CD2 3.77Å; Y160-F291 AromaticContact CD1-CE1 3.68Å; Y160-F291 HydrophobicContact CD1-CE1 3.68Å; Y160-F291 AromaticContact CD1-CE2 3.81Å; Y160-F291 HydrophobicContact CD1-CE2 3.81Å; Y160-F291 AromaticContact CD1-CG 3.69Å; Y160-F291 HydrophobicContact CD1-CG 3.69Å; Y160-F291 AromaticContact CD1-CZ 3.76Å; Y160-F291 HydrophobicContact CD1-CZ 3.76Å; Y160-F291 HydrophobicContact CD2-CB 3.93Å; Y160-F291 HydrophobicContact CD2-CD1 4.47Å; Y160-F291 AromaticContact CD2-CD2 3.36Å; Y160-F291 HydrophobicContact CD2-CD2 3.36Å; Y160-F291 AromaticContact CD2-CE2 3.94Å; Y160-F291 HydrophobicContact CD2-CE2 3.94Å; Y160-F291 AromaticContact CD2-CG 3.67Å; Y160-F291 HydrophobicContact CD2-CG 3.67Å; Y160-F291 HydrophobicContact CE1-CB 3.97Å; Y160-F291 AromaticContact CE1-CD1 3.53Å; Y160-F291 HydrophobicContact CE1-CD1 3.53Å; Y160-F291 HydrophobicContact CE1-CD2 4.15Å; Y160-F291 AromaticContact CE1-CE1 3.98Å; Y160-F291 HydrophobicContact CE1-CE1 3.98Å; Y160-F291 AromaticContact CE1-CG 3.62Å; Y160-F291 HydrophobicContact CE1-CG 3.62Å; Y160-F291 HydrophobicContact CE1-CZ 4.48Å; Y160-F291 HydrophobicContact CE2-CB 3.37Å; Y160-F291 HydrophobicContact CE2-CD1 4.36Å; Y160-F291 AromaticContact CE2-CD2 3.77Å; Y160-F291 HydrophobicContact CE2-CD2 3.77Å; Y160-F291 AromaticContact CE2-CG 3.58Å; Y160-F291 HydrophobicContact CE2-CG 3.58Å; Y160-F291 HydrophobicContact CG-CB 4.44Å; Y160-F291 HydrophobicContact CG-CD1 4.15Å; Y160-F291 AromaticContact CG-CD2 3.35Å; Y160-F291 HydrophobicContact CG-CD2 3.35Å; Y160-F291 HydrophobicContact CG-CE1 4.21Å; Y160-F291 AromaticContact CG-CE2 3.46Å; Y160-F291 HydrophobicContact CG-CE2 3.46Å; Y160-F291 VanDerWaalsContact CG-CE2 3.46Å; Y160-F291 AromaticContact CG-CG 3.73Å; Y160-F291 HydrophobicContact CG-CG 3.73Å; Y160-F291 AromaticContact CG-CZ 3.89Å; Y160-F291 HydrophobicContact CG-CZ 3.89Å; Y160-F291 VanDerWaalsContact CZ-CB 3.42Å; Y160-F291 AromaticContact CZ-CD1 3.93Å; Y160-F291 AromaticContact CZ-CG 3.58Å; L189-F291 HydrophobicContact CD2-CD1 4.23Å; I191-F291 HydrophobicContact CD1-CD1 4.37Å; I191-F291 HydrophobicContact CD1-CE1 3.82Å; I191-F291 HydrophobicContact CG1-CE1 4.35Å; I191-F291 HydrophobicContact CG2-CE1 4.41Å; V287-F291 HydrophobicContact CG1-CE2 4.49Å; V287-F291 WeakPolarHBondContact O-CD2 3.39Å; F291-A295 WeakPolarHBondContact O-CB 3.17Å; F291-A295 PolarHBondContact O-N 3.3Å
292	Q	96.1	Very high	93	Very high	52 Å²	52	47 Å²	47	24%	0.243	23%	0.23	C	C	.	.	H	α-helix	trans	-67.7	-43.6	176.5	-165.5	68	16.2	0	0	112.7	V181 E288 R289 V290 A295 Q296	V181-Q292 PolarHBondContact O-NE2 3.28Å; E288-Q292 WeakPolarHBondContact O-CB 3.25Å; E288-Q292 PolarHBondContact O-N 2.85Å; R289-Q292 PolarHBondContact O-N 2.95Å; V290-Q292 VanDerWaalsContact C-N 3.33Å; V290-Q292 PolarHBondContact O-N 2.92Å; Q292-A295 PolarHBondContact O-N 2.96Å; Q292-Q296 VanDerWaalsContact O-CB 3.32Å; Q292-Q296 WeakPolarHBondContact O-CB 3.33Å; Q292-Q296 VanDerWaalsContact O-CG 3.28Å; Q292-Q296 WeakPolarHBondContact O-CG 3.31Å; Q292-Q296 PolarHBondContact O-N 2.68Å
293	D	95.6	Very high	92.9	Very high	22 Å²	22	48 Å²	48	12%	0.118	23%	0.23	C	C	.	.	H	α-helix	trans	-62.6	-44.4	175.3	172.2	45.9	0	0	0	111.3	V243 T275 Y277 R289 V290 A295 Q296 K297	V243-D293 WeakPolarHBondContact CG2-OD2 3.32Å; T275-D293 PolarHBondContact OG1-OD2 2.99Å; Y277-D293 HydrophobicContact CE2-CB 4.28Å; Y277-D293 WeakPolarHBondContact CE2-OD2 3.46Å; R289-D293 VanDerWaalsContact O-CB 3.31Å; R289-D293 WeakPolarHBondContact O-CB 3.2Å; R289-D293 PolarHBondContact O-N 3.21Å; V290-D293 PolarHBondContact O-N 3.45Å; D293-A295 PolarHBondContact O-N 2.74Å; D293-Q296 PolarHBondContact O-N 3.5Å; D293-K297 VanDerWaalsContact CG-NZ 3.25Å; D293-K297 WeakPolarHBondContact O-CB 3.34Å; D293-K297 WeakPolarHBondContact O-CD 3.27Å; D293-K297 VanDerWaalsContact O-CG 3.29Å; D293-K297 WeakPolarHBondContact O-CG 3.29Å; D293-K297 PolarHBondContact O-N 2.96Å; D293-K297 WeakPolarHBondContact OD1-CE 3.42Å; D293-K297 IonicContact OD1-NZ 2.73Å; D293-K297 PolarHBondContact OD1-NZ 3.07Å; D293-K297 VanDerWaalsContact OD1-NZ 3.08Å; D293-K297 IonicContact OD2-NZ 2.72Å; D293-K297 PolarHBondContact OD2-NZ 3.28Å
294	V	95.8	Very high	92.9	Very high	1 Å²	1	48.9 Å²	48.9	1%	0.006	24%	0.236	C	C	.	.	H	α-helix	trans	-56.6	-51.6	173.9	173.4	0	0	0	0	111.1	V143 A208 V210 V243 V290 K297 V298	V143-V294 HydrophobicContact CB-CG1 4.37Å; V143-V294 HydrophobicContact CG1-CG1 3.93Å; V143-V294 HydrophobicContact CG2-CG1 3.47Å; V143-V294 VanDerWaalsContact CG2-CG1 3.47Å; A208-V294 HydrophobicContact CB-CG1 3.61Å; V210-V294 HydrophobicContact CG2-CG2 3.65Å; V243-V294 HydrophobicContact CB-CG2 4.04Å; V243-V294 HydrophobicContact CG2-CG2 3.5Å; V243-V294 VanDerWaalsContact CG2-CG2 3.5Å; V290-V294 WeakPolarHBondContact O-CG2 3.45Å; V290-V294 PolarHBondContact O-N 3.14Å; V294-K297 PolarHBondContact O-N 3.1Å; V294-V298 WeakPolarHBondContact O-CG2 3.41Å; V294-V298 PolarHBondContact O-N 3.14Å
295	A	95.8	Very high	92.6	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-66.2	-42	-177.9	0	0	0	0	0	112.6	L141 I180 V182 F291 Q292 D293 K297 V298 V299	L141-A295 HydrophobicContact CD1-CB 3.91Å; I180-A295 HydrophobicContact CD1-CB 3.6Å; V182-A295 HydrophobicContact CG2-CB 3.79Å; F291-A295 WeakPolarHBondContact O-CB 3.17Å; F291-A295 PolarHBondContact O-N 3.3Å; Q292-A295 PolarHBondContact O-N 2.96Å; D293-A295 PolarHBondContact O-N 2.74Å; A295-K297 VanDerWaalsContact C-N 3.33Å; A295-K297 PolarHBondContact O-N 2.76Å; A295-V298 PolarHBondContact O-N 2.88Å; A295-V299 WeakPolarHBondContact O-CG2 3.29Å; A295-V299 PolarHBondContact O-N 3.08Å
296	Q	95	Very high	91.8	Very high	90 Å²	90	55.7 Å²	55.7	42%	0.421	26%	0.259	S	S	.	.	H	α-helix	trans	-57.7	-43.8	172.9	-79.3	174.8	-16	0	0	111.7	V182 Q292 D293 V299 A300	V182-Q296 HydrophobicContact CG1-CG 3.93Å; Q292-Q296 VanDerWaalsContact O-CB 3.32Å; Q292-Q296 WeakPolarHBondContact O-CB 3.33Å; Q292-Q296 VanDerWaalsContact O-CG 3.28Å; Q292-Q296 WeakPolarHBondContact O-CG 3.31Å; Q292-Q296 PolarHBondContact O-N 2.68Å; D293-Q296 PolarHBondContact O-N 3.5Å; Q296-V299 PolarHBondContact O-N 3.2Å; Q296-A300 VanDerWaalsContact O-CB 3.26Å; Q296-A300 WeakPolarHBondContact O-CB 3.33Å; Q296-A300 PolarHBondContact O-N 3.28Å
297	K	93.9	Very high	90.6	Very high	53 Å²	53	61.9 Å²	61.9	23%	0.23	29%	0.291	C	S	.	.	H	α-helix	trans	-65.5	-40.4	177.1	-75.1	165	172.3	161.9	0	113.5	P241 T275 D293 V294 A295 A300 M301	P241-K297 HydrophobicContact CB-CB 3.67Å; P241-K297 HydrophobicContact CB-CD 4.22Å; P241-K297 HydrophobicContact CG-CB 3.96Å; T275-K297 PolarHBondContact OG1-NZ 2.88Å; D293-K297 VanDerWaalsContact CG-NZ 3.25Å; D293-K297 WeakPolarHBondContact O-CB 3.34Å; D293-K297 WeakPolarHBondContact O-CD 3.27Å; D293-K297 VanDerWaalsContact O-CG 3.29Å; D293-K297 WeakPolarHBondContact O-CG 3.29Å; D293-K297 PolarHBondContact O-N 2.96Å; D293-K297 WeakPolarHBondContact OD1-CE 3.42Å; D293-K297 IonicContact OD1-NZ 2.73Å; D293-K297 PolarHBondContact OD1-NZ 3.07Å; D293-K297 VanDerWaalsContact OD1-NZ 3.08Å; D293-K297 IonicContact OD2-NZ 2.72Å; D293-K297 PolarHBondContact OD2-NZ 3.28Å; V294-K297 PolarHBondContact O-N 3.1Å; A295-K297 VanDerWaalsContact C-N 3.33Å; A295-K297 PolarHBondContact O-N 2.76Å; K297-A300 PolarHBondContact O-N 2.72Å; K297-M301 VanDerWaalsContact O-CB 3.25Å; K297-M301 WeakPolarHBondContact O-CB 3.34Å; K297-M301 PolarHBondContact O-N 2.89Å
298	V	94.2	Very high	89	Confident	3 Å²	3	66.1 Å²	66.1	2%	0.018	32%	0.321	C	S	.	.	H	α-helix	trans	-62	-47.9	174.8	173.9	0	0	0	0	110.4	L141 D207 A208 P241 V294 A295 A300 M301 R302	L141-V298 HydrophobicContact CD2-CB 4.08Å; L141-V298 HydrophobicContact CD2-CG1 3.48Å; L141-V298 VanDerWaalsContact CD2-CG1 3.48Å; D207-V298 HydrophobicContact CB-CB 4.38Å; D207-V298 HydrophobicContact CB-CG1 3.61Å; D207-V298 HydrophobicContact CB-CG2 3.76Å; A208-V298 HydrophobicContact CB-CG2 3.47Å; A208-V298 VanDerWaalsContact CB-CG2 3.47Å; P241-V298 HydrophobicContact CG-CG2 4.12Å; V294-V298 WeakPolarHBondContact O-CG2 3.41Å; V294-V298 PolarHBondContact O-N 3.14Å; A295-V298 PolarHBondContact O-N 2.88Å; V298-A300 PolarHBondContact O-N 2.96Å; V298-M301 PolarHBondContact O-N 3.25Å; V298-R302 HydrophobicContact CG1-CG 4.4Å; V298-R302 WeakPolarHBondContact O-CB 3.34Å; V298-R302 WeakPolarHBondContact O-CG 3.21Å; V298-R302 PolarHBondContact O-N 2.97Å
299	V	93.8	Very high	87.2	Confident	4 Å²	4	67.7 Å²	67.7	2%	0.024	33%	0.331	C	S	.	.	H	α-helix	trans	-62.3	-43.5	178.5	171.8	0	0	0	0	111.2	L141 V182 Y187 A295 Q296 R302 K303	L141-V299 HydrophobicContact CD1-CG2 4.35Å; L141-V299 HydrophobicContact CD2-CG2 4Å; V182-V299 HydrophobicContact CB-CG2 4.26Å; V182-V299 HydrophobicContact CG1-CB 4.02Å; V182-V299 HydrophobicContact CG1-CG1 4.17Å; V182-V299 HydrophobicContact CG1-CG2 3.93Å; Y187-V299 HydrophobicContact CE1-CG2 3.93Å; Y187-V299 HydrophobicContact CE2-CG2 4.08Å; A295-V299 WeakPolarHBondContact O-CG2 3.29Å; A295-V299 PolarHBondContact O-N 3.08Å; Q296-V299 PolarHBondContact O-N 3.2Å; V299-R302 PolarHBondContact O-N 3.09Å; V299-K303 HydrophobicContact CG1-CD 4.07Å; V299-K303 WeakPolarHBondContact O-CB 3.27Å; V299-K303 VanDerWaalsContact O-CG 3.28Å; V299-K303 WeakPolarHBondContact O-CG 3.28Å; V299-K303 PolarHBondContact O-N 3.2Å
300	A	91.8	Very high	84.9	Confident	59 Å²	59	62.5 Å²	62.5	49%	0.488	33%	0.327	S	S	.	.	H	α-helix	trans	-64.9	-40.7	176.5	0	0	0	0	0	112.9	Q296 K297 V298 K303 K304	Q296-A300 VanDerWaalsContact O-CB 3.26Å; Q296-A300 WeakPolarHBondContact O-CB 3.33Å; Q296-A300 PolarHBondContact O-N 3.28Å; K297-A300 PolarHBondContact O-N 2.72Å; V298-A300 PolarHBondContact O-N 2.96Å; A300-K303 PolarHBondContact O-N 3.31Å; A300-K304 WeakPolarHBondContact O-CB 3.24Å; A300-K304 PolarHBondContact O-N 2.81Å
301	M	89.3	Confident	82.2	Confident	51 Å²	51	69 Å²	69	25%	0.251	37%	0.369	S	S	.	.	H	α-helix	trans	-66.1	-44	177	-173.5	177.2	-77	0	0	111.3	A238 P241 K297 V298 K304 Q305	A238-M301 WeakPolarHBondContact O-CE 3.36Å; P241-M301 HydrophobicContact CG-CE 3.83Å; P241-M301 HydrophobicContact CG-SD 4.1Å; K297-M301 VanDerWaalsContact O-CB 3.25Å; K297-M301 WeakPolarHBondContact O-CB 3.34Å; K297-M301 PolarHBondContact O-N 2.89Å; V298-M301 PolarHBondContact O-N 3.25Å; M301-K304 WeakPolarHBondContact O-CB 3.37Å; M301-K304 PolarHBondContact O-N 3.19Å; M301-Q305 WeakPolarHBondContact O-CG 3.49Å; M301-Q305 PolarHBondContact O-N 3.44Å
302	R	89.8	Confident	79.2	Confident	72 Å²	72	74.9 Å²	74.9	27%	0.272	41%	0.409	S	S	.	.	H	α-helix	trans	-62.4	-43.4	174.3	-72.4	173.6	173.1	-171.2	-1.4	112	E140 D207 V298 V299 K304 Q305 Q306	E140-R302 VanDerWaalsContact O-CZ 3.31Å; E140-R302 PolarHBondContact O-NH1 3.17Å; E140-R302 PolarHBondContact O-NH2 3.16Å; D207-R302 IonicContact OD1-CZ 2.75Å; D207-R302 IonicContact OD1-NE 3.35Å; D207-R302 PolarHBondContact OD1-NE 3.14Å; D207-R302 IonicContact OD1-NH2 3.46Å; D207-R302 PolarHBondContact OD1-NH2 2.99Å; D207-R302 IonicContact OD2-CZ 3.04Å; D207-R302 IonicContact OD2-NH2 2.92Å; D207-R302 PolarHBondContact OD2-NH2 3.25Å; V298-R302 HydrophobicContact CG1-CG 4.4Å; V298-R302 WeakPolarHBondContact O-CB 3.34Å; V298-R302 WeakPolarHBondContact O-CG 3.21Å; V298-R302 PolarHBondContact O-N 2.97Å; V299-R302 PolarHBondContact O-N 3.09Å; R302-K304 VanDerWaalsContact C-N 3.33Å; R302-K304 PolarHBondContact O-N 3.01Å; R302-Q305 PolarHBondContact O-N 2.84Å; R302-Q306 WeakPolarHBondContact O-CG 3.36Å; R302-Q306 PolarHBondContact O-N 3.02Å
303	K	87.1	Confident	76.6	Confident	86 Å²	86	82.4 Å²	82.4	37%	0.374	44%	0.441	S	S	.	.	H	α-helix	trans	-58.2	-43.4	172.9	-76.4	173.2	177.9	-177.6	0	111.7	D183 V299 A300 Q306 L307	D183-K303 IonicContact OD2-NZ 3.83Å; D183-K303 PolarHBondContact OD2-NZ 2.92Å; V299-K303 HydrophobicContact CG1-CD 4.07Å; V299-K303 WeakPolarHBondContact O-CB 3.27Å; V299-K303 VanDerWaalsContact O-CG 3.28Å; V299-K303 WeakPolarHBondContact O-CG 3.28Å; V299-K303 PolarHBondContact O-N 3.2Å; A300-K303 PolarHBondContact O-N 3.31Å; K303-Q306 PolarHBondContact O-N 3.01Å; K303-L307 WeakPolarHBondContact O-CG 3.25Å; K303-L307 PolarHBondContact O-N 3.01Å; K303-L307 VanDerWaalsContact O-N 3.08Å
304	K	85.1	Confident	73.6	Confident	160 Å²	160	87 Å²	87	70%	0.696	48%	0.475	S	S	*	.	H	α-helix	trans	-63.2	-43.2	175.8	-173.4	-177.5	178.2	-175.4	0	112.2	A300 M301 R302 L307 S308	A300-K304 WeakPolarHBondContact O-CB 3.24Å; A300-K304 PolarHBondContact O-N 2.81Å; M301-K304 WeakPolarHBondContact O-CB 3.37Å; M301-K304 PolarHBondContact O-N 3.19Å; R302-K304 VanDerWaalsContact C-N 3.33Å; R302-K304 PolarHBondContact O-N 3.01Å; K304-L307 PolarHBondContact O-N 3.37Å; K304-S308 PolarHBondContact O-N 3.4Å; K304-S308 VanDerWaalsContact O-N 3.11Å; K304-S308 PolarHBondContact O-OG 2.98Å
305	Q	80.6	Confident	70.6	Confident	87 Å²	87	95.1 Å²	95.1	41%	0.407	52%	0.517	S	S	.	.	H	α-helix	trans	-62.3	-44.6	177	-74.2	167.4	-14.4	0	0	111.7	M301 R302 L307 S308 I309	M301-Q305 WeakPolarHBondContact O-CG 3.49Å; M301-Q305 PolarHBondContact O-N 3.44Å; R302-Q305 PolarHBondContact O-N 2.84Å; Q305-L307 VanDerWaalsContact C-N 3.33Å; Q305-L307 PolarHBondContact O-N 2.74Å; Q305-S308 WeakPolarHBondContact CA-OG 3.43Å; Q305-S308 PolarHBondContact O-N 2.73Å; Q305-S308 VanDerWaalsContact O-N 3.14Å; Q305-S308 PolarHBondContact O-OG 3.21Å; Q305-I309 PolarHBondContact O-N 3.44Å
306	Q	75.4	Confident	68.4	Low	139 Å²	139	100.3 Å²	100.3	65%	0.65	55%	0.551	S	S	*	*	H	α-helix	trans	-59.3	-40.5	174.9	-72.6	172.5	-7.3	0	0	112.5	R302 K303 S308 I309	R302-Q306 WeakPolarHBondContact O-CG 3.36Å; R302-Q306 PolarHBondContact O-N 3.02Å; K303-Q306 PolarHBondContact O-N 3.01Å; Q306-S308 VanDerWaalsContact C-N 3.31Å; Q306-S308 PolarHBondContact O-N 3.41Å; Q306-I309 PolarHBondContact O-N 2.96Å
307	L	68.9	Low	65.3	Low	156 Å²	156	104 Å²	104	82%	0.817	57%	0.574	S	S	*	*	H	α-helix	trans	-71.8	-20.9	177	-70.7	168.1	0	0	0	113.9	K303 K304 Q305	K303-L307 WeakPolarHBondContact O-CG 3.25Å; K303-L307 PolarHBondContact O-N 3.01Å; K303-L307 VanDerWaalsContact O-N 3.08Å; K304-L307 PolarHBondContact O-N 3.37Å; Q305-L307 VanDerWaalsContact C-N 3.33Å; Q305-L307 PolarHBondContact O-N 2.74Å
308	S	59.4	Low	62.2	Low	94 Å²	94	106.6 Å²	106.6	66%	0.657	60%	0.599	S	S	*	*	H	α-helix	trans	-87.3	-8.1	174.9	54.9	0	0	0	0	114.7	K304 Q305 Q306	K304-S308 PolarHBondContact O-N 3.4Å; K304-S308 VanDerWaalsContact O-N 3.11Å; K304-S308 PolarHBondContact O-OG 2.98Å; Q305-S308 WeakPolarHBondContact CA-OG 3.43Å; Q305-S308 PolarHBondContact O-N 2.73Å; Q305-S308 VanDerWaalsContact O-N 3.14Å; Q305-S308 PolarHBondContact O-OG 3.21Å; Q306-S308 VanDerWaalsContact C-N 3.31Å; Q306-S308 PolarHBondContact O-N 3.41Å
309	I	57.8	Low	60.2	Low	131 Å²	131	112 Å²	112	67%	0.672	63%	0.634	S	S	*	*	S	Bend	trans	-100.2	110.5	175.5	-63.2	169.3	0	0	0	108.3	Q305 Q306	Q305-I309 PolarHBondContact O-N 3.44Å; Q306-I309 PolarHBondContact O-N 2.96Å
310	G	44.8	Very low	57	Low	50 Å²	50	117.8 Å²	117.8	52%	0.515	67%	0.674	S	S	.	*			trans	-61.8	156	179	0	0	0	0	0	113.3	C312	G310-C312 PolarHBondContact O-N 2.8Å
311	P	40.3	Very low	54	Low	136 Å²	136	123.6 Å²	123.6	88%	0.883	69%	0.691	S	S	*	*			trans	-75.7	78.5	-167.1	31	-37.3	0	0	0	114.1
312	C	32.5	Very low	51.1	Low	127 Å²	127	126.3 Å²	126.3	86%	0.858	72%	0.715	S	S	*	*			trans	-76	121.2	165	-72	0	0	0	0	110.4	G310	G310-C312 PolarHBondContact O-N 2.8Å
313	K	42.7	Very low	48.1	Very low	210 Å²	210	128.9 Å²	128.9	91%	0.913	74%	0.744	S	S	*	*			trans	-82.1	125.4	-175.3	-61.9	175.6	-178.7	175.4	0	112.6
314	S	32.4	Very low	45.3	Very low	118 Å²	118	131.6 Å²	131.6	83%	0.825	77%	0.767	S	S	*	*			trans	-156.2	134.4	146.4	51.4	0	0	0	0	110.9
315	L	33.1	Very low	43.4	Very low	171 Å²	171	129.9 Å²	129.9	90%	0.895	77%	0.773	S	S	*	*			trans	-92.9	160	175.8	-84.8	166.9	0	0	0	110.5
316	P	49.2	Very low	40.8	Very low	110 Å²	110	130.7 Å²	130.7	71%	0.714	80%	0.795	S	S	*	*			trans	-83.7	154.4	-167.2	33.6	-36.9	0	0	0	113.9
317	N	29.6	Very low	38.5	Very low	168 Å²	168	129.2 Å²	129.2	90%	0.898	81%	0.806	S	S	*	*			trans	-162	154.4	148.8	-106	-25.7	0	0	0	111.4
318	S	29.6	Very low	36.5	Very low	106 Å²	106	126.8 Å²	126.8	74%	0.741	80%	0.802	S	S	*	*			trans	-145.2	164.1	178.4	-65.2	0	0	0	0	108.9
319	P	51.3	Low	34.9	Very low	118 Å²	118	129.8 Å²	129.8	77%	0.766	81%	0.809	S	S	*	*			cis	-125.4	164.8	-34.3	37.5	-24.6	0	0	0	111.6
320	S	26.5	Very low	33.7	Very low	124 Å²	124	129 Å²	129	87%	0.867	81%	0.813	S	S	*	*			trans	-162.6	161.8	163.8	-87.4	0	0	0	0	112.6
321	H	28.9	Very low	32.8	Very low	182 Å²	182	131.6 Å²	131.6	84%	0.843	82%	0.823	S	S	*	*			trans	-89.2	151.2	-166.2	-73.4	-114.5	0	0	0	115.2
322	S	28.2	Very low	32.1	Very low	108 Å²	108	131 Å²	131	76%	0.755	82%	0.816	S	S	*	*			trans	54.3	116.7	144.3	62.1	0	0	0	0	121.2
323	S	27	Very low	31.9	Very low	126 Å²	126	133.5 Å²	133.5	88%	0.881	82%	0.815	S	S	*	*				-164.4	162.3	122.8	18.7	0	0	0	0	111.7
324	V	28.9	Very low	31.1	Very low	142 Å²	142	130.1 Å²	130.1	86%	0.861	81%	0.806	S	S	*	*			trans	-97.1	147	-173	171.1	0	0	0	0	110.1
325	P	45.2	Very low	30.8	Very low	124 Å²	124	131.7 Å²	131.7	81%	0.805	81%	0.805	S	S	*	*			trans	-91	151.6	-165.7	35.4	-36.7	0	0	0	115
326	A	26.2	Very low	30.6	Very low	105 Å²	105	131.7 Å²	131.7	87%	0.868	80%	0.801	S	S	*	*			trans	-161.7	113.4	160.2	0	0	0	0	0	112.7
327	A	26.6	Very low	29.6	Very low	108 Å²	108	130.8 Å²	130.8	89%	0.893	80%	0.802	S	S	*	*			trans	-179.4	145.7	149.7	0	0	0	0	0	109
328	S	25.7	Very low	29.5	Very low	104 Å²	104	126.8 Å²	126.8	73%	0.727	79%	0.793	S	S	*	*			trans	-151.1	163.9	-177.3	59.6	0	0	0	0	111.8
329	I	27.1	Very low	29.5	Very low	157 Å²	157	129.8 Å²	129.8	81%	0.805	80%	0.8	S	S	*	*			trans	72.3	140.3	171.8	-65.7	170.4	0	0	0	112.1
330	P	32	Very low	28.4	Very low	116 Å²	116	127.7 Å²	127.7	75%	0.753	80%	0.801	S	S	*	*			cis	-117.3	167.9	28.7	9.5	16	0	0	0	119.8
331	S	25.9	Very low	28.5	Very low	103 Å²	103	126 Å²	126	72%	0.72	80%	0.803	S	S	*	*			trans	-26	171.4	154.5	45	0	0	0	0	117.7
332	V	26.4	Very low	28.4	Very low	123 Å²	123	120.7 Å²	120.7	75%	0.745	80%	0.797	S	S	*	*			cis	-157	146.9	48.1	-171.8	0	0	0	0	114.7
333	H	27.2	Very low	28.6	Very low	180 Å²	180	119.6 Å²	119.6	83%	0.833	80%	0.795	S	S	*	*			trans	79.2	158.8	158.8	-106.5	-103.7	0	0	0	123.1
334	L	25.7	Very low	28.5	Very low	139 Å²	139	122.6 Å²	122.6	73%	0.728	79%	0.792	S	S	*	*			trans	-148.5	144.1	-166	168.1	69.3	0	0	0	108.9
335	N	27.4	Very low	28.7	Very low	152 Å²	152	120 Å²	120	81%	0.813	78%	0.781	S	S	*	*			trans	-139.7	107.2	155.1	-82	-20.8	0	0	0	104.9
336	Q	29	Very low	27.9	Very low	171 Å²	171	120.8 Å²	120.8	80%	0.799	78%	0.778	S	S	*	*				85.4	84.9	58.9	-165.8	-177.7	47.9	0	0	114.5
337	A	27.5	Very low	28.1	Very low	90 Å²	90	125.2 Å²	125.2	74%	0.744	77%	0.773	S	S	*	*			trans	-160.7	116.3	142.6	0	0	0	0	0	105.7
338	A	28.1	Very low	28.2	Very low	85 Å²	85	123.7 Å²	123.7	70%	0.702	76%	0.756	S	S	*	*				60.2	115.7	75.6	0	0	0	0	0	111.8
339	N	29.8	Very low	28.5	Very low	168 Å²	168	124 Å²	124	90%	0.898	76%	0.759	S	S	*	*			cis	-147.4	174.3	3.6	-68.3	-48.6	0	0	0	108.1
340	G	27.5	Very low	28.6	Very low	75 Å²	75	121.9 Å²	121.9	77%	0.773	76%	0.758	S	S	*	*			cis	153.6	132.9	-3.7	0	0	0	0	0	111.6
341	G	27.9	Very low	28.6	Very low	88 Å²	88	122.4 Å²	122.4	91%	0.907	76%	0.759	S	S	*	*			trans	87.2	148.9	-178.4	0	0	0	0	0	114.6
342	G	28.1	Very low	29.3	Very low	70 Å²	70	123.2 Å²	123.2	72%	0.722	76%	0.761	S	S	*	*			cis	-171.9	134.3	-8.5	0	0	0	0	0	108.5
343	A	30.7	Very low	29.4	Very low	86 Å²	86	122.1 Å²	122.1	71%	0.711	76%	0.759	S	S	*	*				56	127.8	90.8	0	0	0	0	0	113.5
344	F	25.8	Very low	29.5	Very low	188 Å²	188	120.5 Å²	120.5	83%	0.825	76%	0.762	S	S	*	*			cis	-132.9	165.6	19.4	-78.1	-95	0	0	0	110.9
345	S	33.3	Very low	29.7	Very low	89 Å²	89	119.7 Å²	119.7	62%	0.622	77%	0.765	S	S	*	*				54	140.4	69.9	126.9	0	0	0	0	113.1
346	D	29.1	Very low	29.6	Very low	139 Å²	139	117.5 Å²	117.5	74%	0.743	76%	0.762	S	S	*	*			cis	-160.5	-172.8	13	-115.3	-51.5	0	0	0	107.9
347	Y	29.6	Very low	29.4	Very low	198 Å²	198	116.7 Å²	116.7	78%	0.776	76%	0.761	S	S	*	*			cis	-175.1	158.6	-6.9	160.5	-78.3	0	0	0	106.7
348	S	28.2	Very low	29.2	Very low	76 Å²	76	116.1 Å²	116.1	53%	0.531	75%	0.752	S	S	.	*			cis	-177.8	167.1	-29.7	-80.2	0	0	0	0	109.7
349	S	32.2	Very low	29.1	Very low	112 Å²	112	118.4 Å²	118.4	78%	0.783	75%	0.748	S	S	*	*			trans	73.8	157.9	171.6	82.9	0	0	0	0	117.7
350	S	29.4	Very low	29	Very low	112 Å²	112	119.6 Å²	119.6	78%	0.783	74%	0.74	S	S	*	*			cis	-150.3	158.9	9.5	55.9	0	0	0	0	114.2
351	V	32.4	Very low	29	Very low	127 Å²	127	123.2 Å²	123.2	77%	0.77	74%	0.736	S	S	*	*			trans	-95.7	164.6	175.1	-62	0	0	0	0	113.1
352	P	38.9	Very low	28.8	Very low	119 Å²	119	125.7 Å²	125.7	77%	0.773	73%	0.726	S	S	*	*				-146.9	134.4	95.4	34.3	-15.6	0	0	0	115.1
353	S	28.7	Very low	28.6	Very low	101 Å²	101	132.4 Å²	132.4	71%	0.706	73%	0.73	S	S	*	*				84.9	119.3	79.3	-55.1	0	0	0	0	117
354	T	29.5	Very low	28.3	Very low	145 Å²	145	134.7 Å²	134.7	89%	0.89	73%	0.729	S	S	*	*			trans	-168.5	155.2	138	14.2	0	0	0	0	110.6
355	P	31.4	Very low	28.2	Very low	123 Å²	123	133.7 Å²	133.7	80%	0.799	73%	0.726	S	S	*	*			trans	-121.6	173.2	-150.4	42.9	-32.9	0	0	0	117.9
356	S	24.4	Very low	27.8	Very low	105 Å²	105	135.4 Å²	135.4	73%	0.734	73%	0.733	S	S	*	*			trans	-78.7	155.2	172.4	56.5	0	0	0	0	115.7
357	I	24.6	Very low	27.6	Very low	154 Å²	154	136.2 Å²	136.2	79%	0.79	74%	0.736	S	S	*	*			trans	-172.9	130.9	137.9	-105.1	160.8	0	0	0	107.8
358	S	23.6	Very low	27.4	Very low	78 Å²	78	131.3 Å²	131.3	55%	0.545	74%	0.737	S	S	.	*				67.7	142.6	67.7	126.5	0	0	0	0	112.7
359	Q	26.1	Very low	27.2	Very low	133 Å²	133	131.9 Å²	131.9	62%	0.621	75%	0.746	S	S	*	*			cis	-166.9	161.7	16.6	-127	172.6	81.8	0	0	110.4
360	R	27.8	Very low	27.1	Very low	194 Å²	194	131.1 Å²	131.1	73%	0.732	74%	0.741	S	S	*	*			trans	63.2	168.1	153.7	-72.4	172.4	144.1	114	-5.1	117.3
361	E	26.8	Very low	27.2	Very low	150 Å²	150	132.5 Å²	132.5	70%	0.701	74%	0.739	S	S	*	*			cis	-138.1	-149	-3.8	-151	123.6	-128.1	0	0	112.9
362	M	23.8	Very low	27	Very low	141 Å²	141	132.2 Å²	132.2	70%	0.695	74%	0.738	S	S	*	*			trans	-107.9	134.2	-159.5	-83.6	-172.7	-73.5	0	0	117.1
363	R	24.6	Very low	27.1	Very low	210 Å²	210	131.1 Å²	131.1	79%	0.792	73%	0.731	S	S	*	*				70.6	149.7	127.9	-153.8	-164	-115.2	127.4	-5.9	120.1
364	I	25.1	Very low	27.2	Very low	134 Å²	134	132.6 Å²	132.6	69%	0.687	74%	0.736	S	S	*	*			trans	105.8	115.1	156.5	-56.1	-175	0	0	0	118.8
365	E	22.8	Very low	27.9	Very low	167 Å²	167	130.6 Å²	130.6	78%	0.78	73%	0.725	S	S	*	*			trans	49.9	110.2	146.2	-65.2	165.8	-150.8	0	0	126.3
366	T	24.7	Very low	27.9	Very low	125 Å²	125	132.3 Å²	132.3	77%	0.767	73%	0.726	S	S	*	*				48	136.1	113.7	-11.9	0	0	0	0	125.1
367	I	25.3	Very low	28.1	Very low	156 Å²	156	138.2 Å²	138.2	80%	0.8	73%	0.732	S	S	*	*			trans	102.5	100.7	151.4	-54.9	-171	0	0	0	120.4
368	A	25.5	Very low	28.4	Very low	96 Å²	96	139.2 Å²	139.2	79%	0.793	73%	0.731	S	S	*	*			trans	49.5	128.5	133.2	0	0	0	0	0	125.8
369	A	24.6	Very low	28.6	Very low	88 Å²	88	144.2 Å²	144.2	73%	0.727	75%	0.745	S	S	*	*				175	120.3	128.2	0	0	0	0	0	108.5
370	S	30	Very low	28.5	Very low	95 Å²	95	143.8 Å²	143.8	66%	0.664	76%	0.757	S	S	*	*			cis	91.8	147.8	45	77.2	0	0	0	0	114.6
371	N	30.2	Very low	28.9	Very low	141 Å²	141	144 Å²	144	75%	0.754	76%	0.764	S	S	*	*			trans	91.9	142.4	171.5	-54.9	-37	0	0	0	117.1
372	T	28.9	Very low	28.9	Very low	122 Å²	122	148.7 Å²	148.7	75%	0.748	78%	0.775	S	S	*	*			cis	-172.1	-175.9	2.7	21.9	0	0	0	0	109.6
373	P	40.4	Very low	29.3	Very low	95 Å²	95	152.6 Å²	152.6	62%	0.617	78%	0.782	S	S	*	*			cis	-145	141.7	-47.4	39.3	-20	0	0	0	118.8
374	T	32	Very low	29.6	Very low	133 Å²	133	147.8 Å²	147.8	82%	0.816	78%	0.781	S	S	*	*			trans	64.7	176.1	134.2	69.8	0	0	0	0	120.7
375	P	44.1	Very low	30	Very low	102 Å²	102	148.6 Å²	148.6	66%	0.662	79%	0.786	S	S	*	*			cis	-139.9	148.1	5.4	37.5	-15.8	0	0	0	121.7
376	I	30	Very low	30.4	Very low	160 Å²	160	148 Å²	148	82%	0.821	79%	0.787	S	S	*	*			trans	67.9	123.8	135.9	-62.5	170.3	0	0	0	118.8
377	R	29.1	Very low	30.5	Very low	229 Å²	229	151.9 Å²	151.9	86%	0.864	79%	0.793	S	S	*	*				-166.1	132.7	74.3	-169.2	168	176	153.1	-2.9	116.7
378	K	30.2	Very low	30.6	Very low	174 Å²	174	150.9 Å²	150.9	76%	0.757	80%	0.795	S	S	*	*			trans	8.7	118.8	153.7	-68.2	-179.2	178.7	-178.5	0	119.7
379	Q	27.7	Very low	30.6	Very low	183 Å²	183	151.5 Å²	151.5	86%	0.855	79%	0.793	S	S	*	*				76.7	123.4	78.3	-80.5	-173	-15.4	0	0	117.8
380	S	26	Very low	30.9	Very low	124 Å²	124	159.3 Å²	159.3	87%	0.867	80%	0.804	S	S	*	*			trans	-166.7	164.1	133.5	-165.3	0	0	0	0	112.1
381	K	35	Very low	30.7	Very low	200 Å²	200	164.8 Å²	164.8	87%	0.87	82%	0.816	S	S	*	*			trans	-135.9	143.2	176.2	-66	179.4	179.7	177.9	0	110.9
382	R	27.8	Very low	30.4	Very low	247 Å²	247	161.4 Å²	161.4	93%	0.932	82%	0.815	S	S	*	*			trans	-160.7	155	145.8	-131.4	172.5	-177.9	-97.9	3.2	114.5
383	R	31.6	Very low	30.3	Very low	223 Å²	223	161.2 Å²	161.2	84%	0.842	82%	0.818	S	S	*	*			trans	-94.7	157.8	170.7	-66.8	173.7	162.1	-136	3.3	110.9
384	S	30.3	Very low	29.6	Very low	110 Å²	110	165.4 Å²	165.4	77%	0.769	83%	0.829	S	S	*	*				-173.1	141.5	121.6	49	0	0	0	0	112.8
385	N	34.7	Very low	29.3	Very low	150 Å²	150	168.5 Å²	168.5	80%	0.802	83%	0.834	S	S	*	*			trans	-73.6	158.4	165.1	-55.7	6	0	0	0	110
386	I	29.3	Very low	28.7	Very low	156 Å²	156	167.2 Å²	167.2	80%	0.8	84%	0.84	S	S	*	*			trans	-153	138.3	148	-113.1	159.7	0	0	0	110
387	F	27.9	Very low	28.5	Very low	205 Å²	205	169.4 Å²	169.4	90%	0.899	84%	0.843	S	S	*	*			trans	-110.8	139.8	166.8	-105.3	-86.2	0	0	0	107.6
388	T	28	Very low	28.3	Very low	136 Å²	136	163.4 Å²	163.4	83%	0.834	84%	0.837	S	S	*	*			trans	-134.1	140.4	159.6	47.4	0	0	0	0	109.2
389	S	24.7	Very low	28.2	Very low	108 Å²	108	161.5 Å²	161.5	76%	0.755	84%	0.839	S	S	*	*			trans	-127.4	143.2	-176.8	169.8	0	0	0	0	109.8
390	R	30.2	Very low	28.3	Very low	252 Å²	252	159.4 Å²	159.4	95%	0.951	83%	0.834	S	S	*	*			trans	-160.3	169.9	149.4	-107.9	159.2	-161.7	-145.6	2.1	110.7
391	K	26.7	Very low	28.3	Very low	210 Å²	210	159.1 Å²	159.1	91%	0.913	83%	0.832	S	S	*	*			trans	-138.1	140.1	-145.3	175.3	-175.5	178.2	-177.7	0	110.9
392	G	24.3	Very low	28	Very low	71 Å²	71	157.1 Å²	157.1	73%	0.732	82%	0.823	S	S	*	*			trans	-176.7	123.9	173.9	0	0	0	0	0	113.2
393	S	25.8	Very low	28	Very low	117 Å²	117	151.8 Å²	151.8	82%	0.818	82%	0.818	S	S	*	*			trans	-39.9	163.9	173.2	49.1	0	0	0	0	118.3
394	E	27	Very low	27.7	Very low	183 Å²	183	147.2 Å²	147.2	86%	0.855	81%	0.811	S	S	*	*			cis	176.8	137.1	-21.1	-173.1	176.9	-105.3	0	0	107.2
395	Q	25.8	Very low	27.5	Very low	198 Å²	198	147.1 Å²	147.1	93%	0.925	81%	0.81	S	S	*	*			trans	176.6	135	149.9	-103.1	172.3	30.2	0	0	109.6
396	G	30.1	Very low	27.3	Very low	75 Å²	75	148.8 Å²	148.8	77%	0.773	82%	0.817	S	S	*	*			trans	-101.1	171	-165	0	0	0	0	0	116.6
397	K	27.2	Very low	27.5	Very low	206 Å²	206	144.8 Å²	144.8	90%	0.896	82%	0.815	S	S	*	*			trans	-158.5	174.3	159.3	-114.3	163.2	-172	176.7	0	111.2
398	S	24.6	Very low	27.6	Very low	104 Å²	104	140.8 Å²	140.8	73%	0.727	81%	0.812	S	S	*	*			trans	-52.5	145.4	-167.3	44	0	0	0	0	115.2
399	V	27.5	Very low	28.2	Very low	133 Å²	133	137.2 Å²	137.2	81%	0.806	80%	0.802	S	S	*	*			trans	-109.8	104.2	167.8	175.3	0	0	0	0	108.1
400	D	28.9	Very low	29.9	Very low	139 Å²	139	137.1 Å²	137.1	74%	0.743	79%	0.785	S	S	*	*			trans	-81	142.2	161.3	-72.4	-68	0	0	0	109.6	K402	D400-K402 PolarHBondContact O-N 2.8Å
401	S	26.2	Very low	31.3	Very low	118 Å²	118	127.8 Å²	127.8	83%	0.825	76%	0.762	S	S	*	*			trans	-80.6	90.8	-170.7	-67.6	0	0	0	0	112.4	T403	S401-T403 PolarHBondContact O-N 2.82Å
402	K	28.7	Very low	33.6	Very low	158 Å²	158	124.7 Å²	124.7	69%	0.687	75%	0.754	S	S	*	*			trans	-64.7	121.3	164.3	-82.1	169.3	126.6	-88.6	0	111	D400 D404	D400-K402 PolarHBondContact O-N 2.8Å; K402-D404 IonicContact NZ-OD1 3.83Å; K402-D404 PolarHBondContact NZ-OD1 3.32Å; K402-D404 IonicContact NZ-OD2 3.23Å; K402-D404 PolarHBondContact NZ-OD2 2.8Å
403	T	28.4	Very low	36.3	Very low	135 Å²	135	122.1 Å²	122.1	83%	0.828	72%	0.724	S	S	*	*			trans	-90.8	88	153.5	50.9	0	0	0	0	109.1	S401 S405	S401-T403 PolarHBondContact O-N 2.82Å; T403-S405 PolarHBondContact O-N 2.97Å; T403-S405 VanDerWaalsContact O-N 3.14Å
404	D	25.7	Very low	39.1	Very low	128 Å²	128	121.3 Å²	121.3	68%	0.684	71%	0.71	S	S	*	*			trans	-74.1	102.7	175	-83.8	-35.4	0	0	0	110.6	K402	K402-D404 IonicContact NZ-OD1 3.83Å; K402-D404 PolarHBondContact NZ-OD1 3.32Å; K402-D404 IonicContact NZ-OD2 3.23Å; K402-D404 PolarHBondContact NZ-OD2 2.8Å
405	S	25.2	Very low	42.1	Very low	108 Å²	108	115 Å²	115	76%	0.755	68%	0.679	S	S	*	*			trans	-118.7	112.1	164.8	-74.7	0	0	0	0	109.5	T403 G407	T403-S405 PolarHBondContact O-N 2.97Å; T403-S405 VanDerWaalsContact O-N 3.14Å; S405-G407 PolarHBondContact O-N 3.07Å
406	I	31.1	Very low	45.3	Very low	184 Å²	184	110.5 Å²	110.5	94%	0.944	66%	0.658	S	S	*	*	S	Bend	trans	-23.8	119.2	-179.7	-63.2	161.6	0	0	0	114.1
407	G	32.7	Very low	48.2	Very low	73 Å²	73	107.7 Å²	107.7	75%	0.753	63%	0.629	S	S	*	*			trans	129.1	-1.1	164.5	0	0	0	0	0	117.3	S405 G409	S405-G407 PolarHBondContact O-N 3.07Å; G407-G409 PolarHBondContact O-N 2.99Å
408	S	30.3	Very low	51.3	Low	120 Å²	120	102.6 Å²	102.6	84%	0.839	61%	0.611	S	S	*	*			trans	-62.1	106.8	-178.5	-167.4	0	0	0	0	112.5
409	G	40.7	Very low	54.5	Low	61 Å²	61	97.7 Å²	97.7	63%	0.629	58%	0.577	S	S	*	*	P	Polyproline II helix	trans	-59.9	158.4	156.7	0	0	0	0	0	110.6	G407	G407-G409 PolarHBondContact O-N 2.99Å
410	R	60.9	Low	57.6	Low	106 Å²	106	93.8 Å²	93.8	40%	0.4	55%	0.551	S	S	.	*	P	Polyproline II helix	trans	-76.3	148.4	170.6	-69.2	154.6	173.2	-94.3	-6.3	109.1	I412 Y453 M454	R410-I412 PolarHBondContact O-N 3.48Å; R410-Y453 PolarHBondContact NH1-O 2.83Å; R410-Y453 PolarHBondContact NH2-O 3.2Å; R410-M454 PolarHBondContact NH2-O 3.15Å
411	A	60.5	Low	60.5	Low	57 Å²	57	88.4 Å²	88.4	47%	0.471	52%	0.521	S	S	.	.	P	Polyproline II helix	trans	-52.7	133.6	163.5	0	0	0	0	0	109.2	P413	A411-P413 WeakPolarHBondContact O-CD 3.44Å
412	I	74.1	Confident	63.5	Low	144 Å²	144	85.2 Å²	85.2	74%	0.738	49%	0.491	S	S	*	.	P	Polyproline II helix	trans	-76.4	119.3	-176.7	-60.2	175.5	0	0	0	107.6	R410 I414	R410-I412 PolarHBondContact O-N 3.48Å; I412-I414 PolarHBondContact O-N 3.03Å
413	P	81.4	Confident	65.7	Low	17 Å²	17	79.7 Å²	79.7	11%	0.11	47%	0.472	C	S	.	.	P	Polyproline II helix	trans	-67.5	129.3	-180	-19.8	33.2	0	0	0	111.1	A411 K415 Q416 T437 L438	A411-P413 WeakPolarHBondContact O-CD 3.44Å; P413-K415 PolarHBondContact O-N 3.27Å; P413-Q416 HydrophobicContact CB-CB 4.22Å; P413-T437 HydrophobicContact CB-CG2 4.11Å; P413-T437 HydrophobicContact CG-CG2 3.79Å; P413-L438 CarbonylContact C-O 3.55Å; P413-L438 VanDerWaalsContact CA-O 3.26Å; P413-L438 WeakPolarHBondContact CA-O 3.24Å; P413-L438 WeakPolarHBondContact CB-O 3.41Å
414	I	85.3	Confident	67.3	Low	100 Å²	100	77 Å²	77	51%	0.513	47%	0.471	S	S	.	.	S	Bend	trans	-56	-38	171.5	-68.5	176.5	0	0	0	110.6	I412 L438 D440	I412-I414 PolarHBondContact O-N 3.03Å; I414-L438 PolarHBondContact N-O 2.75Å; I414-D440 HydrophobicContact CD1-CB 3.85Å; I414-D440 HydrophobicContact CG1-CB 4.3Å
415	K	89.4	Confident	68.6	Low	50 Å²	50	81 Å²	81	22%	0.217	48%	0.482	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	137	174.4	-164	176.5	178.9	79.4	0	110.7	P413 T437 L438 L640 W641 A644	P413-K415 PolarHBondContact O-N 3.27Å; K415-T437 WeakPolarHBondContact O-CA 3.44Å; K415-L438 HydrophobicContact CB-CB 4.22Å; K415-L438 HydrophobicContact CB-CD2 4.32Å; K415-L438 PolarHBondContact N-O 3.49Å; K415-L438 PolarHBondContact O-N 3.31Å; K415-L640 VanDerWaalsContact CE-O 3.25Å; K415-L640 WeakPolarHBondContact CE-O 3.45Å; K415-L640 PolarHBondContact NZ-O 3.2Å; K415-W641 HydrophobicContact CB-CH2 4.28Å; K415-W641 HydrophobicContact CB-CZ3 4.08Å; K415-W641 HydrophobicContact CD-CD2 3.71Å; K415-W641 HydrophobicContact CD-CE3 3.63Å; K415-W641 HydrophobicContact CD-CG 4.25Å; K415-W641 HydrophobicContact CD-CH2 4.29Å; K415-W641 HydrophobicContact CD-CZ2 4.37Å; K415-W641 HydrophobicContact CD-CZ3 3.93Å; K415-W641 VanDerWaalsContact CE-CD2 3.44Å; K415-W641 HydrophobicContact CG-CD2 4.36Å; K415-W641 HydrophobicContact CG-CE3 4.15Å; K415-W641 HydrophobicContact CG-CH2 3.91Å; K415-W641 HydrophobicContact CG-CZ2 4.12Å; K415-W641 HydrophobicContact CG-CZ3 3.92Å; K415-A644 HydrophobicContact CB-CB 4.46Å; K415-A644 HydrophobicContact CD-CB 3.62Å
416	Q	92.3	Very high	69.7	Low	104 Å²	104	78 Å²	78	49%	0.486	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	144.9	179.1	59.4	-173.7	-9.8	0	0	111.4	P413 Y435 V436 T437	P413-Q416 HydrophobicContact CB-CB 4.22Å; Q416-Y435 PolarHBondContact OE1-OH 3.07Å; Q416-V436 VanDerWaalsContact CA-O 3.28Å; Q416-V436 WeakPolarHBondContact CA-O 3.22Å; Q416-T437 HydrophobicContact CB-CG2 3.82Å
417	G	91.6	Very high	70.6	Confident	16 Å²	16	78.2 Å²	78.2	17%	0.165	46%	0.464	C	S	.	.	E	Extended strand (participates in β ladder)	trans	176.8	-166.5	-176.7	0	0	0	0	0	114.1	Y435 V436	G417-Y435 WeakPolarHBondContact O-CA 3.34Å; G417-Y435 WeakPolarHBondContact O-CD2 3.37Å; G417-V436 PolarHBondContact N-O 3.44Å; G417-V436 PolarHBondContact O-N 3.26Å
418	I	92.1	Very high	71.6	Confident	99 Å²	99	81 Å²	81	51%	0.508	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	110.4	-178.4	-59.7	176.9	0	0	0	110.1	K433 K434 Y435	I418-K433 HydrophobicContact CG2-CB 4.01Å; I418-K433 HydrophobicContact CG2-CD 4.14Å; I418-K433 HydrophobicContact CG2-CG 4.26Å; I418-K434 WeakPolarHBondContact CA-O 3.36Å; I418-Y435 HydrophobicContact CG1-CD2 4.17Å
419	L	92.3	Very high	73.1	Confident	1 Å²	1	83.2 Å²	83.2	1%	0.005	46%	0.456	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	151	175.4	-66.8	174.6	0	0	0	111.3	K433 K434 V436 F618 F630 A632 W641	L419-K433 CarbonylContact O-C 3.45Å; L419-K433 WeakPolarHBondContact O-CA 3.37Å; L419-K434 PolarHBondContact N-O 2.97Å; L419-K434 PolarHBondContact O-N 2.87Å; L419-V436 HydrophobicContact CB-CG2 3.97Å; L419-V436 HydrophobicContact CD1-CB 4.27Å; L419-V436 HydrophobicContact CD1-CG1 4.34Å; L419-V436 HydrophobicContact CD1-CG2 4.08Å; L419-V436 HydrophobicContact CG-CG2 4.27Å; L419-F618 HydrophobicContact CD1-CE1 4.06Å; L419-F618 HydrophobicContact CD1-CZ 3.71Å; L419-F618 HydrophobicContact CD2-CE1 4.3Å; L419-F630 HydrophobicContact CB-CD1 3.99Å; L419-F630 HydrophobicContact CD1-CB 4.31Å; L419-F630 HydrophobicContact CD1-CD1 4.05Å; L419-F630 HydrophobicContact CD1-CG 4.35Å; L419-A632 HydrophobicContact CD2-CB 3.87Å; L419-W641 HydrophobicContact CD1-CD2 3.99Å; L419-W641 HydrophobicContact CD1-CE3 4.38Å; L419-W641 HydrophobicContact CD1-CG 4.27Å; L419-W641 HydrophobicContact CD1-CZ2 4.41Å; L419-W641 HydrophobicContact CD2-CG 4.34Å
420	L	91.1	Very high	75	Confident	51 Å²	51	85 Å²	85	27%	0.267	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	130.3	165.2	-72.7	167.5	0	0	0	108.5	W431 K433 F630 E631	L420-W431 HydrophobicContact CB-CE3 4.03Å; L420-W431 HydrophobicContact CD2-CB 4.43Å; L420-K433 HydrophobicContact CD2-CB 4.49Å; L420-K433 HydrophobicContact CD2-CG 3.58Å; L420-K433 HydrophobicContact CG-CG 4.47Å; L420-F630 CarbonylContact O-C 3.46Å; L420-F630 VanDerWaalsContact O-CA 3.23Å; L420-F630 WeakPolarHBondContact O-CA 3.49Å; L420-E631 HydrophobicContact CB-CB 3.93Å; L420-E631 HydrophobicContact CB-CG 4.23Å; L420-E631 HydrophobicContact CD1-CG 4.14Å; L420-E631 VanDerWaalsContact CD1-OE2 3.27Å; L420-E631 WeakPolarHBondContact CD1-OE2 3.14Å; L420-E631 PolarHBondContact N-O 3.06Å; L420-E631 PolarHBondContact O-N 2.97Å
421	K	91.6	Very high	76.1	Confident	26 Å²	26	83.4 Å²	83.4	11%	0.113	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	122.7	-177.7	-157.4	-77.9	159.2	-160.1	0	109.9	K432 K434 Y446 F630	K421-K432 PolarHBondContact N-O 3.36Å; K421-K432 PolarHBondContact O-N 2.63Å; K421-K434 HydrophobicContact CB-CB 4.45Å; K421-K434 HydrophobicContact CB-CG 3.71Å; K421-K434 HydrophobicContact CG-CG 4.45Å; K421-Y446 HydrophobicContact CD-CE2 4.4Å; K421-Y446 HydrophobicContact CG-CE2 4.48Å; K421-F630 HydrophobicContact CB-CD1 4.04Å; K421-F630 HydrophobicContact CB-CE1 4Å; K421-F630 HydrophobicContact CG-CD1 3.71Å; K421-F630 HydrophobicContact CG-CE1 3.37Å; K421-F630 HydrophobicContact CG-CG 4.5Å; K421-F630 HydrophobicContact CG-CZ 3.91Å
422	R	87.4	Confident	77.5	Confident	51 Å²	51	84.9 Å²	84.9	19%	0.192	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	132.5	-179.1	-155.3	160	63.9	-148.7	-5.8	111.9	K429 W431 E617 N629	R422-K429 HydrophobicContact CG-CB 4.47Å; R422-W431 HydrophobicContact CB-CD2 3.96Å; R422-W431 HydrophobicContact CB-CE3 3.64Å; R422-W431 HydrophobicContact CB-CH2 3.99Å; R422-W431 HydrophobicContact CB-CZ2 4.3Å; R422-W431 HydrophobicContact CB-CZ3 3.66Å; R422-W431 HydrophobicContact CG-CD2 4.15Å; R422-W431 HydrophobicContact CG-CE3 4.34Å; R422-W431 HydrophobicContact CG-CZ2 4.49Å; R422-E617 IonicContact CZ-OE1 2.78Å; R422-E617 IonicContact CZ-OE2 2.72Å; R422-E617 VanDerWaalsContact NH1-CD 3.34Å; R422-E617 IonicContact NH1-OE1 3.97Å; R422-E617 PolarHBondContact NH1-OE1 3.28Å; R422-E617 IonicContact NH1-OE2 3.55Å; R422-E617 PolarHBondContact NH1-OE2 2.77Å; R422-E617 IonicContact NH2-OE1 3.76Å; R422-E617 PolarHBondContact NH2-OE1 3.16Å; R422-E617 IonicContact NH2-OE2 3.3Å; R422-N629 HydrophobicContact CB-CB 3.91Å; R422-N629 PolarHBondContact N-O 3.06Å; R422-N629 VanDerWaalsContact N-O 3.13Å; R422-N629 PolarHBondContact NH2-ND2 3.34Å
423	S	75.2	Confident	78.3	Confident	42 Å²	42	85.1 Å²	85.1	29%	0.294	43%	0.433	S	S	.	.			trans	-70.1	128.3	173.7	175.6	0	0	0	0	111.5	S426 E430	S423-S426 WeakPolarHBondContact CB-OG 3.43Å; S423-S426 PolarHBondContact OG-OG 3.14Å; S423-E430 PolarHBondContact N-O 3.31Å
424	G	62.4	Low	78.8	Confident	78 Å²	78	86.5 Å²	86.5	80%	0.804	44%	0.438	S	S	*	.	S	Bend	trans	-98.7	5.8	175.8	0	0	0	0	0	114.7
425	K	53.8	Low	79.2	Confident	212 Å²	212	83.1 Å²	83.1	92%	0.922	42%	0.419	S	S	*	.	S	Bend	trans	-122.9	12	-177.9	-69.3	-161.2	175	-164.8	0	114.1
426	S	48.5	Very low	79.4	Confident	47 Å²	47	80.8 Å²	80.8	33%	0.329	41%	0.408	S	S	.	.	S	Bend	trans	-124.3	134.1	-176.9	50.8	0	0	0	0	111.1	S423 N428	S423-S426 WeakPolarHBondContact CB-OG 3.43Å; S423-S426 PolarHBondContact OG-OG 3.14Å; S426-N428 CarbonylContact C-O 3.6Å; S426-N428 WeakPolarHBondContact CB-O 3.18Å; S426-N428 CarbonylContact O-C 3.56Å; S426-N428 PolarHBondContact O-N 3.14Å; S426-N428 PolarHBondContact OG-O 3.38Å
427	L	49.7	Very low	79.3	Confident	187 Å²	187	75.9 Å²	75.9	98%	0.979	39%	0.385	S	S	*	.	S	Bend	trans	-57.5	-28.3	176.9	-71.6	163.1	0	0	0	112.5
428	N	53.9	Low	79.3	Confident	132 Å²	132	75.1 Å²	75.1	71%	0.706	38%	0.378	S	S	*	.	S	Bend	trans	-91.1	126.4	164.8	-62.3	-19.5	0	0	0	109.5	S426 E430	S426-N428 CarbonylContact C-O 3.6Å; S426-N428 WeakPolarHBondContact CB-O 3.18Å; S426-N428 CarbonylContact O-C 3.56Å; S426-N428 PolarHBondContact O-N 3.14Å; S426-N428 PolarHBondContact OG-O 3.38Å; N428-E430 PolarHBondContact O-N 3.37Å
429	K	62	Low	79	Confident	166 Å²	166	71.1 Å²	71.1	72%	0.722	36%	0.359	S	S	*	.			trans	-73.5	64.4	177.2	-68.4	-177.2	-178	176.9	0	112	R422	R422-K429 HydrophobicContact CG-CB 4.47Å
430	E	80	Confident	78.4	Confident	99 Å²	99	75.9 Å²	75.9	46%	0.463	38%	0.384	S	S	.	.			trans	-78.4	123.5	-175.4	-160.5	-175.7	168.1	0	0	111.8	S423 N428 K432	S423-E430 PolarHBondContact N-O 3.31Å; N428-E430 PolarHBondContact O-N 3.37Å; E430-K432 WeakPolarHBondContact OE1-CE 3.39Å; E430-K432 IonicContact OE1-NZ 2.92Å; E430-K432 PolarHBondContact OE1-NZ 2.88Å; E430-K432 VanDerWaalsContact OE1-NZ 3.11Å; E430-K432 WeakPolarHBondContact OE2-CE 3.48Å; E430-K432 IonicContact OE2-NZ 2.68Å; E430-K432 PolarHBondContact OE2-NZ 2.79Å
431	W	84.1	Confident	77.8	Confident	73 Å²	73	78.6 Å²	78.6	28%	0.277	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	136.6	168.9	-70	111.1	0	0	0	110.7	L420 R422 E617 N629 E631	L420-W431 HydrophobicContact CB-CE3 4.03Å; L420-W431 HydrophobicContact CD2-CB 4.43Å; R422-W431 HydrophobicContact CB-CD2 3.96Å; R422-W431 HydrophobicContact CB-CE3 3.64Å; R422-W431 HydrophobicContact CB-CH2 3.99Å; R422-W431 HydrophobicContact CB-CZ2 4.3Å; R422-W431 HydrophobicContact CB-CZ3 3.66Å; R422-W431 HydrophobicContact CG-CD2 4.15Å; R422-W431 HydrophobicContact CG-CE3 4.34Å; R422-W431 HydrophobicContact CG-CZ2 4.49Å; W431-E617 HydrophobicContact CH2-CB 4.46Å; W431-E617 HydrophobicContact CH2-CG 4.02Å; W431-N629 HydrophobicContact CH2-CB 4.14Å; W431-N629 HydrophobicContact CZ3-CB 4.38Å; W431-E631 VanDerWaalsContact CD2-OE2 3.28Å; W431-E631 HydrophobicContact CE3-CB 4.09Å; W431-E631 HydrophobicContact CH2-CB 3.68Å; W431-E631 HydrophobicContact CZ2-CB 4.21Å; W431-E631 HydrophobicContact CZ3-CB 3.6Å
432	K	88.6	Confident	77.4	Confident	88 Å²	88	77.5 Å²	77.5	38%	0.383	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	132.8	178.6	-59.2	-167.6	-177.7	-161.6	0	111	K421 E430 K434	K421-K432 PolarHBondContact N-O 3.36Å; K421-K432 PolarHBondContact O-N 2.63Å; E430-K432 WeakPolarHBondContact OE1-CE 3.39Å; E430-K432 IonicContact OE1-NZ 2.92Å; E430-K432 PolarHBondContact OE1-NZ 2.88Å; E430-K432 VanDerWaalsContact OE1-NZ 3.11Å; E430-K432 WeakPolarHBondContact OE2-CE 3.48Å; E430-K432 IonicContact OE2-NZ 2.68Å; E430-K432 PolarHBondContact OE2-NZ 2.79Å; K432-K434 PolarHBondContact O-N 3.03Å
433	K	91.4	Very high	77.4	Confident	148 Å²	148	76.4 Å²	76.4	64%	0.643	39%	0.394	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-57.3	137.7	173	-66.1	-167.2	176.4	-159.6	0	110.1	I418 L419 L420	I418-K433 HydrophobicContact CG2-CB 4.01Å; I418-K433 HydrophobicContact CG2-CD 4.14Å; I418-K433 HydrophobicContact CG2-CG 4.26Å; L419-K433 CarbonylContact O-C 3.45Å; L419-K433 WeakPolarHBondContact O-CA 3.37Å; L420-K433 HydrophobicContact CD2-CB 4.49Å; L420-K433 HydrophobicContact CD2-CG 3.58Å; L420-K433 HydrophobicContact CG-CG 4.47Å
434	K	93	Very high	78.2	Confident	47 Å²	47	74.5 Å²	74.5	20%	0.204	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	142	174	-64.4	-63.3	159.7	-153.6	0	109.1	I418 L419 K421 K432 V436 Y446 H447	I418-K434 WeakPolarHBondContact CA-O 3.36Å; L419-K434 PolarHBondContact N-O 2.97Å; L419-K434 PolarHBondContact O-N 2.87Å; K421-K434 HydrophobicContact CB-CB 4.45Å; K421-K434 HydrophobicContact CB-CG 3.71Å; K421-K434 HydrophobicContact CG-CG 4.45Å; K432-K434 PolarHBondContact O-N 3.03Å; K434-V436 HydrophobicContact CB-CG2 4.22Å; K434-Y446 HydrophobicContact CD-CD2 4.33Å; K434-Y446 HydrophobicContact CG-CD2 4.13Å; K434-H447 WeakPolarHBondContact CA-O 3.44Å; K434-H447 WeakPolarHBondContact CB-O 3.28Å; K434-H447 WeakPolarHBondContact CD-O 3.5Å
435	Y	92.3	Very high	79.6	Confident	29 Å²	29	71.4 Å²	71.4	11%	0.114	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	123.2	166.8	-172.2	-104.9	0	0	0	107.6	Q416 G417 I418 T437 Y446 H447 L450 Y453	Q416-Y435 PolarHBondContact OE1-OH 3.07Å; G417-Y435 WeakPolarHBondContact O-CA 3.34Å; G417-Y435 WeakPolarHBondContact O-CD2 3.37Å; I418-Y435 HydrophobicContact CG1-CD2 4.17Å; Y435-T437 HydrophobicContact CD1-CG2 4.15Å; Y435-T437 HydrophobicContact CE1-CG2 3.54Å; Y435-Y446 CarbonylContact O-C 3.51Å; Y435-Y446 WeakPolarHBondContact O-CA 3.38Å; Y435-H447 PolarHBondContact N-O 3.36Å; Y435-H447 PolarHBondContact O-N 2.83Å; Y435-L450 HydrophobicContact CD1-CD1 4.21Å; Y435-L450 HydrophobicContact CD2-CB 4.28Å; Y435-L450 HydrophobicContact CD2-CD1 4.29Å; Y435-L450 HydrophobicContact CE1-CD1 3.73Å; Y435-L450 HydrophobicContact CE2-CD1 3.85Å; Y435-L450 HydrophobicContact CG-CB 4.36Å; Y435-L450 HydrophobicContact CG-CD1 4.45Å; Y435-Y453 HydrophobicContact CD1-CD1 4.01Å; Y435-Y453 HydrophobicContact CD1-CD2 4.49Å; Y435-Y453 AromaticContact CD1-CG 3.83Å; Y435-Y453 HydrophobicContact CD1-CG 3.83Å; Y435-Y453 AromaticContact CE1-CD1 3.49Å; Y435-Y453 HydrophobicContact CE1-CD1 3.49Å; Y435-Y453 VanDerWaalsContact CE1-CD1 3.49Å; Y435-Y453 HydrophobicContact CE1-CD2 4.43Å; Y435-Y453 AromaticContact CE1-CE1 3.92Å; Y435-Y453 HydrophobicContact CE1-CE1 3.92Å; Y435-Y453 AromaticContact CE1-CG 3.77Å; Y435-Y453 HydrophobicContact CE1-CG 3.77Å
436	V	93.7	Very high	81.5	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	136.9	-173.1	-175	0	0	0	0	109	Q416 G417 L419 K434 L444 T445 F630 W641	Q416-V436 VanDerWaalsContact CA-O 3.28Å; Q416-V436 WeakPolarHBondContact CA-O 3.22Å; G417-V436 PolarHBondContact N-O 3.44Å; G417-V436 PolarHBondContact O-N 3.26Å; L419-V436 HydrophobicContact CB-CG2 3.97Å; L419-V436 HydrophobicContact CD1-CB 4.27Å; L419-V436 HydrophobicContact CD1-CG1 4.34Å; L419-V436 HydrophobicContact CD1-CG2 4.08Å; L419-V436 HydrophobicContact CG-CG2 4.27Å; K434-V436 HydrophobicContact CB-CG2 4.22Å; V436-L444 HydrophobicContact CG1-CD1 4.06Å; V436-L444 HydrophobicContact CG1-CD2 3.8Å; V436-L444 HydrophobicContact CG1-CG 3.91Å; V436-T445 WeakPolarHBondContact CA-O 3.43Å; V436-F630 HydrophobicContact CG2-CE1 4.08Å; V436-W641 HydrophobicContact CB-CH2 4.15Å; V436-W641 HydrophobicContact CG1-CH2 4.1Å; V436-W641 HydrophobicContact CG1-CZ3 4.14Å
437	T	91.6	Very high	83.5	Confident	1 Å²	1	60.8 Å²	60.8	1%	0.006	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	122.8	-178.1	41.8	0	0	0	0	109.5	P413 K415 Q416 Y435 T445 Y453	P413-T437 HydrophobicContact CB-CG2 4.11Å; P413-T437 HydrophobicContact CG-CG2 3.79Å; K415-T437 WeakPolarHBondContact O-CA 3.44Å; Q416-T437 HydrophobicContact CB-CG2 3.82Å; Y435-T437 HydrophobicContact CD1-CG2 4.15Å; Y435-T437 HydrophobicContact CE1-CG2 3.54Å; T437-T445 PolarHBondContact N-O 3.19Å; T437-T445 PolarHBondContact O-N 3.46Å; T437-T445 PolarHBondContact OG1-O 2.73Å; T437-T445 PolarHBondContact OG1-OG1 3.41Å; T437-Y453 HydrophobicContact CG2-CD2 4.42Å; T437-Y453 HydrophobicContact CG2-CE1 4.44Å; T437-Y453 HydrophobicContact CG2-CE2 3.96Å
438	L	91	Very high	85.4	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	124.6	174.4	175.2	65.2	0	0	0	108.8	P413 I414 K415 L444 L464 W641 A644 I645 Q648	P413-L438 CarbonylContact C-O 3.55Å; P413-L438 VanDerWaalsContact CA-O 3.26Å; P413-L438 WeakPolarHBondContact CA-O 3.24Å; P413-L438 WeakPolarHBondContact CB-O 3.41Å; I414-L438 PolarHBondContact N-O 2.75Å; K415-L438 HydrophobicContact CB-CB 4.22Å; K415-L438 HydrophobicContact CB-CD2 4.32Å; K415-L438 PolarHBondContact N-O 3.49Å; K415-L438 PolarHBondContact O-N 3.31Å; L438-L444 HydrophobicContact CB-CD1 4.48Å; L438-L444 HydrophobicContact CD1-CB 4.12Å; L438-L444 HydrophobicContact CD1-CD1 4.28Å; L438-L464 HydrophobicContact CD1-CD1 3.39Å; L438-W641 HydrophobicContact CB-CZ3 4.32Å; L438-A644 HydrophobicContact CD2-CB 3.86Å; L438-A644 WeakPolarHBondContact CD2-O 3.34Å; L438-I645 HydrophobicContact CD2-CG1 4.27Å; L438-Q648 HydrophobicContact CD1-CB 4.07Å; L438-Q648 HydrophobicContact CD1-CG 3.95Å; L438-Q648 HydrophobicContact CD2-CB 4.24Å; L438-Q648 HydrophobicContact CG-CB 4.47Å
439	C	85.9	Confident	86.9	Confident	16 Å²	16	50.1 Å²	50.1	11%	0.108	24%	0.244	C	C	.	.			trans	-108.2	157	-179.6	-63.9	0	0	0	0	112.5	N441 G442 V443	C439-N441 VanDerWaalsContact C-N 3.25Å; C439-N441 WeakPolarHBondContact CB-OD1 3.29Å; C439-N441 PolarHBondContact O-N 2.78Å; C439-G442 PolarHBondContact O-N 2.99Å; C439-V443 PolarHBondContact N-O 3.26Å
440	D	79.9	Confident	87.8	Confident	100 Å²	100	46.3 Å²	46.3	54%	0.535	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-28.2	176.3	61	-24.2	0	0	0	114.3	I414 G442 Q648	I414-D440 HydrophobicContact CD1-CB 3.85Å; I414-D440 HydrophobicContact CG1-CB 4.3Å; D440-G442 PolarHBondContact O-N 3.26Å; D440-G442 VanDerWaalsContact O-N 3.14Å; D440-Q648 PolarHBondContact O-NE2 2.9Å
441	N	77.3	Confident	88	Confident	108 Å²	108	47.1 Å²	47.1	58%	0.578	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.9	7.4	174.2	73	-8.3	0	0	0	114.9	C439 V443	C439-N441 VanDerWaalsContact C-N 3.25Å; C439-N441 WeakPolarHBondContact CB-OD1 3.29Å; C439-N441 PolarHBondContact O-N 2.78Å; N441-V443 WeakPolarHBondContact OD1-CB 3.26Å; N441-V443 WeakPolarHBondContact OD1-CG2 3.43Å; N441-V443 PolarHBondContact OD1-N 2.95Å
442	G	82.9	Confident	88	Confident	3 Å²	3	45.1 Å²	45.1	3%	0.031	23%	0.229	C	C	.	.	S	Bend	trans	79.7	11.8	-179.9	0	0	0	0	0	115	C439 D440 L464 S652	C439-G442 PolarHBondContact O-N 2.99Å; D440-G442 PolarHBondContact O-N 3.26Å; D440-G442 VanDerWaalsContact O-N 3.14Å; G442-L464 WeakPolarHBondContact O-CB 3.5Å; G442-L464 WeakPolarHBondContact O-CG 3.47Å; G442-L464 PolarHBondContact O-N 3.38Å; G442-S652 WeakPolarHBondContact CA-OG 3.48Å
443	V	88.7	Confident	87.7	Confident	29 Å²	29	42.2 Å²	42.2	18%	0.176	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	127.9	178.8	-171.9	0	0	0	0	110.9	C439 N441 T445 E461	C439-V443 PolarHBondContact N-O 3.26Å; N441-V443 WeakPolarHBondContact OD1-CB 3.26Å; N441-V443 WeakPolarHBondContact OD1-CG2 3.43Å; N441-V443 PolarHBondContact OD1-N 2.95Å; V443-T445 HydrophobicContact CG1-CG2 3.69Å; V443-E461 HydrophobicContact CG1-CB 3.9Å
444	L	92.3	Very high	87.2	Confident	1 Å²	1	41 Å²	41	1%	0.005	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	119.3	166.6	-178.6	143.5	0	0	0	109.5	V436 L438 I462 L464 I620 F630 I645	V436-L444 HydrophobicContact CG1-CD1 4.06Å; V436-L444 HydrophobicContact CG1-CD2 3.8Å; V436-L444 HydrophobicContact CG1-CG 3.91Å; L438-L444 HydrophobicContact CB-CD1 4.48Å; L438-L444 HydrophobicContact CD1-CB 4.12Å; L438-L444 HydrophobicContact CD1-CD1 4.28Å; L444-I462 HydrophobicContact CD2-CD1 3.95Å; L444-I462 PolarHBondContact N-O 3.38Å; L444-I462 PolarHBondContact O-N 3.07Å; L444-L464 HydrophobicContact CB-CD1 4.16Å; L444-L464 HydrophobicContact CB-CD2 4.05Å; L444-L464 HydrophobicContact CB-CG 4.2Å; L444-I620 HydrophobicContact CD1-CD1 4.33Å; L444-I620 HydrophobicContact CD2-CD1 4.28Å; L444-F630 HydrophobicContact CD2-CZ 4.29Å; L444-I645 HydrophobicContact CD1-CD1 3.6Å; L444-I645 HydrophobicContact CD1-CG1 3.76Å
445	T	91.9	Very high	86.4	Confident	14 Å²	14	44.3 Å²	44.3	9%	0.086	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	148.8	179.4	77.3	0	0	0	0	112	V436 T437 V443 K460 E461	V436-T445 WeakPolarHBondContact CA-O 3.43Å; T437-T445 PolarHBondContact N-O 3.19Å; T437-T445 PolarHBondContact O-N 3.46Å; T437-T445 PolarHBondContact OG1-O 2.73Å; T437-T445 PolarHBondContact OG1-OG1 3.41Å; V443-T445 HydrophobicContact CG1-CG2 3.69Å; T445-K460 CarbonylContact C-O 3.57Å; T445-K460 WeakPolarHBondContact CA-O 3.5Å; T445-E461 HydrophobicContact CG2-CB 4.13Å; T445-E461 HydrophobicContact CG2-CG 3.74Å
446	Y	92.7	Very high	85.6	Confident	28 Å²	28	48.7 Å²	48.7	11%	0.11	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	133.4	-179.9	68.8	-86.8	0	0	0	113	K421 K434 Y435 K460 I462 F630	K421-Y446 HydrophobicContact CD-CE2 4.4Å; K421-Y446 HydrophobicContact CG-CE2 4.48Å; K434-Y446 HydrophobicContact CD-CD2 4.33Å; K434-Y446 HydrophobicContact CG-CD2 4.13Å; Y435-Y446 CarbonylContact O-C 3.51Å; Y435-Y446 WeakPolarHBondContact O-CA 3.38Å; Y446-K460 HydrophobicContact CD1-CB 4.08Å; Y446-K460 WeakPolarHBondContact CD1-O 3.25Å; Y446-K460 HydrophobicContact CD2-CB 4.38Å; Y446-K460 HydrophobicContact CE1-CB 3.65Å; Y446-K460 HydrophobicContact CE2-CB 3.99Å; Y446-K460 HydrophobicContact CE2-CD 4.09Å; Y446-K460 HydrophobicContact CE2-CG 4.5Å; Y446-K460 HydrophobicContact CG-CB 4.43Å; Y446-K460 PolarHBondContact N-O 3.27Å; Y446-K460 PolarHBondContact O-N 2.8Å; Y446-I462 HydrophobicContact CD1-CD1 4.2Å; Y446-I462 HydrophobicContact CD1-CG1 4.41Å; Y446-I462 HydrophobicContact CE1-CD1 3.97Å; Y446-I462 HydrophobicContact CE1-CG1 4.11Å; Y446-F630 HydrophobicContact CD1-CZ 4.21Å; Y446-F630 HydrophobicContact CG-CZ 4.42Å
447	H	91.3	Very high	84.5	Confident	7 Å²	7	51.7 Å²	51.7	3%	0.032	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	153.6	-169.4	-68.5	77.9	0	0	0	111.6	K434 Y435 S449 D452 Y453 G459	K434-H447 WeakPolarHBondContact CA-O 3.44Å; K434-H447 WeakPolarHBondContact CB-O 3.28Å; K434-H447 WeakPolarHBondContact CD-O 3.5Å; Y435-H447 PolarHBondContact N-O 3.36Å; Y435-H447 PolarHBondContact O-N 2.83Å; H447-S449 VanDerWaalsContact C-N 3.29Å; H447-S449 PolarHBondContact O-N 2.82Å; H447-D452 HydrophobicContact CB-CB 4.36Å; H447-Y453 VanDerWaalsContact CD2-CA 3.48Å; H447-Y453 WeakPolarHBondContact CD2-CA 3.48Å; H447-Y453 AromaticContact CE1-CD2 3.66Å; H447-Y453 AromaticContact ND1-CD2 3.76Å; H447-G459 WeakPolarHBondContact CD2-CA 3.3Å; H447-G459 WeakPolarHBondContact NE2-CA 3.43Å
448	P	88.4	Confident	83.6	Confident	54 Å²	54	57.8 Å²	57.8	35%	0.351	30%	0.302	S	S	.	.	S	Bend	trans	-59.9	-34.2	176.2	-24	33.7	0	0	0	114.8	D452 H458	P448-D452 HydrophobicContact CB-CB 4.44Å; P448-D452 HydrophobicContact CG-CB 4.37Å; P448-D452 WeakPolarHBondContact CG-OD2 3.1Å; P448-H458 HydrophobicContact CG-CB 3.65Å
449	S	86.3	Confident	83.3	Confident	42 Å²	42	59.4 Å²	59.4	29%	0.294	32%	0.318	S	S	.	.	S	Bend	trans	-151.3	172.5	174.6	78.2	0	0	0	0	110.9	H447 H451 D452 Y453	H447-S449 VanDerWaalsContact C-N 3.29Å; H447-S449 PolarHBondContact O-N 2.82Å; S449-H451 PolarHBondContact O-N 2.94Å; S449-H451 WeakPolarHBondContact OG-CB 3.49Å; S449-H451 PolarHBondContact OG-N 2.84Å; S449-D452 WeakPolarHBondContact CB-OD1 3.31Å; S449-D452 PolarHBondContact N-OD1 3.02Å; S449-D452 PolarHBondContact O-N 3.16Å; S449-D452 PolarHBondContact OG-N 2.91Å; S449-D452 VanDerWaalsContact OG-N 3.11Å; S449-D452 PolarHBondContact OG-OD1 3.28Å; S449-Y453 PolarHBondContact O-N 3.31Å; S449-Y453 VanDerWaalsContact O-N 3.11Å
450	L	80.9	Confident	83.4	Confident	86 Å²	86	64.5 Å²	64.5	45%	0.45	34%	0.339	S	S	.	.	H	α-helix	trans	-60.4	-31.2	168.2	175.1	62.8	0	0	0	112	Y435 Y453 M454	Y435-L450 HydrophobicContact CD1-CD1 4.21Å; Y435-L450 HydrophobicContact CD2-CB 4.28Å; Y435-L450 HydrophobicContact CD2-CD1 4.29Å; Y435-L450 HydrophobicContact CE1-CD1 3.73Å; Y435-L450 HydrophobicContact CE2-CD1 3.85Å; Y435-L450 HydrophobicContact CG-CB 4.36Å; Y435-L450 HydrophobicContact CG-CD1 4.45Å; L450-Y453 HydrophobicContact CD1-CD1 4.14Å; L450-Y453 WeakPolarHBondContact O-CB 3.36Å; L450-Y453 PolarHBondContact O-N 3.36Å; L450-M454 HydrophobicContact CD1-CG 4.31Å; L450-M454 HydrophobicContact CD1-SD 4.48Å; L450-M454 HydrophobicContact CG-CG 4.49Å; L450-M454 HydrophobicContact CG-SD 4.2Å; L450-M454 WeakPolarHBondContact O-CB 3.19Å; L450-M454 VanDerWaalsContact O-CG 3.27Å; L450-M454 WeakPolarHBondContact O-CG 3.32Å; L450-M454 PolarHBondContact O-N 3.15Å
451	H	83	Confident	83.9	Confident	116 Å²	116	66.8 Å²	66.8	54%	0.537	35%	0.346	S	S	.	.	H	α-helix	trans	-72.4	-43.2	179.5	-165.2	68.2	0	0	0	111.6	S449 Y453 M454 Q455	S449-H451 PolarHBondContact O-N 2.94Å; S449-H451 WeakPolarHBondContact OG-CB 3.49Å; S449-H451 PolarHBondContact OG-N 2.84Å; H451-Y453 VanDerWaalsContact C-N 3.29Å; H451-Y453 PolarHBondContact O-N 2.89Å; H451-M454 PolarHBondContact O-N 3.5Å; H451-Q455 PolarHBondContact CE1-NE2 3.13Å; H451-Q455 PolarHBondContact NE2-NE2 3.32Å; H451-Q455 WeakPolarHBondContact O-CG 3.45Å; H451-Q455 PolarHBondContact O-N 3.27Å
452	D	85.4	Confident	84.4	Confident	31 Å²	31	61.8 Å²	61.8	17%	0.166	32%	0.319	C	S	.	.	H	α-helix	trans	-56.9	-44	171	-67	76.6	0	0	0	110.8	H447 P448 S449 Q455 N456 V457 H458	H447-D452 HydrophobicContact CB-CB 4.36Å; P448-D452 HydrophobicContact CB-CB 4.44Å; P448-D452 HydrophobicContact CG-CB 4.37Å; P448-D452 WeakPolarHBondContact CG-OD2 3.1Å; S449-D452 WeakPolarHBondContact CB-OD1 3.31Å; S449-D452 PolarHBondContact N-OD1 3.02Å; S449-D452 PolarHBondContact O-N 3.16Å; S449-D452 PolarHBondContact OG-N 2.91Å; S449-D452 VanDerWaalsContact OG-N 3.11Å; S449-D452 PolarHBondContact OG-OD1 3.28Å; D452-Q455 PolarHBondContact O-N 3.09Å; D452-N456 PolarHBondContact O-N 3.07Å; D452-V457 WeakPolarHBondContact CB-O 3.46Å; D452-V457 PolarHBondContact O-N 3.47Å; D452-H458 IonicContact OD2-CE1 3.89Å; D452-H458 IonicContact OD2-CG 2.78Å; D452-H458 IonicContact OD2-ND1 2.7Å; D452-H458 PolarHBondContact OD2-ND1 2.84Å
453	Y	82.8	Confident	84.6	Confident	26 Å²	26	65.6 Å²	65.6	10%	0.102	34%	0.339	C	S	.	.	H	α-helix	trans	-58	-56.2	172	171.5	-109.6	0	0	0	111.4	R410 Y435 T437 H447 S449 L450 H451 Q455 N456	R410-Y453 PolarHBondContact NH1-O 2.83Å; R410-Y453 PolarHBondContact NH2-O 3.2Å; Y435-Y453 HydrophobicContact CD1-CD1 4.01Å; Y435-Y453 HydrophobicContact CD1-CD2 4.49Å; Y435-Y453 AromaticContact CD1-CG 3.83Å; Y435-Y453 HydrophobicContact CD1-CG 3.83Å; Y435-Y453 AromaticContact CE1-CD1 3.49Å; Y435-Y453 HydrophobicContact CE1-CD1 3.49Å; Y435-Y453 VanDerWaalsContact CE1-CD1 3.49Å; Y435-Y453 HydrophobicContact CE1-CD2 4.43Å; Y435-Y453 AromaticContact CE1-CE1 3.92Å; Y435-Y453 HydrophobicContact CE1-CE1 3.92Å; Y435-Y453 AromaticContact CE1-CG 3.77Å; Y435-Y453 HydrophobicContact CE1-CG 3.77Å; T437-Y453 HydrophobicContact CG2-CD2 4.42Å; T437-Y453 HydrophobicContact CG2-CE1 4.44Å; T437-Y453 HydrophobicContact CG2-CE2 3.96Å; H447-Y453 VanDerWaalsContact CD2-CA 3.48Å; H447-Y453 WeakPolarHBondContact CD2-CA 3.48Å; H447-Y453 AromaticContact CE1-CD2 3.66Å; H447-Y453 AromaticContact ND1-CD2 3.76Å; S449-Y453 PolarHBondContact O-N 3.31Å; S449-Y453 VanDerWaalsContact O-N 3.11Å; L450-Y453 HydrophobicContact CD1-CD1 4.14Å; L450-Y453 WeakPolarHBondContact O-CB 3.36Å; L450-Y453 PolarHBondContact O-N 3.36Å; H451-Y453 VanDerWaalsContact C-N 3.29Å; H451-Y453 PolarHBondContact O-N 2.89Å; Y453-Q455 PolarHBondContact O-N 3.26Å; Y453-Q455 VanDerWaalsContact O-N 3.16Å; Y453-N456 PolarHBondContact O-N 2.83Å
454	M	79.6	Confident	84.6	Confident	124 Å²	124	64.2 Å²	64.2	61%	0.611	33%	0.331	S	S	*	.	H	α-helix	trans	-58	-29	-178.7	-73.1	177.4	77.8	0	0	113.9	R410 L450 H451	R410-M454 PolarHBondContact NH2-O 3.15Å; L450-M454 HydrophobicContact CD1-CG 4.31Å; L450-M454 HydrophobicContact CD1-SD 4.48Å; L450-M454 HydrophobicContact CG-CG 4.49Å; L450-M454 HydrophobicContact CG-SD 4.2Å; L450-M454 WeakPolarHBondContact O-CB 3.19Å; L450-M454 VanDerWaalsContact O-CG 3.27Å; L450-M454 WeakPolarHBondContact O-CG 3.32Å; L450-M454 PolarHBondContact O-N 3.15Å; H451-M454 PolarHBondContact O-N 3.5Å
455	Q	77.7	Confident	83.9	Confident	115 Å²	115	67.3 Å²	67.3	54%	0.537	35%	0.347	S	S	.	.	H	α-helix	trans	-89.2	-8.9	175.4	-68.7	177.8	-16.4	0	0	114	H451 D452 Y453 V457	H451-Q455 PolarHBondContact CE1-NE2 3.13Å; H451-Q455 PolarHBondContact NE2-NE2 3.32Å; H451-Q455 WeakPolarHBondContact O-CG 3.45Å; H451-Q455 PolarHBondContact O-N 3.27Å; D452-Q455 PolarHBondContact O-N 3.09Å; Y453-Q455 PolarHBondContact O-N 3.26Å; Y453-Q455 VanDerWaalsContact O-N 3.16Å; Q455-V457 HydrophobicContact CB-CG2 3.88Å; Q455-V457 WeakPolarHBondContact O-CG2 3.26Å
456	N	74.8	Confident	83.3	Confident	122 Å²	122	73.2 Å²	73.2	65%	0.652	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.7	43.4	-175	-154.4	51.4	0	0	0	113.5	D452 Y453	D452-N456 PolarHBondContact O-N 3.07Å; Y453-N456 PolarHBondContact O-N 2.83Å
457	V	69.8	Low	83	Confident	62 Å²	62	72.4 Å²	72.4	38%	0.376	37%	0.365	S	S	.	.			trans	-124.1	146.9	-177.7	-163.4	0	0	0	0	110	D452 Q455 G459	D452-V457 WeakPolarHBondContact CB-O 3.46Å; D452-V457 PolarHBondContact O-N 3.47Å; Q455-V457 HydrophobicContact CB-CG2 3.88Å; Q455-V457 WeakPolarHBondContact O-CG2 3.26Å; V457-G459 PolarHBondContact O-N 3.13Å
458	H	74.1	Confident	82.8	Confident	129 Å²	129	75.1 Å²	75.1	60%	0.597	38%	0.383	S	S	*	.	S	Bend	trans	58	12.8	178.4	-48.5	125.5	0	0	0	116.7	P448 D452	P448-H458 HydrophobicContact CG-CB 3.65Å; D452-H458 IonicContact OD2-CE1 3.89Å; D452-H458 IonicContact OD2-CG 2.78Å; D452-H458 IonicContact OD2-ND1 2.7Å; D452-H458 PolarHBondContact OD2-ND1 2.84Å
459	G	83.6	Confident	82.9	Confident	34 Å²	34	73.3 Å²	73.3	35%	0.351	37%	0.37	S	S	.	.			trans	-58.2	152.5	171.2	0	0	0	0	0	112.7	H447 V457	H447-G459 WeakPolarHBondContact CD2-CA 3.3Å; H447-G459 WeakPolarHBondContact NE2-CA 3.43Å; V457-G459 PolarHBondContact O-N 3.13Å
460	K	88.3	Confident	83	Confident	124 Å²	124	76.7 Å²	76.7	54%	0.539	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	138.7	171.5	-68	-168.8	176.2	-168.7	0	109.5	T445 Y446	T445-K460 CarbonylContact C-O 3.57Å; T445-K460 WeakPolarHBondContact CA-O 3.5Å; Y446-K460 HydrophobicContact CD1-CB 4.08Å; Y446-K460 WeakPolarHBondContact CD1-O 3.25Å; Y446-K460 HydrophobicContact CD2-CB 4.38Å; Y446-K460 HydrophobicContact CE1-CB 3.65Å; Y446-K460 HydrophobicContact CE2-CB 3.99Å; Y446-K460 HydrophobicContact CE2-CD 4.09Å; Y446-K460 HydrophobicContact CE2-CG 4.5Å; Y446-K460 HydrophobicContact CG-CB 4.43Å; Y446-K460 PolarHBondContact N-O 3.27Å; Y446-K460 PolarHBondContact O-N 2.8Å
461	E	89.8	Confident	83.2	Confident	147 Å²	147	73.7 Å²	73.7	69%	0.687	37%	0.365	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.4	150.5	-168.2	-47.7	-166.2	144.3	0	0	110.6	V443 T445	V443-E461 HydrophobicContact CG1-CB 3.9Å; T445-E461 HydrophobicContact CG2-CB 4.13Å; T445-E461 HydrophobicContact CG2-CG 3.74Å
462	I	89.1	Confident	83.1	Confident	3 Å²	3	71.1 Å²	71.1	2%	0.015	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	105.6	175.1	-53.9	178.3	0	0	0	105.8	L444 Y446 L464 T467 I620 W628 F630	L444-I462 HydrophobicContact CD2-CD1 3.95Å; L444-I462 PolarHBondContact N-O 3.38Å; L444-I462 PolarHBondContact O-N 3.07Å; Y446-I462 HydrophobicContact CD1-CD1 4.2Å; Y446-I462 HydrophobicContact CD1-CG1 4.41Å; Y446-I462 HydrophobicContact CE1-CD1 3.97Å; Y446-I462 HydrophobicContact CE1-CG1 4.11Å; I462-L464 HydrophobicContact CG2-CD2 4.22Å; I462-L464 PolarHBondContact O-N 3.25Å; I462-T467 HydrophobicContact CG2-CG2 4.11Å; I462-I620 HydrophobicContact CD1-CD1 4.37Å; I462-I620 HydrophobicContact CG2-CG2 4.25Å; I462-W628 HydrophobicContact CD1-CB 4Å; I462-W628 HydrophobicContact CD1-CD2 3.61Å; I462-W628 HydrophobicContact CD1-CE3 4.2Å; I462-W628 HydrophobicContact CD1-CG 3.5Å; I462-W628 VanDerWaalsContact CD1-CG 3.5Å; I462-W628 HydrophobicContact CG1-CD2 4.16Å; I462-W628 HydrophobicContact CG1-CG 4.41Å; I462-W628 HydrophobicContact CG1-CZ2 4.21Å; I462-W628 HydrophobicContact CG2-CE3 4.22Å; I462-W628 HydrophobicContact CG2-CH2 4.13Å; I462-W628 HydrophobicContact CG2-CZ2 4.4Å; I462-W628 HydrophobicContact CG2-CZ3 4.03Å; I462-F630 HydrophobicContact CD1-CE2 4.13Å; I462-F630 HydrophobicContact CD1-CZ 4.28Å
463	D	86.7	Confident	82.2	Confident	84 Å²	84	73.9 Å²	73.9	45%	0.449	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.8	118.6	164.8	161.2	30.1	0	0	0	108.4	L465 T467	D463-L465 WeakPolarHBondContact OD1-CB 3.29Å; D463-L465 PolarHBondContact OD1-N 3.14Å; D463-T467 WeakPolarHBondContact O-CG2 3.22Å
464	L	87.6	Confident	81.4	Confident	0 Å²	0	77.6 Å²	77.6	0%	0	41%	0.411	C	S	.	.	S	Bend	trans	-84.2	-22.2	-178	-62.9	179.6	0	0	0	113.4	L438 G442 L444 I462 R466 T467 I645 Q648 I649	L438-L464 HydrophobicContact CD1-CD1 3.39Å; G442-L464 WeakPolarHBondContact O-CB 3.5Å; G442-L464 WeakPolarHBondContact O-CG 3.47Å; G442-L464 PolarHBondContact O-N 3.38Å; L444-L464 HydrophobicContact CB-CD1 4.16Å; L444-L464 HydrophobicContact CB-CD2 4.05Å; L444-L464 HydrophobicContact CB-CG 4.2Å; I462-L464 HydrophobicContact CG2-CD2 4.22Å; I462-L464 PolarHBondContact O-N 3.25Å; L464-R466 PolarHBondContact O-N 2.97Å; L464-T467 WeakPolarHBondContact CA-OG1 3.28Å; L464-T467 PolarHBondContact O-N 3.41Å; L464-T467 PolarHBondContact O-OG1 3.05Å; L464-I645 HydrophobicContact CD1-CG2 4.02Å; L464-I645 HydrophobicContact CD2-CG2 3.93Å; L464-Q648 HydrophobicContact CD1-CB 4.3Å; L464-Q648 HydrophobicContact CD1-CG 4.09Å; L464-I649 HydrophobicContact CB-CG1 3.83Å
465	L	78.1	Confident	79.6	Confident	65 Å²	65	82.8 Å²	82.8	34%	0.34	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-26.4	-174.9	-173.2	68.9	0	0	0	112.5	D463 L653	D463-L465 WeakPolarHBondContact OD1-CB 3.29Å; D463-L465 PolarHBondContact OD1-N 3.14Å; L465-L653 HydrophobicContact CD1-CD2 4.11Å
466	R	79.7	Confident	77.8	Confident	139 Å²	139	82.9 Å²	82.9	53%	0.525	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.4	35.1	-179.7	-51.3	-164.8	78.6	-140.5	2.7	112.4	L464 S622 L623	L464-R466 PolarHBondContact O-N 2.97Å; R466-S622 CarbonylContact O-C 3.29Å; R466-S622 WeakPolarHBondContact O-CA 3.49Å; R466-L623 HydrophobicContact CB-CD1 4.05Å; R466-L623 HydrophobicContact CB-CG 4.33Å; R466-L623 PolarHBondContact O-N 3.37Å
467	T	85.5	Confident	76.2	Confident	10 Å²	10	83.4 Å²	83.4	6%	0.061	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	166.9	178.2	68.7	0	0	0	0	113.9	I462 D463 L464 I620 V621	I462-T467 HydrophobicContact CG2-CG2 4.11Å; D463-T467 WeakPolarHBondContact O-CG2 3.22Å; L464-T467 WeakPolarHBondContact CA-OG1 3.28Å; L464-T467 PolarHBondContact O-N 3.41Å; L464-T467 PolarHBondContact O-OG1 3.05Å; T467-I620 HydrophobicContact CG2-CG2 3.93Å; T467-V621 CarbonylContact C-O 3.48Å; T467-V621 VanDerWaalsContact CA-O 3.31Å; T467-V621 WeakPolarHBondContact CA-O 3.45Å
468	T	87.4	Confident	74.4	Confident	64 Å²	64	91.7 Å²	91.7	39%	0.393	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	144.7	171.2	53.4	0	0	0	0	108.8	V621	T468-V621 PolarHBondContact N-O 2.92Å; T468-V621 PolarHBondContact O-N 3.34Å; T468-V621 PolarHBondContact OG1-O 2.69Å
469	V	90.6	Very high	72.3	Confident	16 Å²	16	90.4 Å²	90.4	10%	0.097	48%	0.481	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	144.6	169.5	-171.2	0	0	0	0	108.9	F618 I619 V642 I645 E646 I649	V469-F618 HydrophobicContact CG1-CD2 4.07Å; V469-I619 CarbonylContact C-O 3.55Å; V469-V642 HydrophobicContact CG1-CB 4.4Å; V469-V642 HydrophobicContact CG1-CG1 3.98Å; V469-V642 HydrophobicContact CG1-CG2 4.01Å; V469-I645 HydrophobicContact CG2-CB 4.02Å; V469-I645 HydrophobicContact CG2-CG2 3.42Å; V469-I645 VanDerWaalsContact CG2-CG2 3.42Å; V469-E646 HydrophobicContact CB-CG 4.07Å; V469-E646 HydrophobicContact CG2-CG 3.98Å; V469-I649 HydrophobicContact CG2-CD1 4.07Å
470	K	88.9	Confident	69.7	Low	114 Å²	114	95.1 Å²	95.1	50%	0.496	50%	0.502	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	123.6	176.2	-61.1	-171.4	-177	-176.8	0	110.3	I619 V621	K470-I619 PolarHBondContact N-O 2.97Å; K470-I619 PolarHBondContact O-N 3.42Å; K470-V621 HydrophobicContact CD-CG2 4.01Å; K470-V621 HydrophobicContact CG-CG2 4.37Å
471	V	85.6	Confident	66.8	Low	22 Å²	22	93.5 Å²	93.5	13%	0.133	51%	0.512	C	S	.	.			trans	-93.6	121.3	169.5	169.6	0	0	0	0	108.4	K474 V642	V471-K474 HydrophobicContact CB-CB 4.33Å; V471-K474 HydrophobicContact CB-CD 4.34Å; V471-K474 HydrophobicContact CB-CG 4.45Å; V471-K474 HydrophobicContact CG1-CB 4.16Å; V471-K474 HydrophobicContact CG1-CD 3.84Å; V471-K474 HydrophobicContact CG1-CG 3.83Å; V471-K474 PolarHBondContact O-N 2.83Å; V471-V642 HydrophobicContact CG2-CG1 4.4Å; V471-V642 HydrophobicContact CG2-CG2 3.94Å
472	P	80.4	Confident	63.8	Low	63 Å²	63	93.1 Å²	93.1	41%	0.409	52%	0.52	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.9	139.4	171.5	-24.8	35.4	0	0	0	111.6	K474 E617 I619	P472-K474 VanDerWaalsContact C-N 3.29Å; P472-K474 PolarHBondContact O-N 2.82Å; P472-E617 VanDerWaalsContact CD-O 3.29Å; P472-E617 WeakPolarHBondContact CD-O 3.27Å; P472-E617 HydrophobicContact CG-CG 4.38Å; P472-I619 HydrophobicContact CG-CD1 4.37Å
473	G	66.8	Low	60.8	Low	88 Å²	88	99.7 Å²	99.7	91%	0.907	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	83.3	-30.3	179.1	0	0	0	0	0	116.2
474	K	65.1	Low	57.9	Low	104 Å²	104	99.6 Å²	99.6	45%	0.452	57%	0.571	S	S	.	*	P	Polyproline II helix	trans	-79.9	133.3	176.9	-67.8	-171.7	-177.9	-176.3	0	111.3	V471 P472 Y635 E639	V471-K474 HydrophobicContact CB-CB 4.33Å; V471-K474 HydrophobicContact CB-CD 4.34Å; V471-K474 HydrophobicContact CB-CG 4.45Å; V471-K474 HydrophobicContact CG1-CB 4.16Å; V471-K474 HydrophobicContact CG1-CD 3.84Å; V471-K474 HydrophobicContact CG1-CG 3.83Å; V471-K474 PolarHBondContact O-N 2.83Å; P472-K474 VanDerWaalsContact C-N 3.29Å; P472-K474 PolarHBondContact O-N 2.82Å; K474-Y635 PolarHBondContact NZ-OH 3.48Å; K474-E639 IonicContact NZ-OE1 3.05Å; K474-E639 IonicContact NZ-OE2 2.73Å; K474-E639 PolarHBondContact NZ-OE2 3.37Å
475	R	41.9	Very low	55.2	Low	234 Å²	234	105.9 Å²	105.9	88%	0.883	61%	0.611	S	S	*	*	P	Polyproline II helix	trans	-76.7	142.6	171.1	-66	-176.2	-176	176	2.5	109.7
476	P	40.8	Very low	52.7	Low	117 Å²	117	108.3 Å²	108.3	76%	0.76	63%	0.634	S	S	*	*	P	Polyproline II helix	trans	-60.1	144.9	173.4	-23	33.7	0	0	0	112.2
477	P	40.2	Very low	50.2	Low	132 Å²	132	106.8 Å²	106.8	86%	0.857	65%	0.651	S	S	*	*	P	Polyproline II helix	trans	-56.8	138.5	170.7	-24.5	34.7	0	0	0	111.7
478	R	31.8	Very low	47.4	Very low	237 Å²	237	111.4 Å²	111.4	89%	0.894	68%	0.684	S	S	*	*	P	Polyproline II helix	trans	-81.2	124.9	175.6	-161.8	-178.1	-159.4	-167.2	5.3	108.8	V480	R478-V480 PolarHBondContact O-N 3.4Å
479	A	30.2	Very low	44.8	Very low	102 Å²	102	114.3 Å²	114.3	84%	0.843	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-58.2	125.4	175.7	0	0	0	0	0	110.6
480	V	29.8	Very low	41.8	Very low	132 Å²	132	123.6 Å²	123.6	80%	0.8	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-94.4	119.8	175.5	-179.2	0	0	0	0	107.8	R478 T482	R478-V480 PolarHBondContact O-N 3.4Å; V480-T482 PolarHBondContact O-N 2.72Å
481	A	26.3	Very low	38.9	Very low	90 Å²	90	124.1 Å²	124.1	74%	0.744	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-74.6	116.5	176	0	0	0	0	0	110	V483	A481-V483 PolarHBondContact O-N 3Å
482	T	26.5	Very low	36.2	Very low	139 Å²	139	131.2 Å²	131.2	85%	0.853	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-72.8	122.6	169.4	36.7	0	0	0	0	109.7	V480 A484	V480-T482 PolarHBondContact O-N 2.72Å; T482-A484 PolarHBondContact O-N 3Å
483	V	27.3	Very low	33.6	Very low	142 Å²	142	131.8 Å²	131.8	86%	0.861	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-76.6	121.3	178.4	179.2	0	0	0	0	109.2	A481	A481-V483 PolarHBondContact O-N 3Å
484	A	25.3	Very low	31.7	Very low	82 Å²	82	135.2 Å²	135.2	68%	0.678	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-73	140.6	176.1	0	0	0	0	0	111.4	T482 S486	T482-A484 PolarHBondContact O-N 3Å; A484-S486 PolarHBondContact O-N 2.9Å
485	P	30.1	Very low	29.9	Very low	131 Å²	131	135.7 Å²	135.7	85%	0.851	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-72	124.5	173.1	-1.9	16.1	0	0	0	110.6	A487	P485-A487 PolarHBondContact O-N 3.04Å
486	S	26.9	Very low	29.3	Very low	116 Å²	116	133.3 Å²	133.3	81%	0.811	82%	0.815	S	S	*	*			trans	-81.9	98.8	-180	43.5	0	0	0	0	112.4	A484	A484-S486 PolarHBondContact O-N 2.9Å
487	A	26.3	Very low	28.5	Very low	107 Å²	107	132.9 Å²	132.9	88%	0.884	81%	0.806	S	S	*	*			trans	-73	125.1	165.8	0	0	0	0	0	110.3	P485	P485-A487 PolarHBondContact O-N 3.04Å
488	S	26.3	Very low	28	Very low	107 Å²	107	136.8 Å²	136.8	75%	0.748	80%	0.804	S	S	*	*			trans	-139.1	134.7	169.7	59.6	0	0	0	0	110.6
489	P	33.3	Very low	27.7	Very low	125 Å²	125	131.3 Å²	131.3	81%	0.812	80%	0.802	S	S	*	*			trans	-93.7	130.2	-170.3	34.1	-33.3	0	0	0	112.7
490	K	27.4	Very low	27.5	Very low	211 Å²	211	130.8 Å²	130.8	92%	0.917	80%	0.797	S	S	*	*			trans	-140.9	144.3	160.5	-69.7	-166.5	177.2	-178.5	0	110.7
491	T	28.1	Very low	27.4	Very low	126 Å²	126	132 Å²	132	77%	0.773	80%	0.799	S	S	*	*			trans	-116.8	148	-168.9	45.1	0	0	0	0	112.6
492	N	29.7	Very low	27.4	Very low	170 Å²	170	134.6 Å²	134.6	91%	0.909	80%	0.795	S	S	*	*			trans	53.1	120	158.8	-61.5	-6.7	0	0	0	120.3
493	G	26.4	Very low	27.4	Very low	76 Å²	76	135.5 Å²	135.5	78%	0.784	79%	0.794	S	S	*	*			trans	-177.7	111.9	164.2	0	0	0	0	0	113.9
494	L	26.1	Very low	27.3	Very low	160 Å²	160	132.6 Å²	132.6	84%	0.838	79%	0.793	S	S	*	*			trans	-69.3	160.8	172	-81.2	68.1	0	0	0	110.6
495	T	28	Very low	27.5	Very low	114 Å²	114	137.5 Å²	137.5	70%	0.699	81%	0.806	S	S	*	*			cis	-168.2	162	2.1	13.5	0	0	0	0	109.4
496	K	27.8	Very low	27.3	Very low	184 Å²	184	134.9 Å²	134.9	80%	0.8	80%	0.802	S	S	*	*			trans	39.5	146.3	147	-83	177	159.5	-98	0	121.1
497	D	25.6	Very low	27.3	Very low	108 Å²	108	136.2 Å²	136.2	58%	0.578	80%	0.8	S	S	*	*			cis	-155.7	179.8	8.1	-139.6	-47.5	0	0	0	112
498	R	28.1	Very low	27.3	Very low	214 Å²	214	138 Å²	138	81%	0.808	80%	0.8	S	S	*	*			trans	-37.7	141.3	177.3	-67.1	149	50.3	168	-4.2	117.3
499	S	26.2	Very low	27.3	Very low	122 Å²	122	136.7 Å²	136.7	85%	0.853	80%	0.804	S	S	*	*				176.8	169.9	103.5	-74.1	0	0	0	0	112.8
500	A	25.2	Very low	27	Very low	90 Å²	90	135 Å²	135	74%	0.744	80%	0.8	S	S	*	*			trans	-115.4	168.3	-163.1	0	0	0	0	0	115.6
501	L	28	Very low	27	Very low	159 Å²	159	130.5 Å²	130.5	83%	0.832	79%	0.791	S	S	*	*			trans	80.1	145.3	154.3	-70.4	164.7	0	0	0	121.7
502	Q	26.8	Very low	27	Very low	143 Å²	143	132.7 Å²	132.7	67%	0.668	79%	0.792	S	S	*	*			trans	84.9	112.4	147.7	-127.3	62.7	1.1	0	0	122.7
503	L	26.8	Very low	26.9	Very low	159 Å²	159	128.6 Å²	128.6	83%	0.832	78%	0.777	S	S	*	*			trans	25.2	129.8	140.2	-54.5	173.6	0	0	0	120.7
504	G	25.7	Very low	27	Very low	80 Å²	80	132 Å²	132	83%	0.825	78%	0.777	S	S	*	*			trans	-167.6	117.3	160.1	0	0	0	0	0	113.6
505	I	28.1	Very low	27.3	Very low	186 Å²	186	128.8 Å²	128.8	95%	0.954	77%	0.768	S	S	*	*			trans	-101.7	137.3	169.1	-60.8	168.3	0	0	0	107.2
506	G	26.7	Very low	27.2	Very low	75 Å²	75	128.5 Å²	128.5	77%	0.773	77%	0.77	S	S	*	*			trans	170.6	81	175.5	0	0	0	0	0	118.1
507	N	26.6	Very low	27.5	Very low	145 Å²	145	127.3 Å²	127.3	78%	0.775	77%	0.771	S	S	*	*			trans	-30.1	157.9	164.2	-89.8	16	0	0	0	120.8
508	T	27.3	Very low	27.6	Very low	144 Å²	144	127.1 Å²	127.1	88%	0.883	78%	0.778	S	S	*	*			trans	72.4	150.8	143.6	50.6	0	0	0	0	121.1
509	G	24.9	Very low	27.8	Very low	80 Å²	80	123.4 Å²	123.4	83%	0.825	77%	0.774	S	S	*	*			trans	123.2	66.2	162.6	0	0	0	0	0	116.1
510	A	27.8	Very low	28.2	Very low	89 Å²	89	126.1 Å²	126.1	74%	0.736	77%	0.773	S	S	*	*			trans	-76.7	163.4	165.2	0	0	0	0	0	111.2
511	T	27.8	Very low	28.4	Very low	117 Å²	117	126.7 Å²	126.7	72%	0.718	78%	0.778	S	S	*	*				176.9	136.8	123.4	28.5	0	0	0	0	114.1
512	H	27.6	Very low	28.4	Very low	171 Å²	171	123 Å²	123	79%	0.792	78%	0.778	S	S	*	*			trans	60.9	145.6	139.2	-61.5	-37.1	0	0	0	121.8
513	S	28.3	Very low	28.4	Very low	85 Å²	85	119.7 Å²	119.7	59%	0.594	78%	0.782	S	S	*	*			cis	-171.1	175.2	-6.8	-108.3	0	0	0	0	113.9
514	N	27.9	Very low	28.4	Very low	147 Å²	147	118.8 Å²	118.8	79%	0.786	79%	0.789	S	S	*	*			trans	87.5	149.8	149.1	-71.7	-7.6	0	0	0	121.8
515	S	31.4	Very low	28.4	Very low	93 Å²	93	119.1 Å²	119.1	65%	0.65	78%	0.784	S	S	*	*			cis	178.7	131.2	-33.8	51.4	0	0	0	0	113.1
516	S	27.1	Very low	28.3	Very low	107 Å²	107	121 Å²	121	75%	0.748	79%	0.786	S	S	*	*			trans	-174.1	115.1	155.6	50.3	0	0	0	0	109.5
517	I	32.8	Very low	28.2	Very low	159 Å²	159	121.3 Å²	121.3	82%	0.815	79%	0.789	S	S	*	*				65.1	117.9	75.7	-62	169.8	0	0	0	110.3
518	S	28.6	Very low	28	Very low	104 Å²	104	118.3 Å²	118.3	73%	0.727	79%	0.793	S	S	*	*				-153.7	169.1	51.2	50.4	0	0	0	0	113.5
519	L	31.9	Very low	27.9	Very low	136 Å²	136	117 Å²	117	71%	0.712	79%	0.79	S	S	*	*			cis	-164.6	148.7	-11.8	-106.1	168.4	0	0	0	111.4
520	Q	34.6	Very low	28	Very low	179 Å²	179	121.8 Å²	121.8	84%	0.836	79%	0.788	S	S	*	*			trans	16.1	150.9	143	-68.3	171.8	-7.3	0	0	123.7
521	A	30.2	Very low	28	Very low	103 Å²	103	123.7 Å²	123.7	85%	0.851	79%	0.785	S	S	*	*			cis	-138.5	-161.1	12	0	0	0	0	0	111.4
522	G	26.8	Very low	27.9	Very low	82 Å²	82	121.5 Å²	121.5	85%	0.845	79%	0.787	S	S	*	*			cis	121.6	139	6.6	0	0	0	0	0	112
523	G	27.1	Very low	27.9	Very low	73 Å²	73	121 Å²	121	75%	0.753	79%	0.786	S	S	*	*			cis	179.3	-158.5	1	0	0	0	0	0	112.7
524	S	26.7	Very low	27.9	Very low	139 Å²	139	123.5 Å²	123.5	97%	0.972	79%	0.789	S	S	*	*			trans	80.8	169.4	168.8	-59.4	0	0	0	0	120.1
525	A	26.2	Very low	27.7	Very low	88 Å²	88	122.5 Å²	122.5	73%	0.727	78%	0.779	S	S	*	*			trans	-147.5	-164.1	-158.2	0	0	0	0	0	114.8
526	F	26.3	Very low	27.4	Very low	224 Å²	224	128.2 Å²	128.2	98%	0.982	79%	0.786	S	S	*	*			trans	80.8	158.2	-173.3	-64.6	-86.2	0	0	0	116.1
527	G	23.5	Very low	27.3	Very low	82 Å²	82	127 Å²	127	85%	0.845	78%	0.777	S	S	*	*			trans	-162.7	-173	-173.4	0	0	0	0	0	114
528	G	24.1	Very low	26.9	Very low	83 Å²	83	128.4 Å²	128.4	86%	0.856	78%	0.778	S	S	*	*			trans	-168	148.9	-179.6	0	0	0	0	0	112.7
529	S	25.3	Very low	26.8	Very low	116 Å²	116	128.4 Å²	128.4	81%	0.811	78%	0.778	S	S	*	*			trans	-98.2	164.7	-164.6	-46.4	0	0	0	0	115.2
530	K	27.1	Very low	26.4	Very low	181 Å²	181	128 Å²	128	79%	0.787	78%	0.781	S	S	*	*			trans	149.2	149.1	134.6	-83.2	-170.8	165.4	-85.9	0	111.4
531	D	26.3	Very low	25.9	Very low	128 Å²	128	124.7 Å²	124.7	68%	0.684	78%	0.778	S	S	*	*			cis	-162.1	139.9	-19	-112	-9.9	0	0	0	110.3
532	G	25.3	Very low	25.6	Very low	72 Å²	72	125.2 Å²	125.2	74%	0.742	78%	0.775	S	S	*	*			trans	73.1	168.1	156.9	0	0	0	0	0	119.4
533	M	27.8	Very low	25.4	Very low	159 Å²	159	125 Å²	125	78%	0.783	77%	0.766	S	S	*	*			cis	-163.9	162.7	-22.7	-156.7	146	67.8	0	0	110.6
534	H	28.5	Very low	25.4	Very low	139 Å²	139	128.9 Å²	128.9	64%	0.644	77%	0.769	S	S	*	*			trans	70.8	154.4	172.1	-59.9	-72.5	0	0	0	117.9
535	Q	24.6	Very low	25.2	Very low	126 Å²	126	130 Å²	130	59%	0.589	76%	0.759	S	S	*	*			cis	-170.4	149.5	-40.9	-124.5	179.8	43.7	0	0	109.9
536	R	24.1	Very low	25.1	Very low	213 Å²	213	137.4 Å²	137.4	80%	0.804	77%	0.768	S	S	*	*			trans	67.7	157.5	154.1	-66.5	174.7	-163.4	-116.6	0.3	119.2
537	S	25	Very low	25	Very low	80 Å²	80	132.2 Å²	132.2	56%	0.559	75%	0.751	S	S	*	*			cis	-179.9	134	-36.1	-105.1	0	0	0	0	112.5
538	F	24.8	Very low	25	Very low	189 Å²	189	135.7 Å²	135.7	83%	0.829	75%	0.745	S	S	*	*			trans	60.9	162.7	153.3	-46.9	-52.2	0	0	0	118.1
539	S	27.2	Very low	25	Very low	105 Å²	105	135.9 Å²	135.9	73%	0.734	74%	0.739	S	S	*	*			cis	-141.4	144.5	13	-58.5	0	0	0	0	109
540	V	23.5	Very low	24.9	Very low	127 Å²	127	136.3 Å²	136.3	77%	0.77	73%	0.73	S	S	*	*				65.3	124.2	64.7	177.9	0	0	0	0	110.5
541	S	23.5	Very low	24.8	Very low	109 Å²	109	134.5 Å²	134.5	76%	0.762	73%	0.729	S	S	*	*			cis	-147.2	170.1	37.4	-45.9	0	0	0	0	117
542	S	23.5	Very low	24.6	Very low	115 Å²	115	133.9 Å²	133.9	80%	0.804	73%	0.731	S	S	*	*			trans	-71.1	-178.9	146	53.8	0	0	0	0	111.2
543	A	23.6	Very low	24.5	Very low	78 Å²	78	134.9 Å²	134.9	65%	0.645	73%	0.726	S	S	*	*			cis	-139.6	-158	7.5	0	0	0	0	0	107.9
544	D	26	Very low	24.4	Very low	154 Å²	154	133 Å²	133	82%	0.824	72%	0.724	S	S	*	*			cis	-146.8	167.5	23.7	-99.8	-51.7	0	0	0	112.7
545	Q	22.6	Very low	24.3	Very low	162 Å²	162	132.9 Å²	132.9	76%	0.757	73%	0.728	S	S	*	*			trans	-121.5	134.7	179.5	179.4	-177.5	25.7	0	0	109.8
546	W	23.9	Very low	24.5	Very low	243 Å²	243	132.1 Å²	132.1	92%	0.92	74%	0.736	S	S	*	*			trans	-132.9	150.1	162.7	-87.9	91.4	0	0	0	110.8
547	N	24.2	Very low	24.6	Very low	115 Å²	115	126.9 Å²	126.9	62%	0.615	74%	0.739	S	S	*	*			trans	-147.6	157.1	-162.5	-158.8	28.2	0	0	0	109.6
548	E	24.7	Very low	24.8	Very low	155 Å²	155	127.5 Å²	127.5	72%	0.724	75%	0.748	S	S	*	*			trans	63.5	165.9	171.6	-56.2	-177.5	122.7	0	0	115.1
549	A	23.7	Very low	25.6	Very low	88 Å²	88	123.4 Å²	123.4	73%	0.727	74%	0.741	S	S	*	*			cis	-129	152	3.7	0	0	0	0	0	109.1
550	I	23.8	Very low	25.8	Very low	124 Å²	124	126.2 Å²	126.2	64%	0.636	75%	0.748	S	S	*	*				61.5	93.6	52.1	-56.4	176.6	0	0	0	112.4
551	N	23.6	Very low	25.9	Very low	143 Å²	143	123.9 Å²	123.9	77%	0.765	75%	0.749	S	S	*	*				-167.5	156.9	105.1	-112.9	-37	0	0	0	116.7
552	T	22.6	Very low	26.2	Very low	116 Å²	116	127.2 Å²	127.2	71%	0.712	76%	0.755	S	S	*	*			trans	-49.9	161.8	165	53.5	0	0	0	0	114
553	S	24.4	Very low	26.5	Very low	93 Å²	93	128.2 Å²	128.2	65%	0.65	76%	0.757	S	S	*	*				-179	146.6	64	47.6	0	0	0	0	117.3
554	T	25	Very low	26.7	Very low	118 Å²	118	131.4 Å²	131.4	72%	0.724	76%	0.763	S	S	*	*			trans	65	142	141.2	52.1	0	0	0	0	124.6
555	N	26.3	Very low	27.4	Very low	138 Å²	138	130 Å²	130	74%	0.738	76%	0.762	S	S	*	*			trans	89.1	96.1	143.7	-70.8	-2.7	0	0	0	122.4
556	S	27.6	Very low	27.8	Very low	109 Å²	109	126.3 Å²	126.3	76%	0.762	76%	0.759	S	S	*	*				69	135.7	105.4	-56.6	0	0	0	0	123
557	A	27.7	Very low	28.1	Very low	104 Å²	104	121.4 Å²	121.4	86%	0.86	76%	0.756	S	S	*	*			trans	84.2	130.4	152.4	0	0	0	0	0	120
558	A	28.8	Very low	28.5	Very low	92 Å²	92	121.2 Å²	121.2	76%	0.76	76%	0.764	S	S	*	*			trans	-83.6	178.7	157.9	0	0	0	0	0	108.8
559	P	42	Very low	28.9	Very low	104 Å²	104	118.2 Å²	118.2	68%	0.675	76%	0.76	S	S	*	*			cis	-148.1	-175.6	24.9	45.3	-25	0	0	0	118.1
560	N	30.3	Very low	29.2	Very low	164 Å²	164	122.4 Å²	122.4	88%	0.877	77%	0.767	S	S	*	*			trans	59.2	140	150.9	-65.1	-9	0	0	0	121.9
561	G	26.8	Very low	29.4	Very low	77 Å²	77	120 Å²	120	79%	0.794	77%	0.772	S	S	*	*			trans	136.6	120.4	140.1	0	0	0	0	0	117.1
562	M	29.3	Very low	29.7	Very low	179 Å²	179	119 Å²	119	88%	0.882	78%	0.776	S	S	*	*			trans	-58.6	146.5	161.1	-81.4	81.1	139.2	0	0	111.6
563	T	29.8	Very low	30.1	Very low	137 Å²	137	117.5 Å²	117.5	84%	0.84	78%	0.776	S	S	*	*				178.1	139.9	98.8	39.3	0	0	0	0	112.8
564	D	27.8	Very low	30.3	Very low	145 Å²	145	119.4 Å²	119.4	78%	0.775	78%	0.784	S	S	*	*			trans	-64.1	162.9	155.8	-107.4	-48.6	0	0	0	111
565	P	41.1	Very low	30.3	Very low	123 Å²	123	119 Å²	119	80%	0.799	79%	0.786	S	S	*	*			cis	-146.4	173.7	46.1	40.8	-20.4	0	0	0	118.3
566	A	30.2	Very low	31.4	Very low	86 Å²	86	117.7 Å²	117.7	71%	0.711	79%	0.785	S	S	*	*			trans	-93.7	161.8	177.5	0	0	0	0	0	115
567	T	30.4	Very low	31.3	Very low	140 Å²	140	121.5 Å²	121.5	86%	0.859	79%	0.788	S	S	*	*			trans	-173.8	162.1	154.8	29.6	0	0	0	0	108.2
568	S	32.6	Very low	31.3	Very low	111 Å²	111	122.4 Å²	122.4	78%	0.776	78%	0.778	S	S	*	*			cis	-162.6	179.8	-30.7	67.3	0	0	0	0	106.1
569	S	32.7	Very low	31	Very low	92 Å²	92	126.1 Å²	126.1	64%	0.643	78%	0.779	S	S	*	*			cis	-155.2	178.3	5.5	60.9	0	0	0	0	106.7
570	M	30.1	Very low	31	Very low	176 Å²	176	126.1 Å²	126.1	87%	0.867	78%	0.779	S	S	*	*			cis	-116	-155.9	7.7	-62.5	-172.2	175.4	0	0	109.1
571	G	28.7	Very low	31.6	Very low	73 Å²	73	123.9 Å²	123.9	75%	0.753	77%	0.774	S	S	*	*			cis	80.3	148.2	16.1	0	0	0	0	0	112.5
572	S	30.5	Very low	31.9	Very low	121 Å²	121	126 Å²	126	85%	0.846	77%	0.774	S	S	*	*			cis	-137.9	172.9	8	-134.4	0	0	0	0	109.4
573	A	29.6	Very low	31.9	Very low	86 Å²	86	122.7 Å²	122.7	71%	0.711	77%	0.768	S	S	*	*			cis	-138.5	-135.4	14.5	0	0	0	0	0	112.9
574	T	29.2	Very low	32.6	Very low	133 Å²	133	121 Å²	121	82%	0.816	76%	0.76	S	S	*	*			trans	-125.6	146	-149	51.4	0	0	0	0	116.9
575	S	26	Very low	32.6	Very low	109 Å²	109	123.2 Å²	123.2	76%	0.762	77%	0.765	S	S	*	*			trans	-73.9	-160.4	174.9	-36.1	0	0	0	0	113.2
576	P	48.7	Very low	31.9	Very low	111 Å²	111	122.4 Å²	122.4	72%	0.721	77%	0.768	S	S	*	*			cis	-144.9	165.9	-4.2	37	-15.8	0	0	0	119.8
577	K	25.3	Very low	31.8	Very low	189 Å²	189	125.7 Å²	125.7	82%	0.822	77%	0.774	S	S	*	*			trans	62.7	152.8	147.4	-74.1	-172.8	162.4	-173.4	0	120.4
578	L	27.6	Very low	31.8	Very low	123 Å²	123	130.3 Å²	130.3	64%	0.644	78%	0.776	S	S	*	*			cis	-159.5	141	-0.8	-116	170.4	0	0	0	111.5
579	E	22.8	Very low	31.7	Very low	170 Å²	170	134.5 Å²	134.5	79%	0.794	78%	0.78	S	S	*	*			trans	35.8	165.6	151.6	-78.7	-170.7	110.3	0	0	125.5
580	P	41.8	Very low	31.6	Very low	103 Å²	103	140.3 Å²	140.3	67%	0.669	79%	0.794	S	S	*	*			cis	-132.1	-150.4	-33.2	39.7	-21.1	0	0	0	110.7
581	P	43.3	Very low	31.9	Very low	117 Å²	117	141.2 Å²	141.2	76%	0.76	80%	0.795	S	S	*	*			cis	-110.9	-123.1	-35.8	25.7	-0.4	0	0	0	109.1
582	P	33	Very low	31.9	Very low	123 Å²	123	149.2 Å²	149.2	80%	0.799	80%	0.803	S	S	*	*			cis	-133.8	-152.1	-26.5	43.3	-22.7	0	0	0	115.2
583	S	28.8	Very low	31.9	Very low	108 Å²	108	153.1 Å²	153.1	76%	0.755	80%	0.799	S	S	*	*			trans	-136.5	-170.6	174.7	67.2	0	0	0	0	110.8
584	P	44.2	Very low	31.9	Very low	103 Å²	103	157.4 Å²	157.4	67%	0.669	80%	0.801	S	S	*	*			cis	-138.6	-170.5	-6.8	43.8	-24.7	0	0	0	116.5
585	H	27.5	Very low	31.7	Very low	191 Å²	191	159.9 Å²	159.9	88%	0.884	80%	0.801	S	S	*	*			trans	46.7	128.2	155.1	-77.1	-62.2	0	0	0	124.4
586	A	27.4	Very low	32	Very low	106 Å²	106	159.2 Å²	159.2	88%	0.876	80%	0.796	S	S	*	*			trans	-165.5	158.8	139.7	0	0	0	0	0	115
587	N	27.2	Very low	31.1	Very low	155 Å²	155	161 Å²	161	83%	0.829	81%	0.805	S	S	*	*			trans	-108.9	155.1	177.3	-107.4	-75.9	0	0	0	112.1
588	R	30.6	Very low	31.1	Very low	237 Å²	237	155.1 Å²	155.1	89%	0.894	80%	0.798	S	S	*	*				170.8	126.7	122.8	-91.9	158	83.2	163.3	6	117.7
589	K	30.4	Very low	31.2	Very low	198 Å²	198	157.3 Å²	157.3	86%	0.861	81%	0.809	S	S	*	*			trans	1.8	138.4	147.5	-66.7	175.3	174.2	174.2	0	120.3
590	K	31.8	Very low	31.6	Very low	215 Å²	215	155.4 Å²	155.4	94%	0.935	81%	0.809	S	S	*	*				-160	126.9	125.3	-109.4	161.8	-174.4	174.4	0	113.5
591	H	35.3	Very low	31	Very low	195 Å²	195	159.7 Å²	159.7	90%	0.903	82%	0.817	S	S	*	*			trans	-88.5	144	166.8	-89	-93.5	0	0	0	110.8
592	R	28.9	Very low	31.1	Very low	240 Å²	240	158.8 Å²	158.8	91%	0.906	81%	0.811	S	S	*	*			trans	-153.2	74.8	154.3	-164.2	170.5	165.1	165.4	-6.4	116.2
593	R	31.3	Very low	30.9	Very low	204 Å²	204	160.6 Å²	160.6	77%	0.77	81%	0.814	S	S	*	*				30	118.4	126.9	-168	-173.7	-162.7	-149.6	7.4	119.8
594	K	28.1	Very low	30.8	Very low	175 Å²	175	159.3 Å²	159.3	76%	0.761	82%	0.818	S	S	*	*			trans	74.5	155.3	148.2	-79.1	-176.2	179.8	-169.9	0	118.2
595	K	26.1	Very low	30.1	Very low	186 Å²	186	162.8 Å²	162.8	81%	0.809	83%	0.83	S	S	*	*			cis	-156.8	161.3	-3.3	157.9	-177.5	176.9	-162.2	0	110.6
596	S	32.2	Very low	30	Very low	95 Å²	95	159.7 Å²	159.7	66%	0.664	83%	0.829	S	S	*	*			trans	-69.3	144	-177.7	55.9	0	0	0	0	119.2
597	T	28.7	Very low	30.6	Very low	148 Å²	148	160 Å²	160	91%	0.908	83%	0.832	S	S	*	*			trans	-168.1	147.8	150.5	25.1	0	0	0	0	108.3
598	G	26.4	Very low	30.5	Very low	65 Å²	65	155.7 Å²	155.7	67%	0.67	83%	0.825	S	S	*	*			cis	141.1	127.3	-14.1	0	0	0	0	0	114.2
599	I	30.5	Very low	30.7	Very low	169 Å²	169	152.3 Å²	152.3	87%	0.867	82%	0.824	S	S	*	*			trans	73.7	143	177.4	-50.8	172.1	0	0	0	111.8
600	T	29.6	Very low	30.9	Very low	131 Å²	131	150.7 Å²	150.7	80%	0.804	83%	0.825	S	S	*	*			cis	-139.3	179.4	14.4	-14.8	0	0	0	0	112.8
601	K	29.5	Very low	31.2	Very low	193 Å²	193	149.2 Å²	149.2	84%	0.839	82%	0.821	S	S	*	*			trans	-113.1	172.3	153.6	-95.5	-166.6	175.8	-165.3	0	108.5
602	P	46.3	Very low	31.4	Very low	97 Å²	97	148 Å²	148	63%	0.63	82%	0.816	S	S	*	*			cis	-137	-170.5	15.9	45.6	-28	0	0	0	116.3
603	D	28.1	Very low	32.2	Very low	162 Å²	162	144.6 Å²	144.6	87%	0.866	81%	0.81	S	S	*	*			trans	61.4	133.5	155.1	-53	-27	0	0	0	122.5
604	G	26.6	Very low	33.3	Very low	80 Å²	80	140.7 Å²	140.7	83%	0.825	81%	0.805	S	S	*	*			trans	151.3	119.8	172.3	0	0	0	0	0	113.2
605	L	29.6	Very low	35.2	Very low	176 Å²	176	135 Å²	135	92%	0.921	79%	0.787	S	S	*	*			trans	-85	134.3	-179.8	-69.6	165.3	0	0	0	112.3
606	S	26.5	Very low	38.1	Very low	126 Å²	126	128.9 Å²	128.9	88%	0.881	76%	0.76	S	S	*	*			trans	-165.7	152.1	146.6	-85	0	0	0	0	111.1
607	A	38.3	Very low	40.8	Very low	112 Å²	112	125.3 Å²	125.3	93%	0.926	73%	0.734	S	S	*	*			trans	-79.2	141.7	177.2	0	0	0	0	0	111.6
608	G	26.1	Very low	43.9	Very low	66 Å²	66	118.3 Å²	118.3	68%	0.68	69%	0.69	S	S	*	*			trans	-151.4	156.1	168.3	0	0	0	0	0	108.5	D610	G608-D610 PolarHBondContact O-N 3.22Å
609	N	35.2	Very low	47	Very low	165 Å²	165	117 Å²	117	88%	0.882	67%	0.667	S	S	*	*	P	Polyproline II helix	trans	-67.4	118.7	176.5	-64.8	-19.5	0	0	0	108.9	E611	N609-E611 PolarHBondContact O-N 2.89Å
610	D	34.1	Very low	49.9	Very low	165 Å²	165	108.9 Å²	108.9	88%	0.882	63%	0.626	S	S	*	*	P	Polyproline II helix	trans	-66.2	116.6	163.3	-84.5	-37.1	0	0	0	108	G608 Q612	G608-D610 PolarHBondContact O-N 3.22Å; D610-Q612 PolarHBondContact O-N 2.72Å
611	E	37.6	Very low	52.7	Low	183 Å²	183	103.8 Å²	103.8	86%	0.855	60%	0.595	S	S	*	*	P	Polyproline II helix	trans	-61.9	128.7	171.5	-62.9	178.7	126.6	0	0	108.5	N609 E613	N609-E611 PolarHBondContact O-N 2.89Å; E611-E613 VanDerWaalsContact C-N 3.28Å; E611-E613 PolarHBondContact O-N 2.84Å
612	Q	40.4	Very low	55.4	Low	169 Å²	169	95.4 Å²	95.4	79%	0.79	56%	0.56	S	S	*	*			trans	-69.4	88.1	174.6	-174.1	71	77.7	0	0	108.1	D610 D614	D610-Q612 PolarHBondContact O-N 2.72Å; Q612-D614 PolarHBondContact O-N 3.16Å
613	E	45.7	Very low	56.6	Low	169 Å²	169	96.5 Å²	96.5	79%	0.79	56%	0.56	S	S	*	*			trans	-54.5	110	170.9	-92.1	-165	141.8	0	0	108.4	E611 S615	E611-E613 VanDerWaalsContact C-N 3.28Å; E611-E613 PolarHBondContact O-N 2.84Å; E613-S615 PolarHBondContact O-N 2.8Å
614	D	53.7	Low	59	Low	123 Å²	123	93.5 Å²	93.5	66%	0.658	55%	0.548	S	S	*	.			trans	-70.8	68.4	174	-86.3	-39.9	0	0	0	110	Q612 F616	Q612-D614 PolarHBondContact O-N 3.16Å; D614-F616 HydrophobicContact CB-CE1 3.92Å; D614-F616 HydrophobicContact CB-CZ 4.09Å; D614-F616 WeakPolarHBondContact O-CD1 3.48Å; D614-F616 WeakPolarHBondContact O-CE1 3.49Å; D614-F616 PolarHBondContact O-N 3Å; D614-F616 VanDerWaalsContact O-N 3.09Å
615	S	68.2	Low	61.3	Low	54 Å²	54	92.3 Å²	92.3	38%	0.378	54%	0.535	S	S	.	.			trans	-72.3	105.4	-179.2	-172.7	0	0	0	0	109.8	E613 E617 R638	E613-S615 PolarHBondContact O-N 2.8Å; S615-E617 PolarHBondContact O-N 2.94Å; S615-R638 PolarHBondContact O-NH2 3.43Å
616	F	87	Confident	63.9	Low	58 Å²	58	89.6 Å²	89.6	25%	0.254	52%	0.518	S	S	.	.			trans	-74.3	21.2	172.2	-43.8	-50	0	0	0	112.8	D614 E631 A632 R638	D614-F616 HydrophobicContact CB-CE1 3.92Å; D614-F616 HydrophobicContact CB-CZ 4.09Å; D614-F616 WeakPolarHBondContact O-CD1 3.48Å; D614-F616 WeakPolarHBondContact O-CE1 3.49Å; D614-F616 PolarHBondContact O-N 3Å; D614-F616 VanDerWaalsContact O-N 3.09Å; F616-E631 WeakPolarHBondContact O-CA 3.46Å; F616-A632 PolarHBondContact O-N 3.19Å; F616-R638 WeakPolarHBondContact O-CD 3.44Å
617	E	89.8	Confident	66.9	Low	21 Å²	21	87 Å²	87	10%	0.098	50%	0.497	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	141.2	173.2	-179.4	168.1	174	0	0	111.3	R422 W431 P472 S615 I619 N629 F630 R638	R422-E617 IonicContact CZ-OE1 2.78Å; R422-E617 IonicContact CZ-OE2 2.72Å; R422-E617 VanDerWaalsContact NH1-CD 3.34Å; R422-E617 IonicContact NH1-OE1 3.97Å; R422-E617 PolarHBondContact NH1-OE1 3.28Å; R422-E617 IonicContact NH1-OE2 3.55Å; R422-E617 PolarHBondContact NH1-OE2 2.77Å; R422-E617 IonicContact NH2-OE1 3.76Å; R422-E617 PolarHBondContact NH2-OE1 3.16Å; R422-E617 IonicContact NH2-OE2 3.3Å; W431-E617 HydrophobicContact CH2-CB 4.46Å; W431-E617 HydrophobicContact CH2-CG 4.02Å; P472-E617 VanDerWaalsContact CD-O 3.29Å; P472-E617 WeakPolarHBondContact CD-O 3.27Å; P472-E617 HydrophobicContact CG-CG 4.38Å; S615-E617 PolarHBondContact O-N 2.94Å; E617-I619 HydrophobicContact CG-CG1 4.29Å; E617-N629 WeakPolarHBondContact OE1-CB 3.4Å; E617-N629 PolarHBondContact OE1-ND2 3.17Å; E617-F630 CarbonylContact C-O 3.59Å; E617-F630 VanDerWaalsContact CA-O 3.26Å; E617-F630 WeakPolarHBondContact CA-O 3.33Å; E617-R638 VanDerWaalsContact O-CD 3.31Å; E617-R638 WeakPolarHBondContact O-CD 3.48Å; E617-R638 PolarHBondContact O-NH2 3.4Å
618	F	92.6	Very high	69.4	Low	0 Å²	0	83.3 Å²	83.3	0%	0	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	157.2	161.4	68.2	-79.7	0	0	0	110.1	L419 V469 I620 F630 R638 W641 V642 I645	L419-F618 HydrophobicContact CD1-CE1 4.06Å; L419-F618 HydrophobicContact CD1-CZ 3.71Å; L419-F618 HydrophobicContact CD2-CE1 4.3Å; V469-F618 HydrophobicContact CG1-CD2 4.07Å; F618-I620 HydrophobicContact CE2-CG1 4.35Å; F618-F630 HydrophobicContact CD1-CB 3.99Å; F618-F630 HydrophobicContact CD2-CB 4.4Å; F618-F630 HydrophobicContact CE1-CB 3.54Å; F618-F630 HydrophobicContact CE2-CB 3.98Å; F618-F630 HydrophobicContact CE2-CD2 4.28Å; F618-F630 HydrophobicContact CE2-CG 4.43Å; F618-F630 HydrophobicContact CG-CB 4.42Å; F618-F630 HydrophobicContact CZ-CB 3.55Å; F618-F630 HydrophobicContact CZ-CD2 4.45Å; F618-F630 HydrophobicContact CZ-CG 4.17Å; F618-F630 PolarHBondContact N-O 3.26Å; F618-F630 PolarHBondContact O-N 3.25Å; F618-R638 HydrophobicContact CB-CG 4.26Å; F618-R638 HydrophobicContact CD1-CG 3.81Å; F618-R638 HydrophobicContact CG-CG 4.37Å; F618-W641 HydrophobicContact CE1-CB 4.26Å; F618-W641 HydrophobicContact CZ-CB 4.04Å; F618-V642 HydrophobicContact CB-CG2 3.97Å; F618-V642 HydrophobicContact CD2-CG2 4.3Å; F618-V642 HydrophobicContact CG-CG2 4.1Å; F618-I645 HydrophobicContact CE2-CD1 3.7Å; F618-I645 HydrophobicContact CZ-CD1 4.22Å
619	I	91.6	Very high	72.6	Confident	37 Å²	37	81.2 Å²	81.2	19%	0.19	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	118.5	-172.4	-45.7	179.7	0	0	0	109.3	V469 K470 P472 E617 V621 N629	V469-I619 CarbonylContact C-O 3.55Å; K470-I619 PolarHBondContact N-O 2.97Å; K470-I619 PolarHBondContact O-N 3.42Å; P472-I619 HydrophobicContact CG-CD1 4.37Å; E617-I619 HydrophobicContact CG-CG1 4.29Å; I619-V621 HydrophobicContact CG2-CG2 3.85Å; I619-N629 WeakPolarHBondContact CD1-ND2 3.29Å; I619-N629 WeakPolarHBondContact CG1-ND2 3.39Å
620	I	92.1	Very high	75.4	Confident	0 Å²	0	73.4 Å²	73.4	0%	0	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	131.2	166.5	-52.1	179.3	0	0	0	107.8	L444 I462 T467 F618 T627 W628 F630 I645	L444-I620 HydrophobicContact CD1-CD1 4.33Å; L444-I620 HydrophobicContact CD2-CD1 4.28Å; I462-I620 HydrophobicContact CD1-CD1 4.37Å; I462-I620 HydrophobicContact CG2-CG2 4.25Å; T467-I620 HydrophobicContact CG2-CG2 3.93Å; F618-I620 HydrophobicContact CE2-CG1 4.35Å; I620-T627 CarbonylContact O-C 3.38Å; I620-T627 WeakPolarHBondContact O-CA 3.37Å; I620-W628 HydrophobicContact CB-CB 4.49Å; I620-W628 HydrophobicContact CB-CE3 4.23Å; I620-W628 HydrophobicContact CG2-CE3 4.18Å; I620-W628 PolarHBondContact N-O 3.44Å; I620-W628 PolarHBondContact O-N 3.24Å; I620-F630 HydrophobicContact CD1-CD2 4.23Å; I620-F630 HydrophobicContact CD1-CE2 3.94Å; I620-F630 HydrophobicContact CG1-CD2 4.38Å; I620-F630 HydrophobicContact CG1-CE2 4.45Å; I620-I645 HydrophobicContact CD1-CD1 4.18Å
621	V	87.8	Confident	78.2	Confident	24 Å²	24	67.7 Å²	67.7	15%	0.145	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	117.9	-178.4	-177.2	0	0	0	0	109.6	T467 T468 K470 I619 T627	T467-V621 CarbonylContact C-O 3.48Å; T467-V621 VanDerWaalsContact CA-O 3.31Å; T467-V621 WeakPolarHBondContact CA-O 3.45Å; T468-V621 PolarHBondContact N-O 2.92Å; T468-V621 PolarHBondContact O-N 3.34Å; T468-V621 PolarHBondContact OG1-O 2.69Å; K470-V621 HydrophobicContact CD-CG2 4.01Å; K470-V621 HydrophobicContact CG-CG2 4.37Å; I619-V621 HydrophobicContact CG2-CG2 3.85Å; V621-T627 HydrophobicContact CB-CG2 4.43Å; V621-T627 HydrophobicContact CG1-CG2 4.12Å; V621-T627 HydrophobicContact CG2-CG2 3.96Å
622	S	85.5	Confident	80.8	Confident	16 Å²	16	59.2 Å²	59.2	11%	0.112	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	157.4	175.3	59.4	0	0	0	0	112.9	R466 T624 G625 Q626	R466-S622 CarbonylContact O-C 3.29Å; R466-S622 WeakPolarHBondContact O-CA 3.49Å; S622-T624 PolarHBondContact O-N 2.84Å; S622-T624 VanDerWaalsContact O-N 3.14Å; S622-T624 PolarHBondContact OG-OG1 2.68Å; S622-G625 PolarHBondContact O-N 2.92Å; S622-Q626 PolarHBondContact N-O 2.95Å; S622-Q626 WeakPolarHBondContact OG-CA 3.29Å; S622-Q626 WeakPolarHBondContact OG-CB 3.31Å; S622-Q626 PolarHBondContact OG-N 2.8Å; S622-Q626 PolarHBondContact OG-O 3.08Å
623	L	72.7	Confident	83	Confident	121 Å²	121	55.4 Å²	55.4	63%	0.634	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-18.3	172.3	-68.9	-179.9	0	0	0	113.7	R466 G625	R466-L623 HydrophobicContact CB-CD1 4.05Å; R466-L623 HydrophobicContact CB-CG 4.33Å; R466-L623 PolarHBondContact O-N 3.37Å; L623-G625 VanDerWaalsContact C-N 3.33Å
624	T	77	Confident	85.1	Confident	99 Å²	99	50 Å²	50	61%	0.607	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.4	7	173.7	58.8	0	0	0	0	113.3	S622 Q626	S622-T624 PolarHBondContact O-N 2.84Å; S622-T624 VanDerWaalsContact O-N 3.14Å; S622-T624 PolarHBondContact OG-OG1 2.68Å; T624-Q626 VanDerWaalsContact C-N 3.31Å; T624-Q626 PolarHBondContact O-N 3.35Å
625	G	76.5	Confident	86.6	Confident	54 Å²	54	48.8 Å²	48.8	56%	0.557	28%	0.277	S	S	*	.	S	Bend	trans	80.7	0.1	177.3	0	0	0	0	0	115.4	S622 L623	S622-G625 PolarHBondContact O-N 2.92Å; L623-G625 VanDerWaalsContact C-N 3.33Å
626	Q	84.4	Confident	87.5	Confident	119 Å²	119	51.8 Å²	51.8	56%	0.556	29%	0.285	S	S	*	.			trans	-69.5	138.6	171.4	-53.7	-172.6	33	0	0	110.3	S622 T624 W628	S622-Q626 PolarHBondContact N-O 2.95Å; S622-Q626 WeakPolarHBondContact OG-CA 3.29Å; S622-Q626 WeakPolarHBondContact OG-CB 3.31Å; S622-Q626 PolarHBondContact OG-N 2.8Å; S622-Q626 PolarHBondContact OG-O 3.08Å; T624-Q626 VanDerWaalsContact C-N 3.31Å; T624-Q626 PolarHBondContact O-N 3.35Å; Q626-W628 HydrophobicContact CB-CH2 3.75Å; Q626-W628 HydrophobicContact CB-CZ2 4.13Å; Q626-W628 HydrophobicContact CB-CZ3 4.17Å; Q626-W628 WeakPolarHBondContact O-CZ3 3.49Å
627	T	87.9	Confident	87.6	Confident	72 Å²	72	50.8 Å²	50.8	44%	0.442	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	143.1	-175.5	61	0	0	0	0	112.8	I620 V621	I620-T627 CarbonylContact O-C 3.38Å; I620-T627 WeakPolarHBondContact O-CA 3.37Å; V621-T627 HydrophobicContact CB-CG2 4.43Å; V621-T627 HydrophobicContact CG1-CG2 4.12Å; V621-T627 HydrophobicContact CG2-CG2 3.96Å
628	W	92.1	Very high	87.6	Confident	34 Å²	34	50.4 Å²	50.4	13%	0.129	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	104.4	175.1	-56.3	-104.6	0	0	0	109.9	I462 I620 Q626 F630	I462-W628 HydrophobicContact CD1-CB 4Å; I462-W628 HydrophobicContact CD1-CD2 3.61Å; I462-W628 HydrophobicContact CD1-CE3 4.2Å; I462-W628 HydrophobicContact CD1-CG 3.5Å; I462-W628 VanDerWaalsContact CD1-CG 3.5Å; I462-W628 HydrophobicContact CG1-CD2 4.16Å; I462-W628 HydrophobicContact CG1-CG 4.41Å; I462-W628 HydrophobicContact CG1-CZ2 4.21Å; I462-W628 HydrophobicContact CG2-CE3 4.22Å; I462-W628 HydrophobicContact CG2-CH2 4.13Å; I462-W628 HydrophobicContact CG2-CZ2 4.4Å; I462-W628 HydrophobicContact CG2-CZ3 4.03Å; I620-W628 HydrophobicContact CB-CB 4.49Å; I620-W628 HydrophobicContact CB-CE3 4.23Å; I620-W628 HydrophobicContact CG2-CE3 4.18Å; I620-W628 PolarHBondContact N-O 3.44Å; I620-W628 PolarHBondContact O-N 3.24Å; Q626-W628 HydrophobicContact CB-CH2 3.75Å; Q626-W628 HydrophobicContact CB-CZ2 4.13Å; Q626-W628 HydrophobicContact CB-CZ3 4.17Å; Q626-W628 WeakPolarHBondContact O-CZ3 3.49Å; W628-F630 HydrophobicContact CB-CD2 4.18Å; W628-F630 HydrophobicContact CB-CE2 3.6Å; W628-F630 HydrophobicContact CB-CZ 4.38Å; W628-F630 WeakPolarHBondContact O-CD2 3.47Å
629	N	92	Very high	87.5	Confident	22 Å²	22	52.6 Å²	52.6	12%	0.118	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	126.4	171.8	-49.1	92.8	0	0	0	110.3	R422 W431 E617 I619	R422-N629 HydrophobicContact CB-CB 3.91Å; R422-N629 PolarHBondContact N-O 3.06Å; R422-N629 VanDerWaalsContact N-O 3.13Å; R422-N629 PolarHBondContact NH2-ND2 3.34Å; W431-N629 HydrophobicContact CH2-CB 4.14Å; W431-N629 HydrophobicContact CZ3-CB 4.38Å; E617-N629 WeakPolarHBondContact OE1-CB 3.4Å; E617-N629 PolarHBondContact OE1-ND2 3.17Å; I619-N629 WeakPolarHBondContact CD1-ND2 3.29Å; I619-N629 WeakPolarHBondContact CG1-ND2 3.39Å
630	F	94.2	Very high	87.5	Confident	1 Å²	1	55.1 Å²	55.1	0%	0.004	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	153.6	174.3	-70.3	-82.5	0	0	0	110	L419 L420 K421 V436 L444 Y446 I462 E617 F618 I620 W628	L419-F630 HydrophobicContact CB-CD1 3.99Å; L419-F630 HydrophobicContact CD1-CB 4.31Å; L419-F630 HydrophobicContact CD1-CD1 4.05Å; L419-F630 HydrophobicContact CD1-CG 4.35Å; L420-F630 CarbonylContact O-C 3.46Å; L420-F630 VanDerWaalsContact O-CA 3.23Å; L420-F630 WeakPolarHBondContact O-CA 3.49Å; K421-F630 HydrophobicContact CB-CD1 4.04Å; K421-F630 HydrophobicContact CB-CE1 4Å; K421-F630 HydrophobicContact CG-CD1 3.71Å; K421-F630 HydrophobicContact CG-CE1 3.37Å; K421-F630 HydrophobicContact CG-CG 4.5Å; K421-F630 HydrophobicContact CG-CZ 3.91Å; V436-F630 HydrophobicContact CG2-CE1 4.08Å; L444-F630 HydrophobicContact CD2-CZ 4.29Å; Y446-F630 HydrophobicContact CD1-CZ 4.21Å; Y446-F630 HydrophobicContact CG-CZ 4.42Å; I462-F630 HydrophobicContact CD1-CE2 4.13Å; I462-F630 HydrophobicContact CD1-CZ 4.28Å; E617-F630 CarbonylContact C-O 3.59Å; E617-F630 VanDerWaalsContact CA-O 3.26Å; E617-F630 WeakPolarHBondContact CA-O 3.33Å; F618-F630 HydrophobicContact CD1-CB 3.99Å; F618-F630 HydrophobicContact CD2-CB 4.4Å; F618-F630 HydrophobicContact CE1-CB 3.54Å; F618-F630 HydrophobicContact CE2-CB 3.98Å; F618-F630 HydrophobicContact CE2-CD2 4.28Å; F618-F630 HydrophobicContact CE2-CG 4.43Å; F618-F630 HydrophobicContact CG-CB 4.42Å; F618-F630 HydrophobicContact CZ-CB 3.55Å; F618-F630 HydrophobicContact CZ-CD2 4.45Å; F618-F630 HydrophobicContact CZ-CG 4.17Å; F618-F630 PolarHBondContact N-O 3.26Å; F618-F630 PolarHBondContact O-N 3.25Å; I620-F630 HydrophobicContact CD1-CD2 4.23Å; I620-F630 HydrophobicContact CD1-CE2 3.94Å; I620-F630 HydrophobicContact CG1-CD2 4.38Å; I620-F630 HydrophobicContact CG1-CE2 4.45Å; W628-F630 HydrophobicContact CB-CD2 4.18Å; W628-F630 HydrophobicContact CB-CE2 3.6Å; W628-F630 HydrophobicContact CB-CZ 4.38Å; W628-F630 WeakPolarHBondContact O-CD2 3.47Å
631	E	92.8	Very high	87.6	Confident	45 Å²	45	55.2 Å²	55.2	21%	0.21	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	129.4	-179.8	164.7	-173.4	-140.4	0	0	107.8	L420 W431 F616	L420-E631 HydrophobicContact CB-CB 3.93Å; L420-E631 HydrophobicContact CB-CG 4.23Å; L420-E631 HydrophobicContact CD1-CG 4.14Å; L420-E631 VanDerWaalsContact CD1-OE2 3.27Å; L420-E631 WeakPolarHBondContact CD1-OE2 3.14Å; L420-E631 PolarHBondContact N-O 3.06Å; L420-E631 PolarHBondContact O-N 2.97Å; W431-E631 VanDerWaalsContact CD2-OE2 3.28Å; W431-E631 HydrophobicContact CE3-CB 4.09Å; W431-E631 HydrophobicContact CH2-CB 3.68Å; W431-E631 HydrophobicContact CZ2-CB 4.21Å; W431-E631 HydrophobicContact CZ3-CB 3.6Å; F616-E631 WeakPolarHBondContact O-CA 3.46Å
632	A	92.1	Very high	87.8	Confident	6 Å²	6	54.4 Å²	54.4	5%	0.05	30%	0.298	C	S	.	.			trans	-94	171.2	-178.7	0	0	0	0	0	111.8	L419 F616 E637 R638	L419-A632 HydrophobicContact CD2-CB 3.87Å; F616-A632 PolarHBondContact O-N 3.19Å; A632-E637 HydrophobicContact CB-CB 4.12Å; A632-E637 HydrophobicContact CB-CG 4.48Å; A632-R638 HydrophobicContact CB-CB 3.88Å
633	S	88	Confident	88	Confident	89 Å²	89	59.7 Å²	59.7	62%	0.622	32%	0.321	S	S	*	.	S	Bend	trans	-82.1	-22.2	-179.1	63.9	0	0	0	0	114.4	E637	S633-E637 WeakPolarHBondContact CB-OE2 3.31Å; S633-E637 PolarHBondContact N-OE2 3.09Å; S633-E637 PolarHBondContact OG-OE2 3.21Å
634	T	89.5	Confident	88.7	Confident	54 Å²	54	55 Å²	55	33%	0.331	30%	0.299	S	S	.	.	S	Bend	trans	-143.8	171.3	172.8	81.1	0	0	0	0	111.1	E636 E637 R638	T634-E636 WeakPolarHBondContact CB-OE2 3.37Å; T634-E636 PolarHBondContact OG1-N 3.44Å; T634-E636 PolarHBondContact OG1-OE2 3.19Å; T634-E637 PolarHBondContact OG1-N 3.05Å; T634-E637 VanDerWaalsContact OG1-N 3.1Å; T634-R638 PolarHBondContact O-N 3.45Å; T634-R638 VanDerWaalsContact O-N 3.07Å
635	Y	84.9	Confident	89.4	Confident	99 Å²	99	50.2 Å²	50.2	39%	0.388	27%	0.27	S	S	.	.	H	α-helix	trans	-60.9	-46.5	172.7	177.8	-96.8	0	0	0	111.6	K474 E637 R638 E639	K474-Y635 PolarHBondContact NZ-OH 3.48Å; Y635-E637 VanDerWaalsContact C-N 3.34Å; Y635-E637 PolarHBondContact O-N 2.83Å; Y635-R638 WeakPolarHBondContact O-CB 3.25Å; Y635-R638 PolarHBondContact O-N 3.25Å; Y635-R638 VanDerWaalsContact O-N 3.09Å; Y635-E639 HydrophobicContact CD1-CG 4.1Å; Y635-E639 HydrophobicContact CD2-CG 4.43Å; Y635-E639 HydrophobicContact CE1-CG 3.62Å; Y635-E639 HydrophobicContact CE2-CG 3.99Å; Y635-E639 HydrophobicContact CG-CG 4.47Å; Y635-E639 WeakPolarHBondContact O-CG 3.12Å; Y635-E639 PolarHBondContact O-N 3.05Å
636	E	86.8	Confident	90	Very high	116 Å²	116	52.3 Å²	52.3	54%	0.542	27%	0.266	S	S	.	.	H	α-helix	trans	-62.8	-42.5	-179.6	-51.5	68.5	-144.4	0	0	110.6	T634 R638 E639 L640	T634-E636 WeakPolarHBondContact CB-OE2 3.37Å; T634-E636 PolarHBondContact OG1-N 3.44Å; T634-E636 PolarHBondContact OG1-OE2 3.19Å; E636-R638 VanDerWaalsContact C-N 3.3Å; E636-R638 PolarHBondContact O-N 2.87Å; E636-E639 PolarHBondContact O-N 3.35Å; E636-L640 VanDerWaalsContact O-CB 3.29Å; E636-L640 WeakPolarHBondContact O-CB 3.27Å; E636-L640 WeakPolarHBondContact O-CG 3.26Å; E636-L640 PolarHBondContact O-N 3.24Å
637	E	88.6	Confident	90	Very high	38 Å²	38	50.1 Å²	50.1	18%	0.178	26%	0.264	C	S	.	.	H	α-helix	trans	-62.2	-40	175	-156.3	-150.3	163.4	0	0	110.9	A632 S633 T634 Y635 W641	A632-E637 HydrophobicContact CB-CB 4.12Å; A632-E637 HydrophobicContact CB-CG 4.48Å; S633-E637 WeakPolarHBondContact CB-OE2 3.31Å; S633-E637 PolarHBondContact N-OE2 3.09Å; S633-E637 PolarHBondContact OG-OE2 3.21Å; T634-E637 PolarHBondContact OG1-N 3.05Å; T634-E637 VanDerWaalsContact OG1-N 3.1Å; Y635-E637 VanDerWaalsContact C-N 3.34Å; Y635-E637 PolarHBondContact O-N 2.83Å; E637-W641 PolarHBondContact O-N 3.2Å; E637-W641 PolarHBondContact OE1-NE1 2.92Å
638	R	90.9	Very high	90	Very high	13 Å²	13	47.4 Å²	47.4	5%	0.049	25%	0.246	C	C	.	.	H	α-helix	trans	-61.1	-55.5	175.4	-172.1	-176.2	76.8	-164.6	161.6	111.4	S615 F616 E617 F618 A632 T634 Y635 E636 L640 W641 V642	S615-R638 PolarHBondContact O-NH2 3.43Å; F616-R638 WeakPolarHBondContact O-CD 3.44Å; E617-R638 VanDerWaalsContact O-CD 3.31Å; E617-R638 WeakPolarHBondContact O-CD 3.48Å; E617-R638 PolarHBondContact O-NH2 3.4Å; F618-R638 HydrophobicContact CB-CG 4.26Å; F618-R638 HydrophobicContact CD1-CG 3.81Å; F618-R638 HydrophobicContact CG-CG 4.37Å; A632-R638 HydrophobicContact CB-CB 3.88Å; T634-R638 PolarHBondContact O-N 3.45Å; T634-R638 VanDerWaalsContact O-N 3.07Å; Y635-R638 WeakPolarHBondContact O-CB 3.25Å; Y635-R638 PolarHBondContact O-N 3.25Å; Y635-R638 VanDerWaalsContact O-N 3.09Å; E636-R638 VanDerWaalsContact C-N 3.3Å; E636-R638 PolarHBondContact O-N 2.87Å; R638-L640 PolarHBondContact O-N 3.5Å; R638-W641 WeakPolarHBondContact O-CA 3.46Å; R638-W641 PolarHBondContact O-N 3.09Å; R638-V642 HydrophobicContact CG-CG2 4.08Å; R638-V642 WeakPolarHBondContact O-CG2 3.17Å; R638-V642 PolarHBondContact O-N 3.06Å
639	E	90.6	Very high	89.6	Confident	46 Å²	46	46.8 Å²	46.8	22%	0.215	25%	0.245	C	C	.	.	H	α-helix	trans	-63.3	-34.7	-175.1	-53.3	-60.8	115.3	0	0	110.6	K474 Y635 E636 W641 V642 Q643	K474-E639 IonicContact NZ-OE1 3.05Å; K474-E639 IonicContact NZ-OE2 2.73Å; K474-E639 PolarHBondContact NZ-OE2 3.37Å; Y635-E639 HydrophobicContact CD1-CG 4.1Å; Y635-E639 HydrophobicContact CD2-CG 4.43Å; Y635-E639 HydrophobicContact CE1-CG 3.62Å; Y635-E639 HydrophobicContact CE2-CG 3.99Å; Y635-E639 HydrophobicContact CG-CG 4.47Å; Y635-E639 WeakPolarHBondContact O-CG 3.12Å; Y635-E639 PolarHBondContact O-N 3.05Å; E636-E639 PolarHBondContact O-N 3.35Å; E639-W641 VanDerWaalsContact C-N 3.35Å; E639-W641 PolarHBondContact O-N 3.49Å; E639-V642 PolarHBondContact O-N 3.06Å; E639-Q643 WeakPolarHBondContact O-CB 3.38Å; E639-Q643 PolarHBondContact O-N 3.38Å
640	L	91	Very high	89.1	Confident	89 Å²	89	51.6 Å²	51.6	47%	0.466	27%	0.265	S	S	.	.	H	α-helix	trans	-67.8	-25.4	171.5	-72.5	171.6	0	0	0	114.4	K415 E636 R638 A644	K415-L640 VanDerWaalsContact CE-O 3.25Å; K415-L640 WeakPolarHBondContact CE-O 3.45Å; K415-L640 PolarHBondContact NZ-O 3.2Å; E636-L640 VanDerWaalsContact O-CB 3.29Å; E636-L640 WeakPolarHBondContact O-CB 3.27Å; E636-L640 WeakPolarHBondContact O-CG 3.26Å; E636-L640 PolarHBondContact O-N 3.24Å; R638-L640 PolarHBondContact O-N 3.5Å; L640-A644 WeakPolarHBondContact O-CB 3.42Å; L640-A644 PolarHBondContact O-N 3.35Å
641	W	93.6	Very high	88.3	Confident	2 Å²	2	53.5 Å²	53.5	1%	0.008	28%	0.281	C	S	.	.	H	α-helix	trans	-79.7	-43.4	170.2	-87.4	109.4	0	0	0	111.5	K415 L419 V436 L438 F618 E637 R638 E639 A644 I645	K415-W641 HydrophobicContact CB-CH2 4.28Å; K415-W641 HydrophobicContact CB-CZ3 4.08Å; K415-W641 HydrophobicContact CD-CD2 3.71Å; K415-W641 HydrophobicContact CD-CE3 3.63Å; K415-W641 HydrophobicContact CD-CG 4.25Å; K415-W641 HydrophobicContact CD-CH2 4.29Å; K415-W641 HydrophobicContact CD-CZ2 4.37Å; K415-W641 HydrophobicContact CD-CZ3 3.93Å; K415-W641 VanDerWaalsContact CE-CD2 3.44Å; K415-W641 HydrophobicContact CG-CD2 4.36Å; K415-W641 HydrophobicContact CG-CE3 4.15Å; K415-W641 HydrophobicContact CG-CH2 3.91Å; K415-W641 HydrophobicContact CG-CZ2 4.12Å; K415-W641 HydrophobicContact CG-CZ3 3.92Å; L419-W641 HydrophobicContact CD1-CD2 3.99Å; L419-W641 HydrophobicContact CD1-CE3 4.38Å; L419-W641 HydrophobicContact CD1-CG 4.27Å; L419-W641 HydrophobicContact CD1-CZ2 4.41Å; L419-W641 HydrophobicContact CD2-CG 4.34Å; V436-W641 HydrophobicContact CB-CH2 4.15Å; V436-W641 HydrophobicContact CG1-CH2 4.1Å; V436-W641 HydrophobicContact CG1-CZ3 4.14Å; L438-W641 HydrophobicContact CB-CZ3 4.32Å; F618-W641 HydrophobicContact CE1-CB 4.26Å; F618-W641 HydrophobicContact CZ-CB 4.04Å; E637-W641 PolarHBondContact O-N 3.2Å; E637-W641 PolarHBondContact OE1-NE1 2.92Å; R638-W641 WeakPolarHBondContact O-CA 3.46Å; R638-W641 PolarHBondContact O-N 3.09Å; E639-W641 VanDerWaalsContact C-N 3.35Å; E639-W641 PolarHBondContact O-N 3.49Å; W641-A644 PolarHBondContact O-N 2.99Å; W641-I645 HydrophobicContact CE3-CD1 4.33Å; W641-I645 WeakPolarHBondContact O-CB 3.34Å; W641-I645 WeakPolarHBondContact O-CD1 3.36Å; W641-I645 WeakPolarHBondContact O-CG1 3.38Å; W641-I645 PolarHBondContact O-N 2.83Å
642	V	91.8	Very high	87.3	Confident	8 Å²	8	51.7 Å²	51.7	5%	0.048	27%	0.273	C	S	.	.	H	α-helix	trans	-59.1	-53.3	176.1	172.1	0	0	0	0	109.9	V469 V471 F618 R638 E639 A644 I645 E646	V469-V642 HydrophobicContact CG1-CB 4.4Å; V469-V642 HydrophobicContact CG1-CG1 3.98Å; V469-V642 HydrophobicContact CG1-CG2 4.01Å; V471-V642 HydrophobicContact CG2-CG1 4.4Å; V471-V642 HydrophobicContact CG2-CG2 3.94Å; F618-V642 HydrophobicContact CB-CG2 3.97Å; F618-V642 HydrophobicContact CD2-CG2 4.3Å; F618-V642 HydrophobicContact CG-CG2 4.1Å; R638-V642 HydrophobicContact CG-CG2 4.08Å; R638-V642 WeakPolarHBondContact O-CG2 3.17Å; R638-V642 PolarHBondContact O-N 3.06Å; E639-V642 PolarHBondContact O-N 3.06Å; V642-A644 VanDerWaalsContact C-N 3.33Å; V642-A644 PolarHBondContact O-N 3.43Å; V642-I645 PolarHBondContact O-N 3.28Å; V642-E646 HydrophobicContact CG1-CG 4.24Å; V642-E646 WeakPolarHBondContact O-CB 3.44Å; V642-E646 WeakPolarHBondContact O-CG 3.27Å; V642-E646 PolarHBondContact O-N 3.31Å
643	Q	90.6	Very high	86.4	Confident	127 Å²	127	55.5 Å²	55.5	59%	0.593	29%	0.292	S	S	*	.	H	α-helix	trans	-58.1	-41.8	178.7	-174.2	-174.9	13.6	0	0	112.4	E639 S647	E639-Q643 WeakPolarHBondContact O-CB 3.38Å; E639-Q643 PolarHBondContact O-N 3.38Å; Q643-S647 WeakPolarHBondContact O-CB 3.41Å; Q643-S647 PolarHBondContact O-N 3.44Å
644	A	87.9	Confident	85.2	Confident	21 Å²	21	55.8 Å²	55.8	17%	0.174	28%	0.284	C	S	.	.	H	α-helix	trans	-67.3	-40.2	178.3	0	0	0	0	0	112.3	K415 L438 L640 W641 V642 Q648	K415-A644 HydrophobicContact CB-CB 4.46Å; K415-A644 HydrophobicContact CD-CB 3.62Å; L438-A644 HydrophobicContact CD2-CB 3.86Å; L438-A644 WeakPolarHBondContact CD2-O 3.34Å; L640-A644 WeakPolarHBondContact O-CB 3.42Å; L640-A644 PolarHBondContact O-N 3.35Å; W641-A644 PolarHBondContact O-N 2.99Å; V642-A644 VanDerWaalsContact C-N 3.33Å; V642-A644 PolarHBondContact O-N 3.43Å; A644-Q648 WeakPolarHBondContact O-CB 3.36Å; A644-Q648 PolarHBondContact O-N 3.17Å
645	I	91.3	Very high	83.6	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-71.5	-42	178.1	-64.1	163.2	0	0	0	110.7	L438 L444 L464 V469 F618 I620 W641 V642 Q648 I649	L438-I645 HydrophobicContact CD2-CG1 4.27Å; L444-I645 HydrophobicContact CD1-CD1 3.6Å; L444-I645 HydrophobicContact CD1-CG1 3.76Å; L464-I645 HydrophobicContact CD1-CG2 4.02Å; L464-I645 HydrophobicContact CD2-CG2 3.93Å; V469-I645 HydrophobicContact CG2-CB 4.02Å; V469-I645 HydrophobicContact CG2-CG2 3.42Å; V469-I645 VanDerWaalsContact CG2-CG2 3.42Å; F618-I645 HydrophobicContact CE2-CD1 3.7Å; F618-I645 HydrophobicContact CZ-CD1 4.22Å; I620-I645 HydrophobicContact CD1-CD1 4.18Å; W641-I645 HydrophobicContact CE3-CD1 4.33Å; W641-I645 WeakPolarHBondContact O-CB 3.34Å; W641-I645 WeakPolarHBondContact O-CD1 3.36Å; W641-I645 WeakPolarHBondContact O-CG1 3.38Å; W641-I645 PolarHBondContact O-N 2.83Å; V642-I645 PolarHBondContact O-N 3.28Å; I645-Q648 PolarHBondContact O-N 2.61Å; I645-I649 HydrophobicContact CG2-CD1 3.97Å; I645-I649 HydrophobicContact CG2-CG1 4.5Å; I645-I649 VanDerWaalsContact O-CG1 3.23Å; I645-I649 WeakPolarHBondContact O-CG1 3.18Å; I645-I649 PolarHBondContact O-N 2.84Å
646	E	88.8	Confident	81.9	Confident	97 Å²	97	53.6 Å²	53.6	45%	0.453	28%	0.284	S	S	.	.	H	α-helix	trans	-64.9	-42.1	175.7	-71.6	179.5	160.7	0	0	111.8	V469 V642 I649 F650	V469-E646 HydrophobicContact CB-CG 4.07Å; V469-E646 HydrophobicContact CG2-CG 3.98Å; V642-E646 HydrophobicContact CG1-CG 4.24Å; V642-E646 WeakPolarHBondContact O-CB 3.44Å; V642-E646 WeakPolarHBondContact O-CG 3.27Å; V642-E646 PolarHBondContact O-N 3.31Å; E646-I649 PolarHBondContact O-N 2.86Å; E646-F650 WeakPolarHBondContact O-CB 3.37Å; E646-F650 PolarHBondContact O-N 3.46Å
647	S	85.6	Confident	79.8	Confident	74 Å²	74	53.8 Å²	53.8	52%	0.517	29%	0.285	S	S	.	.	H	α-helix	trans	-60.1	-44.8	171.9	-175.3	0	0	0	0	111.4	Q643 F650 A651	Q643-S647 WeakPolarHBondContact O-CB 3.41Å; Q643-S647 PolarHBondContact O-N 3.44Å; S647-F650 PolarHBondContact O-N 2.97Å; S647-A651 VanDerWaalsContact O-CB 3.31Å; S647-A651 WeakPolarHBondContact O-CB 3.2Å; S647-A651 PolarHBondContact O-N 2.95Å
648	Q	86.2	Confident	77.3	Confident	14 Å²	14	55 Å²	55	7%	0.065	30%	0.298	C	S	.	.	H	α-helix	trans	-68.7	-35.4	177.3	-174.6	58.7	42.5	0	0	112.8	L438 D440 L464 A644 I645 S652	L438-Q648 HydrophobicContact CD1-CB 4.07Å; L438-Q648 HydrophobicContact CD1-CG 3.95Å; L438-Q648 HydrophobicContact CD2-CB 4.24Å; L438-Q648 HydrophobicContact CG-CB 4.47Å; D440-Q648 PolarHBondContact O-NE2 2.9Å; L464-Q648 HydrophobicContact CD1-CB 4.3Å; L464-Q648 HydrophobicContact CD1-CG 4.09Å; A644-Q648 WeakPolarHBondContact O-CB 3.36Å; A644-Q648 PolarHBondContact O-N 3.17Å; I645-Q648 PolarHBondContact O-N 2.61Å; Q648-S652 PolarHBondContact NE2-OG 2.8Å; Q648-S652 VanDerWaalsContact NE2-OG 3.13Å; Q648-S652 VanDerWaalsContact O-CB 3.27Å; Q648-S652 WeakPolarHBondContact O-CB 3.5Å; Q648-S652 PolarHBondContact O-N 3.23Å; Q648-S652 PolarHBondContact O-OG 2.62Å
649	I	85.2	Confident	74.9	Confident	21 Å²	21	60 Å²	60	11%	0.108	32%	0.324	C	S	.	.	H	α-helix	trans	-59.7	-49.4	170.8	-71	162.6	0	0	0	109.3	L464 V469 I645 E646 S652 L653	L464-I649 HydrophobicContact CB-CG1 3.83Å; V469-I649 HydrophobicContact CG2-CD1 4.07Å; I645-I649 HydrophobicContact CG2-CD1 3.97Å; I645-I649 HydrophobicContact CG2-CG1 4.5Å; I645-I649 VanDerWaalsContact O-CG1 3.23Å; I645-I649 WeakPolarHBondContact O-CG1 3.18Å; I645-I649 PolarHBondContact O-N 2.84Å; E646-I649 PolarHBondContact O-N 2.86Å; I649-S652 PolarHBondContact O-N 3.4Å; I649-L653 HydrophobicContact CG2-CD1 3.99Å; I649-L653 WeakPolarHBondContact O-CG 3.21Å; I649-L653 PolarHBondContact O-N 3.22Å
650	F	80.4	Confident	72.6	Confident	124 Å²	124	62.1 Å²	62.1	54%	0.544	33%	0.333	S	S	.	.	H	α-helix	trans	-62.9	-45.5	-179.7	-168.9	-107.3	0	0	0	112.2	E646 S647 S652 L653 Q654	E646-F650 WeakPolarHBondContact O-CB 3.37Å; E646-F650 PolarHBondContact O-N 3.46Å; S647-F650 PolarHBondContact O-N 2.97Å; F650-S652 VanDerWaalsContact C-N 3.3Å; F650-S652 PolarHBondContact O-N 2.87Å; F650-L653 PolarHBondContact O-N 2.89Å; F650-Q654 HydrophobicContact CD1-CG 4.45Å; F650-Q654 VanDerWaalsContact CE1-CD 3.46Å; F650-Q654 HydrophobicContact CE1-CG 4.27Å; F650-Q654 VanDerWaalsContact CE1-NE2 3.29Å; F650-Q654 WeakPolarHBondContact O-CB 3.37Å; F650-Q654 WeakPolarHBondContact O-CG 3.48Å; F650-Q654 PolarHBondContact O-N 2.91Å
651	A	76.8	Confident	70	Confident	40 Å²	40	61.4 Å²	61.4	33%	0.331	33%	0.329	S	S	.	.	H	α-helix	trans	-63.8	-32.6	174.8	0	0	0	0	0	112.8	S647 S655	S647-A651 VanDerWaalsContact O-CB 3.31Å; S647-A651 WeakPolarHBondContact O-CB 3.2Å; S647-A651 PolarHBondContact O-N 2.95Å; A651-S655 VanDerWaalsContact O-CB 3.3Å; A651-S655 WeakPolarHBondContact O-CB 3.47Å; A651-S655 PolarHBondContact O-N 2.84Å; A651-S655 PolarHBondContact O-OG 3.31Å
652	S	73.1	Confident	67.2	Low	7 Å²	7	70.3 Å²	70.3	5%	0.049	37%	0.368	C	S	.	.	H	α-helix	trans	-73	-35.8	175.1	-54.1	0	0	0	0	112	G442 Q648 I649 F650 S655 C656	G442-S652 WeakPolarHBondContact CA-OG 3.48Å; Q648-S652 PolarHBondContact NE2-OG 2.8Å; Q648-S652 VanDerWaalsContact NE2-OG 3.13Å; Q648-S652 VanDerWaalsContact O-CB 3.27Å; Q648-S652 WeakPolarHBondContact O-CB 3.5Å; Q648-S652 PolarHBondContact O-N 3.23Å; Q648-S652 PolarHBondContact O-OG 2.62Å; I649-S652 PolarHBondContact O-N 3.4Å; F650-S652 VanDerWaalsContact C-N 3.3Å; F650-S652 PolarHBondContact O-N 2.87Å; S652-S655 WeakPolarHBondContact CA-OG 3.4Å; S652-S655 PolarHBondContact O-OG 2.93Å; S652-S655 VanDerWaalsContact O-OG 3.07Å; S652-C656 PolarHBondContact O-N 2.85Å; S652-C656 VanDerWaalsContact O-N 3.13Å; S652-C656 PolarHBondContact O-SG 2.82Å
653	L	72.2	Confident	64.7	Low	87 Å²	87	73.1 Å²	73.1	46%	0.455	39%	0.389	S	S	.	.	H	α-helix	trans	-67.9	-43.7	172.1	-67.3	167.6	0	0	0	111.1	L465 I649 F650 S655 C656 E657	L465-L653 HydrophobicContact CD1-CD2 4.11Å; I649-L653 HydrophobicContact CG2-CD1 3.99Å; I649-L653 WeakPolarHBondContact O-CG 3.21Å; I649-L653 PolarHBondContact O-N 3.22Å; F650-L653 PolarHBondContact O-N 2.89Å; L653-S655 VanDerWaalsContact C-N 3.34Å; L653-S655 PolarHBondContact O-N 3.34Å; L653-C656 WeakPolarHBondContact O-CB 3.42Å; L653-C656 PolarHBondContact O-N 2.92Å; L653-E657 PolarHBondContact O-N 3.17Å; L653-E657 VanDerWaalsContact O-N 3.15Å
654	Q	64.2	Low	62.4	Low	95 Å²	95	74.7 Å²	74.7	44%	0.444	39%	0.389	S	S	.	.	H	α-helix	trans	-68.4	-27.5	174.9	-72.1	-170.5	-33.3	0	0	113.5	F650 E657 S658	F650-Q654 HydrophobicContact CD1-CG 4.45Å; F650-Q654 VanDerWaalsContact CE1-CD 3.46Å; F650-Q654 HydrophobicContact CE1-CG 4.27Å; F650-Q654 VanDerWaalsContact CE1-NE2 3.29Å; F650-Q654 WeakPolarHBondContact O-CB 3.37Å; F650-Q654 WeakPolarHBondContact O-CG 3.48Å; F650-Q654 PolarHBondContact O-N 2.91Å; Q654-E657 CarbonylContact O-C 3.55Å; Q654-E657 WeakPolarHBondContact O-CB 3.2Å; Q654-E657 PolarHBondContact O-N 3Å; Q654-S658 PolarHBondContact O-N 3.4Å
655	S	55.3	Low	60	Low	51 Å²	51	82.2 Å²	82.2	36%	0.357	43%	0.425	S	S	.	.	H	α-helix	trans	-76.4	-29	173.1	73.1	0	0	0	0	112.2	A651 S652 L653 E657 S658 I659	A651-S655 VanDerWaalsContact O-CB 3.3Å; A651-S655 WeakPolarHBondContact O-CB 3.47Å; A651-S655 PolarHBondContact O-N 2.84Å; A651-S655 PolarHBondContact O-OG 3.31Å; S652-S655 WeakPolarHBondContact CA-OG 3.4Å; S652-S655 PolarHBondContact O-OG 2.93Å; S652-S655 VanDerWaalsContact O-OG 3.07Å; L653-S655 VanDerWaalsContact C-N 3.34Å; L653-S655 PolarHBondContact O-N 3.34Å; S655-E657 VanDerWaalsContact C-N 3.3Å; S655-E657 PolarHBondContact O-N 3.34Å; S655-S658 WeakPolarHBondContact CA-OG 3.36Å; S655-S658 PolarHBondContact O-N 3.46Å; S655-S658 PolarHBondContact O-OG 2.83Å; S655-I659 VanDerWaalsContact O-CG1 3.28Å; S655-I659 WeakPolarHBondContact O-CG1 3.11Å; S655-I659 PolarHBondContact O-N 3.45Å
656	C	49.2	Very low	57.6	Low	55 Å²	55	82.9 Å²	82.9	37%	0.372	43%	0.433	S	S	.	.	H	α-helix	trans	-62.9	-35.5	163.6	-70.6	0	0	0	0	112.3	S652 L653 K660	S652-C656 PolarHBondContact O-N 2.85Å; S652-C656 VanDerWaalsContact O-N 3.13Å; S652-C656 PolarHBondContact O-SG 2.82Å; L653-C656 WeakPolarHBondContact O-CB 3.42Å; L653-C656 PolarHBondContact O-N 2.92Å; C656-K660 PolarHBondContact O-N 3.38Å
657	E	42.1	Very low	55.8	Low	120 Å²	120	81.4 Å²	81.4	56%	0.561	43%	0.433	S	S	*	.	H	α-helix	trans	-70.4	-32.9	169.8	-63.6	-177.9	145	0	0	112.8	L653 Q654 S655 K660 N661	L653-E657 PolarHBondContact O-N 3.17Å; L653-E657 VanDerWaalsContact O-N 3.15Å; Q654-E657 CarbonylContact O-C 3.55Å; Q654-E657 WeakPolarHBondContact O-CB 3.2Å; Q654-E657 PolarHBondContact O-N 3Å; S655-E657 VanDerWaalsContact C-N 3.3Å; S655-E657 PolarHBondContact O-N 3.34Å; E657-K660 CarbonylContact O-C 3.59Å; E657-K660 WeakPolarHBondContact O-CB 3.49Å; E657-K660 PolarHBondContact O-N 2.84Å; E657-N661 PolarHBondContact O-N 2.84Å; E657-N661 VanDerWaalsContact O-N 3.09Å; E657-N661 PolarHBondContact O-ND2 3.31Å
658	S	36.7	Very low	54.3	Low	64 Å²	64	84.5 Å²	84.5	45%	0.448	44%	0.439	S	S	.	.	H	α-helix	trans	-75.7	-27.2	177.4	85.6	0	0	0	0	113.2	Q654 S655 N661 K662	Q654-S658 PolarHBondContact O-N 3.4Å; S655-S658 WeakPolarHBondContact CA-OG 3.36Å; S655-S658 PolarHBondContact O-N 3.46Å; S655-S658 PolarHBondContact O-OG 2.83Å; S658-N661 WeakPolarHBondContact O-CA 3.48Å; S658-N661 WeakPolarHBondContact O-CB 3.23Å; S658-N661 PolarHBondContact O-N 2.97Å; S658-K662 PolarHBondContact O-N 2.97Å
659	I	40.7	Very low	53.1	Low	118 Å²	118	87 Å²	87	61%	0.605	46%	0.458	S	S	*	.	H	α-helix	trans	-64	-41.7	167.4	-70.5	163.8	0	0	0	110.3	S655 N661 K662	S655-I659 VanDerWaalsContact O-CG1 3.28Å; S655-I659 WeakPolarHBondContact O-CG1 3.11Å; S655-I659 PolarHBondContact O-N 3.45Å; I659-N661 PolarHBondContact O-N 2.99Å; I659-K662 PolarHBondContact O-N 3.43Å; I659-K662 VanDerWaalsContact O-N 3.07Å
660	K	41	Very low	52.3	Low	91 Å²	91	88.5 Å²	88.5	40%	0.396	47%	0.466	S	S	.	.	H	α-helix	trans	-64.2	-18.4	168.3	-68.9	165	160.9	-87.6	0	113.8	C656 E657 S663 D730	C656-K660 PolarHBondContact O-N 3.38Å; E657-K660 CarbonylContact O-C 3.59Å; E657-K660 WeakPolarHBondContact O-CB 3.49Å; E657-K660 PolarHBondContact O-N 2.84Å; K660-S663 PolarHBondContact O-OG 3.07Å; K660-D730 IonicContact NZ-OD1 2.94Å; K660-D730 PolarHBondContact NZ-OD1 3.06Å; K660-D730 IonicContact NZ-OD2 3.36Å; K660-D730 PolarHBondContact NZ-OD2 2.8Å
661	N	36.6	Very low	52.2	Low	73 Å²	73	85.3 Å²	85.3	39%	0.39	46%	0.463	S	S	.	.	H	α-helix	trans	-83.5	-17.7	171.9	-71.7	-43.9	0	0	0	113	E657 S658 I659 S663 R664	E657-N661 PolarHBondContact O-N 2.84Å; E657-N661 VanDerWaalsContact O-N 3.09Å; E657-N661 PolarHBondContact O-ND2 3.31Å; S658-N661 WeakPolarHBondContact O-CA 3.48Å; S658-N661 WeakPolarHBondContact O-CB 3.23Å; S658-N661 PolarHBondContact O-N 2.97Å; I659-N661 PolarHBondContact O-N 2.99Å; N661-S663 VanDerWaalsContact C-N 3.31Å; N661-S663 PolarHBondContact O-N 2.95Å; N661-R664 WeakPolarHBondContact O-CB 3.32Å; N661-R664 PolarHBondContact O-N 3.43Å; N661-R664 VanDerWaalsContact O-N 3.15Å; N661-R664 WeakPolarHBondContact OD1-CD 3.39Å; N661-R664 PolarHBondContact OD1-NE 3.09Å; N661-R664 PolarHBondContact OD1-NH1 3.44Å
662	K	36.2	Very low	52.5	Low	189 Å²	189	88.9 Å²	88.9	82%	0.822	47%	0.474	S	S	*	.	H	α-helix	trans	-73.9	-19.4	174.8	-103.8	-177.6	177.5	177	0	113.9	S658 I659 R664	S658-K662 PolarHBondContact O-N 2.97Å; I659-K662 PolarHBondContact O-N 3.43Å; I659-K662 VanDerWaalsContact O-N 3.07Å; K662-R664 VanDerWaalsContact C-N 3.34Å
663	S	38.6	Very low	53	Low	68 Å²	68	89.7 Å²	89.7	48%	0.476	48%	0.481	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-9.4	167.2	49.4	0	0	0	0	113.6	K660 N661 L665 G666	K660-S663 PolarHBondContact O-OG 3.07Å; N661-S663 VanDerWaalsContact C-N 3.31Å; N661-S663 PolarHBondContact O-N 2.95Å; S663-L665 PolarHBondContact O-N 2.86Å; S663-G666 PolarHBondContact O-N 3.49Å
664	R	41.9	Very low	53.9	Low	159 Å²	159	86.6 Å²	86.6	60%	0.6	47%	0.465	S	S	*	.	G	3₁₀ helix	trans	-68.9	1.1	-173.5	-78.3	-171	170.2	172.8	-2.3	116.7	N661 K662 G666 S667	N661-R664 WeakPolarHBondContact O-CB 3.32Å; N661-R664 PolarHBondContact O-N 3.43Å; N661-R664 VanDerWaalsContact O-N 3.15Å; N661-R664 WeakPolarHBondContact OD1-CD 3.39Å; N661-R664 PolarHBondContact OD1-NE 3.09Å; N661-R664 PolarHBondContact OD1-NH1 3.44Å; K662-R664 VanDerWaalsContact C-N 3.34Å; R664-G666 PolarHBondContact O-N 2.91Å; R664-S667 WeakPolarHBondContact O-CB 3.47Å; R664-S667 PolarHBondContact O-N 2.89Å
665	L	37.2	Very low	55.2	Low	179 Å²	179	86.6 Å²	86.6	94%	0.937	47%	0.465	S	S	*	.	G	3₁₀ helix	trans	-61.1	-22.9	157.1	-82	166.6	0	0	0	111.7	S663	S663-L665 PolarHBondContact O-N 2.86Å
666	G	41.3	Very low	57	Low	15 Å²	15	86.8 Å²	86.8	16%	0.155	47%	0.466	C	S	.	.	G	3₁₀ helix	trans	-79.8	-9.6	166.7	0	0	0	0	0	115.2	S663 R664 Q668 S669 D670	S663-G666 PolarHBondContact O-N 3.49Å; R664-G666 PolarHBondContact O-N 2.91Å; G666-Q668 CarbonylContact O-C 3.47Å; G666-Q668 PolarHBondContact O-N 2.95Å; G666-S669 VanDerWaalsContact CA-OG 3.24Å; G666-S669 WeakPolarHBondContact CA-OG 3.35Å; G666-S669 CarbonylContact O-C 3.54Å; G666-S669 WeakPolarHBondContact O-CA 3.33Å; G666-S669 PolarHBondContact O-N 2.82Å; G666-S669 PolarHBondContact O-OG 2.62Å; G666-D670 VanDerWaalsContact C-CG 3.45Å; G666-D670 VanDerWaalsContact C-OD2 3.27Å; G666-D670 WeakPolarHBondContact O-CB 3.46Å; G666-D670 PolarHBondContact O-N 3.1Å
667	S	51.7	Low	59.2	Low	66 Å²	66	84.2 Å²	84.2	46%	0.462	45%	0.449	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-9.5	-167.7	95.8	0	0	0	0	115.1	R664 A671	R664-S667 WeakPolarHBondContact O-CB 3.47Å; R664-S667 PolarHBondContact O-N 2.89Å; S667-A671 WeakPolarHBondContact O-CB 3.45Å
668	Q	52.8	Low	61.8	Low	139 Å²	139	81.8 Å²	81.8	65%	0.65	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	-42.1	165.5	-170.2	175.2	21.8	0	0	112.5	G666 D670 M672	G666-Q668 CarbonylContact O-C 3.47Å; G666-Q668 PolarHBondContact O-N 2.95Å; Q668-D670 VanDerWaalsContact C-N 3.33Å; Q668-M672 HydrophobicContact CG-CE 3.89Å; Q668-M672 HydrophobicContact CG-SD 4.35Å; Q668-M672 WeakPolarHBondContact O-CB 3.3Å; Q668-M672 VanDerWaalsContact O-CG 3.25Å; Q668-M672 WeakPolarHBondContact O-CG 3.22Å; Q668-M672 PolarHBondContact O-N 2.6Å
669	S	62.8	Low	64.6	Low	66 Å²	66	84.1 Å²	84.1	46%	0.462	44%	0.442	S	S	.	.	H	α-helix	trans	-64.3	-38.5	173.9	51.6	0	0	0	0	112	G666 M672 A673	G666-S669 VanDerWaalsContact CA-OG 3.24Å; G666-S669 WeakPolarHBondContact CA-OG 3.35Å; G666-S669 CarbonylContact O-C 3.54Å; G666-S669 WeakPolarHBondContact O-CA 3.33Å; G666-S669 PolarHBondContact O-N 2.82Å; G666-S669 PolarHBondContact O-OG 2.62Å; S669-M672 CarbonylContact O-C 3.55Å; S669-M672 PolarHBondContact O-N 3.31Å; S669-A673 VanDerWaalsContact O-CB 3.29Å; S669-A673 WeakPolarHBondContact O-CB 3.42Å; S669-A673 PolarHBondContact O-N 3Å
670	D	67.8	Low	67.2	Low	53 Å²	53	79.8 Å²	79.8	28%	0.283	42%	0.421	S	S	.	.	H	α-helix	trans	-70.4	-41.8	-177.6	-48.3	-15.2	0	0	0	109.6	G666 Q668 M672 A673 I674	G666-D670 VanDerWaalsContact C-CG 3.45Å; G666-D670 VanDerWaalsContact C-OD2 3.27Å; G666-D670 WeakPolarHBondContact O-CB 3.46Å; G666-D670 PolarHBondContact O-N 3.1Å; Q668-D670 VanDerWaalsContact C-N 3.33Å; D670-M672 PolarHBondContact O-N 2.99Å; D670-A673 PolarHBondContact O-N 3.43Å; D670-I674 WeakPolarHBondContact O-CB 3.28Å; D670-I674 WeakPolarHBondContact O-CD1 3.36Å; D670-I674 VanDerWaalsContact O-CG1 3.26Å; D670-I674 WeakPolarHBondContact O-CG1 3.12Å; D670-I674 PolarHBondContact O-N 3.11Å
671	A	77.3	Confident	69.9	Low	57 Å²	57	85.6 Å²	85.6	47%	0.471	44%	0.441	S	S	.	.	H	α-helix	trans	-63.7	-38.6	171.9	0	0	0	0	0	112.3	S667 Q675	S667-A671 WeakPolarHBondContact O-CB 3.45Å; A671-Q675 WeakPolarHBondContact O-CB 3.29Å; A671-Q675 PolarHBondContact O-N 3.44Å
672	M	83.4	Confident	72.8	Confident	114 Å²	114	83.6 Å²	83.6	56%	0.562	44%	0.437	S	S	*	.	H	α-helix	trans	-68.6	-35.6	173.2	-73.7	175.3	177.6	0	0	112.6	Q668 S669 D670 S676	Q668-M672 HydrophobicContact CG-CE 3.89Å; Q668-M672 HydrophobicContact CG-SD 4.35Å; Q668-M672 WeakPolarHBondContact O-CB 3.3Å; Q668-M672 VanDerWaalsContact O-CG 3.25Å; Q668-M672 WeakPolarHBondContact O-CG 3.22Å; Q668-M672 PolarHBondContact O-N 2.6Å; S669-M672 CarbonylContact O-C 3.55Å; S669-M672 PolarHBondContact O-N 3.31Å; D670-M672 PolarHBondContact O-N 2.99Å; M672-S676 WeakPolarHBondContact O-CB 3.19Å; M672-S676 PolarHBondContact O-N 3.02Å; M672-S676 PolarHBondContact O-OG 3.34Å
673	A	84.8	Confident	75.7	Confident	24 Å²	24	74.7 Å²	74.7	20%	0.198	40%	0.398	C	S	.	.	H	α-helix	trans	-68.9	-49	176.3	0	0	0	0	0	110.8	S669 D670 Q675 S676 I677	S669-A673 VanDerWaalsContact O-CB 3.29Å; S669-A673 WeakPolarHBondContact O-CB 3.42Å; S669-A673 PolarHBondContact O-N 3Å; D670-A673 PolarHBondContact O-N 3.43Å; A673-Q675 VanDerWaalsContact C-N 3.29Å; A673-Q675 PolarHBondContact O-N 3.44Å; A673-S676 CarbonylContact O-C 3.49Å; A673-S676 WeakPolarHBondContact O-CA 3.18Å; A673-S676 WeakPolarHBondContact O-CB 3.38Å; A673-S676 PolarHBondContact O-N 3.11Å; A673-I677 VanDerWaalsContact O-CG1 3.31Å; A673-I677 WeakPolarHBondContact O-CG1 3.47Å; A673-I677 PolarHBondContact O-N 3.07Å
674	I	90.5	Very high	78.5	Confident	23 Å²	23	74.2 Å²	74.2	12%	0.118	40%	0.395	C	S	.	.	H	α-helix	trans	-58.7	-40.3	173.9	-68.8	160.1	0	0	0	111	D670 I677 R678 L726 W731	D670-I674 WeakPolarHBondContact O-CB 3.28Å; D670-I674 WeakPolarHBondContact O-CD1 3.36Å; D670-I674 VanDerWaalsContact O-CG1 3.26Å; D670-I674 WeakPolarHBondContact O-CG1 3.12Å; D670-I674 PolarHBondContact O-N 3.11Å; I674-I677 PolarHBondContact O-N 3.4Å; I674-R678 VanDerWaalsContact CG2-NH1 3.32Å; I674-R678 WeakPolarHBondContact O-CG 3.41Å; I674-R678 PolarHBondContact O-N 3.05Å; I674-L726 WeakPolarHBondContact CD1-O 3.48Å; I674-L726 HydrophobicContact CG2-CB 4.08Å; I674-L726 HydrophobicContact CG2-CD1 4.35Å; I674-L726 HydrophobicContact CG2-CD2 4.4Å; I674-W731 HydrophobicContact CD1-CG 4.49Å; I674-W731 HydrophobicContact CG1-CG 4.34Å
675	Q	90.8	Very high	81.2	Confident	94 Å²	94	71.7 Å²	71.7	44%	0.439	39%	0.388	S	S	.	.	H	α-helix	trans	-67.4	-37	173.8	-170.3	59.8	54.6	0	0	112.4	A671 A673 I677 R678 N679	A671-Q675 WeakPolarHBondContact O-CB 3.29Å; A671-Q675 PolarHBondContact O-N 3.44Å; A673-Q675 VanDerWaalsContact C-N 3.29Å; A673-Q675 PolarHBondContact O-N 3.44Å; Q675-I677 VanDerWaalsContact C-N 3.35Å; Q675-R678 PolarHBondContact O-N 3.11Å; Q675-N679 PolarHBondContact NE2-OD1 2.81Å; Q675-N679 WeakPolarHBondContact O-CB 3.31Å; Q675-N679 PolarHBondContact O-N 2.97Å; Q675-N679 PolarHBondContact O-ND2 2.79Å; Q675-N679 PolarHBondContact O-OD1 2.77Å
676	S	93.8	Very high	84.1	Confident	56 Å²	56	63.1 Å²	63.1	39%	0.392	34%	0.344	S	S	.	.	H	α-helix	trans	-63.4	-41.2	173.8	-60.2	0	0	0	0	111.4	M672 A673 N679 V680	M672-S676 WeakPolarHBondContact O-CB 3.19Å; M672-S676 PolarHBondContact O-N 3.02Å; M672-S676 PolarHBondContact O-OG 3.34Å; A673-S676 CarbonylContact O-C 3.49Å; A673-S676 WeakPolarHBondContact O-CA 3.18Å; A673-S676 WeakPolarHBondContact O-CB 3.38Å; A673-S676 PolarHBondContact O-N 3.11Å; S676-N679 PolarHBondContact O-N 3.45Å; S676-N679 VanDerWaalsContact O-N 3.16Å; S676-V680 WeakPolarHBondContact O-CG2 3.3Å; S676-V680 PolarHBondContact O-N 2.56Å
677	I	96.3	Very high	86.8	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-61.2	-47.8	173	-64.2	165.3	0	0	0	110.6	A673 I674 Q675 N679 V680 N683 L704 L726 W731 M739	A673-I677 VanDerWaalsContact O-CG1 3.31Å; A673-I677 WeakPolarHBondContact O-CG1 3.47Å; A673-I677 PolarHBondContact O-N 3.07Å; I674-I677 PolarHBondContact O-N 3.4Å; Q675-I677 VanDerWaalsContact C-N 3.35Å; I677-N679 PolarHBondContact O-N 3.27Å; I677-V680 WeakPolarHBondContact O-CG2 3.22Å; I677-V680 PolarHBondContact O-N 3.24Å; I677-N683 WeakPolarHBondContact O-CB 3.31Å; I677-N683 PolarHBondContact O-ND2 3.29Å; I677-L704 HydrophobicContact CG2-CD1 4.16Å; I677-L704 HydrophobicContact CG2-CD2 3.95Å; I677-L704 HydrophobicContact CG2-CG 4.3Å; I677-L726 HydrophobicContact CG2-CD2 4.16Å; I677-W731 HydrophobicContact CD1-CE3 4.2Å; I677-W731 HydrophobicContact CD1-CZ3 4.33Å; I677-M739 HydrophobicContact CB-CB 4.48Å; I677-M739 HydrophobicContact CD1-CB 3.78Å; I677-M739 HydrophobicContact CD1-CG 4.44Å; I677-M739 HydrophobicContact CG1-CB 3.75Å; I677-M739 HydrophobicContact CG2-CB 3.9Å; I677-M739 HydrophobicContact CG2-CE 4.3Å
678	R	95.6	Very high	89	Confident	69 Å²	69	59.4 Å²	59.4	26%	0.26	32%	0.315	S	S	.	.	H	α-helix	trans	-60.1	-28.6	175.1	-74.5	178.7	170.2	126.9	-0.2	112.6	I674 Q675 D695 L726 D727	I674-R678 VanDerWaalsContact CG2-NH1 3.32Å; I674-R678 WeakPolarHBondContact O-CG 3.41Å; I674-R678 PolarHBondContact O-N 3.05Å; Q675-R678 PolarHBondContact O-N 3.11Å; R678-D695 IonicContact CZ-OD1 2.7Å; R678-D695 VanDerWaalsContact CZ-OD1 3.3Å; R678-D695 IonicContact NE-OD1 2.77Å; R678-D695 PolarHBondContact NE-OD1 3.09Å; R678-D695 VanDerWaalsContact NE-OD1 3.08Å; R678-D695 IonicContact NH2-OD1 3.94Å; R678-D695 PolarHBondContact NH2-OD1 2.93Å; R678-L726 HydrophobicContact CG-CD1 3.79Å; R678-D727 IonicContact CZ-OD1 3.52Å; R678-D727 IonicContact NH1-OD1 3.98Å; R678-D727 PolarHBondContact NH1-OD1 2.95Å; R678-D727 IonicContact NH2-OD1 3.17Å; R678-D727 PolarHBondContact NH2-OD1 3.26Å; R678-D727 IonicContact NH2-OD2 3.08Å; R678-D727 PolarHBondContact NH2-OD2 2.89Å
679	N	95.3	Very high	91.2	Very high	114 Å²	114	52.8 Å²	52.8	61%	0.61	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-8.1	-179.5	-68.3	-8.8	0	0	0	115.1	Q675 S676 I677	Q675-N679 PolarHBondContact NE2-OD1 2.81Å; Q675-N679 WeakPolarHBondContact O-CB 3.31Å; Q675-N679 PolarHBondContact O-N 2.97Å; Q675-N679 PolarHBondContact O-ND2 2.79Å; Q675-N679 PolarHBondContact O-OD1 2.77Å; S676-N679 PolarHBondContact O-N 3.45Å; S676-N679 VanDerWaalsContact O-N 3.16Å; I677-N679 PolarHBondContact O-N 3.27Å
680	V	96.7	Very high	92.8	Very high	27 Å²	27	53.4 Å²	53.4	16%	0.164	28%	0.282	C	S	.	.	S	Bend	trans	-64.6	149.9	179.8	-170.9	0	0	0	0	110.8	S676 I677 G682 N683 T740	S676-V680 WeakPolarHBondContact O-CG2 3.3Å; S676-V680 PolarHBondContact O-N 2.56Å; I677-V680 WeakPolarHBondContact O-CG2 3.22Å; I677-V680 PolarHBondContact O-N 3.24Å; V680-G682 PolarHBondContact O-N 2.7Å; V680-G682 VanDerWaalsContact O-N 3.09Å; V680-N683 HydrophobicContact CB-CB 4.36Å; V680-N683 WeakPolarHBondContact O-CB 3.5Å; V680-N683 PolarHBondContact O-N 3.41Å; V680-T740 HydrophobicContact CG2-CG2 4.38Å
681	R	97.4	Very high	94.3	Very high	213 Å²	213	51.1 Å²	51.1	80%	0.804	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.1	117.9	-178.6	-169	-178	176.9	175.3	-1.7	111.6	A745	R681-A745 HydrophobicContact CB-CB 4.06Å; R681-A745 HydrophobicContact CG-CB 3.71Å; R681-A745 WeakPolarHBondContact O-CB 3.38Å; R681-A745 PolarHBondContact O-N 3.16Å
682	G	96.3	Very high	95.2	Very high	30 Å²	30	52 Å²	52	31%	0.309	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.6	-12	179.9	0	0	0	0	0	115.3	V680 S684 F685	V680-G682 PolarHBondContact O-N 2.7Å; V680-G682 VanDerWaalsContact O-N 3.09Å; G682-S684 PolarHBondContact O-N 3.27Å; G682-S684 VanDerWaalsContact O-N 3.11Å; G682-F685 PolarHBondContact O-N 3.21Å; G682-F685 VanDerWaalsContact O-O 3.14Å
683	N	98.1	Very high	95.8	Very high	3 Å²	3	52.3 Å²	52.3	2%	0.016	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-3.4	-176.6	-79.5	13.8	0	0	0	114.3	I677 V680 F685 P694 L704 G743 N744	I677-N683 WeakPolarHBondContact O-CB 3.31Å; I677-N683 PolarHBondContact O-ND2 3.29Å; V680-N683 HydrophobicContact CB-CB 4.36Å; V680-N683 WeakPolarHBondContact O-CB 3.5Å; V680-N683 PolarHBondContact O-N 3.41Å; N683-F685 PolarHBondContact O-N 3.09Å; N683-P694 VanDerWaalsContact O-CD 3.29Å; N683-P694 WeakPolarHBondContact O-CD 3.44Å; N683-P694 WeakPolarHBondContact O-CG 3.39Å; N683-L704 HydrophobicContact CB-CD1 3.7Å; N683-L704 HydrophobicContact CB-CG 4.3Å; N683-G743 VanDerWaalsContact OD1-CA 3.28Å; N683-G743 WeakPolarHBondContact OD1-CA 3.47Å; N683-N744 PolarHBondContact OD1-N 2.95Å; N683-N744 PolarHBondContact OD1-OD1 3.4Å
684	S	96.9	Very high	96.4	Very high	57 Å²	57	51.2 Å²	51.2	40%	0.399	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-15.3	169.4	58.4	0	0	0	0	114.1	G682 N693	G682-S684 PolarHBondContact O-N 3.27Å; G682-S684 VanDerWaalsContact O-N 3.11Å; S684-N693 PolarHBondContact O-N 3.48Å
685	F	98.3	Very high	96.6	Very high	106 Å²	106	52.7 Å²	52.7	47%	0.465	27%	0.274	S	S	.	.	B	Isolated β-bridge	trans	-134.6	143.6	-177.4	-58.9	-71.3	0	0	0	111	G682 N683 V687 D690 A691 P692 N744	G682-F685 PolarHBondContact O-N 3.21Å; G682-F685 VanDerWaalsContact O-O 3.14Å; N683-F685 PolarHBondContact O-N 3.09Å; F685-V687 PolarHBondContact O-N 3.44Å; F685-D690 HydrophobicContact CB-CB 4.37Å; F685-D690 VanDerWaalsContact CD1-O 3.3Å; F685-D690 WeakPolarHBondContact CD1-O 3.39Å; F685-A691 CarbonylContact C-O 3.24Å; F685-A691 WeakPolarHBondContact CA-O 3.4Å; F685-P692 HydrophobicContact CD1-CB 4.19Å; F685-P692 HydrophobicContact CE1-CB 4.23Å; F685-N744 PolarHBondContact O-ND2 2.89Å
686	C	98.5	Very high	97	Very high	0 Å²	0	50 Å²	50	0%	0	26%	0.26	C	S	.	.			trans	-56.6	127.6	-179.9	176.2	0	0	0	0	111.8	D688 C689 D690 A691 P694 M705 C706	C686-D688 PolarHBondContact O-N 3.05Å; C686-C689 PolarHBondContact O-N 3.47Å; C686-C689 PolarHBondContact SG-SG 3.02Å; C686-D690 VanDerWaalsContact O-CA 3.32Å; C686-D690 WeakPolarHBondContact O-CA 3.38Å; C686-D690 PolarHBondContact O-N 2.89Å; C686-A691 HydrophobicContact CB-CB 3.93Å; C686-A691 WeakPolarHBondContact CB-O 3.29Å; C686-A691 PolarHBondContact N-O 2.97Å; C686-P694 HydrophobicContact CB-CB 4.37Å; C686-M705 VanDerWaalsContact SG-CA 3.59Å; C686-C706 HydrophobicContact CB-CB 4.14Å; C686-C706 PolarHBondContact SG-N 3.29Å
687	V	98.4	Very high	97.2	Very high	1 Å²	1	47.3 Å²	47.3	1%	0.006	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-27.6	-176.2	68.3	0	0	0	0	114	F685 A703 L704 M705 N744 A747 N748 K760 K777	F685-V687 PolarHBondContact O-N 3.44Å; V687-A703 HydrophobicContact CB-CB 4.09Å; V687-A703 HydrophobicContact CG1-CB 4.05Å; V687-A703 HydrophobicContact CG2-CB 3.87Å; V687-L704 WeakPolarHBondContact CB-O 3.23Å; V687-L704 WeakPolarHBondContact CG1-O 3.37Å; V687-L704 PolarHBondContact N-O 3.33Å; V687-M705 HydrophobicContact CG1-CB 4.22Å; V687-M705 HydrophobicContact CG1-CE 4.28Å; V687-N744 HydrophobicContact CB-CB 4.28Å; V687-N744 HydrophobicContact CG2-CB 4.24Å; V687-N744 PolarHBondContact N-ND2 3.43Å; V687-A747 HydrophobicContact CG2-CB 4.45Å; V687-N748 WeakPolarHBondContact CG2-OD1 3.45Å; V687-N748 PolarHBondContact O-ND2 3.19Å; V687-N748 PolarHBondContact O-OD1 2.87Å; V687-K760 WeakPolarHBondContact O-CE 3.38Å; V687-K760 PolarHBondContact O-NZ 2.79Å; V687-K777 PolarHBondContact O-NZ 2.66Å
688	D	98.4	Very high	97.3	Very high	1 Å²	1	47.3 Å²	47.3	1%	0.005	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.1	-22.5	-173.2	-52.2	-54.8	0	0	0	116	C686 H713 K760 I774 K777 Y778	C686-D688 PolarHBondContact O-N 3.05Å; D688-H713 IonicContact OD2-CD2 2.63Å; D688-H713 IonicContact OD2-NE2 3.92Å; D688-H713 PolarHBondContact OD2-NE2 3.48Å; D688-K760 VanDerWaalsContact O-CE 3.3Å; D688-K760 WeakPolarHBondContact O-CE 3.49Å; D688-I774 HydrophobicContact CB-CD1 4.27Å; D688-I774 HydrophobicContact CB-CG1 3.96Å; D688-K777 IonicContact OD1-NZ 3.35Å; D688-K777 PolarHBondContact OD1-NZ 2.88Å; D688-Y778 VanDerWaalsContact OD1-CE2 3.28Å; D688-Y778 WeakPolarHBondContact OD1-CE2 3.42Å; D688-Y778 PolarHBondContact OD1-OH 3.48Å; D688-Y778 VanDerWaalsContact OD1-OH 3.05Å
689	C	97.6	Very high	97.3	Very high	1 Å²	1	44.4 Å²	44.4	1%	0.007	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-141	8.2	-175.7	70.6	0	0	0	0	114.9	C686 A691 P761 G762 N763 K770	C686-C689 PolarHBondContact O-N 3.47Å; C686-C689 PolarHBondContact SG-SG 3.02Å; C689-A691 PolarHBondContact O-N 3.01Å; C689-P761 VanDerWaalsContact CA-O 3.26Å; C689-P761 WeakPolarHBondContact CA-O 3.49Å; C689-P761 HydrophobicContact CB-CG 4.44Å; C689-G762 CarbonylContact O-C 3.6Å; C689-N763 PolarHBondContact O-N 2.93Å; C689-K770 HydrophobicContact CB-CG 4.36Å
690	D	97.8	Very high	97.3	Very high	79 Å²	79	39.1 Å²	39.1	42%	0.422	20%	0.203	S	C	.	.			trans	54.5	15.5	177.7	-52.2	-40.9	0	0	0	115.7	F685 C686 K760	F685-D690 HydrophobicContact CB-CB 4.37Å; F685-D690 VanDerWaalsContact CD1-O 3.3Å; F685-D690 WeakPolarHBondContact CD1-O 3.39Å; C686-D690 VanDerWaalsContact O-CA 3.32Å; C686-D690 WeakPolarHBondContact O-CA 3.38Å; C686-D690 PolarHBondContact O-N 2.89Å; D690-K760 WeakPolarHBondContact OD1-CE 3.35Å; D690-K760 IonicContact OD1-NZ 2.72Å; D690-K760 PolarHBondContact OD1-NZ 2.66Å; D690-K760 WeakPolarHBondContact OD2-CD 3.45Å; D690-K760 WeakPolarHBondContact OD2-CE 3.23Å; D690-K760 IonicContact OD2-NZ 3.75Å; D690-K760 PolarHBondContact OD2-NZ 2.73Å
691	A	97.8	Very high	97.3	Very high	5 Å²	5	38.1 Å²	38.1	4%	0.041	20%	0.197	C	C	.	.			trans	-55.3	130.7	168.5	0	0	0	0	0	111.2	F685 C686 C689 C706 N763	F685-A691 CarbonylContact C-O 3.24Å; F685-A691 WeakPolarHBondContact CA-O 3.4Å; C686-A691 HydrophobicContact CB-CB 3.93Å; C686-A691 WeakPolarHBondContact CB-O 3.29Å; C686-A691 PolarHBondContact N-O 2.97Å; C689-A691 PolarHBondContact O-N 3.01Å; A691-C706 HydrophobicContact CB-CB 4Å; A691-N763 HydrophobicContact CB-CB 4.27Å; A691-N763 WeakPolarHBondContact CB-OD1 3.48Å
692	P	97.4	Very high	97.3	Very high	75 Å²	75	28 Å²	28	49%	0.487	16%	0.158	S	C	.	.	B	Isolated β-bridge	trans	-70	154.6	-172.8	29.4	-36.1	0	0	0	113	F685	F685-P692 HydrophobicContact CD1-CB 4.19Å; F685-P692 HydrophobicContact CE1-CB 4.23Å
693	N	94.4	Very high	97.4	Very high	120 Å²	120	26.5 Å²	26.5	64%	0.642	14%	0.144	S	C	*	.	S	Bend	trans	52.8	66.1	176	-55.1	-30.7	0	0	0	113.8	S684 D695	S684-N693 PolarHBondContact O-N 3.48Å; N693-D695 PolarHBondContact O-N 3.3Å
694	P	97.3	Very high	97.5	Very high	2 Å²	2	26.4 Å²	26.4	1%	0.013	14%	0.143	C	C	.	.			trans	-75.8	102.9	-179.5	31.3	-37.4	0	0	0	113.6	N683 C686 W696 L704 M705	N683-P694 VanDerWaalsContact O-CD 3.29Å; N683-P694 WeakPolarHBondContact O-CD 3.44Å; N683-P694 WeakPolarHBondContact O-CG 3.39Å; C686-P694 HydrophobicContact CB-CB 4.37Å; P694-W696 PolarHBondContact O-N 3Å; P694-L704 HydrophobicContact CB-CB 3.89Å; P694-L704 HydrophobicContact CG-CB 3.63Å; P694-L704 HydrophobicContact CG-CD1 4.25Å; P694-M705 CarbonylContact C-O 3.58Å; P694-M705 WeakPolarHBondContact CB-O 3.27Å
695	D	95.6	Very high	97.5	Very high	53 Å²	53	23.7 Å²	23.7	28%	0.283	12%	0.124	S	C	.	.			trans	-91.2	17.4	-178.5	-60.8	-47.1	0	0	0	115.5	R678 N693 L726	R678-D695 IonicContact CZ-OD1 2.7Å; R678-D695 VanDerWaalsContact CZ-OD1 3.3Å; R678-D695 IonicContact NE-OD1 2.77Å; R678-D695 PolarHBondContact NE-OD1 3.09Å; R678-D695 VanDerWaalsContact NE-OD1 3.08Å; R678-D695 IonicContact NH2-OD1 3.94Å; R678-D695 PolarHBondContact NH2-OD1 2.93Å; N693-D695 PolarHBondContact O-N 3.3Å; D695-L726 PolarHBondContact O-N 2.99Å
696	W	98.3	Very high	97.5	Very high	38 Å²	38	19.4 Å²	19.4	14%	0.144	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	155.6	169.9	-64.1	78.5	0	0	0	110.5	P694 L704 M705 I707 S710 V723 R724 S725 L728	P694-W696 PolarHBondContact O-N 3Å; W696-L704 CarbonylContact O-C 3.19Å; W696-L704 WeakPolarHBondContact O-CA 3.18Å; W696-M705 HydrophobicContact CB-CG 3.94Å; W696-M705 WeakPolarHBondContact CB-O 3.34Å; W696-M705 PolarHBondContact N-O 2.64Å; W696-M705 VanDerWaalsContact N-O 3.12Å; W696-M705 PolarHBondContact O-N 3.36Å; W696-I707 VanDerWaalsContact CD1-CA 3.5Å; W696-I707 HydrophobicContact CZ2-CD1 4.44Å; W696-S710 VanDerWaalsContact CB-CB 3.47Å; W696-S710 VanDerWaalsContact CD2-OG 3.31Å; W696-V723 HydrophobicContact CE3-CG1 4.03Å; W696-R724 CarbonylContact C-O 3.58Å; W696-R724 WeakPolarHBondContact CA-O 3.34Å; W696-S725 VanDerWaalsContact CZ3-CB 3.5Å; W696-L728 HydrophobicContact CH2-CD1 4.24Å; W696-L728 HydrophobicContact CZ2-CD1 4.28Å
697	A	98.3	Very high	97.4	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	151.8	-176.4	0	0	0	0	0	111.5	A703 L704 V723 R724 W731 M739	A697-A703 CarbonylContact C-O 3.59Å; A697-A703 WeakPolarHBondContact CA-O 3.15Å; A697-L704 HydrophobicContact CB-CD2 3.71Å; A697-V723 CarbonylContact O-C 3.51Å; A697-V723 VanDerWaalsContact O-CA 3.28Å; A697-V723 WeakPolarHBondContact O-CA 3.32Å; A697-R724 PolarHBondContact N-O 3.32Å; A697-R724 PolarHBondContact O-N 2.93Å; A697-W731 HydrophobicContact CB-CH2 3.72Å; A697-W731 HydrophobicContact CB-CZ2 4.01Å; A697-M739 HydrophobicContact CB-CE 3.77Å; A697-M739 HydrophobicContact CB-SD 4.17Å
698	S	98.3	Very high	97.4	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	111.7	158.7	-176.9	0	0	0	0	109.9	N700 L701 G702 A703 S721 R722	S698-N700 PolarHBondContact O-N 3.23Å; S698-L701 PolarHBondContact O-N 3.31Å; S698-L701 VanDerWaalsContact O-N 3.16Å; S698-G702 PolarHBondContact O-N 2.84Å; S698-A703 PolarHBondContact N-O 3.33Å; S698-A703 PolarHBondContact O-N 2.79Å; S698-S721 WeakPolarHBondContact CB-OG 3.22Å; S698-S721 PolarHBondContact OG-OG 2.93Å; S698-R722 PolarHBondContact OG-N 3.36Å
699	L	96.8	Very high	97.4	Very high	7 Å²	7	28 Å²	28	4%	0.037	15%	0.15	C	C	.	.	G	3₁₀ helix	trans	-58.9	-49.2	-169.5	-63.1	174.1	0	0	0	112.4	L701 G702 R722 R724 W731 L735 M739 W852	L699-L701 PolarHBondContact O-N 2.9Å; L699-G702 PolarHBondContact O-N 3.01Å; L699-R722 HydrophobicContact CB-CB 4.15Å; L699-R722 HydrophobicContact CD1-CB 4.42Å; L699-R722 WeakPolarHBondContact CG-O 3.45Å; L699-R722 PolarHBondContact N-O 2.78Å; L699-R724 HydrophobicContact CD1-CG 3.76Å; L699-R724 HydrophobicContact CD2-CG 4.15Å; L699-R724 HydrophobicContact CG-CG 3.96Å; L699-W731 HydrophobicContact CD2-CH2 3.49Å; L699-W731 VanDerWaalsContact CD2-CH2 3.49Å; L699-W731 HydrophobicContact CD2-CZ3 3.54Å; L699-L735 HydrophobicContact CD1-CD1 4.04Å; L699-L735 HydrophobicContact CD1-CD2 4.24Å; L699-L735 HydrophobicContact CD2-CB 4.18Å; L699-L735 HydrophobicContact CD2-CD1 4.1Å; L699-L735 HydrophobicContact CD2-CD2 4.46Å; L699-L735 HydrophobicContact CD2-CG 4.49Å; L699-M739 HydrophobicContact CD2-CG 4.49Å; L699-W852 VanDerWaalsContact C-CZ3 3.47Å; L699-W852 HydrophobicContact CB-CE3 4.5Å; L699-W852 HydrophobicContact CB-CH2 3.64Å; L699-W852 HydrophobicContact CB-CZ2 4.11Å; L699-W852 HydrophobicContact CB-CZ3 3.85Å; L699-W852 HydrophobicContact CD1-CH2 4.49Å; L699-W852 HydrophobicContact CD1-CZ2 4.32Å; L699-W852 HydrophobicContact CG-CH2 4.5Å; L699-W852 VanDerWaalsContact O-CZ3 3.27Å; L699-W852 WeakPolarHBondContact O-CZ3 3.23Å
700	N	95	Very high	97.4	Very high	4 Å²	4	28.2 Å²	28.2	2%	0.021	15%	0.151	C	C	.	.	G	3₁₀ helix	trans	-77.8	-4.7	-177.9	68.8	-90.8	0	0	0	114.5	S698 L720 R722 W852 Y853	S698-N700 PolarHBondContact O-N 3.23Å; N700-L720 PolarHBondContact ND2-O 2.78Å; N700-R722 WeakPolarHBondContact OD1-CB 3.47Å; N700-R722 WeakPolarHBondContact OD1-CG 3.31Å; N700-R722 PolarHBondContact OD1-N 3.07Å; N700-W852 HydrophobicContact CB-CB 4.07Å; N700-W852 HydrophobicContact CB-CD2 4.23Å; N700-W852 HydrophobicContact CB-CE3 3.81Å; N700-W852 HydrophobicContact CB-CG 4.39Å; N700-Y853 HydrophobicContact CB-CE2 4.33Å; N700-Y853 PolarHBondContact O-OH 3.39Å
701	L	97.6	Very high	97.3	Very high	5 Å²	5	25.5 Å²	25.5	3%	0.026	14%	0.142	C	C	.	.	G	3₁₀ helix	trans	-104.4	-8.6	171.2	-57.8	175.8	0	0	0	111.6	S698 L699 A703 W751 Y778	S698-L701 PolarHBondContact O-N 3.31Å; S698-L701 VanDerWaalsContact O-N 3.16Å; L699-L701 PolarHBondContact O-N 2.9Å; L701-A703 HydrophobicContact CB-CB 4.31Å; L701-A703 PolarHBondContact O-N 3.08Å; L701-W751 HydrophobicContact CD2-CZ2 3.69Å; L701-Y778 HydrophobicContact CD1-CD1 3.87Å; L701-Y778 HydrophobicContact CD1-CE1 3.58Å; L701-Y778 HydrophobicContact CD1-CG 4.44Å; L701-Y778 HydrophobicContact CD2-CD1 4.15Å; L701-Y778 HydrophobicContact CD2-CE1 4.12Å; L701-Y778 HydrophobicContact CG-CE1 4.41Å
702	G	97.4	Very high	97.3	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	63.6	21.3	-178.8	0	0	0	0	0	114.8	S698 L699 M739 G743	S698-G702 PolarHBondContact O-N 2.84Å; L699-G702 PolarHBondContact O-N 3.01Å; G702-M739 VanDerWaalsContact C-CE 3.5Å; G702-G743 WeakPolarHBondContact O-CA 3.21Å; G702-G743 PolarHBondContact O-N 3.46Å
703	A	98.4	Very high	97.3	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	144.3	-161.7	0	0	0	0	0	113.8	V687 A697 S698 L701 N744 A747	V687-A703 HydrophobicContact CB-CB 4.09Å; V687-A703 HydrophobicContact CG1-CB 4.05Å; V687-A703 HydrophobicContact CG2-CB 3.87Å; A697-A703 CarbonylContact C-O 3.59Å; A697-A703 WeakPolarHBondContact CA-O 3.15Å; S698-A703 PolarHBondContact N-O 3.33Å; S698-A703 PolarHBondContact O-N 2.79Å; L701-A703 HydrophobicContact CB-CB 4.31Å; L701-A703 PolarHBondContact O-N 3.08Å; A703-N744 WeakPolarHBondContact CA-OD1 3.38Å; A703-N744 WeakPolarHBondContact CB-OD1 3.33Å; A703-A747 HydrophobicContact CB-CB 4Å
704	L	98.6	Very high	97.4	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	140.9	175.1	-60	-172.5	0	0	0	113	I677 N683 V687 P694 W696 A697 L726 M739 N744	I677-L704 HydrophobicContact CG2-CD1 4.16Å; I677-L704 HydrophobicContact CG2-CD2 3.95Å; I677-L704 HydrophobicContact CG2-CG 4.3Å; N683-L704 HydrophobicContact CB-CD1 3.7Å; N683-L704 HydrophobicContact CB-CG 4.3Å; V687-L704 WeakPolarHBondContact CB-O 3.23Å; V687-L704 WeakPolarHBondContact CG1-O 3.37Å; V687-L704 PolarHBondContact N-O 3.33Å; P694-L704 HydrophobicContact CB-CB 3.89Å; P694-L704 HydrophobicContact CG-CB 3.63Å; P694-L704 HydrophobicContact CG-CD1 4.25Å; W696-L704 CarbonylContact O-C 3.19Å; W696-L704 WeakPolarHBondContact O-CA 3.18Å; A697-L704 HydrophobicContact CB-CD2 3.71Å; L704-L726 HydrophobicContact CD1-CD1 4.02Å; L704-L726 HydrophobicContact CD2-CD1 4.05Å; L704-L726 HydrophobicContact CD2-CD2 4.14Å; L704-L726 HydrophobicContact CD2-CG 4.23Å; L704-M739 HydrophobicContact CD2-CE 3.59Å; L704-M739 HydrophobicContact CG-CE 4.24Å; L704-N744 PolarHBondContact N-OD1 2.89Å; L704-N744 PolarHBondContact O-ND2 2.76Å; L704-N744 PolarHBondContact O-OD1 2.77Å
705	M	98.3	Very high	97.3	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	155.9	-176.7	55.7	-169.7	55.7	0	0	111.5	C686 V687 P694 W696 C709 S710 H713	C686-M705 VanDerWaalsContact SG-CA 3.59Å; V687-M705 HydrophobicContact CG1-CB 4.22Å; V687-M705 HydrophobicContact CG1-CE 4.28Å; P694-M705 CarbonylContact C-O 3.58Å; P694-M705 WeakPolarHBondContact CB-O 3.27Å; W696-M705 HydrophobicContact CB-CG 3.94Å; W696-M705 WeakPolarHBondContact CB-O 3.34Å; W696-M705 PolarHBondContact N-O 2.64Å; W696-M705 VanDerWaalsContact N-O 3.12Å; W696-M705 PolarHBondContact O-N 3.36Å; M705-C709 HydrophobicContact CB-CB 4.06Å; M705-S710 VanDerWaalsContact SD-CA 3.58Å; M705-H713 HydrophobicContact CE-CB 4.38Å; M705-H713 HydrophobicContact SD-CB 3.88Å
706	C	98.1	Very high	97.2	Very high	17 Å²	17	24.5 Å²	24.5	12%	0.115	12%	0.122	C	C	.	.			trans	-73.7	168.3	174.2	71.7	0	0	0	0	111.5	C686 A691 E708 C709 S710	C686-C706 HydrophobicContact CB-CB 4.14Å; C686-C706 PolarHBondContact SG-N 3.29Å; A691-C706 HydrophobicContact CB-CB 4Å; C706-E708 PolarHBondContact O-N 2.66Å; C706-C709 PolarHBondContact O-N 2.97Å; C706-S710 WeakPolarHBondContact O-CB 3.15Å; C706-S710 PolarHBondContact O-N 3.33Å
707	I	96.2	Very high	96.9	Very high	125 Å²	125	23.9 Å²	23.9	64%	0.641	13%	0.127	S	C	*	.	H	α-helix	trans	-58.9	-29.4	-180	-172.5	161	0	0	0	113.9	W696 S710 G711	W696-I707 VanDerWaalsContact CD1-CA 3.5Å; W696-I707 HydrophobicContact CZ2-CD1 4.44Å; I707-S710 PolarHBondContact O-OG 3.26Å; I707-G711 PolarHBondContact O-N 3.21Å
708	E	97.4	Very high	96.6	Very high	58 Å²	58	28.9 Å²	28.9	27%	0.271	16%	0.158	S	C	.	.	H	α-helix	trans	-72.9	-51.9	177.3	-164.8	-172.5	-176.2	0	0	111	C706 S710 G711 M712 R767 K770	C706-E708 PolarHBondContact O-N 2.66Å; E708-S710 VanDerWaalsContact C-N 3.31Å; E708-S710 PolarHBondContact O-N 3.49Å; E708-G711 WeakPolarHBondContact O-CA 3.32Å; E708-G711 PolarHBondContact O-N 3.21Å; E708-M712 HydrophobicContact CG-CE 3.92Å; E708-M712 PolarHBondContact O-N 3.4Å; E708-R767 WeakPolarHBondContact OE1-CB 3.39Å; E708-K770 IonicContact OE1-NZ 2.61Å; E708-K770 WeakPolarHBondContact OE2-CD 3.41Å; E708-K770 WeakPolarHBondContact OE2-CE 3.39Å; E708-K770 IonicContact OE2-NZ 3.08Å; E708-K770 PolarHBondContact OE2-NZ 2.86Å
709	C	98.3	Very high	96.1	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-62.1	-36.4	177.4	-68.1	0	0	0	0	112.2	M705 C706 G711 M712 H713 I774	M705-C709 HydrophobicContact CB-CB 4.06Å; C706-C709 PolarHBondContact O-N 2.97Å; C709-G711 VanDerWaalsContact C-N 3.25Å; C709-G711 PolarHBondContact O-N 3.14Å; C709-M712 HydrophobicContact CB-CE 4.45Å; C709-M712 PolarHBondContact O-N 2.98Å; C709-H713 PolarHBondContact O-CD2 3.02Å; C709-H713 PolarHBondContact O-N 3.41Å; C709-I774 HydrophobicContact CB-CD1 3.96Å
710	S	97.9	Very high	95.9	Very high	4 Å²	4	37.3 Å²	37.3	3%	0.028	20%	0.198	C	C	.	.	H	α-helix	trans	-63.4	-31.5	173.9	89.2	0	0	0	0	112.8	W696 M705 C706 I707 E708 R714	W696-S710 VanDerWaalsContact CB-CB 3.47Å; W696-S710 VanDerWaalsContact CD2-OG 3.31Å; M705-S710 VanDerWaalsContact SD-CA 3.58Å; C706-S710 WeakPolarHBondContact O-CB 3.15Å; C706-S710 PolarHBondContact O-N 3.33Å; I707-S710 PolarHBondContact O-OG 3.26Å; E708-S710 VanDerWaalsContact C-N 3.31Å; E708-S710 PolarHBondContact O-N 3.49Å; S710-R714 VanDerWaalsContact O-CG 3.27Å; S710-R714 WeakPolarHBondContact O-CG 3.31Å; S710-R714 PolarHBondContact O-N 3.35Å; S710-R714 VanDerWaalsContact O-N 3.14Å
711	G	95.9	Very high	96	Very high	23 Å²	23	37.3 Å²	37.3	24%	0.237	20%	0.198	C	C	.	.	H	α-helix	trans	-64.2	-38	169.6	0	0	0	0	0	113.3	I707 E708 C709	I707-G711 PolarHBondContact O-N 3.21Å; E708-G711 WeakPolarHBondContact O-CA 3.32Å; E708-G711 PolarHBondContact O-N 3.21Å; C709-G711 VanDerWaalsContact C-N 3.25Å; C709-G711 PolarHBondContact O-N 3.14Å
712	M	97.5	Very high	96	Very high	1 Å²	1	39.8 Å²	39.8	1%	0.005	21%	0.207	C	C	.	.	H	α-helix	trans	-76.4	-38.7	177	-70.1	174	-75.3	0	0	111.9	E708 C709 R714 N715 L716 R767 K770 E771 I774	E708-M712 HydrophobicContact CG-CE 3.92Å; E708-M712 PolarHBondContact O-N 3.4Å; C709-M712 HydrophobicContact CB-CE 4.45Å; C709-M712 PolarHBondContact O-N 2.98Å; M712-R714 VanDerWaalsContact C-N 3.25Å; M712-R714 PolarHBondContact O-N 3.35Å; M712-N715 WeakPolarHBondContact O-CB 3.42Å; M712-N715 PolarHBondContact O-N 2.75Å; M712-L716 PolarHBondContact O-N 3.16Å; M712-R767 HydrophobicContact SD-CG 4.2Å; M712-K770 HydrophobicContact CE-CB 3.46Å; M712-K770 VanDerWaalsContact CE-CB 3.46Å; M712-K770 HydrophobicContact CE-CD 4.28Å; M712-K770 HydrophobicContact CE-CG 4.45Å; M712-K770 HydrophobicContact SD-CB 3.87Å; M712-E771 HydrophobicContact CG-CB 4.23Å; M712-E771 HydrophobicContact CG-CG 4.46Å; M712-E771 VanDerWaalsContact SD-CA 3.56Å; M712-E771 HydrophobicContact SD-CB 3.62Å; M712-E771 HydrophobicContact SD-CG 4.45Å; M712-E771 PolarHBondContact SD-N 3.39Å; M712-I774 HydrophobicContact CB-CD1 3.78Å; M712-I774 HydrophobicContact CE-CD1 3.9Å; M712-I774 HydrophobicContact SD-CD1 4.22Å
713	H	98	Very high	96	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-61.1	-30.3	172.9	-90.2	-102	0	0	0	113.6	D688 M705 C709 N715 L716 S721 V723 Y778	D688-H713 IonicContact OD2-CD2 2.63Å; D688-H713 IonicContact OD2-NE2 3.92Å; D688-H713 PolarHBondContact OD2-NE2 3.48Å; M705-H713 HydrophobicContact CE-CB 4.38Å; M705-H713 HydrophobicContact SD-CB 3.88Å; C709-H713 PolarHBondContact O-CD2 3.02Å; C709-H713 PolarHBondContact O-N 3.41Å; H713-N715 VanDerWaalsContact C-N 3.28Å; H713-N715 PolarHBondContact O-N 2.86Å; H713-L716 PolarHBondContact O-N 3.1Å; H713-S721 WeakPolarHBondContact ND1-CB 3.44Å; H713-S721 PolarHBondContact ND1-OG 2.96Å; H713-V723 HydrophobicContact CB-CG2 3.65Å; H713-Y778 AromaticContact CE1-CD2 3.46Å; H713-Y778 VanDerWaalsContact CE1-CD2 3.46Å; H713-Y778 WeakPolarHBondContact CE1-CD2 3.35Å; H713-Y778 AromaticContact CE1-CE2 3.19Å; H713-Y778 WeakPolarHBondContact CE1-CE2 3.36Å; H713-Y778 AromaticContact CE1-CZ 3.79Å; H713-Y778 AromaticContact NE2-CD2 3.7Å; H713-Y778 AromaticContact NE2-CE2 3.27Å; H713-Y778 VanDerWaalsContact NE2-CE2 3.27Å; H713-Y778 WeakPolarHBondContact NE2-CE2 3.42Å
714	R	96.4	Very high	95.9	Very high	129 Å²	129	44.9 Å²	44.9	49%	0.487	23%	0.228	S	C	.	.	H	α-helix	trans	-64.4	-31.9	171.4	-73.4	165.9	-173	-78.2	0.7	112.5	S710 M712 L716 G717 V723	S710-R714 VanDerWaalsContact O-CG 3.27Å; S710-R714 WeakPolarHBondContact O-CG 3.31Å; S710-R714 PolarHBondContact O-N 3.35Å; S710-R714 VanDerWaalsContact O-N 3.14Å; M712-R714 VanDerWaalsContact C-N 3.25Å; M712-R714 PolarHBondContact O-N 3.35Å; R714-L716 VanDerWaalsContact C-N 3.33Å; R714-G717 PolarHBondContact O-N 3.43Å; R714-V723 HydrophobicContact CG-CB 4.16Å; R714-V723 HydrophobicContact CG-CG1 4.34Å; R714-V723 HydrophobicContact CG-CG2 4.08Å
715	N	95.2	Very high	95.7	Very high	94 Å²	94	45 Å²	45	50%	0.503	23%	0.229	S	C	.	.	H	α-helix	trans	-76.6	-16.5	179	-65.3	-9	0	0	0	113.5	M712 H713 G717	M712-N715 WeakPolarHBondContact O-CB 3.42Å; M712-N715 PolarHBondContact O-N 2.75Å; H713-N715 VanDerWaalsContact C-N 3.28Å; H713-N715 PolarHBondContact O-N 2.86Å; N715-G717 VanDerWaalsContact C-N 3.34Å
716	L	94.5	Very high	95.4	Very high	10 Å²	10	45.1 Å²	45.1	5%	0.052	23%	0.229	C	C	.	.	H	α-helix	trans	-74.3	-25.8	170.1	-58.8	-176.8	0	0	0	112.5	M712 H713 R714 H719 L720 I774 R775 Y778 E779	M712-L716 PolarHBondContact O-N 3.16Å; H713-L716 PolarHBondContact O-N 3.1Å; R714-L716 VanDerWaalsContact C-N 3.33Å; L716-H719 PolarHBondContact O-CE1 3.37Å; L716-H719 VanDerWaalsContact O-CE1 3.23Å; L716-L720 HydrophobicContact CB-CB 4.1Å; L716-L720 HydrophobicContact CB-CD1 4.07Å; L716-I774 HydrophobicContact CD1-CG2 3.8Å; L716-I774 HydrophobicContact CD2-CG2 4.43Å; L716-I774 HydrophobicContact CG-CG2 4.28Å; L716-R775 HydrophobicContact CD2-CG 4.02Å; L716-Y778 HydrophobicContact CD1-CD2 4.41Å; L716-E779 HydrophobicContact CD2-CB 4.34Å
717	G	91.4	Very high	94.8	Very high	24 Å²	24	48.8 Å²	48.8	25%	0.247	25%	0.248	C	C	.	.			trans	83.5	163	-176.8	0	0	0	0	0	114.6	R714 N715 H719 L720 S721	R714-G717 PolarHBondContact O-N 3.43Å; N715-G717 VanDerWaalsContact C-N 3.34Å; G717-H719 PolarHBondContact O-N 2.75Å; G717-H719 VanDerWaalsContact O-N 3.11Å; G717-L720 PolarHBondContact O-N 3.39Å; G717-L720 VanDerWaalsContact O-N 3.14Å; G717-S721 PolarHBondContact O-N 3.15Å
718	T	91.9	Very high	94.3	Very high	105 Å²	105	49.1 Å²	49.1	64%	0.644	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-9.8	-167.5	49.9	0	0	0	0	115.9	R722	T718-R722 WeakPolarHBondContact O-CG 3.5Å; T718-R722 PolarHBondContact O-NH1 2.93Å
719	H	87.1	Confident	93.9	Very high	144 Å²	144	49.1 Å²	49.1	67%	0.667	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-27.4	175.2	67	-73	0	0	0	112.2	L716 G717	L716-H719 PolarHBondContact O-CE1 3.37Å; L716-H719 VanDerWaalsContact O-CE1 3.23Å; G717-H719 PolarHBondContact O-N 2.75Å; G717-H719 VanDerWaalsContact O-N 3.11Å
720	L	93.7	Very high	93.3	Very high	40 Å²	40	53.2 Å²	53.2	21%	0.209	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.9	-41	171.5	-64.7	175	0	0	0	111.7	N700 L716 G717 E779	N700-L720 PolarHBondContact ND2-O 2.78Å; L716-L720 HydrophobicContact CB-CB 4.1Å; L716-L720 HydrophobicContact CB-CD1 4.07Å; G717-L720 PolarHBondContact O-N 3.39Å; G717-L720 VanDerWaalsContact O-N 3.14Å; L720-E779 HydrophobicContact CD1-CB 4.09Å; L720-E779 HydrophobicContact CD1-CG 4.32Å
721	S	96.9	Very high	92.8	Very high	4 Å²	4	53.7 Å²	53.7	3%	0.028	28%	0.275	C	S	.	.			trans	-145.1	116.8	-172.5	-174.3	0	0	0	0	114.4	S698 H713 G717 V723	S698-S721 WeakPolarHBondContact CB-OG 3.22Å; S698-S721 PolarHBondContact OG-OG 2.93Å; H713-S721 WeakPolarHBondContact ND1-CB 3.44Å; H713-S721 PolarHBondContact ND1-OG 2.96Å; G717-S721 PolarHBondContact O-N 3.15Å; S721-V723 PolarHBondContact O-N 2.85Å
722	R	96.3	Very high	92.4	Very high	58 Å²	58	55 Å²	55	22%	0.219	28%	0.279	C	S	.	.			trans	-95.6	86.6	176.7	-67.7	175.8	176.3	85.2	-10.8	111	S698 L699 N700 T718 W852	S698-R722 PolarHBondContact OG-N 3.36Å; L699-R722 HydrophobicContact CB-CB 4.15Å; L699-R722 HydrophobicContact CD1-CB 4.42Å; L699-R722 WeakPolarHBondContact CG-O 3.45Å; L699-R722 PolarHBondContact N-O 2.78Å; N700-R722 WeakPolarHBondContact OD1-CB 3.47Å; N700-R722 WeakPolarHBondContact OD1-CG 3.31Å; N700-R722 PolarHBondContact OD1-N 3.07Å; T718-R722 WeakPolarHBondContact O-CG 3.5Å; T718-R722 PolarHBondContact O-NH1 2.93Å; R722-W852 VanDerWaalsContact CZ-O 3.3Å; R722-W852 PolarHBondContact NH1-O 2.8Å; R722-W852 PolarHBondContact NH2-O 3.24Å
723	V	97.4	Very high	91.9	Very high	10 Å²	10	59.3 Å²	59.3	6%	0.061	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	138.6	-173.5	-177.1	0	0	0	0	113.5	W696 A697 H713 R714 S721	W696-V723 HydrophobicContact CE3-CG1 4.03Å; A697-V723 CarbonylContact O-C 3.51Å; A697-V723 VanDerWaalsContact O-CA 3.28Å; A697-V723 WeakPolarHBondContact O-CA 3.32Å; H713-V723 HydrophobicContact CB-CG2 3.65Å; R714-V723 HydrophobicContact CG-CB 4.16Å; R714-V723 HydrophobicContact CG-CG1 4.34Å; R714-V723 HydrophobicContact CG-CG2 4.08Å; S721-V723 PolarHBondContact O-N 2.85Å
724	R	96	Very high	91.4	Very high	97 Å²	97	60.8 Å²	60.8	37%	0.366	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	158.6	170.6	-71.2	-64.9	-178.4	-85.7	3.8	111.6	W696 A697 L699 D729 W731	W696-R724 CarbonylContact C-O 3.58Å; W696-R724 WeakPolarHBondContact CA-O 3.34Å; A697-R724 PolarHBondContact N-O 3.32Å; A697-R724 PolarHBondContact O-N 2.93Å; L699-R724 HydrophobicContact CD1-CG 3.76Å; L699-R724 HydrophobicContact CD2-CG 4.15Å; L699-R724 HydrophobicContact CG-CG 3.96Å; R724-D729 VanDerWaalsContact CA-OD2 3.27Å; R724-D729 WeakPolarHBondContact CA-OD2 3.4Å; R724-D729 HydrophobicContact CB-CB 4.4Å; R724-D729 VanDerWaalsContact CD-CG 3.42Å; R724-D729 VanDerWaalsContact CD-OD2 3.29Å; R724-D729 WeakPolarHBondContact CD-OD2 3.46Å; R724-W731 HydrophobicContact CB-CH2 4.24Å; R724-W731 HydrophobicContact CB-CZ2 3.76Å
725	S	95.6	Very high	91.2	Very high	3 Å²	3	55.6 Å²	55.6	2%	0.021	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	145.4	166.3	179.9	0	0	0	0	110.6	W696 D727 L728 D729 W731	W696-S725 VanDerWaalsContact CZ3-CB 3.5Å; S725-D727 PolarHBondContact OG-N 2.82Å; S725-L728 PolarHBondContact OG-N 2.63Å; S725-D729 PolarHBondContact N-OD2 2.95Å; S725-W731 PolarHBondContact O-NE1 2.88Å
726	L	91.9	Very high	91.2	Very high	1 Å²	1	51.5 Å²	51.5	1%	0.005	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-33.4	169.6	-70.4	-176.1	0	0	0	112.8	I674 I677 R678 D695 L704 W731	I674-L726 WeakPolarHBondContact CD1-O 3.48Å; I674-L726 HydrophobicContact CG2-CB 4.08Å; I674-L726 HydrophobicContact CG2-CD1 4.35Å; I674-L726 HydrophobicContact CG2-CD2 4.4Å; I677-L726 HydrophobicContact CG2-CD2 4.16Å; R678-L726 HydrophobicContact CG-CD1 3.79Å; D695-L726 PolarHBondContact O-N 2.99Å; L704-L726 HydrophobicContact CD1-CD1 4.02Å; L704-L726 HydrophobicContact CD2-CD1 4.05Å; L704-L726 HydrophobicContact CD2-CD2 4.14Å; L704-L726 HydrophobicContact CD2-CG 4.23Å; L726-W731 HydrophobicContact CD2-CH2 4.29Å; L726-W731 HydrophobicContact CD2-CZ2 3.75Å
727	D	86.2	Confident	91.1	Very high	95 Å²	95	54.5 Å²	54.5	51%	0.508	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.4	-11.1	-171.3	-49	-68	0	0	0	114.5	R678 S725	R678-D727 IonicContact CZ-OD1 3.52Å; R678-D727 IonicContact NH1-OD1 3.98Å; R678-D727 PolarHBondContact NH1-OD1 2.95Å; R678-D727 IonicContact NH2-OD1 3.17Å; R678-D727 PolarHBondContact NH2-OD1 3.26Å; R678-D727 IonicContact NH2-OD2 3.08Å; R678-D727 PolarHBondContact NH2-OD2 2.89Å; S725-D727 PolarHBondContact OG-N 2.82Å
728	L	85.6	Confident	91.4	Very high	131 Å²	131	53.3 Å²	53.3	69%	0.686	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.1	-16.7	-174.5	-54.2	175	0	0	0	115.4	W696 S725	W696-L728 HydrophobicContact CH2-CD1 4.24Å; W696-L728 HydrophobicContact CZ2-CD1 4.28Å; S725-L728 PolarHBondContact OG-N 2.63Å
729	D	88.8	Confident	91.7	Very high	59 Å²	59	48.3 Å²	48.3	32%	0.316	25%	0.245	S	C	.	.	S	Bend	trans	-108.9	157.5	177.4	-72.1	-61.7	0	0	0	110.8	R724 S725 W731	R724-D729 VanDerWaalsContact CA-OD2 3.27Å; R724-D729 WeakPolarHBondContact CA-OD2 3.4Å; R724-D729 HydrophobicContact CB-CB 4.4Å; R724-D729 VanDerWaalsContact CD-CG 3.42Å; R724-D729 VanDerWaalsContact CD-OD2 3.29Å; R724-D729 WeakPolarHBondContact CD-OD2 3.46Å; S725-D729 PolarHBondContact N-OD2 2.95Å; D729-W731 VanDerWaalsContact O-CD1 3.23Å
730	D	85.1	Confident	92.1	Very high	85 Å²	85	44.2 Å²	44.2	46%	0.455	23%	0.23	S	C	.	.			trans	-77.6	141.6	175.4	-41.6	-73.4	0	0	0	110.9	K660 P732	K660-D730 IonicContact NZ-OD1 2.94Å; K660-D730 PolarHBondContact NZ-OD1 3.06Å; K660-D730 IonicContact NZ-OD2 3.36Å; K660-D730 PolarHBondContact NZ-OD2 2.8Å; D730-P732 VanDerWaalsContact O-CD 3.25Å; D730-P732 WeakPolarHBondContact O-CD 3.49Å
731	W	87.4	Confident	92.3	Very high	14 Å²	14	44.3 Å²	44.3	5%	0.053	24%	0.236	C	C	.	.			trans	-118.6	81.9	-175.5	-78.2	90.1	0	0	0	113.7	I674 I677 A697 L699 R724 S725 L726 D729 L735 M739	I674-W731 HydrophobicContact CD1-CG 4.49Å; I674-W731 HydrophobicContact CG1-CG 4.34Å; I677-W731 HydrophobicContact CD1-CE3 4.2Å; I677-W731 HydrophobicContact CD1-CZ3 4.33Å; A697-W731 HydrophobicContact CB-CH2 3.72Å; A697-W731 HydrophobicContact CB-CZ2 4.01Å; L699-W731 HydrophobicContact CD2-CH2 3.49Å; L699-W731 VanDerWaalsContact CD2-CH2 3.49Å; L699-W731 HydrophobicContact CD2-CZ3 3.54Å; R724-W731 HydrophobicContact CB-CH2 4.24Å; R724-W731 HydrophobicContact CB-CZ2 3.76Å; S725-W731 PolarHBondContact O-NE1 2.88Å; L726-W731 HydrophobicContact CD2-CH2 4.29Å; L726-W731 HydrophobicContact CD2-CZ2 3.75Å; D729-W731 VanDerWaalsContact O-CD1 3.23Å; W731-L735 HydrophobicContact CE3-CB 3.82Å; W731-L735 HydrophobicContact CZ3-CB 3.92Å; W731-M739 HydrophobicContact CH2-CG 3.88Å; W731-M739 HydrophobicContact CZ3-CB 4.47Å; W731-M739 HydrophobicContact CZ3-CG 3.55Å
732	P	88.5	Confident	92.3	Very high	52 Å²	52	44.5 Å²	44.5	34%	0.338	24%	0.237	S	C	.	.			trans	-52.3	157.4	166.7	-27.5	35.2	0	0	0	113.9	D730 E734 L735 S736	D730-P732 VanDerWaalsContact O-CD 3.25Å; D730-P732 WeakPolarHBondContact O-CD 3.49Å; P732-E734 VanDerWaalsContact C-N 3.32Å; P732-E734 HydrophobicContact CB-CG 4.43Å; P732-E734 WeakPolarHBondContact CB-OE1 3.3Å; P732-E734 WeakPolarHBondContact CB-OE2 3.5Å; P732-E734 PolarHBondContact O-N 3.01Å; P732-L735 HydrophobicContact CB-CG 4.37Å; P732-L735 HydrophobicContact CG-CD1 4.46Å; P732-L735 PolarHBondContact O-N 3.48Å; P732-S736 PolarHBondContact O-N 2.82Å; P732-S736 VanDerWaalsContact O-N 3.09Å; P732-S736 PolarHBondContact O-OG 3.12Å; P732-S736 VanDerWaalsContact O-OG 3.05Å
733	V	85.7	Confident	92.3	Very high	90 Å²	90	41.7 Å²	41.7	55%	0.545	23%	0.226	S	C	.	.	H	α-helix	trans	-63.8	-38	-173.2	68.7	0	0	0	0	111.7	L735 S736 M737	V733-L735 PolarHBondContact O-N 3.19Å; V733-S736 WeakPolarHBondContact O-CB 3.46Å; V733-S736 PolarHBondContact O-N 3.36Å; V733-M737 HydrophobicContact CG2-CG 4.4Å; V733-M737 HydrophobicContact CG2-SD 4.3Å; V733-M737 VanDerWaalsContact O-CG 3.29Å; V733-M737 WeakPolarHBondContact O-CG 3.31Å; V733-M737 PolarHBondContact O-N 3.18Å
734	E	88.1	Confident	92.4	Very high	31 Å²	31	41.5 Å²	41.5	15%	0.145	23%	0.225	C	C	.	.	H	α-helix	trans	-62.9	-38.8	178.1	65.9	-79.8	-169.8	0	0	112.7	P732 V738 V844 I882	P732-E734 VanDerWaalsContact C-N 3.32Å; P732-E734 HydrophobicContact CB-CG 4.43Å; P732-E734 WeakPolarHBondContact CB-OE1 3.3Å; P732-E734 WeakPolarHBondContact CB-OE2 3.5Å; P732-E734 PolarHBondContact O-N 3.01Å; E734-V738 WeakPolarHBondContact O-CG2 3.46Å; E734-V738 PolarHBondContact O-N 2.89Å; E734-V844 HydrophobicContact CB-CG1 4.11Å; E734-I882 HydrophobicContact CB-CD1 3.7Å; E734-I882 HydrophobicContact CB-CG1 4.09Å; E734-I882 HydrophobicContact CG-CD1 4.23Å; E734-I882 HydrophobicContact CG-CG1 4.09Å
735	L	92.6	Very high	92.4	Very high	20 Å²	20	38.7 Å²	38.7	11%	0.105	22%	0.222	C	C	.	.	H	α-helix	trans	-68.8	-42.5	174.6	-54.8	-165.7	0	0	0	110.6	L699 W731 P732 V733 M737 V738 M739 W852	L699-L735 HydrophobicContact CD1-CD1 4.04Å; L699-L735 HydrophobicContact CD1-CD2 4.24Å; L699-L735 HydrophobicContact CD2-CB 4.18Å; L699-L735 HydrophobicContact CD2-CD1 4.1Å; L699-L735 HydrophobicContact CD2-CD2 4.46Å; L699-L735 HydrophobicContact CD2-CG 4.49Å; W731-L735 HydrophobicContact CE3-CB 3.82Å; W731-L735 HydrophobicContact CZ3-CB 3.92Å; P732-L735 HydrophobicContact CB-CG 4.37Å; P732-L735 HydrophobicContact CG-CD1 4.46Å; P732-L735 PolarHBondContact O-N 3.48Å; V733-L735 PolarHBondContact O-N 3.19Å; L735-M737 VanDerWaalsContact C-N 3.33Å; L735-M737 PolarHBondContact O-N 3.24Å; L735-V738 PolarHBondContact O-N 2.92Å; L735-M739 WeakPolarHBondContact O-CG 3.45Å; L735-M739 PolarHBondContact O-N 3.19Å; L735-M739 VanDerWaalsContact O-N 3.09Å; L735-W852 HydrophobicContact CD2-CH2 3.7Å; L735-W852 HydrophobicContact CD2-CZ2 3.48Å; L735-W852 VanDerWaalsContact CD2-CZ2 3.48Å
736	S	93.4	Very high	92.5	Very high	8 Å²	8	40.3 Å²	40.3	6%	0.056	23%	0.23	C	C	.	.	H	α-helix	trans	-65	-37.2	-179.6	-59	0	0	0	0	112.1	P732 V733 T740	P732-S736 PolarHBondContact O-N 2.82Å; P732-S736 VanDerWaalsContact O-N 3.09Å; P732-S736 PolarHBondContact O-OG 3.12Å; P732-S736 VanDerWaalsContact O-OG 3.05Å; V733-S736 WeakPolarHBondContact O-CB 3.46Å; V733-S736 PolarHBondContact O-N 3.36Å; S736-T740 VanDerWaalsContact O-CB 3.29Å; S736-T740 WeakPolarHBondContact O-CB 3.38Å; S736-T740 PolarHBondContact O-N 2.9Å; S736-T740 PolarHBondContact O-OG1 3.19Å
737	M	94.4	Very high	92.8	Very high	73 Å²	73	40.3 Å²	40.3	36%	0.36	23%	0.23	S	C	.	.	H	α-helix	trans	-63.7	-46.8	174.5	-74	176.1	75.5	0	0	111.9	V733 L735 M739 T740 A741 V844 V845	V733-M737 HydrophobicContact CG2-CG 4.4Å; V733-M737 HydrophobicContact CG2-SD 4.3Å; V733-M737 VanDerWaalsContact O-CG 3.29Å; V733-M737 WeakPolarHBondContact O-CG 3.31Å; V733-M737 PolarHBondContact O-N 3.18Å; L735-M737 VanDerWaalsContact C-N 3.33Å; L735-M737 PolarHBondContact O-N 3.24Å; M737-M739 PolarHBondContact O-N 3.21Å; M737-T740 PolarHBondContact O-N 3.45Å; M737-A741 VanDerWaalsContact O-CB 3.3Å; M737-A741 WeakPolarHBondContact O-CB 3.48Å; M737-A741 PolarHBondContact O-N 3.03Å; M737-V844 HydrophobicContact CE-CB 3.84Å; M737-V844 HydrophobicContact CE-CG1 4.4Å; M737-V844 HydrophobicContact CE-CG2 3.91Å; M737-V844 HydrophobicContact SD-CB 4.16Å; M737-V844 HydrophobicContact SD-CG1 4.06Å; M737-V844 HydrophobicContact SD-CG2 4.32Å; M737-V845 HydrophobicContact CB-CG2 3.95Å
738	V	96.6	Very high	93.3	Very high	0 Å²	0	37 Å²	37	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-62.2	-45.3	178.1	180	0	0	0	0	111.3	E734 L735 T740 A741 I742 V845 Q848 L849 W852	E734-V738 WeakPolarHBondContact O-CG2 3.46Å; E734-V738 PolarHBondContact O-N 2.89Å; L735-V738 PolarHBondContact O-N 2.92Å; V738-T740 VanDerWaalsContact C-N 3.29Å; V738-T740 PolarHBondContact O-N 2.88Å; V738-A741 PolarHBondContact O-N 2.93Å; V738-I742 HydrophobicContact CG1-CD1 3.85Å; V738-I742 PolarHBondContact O-N 2.9Å; V738-V845 HydrophobicContact CB-CG1 4.47Å; V738-V845 HydrophobicContact CG1-CG1 4.48Å; V738-V845 HydrophobicContact CG2-CB 4.39Å; V738-V845 HydrophobicContact CG2-CG1 4.12Å; V738-V845 HydrophobicContact CG2-CG2 4.42Å; V738-Q848 HydrophobicContact CG2-CB 4Å; V738-Q848 HydrophobicContact CG2-CG 4.11Å; V738-L849 HydrophobicContact CG1-CD2 4Å; V738-L849 HydrophobicContact CG1-CG 4.29Å; V738-W852 HydrophobicContact CB-CZ3 4.37Å; V738-W852 HydrophobicContact CG1-CZ3 4.06Å; V738-W852 HydrophobicContact CG2-CH2 4.39Å; V738-W852 HydrophobicContact CG2-CZ3 4.2Å
739	M	97.4	Very high	93.8	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-66.1	-30.1	178.6	-68.8	-56.7	-53.7	0	0	113.3	I677 A697 L699 G702 L704 W731 L735 M737	I677-M739 HydrophobicContact CB-CB 4.48Å; I677-M739 HydrophobicContact CD1-CB 3.78Å; I677-M739 HydrophobicContact CD1-CG 4.44Å; I677-M739 HydrophobicContact CG1-CB 3.75Å; I677-M739 HydrophobicContact CG2-CB 3.9Å; I677-M739 HydrophobicContact CG2-CE 4.3Å; A697-M739 HydrophobicContact CB-CE 3.77Å; A697-M739 HydrophobicContact CB-SD 4.17Å; L699-M739 HydrophobicContact CD2-CG 4.49Å; G702-M739 VanDerWaalsContact C-CE 3.5Å; L704-M739 HydrophobicContact CD2-CE 3.59Å; L704-M739 HydrophobicContact CG-CE 4.24Å; W731-M739 HydrophobicContact CH2-CG 3.88Å; W731-M739 HydrophobicContact CZ3-CB 4.47Å; W731-M739 HydrophobicContact CZ3-CG 3.55Å; L735-M739 WeakPolarHBondContact O-CG 3.45Å; L735-M739 PolarHBondContact O-N 3.19Å; L735-M739 VanDerWaalsContact O-N 3.09Å; M737-M739 PolarHBondContact O-N 3.21Å
740	T	96.3	Very high	94.2	Very high	58 Å²	58	29.8 Å²	29.8	36%	0.356	18%	0.178	S	C	.	.	H	α-helix	trans	-77.7	-31.8	176.1	-55.3	0	0	0	0	112.1	V680 S736 M737 V738	V680-T740 HydrophobicContact CG2-CG2 4.38Å; S736-T740 VanDerWaalsContact O-CB 3.29Å; S736-T740 WeakPolarHBondContact O-CB 3.38Å; S736-T740 PolarHBondContact O-N 2.9Å; S736-T740 PolarHBondContact O-OG1 3.19Å; M737-T740 PolarHBondContact O-N 3.45Å; V738-T740 VanDerWaalsContact C-N 3.29Å; V738-T740 PolarHBondContact O-N 2.88Å
741	A	96.9	Very high	94.8	Very high	41 Å²	41	26.2 Å²	26.2	34%	0.339	16%	0.158	S	C	.	.	H	α-helix	trans	-81.8	-24.4	-176.6	0	0	0	0	0	114.6	M737 V738 M746 L807 V845	M737-A741 VanDerWaalsContact O-CB 3.3Å; M737-A741 WeakPolarHBondContact O-CB 3.48Å; M737-A741 PolarHBondContact O-N 3.03Å; V738-A741 PolarHBondContact O-N 2.93Å; A741-M746 VanDerWaalsContact O-CE 3.22Å; A741-M746 WeakPolarHBondContact O-CE 3.35Å; A741-L807 HydrophobicContact CB-CD2 3.7Å; A741-V845 HydrophobicContact CB-CG1 4.04Å; A741-V845 HydrophobicContact CB-CG2 4.04Å
742	I	97.5	Very high	95.2	Very high	8 Å²	8	26.7 Å²	26.7	4%	0.041	16%	0.161	C	C	.	.	S	Bend	trans	-99.9	-81.7	-178.6	-61.6	173.2	0	0	0	111	V738 M746 A747 L807 V811 L849	V738-I742 HydrophobicContact CG1-CD1 3.85Å; V738-I742 PolarHBondContact O-N 2.9Å; I742-M746 HydrophobicContact CB-CE 4.34Å; I742-M746 HydrophobicContact CB-SD 4.37Å; I742-M746 HydrophobicContact CG1-CE 4.11Å; I742-M746 HydrophobicContact CG1-SD 4.25Å; I742-M746 HydrophobicContact CG2-CB 4.34Å; I742-M746 HydrophobicContact CG2-SD 3.96Å; I742-M746 VanDerWaalsContact O-CB 3.3Å; I742-M746 WeakPolarHBondContact O-CB 3.34Å; I742-A747 HydrophobicContact CG2-CB 4.15Å; I742-L807 HydrophobicContact CG1-CD2 4.31Å; I742-V811 HydrophobicContact CD1-CG2 4.01Å; I742-L849 HydrophobicContact CD1-CD1 4.2Å; I742-L849 HydrophobicContact CD1-CD2 4.19Å
743	G	97.3	Very high	95.2	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	66.8	164.4	-173.2	0	0	0	0	0	115.1	N683 G702 A745 M746 A747	N683-G743 VanDerWaalsContact OD1-CA 3.28Å; N683-G743 WeakPolarHBondContact OD1-CA 3.47Å; G702-G743 WeakPolarHBondContact O-CA 3.21Å; G702-G743 PolarHBondContact O-N 3.46Å; G743-A745 VanDerWaalsContact C-N 3.31Å; G743-A745 PolarHBondContact O-N 3.39Å; G743-M746 PolarHBondContact O-N 2.95Å; G743-M746 VanDerWaalsContact O-N 3.12Å; G743-A747 WeakPolarHBondContact O-CB 3.33Å; G743-A747 PolarHBondContact O-N 3.21Å
744	N	98.3	Very high	95.4	Very high	5 Å²	5	25 Å²	25	3%	0.027	16%	0.16	C	C	.	.	H	α-helix	trans	-62.9	-32.9	-168.1	-67.8	-4.4	0	0	0	113.5	N683 F685 V687 A703 L704 N748	N683-N744 PolarHBondContact OD1-N 2.95Å; N683-N744 PolarHBondContact OD1-OD1 3.4Å; F685-N744 PolarHBondContact O-ND2 2.89Å; V687-N744 HydrophobicContact CB-CB 4.28Å; V687-N744 HydrophobicContact CG2-CB 4.24Å; V687-N744 PolarHBondContact N-ND2 3.43Å; A703-N744 WeakPolarHBondContact CA-OD1 3.38Å; A703-N744 WeakPolarHBondContact CB-OD1 3.33Å; L704-N744 PolarHBondContact N-OD1 2.89Å; L704-N744 PolarHBondContact O-ND2 2.76Å; L704-N744 PolarHBondContact O-OD1 2.77Å; N744-N748 WeakPolarHBondContact O-CB 3.38Å; N744-N748 PolarHBondContact O-N 2.75Å
745	A	97.4	Very high	95.4	Very high	38 Å²	38	26.5 Å²	26.5	31%	0.314	17%	0.169	S	C	.	.	H	α-helix	trans	-68.6	-38	176.9	0	0	0	0	0	112.6	R681 G743 S749	R681-A745 HydrophobicContact CB-CB 4.06Å; R681-A745 HydrophobicContact CG-CB 3.71Å; R681-A745 WeakPolarHBondContact O-CB 3.38Å; R681-A745 PolarHBondContact O-N 3.16Å; G743-A745 VanDerWaalsContact C-N 3.31Å; G743-A745 PolarHBondContact O-N 3.39Å; A745-S749 WeakPolarHBondContact O-CB 3.38Å; A745-S749 PolarHBondContact O-N 2.88Å
746	M	97.6	Very high	94.9	Very high	38 Å²	38	33.8 Å²	33.8	19%	0.187	20%	0.203	C	C	.	.	H	α-helix	trans	-74.3	-44.6	174.2	-167.6	-131.9	-81.1	0	0	110.5	A741 I742 G743 N748 S749 V750 L807 R808	A741-M746 VanDerWaalsContact O-CE 3.22Å; A741-M746 WeakPolarHBondContact O-CE 3.35Å; I742-M746 HydrophobicContact CB-CE 4.34Å; I742-M746 HydrophobicContact CB-SD 4.37Å; I742-M746 HydrophobicContact CG1-CE 4.11Å; I742-M746 HydrophobicContact CG1-SD 4.25Å; I742-M746 HydrophobicContact CG2-CB 4.34Å; I742-M746 HydrophobicContact CG2-SD 3.96Å; I742-M746 VanDerWaalsContact O-CB 3.3Å; I742-M746 WeakPolarHBondContact O-CB 3.34Å; G743-M746 PolarHBondContact O-N 2.95Å; G743-M746 VanDerWaalsContact O-N 3.12Å; M746-N748 PolarHBondContact O-N 3.31Å; M746-S749 WeakPolarHBondContact O-CA 3.27Å; M746-S749 WeakPolarHBondContact O-CB 3.2Å; M746-S749 PolarHBondContact O-N 2.78Å; M746-S749 PolarHBondContact O-OG 2.93Å; M746-V750 PolarHBondContact O-N 3.38Å; M746-L807 HydrophobicContact CE-CB 4.46Å; M746-L807 HydrophobicContact CE-CD2 3.74Å; M746-L807 HydrophobicContact CE-CG 3.85Å; M746-R808 HydrophobicContact CG-CB 4.43Å; M746-R808 HydrophobicContact CG-CG 4.31Å; M746-R808 HydrophobicContact SD-CB 4.3Å
747	A	97.8	Very high	94.4	Very high	1 Å²	1	37.5 Å²	37.5	1%	0.008	24%	0.242	C	C	.	.	H	α-helix	trans	-55.5	-49.9	178.4	0	0	0	0	0	111.7	V687 A703 I742 G743 S749 V750 W751	V687-A747 HydrophobicContact CG2-CB 4.45Å; A703-A747 HydrophobicContact CB-CB 4Å; I742-A747 HydrophobicContact CG2-CB 4.15Å; G743-A747 WeakPolarHBondContact O-CB 3.33Å; G743-A747 PolarHBondContact O-N 3.21Å; A747-S749 VanDerWaalsContact C-N 3.32Å; A747-S749 PolarHBondContact O-N 3.27Å; A747-V750 PolarHBondContact O-N 3.43Å; A747-W751 VanDerWaalsContact O-CD1 3.28Å; A747-W751 PolarHBondContact O-N 3Å
748	N	97.3	Very high	94.1	Very high	24 Å²	24	39.5 Å²	39.5	13%	0.128	25%	0.246	C	C	.	.	H	α-helix	trans	-72.2	-22.6	177.6	-71.5	-14.2	0	0	0	113	V687 N744 M746 V750 E752 G753 K760 K777	V687-N748 WeakPolarHBondContact CG2-OD1 3.45Å; V687-N748 PolarHBondContact O-ND2 3.19Å; V687-N748 PolarHBondContact O-OD1 2.87Å; N744-N748 WeakPolarHBondContact O-CB 3.38Å; N744-N748 PolarHBondContact O-N 2.75Å; M746-N748 PolarHBondContact O-N 3.31Å; N748-V750 PolarHBondContact O-N 2.94Å; N748-V750 VanDerWaalsContact O-N 3.12Å; N748-E752 HydrophobicContact CB-CB 4.02Å; N748-E752 HydrophobicContact CB-CG 4.01Å; N748-E752 VanDerWaalsContact CG-CD 3.43Å; N748-E752 PolarHBondContact ND2-OE2 3.02Å; N748-E752 CarbonylContact O-C 3.56Å; N748-E752 VanDerWaalsContact O-C 3.24Å; N748-E752 VanDerWaalsContact O-CA 3.3Å; N748-E752 WeakPolarHBondContact O-CA 3.49Å; N748-E752 PolarHBondContact O-N 3.27Å; N748-G753 PolarHBondContact O-N 3.42Å; N748-K760 PolarHBondContact ND2-NZ 2.96Å; N748-K777 PolarHBondContact OD1-NZ 3.12Å
749	S	96.2	Very high	93.8	Very high	40 Å²	40	45.8 Å²	45.8	28%	0.28	29%	0.285	S	S	.	.	H	α-helix	trans	-65.8	-8.8	167.8	85.8	0	0	0	0	114.1	A745 M746 A747 V785 R808	A745-S749 WeakPolarHBondContact O-CB 3.38Å; A745-S749 PolarHBondContact O-N 2.88Å; M746-S749 WeakPolarHBondContact O-CA 3.27Å; M746-S749 WeakPolarHBondContact O-CB 3.2Å; M746-S749 PolarHBondContact O-N 2.78Å; M746-S749 PolarHBondContact O-OG 2.93Å; A747-S749 VanDerWaalsContact C-N 3.32Å; A747-S749 PolarHBondContact O-N 3.27Å; S749-V785 WeakPolarHBondContact O-CG2 3.32Å; S749-R808 PolarHBondContact O-NH2 2.85Å; S749-R808 PolarHBondContact OG-NE 3.47Å
750	V	96.6	Very high	93.7	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-111.8	-54.8	173.4	172.2	0	0	0	0	110	M746 A747 N748 L784 V785 R808 V811 L812 A815	M746-V750 PolarHBondContact O-N 3.38Å; A747-V750 PolarHBondContact O-N 3.43Å; N748-V750 PolarHBondContact O-N 2.94Å; N748-V750 VanDerWaalsContact O-N 3.12Å; V750-L784 HydrophobicContact CG1-CD1 3.56Å; V750-L784 WeakPolarHBondContact O-CA 3.39Å; V750-V785 WeakPolarHBondContact O-CG2 3.42Å; V750-V785 PolarHBondContact O-N 3.03Å; V750-R808 HydrophobicContact CG2-CG 3.98Å; V750-V811 HydrophobicContact CG1-CG1 4.44Å; V750-V811 HydrophobicContact CG2-CG1 4.47Å; V750-L812 HydrophobicContact CG1-CB 4.29Å; V750-L812 HydrophobicContact CG1-CD1 4.07Å; V750-L812 HydrophobicContact CG2-CB 4.42Å; V750-A815 HydrophobicContact CG1-CB 4.42Å
751	W	96.9	Very high	93.7	Very high	10 Å²	10	45.4 Å²	45.4	4%	0.038	28%	0.28	C	S	.	.	H	α-helix	trans	-84.2	-10.5	-173.3	-66.2	100.8	0	0	0	115.6	L701 A747 K777 Y778 K781 L784 A815	L701-W751 HydrophobicContact CD2-CZ2 3.69Å; A747-W751 VanDerWaalsContact O-CD1 3.28Å; A747-W751 PolarHBondContact O-N 3Å; W751-K777 HydrophobicContact CB-CG 4.27Å; W751-Y778 HydrophobicContact CB-CE1 4.19Å; W751-Y778 AromaticContact CD2-CD1 3.76Å; W751-Y778 HydrophobicContact CD2-CD1 3.76Å; W751-Y778 AromaticContact CD2-CE1 3.74Å; W751-Y778 HydrophobicContact CD2-CE1 3.74Å; W751-Y778 AromaticContact CE3-CD1 3.58Å; W751-Y778 HydrophobicContact CE3-CD1 3.58Å; W751-Y778 HydrophobicContact CE3-CE1 4.01Å; W751-Y778 HydrophobicContact CG-CD1 4.33Å; W751-Y778 AromaticContact CG-CE1 3.82Å; W751-Y778 HydrophobicContact CG-CE1 3.82Å; W751-Y778 HydrophobicContact CH2-CD1 4.3Å; W751-Y778 HydrophobicContact CZ2-CD1 4.45Å; W751-Y778 AromaticContact CZ3-CD1 3.87Å; W751-Y778 HydrophobicContact CZ3-CD1 3.87Å; W751-K781 HydrophobicContact CZ3-CG 4.42Å; W751-L784 HydrophobicContact CD2-CD1 4.3Å; W751-L784 HydrophobicContact CE3-CD1 4.13Å; W751-L784 HydrophobicContact CZ3-CD1 4.44Å; W751-A815 HydrophobicContact CH2-CB 3.8Å; W751-A815 HydrophobicContact CZ2-CB 3.58Å
752	E	95.5	Very high	93.6	Very high	23 Å²	23	45 Å²	45	11%	0.107	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-132.4	32.2	175	-54.5	-171.7	155.7	0	0	110.4	N748 L755 K760 W773 K777	N748-E752 HydrophobicContact CB-CB 4.02Å; N748-E752 HydrophobicContact CB-CG 4.01Å; N748-E752 VanDerWaalsContact CG-CD 3.43Å; N748-E752 PolarHBondContact ND2-OE2 3.02Å; N748-E752 CarbonylContact O-C 3.56Å; N748-E752 VanDerWaalsContact O-C 3.24Å; N748-E752 VanDerWaalsContact O-CA 3.3Å; N748-E752 WeakPolarHBondContact O-CA 3.49Å; N748-E752 PolarHBondContact O-N 3.27Å; E752-L755 HydrophobicContact CB-CD1 4.1Å; E752-L755 HydrophobicContact CB-CD2 4.27Å; E752-L755 HydrophobicContact CB-CG 4.2Å; E752-L755 WeakPolarHBondContact O-CD1 3.27Å; E752-L755 WeakPolarHBondContact O-CG 3.49Å; E752-K760 WeakPolarHBondContact OE1-CE 3.39Å; E752-K760 IonicContact OE1-NZ 3.45Å; E752-K760 WeakPolarHBondContact OE2-CE 3.45Å; E752-K760 IonicContact OE2-NZ 3.21Å; E752-K760 PolarHBondContact OE2-NZ 3.16Å; E752-W773 PolarHBondContact OE1-NE1 2.88Å; E752-K777 VanDerWaalsContact CD-NZ 3.34Å; E752-K777 HydrophobicContact CG-CD 4.09Å; E752-K777 VanDerWaalsContact CG-CE 3.44Å; E752-K777 WeakPolarHBondContact OE1-CE 3.44Å; E752-K777 IonicContact OE1-NZ 2.8Å; E752-K777 PolarHBondContact OE1-NZ 2.82Å
753	G	89.1	Confident	93.4	Very high	46 Å²	46	48.4 Å²	48.4	47%	0.474	30%	0.298	S	S	.	.	S	Bend	trans	-91.1	-11.6	-178.2	0	0	0	0	0	115	N748 F783	N748-G753 PolarHBondContact O-N 3.42Å; G753-F783 PolarHBondContact N-O 3.3Å; G753-F783 VanDerWaalsContact N-O 3.17Å
754	C	90.4	Very high	93.2	Very high	60 Å²	60	55.6 Å²	55.6	41%	0.405	34%	0.336	S	S	.	.			trans	-120.3	72.5	172.6	-163.5	0	0	0	0	110.2	F783	C754-F783 PolarHBondContact N-O 2.96Å; C754-F783 WeakPolarHBondContact O-CA 3.25Å
755	L	88.5	Confident	93.2	Very high	63 Å²	63	56.9 Å²	56.9	33%	0.33	35%	0.346	S	S	.	.			trans	-92.2	14.2	-175.2	-77.8	178.8	0	0	0	114.7	E752 G757 Y758 W773 F783	E752-L755 HydrophobicContact CB-CD1 4.1Å; E752-L755 HydrophobicContact CB-CD2 4.27Å; E752-L755 HydrophobicContact CB-CG 4.2Å; E752-L755 WeakPolarHBondContact O-CD1 3.27Å; E752-L755 WeakPolarHBondContact O-CG 3.49Å; L755-G757 PolarHBondContact O-N 3.16Å; L755-Y758 PolarHBondContact O-N 2.89Å; L755-W773 HydrophobicContact CD2-CH2 3.5Å; L755-W773 VanDerWaalsContact CD2-CH2 3.5Å; L755-W773 HydrophobicContact CD2-CZ2 3.91Å; L755-F783 HydrophobicContact CD2-CB 4.12Å; L755-F783 HydrophobicContact CD2-CD1 4.37Å; L755-F783 HydrophobicContact CD2-CD2 4.39Å; L755-F783 HydrophobicContact CD2-CG 4.04Å
756	E	81.8	Confident	93.2	Very high	174 Å²	174	58.3 Å²	58.3	81%	0.813	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	111.5	-170.3	-63.2	-164.6	168.9	0	0	112.5	Y758	E756-Y758 VanDerWaalsContact O-CD2 3.27Å; E756-Y758 WeakPolarHBondContact O-CD2 3.28Å
757	G	81.9	Confident	93.1	Very high	85 Å²	85	61.6 Å²	61.6	88%	0.876	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.2	-2.3	-177.7	0	0	0	0	0	115.9	L755	L755-G757 PolarHBondContact O-N 3.16Å
758	Y	88.8	Confident	93	Very high	115 Å²	115	67 Å²	67	45%	0.451	39%	0.386	S	S	.	.			trans	-108.7	128.6	-175.7	-65.6	-80	0	0	0	112.5	L755 E756 L782 F783	L755-Y758 PolarHBondContact O-N 2.89Å; E756-Y758 VanDerWaalsContact O-CD2 3.27Å; E756-Y758 WeakPolarHBondContact O-CD2 3.28Å; Y758-L782 HydrophobicContact CE1-CD2 3.89Å; Y758-L782 HydrophobicContact CE2-CD2 4.41Å; Y758-L782 HydrophobicContact CE2-CG 4.44Å; Y758-F783 AromaticContact CD1-CE1 3.65Å; Y758-F783 HydrophobicContact CD1-CE1 3.65Å; Y758-F783 HydrophobicContact CD1-CZ 4.26Å; Y758-F783 AromaticContact CD2-CD1 3.96Å; Y758-F783 HydrophobicContact CD2-CD1 3.96Å; Y758-F783 AromaticContact CD2-CE1 3.72Å; Y758-F783 HydrophobicContact CD2-CE1 3.72Å; Y758-F783 HydrophobicContact CE1-CE1 4.15Å; Y758-F783 HydrophobicContact CE2-CE1 4.21Å; Y758-F783 HydrophobicContact CG-CD1 4.04Å; Y758-F783 AromaticContact CG-CE1 3.42Å; Y758-F783 HydrophobicContact CG-CE1 3.42Å; Y758-F783 VanDerWaalsContact CG-CE1 3.42Å; Y758-F783 HydrophobicContact CG-CZ 4.28Å
759	T	91.1	Very high	93	Very high	132 Å²	132	69.7 Å²	69.7	81%	0.81	40%	0.398	S	S	*	.	P	Polyproline II helix	trans	-101.9	124.6	176.8	-54.7	0	0	0	0	110.3	W773	T759-W773 VanDerWaalsContact O-CZ3 3.27Å; T759-W773 WeakPolarHBondContact O-CZ3 3.4Å
760	K	94.8	Very high	93.1	Very high	40 Å²	40	68.2 Å²	68.2	17%	0.174	39%	0.386	C	S	.	.	P	Polyproline II helix	trans	-65.8	137.5	176.1	-171.2	175	-176.5	177.2	0	111	V687 D688 D690 N748 E752 W773	V687-K760 WeakPolarHBondContact O-CE 3.38Å; V687-K760 PolarHBondContact O-NZ 2.79Å; D688-K760 VanDerWaalsContact O-CE 3.3Å; D688-K760 WeakPolarHBondContact O-CE 3.49Å; D690-K760 WeakPolarHBondContact OD1-CE 3.35Å; D690-K760 IonicContact OD1-NZ 2.72Å; D690-K760 PolarHBondContact OD1-NZ 2.66Å; D690-K760 WeakPolarHBondContact OD2-CD 3.45Å; D690-K760 WeakPolarHBondContact OD2-CE 3.23Å; D690-K760 IonicContact OD2-NZ 3.75Å; D690-K760 PolarHBondContact OD2-NZ 2.73Å; N748-K760 PolarHBondContact ND2-NZ 2.96Å; E752-K760 WeakPolarHBondContact OE1-CE 3.39Å; E752-K760 IonicContact OE1-NZ 3.45Å; E752-K760 WeakPolarHBondContact OE2-CE 3.45Å; E752-K760 IonicContact OE2-NZ 3.21Å; E752-K760 PolarHBondContact OE2-NZ 3.16Å; K760-W773 VanDerWaalsContact CA-CH2 3.47Å; K760-W773 HydrophobicContact CB-CH2 3.8Å; K760-W773 HydrophobicContact CB-CZ2 3.67Å; K760-W773 HydrophobicContact CB-CZ3 4.46Å; K760-W773 HydrophobicContact CD-CZ2 4.34Å; K760-W773 HydrophobicContact CG-CH2 4.32Å; K760-W773 HydrophobicContact CG-CZ2 3.69Å
761	P	96.6	Very high	93.1	Very high	11 Å²	11	70.5 Å²	70.5	7%	0.071	40%	0.397	C	S	.	.	P	Polyproline II helix	trans	-66.1	148.7	174.4	29	-35.2	0	0	0	110.7	C689 K770 W773	C689-P761 VanDerWaalsContact CA-O 3.26Å; C689-P761 WeakPolarHBondContact CA-O 3.49Å; C689-P761 HydrophobicContact CB-CG 4.44Å; P761-K770 HydrophobicContact CB-CG 4.06Å; P761-K770 HydrophobicContact CG-CG 4.22Å; P761-W773 HydrophobicContact CG-CB 3.76Å; P761-W773 HydrophobicContact CG-CD2 4.29Å; P761-W773 HydrophobicContact CG-CG 3.77Å
762	G	94.1	Very high	93.1	Very high	32 Å²	32	77.3 Å²	77.3	33%	0.33	42%	0.423	S	S	.	.			trans	-92.4	-179.5	173.5	0	0	0	0	0	112.9	C689 D764 S765 K770	C689-G762 CarbonylContact O-C 3.6Å; G762-D764 PolarHBondContact O-N 3.4Å; G762-S765 PolarHBondContact N-OG 2.85Å; G762-S765 WeakPolarHBondContact O-CB 3.28Å; G762-S765 PolarHBondContact O-N 3.47Å; G762-K770 VanDerWaalsContact O-CE 3.26Å; G762-K770 WeakPolarHBondContact O-CE 3.47Å
763	N	94.3	Very high	93.2	Very high	80 Å²	80	77 Å²	77	43%	0.428	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.6	-42.1	172.6	-178.5	83.1	0	0	0	111.9	C689 A691 K770	C689-N763 PolarHBondContact O-N 2.93Å; A691-N763 HydrophobicContact CB-CB 4.27Å; A691-N763 WeakPolarHBondContact CB-OD1 3.48Å; N763-K770 WeakPolarHBondContact O-CE 3.29Å; N763-K770 PolarHBondContact O-NZ 3.44Å
764	D	93.3	Very high	93.7	Very high	150 Å²	150	74.8 Å²	74.8	80%	0.802	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.2	-0.9	-172.9	-51.9	-27.4	0	0	0	113.4	G762	G762-D764 PolarHBondContact O-N 3.4Å
765	S	96.6	Very high	94	Very high	33 Å²	33	75 Å²	75	23%	0.231	39%	0.39	C	S	.	.	S	Bend	trans	-64.2	154.2	175	-68.3	0	0	0	0	111.8	G762 K770	G762-S765 PolarHBondContact N-OG 2.85Å; G762-S765 WeakPolarHBondContact O-CB 3.28Å; G762-S765 PolarHBondContact O-N 3.47Å; S765-K770 WeakPolarHBondContact O-CE 3.46Å; S765-K770 PolarHBondContact O-NZ 3.28Å
766	T	97.3	Very high	94.4	Very high	68 Å²	68	72.4 Å²	72.4	42%	0.417	38%	0.378	S	S	.	.			trans	-65.3	155	179.8	62.7	0	0	0	0	111.9	E768 E769 K770	T766-E768 PolarHBondContact O-N 3.11Å; T766-E769 WeakPolarHBondContact CB-OE2 3.3Å; T766-E769 PolarHBondContact N-OE2 3.28Å; T766-E769 PolarHBondContact O-N 3.23Å; T766-E769 VanDerWaalsContact O-N 3.16Å; T766-E769 WeakPolarHBondContact OG1-CG 3.43Å; T766-E769 PolarHBondContact OG1-N 3.35Å; T766-E769 PolarHBondContact OG1-OE2 2.84Å; T766-K770 WeakPolarHBondContact O-CG 3.31Å; T766-K770 PolarHBondContact O-N 2.91Å
767	R	95.9	Very high	95.1	Very high	106 Å²	106	64.1 Å²	64.1	40%	0.4	34%	0.339	S	S	.	.	H	α-helix	trans	-56.3	-38.9	175.5	-176	-170.4	175.8	86.6	6.3	111.1	E708 M712 E769 K770 E771	E708-R767 WeakPolarHBondContact OE1-CB 3.39Å; M712-R767 HydrophobicContact SD-CG 4.2Å; R767-E769 VanDerWaalsContact C-N 3.33Å; R767-E769 PolarHBondContact O-N 2.96Å; R767-K770 PolarHBondContact O-N 3.06Å; R767-E771 PolarHBondContact O-N 2.85Å
768	E	96.2	Very high	95.9	Very high	116 Å²	116	60.2 Å²	60.2	54%	0.542	30%	0.298	S	S	.	.	H	α-helix	trans	-70.4	-28.8	-177.4	-65.1	64.4	-142.1	0	0	112.2	T766 R772	T766-E768 PolarHBondContact O-N 3.11Å; E768-R772 VanDerWaalsContact C-NH2 3.28Å; E768-R772 VanDerWaalsContact O-CZ 3.24Å; E768-R772 PolarHBondContact O-N 3.39Å; E768-R772 PolarHBondContact O-NE 2.67Å; E768-R772 PolarHBondContact O-NH2 3.13Å
769	E	97	Very high	96.2	Very high	80 Å²	80	59.1 Å²	59.1	37%	0.374	30%	0.297	S	S	.	.	H	α-helix	trans	-74.9	-44.8	171	-71.8	163.3	138.5	0	0	111.1	T766 R767 E771 R772 W773	T766-E769 WeakPolarHBondContact CB-OE2 3.3Å; T766-E769 PolarHBondContact N-OE2 3.28Å; T766-E769 PolarHBondContact O-N 3.23Å; T766-E769 VanDerWaalsContact O-N 3.16Å; T766-E769 WeakPolarHBondContact OG1-CG 3.43Å; T766-E769 PolarHBondContact OG1-N 3.35Å; T766-E769 PolarHBondContact OG1-OE2 2.84Å; R767-E769 VanDerWaalsContact C-N 3.33Å; R767-E769 PolarHBondContact O-N 2.96Å; E769-E771 PolarHBondContact O-N 2.95Å; E769-R772 VanDerWaalsContact CG-NH2 3.34Å; E769-R772 PolarHBondContact O-N 3.17Å; E769-W773 PolarHBondContact O-N 2.82Å
770	K	97.9	Very high	96.4	Very high	8 Å²	8	58.7 Å²	58.7	4%	0.035	29%	0.286	C	S	.	.	H	α-helix	trans	-61.5	-40.3	175.9	-68.4	162.3	175.1	157.6	0	111.9	C689 E708 M712 P761 G762 N763 S765 T766 R767 W773 I774	C689-K770 HydrophobicContact CB-CG 4.36Å; E708-K770 IonicContact OE1-NZ 2.61Å; E708-K770 WeakPolarHBondContact OE2-CD 3.41Å; E708-K770 WeakPolarHBondContact OE2-CE 3.39Å; E708-K770 IonicContact OE2-NZ 3.08Å; E708-K770 PolarHBondContact OE2-NZ 2.86Å; M712-K770 HydrophobicContact CE-CB 3.46Å; M712-K770 VanDerWaalsContact CE-CB 3.46Å; M712-K770 HydrophobicContact CE-CD 4.28Å; M712-K770 HydrophobicContact CE-CG 4.45Å; M712-K770 HydrophobicContact SD-CB 3.87Å; P761-K770 HydrophobicContact CB-CG 4.06Å; P761-K770 HydrophobicContact CG-CG 4.22Å; G762-K770 VanDerWaalsContact O-CE 3.26Å; G762-K770 WeakPolarHBondContact O-CE 3.47Å; N763-K770 WeakPolarHBondContact O-CE 3.29Å; N763-K770 PolarHBondContact O-NZ 3.44Å; S765-K770 WeakPolarHBondContact O-CE 3.46Å; S765-K770 PolarHBondContact O-NZ 3.28Å; T766-K770 WeakPolarHBondContact O-CG 3.31Å; T766-K770 PolarHBondContact O-N 2.91Å; R767-K770 PolarHBondContact O-N 3.06Å; K770-W773 PolarHBondContact O-N 3.09Å; K770-I774 WeakPolarHBondContact O-CB 3.28Å; K770-I774 WeakPolarHBondContact O-CD1 3.31Å; K770-I774 VanDerWaalsContact O-CG1 3.31Å; K770-I774 WeakPolarHBondContact O-CG1 3.35Å; K770-I774 PolarHBondContact O-N 2.86Å
771	E	97.5	Very high	96.4	Very high	48 Å²	48	60.6 Å²	60.6	22%	0.224	29%	0.294	C	S	.	.	H	α-helix	trans	-68	-41.4	176.5	-170.7	165.5	162.8	0	0	111.4	M712 R767 E769 W773 I774 R775	M712-E771 HydrophobicContact CG-CB 4.23Å; M712-E771 HydrophobicContact CG-CG 4.46Å; M712-E771 VanDerWaalsContact SD-CA 3.56Å; M712-E771 HydrophobicContact SD-CB 3.62Å; M712-E771 HydrophobicContact SD-CG 4.45Å; M712-E771 PolarHBondContact SD-N 3.39Å; R767-E771 PolarHBondContact O-N 2.85Å; E769-E771 PolarHBondContact O-N 2.95Å; E771-W773 VanDerWaalsContact C-N 3.32Å; E771-W773 PolarHBondContact O-N 2.77Å; E771-I774 PolarHBondContact O-N 3.19Å; E771-R775 HydrophobicContact CG-CG 4.35Å; E771-R775 WeakPolarHBondContact O-CB 3.35Å; E771-R775 WeakPolarHBondContact O-CG 3.33Å; E771-R775 PolarHBondContact O-N 2.81Å; E771-R775 IonicContact OE1-CZ 2.9Å; E771-R775 VanDerWaalsContact OE1-CZ 3.28Å; E771-R775 IonicContact OE1-NE 2.64Å; E771-R775 PolarHBondContact OE1-NE 2.87Å; E771-R775 IonicContact OE1-NH2 3.14Å; E771-R775 PolarHBondContact OE1-NH2 2.82Å
772	R	97.1	Very high	96.3	Very high	153 Å²	153	63.5 Å²	63.5	58%	0.577	31%	0.309	S	S	*	.	H	α-helix	trans	-58.8	-43	172.9	-91.7	175.4	-76.5	125.1	-5.1	112	E768 E769 A776	E768-R772 VanDerWaalsContact C-NH2 3.28Å; E768-R772 VanDerWaalsContact O-CZ 3.24Å; E768-R772 PolarHBondContact O-N 3.39Å; E768-R772 PolarHBondContact O-NE 2.67Å; E768-R772 PolarHBondContact O-NH2 3.13Å; E769-R772 VanDerWaalsContact CG-NH2 3.34Å; E769-R772 PolarHBondContact O-N 3.17Å; R772-A776 VanDerWaalsContact O-CB 3.3Å; R772-A776 WeakPolarHBondContact O-CB 3.26Å; R772-A776 PolarHBondContact O-N 2.85Å
773	W	97.7	Very high	96.4	Very high	16 Å²	16	62.1 Å²	62.1	6%	0.061	29%	0.294	C	S	.	.	H	α-helix	trans	-61.4	-52.5	176.1	-175.1	-102	0	0	0	112.3	E752 L755 T759 K760 P761 E769 K770 E771 R775 A776 K777 F783	E752-W773 PolarHBondContact OE1-NE1 2.88Å; L755-W773 HydrophobicContact CD2-CH2 3.5Å; L755-W773 VanDerWaalsContact CD2-CH2 3.5Å; L755-W773 HydrophobicContact CD2-CZ2 3.91Å; T759-W773 VanDerWaalsContact O-CZ3 3.27Å; T759-W773 WeakPolarHBondContact O-CZ3 3.4Å; K760-W773 VanDerWaalsContact CA-CH2 3.47Å; K760-W773 HydrophobicContact CB-CH2 3.8Å; K760-W773 HydrophobicContact CB-CZ2 3.67Å; K760-W773 HydrophobicContact CB-CZ3 4.46Å; K760-W773 HydrophobicContact CD-CZ2 4.34Å; K760-W773 HydrophobicContact CG-CH2 4.32Å; K760-W773 HydrophobicContact CG-CZ2 3.69Å; P761-W773 HydrophobicContact CG-CB 3.76Å; P761-W773 HydrophobicContact CG-CD2 4.29Å; P761-W773 HydrophobicContact CG-CG 3.77Å; E769-W773 PolarHBondContact O-N 2.82Å; K770-W773 PolarHBondContact O-N 3.09Å; E771-W773 VanDerWaalsContact C-N 3.32Å; E771-W773 PolarHBondContact O-N 2.77Å; W773-R775 VanDerWaalsContact C-N 3.3Å; W773-R775 PolarHBondContact O-N 2.93Å; W773-A776 PolarHBondContact O-N 3.44Å; W773-K777 VanDerWaalsContact O-CB 3.23Å; W773-K777 WeakPolarHBondContact O-CB 3.23Å; W773-K777 PolarHBondContact O-N 3.22Å; W773-F783 AromaticContact CD2-CE2 3.83Å; W773-F783 HydrophobicContact CD2-CE2 3.83Å; W773-F783 HydrophobicContact CD2-CZ 4.36Å; W773-F783 AromaticContact CE2-CE2 3.86Å; W773-F783 AromaticContact CE3-CE2 3.75Å; W773-F783 HydrophobicContact CE3-CE2 3.75Å; W773-F783 AromaticContact CE3-CZ 3.82Å; W773-F783 HydrophobicContact CE3-CZ 3.82Å; W773-F783 HydrophobicContact CH2-CD2 4.2Å; W773-F783 AromaticContact CH2-CE2 3.82Å; W773-F783 HydrophobicContact CH2-CE2 3.82Å; W773-F783 HydrophobicContact CH2-CZ 4.09Å; W773-F783 HydrophobicContact CZ2-CD2 4.08Å; W773-F783 AromaticContact CZ2-CE2 3.86Å; W773-F783 HydrophobicContact CZ2-CE2 3.86Å; W773-F783 HydrophobicContact CZ3-CE1 4.43Å; W773-F783 AromaticContact CZ3-CE2 3.75Å; W773-F783 HydrophobicContact CZ3-CE2 3.75Å; W773-F783 AromaticContact CZ3-CZ 3.68Å; W773-F783 HydrophobicContact CZ3-CZ 3.68Å
774	I	98.3	Very high	96.4	Very high	1 Å²	1	58.9 Å²	58.9	1%	0.005	28%	0.277	C	S	.	.	H	α-helix	trans	-60.5	-39.3	-177.9	-74.3	165.6	0	0	0	111.2	D688 C709 M712 L716 K770 E771 Y778	D688-I774 HydrophobicContact CB-CD1 4.27Å; D688-I774 HydrophobicContact CB-CG1 3.96Å; C709-I774 HydrophobicContact CB-CD1 3.96Å; M712-I774 HydrophobicContact CB-CD1 3.78Å; M712-I774 HydrophobicContact CE-CD1 3.9Å; M712-I774 HydrophobicContact SD-CD1 4.22Å; L716-I774 HydrophobicContact CD1-CG2 3.8Å; L716-I774 HydrophobicContact CD2-CG2 4.43Å; L716-I774 HydrophobicContact CG-CG2 4.28Å; K770-I774 WeakPolarHBondContact O-CB 3.28Å; K770-I774 WeakPolarHBondContact O-CD1 3.31Å; K770-I774 VanDerWaalsContact O-CG1 3.31Å; K770-I774 WeakPolarHBondContact O-CG1 3.35Å; K770-I774 PolarHBondContact O-N 2.86Å; E771-I774 PolarHBondContact O-N 3.19Å; I774-Y778 HydrophobicContact CG2-CD2 4.19Å; I774-Y778 WeakPolarHBondContact O-CD2 3.27Å; I774-Y778 PolarHBondContact O-N 2.97Å
775	R	97.6	Very high	96.5	Very high	63 Å²	63	53.1 Å²	53.1	24%	0.238	25%	0.247	C	C	.	.	I	π-helix	trans	-68.3	-47.2	173.7	-69.4	-177	178.8	-76.9	-3	112.4	L716 E771 W773 K777 E779 Q780	L716-R775 HydrophobicContact CD2-CG 4.02Å; E771-R775 HydrophobicContact CG-CG 4.35Å; E771-R775 WeakPolarHBondContact O-CB 3.35Å; E771-R775 WeakPolarHBondContact O-CG 3.33Å; E771-R775 PolarHBondContact O-N 2.81Å; E771-R775 IonicContact OE1-CZ 2.9Å; E771-R775 VanDerWaalsContact OE1-CZ 3.28Å; E771-R775 IonicContact OE1-NE 2.64Å; E771-R775 PolarHBondContact OE1-NE 2.87Å; E771-R775 IonicContact OE1-NH2 3.14Å; E771-R775 PolarHBondContact OE1-NH2 2.82Å; W773-R775 VanDerWaalsContact C-N 3.3Å; W773-R775 PolarHBondContact O-N 2.93Å; R775-K777 VanDerWaalsContact C-N 3.27Å; R775-K777 PolarHBondContact O-N 2.98Å; R775-E779 HydrophobicContact CB-CB 4.45Å; R775-E779 WeakPolarHBondContact CB-OE2 3.32Å; R775-E779 WeakPolarHBondContact CD-OE2 3.48Å; R775-E779 WeakPolarHBondContact CG-OE2 3.38Å; R775-E779 IonicContact CZ-OE2 3.28Å; R775-E779 IonicContact NE-OE2 2.79Å; R775-E779 VanDerWaalsContact NH1-CD 3.3Å; R775-E779 IonicContact NH1-OE1 2.87Å; R775-E779 PolarHBondContact NH1-OE1 2.81Å; R775-E779 VanDerWaalsContact NH1-OE1 3.08Å; R775-E779 IonicContact NH1-OE2 3.08Å; R775-E779 PolarHBondContact NH1-OE2 3.03Å; R775-E779 WeakPolarHBondContact O-CA 3.48Å; R775-E779 VanDerWaalsContact O-CB 3.3Å; R775-E779 WeakPolarHBondContact O-CB 3.29Å; R775-E779 PolarHBondContact O-N 2.82Å; R775-Q780 PolarHBondContact O-N 3.13Å
776	A	96.8	Very high	96.2	Very high	10 Å²	10	54.1 Å²	54.1	8%	0.083	26%	0.262	C	S	.	.	I	π-helix	trans	-56.1	-44	175.4	0	0	0	0	0	111.7	R772 W773 Q780 K781 L782 F783	R772-A776 VanDerWaalsContact O-CB 3.3Å; R772-A776 WeakPolarHBondContact O-CB 3.26Å; R772-A776 PolarHBondContact O-N 2.85Å; W773-A776 PolarHBondContact O-N 3.44Å; A776-Q780 CarbonylContact O-C 3.54Å; A776-K781 PolarHBondContact O-N 2.83Å; A776-L782 HydrophobicContact CB-CB 4.32Å; A776-L782 HydrophobicContact CB-CD2 4.07Å; A776-L782 VanDerWaalsContact O-CB 3.27Å; A776-L782 WeakPolarHBondContact O-CB 3.34Å; A776-L782 PolarHBondContact O-N 2.75Å; A776-F783 HydrophobicContact CB-CE1 4.44Å; A776-F783 HydrophobicContact CB-CE2 3.9Å; A776-F783 HydrophobicContact CB-CZ 3.58Å
777	K	97.4	Very high	95.9	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	26%	0.258	C	S	.	.	I	π-helix	trans	-67.6	-50.8	-177.7	-172.9	171.2	175.6	-175.7	0	113.7	V687 D688 N748 W751 E752 W773 R775 K781 F783	V687-K777 PolarHBondContact O-NZ 2.66Å; D688-K777 IonicContact OD1-NZ 3.35Å; D688-K777 PolarHBondContact OD1-NZ 2.88Å; N748-K777 PolarHBondContact OD1-NZ 3.12Å; W751-K777 HydrophobicContact CB-CG 4.27Å; E752-K777 VanDerWaalsContact CD-NZ 3.34Å; E752-K777 HydrophobicContact CG-CD 4.09Å; E752-K777 VanDerWaalsContact CG-CE 3.44Å; E752-K777 WeakPolarHBondContact OE1-CE 3.44Å; E752-K777 IonicContact OE1-NZ 2.8Å; E752-K777 PolarHBondContact OE1-NZ 2.82Å; W773-K777 VanDerWaalsContact O-CB 3.23Å; W773-K777 WeakPolarHBondContact O-CB 3.23Å; W773-K777 PolarHBondContact O-N 3.22Å; R775-K777 VanDerWaalsContact C-N 3.27Å; R775-K777 PolarHBondContact O-N 2.98Å; K777-K781 WeakPolarHBondContact O-CA 3.3Å; K777-F783 HydrophobicContact CB-CD2 3.92Å; K777-F783 HydrophobicContact CB-CE2 4Å; K777-F783 HydrophobicContact CG-CD2 4.22Å
778	Y	97.4	Very high	95.3	Very high	3 Å²	3	52 Å²	52	1%	0.012	26%	0.259	C	S	.	.	I	π-helix	trans	-109.2	-32.5	-169.2	-58	-69.2	0	0	0	115.3	D688 L701 H713 L716 W751 I774	D688-Y778 VanDerWaalsContact OD1-CE2 3.28Å; D688-Y778 WeakPolarHBondContact OD1-CE2 3.42Å; D688-Y778 PolarHBondContact OD1-OH 3.48Å; D688-Y778 VanDerWaalsContact OD1-OH 3.05Å; L701-Y778 HydrophobicContact CD1-CD1 3.87Å; L701-Y778 HydrophobicContact CD1-CE1 3.58Å; L701-Y778 HydrophobicContact CD1-CG 4.44Å; L701-Y778 HydrophobicContact CD2-CD1 4.15Å; L701-Y778 HydrophobicContact CD2-CE1 4.12Å; L701-Y778 HydrophobicContact CG-CE1 4.41Å; H713-Y778 AromaticContact CE1-CD2 3.46Å; H713-Y778 VanDerWaalsContact CE1-CD2 3.46Å; H713-Y778 WeakPolarHBondContact CE1-CD2 3.35Å; H713-Y778 AromaticContact CE1-CE2 3.19Å; H713-Y778 WeakPolarHBondContact CE1-CE2 3.36Å; H713-Y778 AromaticContact CE1-CZ 3.79Å; H713-Y778 AromaticContact NE2-CD2 3.7Å; H713-Y778 AromaticContact NE2-CE2 3.27Å; H713-Y778 VanDerWaalsContact NE2-CE2 3.27Å; H713-Y778 WeakPolarHBondContact NE2-CE2 3.42Å; L716-Y778 HydrophobicContact CD1-CD2 4.41Å; W751-Y778 HydrophobicContact CB-CE1 4.19Å; W751-Y778 AromaticContact CD2-CD1 3.76Å; W751-Y778 HydrophobicContact CD2-CD1 3.76Å; W751-Y778 AromaticContact CD2-CE1 3.74Å; W751-Y778 HydrophobicContact CD2-CE1 3.74Å; W751-Y778 AromaticContact CE3-CD1 3.58Å; W751-Y778 HydrophobicContact CE3-CD1 3.58Å; W751-Y778 HydrophobicContact CE3-CE1 4.01Å; W751-Y778 HydrophobicContact CG-CD1 4.33Å; W751-Y778 AromaticContact CG-CE1 3.82Å; W751-Y778 HydrophobicContact CG-CE1 3.82Å; W751-Y778 HydrophobicContact CH2-CD1 4.3Å; W751-Y778 HydrophobicContact CZ2-CD1 4.45Å; W751-Y778 AromaticContact CZ3-CD1 3.87Å; W751-Y778 HydrophobicContact CZ3-CD1 3.87Å; I774-Y778 HydrophobicContact CG2-CD2 4.19Å; I774-Y778 WeakPolarHBondContact O-CD2 3.27Å; I774-Y778 PolarHBondContact O-N 2.97Å
779	E	95.4	Very high	94.5	Very high	91 Å²	91	56.1 Å²	56.1	43%	0.425	28%	0.279	S	S	.	.	I	π-helix	trans	-87.2	-38.4	-179.7	-177.2	176.1	-134.6	0	0	111	L716 L720 R775	L716-E779 HydrophobicContact CD2-CB 4.34Å; L720-E779 HydrophobicContact CD1-CB 4.09Å; L720-E779 HydrophobicContact CD1-CG 4.32Å; R775-E779 HydrophobicContact CB-CB 4.45Å; R775-E779 WeakPolarHBondContact CB-OE2 3.32Å; R775-E779 WeakPolarHBondContact CD-OE2 3.48Å; R775-E779 WeakPolarHBondContact CG-OE2 3.38Å; R775-E779 IonicContact CZ-OE2 3.28Å; R775-E779 IonicContact NE-OE2 2.79Å; R775-E779 VanDerWaalsContact NH1-CD 3.3Å; R775-E779 IonicContact NH1-OE1 2.87Å; R775-E779 PolarHBondContact NH1-OE1 2.81Å; R775-E779 VanDerWaalsContact NH1-OE1 3.08Å; R775-E779 IonicContact NH1-OE2 3.08Å; R775-E779 PolarHBondContact NH1-OE2 3.03Å; R775-E779 WeakPolarHBondContact O-CA 3.48Å; R775-E779 VanDerWaalsContact O-CB 3.3Å; R775-E779 WeakPolarHBondContact O-CB 3.29Å; R775-E779 PolarHBondContact O-N 2.82Å
780	Q	95.4	Very high	93.9	Very high	124 Å²	124	54.9 Å²	54.9	58%	0.579	28%	0.279	S	S	*	.	S	Bend	trans	-100.1	-10.1	179.8	-54.9	170.5	9.3	0	0	113.3	R775 A776 L782	R775-Q780 PolarHBondContact O-N 3.13Å; A776-Q780 CarbonylContact O-C 3.54Å; Q780-L782 PolarHBondContact O-N 2.95Å; Q780-L782 VanDerWaalsContact O-N 3.16Å
781	K	95.4	Very high	93.4	Very high	80 Å²	80	62.9 Å²	62.9	35%	0.348	32%	0.322	S	S	.	.			trans	54.7	26.1	-178.4	-52.2	-176	-175	-174.3	0	114.3	W751 A776 K777 F783 L784 A815 H816	W751-K781 HydrophobicContact CZ3-CG 4.42Å; A776-K781 PolarHBondContact O-N 2.83Å; K777-K781 WeakPolarHBondContact O-CA 3.3Å; K781-F783 VanDerWaalsContact C-N 3.3Å; K781-F783 PolarHBondContact O-N 3.09Å; K781-L784 HydrophobicContact CB-CB 4.14Å; K781-L784 HydrophobicContact CB-CD2 3.99Å; K781-L784 HydrophobicContact CD-CD2 3.93Å; K781-L784 HydrophobicContact CG-CD2 4.3Å; K781-L784 WeakPolarHBondContact O-CB 3.48Å; K781-L784 PolarHBondContact O-N 2.85Å; K781-L784 VanDerWaalsContact O-N 3.14Å; K781-A815 WeakPolarHBondContact CD-O 3.44Å; K781-A815 VanDerWaalsContact CE-O 3.24Å; K781-A815 WeakPolarHBondContact CE-O 3.48Å; K781-A815 PolarHBondContact NZ-O 2.9Å; K781-H816 PolarHBondContact NZ-O 2.86Å
782	L	94.7	Very high	93	Very high	72 Å²	72	62.1 Å²	62.1	38%	0.377	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-28.9	-164.8	-172	59.5	0	0	0	114.4	Y758 A776 Q780	Y758-L782 HydrophobicContact CE1-CD2 3.89Å; Y758-L782 HydrophobicContact CE2-CD2 4.41Å; Y758-L782 HydrophobicContact CE2-CG 4.44Å; A776-L782 HydrophobicContact CB-CB 4.32Å; A776-L782 HydrophobicContact CB-CD2 4.07Å; A776-L782 VanDerWaalsContact O-CB 3.27Å; A776-L782 WeakPolarHBondContact O-CB 3.34Å; A776-L782 PolarHBondContact O-N 2.75Å; Q780-L782 PolarHBondContact O-N 2.95Å; Q780-L782 VanDerWaalsContact O-N 3.16Å
783	F	95.3	Very high	92.6	Very high	2 Å²	2	57.7 Å²	57.7	1%	0.009	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.8	8.2	-179.1	-33.2	-52.7	0	0	0	113.2	G753 C754 L755 Y758 W773 A776 K777 K781	G753-F783 PolarHBondContact N-O 3.3Å; G753-F783 VanDerWaalsContact N-O 3.17Å; C754-F783 PolarHBondContact N-O 2.96Å; C754-F783 WeakPolarHBondContact O-CA 3.25Å; L755-F783 HydrophobicContact CD2-CB 4.12Å; L755-F783 HydrophobicContact CD2-CD1 4.37Å; L755-F783 HydrophobicContact CD2-CD2 4.39Å; L755-F783 HydrophobicContact CD2-CG 4.04Å; Y758-F783 AromaticContact CD1-CE1 3.65Å; Y758-F783 HydrophobicContact CD1-CE1 3.65Å; Y758-F783 HydrophobicContact CD1-CZ 4.26Å; Y758-F783 AromaticContact CD2-CD1 3.96Å; Y758-F783 HydrophobicContact CD2-CD1 3.96Å; Y758-F783 AromaticContact CD2-CE1 3.72Å; Y758-F783 HydrophobicContact CD2-CE1 3.72Å; Y758-F783 HydrophobicContact CE1-CE1 4.15Å; Y758-F783 HydrophobicContact CE2-CE1 4.21Å; Y758-F783 HydrophobicContact CG-CD1 4.04Å; Y758-F783 AromaticContact CG-CE1 3.42Å; Y758-F783 HydrophobicContact CG-CE1 3.42Å; Y758-F783 VanDerWaalsContact CG-CE1 3.42Å; Y758-F783 HydrophobicContact CG-CZ 4.28Å; W773-F783 AromaticContact CD2-CE2 3.83Å; W773-F783 HydrophobicContact CD2-CE2 3.83Å; W773-F783 HydrophobicContact CD2-CZ 4.36Å; W773-F783 AromaticContact CE2-CE2 3.86Å; W773-F783 AromaticContact CE3-CE2 3.75Å; W773-F783 HydrophobicContact CE3-CE2 3.75Å; W773-F783 AromaticContact CE3-CZ 3.82Å; W773-F783 HydrophobicContact CE3-CZ 3.82Å; W773-F783 HydrophobicContact CH2-CD2 4.2Å; W773-F783 AromaticContact CH2-CE2 3.82Å; W773-F783 HydrophobicContact CH2-CE2 3.82Å; W773-F783 HydrophobicContact CH2-CZ 4.09Å; W773-F783 HydrophobicContact CZ2-CD2 4.08Å; W773-F783 AromaticContact CZ2-CE2 3.86Å; W773-F783 HydrophobicContact CZ2-CE2 3.86Å; W773-F783 HydrophobicContact CZ3-CE1 4.43Å; W773-F783 AromaticContact CZ3-CE2 3.75Å; W773-F783 HydrophobicContact CZ3-CE2 3.75Å; W773-F783 AromaticContact CZ3-CZ 3.68Å; W773-F783 HydrophobicContact CZ3-CZ 3.68Å; A776-F783 HydrophobicContact CB-CE1 4.44Å; A776-F783 HydrophobicContact CB-CE2 3.9Å; A776-F783 HydrophobicContact CB-CZ 3.58Å; K777-F783 HydrophobicContact CB-CD2 3.92Å; K777-F783 HydrophobicContact CB-CE2 4Å; K777-F783 HydrophobicContact CG-CD2 4.22Å; K781-F783 VanDerWaalsContact C-N 3.3Å; K781-F783 PolarHBondContact O-N 3.09Å
784	L	95.4	Very high	92.4	Very high	13 Å²	13	57.6 Å²	57.6	7%	0.068	31%	0.312	C	S	.	.	P	Polyproline II helix	trans	-66.7	132.7	-178.2	-177.4	61.5	0	0	0	110	V750 W751 K781 G786 L812 A815	V750-L784 HydrophobicContact CG1-CD1 3.56Å; V750-L784 WeakPolarHBondContact O-CA 3.39Å; W751-L784 HydrophobicContact CD2-CD1 4.3Å; W751-L784 HydrophobicContact CE3-CD1 4.13Å; W751-L784 HydrophobicContact CZ3-CD1 4.44Å; K781-L784 HydrophobicContact CB-CB 4.14Å; K781-L784 HydrophobicContact CB-CD2 3.99Å; K781-L784 HydrophobicContact CD-CD2 3.93Å; K781-L784 HydrophobicContact CG-CD2 4.3Å; K781-L784 WeakPolarHBondContact O-CB 3.48Å; K781-L784 PolarHBondContact O-N 2.85Å; K781-L784 VanDerWaalsContact O-N 3.14Å; L784-G786 PolarHBondContact O-N 2.78Å; L784-L812 HydrophobicContact CD1-CD1 4.36Å; L784-A815 HydrophobicContact CD1-CB 3.72Å; L784-A815 HydrophobicContact CD2-CB 3.99Å
785	V	94	Very high	92.1	Very high	29 Å²	29	57.6 Å²	57.6	18%	0.176	31%	0.313	C	S	.	.	P	Polyproline II helix	trans	-52.7	131.9	173.9	166.4	0	0	0	0	110.3	S749 V750 L812 H816	S749-V785 WeakPolarHBondContact O-CG2 3.32Å; V750-V785 WeakPolarHBondContact O-CG2 3.42Å; V750-V785 PolarHBondContact O-N 3.03Å; V785-L812 HydrophobicContact CB-CD1 3.95Å; V785-L812 HydrophobicContact CG1-CD1 4.1Å; V785-L812 HydrophobicContact CG1-CD2 4.05Å; V785-L812 WeakPolarHBondContact O-CD1 3.42Å; V785-H816 PolarHBondContact O-NE2 2.91Å
786	G	91.1	Very high	91.8	Very high	54 Å²	54	56.9 Å²	56.9	56%	0.557	31%	0.312	S	S	*	.	P	Polyproline II helix	trans	-63.8	145.4	172.7	0	0	0	0	0	111.9	L784	L784-G786 PolarHBondContact O-N 2.78Å
787	L	90.3	Very high	91.6	Very high	61 Å²	61	57.6 Å²	57.6	32%	0.319	31%	0.314	S	S	.	.	P	Polyproline II helix	trans	-60.3	148.2	175.2	-68	177.7	0	0	0	111.3	L794 L812 L813 H816	L787-L794 HydrophobicContact CD1-CD1 4.02Å; L787-L812 HydrophobicContact CD2-CG 4.11Å; L787-L813 HydrophobicContact CD2-CD2 3.77Å; L787-L813 HydrophobicContact CD2-CG 4.5Å; L787-H816 HydrophobicContact CD1-CB 4.14Å; L787-H816 HydrophobicContact CD2-CB 4.15Å; L787-H816 WeakPolarHBondContact CD2-CD2 3.49Å; L787-H816 HydrophobicContact CG-CB 4.28Å
788	P	84	Confident	91.5	Very high	67 Å²	67	57.6 Å²	57.6	44%	0.435	31%	0.314	S	S	.	.	P	Polyproline II helix	trans	-54.9	140	168.9	-22.3	33.5	0	0	0	110.9	S790 L809	P788-S790 PolarHBondContact O-N 3.01Å; P788-L809 HydrophobicContact CG-CD1 4.28Å
789	Q	79.8	Confident	91.3	Very high	203 Å²	203	58 Å²	58	95%	0.949	32%	0.316	S	S	*	.	P	Polyproline II helix	trans	-63.5	120.8	172.6	-73.6	-175.1	-18.6	0	0	109.3
790	S	84.3	Confident	91.2	Very high	54 Å²	54	58.1 Å²	58.1	38%	0.378	31%	0.313	S	S	.	.			trans	-158.5	127.1	-169.8	162.3	0	0	0	0	109.1	P788 V792 Q797	P788-S790 PolarHBondContact O-N 3.01Å; S790-V792 PolarHBondContact O-N 3.46Å; S790-V792 WeakPolarHBondContact OG-CB 3.32Å; S790-V792 PolarHBondContact OG-N 2.66Å; S790-V792 VanDerWaalsContact OG-N 3.16Å; S790-V792 PolarHBondContact OG-O 3.43Å; S790-Q797 PolarHBondContact OG-NE2 3.05Å
791	D	86.2	Confident	91.2	Very high	176 Å²	176	52.2 Å²	52.2	94%	0.941	29%	0.285	S	S	*	.	S	Bend	trans	-73.3	-3.7	174.4	-50.8	-57.6	0	0	0	112.7
792	V	88.9	Confident	91.3	Very high	32 Å²	32	48.4 Å²	48.4	19%	0.194	27%	0.269	C	S	.	.	S	Bend	trans	-96.2	131.8	-175	171.9	0	0	0	0	110.6	S790 Q796 Q797	S790-V792 PolarHBondContact O-N 3.46Å; S790-V792 WeakPolarHBondContact OG-CB 3.32Å; S790-V792 PolarHBondContact OG-N 2.66Å; S790-V792 VanDerWaalsContact OG-N 3.16Å; S790-V792 PolarHBondContact OG-O 3.43Å; V792-Q796 HydrophobicContact CG1-CB 3.53Å; V792-Q796 HydrophobicContact CG1-CG 3.65Å; V792-Q797 HydrophobicContact CB-CG 4.46Å; V792-Q797 HydrophobicContact CG1-CG 4.18Å; V792-Q797 PolarHBondContact O-NE2 2.79Å
793	P	90.4	Very high	91.2	Very high	61 Å²	61	49 Å²	49	40%	0.396	28%	0.275	S	S	.	.			trans	-58.8	157.6	-179.2	-27.3	36	0	0	0	115.4	G795 Q796 Q797 Y826	P793-G795 PolarHBondContact O-N 2.88Å; P793-Q796 PolarHBondContact O-N 3.12Å; P793-Q796 VanDerWaalsContact O-N 3.08Å; P793-Q797 PolarHBondContact O-N 2.86Å; P793-Y826 HydrophobicContact CB-CE1 4.4Å; P793-Y826 HydrophobicContact CB-CE2 4.47Å; P793-Y826 WeakPolarHBondContact CB-OH 3.24Å; P793-Y826 HydrophobicContact CG-CE1 4.14Å; P793-Y826 WeakPolarHBondContact CG-OH 3.35Å
794	L	92.5	Very high	91.2	Very high	13 Å²	13	55.4 Å²	55.4	7%	0.068	31%	0.305	C	S	.	.	H	α-helix	trans	-58.1	-43.8	-175.4	-170.6	151.1	0	0	0	112.7	L787 Q796 Q797 L798 L813 H816 E821 V822	L787-L794 HydrophobicContact CD1-CD1 4.02Å; L794-Q796 VanDerWaalsContact C-N 3.31Å; L794-Q796 PolarHBondContact O-N 3.43Å; L794-Q797 PolarHBondContact O-N 3.45Å; L794-L798 WeakPolarHBondContact O-CB 3.35Å; L794-L798 PolarHBondContact O-N 3.02Å; L794-L813 HydrophobicContact CG-CD2 4Å; L794-H816 HydrophobicContact CD1-CB 4.01Å; L794-E821 HydrophobicContact CB-CB 4.43Å; L794-E821 HydrophobicContact CD2-CB 4.02Å; L794-V822 HydrophobicContact CD2-CG1 4.37Å
795	G	91.2	Very high	91.2	Very high	2 Å²	2	58.8 Å²	58.8	2%	0.021	32%	0.323	C	S	.	.	H	α-helix	trans	-60.2	-38.6	176.5	0	0	0	0	0	113	P793 L798 L799 E821	P793-G795 PolarHBondContact O-N 2.88Å; G795-L798 PolarHBondContact O-N 2.9Å; G795-L799 WeakPolarHBondContact O-CD1 3.33Å; G795-L799 VanDerWaalsContact O-CG 3.3Å; G795-L799 WeakPolarHBondContact O-CG 3.42Å; G795-L799 PolarHBondContact O-N 2.9Å; G795-E821 WeakPolarHBondContact CA-O 3.1Å
796	Q	91.2	Very high	91.3	Very high	47 Å²	47	60.7 Å²	60.7	22%	0.22	33%	0.332	C	S	.	.	H	α-helix	trans	-74	-35.5	176.3	-167.7	173.9	12.3	0	0	112.6	V792 P793 L794 L798 L799 R800 Y826	V792-Q796 HydrophobicContact CG1-CB 3.53Å; V792-Q796 HydrophobicContact CG1-CG 3.65Å; P793-Q796 PolarHBondContact O-N 3.12Å; P793-Q796 VanDerWaalsContact O-N 3.08Å; L794-Q796 VanDerWaalsContact C-N 3.31Å; L794-Q796 PolarHBondContact O-N 3.43Å; Q796-L798 VanDerWaalsContact C-N 3.31Å; Q796-L799 PolarHBondContact O-N 2.97Å; Q796-R800 WeakPolarHBondContact O-CG 3.42Å; Q796-R800 PolarHBondContact O-N 3.06Å; Q796-R800 VanDerWaalsContact O-N 3.14Å; Q796-Y826 HydrophobicContact CB-CD1 3.86Å; Q796-Y826 HydrophobicContact CB-CD2 3.62Å; Q796-Y826 HydrophobicContact CB-CE1 4.26Å; Q796-Y826 HydrophobicContact CB-CE2 4.01Å; Q796-Y826 HydrophobicContact CB-CG 3.52Å; Q796-Y826 HydrophobicContact CG-CD1 4.2Å; Q796-Y826 HydrophobicContact CG-CD2 4.41Å; Q796-Y826 HydrophobicContact CG-CG 3.88Å
797	Q	93.7	Very high	91.6	Very high	25 Å²	25	59.4 Å²	59.4	12%	0.117	31%	0.312	C	S	.	.	H	α-helix	trans	-61.4	-41.6	170.2	-68	-176.8	52.2	0	0	111	S790 V792 P793 L794 R800 A801 L813	S790-Q797 PolarHBondContact OG-NE2 3.05Å; V792-Q797 HydrophobicContact CB-CG 4.46Å; V792-Q797 HydrophobicContact CG1-CG 4.18Å; V792-Q797 PolarHBondContact O-NE2 2.79Å; P793-Q797 PolarHBondContact O-N 2.86Å; L794-Q797 PolarHBondContact O-N 3.45Å; Q797-R800 PolarHBondContact O-N 2.91Å; Q797-A801 WeakPolarHBondContact O-CB 3.1Å; Q797-A801 PolarHBondContact O-N 3.41Å; Q797-L813 HydrophobicContact CB-CD1 3.89Å; Q797-L813 HydrophobicContact CB-CD2 3.82Å
798	L	95.2	Very high	91.9	Very high	1 Å²	1	61 Å²	61	1%	0.005	31%	0.314	C	S	.	.	H	α-helix	trans	-64.7	-43.8	178.3	-179	64.6	0	0	0	111.6	L794 G795 Q796 R800 A801 V802 V810 L813 L814 V822 A834 L850	L794-L798 WeakPolarHBondContact O-CB 3.35Å; L794-L798 PolarHBondContact O-N 3.02Å; G795-L798 PolarHBondContact O-N 2.9Å; Q796-L798 VanDerWaalsContact C-N 3.31Å; L798-R800 VanDerWaalsContact C-N 3.31Å; L798-R800 PolarHBondContact O-N 2.94Å; L798-A801 PolarHBondContact O-N 3.39Å; L798-V802 HydrophobicContact CD1-CG2 4.43Å; L798-V802 WeakPolarHBondContact O-CG2 3.49Å; L798-V802 PolarHBondContact O-N 3.06Å; L798-V810 HydrophobicContact CD1-CB 4.48Å; L798-V810 HydrophobicContact CD1-CG1 4.14Å; L798-V810 HydrophobicContact CD1-CG2 4.31Å; L798-L813 HydrophobicContact CB-CD1 4.3Å; L798-L813 HydrophobicContact CD1-CB 4.23Å; L798-L814 HydrophobicContact CD1-CD2 4.15Å; L798-L814 HydrophobicContact CD1-CG 4.23Å; L798-L814 HydrophobicContact CD2-CD2 3.91Å; L798-V822 HydrophobicContact CD2-CB 3.94Å; L798-V822 HydrophobicContact CD2-CG1 4.05Å; L798-A834 HydrophobicContact CD2-CB 4.13Å; L798-A834 HydrophobicContact CG-CB 4.09Å; L798-L850 HydrophobicContact CD1-CD2 4.36Å; L798-L850 HydrophobicContact CD2-CD2 4.05Å; L798-L850 HydrophobicContact CG-CD2 4.48Å
799	L	93.6	Very high	92.5	Very high	12 Å²	12	59.4 Å²	59.4	6%	0.063	30%	0.302	C	S	.	.	H	α-helix	trans	-58.3	-40.7	174.6	-73.5	160	0	0	0	112.1	G795 Q796 V803 Y826 A834 L837	G795-L799 WeakPolarHBondContact O-CD1 3.33Å; G795-L799 VanDerWaalsContact O-CG 3.3Å; G795-L799 WeakPolarHBondContact O-CG 3.42Å; G795-L799 PolarHBondContact O-N 2.9Å; Q796-L799 PolarHBondContact O-N 2.97Å; L799-V803 WeakPolarHBondContact O-CG2 3.24Å; L799-V803 PolarHBondContact O-N 2.89Å; L799-Y826 HydrophobicContact CD1-CD2 3.87Å; L799-Y826 HydrophobicContact CD1-CG 4.3Å; L799-Y826 VanDerWaalsContact CD1-N 3.34Å; L799-A834 HydrophobicContact CD2-CB 4.29Å; L799-L837 HydrophobicContact CB-CD1 4.32Å; L799-L837 HydrophobicContact CD2-CD1 3.53Å; L799-L837 HydrophobicContact CD2-CG 4.32Å
800	R	93	Very high	93.3	Very high	92 Å²	92	49.8 Å²	49.8	35%	0.347	26%	0.257	S	S	.	.	H	α-helix	trans	-68.1	-49.5	175.3	-67.5	177.4	-166	-178.9	6.4	111.9	Q796 Q797 L798 V802 V803 E804	Q796-R800 WeakPolarHBondContact O-CG 3.42Å; Q796-R800 PolarHBondContact O-N 3.06Å; Q796-R800 VanDerWaalsContact O-N 3.14Å; Q797-R800 PolarHBondContact O-N 2.91Å; L798-R800 VanDerWaalsContact C-N 3.31Å; L798-R800 PolarHBondContact O-N 2.94Å; R800-V802 PolarHBondContact O-N 3.41Å; R800-V803 WeakPolarHBondContact O-CA 3.45Å; R800-V803 PolarHBondContact O-N 3.49Å; R800-E804 WeakPolarHBondContact O-CB 3.37Å; R800-E804 WeakPolarHBondContact O-CG 3.27Å; R800-E804 PolarHBondContact O-N 2.81Å
801	A	95.5	Very high	93.9	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-58.3	-33.8	-180	0	0	0	0	0	112.9	Q797 L798 D805 D806 L809 V810 L813	Q797-A801 WeakPolarHBondContact O-CB 3.1Å; Q797-A801 PolarHBondContact O-N 3.41Å; L798-A801 PolarHBondContact O-N 3.39Å; A801-D805 PolarHBondContact O-N 3.06Å; A801-D805 VanDerWaalsContact O-N 3.16Å; A801-D806 PolarHBondContact O-N 3.5Å; A801-L809 HydrophobicContact CB-CB 4.11Å; A801-L809 HydrophobicContact CB-CD2 3.81Å; A801-L809 HydrophobicContact CB-CG 3.78Å; A801-V810 HydrophobicContact CB-CG2 3.76Å; A801-L813 HydrophobicContact CB-CD1 4.02Å
802	V	96.3	Very high	94.4	Very high	1 Å²	1	39.3 Å²	39.3	1%	0.006	20%	0.197	C	C	.	.	H	α-helix	trans	-69.8	-38.6	172.8	171.9	0	0	0	0	112.4	L798 R800 D805 V810 A834 L837 M841 I846	L798-V802 HydrophobicContact CD1-CG2 4.43Å; L798-V802 WeakPolarHBondContact O-CG2 3.49Å; L798-V802 PolarHBondContact O-N 3.06Å; R800-V802 PolarHBondContact O-N 3.41Å; V802-D805 PolarHBondContact O-N 3.4Å; V802-V810 HydrophobicContact CG2-CG2 3.79Å; V802-A834 HydrophobicContact CG2-CB 4.3Å; V802-L837 HydrophobicContact CG1-CB 3.88Å; V802-M841 WeakPolarHBondContact O-CE 3.32Å; V802-M841 VanDerWaalsContact O-SD 3.32Å; V802-I846 HydrophobicContact CB-CG2 4.49Å; V802-I846 HydrophobicContact CG1-CG2 4.1Å; V802-I846 HydrophobicContact CG2-CG2 3.69Å
803	V	94	Very high	94.7	Very high	84 Å²	84	37.8 Å²	37.8	51%	0.509	19%	0.188	S	C	.	.	H	α-helix	trans	-71.7	-32.5	177.2	171.4	0	0	0	0	112.4	L799 R800 D805 L837	L799-V803 WeakPolarHBondContact O-CG2 3.24Å; L799-V803 PolarHBondContact O-N 2.89Å; R800-V803 WeakPolarHBondContact O-CA 3.45Å; R800-V803 PolarHBondContact O-N 3.49Å; V803-D805 VanDerWaalsContact C-N 3.29Å; V803-L837 HydrophobicContact CG2-CD1 3.71Å
804	E	95.3	Very high	95	Very high	136 Å²	136	35 Å²	35	64%	0.636	17%	0.169	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.5	-4.4	177.3	-67.8	168.2	-175.4	0	0	112.9	R800 D806	R800-E804 WeakPolarHBondContact O-CB 3.37Å; R800-E804 WeakPolarHBondContact O-CG 3.27Å; R800-E804 PolarHBondContact O-N 2.81Å; E804-D806 PolarHBondContact O-N 2.97Å
805	D	95	Very high	95.1	Very high	85 Å²	85	34.4 Å²	34.4	46%	0.455	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.6	21.1	-176.7	-147.9	47.9	0	0	0	114.7	A801 V802 V803 L807 M841 N843	A801-D805 PolarHBondContact O-N 3.06Å; A801-D805 VanDerWaalsContact O-N 3.16Å; V802-D805 PolarHBondContact O-N 3.4Å; V803-D805 VanDerWaalsContact C-N 3.29Å; D805-L807 VanDerWaalsContact C-N 3.32Å; D805-L807 PolarHBondContact O-N 3.24Å; D805-M841 HydrophobicContact CB-CE 4.36Å; D805-N843 PolarHBondContact OD1-ND2 2.74Å
806	D	96.6	Very high	95.2	Very high	68 Å²	68	37 Å²	37	36%	0.364	18%	0.178	S	C	.	.			trans	-76.2	83.9	176.2	-172.6	-12.9	0	0	0	110.9	A801 E804 R808 L809 V810	A801-D806 PolarHBondContact O-N 3.5Å; E804-D806 PolarHBondContact O-N 2.97Å; D806-R808 PolarHBondContact O-N 2.77Å; D806-R808 WeakPolarHBondContact OD1-CA 3.38Å; D806-R808 WeakPolarHBondContact OD1-CB 3.19Å; D806-R808 PolarHBondContact OD1-N 3.4Å; D806-L809 HydrophobicContact CB-CB 3.96Å; D806-L809 VanDerWaalsContact CG-CB 3.41Å; D806-L809 PolarHBondContact O-N 3.35Å; D806-L809 PolarHBondContact OD1-N 3.28Å; D806-L809 VanDerWaalsContact OD2-CB 3.31Å; D806-L809 WeakPolarHBondContact OD2-CB 3.46Å; D806-V810 WeakPolarHBondContact O-CG2 3.26Å; D806-V810 PolarHBondContact O-N 2.9Å
807	L	96.8	Very high	95.3	Very high	27 Å²	27	35.5 Å²	35.5	14%	0.141	18%	0.175	C	C	.	.	H	α-helix	trans	-54.3	-31.8	174.8	-179.8	59.8	0	0	0	113.2	A741 I742 M746 D805 V811 V845 I846 L849	A741-L807 HydrophobicContact CB-CD2 3.7Å; I742-L807 HydrophobicContact CG1-CD2 4.31Å; M746-L807 HydrophobicContact CE-CB 4.46Å; M746-L807 HydrophobicContact CE-CD2 3.74Å; M746-L807 HydrophobicContact CE-CG 3.85Å; D805-L807 VanDerWaalsContact C-N 3.32Å; D805-L807 PolarHBondContact O-N 3.24Å; L807-V811 HydrophobicContact CD1-CG2 4.23Å; L807-V811 WeakPolarHBondContact O-CB 3.5Å; L807-V811 VanDerWaalsContact O-CG2 3.27Å; L807-V811 WeakPolarHBondContact O-CG2 3.45Å; L807-V811 PolarHBondContact O-N 3.14Å; L807-V845 HydrophobicContact CD1-CG1 3.76Å; L807-V845 HydrophobicContact CD2-CG1 3.99Å; L807-I846 HydrophobicContact CD1-CG1 4.11Å; L807-L849 HydrophobicContact CD1-CD1 3.61Å
808	R	96.3	Very high	95.1	Very high	95 Å²	95	37.6 Å²	37.6	36%	0.358	19%	0.19	S	C	.	.	H	α-helix	trans	-74.3	-42.6	179.5	-177.1	179.7	171	-81.2	-4.7	110.7	M746 S749 V750 D806 V811 L812	M746-R808 HydrophobicContact CG-CB 4.43Å; M746-R808 HydrophobicContact CG-CG 4.31Å; M746-R808 HydrophobicContact SD-CB 4.3Å; S749-R808 PolarHBondContact O-NH2 2.85Å; S749-R808 PolarHBondContact OG-NE 3.47Å; V750-R808 HydrophobicContact CG2-CG 3.98Å; D806-R808 PolarHBondContact O-N 2.77Å; D806-R808 WeakPolarHBondContact OD1-CA 3.38Å; D806-R808 WeakPolarHBondContact OD1-CB 3.19Å; D806-R808 PolarHBondContact OD1-N 3.4Å; R808-V811 PolarHBondContact O-N 2.88Å; R808-L812 WeakPolarHBondContact O-CB 3.38Å; R808-L812 PolarHBondContact O-N 3.39Å
809	L	96.1	Very high	94.8	Very high	34 Å²	34	43.4 Å²	43.4	18%	0.178	22%	0.215	C	C	.	.	H	α-helix	trans	-66.6	-38	174.4	-177.4	57.1	0	0	0	111.2	P788 A801 D806 L812 L813	P788-L809 HydrophobicContact CG-CD1 4.28Å; A801-L809 HydrophobicContact CB-CB 4.11Å; A801-L809 HydrophobicContact CB-CD2 3.81Å; A801-L809 HydrophobicContact CB-CG 3.78Å; D806-L809 HydrophobicContact CB-CB 3.96Å; D806-L809 VanDerWaalsContact CG-CB 3.41Å; D806-L809 PolarHBondContact O-N 3.35Å; D806-L809 PolarHBondContact OD1-N 3.28Å; D806-L809 VanDerWaalsContact OD2-CB 3.31Å; D806-L809 WeakPolarHBondContact OD2-CB 3.46Å; L809-L812 HydrophobicContact CD1-CD2 4.3Å; L809-L812 PolarHBondContact O-N 3.34Å; L809-L813 HydrophobicContact CD1-CD1 3.92Å; L809-L813 HydrophobicContact CD1-CG 4.02Å; L809-L813 HydrophobicContact CG-CD1 3.74Å; L809-L813 HydrophobicContact CG-CG 4.34Å; L809-L813 WeakPolarHBondContact O-CB 3.3Å; L809-L813 WeakPolarHBondContact O-CD1 3.27Å; L809-L813 VanDerWaalsContact O-CG 3.24Å; L809-L813 WeakPolarHBondContact O-CG 3.15Å; L809-L813 PolarHBondContact O-N 3.37Å
810	V	97.1	Very high	94.5	Very high	0 Å²	0	49 Å²	49	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-58.7	-50.9	170.6	169.7	0	0	0	0	111.3	L798 A801 V802 D806 L812 L813 L814 I846	L798-V810 HydrophobicContact CD1-CB 4.48Å; L798-V810 HydrophobicContact CD1-CG1 4.14Å; L798-V810 HydrophobicContact CD1-CG2 4.31Å; A801-V810 HydrophobicContact CB-CG2 3.76Å; V802-V810 HydrophobicContact CG2-CG2 3.79Å; D806-V810 WeakPolarHBondContact O-CG2 3.26Å; D806-V810 PolarHBondContact O-N 2.9Å; V810-L812 VanDerWaalsContact C-N 3.3Å; V810-L812 PolarHBondContact O-N 3.35Å; V810-L813 PolarHBondContact O-N 2.95Å; V810-L814 HydrophobicContact CG1-CD1 3.85Å; V810-L814 HydrophobicContact CG1-CG 4.31Å; V810-L814 WeakPolarHBondContact O-CB 3.39Å; V810-L814 VanDerWaalsContact O-CG 3.26Å; V810-L814 WeakPolarHBondContact O-CG 3.18Å; V810-L814 PolarHBondContact O-N 2.91Å; V810-I846 HydrophobicContact CG1-CG2 4.44Å; V810-I846 HydrophobicContact CG2-CD1 4.28Å
811	V	97	Very high	94.4	Very high	6 Å²	6	47.6 Å²	47.6	4%	0.036	24%	0.238	C	C	.	.	H	α-helix	trans	-61.5	-38.1	178.3	168.7	0	0	0	0	111.7	I742 V750 L807 R808 A815 L849	I742-V811 HydrophobicContact CD1-CG2 4.01Å; V750-V811 HydrophobicContact CG1-CG1 4.44Å; V750-V811 HydrophobicContact CG2-CG1 4.47Å; L807-V811 HydrophobicContact CD1-CG2 4.23Å; L807-V811 WeakPolarHBondContact O-CB 3.5Å; L807-V811 VanDerWaalsContact O-CG2 3.27Å; L807-V811 WeakPolarHBondContact O-CG2 3.45Å; L807-V811 PolarHBondContact O-N 3.14Å; R808-V811 PolarHBondContact O-N 2.88Å; V811-A815 VanDerWaalsContact O-CB 3.27Å; V811-A815 WeakPolarHBondContact O-CB 3.36Å; V811-A815 PolarHBondContact O-N 3.3Å; V811-L849 HydrophobicContact CG2-CD1 4.13Å
812	L	96.6	Very high	94.2	Very high	4 Å²	4	47.8 Å²	47.8	2%	0.021	24%	0.239	C	C	.	.	H	α-helix	trans	-64.9	-48.2	175	173.9	60.1	0	0	0	112.4	V750 L784 V785 L787 R808 L809 V810 A815 H816	V750-L812 HydrophobicContact CG1-CB 4.29Å; V750-L812 HydrophobicContact CG1-CD1 4.07Å; V750-L812 HydrophobicContact CG2-CB 4.42Å; L784-L812 HydrophobicContact CD1-CD1 4.36Å; V785-L812 HydrophobicContact CB-CD1 3.95Å; V785-L812 HydrophobicContact CG1-CD1 4.1Å; V785-L812 HydrophobicContact CG1-CD2 4.05Å; V785-L812 WeakPolarHBondContact O-CD1 3.42Å; L787-L812 HydrophobicContact CD2-CG 4.11Å; R808-L812 WeakPolarHBondContact O-CB 3.38Å; R808-L812 PolarHBondContact O-N 3.39Å; L809-L812 HydrophobicContact CD1-CD2 4.3Å; L809-L812 PolarHBondContact O-N 3.34Å; V810-L812 VanDerWaalsContact C-N 3.3Å; V810-L812 PolarHBondContact O-N 3.35Å; L812-A815 WeakPolarHBondContact O-CB 3.4Å; L812-A815 PolarHBondContact O-N 3.21Å; L812-H816 PolarHBondContact O-CD2 3.23Å; L812-H816 PolarHBondContact O-N 3Å; L812-H816 VanDerWaalsContact O-N 3.13Å
813	L	95.9	Very high	94	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-65.4	-39.4	179.9	-71.6	163.6	0	0	0	111.5	L787 L794 Q797 L798 A801 L809 V810 A815 H816 G817	L787-L813 HydrophobicContact CD2-CD2 3.77Å; L787-L813 HydrophobicContact CD2-CG 4.5Å; L794-L813 HydrophobicContact CG-CD2 4Å; Q797-L813 HydrophobicContact CB-CD1 3.89Å; Q797-L813 HydrophobicContact CB-CD2 3.82Å; L798-L813 HydrophobicContact CB-CD1 4.3Å; L798-L813 HydrophobicContact CD1-CB 4.23Å; A801-L813 HydrophobicContact CB-CD1 4.02Å; L809-L813 HydrophobicContact CD1-CD1 3.92Å; L809-L813 HydrophobicContact CD1-CG 4.02Å; L809-L813 HydrophobicContact CG-CD1 3.74Å; L809-L813 HydrophobicContact CG-CG 4.34Å; L809-L813 WeakPolarHBondContact O-CB 3.3Å; L809-L813 WeakPolarHBondContact O-CD1 3.27Å; L809-L813 VanDerWaalsContact O-CG 3.24Å; L809-L813 WeakPolarHBondContact O-CG 3.15Å; L809-L813 PolarHBondContact O-N 3.37Å; V810-L813 PolarHBondContact O-N 2.95Å; L813-A815 VanDerWaalsContact C-N 3.35Å; L813-H816 PolarHBondContact O-N 3.27Å; L813-G817 PolarHBondContact O-N 3.29Å
814	L	95.9	Very high	93.6	Very high	2 Å²	2	49.1 Å²	49.1	1%	0.01	24%	0.241	C	C	.	.	H	α-helix	trans	-68.4	-31.1	173.2	-67.3	-178.8	0	0	0	112.8	L798 V810 H816 V822 L849 L850 Y853	L798-L814 HydrophobicContact CD1-CD2 4.15Å; L798-L814 HydrophobicContact CD1-CG 4.23Å; L798-L814 HydrophobicContact CD2-CD2 3.91Å; V810-L814 HydrophobicContact CG1-CD1 3.85Å; V810-L814 HydrophobicContact CG1-CG 4.31Å; V810-L814 WeakPolarHBondContact O-CB 3.39Å; V810-L814 VanDerWaalsContact O-CG 3.26Å; V810-L814 WeakPolarHBondContact O-CG 3.18Å; V810-L814 PolarHBondContact O-N 2.91Å; L814-H816 VanDerWaalsContact C-N 3.32Å; L814-V822 HydrophobicContact CD2-CB 4.2Å; L814-V822 HydrophobicContact CD2-CG1 3.65Å; L814-L849 HydrophobicContact CD1-CB 4.14Å; L814-L850 HydrophobicContact CD1-CD2 4.28Å; L814-L850 HydrophobicContact CD2-CD2 4.09Å; L814-Y853 HydrophobicContact CB-CD1 3.8Å; L814-Y853 HydrophobicContact CB-CD2 4.11Å; L814-Y853 HydrophobicContact CB-CE1 4Å; L814-Y853 HydrophobicContact CB-CE2 4.31Å; L814-Y853 HydrophobicContact CB-CG 3.85Å; L814-Y853 HydrophobicContact CD1-CD2 3.95Å; L814-Y853 HydrophobicContact CD1-CG 4.18Å; L814-Y853 HydrophobicContact CD2-CG 4.33Å; L814-Y853 HydrophobicContact CG-CG 4.34Å; L814-Y853 WeakPolarHBondContact O-CD1 3.28Å; L814-Y853 WeakPolarHBondContact O-CE1 3.15Å
815	A	94.9	Very high	93.2	Very high	1 Å²	1	45.9 Å²	45.9	1%	0.008	23%	0.231	C	C	.	.	H	α-helix	trans	-69.3	-28.6	173.5	0	0	0	0	0	112.8	V750 W751 K781 L784 V811 L812 L813	V750-A815 HydrophobicContact CG1-CB 4.42Å; W751-A815 HydrophobicContact CH2-CB 3.8Å; W751-A815 HydrophobicContact CZ2-CB 3.58Å; K781-A815 WeakPolarHBondContact CD-O 3.44Å; K781-A815 VanDerWaalsContact CE-O 3.24Å; K781-A815 WeakPolarHBondContact CE-O 3.48Å; K781-A815 PolarHBondContact NZ-O 2.9Å; L784-A815 HydrophobicContact CD1-CB 3.72Å; L784-A815 HydrophobicContact CD2-CB 3.99Å; V811-A815 VanDerWaalsContact O-CB 3.27Å; V811-A815 WeakPolarHBondContact O-CB 3.36Å; V811-A815 PolarHBondContact O-N 3.3Å; L812-A815 WeakPolarHBondContact O-CB 3.4Å; L812-A815 PolarHBondContact O-N 3.21Å; L813-A815 VanDerWaalsContact C-N 3.35Å
816	H	93.9	Very high	92.1	Very high	57 Å²	57	45.5 Å²	45.5	26%	0.264	22%	0.223	S	C	.	.	H	α-helix	trans	-84.8	-52.3	173.8	-81	-75.3	0	0	0	113.2	K781 V785 L787 L794 L812 L813 L814	K781-H816 PolarHBondContact NZ-O 2.86Å; V785-H816 PolarHBondContact O-NE2 2.91Å; L787-H816 HydrophobicContact CD1-CB 4.14Å; L787-H816 HydrophobicContact CD2-CB 4.15Å; L787-H816 WeakPolarHBondContact CD2-CD2 3.49Å; L787-H816 HydrophobicContact CG-CB 4.28Å; L794-H816 HydrophobicContact CD1-CB 4.01Å; L812-H816 PolarHBondContact O-CD2 3.23Å; L812-H816 PolarHBondContact O-N 3Å; L812-H816 VanDerWaalsContact O-N 3.13Å; L813-H816 PolarHBondContact O-N 3.27Å; L814-H816 VanDerWaalsContact C-N 3.32Å
817	G	91.8	Very high	90.7	Very high	15 Å²	15	45 Å²	45	16%	0.155	23%	0.234	C	C	.	.			trans	-61.1	145.3	-162.5	0	0	0	0	0	116.1	L813	L813-G817 PolarHBondContact O-N 3.29Å
818	T	90.3	Very high	89	Confident	69 Å²	69	50.3 Å²	50.3	42%	0.423	26%	0.263	S	S	.	.			trans	-70.9	164.4	164.2	61	0	0	0	0	111	E820 E821 V822	T818-E820 PolarHBondContact O-N 2.86Å; T818-E821 VanDerWaalsContact CB-OE2 3.31Å; T818-E821 WeakPolarHBondContact CB-OE2 3.33Å; T818-E821 WeakPolarHBondContact CG2-OE2 3.42Å; T818-E821 PolarHBondContact N-OE2 3.14Å; T818-E821 PolarHBondContact O-N 2.79Å; T818-E821 VanDerWaalsContact OG1-CG 3.32Å; T818-E821 WeakPolarHBondContact OG1-CG 3.45Å; T818-E821 PolarHBondContact OG1-N 3.23Å; T818-E821 PolarHBondContact OG1-OE2 3.4Å; T818-V822 WeakPolarHBondContact O-CG1 3.43Å; T818-V822 PolarHBondContact O-N 2.83Å
819	K	88.1	Confident	87.9	Confident	123 Å²	123	48.8 Å²	48.8	54%	0.535	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-33	176.7	-169.7	-163	169.5	-159.5	0	111	V822 N823 G854	K819-V822 WeakPolarHBondContact O-CG2 3.27Å; K819-N823 PolarHBondContact O-ND2 3.45Å; K819-G854 VanDerWaalsContact CE-O 3.24Å; K819-G854 WeakPolarHBondContact CE-O 3.38Å
820	E	88.3	Confident	87.2	Confident	130 Å²	130	48.8 Å²	48.8	61%	0.607	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-52.7	-178.6	-68.7	57.8	-132.9	0	0	110.2	T818 V822 N823 E824	T818-E820 PolarHBondContact O-N 2.86Å; E820-V822 PolarHBondContact O-N 3.02Å; E820-N823 PolarHBondContact O-N 3.33Å; E820-N823 VanDerWaalsContact O-N 3.09Å; E820-E824 PolarHBondContact O-N 3.36Å
821	E	91.2	Very high	86.7	Confident	62 Å²	62	49.7 Å²	49.7	29%	0.29	29%	0.287	S	S	.	.	G	3₁₀ helix	trans	-60	-40.5	179.2	-68.5	162.5	114.4	0	0	113.3	L794 G795 T818 N823 E824	L794-E821 HydrophobicContact CB-CB 4.43Å; L794-E821 HydrophobicContact CD2-CB 4.02Å; G795-E821 WeakPolarHBondContact CA-O 3.1Å; T818-E821 VanDerWaalsContact CB-OE2 3.31Å; T818-E821 WeakPolarHBondContact CB-OE2 3.33Å; T818-E821 WeakPolarHBondContact CG2-OE2 3.42Å; T818-E821 PolarHBondContact N-OE2 3.14Å; T818-E821 PolarHBondContact O-N 2.79Å; T818-E821 VanDerWaalsContact OG1-CG 3.32Å; T818-E821 WeakPolarHBondContact OG1-CG 3.45Å; T818-E821 PolarHBondContact OG1-N 3.23Å; T818-E821 PolarHBondContact OG1-OE2 3.4Å; E821-N823 PolarHBondContact O-N 3.05Å; E821-E824 PolarHBondContact O-N 3.25Å
822	V	91.8	Very high	86.5	Confident	4 Å²	4	53.4 Å²	53.4	2%	0.024	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-71.7	-11.7	179.3	-56	0	0	0	0	113.4	L794 L798 L814 T818 K819 E820 V855	L794-V822 HydrophobicContact CD2-CG1 4.37Å; L798-V822 HydrophobicContact CD2-CB 3.94Å; L798-V822 HydrophobicContact CD2-CG1 4.05Å; L814-V822 HydrophobicContact CD2-CB 4.2Å; L814-V822 HydrophobicContact CD2-CG1 3.65Å; T818-V822 WeakPolarHBondContact O-CG1 3.43Å; T818-V822 PolarHBondContact O-N 2.83Å; K819-V822 WeakPolarHBondContact O-CG2 3.27Å; E820-V822 PolarHBondContact O-N 3.02Å; V822-V855 HydrophobicContact CB-CG2 4.08Å; V822-V855 HydrophobicContact CG2-CG2 3.83Å; V822-V855 WeakPolarHBondContact O-CG2 3.48Å
823	N	90.6	Very high	86.4	Confident	38 Å²	38	53.4 Å²	53.4	20%	0.203	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-97.7	-3.8	175.3	-84.8	-74.4	0	0	0	113.7	K819 E820 E821 G854 V855 D856	K819-N823 PolarHBondContact O-ND2 3.45Å; E820-N823 PolarHBondContact O-N 3.33Å; E820-N823 VanDerWaalsContact O-N 3.09Å; E821-N823 PolarHBondContact O-N 3.05Å; N823-G854 PolarHBondContact ND2-O 3.3Å; N823-G854 VanDerWaalsContact ND2-O 3.16Å; N823-V855 WeakPolarHBondContact OD1-CA 3.49Å; N823-D856 PolarHBondContact OD1-N 3.19Å
824	E	86.9	Confident	86.3	Confident	75 Å²	75	53.5 Å²	53.5	35%	0.35	30%	0.301	S	S	.	.			trans	-67.7	158.2	179.7	-66.1	-176.6	138.6	0	0	113	E820 E821 Y826	E820-E824 PolarHBondContact O-N 3.36Å; E821-E824 PolarHBondContact O-N 3.25Å; E824-Y826 HydrophobicContact CB-CD2 4.15Å; E824-Y826 HydrophobicContact CB-CE2 3.57Å; E824-Y826 HydrophobicContact CG-CE2 4.41Å; E824-Y826 WeakPolarHBondContact OE2-CE2 3.42Å; E824-Y826 PolarHBondContact OE2-OH 2.77Å; E824-Y826 VanDerWaalsContact OE2-OH 3.07Å
825	T	85.2	Confident	86.3	Confident	69 Å²	69	53.4 Å²	53.4	42%	0.423	30%	0.3	S	S	.	.			trans	-127.6	127	-177.8	61.4	0	0	0	0	109.4	G831 T833	T825-G831 WeakPolarHBondContact CG2-O 3.29Å; T825-T833 HydrophobicContact CG2-CG2 3.58Å
826	Y	72.9	Confident	86.3	Confident	76 Å²	76	53.3 Å²	53.3	30%	0.298	30%	0.3	S	S	.	.			trans	-133.1	134.8	-177.4	-71.2	-93.7	0	0	0	111.4	P793 Q796 L799 E824	P793-Y826 HydrophobicContact CB-CE1 4.4Å; P793-Y826 HydrophobicContact CB-CE2 4.47Å; P793-Y826 WeakPolarHBondContact CB-OH 3.24Å; P793-Y826 HydrophobicContact CG-CE1 4.14Å; P793-Y826 WeakPolarHBondContact CG-OH 3.35Å; Q796-Y826 HydrophobicContact CB-CD1 3.86Å; Q796-Y826 HydrophobicContact CB-CD2 3.62Å; Q796-Y826 HydrophobicContact CB-CE1 4.26Å; Q796-Y826 HydrophobicContact CB-CE2 4.01Å; Q796-Y826 HydrophobicContact CB-CG 3.52Å; Q796-Y826 HydrophobicContact CG-CD1 4.2Å; Q796-Y826 HydrophobicContact CG-CD2 4.41Å; Q796-Y826 HydrophobicContact CG-CG 3.88Å; L799-Y826 HydrophobicContact CD1-CD2 3.87Å; L799-Y826 HydrophobicContact CD1-CG 4.3Å; L799-Y826 VanDerWaalsContact CD1-N 3.34Å; E824-Y826 HydrophobicContact CB-CD2 4.15Å; E824-Y826 HydrophobicContact CB-CE2 3.57Å; E824-Y826 HydrophobicContact CG-CE2 4.41Å; E824-Y826 WeakPolarHBondContact OE2-CE2 3.42Å; E824-Y826 PolarHBondContact OE2-OH 2.77Å; E824-Y826 VanDerWaalsContact OE2-OH 3.07Å
827	G	67	Low	86.4	Confident	57 Å²	57	51.8 Å²	51.8	59%	0.588	29%	0.293	S	S	*	.	S	Bend	trans	143.5	-167.9	-176	0	0	0	0	0	111.3	G829	G827-G829 PolarHBondContact O-N 3.37Å
828	D	61.8	Low	86.6	Confident	139 Å²	139	51 Å²	51	74%	0.743	29%	0.286	S	S	*	.	S	Bend	trans	-72.2	39.6	-171.8	-51.8	-49.8	0	0	0	114.8
829	G	71.7	Confident	86.9	Confident	63 Å²	63	47.8 Å²	47.8	65%	0.649	27%	0.266	S	S	*	.	S	Bend	trans	76.3	17.6	-178.6	0	0	0	0	0	114.8	G827 A862	G827-G829 PolarHBondContact O-N 3.37Å; G829-A862 VanDerWaalsContact O-CB 3.27Å; G829-A862 WeakPolarHBondContact O-CB 3.48Å
830	D	82.1	Confident	87.3	Confident	34 Å²	34	44 Å²	44	18%	0.182	26%	0.257	C	S	.	.			trans	-80.7	-10.8	-177	78.3	10.9	0	0	0	115.3	R832 D861 A862	D830-R832 VanDerWaalsContact C-N 3.32Å; D830-R832 PolarHBondContact O-N 3.07Å; D830-R832 WeakPolarHBondContact OD1-CB 3.43Å; D830-R832 PolarHBondContact OD1-N 3.5Å; D830-R832 IonicContact OD1-NE 2.72Å; D830-R832 IonicContact OD2-CZ 3.73Å; D830-R832 IonicContact OD2-NE 2.8Å; D830-R832 PolarHBondContact OD2-NE 3.49Å; D830-R832 IonicContact OD2-NH2 3.05Å; D830-R832 PolarHBondContact OD2-NH2 3.17Å; D830-D861 WeakPolarHBondContact O-CB 3.43Å; D830-A862 VanDerWaalsContact C-CB 3.5Å; D830-A862 VanDerWaalsContact O-CB 3.28Å; D830-A862 WeakPolarHBondContact O-CB 3.4Å; D830-A862 PolarHBondContact O-N 3.09Å
831	G	87.8	Confident	87.6	Confident	20 Å²	20	41.6 Å²	41.6	21%	0.206	25%	0.247	C	C	.	.			trans	68.7	16.9	175.1	0	0	0	0	0	116	T825 T833	T825-G831 WeakPolarHBondContact CG2-O 3.29Å; G831-T833 PolarHBondContact O-N 3.22Å
832	R	91.7	Very high	87.8	Confident	83 Å²	83	40.5 Å²	40.5	31%	0.313	25%	0.249	S	C	.	.			trans	-76.2	125.1	179.8	-76.6	-175	-88.3	-171.4	-5.3	112.5	D830 H836 L837 D861 Y870	D830-R832 VanDerWaalsContact C-N 3.32Å; D830-R832 PolarHBondContact O-N 3.07Å; D830-R832 WeakPolarHBondContact OD1-CB 3.43Å; D830-R832 PolarHBondContact OD1-N 3.5Å; D830-R832 IonicContact OD1-NE 2.72Å; D830-R832 IonicContact OD2-CZ 3.73Å; D830-R832 IonicContact OD2-NE 2.8Å; D830-R832 PolarHBondContact OD2-NE 3.49Å; D830-R832 IonicContact OD2-NH2 3.05Å; D830-R832 PolarHBondContact OD2-NH2 3.17Å; R832-H836 HydrophobicContact CB-CB 4.22Å; R832-H836 HydrophobicContact CG-CB 4.14Å; R832-L837 HydrophobicContact CB-CD2 4.34Å; R832-D861 HydrophobicContact CG-CB 4.15Å; R832-Y870 WeakPolarHBondContact CD-OH 3.27Å
833	T	93.8	Very high	88	Confident	5 Å²	5	41.7 Å²	41.7	3%	0.031	26%	0.255	C	S	.	.			trans	-84	164.7	166.6	63.6	0	0	0	0	111.1	T825 G831 L835 H836 L837 S859	T825-T833 HydrophobicContact CG2-CG2 3.58Å; G831-T833 PolarHBondContact O-N 3.22Å; T833-L835 PolarHBondContact O-N 3.48Å; T833-L835 VanDerWaalsContact O-N 3.11Å; T833-H836 PolarHBondContact N-ND1 3.33Å; T833-H836 WeakPolarHBondContact O-CB 3.37Å; T833-H836 PolarHBondContact O-N 3.5Å; T833-H836 PolarHBondContact OG1-ND1 2.76Å; T833-L837 PolarHBondContact O-N 3.11Å; T833-S859 PolarHBondContact OG1-OG 3.03Å
834	A	95.1	Very high	88.3	Confident	1 Å²	1	40.2 Å²	40.2	1%	0.008	25%	0.247	C	C	.	.	H	α-helix	trans	-52.9	-34	175.9	0	0	0	0	0	113.2	L798 L799 V802 H836 L837 S838 L850	L798-A834 HydrophobicContact CD2-CB 4.13Å; L798-A834 HydrophobicContact CG-CB 4.09Å; L799-A834 HydrophobicContact CD2-CB 4.29Å; V802-A834 HydrophobicContact CG2-CB 4.3Å; A834-H836 VanDerWaalsContact C-N 3.35Å; A834-H836 PolarHBondContact O-N 3.47Å; A834-L837 PolarHBondContact O-N 3.05Å; A834-L837 VanDerWaalsContact O-N 3.16Å; A834-S838 PolarHBondContact O-N 3.23Å; A834-L850 HydrophobicContact CB-CD1 3.94Å; A834-L850 HydrophobicContact CB-CD2 3.86Å
835	L	96.4	Very high	88.7	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-69.5	-28.4	177.9	-173.6	62.6	0	0	0	113.1	T833 L837 S838 C839 T847 L850 I851 V855 V857 P867 L883	T833-L835 PolarHBondContact O-N 3.48Å; T833-L835 VanDerWaalsContact O-N 3.11Å; L835-L837 VanDerWaalsContact C-N 3.35Å; L835-S838 PolarHBondContact O-OG 2.93Å; L835-C839 WeakPolarHBondContact O-CB 3.48Å; L835-C839 PolarHBondContact O-N 3.14Å; L835-C839 PolarHBondContact O-SG 3.25Å; L835-T847 HydrophobicContact CD1-CG2 3.87Å; L835-L850 HydrophobicContact CB-CD1 4.33Å; L835-L850 HydrophobicContact CD1-CB 4.3Å; L835-L850 HydrophobicContact CD1-CD1 4.41Å; L835-I851 HydrophobicContact CD1-CD1 4.17Å; L835-I851 HydrophobicContact CD1-CG1 3.94Å; L835-I851 HydrophobicContact CD2-CG1 4.2Å; L835-V855 HydrophobicContact CB-CG1 3.75Å; L835-V855 HydrophobicContact CD2-CG1 4.18Å; L835-V857 HydrophobicContact CD2-CG2 4.21Å; L835-P867 HydrophobicContact CD2-CB 4.4Å; L835-P867 HydrophobicContact CD2-CG 4.07Å; L835-P867 HydrophobicContact CG-CB 4.03Å; L835-P867 HydrophobicContact CG-CG 4.02Å; L835-L883 HydrophobicContact CD1-CD2 4.32Å; L835-L883 HydrophobicContact CD2-CD2 4.06Å; L835-L883 HydrophobicContact CG-CD2 4.33Å
836	H	94.9	Very high	89.3	Confident	0 Å²	0	34 Å²	34	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-68.8	-36.3	170.7	-70.3	82.2	0	0	0	111.4	R832 T833 A834 A840 S859 Q865 P867 Y870	R832-H836 HydrophobicContact CB-CB 4.22Å; R832-H836 HydrophobicContact CG-CB 4.14Å; T833-H836 PolarHBondContact N-ND1 3.33Å; T833-H836 WeakPolarHBondContact O-CB 3.37Å; T833-H836 PolarHBondContact O-N 3.5Å; T833-H836 PolarHBondContact OG1-ND1 2.76Å; A834-H836 VanDerWaalsContact C-N 3.35Å; A834-H836 PolarHBondContact O-N 3.47Å; H836-A840 WeakPolarHBondContact O-CB 3.34Å; H836-A840 PolarHBondContact O-N 2.94Å; H836-S859 PolarHBondContact CE1-OG 3.29Å; H836-Q865 PolarHBondContact NE2-O 3.14Å; H836-P867 WeakPolarHBondContact NE2-CD 3.37Å; H836-Y870 AromaticContact CD2-CD2 3.8Å; H836-Y870 AromaticContact CD2-CE2 3.75Å
837	L	95	Very high	90.5	Very high	24 Å²	24	30.4 Å²	30.4	13%	0.126	20%	0.2	C	C	.	.	H	α-helix	trans	-74.5	-45.6	-178.7	-58.2	-177	0	0	0	111.7	L799 V802 V803 R832 T833 A834 L835 C839 A840 M841	L799-L837 HydrophobicContact CB-CD1 4.32Å; L799-L837 HydrophobicContact CD2-CD1 3.53Å; L799-L837 HydrophobicContact CD2-CG 4.32Å; V802-L837 HydrophobicContact CG1-CB 3.88Å; V803-L837 HydrophobicContact CG2-CD1 3.71Å; R832-L837 HydrophobicContact CB-CD2 4.34Å; T833-L837 PolarHBondContact O-N 3.11Å; A834-L837 PolarHBondContact O-N 3.05Å; A834-L837 VanDerWaalsContact O-N 3.16Å; L835-L837 VanDerWaalsContact C-N 3.35Å; L837-C839 VanDerWaalsContact C-N 3.26Å; L837-C839 PolarHBondContact O-N 2.76Å; L837-A840 WeakPolarHBondContact O-CA 3.19Å; L837-A840 VanDerWaalsContact O-CB 3.31Å; L837-A840 WeakPolarHBondContact O-CB 2.98Å; L837-A840 PolarHBondContact O-N 3.16Å; L837-M841 WeakPolarHBondContact O-CG 3.49Å; L837-M841 PolarHBondContact O-N 3Å
838	S	96.9	Very high	91.8	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-59.2	-39.1	176.1	73.1	0	0	0	0	112	A834 L835 M841 A842 N843 T847	A834-S838 PolarHBondContact O-N 3.23Å; L835-S838 PolarHBondContact O-OG 2.93Å; S838-M841 PolarHBondContact O-N 3.41Å; S838-A842 PolarHBondContact O-N 2.73Å; S838-N843 PolarHBondContact O-N 2.94Å; S838-T847 WeakPolarHBondContact CB-OG1 3.13Å; S838-T847 PolarHBondContact OG-OG1 3.16Å
839	C	96.6	Very high	93.5	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-73.3	-27.9	175.6	-64	0	0	0	0	113.2	L835 L837 M841 A871 A874	L835-C839 WeakPolarHBondContact O-CB 3.48Å; L835-C839 PolarHBondContact O-N 3.14Å; L835-C839 PolarHBondContact O-SG 3.25Å; L837-C839 VanDerWaalsContact C-N 3.26Å; L837-C839 PolarHBondContact O-N 2.76Å; C839-M841 VanDerWaalsContact C-N 3.29Å; C839-A871 HydrophobicContact CB-CB 4.13Å; C839-A871 WeakPolarHBondContact O-CA 3.44Å; C839-A874 WeakPolarHBondContact O-CB 3.16Å
840	A	95.3	Very high	94.6	Very high	43 Å²	43	18.1 Å²	18.1	36%	0.355	11%	0.106	S	C	.	.	H	α-helix	trans	-67.7	-32	171.7	0	0	0	0	0	112.2	H836 L837 Y870	H836-A840 WeakPolarHBondContact O-CB 3.34Å; H836-A840 PolarHBondContact O-N 2.94Å; L837-A840 WeakPolarHBondContact O-CA 3.19Å; L837-A840 VanDerWaalsContact O-CB 3.31Å; L837-A840 WeakPolarHBondContact O-CB 2.98Å; L837-A840 PolarHBondContact O-N 3.16Å; A840-Y870 HydrophobicContact CB-CD1 3.65Å; A840-Y870 HydrophobicContact CB-CE1 4.28Å
841	M	94.6	Very high	95.2	Very high	80 Å²	80	17.2 Å²	17.2	39%	0.394	10%	0.101	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.1	2.1	-177.8	-66.2	168.6	63.2	0	0	113.4	V802 D805 L837 S838 C839 N843	V802-M841 WeakPolarHBondContact O-CE 3.32Å; V802-M841 VanDerWaalsContact O-SD 3.32Å; D805-M841 HydrophobicContact CB-CE 4.36Å; L837-M841 WeakPolarHBondContact O-CG 3.49Å; L837-M841 PolarHBondContact O-N 3Å; S838-M841 PolarHBondContact O-N 3.41Å; C839-M841 VanDerWaalsContact C-N 3.29Å; M841-N843 PolarHBondContact O-N 3.21Å
842	A	95.6	Very high	95.5	Very high	40 Å²	40	17.2 Å²	17.2	33%	0.331	10%	0.095	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.5	21.6	-173.3	0	0	0	0	0	114.8	S838 V844 A874	S838-A842 PolarHBondContact O-N 2.73Å; A842-V844 PolarHBondContact O-N 2.91Å; A842-A874 HydrophobicContact CB-CB 4.42Å
843	N	96	Very high	95.6	Very high	28 Å²	28	15.6 Å²	15.6	15%	0.15	9%	0.089	C	C	.	.			trans	-79.5	97.4	179.6	-170.7	-38	0	0	0	110.6	D805 S838 M841 V845 I846 T847	D805-N843 PolarHBondContact OD1-ND2 2.74Å; S838-N843 PolarHBondContact O-N 2.94Å; M841-N843 PolarHBondContact O-N 3.21Å; N843-V845 PolarHBondContact O-N 2.69Å; N843-V845 PolarHBondContact OD1-N 2.7Å; N843-I846 HydrophobicContact CB-CB 4.32Å; N843-I846 WeakPolarHBondContact ND2-CD1 3.26Å; N843-I846 PolarHBondContact OD1-N 2.96Å; N843-T847 VanDerWaalsContact O-CB 3.22Å; N843-T847 WeakPolarHBondContact O-CB 3.39Å; N843-T847 PolarHBondContact O-N 2.83Å; N843-T847 PolarHBondContact O-OG1 3.39Å
844	V	96	Very high	95.4	Very high	8 Å²	8	16.6 Å²	16.6	5%	0.048	10%	0.101	C	C	.	.	H	α-helix	trans	-58.6	-42.5	177.7	-171.5	0	0	0	0	112.2	E734 M737 A842 T847 Q848 E878 I882	E734-V844 HydrophobicContact CB-CG1 4.11Å; M737-V844 HydrophobicContact CE-CB 3.84Å; M737-V844 HydrophobicContact CE-CG1 4.4Å; M737-V844 HydrophobicContact CE-CG2 3.91Å; M737-V844 HydrophobicContact SD-CB 4.16Å; M737-V844 HydrophobicContact SD-CG1 4.06Å; M737-V844 HydrophobicContact SD-CG2 4.32Å; A842-V844 PolarHBondContact O-N 2.91Å; V844-T847 PolarHBondContact O-N 3.27Å; V844-Q848 WeakPolarHBondContact O-CB 3.3Å; V844-Q848 PolarHBondContact O-N 3.05Å; V844-E878 HydrophobicContact CG1-CB 4.1Å; V844-E878 HydrophobicContact CG2-CB 3.73Å; V844-E878 HydrophobicContact CG2-CG 4.32Å; V844-I882 HydrophobicContact CG1-CD1 3.6Å
845	V	96.9	Very high	95.2	Very high	13 Å²	13	16.9 Å²	16.9	8%	0.079	10%	0.102	C	C	.	.	H	α-helix	trans	-66.9	-52.5	-174.7	173	0	0	0	0	111	M737 V738 A741 L807 N843 T847 Q848 L849	M737-V845 HydrophobicContact CB-CG2 3.95Å; V738-V845 HydrophobicContact CB-CG1 4.47Å; V738-V845 HydrophobicContact CG1-CG1 4.48Å; V738-V845 HydrophobicContact CG2-CB 4.39Å; V738-V845 HydrophobicContact CG2-CG1 4.12Å; V738-V845 HydrophobicContact CG2-CG2 4.42Å; A741-V845 HydrophobicContact CB-CG1 4.04Å; A741-V845 HydrophobicContact CB-CG2 4.04Å; L807-V845 HydrophobicContact CD1-CG1 3.76Å; L807-V845 HydrophobicContact CD2-CG1 3.99Å; N843-V845 PolarHBondContact O-N 2.69Å; N843-V845 PolarHBondContact OD1-N 2.7Å; V845-T847 VanDerWaalsContact C-N 3.34Å; V845-T847 PolarHBondContact O-N 3.25Å; V845-Q848 PolarHBondContact O-N 3.11Å; V845-L849 HydrophobicContact CG1-CD1 3.97Å; V845-L849 VanDerWaalsContact O-CG 3.31Å; V845-L849 WeakPolarHBondContact O-CG 3.26Å; V845-L849 PolarHBondContact O-N 3.17Å
846	I	97.7	Very high	94.9	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-62.8	-43	177.3	-67.4	179.3	0	0	0	110	V802 L807 V810 N843 Q848 L849 L850	V802-I846 HydrophobicContact CB-CG2 4.49Å; V802-I846 HydrophobicContact CG1-CG2 4.1Å; V802-I846 HydrophobicContact CG2-CG2 3.69Å; L807-I846 HydrophobicContact CD1-CG1 4.11Å; V810-I846 HydrophobicContact CG1-CG2 4.44Å; V810-I846 HydrophobicContact CG2-CD1 4.28Å; N843-I846 HydrophobicContact CB-CB 4.32Å; N843-I846 WeakPolarHBondContact ND2-CD1 3.26Å; N843-I846 PolarHBondContact OD1-N 2.96Å; I846-Q848 VanDerWaalsContact C-N 3.33Å; I846-Q848 PolarHBondContact O-N 3.2Å; I846-L849 PolarHBondContact O-N 2.93Å; I846-L850 HydrophobicContact CG2-CD1 3.71Å; I846-L850 HydrophobicContact CG2-CG 4.11Å; I846-L850 WeakPolarHBondContact O-CB 3.44Å; I846-L850 VanDerWaalsContact O-CG 3.25Å; I846-L850 WeakPolarHBondContact O-CG 3.34Å; I846-L850 PolarHBondContact O-N 3.24Å
847	T	97.1	Very high	94.9	Very high	0 Å²	0	21 Å²	21	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-55.7	-47.4	176.1	-62	0	0	0	0	111.5	L835 S838 N843 V844 V845 I851 C879 I882	L835-T847 HydrophobicContact CD1-CG2 3.87Å; S838-T847 WeakPolarHBondContact CB-OG1 3.13Å; S838-T847 PolarHBondContact OG-OG1 3.16Å; N843-T847 VanDerWaalsContact O-CB 3.22Å; N843-T847 WeakPolarHBondContact O-CB 3.39Å; N843-T847 PolarHBondContact O-N 2.83Å; N843-T847 PolarHBondContact O-OG1 3.39Å; V844-T847 PolarHBondContact O-N 3.27Å; V845-T847 VanDerWaalsContact C-N 3.34Å; V845-T847 PolarHBondContact O-N 3.25Å; T847-I851 HydrophobicContact CG2-CD1 4.22Å; T847-I851 WeakPolarHBondContact O-CD1 3.34Å; T847-I851 VanDerWaalsContact O-CG1 3.29Å; T847-I851 WeakPolarHBondContact O-CG1 3.42Å; T847-I851 PolarHBondContact O-N 3.05Å; T847-C879 PolarHBondContact OG1-SG 3.47Å; T847-I882 HydrophobicContact CG2-CG2 4.45Å
848	Q	95.9	Very high	94.7	Very high	1 Å²	1	26.1 Å²	26.1	1%	0.005	15%	0.146	C	C	.	.	H	α-helix	trans	-68.1	-37.9	-179.5	-172.8	59.7	87.8	0	0	112.8	V738 V844 V845 I846 W852 I882	V738-Q848 HydrophobicContact CG2-CB 4Å; V738-Q848 HydrophobicContact CG2-CG 4.11Å; V844-Q848 WeakPolarHBondContact O-CB 3.3Å; V844-Q848 PolarHBondContact O-N 3.05Å; V845-Q848 PolarHBondContact O-N 3.11Å; I846-Q848 VanDerWaalsContact C-N 3.33Å; I846-Q848 PolarHBondContact O-N 3.2Å; Q848-W852 HydrophobicContact CG-CD2 4.11Å; Q848-W852 HydrophobicContact CG-CE3 4.15Å; Q848-W852 HydrophobicContact CG-CH2 3.49Å; Q848-W852 VanDerWaalsContact CG-CH2 3.49Å; Q848-W852 HydrophobicContact CG-CZ2 3.42Å; Q848-W852 VanDerWaalsContact CG-CZ2 3.42Å; Q848-W852 HydrophobicContact CG-CZ3 3.87Å; Q848-W852 VanDerWaalsContact NE2-NE1 3.13Å; Q848-W852 PolarHBondContact O-N 2.77Å; Q848-W852 VanDerWaalsContact O-N 3.17Å; Q848-I882 HydrophobicContact CB-CD1 4.46Å
849	L	96.3	Very high	94.4	Very high	1 Å²	1	26.9 Å²	26.9	1%	0.005	15%	0.151	C	C	.	.	H	α-helix	trans	-64.5	-50.5	175.9	-72	166.5	0	0	0	111.9	V738 I742 L807 V811 L814 V845 I846 I851 W852 Y853	V738-L849 HydrophobicContact CG1-CD2 4Å; V738-L849 HydrophobicContact CG1-CG 4.29Å; I742-L849 HydrophobicContact CD1-CD1 4.2Å; I742-L849 HydrophobicContact CD1-CD2 4.19Å; L807-L849 HydrophobicContact CD1-CD1 3.61Å; V811-L849 HydrophobicContact CG2-CD1 4.13Å; L814-L849 HydrophobicContact CD1-CB 4.14Å; V845-L849 HydrophobicContact CG1-CD1 3.97Å; V845-L849 VanDerWaalsContact O-CG 3.31Å; V845-L849 WeakPolarHBondContact O-CG 3.26Å; V845-L849 PolarHBondContact O-N 3.17Å; I846-L849 PolarHBondContact O-N 2.93Å; L849-I851 PolarHBondContact O-N 2.72Å; L849-W852 HydrophobicContact CD2-CE3 4.31Å; L849-W852 CarbonylContact O-C 3.53Å; L849-W852 WeakPolarHBondContact O-CA 3.33Å; L849-W852 WeakPolarHBondContact O-CB 3.46Å; L849-W852 PolarHBondContact O-N 2.73Å; L849-Y853 WeakPolarHBondContact O-CD2 3.47Å; L849-Y853 PolarHBondContact O-N 2.8Å
850	L	95.9	Very high	94.2	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-54.6	-42	179.9	-70.6	169.8	0	0	0	111.8	L798 L814 A834 L835 I846 Y853 G854 V855	L798-L850 HydrophobicContact CD1-CD2 4.36Å; L798-L850 HydrophobicContact CD2-CD2 4.05Å; L798-L850 HydrophobicContact CG-CD2 4.48Å; L814-L850 HydrophobicContact CD1-CD2 4.28Å; L814-L850 HydrophobicContact CD2-CD2 4.09Å; A834-L850 HydrophobicContact CB-CD1 3.94Å; A834-L850 HydrophobicContact CB-CD2 3.86Å; L835-L850 HydrophobicContact CB-CD1 4.33Å; L835-L850 HydrophobicContact CD1-CB 4.3Å; L835-L850 HydrophobicContact CD1-CD1 4.41Å; I846-L850 HydrophobicContact CG2-CD1 3.71Å; I846-L850 HydrophobicContact CG2-CG 4.11Å; I846-L850 WeakPolarHBondContact O-CB 3.44Å; I846-L850 VanDerWaalsContact O-CG 3.25Å; I846-L850 WeakPolarHBondContact O-CG 3.34Å; I846-L850 PolarHBondContact O-N 3.24Å; L850-Y853 PolarHBondContact O-N 3.22Å; L850-G854 PolarHBondContact O-N 3.08Å; L850-G854 VanDerWaalsContact O-N 3.17Å; L850-V855 HydrophobicContact CB-CB 4.26Å; L850-V855 HydrophobicContact CB-CG2 3.96Å; L850-V855 HydrophobicContact CD2-CG2 4.04Å; L850-V855 WeakPolarHBondContact O-CB 3.45Å; L850-V855 WeakPolarHBondContact O-CG2 3.48Å; L850-V855 PolarHBondContact O-N 3.13Å; L850-V855 VanDerWaalsContact O-N 3.07Å
851	I	94.4	Very high	93.9	Very high	14 Å²	14	30.4 Å²	30.4	7%	0.072	16%	0.156	C	C	.	.	H	α-helix	trans	-66.2	-38.8	176.5	-64.2	171.3	0	0	0	111.5	L835 T847 L849 Y853 G854 V857 I882 L883 H886	L835-I851 HydrophobicContact CD1-CD1 4.17Å; L835-I851 HydrophobicContact CD1-CG1 3.94Å; L835-I851 HydrophobicContact CD2-CG1 4.2Å; T847-I851 HydrophobicContact CG2-CD1 4.22Å; T847-I851 WeakPolarHBondContact O-CD1 3.34Å; T847-I851 VanDerWaalsContact O-CG1 3.29Å; T847-I851 WeakPolarHBondContact O-CG1 3.42Å; T847-I851 PolarHBondContact O-N 3.05Å; L849-I851 PolarHBondContact O-N 2.72Å; I851-Y853 VanDerWaalsContact C-N 3.33Å; I851-Y853 PolarHBondContact O-N 2.94Å; I851-G854 PolarHBondContact O-N 3.35Å; I851-V857 HydrophobicContact CB-CG2 4.45Å; I851-V857 HydrophobicContact CD1-CG2 4.09Å; I851-V857 HydrophobicContact CG1-CG2 3.78Å; I851-V857 HydrophobicContact CG2-CG2 4Å; I851-I882 HydrophobicContact CD1-CG2 3.61Å; I851-L883 HydrophobicContact CD1-CD2 4.07Å; I851-H886 HydrophobicContact CG2-CB 4.08Å
852	W	93.2	Very high	93.7	Very high	21 Å²	21	29.9 Å²	29.9	8%	0.08	16%	0.164	C	C	.	.	H	α-helix	trans	-69.7	-26.6	176.2	-74.7	-14.4	0	0	0	114.3	L699 N700 R722 L735 V738 Q848 L849 G854	L699-W852 VanDerWaalsContact C-CZ3 3.47Å; L699-W852 HydrophobicContact CB-CE3 4.5Å; L699-W852 HydrophobicContact CB-CH2 3.64Å; L699-W852 HydrophobicContact CB-CZ2 4.11Å; L699-W852 HydrophobicContact CB-CZ3 3.85Å; L699-W852 HydrophobicContact CD1-CH2 4.49Å; L699-W852 HydrophobicContact CD1-CZ2 4.32Å; L699-W852 HydrophobicContact CG-CH2 4.5Å; L699-W852 VanDerWaalsContact O-CZ3 3.27Å; L699-W852 WeakPolarHBondContact O-CZ3 3.23Å; N700-W852 HydrophobicContact CB-CB 4.07Å; N700-W852 HydrophobicContact CB-CD2 4.23Å; N700-W852 HydrophobicContact CB-CE3 3.81Å; N700-W852 HydrophobicContact CB-CG 4.39Å; R722-W852 VanDerWaalsContact CZ-O 3.3Å; R722-W852 PolarHBondContact NH1-O 2.8Å; R722-W852 PolarHBondContact NH2-O 3.24Å; L735-W852 HydrophobicContact CD2-CH2 3.7Å; L735-W852 HydrophobicContact CD2-CZ2 3.48Å; L735-W852 VanDerWaalsContact CD2-CZ2 3.48Å; V738-W852 HydrophobicContact CB-CZ3 4.37Å; V738-W852 HydrophobicContact CG1-CZ3 4.06Å; V738-W852 HydrophobicContact CG2-CH2 4.39Å; V738-W852 HydrophobicContact CG2-CZ3 4.2Å; Q848-W852 HydrophobicContact CG-CD2 4.11Å; Q848-W852 HydrophobicContact CG-CE3 4.15Å; Q848-W852 HydrophobicContact CG-CH2 3.49Å; Q848-W852 VanDerWaalsContact CG-CH2 3.49Å; Q848-W852 HydrophobicContact CG-CZ2 3.42Å; Q848-W852 VanDerWaalsContact CG-CZ2 3.42Å; Q848-W852 HydrophobicContact CG-CZ3 3.87Å; Q848-W852 VanDerWaalsContact NE2-NE1 3.13Å; Q848-W852 PolarHBondContact O-N 2.77Å; Q848-W852 VanDerWaalsContact O-N 3.17Å; L849-W852 HydrophobicContact CD2-CE3 4.31Å; L849-W852 CarbonylContact O-C 3.53Å; L849-W852 WeakPolarHBondContact O-CA 3.33Å; L849-W852 WeakPolarHBondContact O-CB 3.46Å; L849-W852 PolarHBondContact O-N 2.73Å; W852-G854 VanDerWaalsContact C-N 3.34Å
853	Y	93.4	Very high	93.5	Very high	49 Å²	49	34.1 Å²	34.1	19%	0.192	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.6	3.5	172.8	-78	-97.1	0	0	0	113.5	N700 L814 L849 L850 I851	N700-Y853 HydrophobicContact CB-CE2 4.33Å; N700-Y853 PolarHBondContact O-OH 3.39Å; L814-Y853 HydrophobicContact CB-CD1 3.8Å; L814-Y853 HydrophobicContact CB-CD2 4.11Å; L814-Y853 HydrophobicContact CB-CE1 4Å; L814-Y853 HydrophobicContact CB-CE2 4.31Å; L814-Y853 HydrophobicContact CB-CG 3.85Å; L814-Y853 HydrophobicContact CD1-CD2 3.95Å; L814-Y853 HydrophobicContact CD1-CG 4.18Å; L814-Y853 HydrophobicContact CD2-CG 4.33Å; L814-Y853 HydrophobicContact CG-CG 4.34Å; L814-Y853 WeakPolarHBondContact O-CD1 3.28Å; L814-Y853 WeakPolarHBondContact O-CE1 3.15Å; L849-Y853 WeakPolarHBondContact O-CD2 3.47Å; L849-Y853 PolarHBondContact O-N 2.8Å; L850-Y853 PolarHBondContact O-N 3.22Å; I851-Y853 VanDerWaalsContact C-N 3.33Å; I851-Y853 PolarHBondContact O-N 2.94Å
854	G	89.8	Confident	93.2	Very high	26 Å²	26	36.5 Å²	36.5	27%	0.268	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	94	21	165.6	0	0	0	0	0	116	K819 N823 L850 I851 W852	K819-G854 VanDerWaalsContact CE-O 3.24Å; K819-G854 WeakPolarHBondContact CE-O 3.38Å; N823-G854 PolarHBondContact ND2-O 3.3Å; N823-G854 VanDerWaalsContact ND2-O 3.16Å; L850-G854 PolarHBondContact O-N 3.08Å; L850-G854 VanDerWaalsContact O-N 3.17Å; I851-G854 PolarHBondContact O-N 3.35Å; W852-G854 VanDerWaalsContact C-N 3.34Å
855	V	91.6	Very high	93	Very high	6 Å²	6	38.7 Å²	38.7	4%	0.036	20%	0.2	C	C	.	.			trans	-63.6	138.7	168.7	-177.8	0	0	0	0	110.4	V822 N823 L835 L850 V857	V822-V855 HydrophobicContact CB-CG2 4.08Å; V822-V855 HydrophobicContact CG2-CG2 3.83Å; V822-V855 WeakPolarHBondContact O-CG2 3.48Å; N823-V855 WeakPolarHBondContact OD1-CA 3.49Å; L835-V855 HydrophobicContact CB-CG1 3.75Å; L835-V855 HydrophobicContact CD2-CG1 4.18Å; L850-V855 HydrophobicContact CB-CB 4.26Å; L850-V855 HydrophobicContact CB-CG2 3.96Å; L850-V855 HydrophobicContact CD2-CG2 4.04Å; L850-V855 WeakPolarHBondContact O-CB 3.45Å; L850-V855 WeakPolarHBondContact O-CG2 3.48Å; L850-V855 PolarHBondContact O-N 3.13Å; L850-V855 VanDerWaalsContact O-N 3.07Å; V855-V857 PolarHBondContact O-N 2.72Å; V855-V857 VanDerWaalsContact O-N 3.13Å
856	D	90.3	Very high	92.8	Very high	76 Å²	76	38.1 Å²	38.1	41%	0.406	20%	0.197	S	C	.	.			trans	-73.6	106	-176	-176.1	22.1	0	0	0	111.9	N823 K858 S859	N823-D856 PolarHBondContact OD1-N 3.19Å; D856-K858 PolarHBondContact O-N 2.85Å; D856-K858 VanDerWaalsContact O-N 3.11Å; D856-K858 WeakPolarHBondContact OD1-CB 3.24Å; D856-K858 PolarHBondContact OD1-N 3.32Å; D856-S859 VanDerWaalsContact O-CB 3.29Å; D856-S859 WeakPolarHBondContact O-CB 3.27Å; D856-S859 PolarHBondContact O-N 3.37Å; D856-S859 PolarHBondContact O-OG 3.46Å; D856-S859 PolarHBondContact OD2-N 2.97Å
857	V	93.6	Very high	92.7	Very high	12 Å²	12	38.1 Å²	38.1	7%	0.073	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-18	172	176.2	0	0	0	0	112.7	L835 I851 V855 L883 H886 C888	L835-V857 HydrophobicContact CD2-CG2 4.21Å; I851-V857 HydrophobicContact CB-CG2 4.45Å; I851-V857 HydrophobicContact CD1-CG2 4.09Å; I851-V857 HydrophobicContact CG1-CG2 3.78Å; I851-V857 HydrophobicContact CG2-CG2 4Å; V855-V857 PolarHBondContact O-N 2.72Å; V855-V857 VanDerWaalsContact O-N 3.13Å; V857-L883 HydrophobicContact CG1-CD2 4.01Å; V857-H886 HydrophobicContact CG1-CB 4.28Å; V857-H886 HydrophobicContact CG2-CB 4.13Å; V857-C888 HydrophobicContact CG1-CB 3.55Å; V857-C888 PolarHBondContact O-SG 3.19Å
858	K	91.3	Very high	92.7	Very high	130 Å²	130	38.2 Å²	38.2	57%	0.565	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	-102.6	2.3	179.3	-53.8	-176.1	-179.4	176.1	0	113.8	D856 G887	D856-K858 PolarHBondContact O-N 2.85Å; D856-K858 VanDerWaalsContact O-N 3.11Å; D856-K858 WeakPolarHBondContact OD1-CB 3.24Å; D856-K858 PolarHBondContact OD1-N 3.32Å; K858-G887 VanDerWaalsContact CE-O 3.28Å; K858-G887 WeakPolarHBondContact CE-O 3.37Å
859	S	90.6	Very high	92.5	Very high	17 Å²	17	39.6 Å²	39.6	12%	0.119	21%	0.207	C	C	.	.			trans	-55.4	149.8	173.9	55.7	0	0	0	0	111.1	T833 H836 D856 P867	T833-S859 PolarHBondContact OG1-OG 3.03Å; H836-S859 PolarHBondContact CE1-OG 3.29Å; D856-S859 VanDerWaalsContact O-CB 3.29Å; D856-S859 WeakPolarHBondContact O-CB 3.27Å; D856-S859 PolarHBondContact O-N 3.37Å; D856-S859 PolarHBondContact O-OG 3.46Å; D856-S859 PolarHBondContact OD2-N 2.97Å; S859-P867 WeakPolarHBondContact O-CD 3.36Å
860	R	91.6	Very high	92.5	Very high	110 Å²	110	39.9 Å²	39.9	42%	0.415	21%	0.208	S	C	.	.			trans	-131.5	138.9	176.5	-72	-175	-177.9	-89.9	-3.5	109.5	S864 Q865 T866 D891	R860-S864 WeakPolarHBondContact CD-O 3.43Å; R860-S864 PolarHBondContact NH1-O 2.96Å; R860-Q865 CarbonylContact C-O 3.46Å; R860-Q865 VanDerWaalsContact CA-O 3.3Å; R860-Q865 WeakPolarHBondContact CA-O 3.33Å; R860-T866 HydrophobicContact CG-CG2 3.82Å; R860-D891 IonicContact CZ-OD1 2.69Å; R860-D891 IonicContact CZ-OD2 3.21Å; R860-D891 IonicContact NH1-OD1 3.11Å; R860-D891 PolarHBondContact NH1-OD1 3.08Å; R860-D891 IonicContact NH1-OD2 3.79Å; R860-D891 PolarHBondContact NH1-OD2 2.87Å; R860-D891 IonicContact NH2-OD1 2.7Å; R860-D891 PolarHBondContact NH2-OD1 2.79Å; R860-D891 IonicContact NH2-OD2 3.61Å; R860-D891 PolarHBondContact NH2-OD2 3.3Å
861	D	90.8	Very high	92.5	Very high	7 Å²	7	39.9 Å²	39.9	4%	0.037	21%	0.208	C	C	.	.			trans	-72.9	176.7	173.8	91.5	-17.2	0	0	0	112.1	D830 R832 R863 S864 Q865 Y870	D830-D861 WeakPolarHBondContact O-CB 3.43Å; R832-D861 HydrophobicContact CG-CB 4.15Å; D861-R863 PolarHBondContact O-N 3.39Å; D861-R863 VanDerWaalsContact O-N 3.09Å; D861-R863 VanDerWaalsContact OD1-CA 3.31Å; D861-R863 WeakPolarHBondContact OD1-CA 3.34Å; D861-R863 WeakPolarHBondContact OD1-CB 3.31Å; D861-R863 PolarHBondContact OD1-N 3.22Å; D861-R863 IonicContact OD2-CZ 2.87Å; D861-R863 IonicContact OD2-NH1 3.3Å; D861-R863 PolarHBondContact OD2-NH1 2.75Å; D861-R863 IonicContact OD2-NH2 2.76Å; D861-R863 PolarHBondContact OD2-NH2 3.42Å; D861-S864 WeakPolarHBondContact O-CA 3.42Å; D861-S864 PolarHBondContact O-N 3.27Å; D861-S864 PolarHBondContact OD1-N 3.44Å; D861-Q865 PolarHBondContact N-O 3.11Å; D861-Q865 VanDerWaalsContact OD1-CB 3.32Å; D861-Q865 WeakPolarHBondContact OD1-CB 3.46Å; D861-Q865 PolarHBondContact OD1-N 3.23Å; D861-Y870 PolarHBondContact OD2-OH 3Å; D861-Y870 VanDerWaalsContact OD2-OH 3.07Å
862	A	90.5	Very high	92.5	Very high	68 Å²	68	44.7 Å²	44.7	56%	0.562	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-13.8	-178.6	0	0	0	0	0	114.3	G829 D830 S864	G829-A862 VanDerWaalsContact O-CB 3.27Å; G829-A862 WeakPolarHBondContact O-CB 3.48Å; D830-A862 VanDerWaalsContact C-CB 3.5Å; D830-A862 VanDerWaalsContact O-CB 3.28Å; D830-A862 WeakPolarHBondContact O-CB 3.4Å; D830-A862 PolarHBondContact O-N 3.09Å; A862-S864 VanDerWaalsContact C-N 3.33Å
863	R	89.6	Confident	92.6	Very high	129 Å²	129	50.9 Å²	50.9	49%	0.487	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.4	16.8	170.7	-63.1	-176.7	-52.7	-62.2	-14.7	111.8	D861 Q865 Y870	D861-R863 PolarHBondContact O-N 3.39Å; D861-R863 VanDerWaalsContact O-N 3.09Å; D861-R863 VanDerWaalsContact OD1-CA 3.31Å; D861-R863 WeakPolarHBondContact OD1-CA 3.34Å; D861-R863 WeakPolarHBondContact OD1-CB 3.31Å; D861-R863 PolarHBondContact OD1-N 3.22Å; D861-R863 IonicContact OD2-CZ 2.87Å; D861-R863 IonicContact OD2-NH1 3.3Å; D861-R863 PolarHBondContact OD2-NH1 2.75Å; D861-R863 IonicContact OD2-NH2 2.76Å; D861-R863 PolarHBondContact OD2-NH2 3.42Å; R863-Q865 HydrophobicContact CB-CG 3.99Å; R863-Q865 PolarHBondContact O-N 3.24Å; R863-Y870 PolarHBondContact NH2-OH 2.95Å
864	S	90.3	Very high	92.6	Very high	78 Å²	78	50.7 Å²	50.7	55%	0.545	26%	0.257	S	S	.	.			trans	59.1	16.4	-173.5	-57.4	0	0	0	0	114.8	R860 D861 A862	R860-S864 WeakPolarHBondContact CD-O 3.43Å; R860-S864 PolarHBondContact NH1-O 2.96Å; D861-S864 WeakPolarHBondContact O-CA 3.42Å; D861-S864 PolarHBondContact O-N 3.27Å; D861-S864 PolarHBondContact OD1-N 3.44Å; A862-S864 VanDerWaalsContact C-N 3.33Å
865	Q	91.3	Very high	92.8	Very high	55 Å²	55	52.5 Å²	52.5	26%	0.257	28%	0.276	S	S	.	.			trans	-78.7	139.9	-179	-57.3	-160.3	-87.8	0	0	110.4	H836 R860 D861 R863 Y870	H836-Q865 PolarHBondContact NE2-O 3.14Å; R860-Q865 CarbonylContact C-O 3.46Å; R860-Q865 VanDerWaalsContact CA-O 3.3Å; R860-Q865 WeakPolarHBondContact CA-O 3.33Å; D861-Q865 PolarHBondContact N-O 3.11Å; D861-Q865 VanDerWaalsContact OD1-CB 3.32Å; D861-Q865 WeakPolarHBondContact OD1-CB 3.46Å; D861-Q865 PolarHBondContact OD1-N 3.23Å; R863-Q865 HydrophobicContact CB-CG 3.99Å; R863-Q865 PolarHBondContact O-N 3.24Å; Q865-Y870 HydrophobicContact CB-CD2 4.48Å; Q865-Y870 HydrophobicContact CB-CE2 3.95Å
866	T	94.4	Very high	93	Very high	1 Å²	1	52.6 Å²	52.6	1%	0.006	28%	0.277	C	S	.	.			trans	-95.4	160.5	178.2	48.1	0	0	0	0	111.6	R860 L868 S869 Y870 P889 D891	R860-T866 HydrophobicContact CG-CG2 3.82Å; T866-L868 PolarHBondContact O-N 3.32Å; T866-L868 VanDerWaalsContact O-N 3.14Å; T866-S869 PolarHBondContact N-OG 3.46Å; T866-S869 WeakPolarHBondContact O-CB 3.5Å; T866-S869 PolarHBondContact O-N 3.23Å; T866-S869 PolarHBondContact O-OG 3.22Å; T866-Y870 PolarHBondContact O-N 3.25Å; T866-P889 HydrophobicContact CG2-CG 4.06Å; T866-D891 VanDerWaalsContact CG2-OD2 3.31Å; T866-D891 WeakPolarHBondContact CG2-OD2 3.27Å; T866-D891 PolarHBondContact OG1-OD2 3.18Å
867	P	95.4	Very high	93.1	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-55.2	-33.2	174.1	-26.3	35.2	0	0	0	113.2	L835 H836 S859 S869 Y870 A871 L883	L835-P867 HydrophobicContact CD2-CB 4.4Å; L835-P867 HydrophobicContact CD2-CG 4.07Å; L835-P867 HydrophobicContact CG-CB 4.03Å; L835-P867 HydrophobicContact CG-CG 4.02Å; H836-P867 WeakPolarHBondContact NE2-CD 3.37Å; S859-P867 WeakPolarHBondContact O-CD 3.36Å; P867-S869 VanDerWaalsContact C-N 3.31Å; P867-S869 PolarHBondContact O-N 3.36Å; P867-Y870 WeakPolarHBondContact O-CA 3.36Å; P867-Y870 WeakPolarHBondContact O-CB 3.37Å; P867-Y870 PolarHBondContact O-N 2.72Å; P867-A871 PolarHBondContact O-N 2.95Å; P867-L883 HydrophobicContact CB-CD1 3.8Å; P867-L883 HydrophobicContact CB-CD2 3.99Å
868	L	95.6	Very high	93	Very high	1 Å²	1	57.9 Å²	57.9	1%	0.005	30%	0.298	C	S	.	.	H	α-helix	trans	-64.7	-34	177.2	177.3	61.6	0	0	0	112.5	T866 Y870 R872 A880 L883 L884 C888 N890	T866-L868 PolarHBondContact O-N 3.32Å; T866-L868 VanDerWaalsContact O-N 3.14Å; L868-Y870 VanDerWaalsContact C-N 3.31Å; L868-R872 HydrophobicContact CD1-CG 4.43Å; L868-R872 WeakPolarHBondContact O-CB 3.2Å; L868-R872 VanDerWaalsContact O-CG 3.31Å; L868-R872 WeakPolarHBondContact O-CG 3.3Å; L868-R872 PolarHBondContact O-N 3.19Å; L868-R872 VanDerWaalsContact O-N 3.09Å; L868-A880 HydrophobicContact CD1-CB 3.69Å; L868-L883 HydrophobicContact CB-CD1 4.12Å; L868-L884 HydrophobicContact CD1-CD1 4.44Å; L868-L884 HydrophobicContact CD1-CG 4.17Å; L868-L884 HydrophobicContact CD2-CD2 3.7Å; L868-L884 HydrophobicContact CD2-CG 4.13Å; L868-C888 HydrophobicContact CB-CB 4.36Å; L868-C888 VanDerWaalsContact CB-SG 3.57Å; L868-N890 HydrophobicContact CD2-CB 4.46Å
869	S	93.6	Very high	93.2	Very high	31 Å²	31	51.7 Å²	51.7	22%	0.217	27%	0.271	C	S	.	.	H	α-helix	trans	-69.7	-29.2	173.3	75.7	0	0	0	0	112.5	T866 P867 R873	T866-S869 PolarHBondContact N-OG 3.46Å; T866-S869 WeakPolarHBondContact O-CB 3.5Å; T866-S869 PolarHBondContact O-N 3.23Å; T866-S869 PolarHBondContact O-OG 3.22Å; P867-S869 VanDerWaalsContact C-N 3.31Å; P867-S869 PolarHBondContact O-N 3.36Å; S869-R873 WeakPolarHBondContact O-CB 3.4Å; S869-R873 PolarHBondContact O-N 3.14Å
870	Y	94.8	Very high	93.3	Very high	7 Å²	7	51 Å²	51	3%	0.027	27%	0.267	C	S	.	.	H	α-helix	trans	-73	-48.9	172.7	-83.3	-100.1	0	0	0	111.7	R832 H836 A840 D861 R863 Q865 T866 P867 L868 R872 R873 A874	R832-Y870 WeakPolarHBondContact CD-OH 3.27Å; H836-Y870 AromaticContact CD2-CD2 3.8Å; H836-Y870 AromaticContact CD2-CE2 3.75Å; A840-Y870 HydrophobicContact CB-CD1 3.65Å; A840-Y870 HydrophobicContact CB-CE1 4.28Å; D861-Y870 PolarHBondContact OD2-OH 3Å; D861-Y870 VanDerWaalsContact OD2-OH 3.07Å; R863-Y870 PolarHBondContact NH2-OH 2.95Å; Q865-Y870 HydrophobicContact CB-CD2 4.48Å; Q865-Y870 HydrophobicContact CB-CE2 3.95Å; T866-Y870 PolarHBondContact O-N 3.25Å; P867-Y870 WeakPolarHBondContact O-CA 3.36Å; P867-Y870 WeakPolarHBondContact O-CB 3.37Å; P867-Y870 PolarHBondContact O-N 2.72Å; L868-Y870 VanDerWaalsContact C-N 3.31Å; Y870-R872 VanDerWaalsContact C-N 3.32Å; Y870-R872 PolarHBondContact O-N 2.85Å; Y870-R873 VanDerWaalsContact CD1-NH2 3.29Å; Y870-R873 VanDerWaalsContact CZ-NH2 3.29Å; Y870-R873 PolarHBondContact O-N 3.17Å; Y870-A874 PolarHBondContact O-N 3.2Å
871	A	96.1	Very high	93.3	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-54.5	-46.8	176.5	0	0	0	0	0	111.9	C839 P867 R873 A874 G875 S876 C879 A880 L883	C839-A871 HydrophobicContact CB-CB 4.13Å; C839-A871 WeakPolarHBondContact O-CA 3.44Å; P867-A871 PolarHBondContact O-N 2.95Å; A871-R873 PolarHBondContact O-N 3.24Å; A871-A874 CarbonylContact O-C 3.6Å; A871-A874 PolarHBondContact O-N 3.16Å; A871-G875 PolarHBondContact O-N 2.83Å; A871-S876 PolarHBondContact O-N 3.44Å; A871-C879 HydrophobicContact CB-CB 3.71Å; A871-A880 HydrophobicContact CB-CB 4.27Å; A871-L883 HydrophobicContact CB-CD1 4.27Å
872	R	94.8	Very high	93.4	Very high	114 Å²	114	49.2 Å²	49.2	43%	0.43	27%	0.266	S	S	.	.	H	α-helix	trans	-63.3	-35.6	175.6	-73.6	174.9	176.7	167.8	1.2	113.8	L868 Y870 G875 N890	L868-R872 HydrophobicContact CD1-CG 4.43Å; L868-R872 WeakPolarHBondContact O-CB 3.2Å; L868-R872 VanDerWaalsContact O-CG 3.31Å; L868-R872 WeakPolarHBondContact O-CG 3.3Å; L868-R872 PolarHBondContact O-N 3.19Å; L868-R872 VanDerWaalsContact O-N 3.09Å; Y870-R872 VanDerWaalsContact C-N 3.32Å; Y870-R872 PolarHBondContact O-N 2.85Å; R872-G875 PolarHBondContact O-N 2.92Å; R872-N890 VanDerWaalsContact CZ-OD1 3.27Å; R872-N890 PolarHBondContact NH1-OD1 2.77Å; R872-N890 PolarHBondContact NH2-OD1 3.38Å
873	R	94.4	Very high	93.6	Very high	151 Å²	151	46 Å²	46	57%	0.57	24%	0.239	S	C	*	.	H	α-helix	trans	-73.8	-31.3	176	178.5	170.9	56.8	-175.9	-9.3	112.4	S869 Y870 A871 G875	S869-R873 WeakPolarHBondContact O-CB 3.4Å; S869-R873 PolarHBondContact O-N 3.14Å; Y870-R873 VanDerWaalsContact CD1-NH2 3.29Å; Y870-R873 VanDerWaalsContact CZ-NH2 3.29Å; Y870-R873 PolarHBondContact O-N 3.17Å; A871-R873 PolarHBondContact O-N 3.24Å; R873-G875 VanDerWaalsContact C-N 3.29Å
874	A	94.8	Very high	93.8	Very high	45 Å²	45	42.9 Å²	42.9	37%	0.372	23%	0.232	S	C	.	.	H	α-helix	trans	-75.9	-18	171.8	0	0	0	0	0	112.8	C839 A842 Y870 A871	C839-A874 WeakPolarHBondContact O-CB 3.16Å; A842-A874 HydrophobicContact CB-CB 4.42Å; Y870-A874 PolarHBondContact O-N 3.2Å; A871-A874 CarbonylContact O-C 3.6Å; A871-A874 PolarHBondContact O-N 3.16Å
875	G	94.1	Very high	93.8	Very high	65 Å²	65	45.3 Å²	45.3	67%	0.67	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	83.2	7.8	-180	0	0	0	0	0	114.8	A871 R872 R873 Q877	A871-G875 PolarHBondContact O-N 2.83Å; R872-G875 PolarHBondContact O-N 2.92Å; R873-G875 VanDerWaalsContact C-N 3.29Å; G875-Q877 PolarHBondContact O-N 3.3Å
876	S	94.9	Very high	93.7	Very high	8 Å²	8	46.3 Å²	46.3	6%	0.056	24%	0.239	C	C	.	.			trans	-79.3	119.5	173.6	174.1	0	0	0	0	110.6	A871 E878 C879	A871-S876 PolarHBondContact O-N 3.44Å; S876-E878 PolarHBondContact OG-N 2.65Å; S876-E878 PolarHBondContact OG-OE2 2.83Å; S876-C879 PolarHBondContact OG-N 3.36Å
877	Q	92.4	Very high	93.3	Very high	112 Å²	112	48 Å²	48	52%	0.523	26%	0.257	S	S	.	.	H	α-helix	trans	-76.8	-35.3	173.3	-176.1	56.9	41.4	0	0	110.4	G875 A880 D881	G875-Q877 PolarHBondContact O-N 3.3Å; Q877-A880 WeakPolarHBondContact O-CB 3.42Å; Q877-A880 PolarHBondContact O-N 3.47Å; Q877-A880 VanDerWaalsContact O-N 3.16Å; Q877-D881 WeakPolarHBondContact CG-OD2 3.38Å; Q877-D881 PolarHBondContact NE2-OD1 3.32Å; Q877-D881 PolarHBondContact NE2-OD2 3.19Å; Q877-D881 WeakPolarHBondContact O-CB 3.3Å; Q877-D881 PolarHBondContact O-N 3.05Å
878	E	91.9	Very high	93	Very high	86 Å²	86	48.4 Å²	48.4	40%	0.402	26%	0.259	S	S	.	.	H	α-helix	trans	-64.1	-51	-178.1	-51.5	72.8	-161.1	0	0	111.1	V844 S876 A880 D881 I882	V844-E878 HydrophobicContact CG1-CB 4.1Å; V844-E878 HydrophobicContact CG2-CB 3.73Å; V844-E878 HydrophobicContact CG2-CG 4.32Å; S876-E878 PolarHBondContact OG-N 2.65Å; S876-E878 PolarHBondContact OG-OE2 2.83Å; E878-A880 VanDerWaalsContact C-N 3.26Å; E878-A880 PolarHBondContact O-N 3.31Å; E878-D881 PolarHBondContact O-N 2.92Å; E878-I882 WeakPolarHBondContact O-CD1 3.21Å; E878-I882 VanDerWaalsContact O-CG1 3.23Å; E878-I882 WeakPolarHBondContact O-CG1 3.32Å; E878-I882 PolarHBondContact O-N 2.94Å
879	C	94.6	Very high	92.5	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-60.4	-36.4	173.2	-75.8	0	0	0	0	111.7	T847 A871 S876 L883	T847-C879 PolarHBondContact OG1-SG 3.47Å; A871-C879 HydrophobicContact CB-CB 3.71Å; S876-C879 PolarHBondContact OG-N 3.36Å; C879-L883 WeakPolarHBondContact O-CB 3.43Å; C879-L883 WeakPolarHBondContact O-CD1 3.45Å; C879-L883 WeakPolarHBondContact O-CG 3.43Å; C879-L883 PolarHBondContact O-N 3.16Å
880	A	94.1	Very high	91.9	Very high	2 Å²	2	52.9 Å²	52.9	2%	0.017	28%	0.283	C	S	.	.	H	α-helix	trans	-68.5	-41.6	178.4	0	0	0	0	0	112.3	L868 A871 Q877 E878 L883 L884	L868-A880 HydrophobicContact CD1-CB 3.69Å; A871-A880 HydrophobicContact CB-CB 4.27Å; Q877-A880 WeakPolarHBondContact O-CB 3.42Å; Q877-A880 PolarHBondContact O-N 3.47Å; Q877-A880 VanDerWaalsContact O-N 3.16Å; E878-A880 VanDerWaalsContact C-N 3.26Å; E878-A880 PolarHBondContact O-N 3.31Å; A880-L883 PolarHBondContact O-N 3.28Å; A880-L884 WeakPolarHBondContact O-CB 3.32Å; A880-L884 VanDerWaalsContact O-CG 3.26Å; A880-L884 WeakPolarHBondContact O-CG 3.48Å; A880-L884 PolarHBondContact O-N 3.18Å
881	D	91.8	Very high	90.6	Very high	77 Å²	77	55.1 Å²	55.1	41%	0.412	30%	0.296	S	S	.	.	H	α-helix	trans	-72.2	-40.3	-179.5	-72.2	-29.1	0	0	0	112.2	Q877 E878 L883 L884 Q885	Q877-D881 WeakPolarHBondContact CG-OD2 3.38Å; Q877-D881 PolarHBondContact NE2-OD1 3.32Å; Q877-D881 PolarHBondContact NE2-OD2 3.19Å; Q877-D881 WeakPolarHBondContact O-CB 3.3Å; Q877-D881 PolarHBondContact O-N 3.05Å; E878-D881 PolarHBondContact O-N 2.92Å; D881-L883 VanDerWaalsContact C-N 3.33Å; D881-L883 PolarHBondContact O-N 3.02Å; D881-L884 PolarHBondContact O-N 3.33Å; D881-Q885 VanDerWaalsContact O-CB 3.27Å; D881-Q885 WeakPolarHBondContact O-CB 3.22Å; D881-Q885 PolarHBondContact O-N 2.83Å
882	I	93.2	Very high	88.5	Confident	4 Å²	4	60 Å²	60	2%	0.021	33%	0.33	C	S	.	.	H	α-helix	trans	-56.3	-47.9	170.8	-68.3	164.7	0	0	0	110.4	E734 V844 T847 Q848 I851 E878 L884 Q885 H886	E734-I882 HydrophobicContact CB-CD1 3.7Å; E734-I882 HydrophobicContact CB-CG1 4.09Å; E734-I882 HydrophobicContact CG-CD1 4.23Å; E734-I882 HydrophobicContact CG-CG1 4.09Å; V844-I882 HydrophobicContact CG1-CD1 3.6Å; T847-I882 HydrophobicContact CG2-CG2 4.45Å; Q848-I882 HydrophobicContact CB-CD1 4.46Å; I851-I882 HydrophobicContact CD1-CG2 3.61Å; E878-I882 WeakPolarHBondContact O-CD1 3.21Å; E878-I882 VanDerWaalsContact O-CG1 3.23Å; E878-I882 WeakPolarHBondContact O-CG1 3.32Å; E878-I882 PolarHBondContact O-N 2.94Å; I882-L884 PolarHBondContact O-N 2.96Å; I882-Q885 PolarHBondContact O-N 3.34Å; I882-H886 WeakPolarHBondContact O-CB 3.31Å; I882-H886 PolarHBondContact O-CD2 3.4Å; I882-H886 PolarHBondContact O-N 2.98Å
883	L	93.9	Very high	85.9	Confident	0 Å²	0	60 Å²	60	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-64.4	-40.5	179.4	-75.2	171.3	0	0	0	112.4	L835 I851 V857 P867 L868 A871 C879 A880 D881 H886 G887 C888	L835-L883 HydrophobicContact CD1-CD2 4.32Å; L835-L883 HydrophobicContact CD2-CD2 4.06Å; L835-L883 HydrophobicContact CG-CD2 4.33Å; I851-L883 HydrophobicContact CD1-CD2 4.07Å; V857-L883 HydrophobicContact CG1-CD2 4.01Å; P867-L883 HydrophobicContact CB-CD1 3.8Å; P867-L883 HydrophobicContact CB-CD2 3.99Å; L868-L883 HydrophobicContact CB-CD1 4.12Å; A871-L883 HydrophobicContact CB-CD1 4.27Å; C879-L883 WeakPolarHBondContact O-CB 3.43Å; C879-L883 WeakPolarHBondContact O-CD1 3.45Å; C879-L883 WeakPolarHBondContact O-CG 3.43Å; C879-L883 PolarHBondContact O-N 3.16Å; A880-L883 PolarHBondContact O-N 3.28Å; D881-L883 VanDerWaalsContact C-N 3.33Å; D881-L883 PolarHBondContact O-N 3.02Å; L883-H886 CarbonylContact O-C 3.59Å; L883-H886 PolarHBondContact O-N 2.96Å; L883-G887 PolarHBondContact O-N 2.84Å; L883-G887 VanDerWaalsContact O-N 3.1Å; L883-C888 HydrophobicContact CB-CB 3.84Å; L883-C888 WeakPolarHBondContact O-CB 3.27Å; L883-C888 PolarHBondContact O-N 2.62Å
884	L	92.5	Very high	83.1	Confident	64 Å²	64	57.3 Å²	57.3	34%	0.335	35%	0.352	S	S	.	.	H	α-helix	trans	-66.6	-43.6	176.3	-74.3	167.5	0	0	0	111.7	L868 A880 D881 I882 H886 G887 N890	L868-L884 HydrophobicContact CD1-CD1 4.44Å; L868-L884 HydrophobicContact CD1-CG 4.17Å; L868-L884 HydrophobicContact CD2-CD2 3.7Å; L868-L884 HydrophobicContact CD2-CG 4.13Å; A880-L884 WeakPolarHBondContact O-CB 3.32Å; A880-L884 VanDerWaalsContact O-CG 3.26Å; A880-L884 WeakPolarHBondContact O-CG 3.48Å; A880-L884 PolarHBondContact O-N 3.18Å; D881-L884 PolarHBondContact O-N 3.33Å; I882-L884 PolarHBondContact O-N 2.96Å; L884-H886 VanDerWaalsContact C-N 3.27Å; L884-H886 PolarHBondContact O-N 3.32Å; L884-G887 PolarHBondContact O-N 3.07Å; L884-N890 HydrophobicContact CD2-CB 4.31Å
885	Q	90.8	Very high	80.3	Confident	128 Å²	128	64.2 Å²	64.2	60%	0.598	38%	0.381	S	S	*	.	H	α-helix	trans	-58.5	-39	174.9	-173.6	-167.4	61.9	0	0	111.6	D881 I882 G887	D881-Q885 VanDerWaalsContact O-CB 3.27Å; D881-Q885 WeakPolarHBondContact O-CB 3.22Å; D881-Q885 PolarHBondContact O-N 2.83Å; I882-Q885 PolarHBondContact O-N 3.34Å; Q885-G887 VanDerWaalsContact C-N 3.32Å
886	H	89	Confident	77.3	Confident	76 Å²	76	66.7 Å²	66.7	35%	0.352	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.4	7.6	175.7	-76.5	-78.8	0	0	0	114.7	I851 V857 I882 L883 L884	I851-H886 HydrophobicContact CG2-CB 4.08Å; V857-H886 HydrophobicContact CG1-CB 4.28Å; V857-H886 HydrophobicContact CG2-CB 4.13Å; I882-H886 WeakPolarHBondContact O-CB 3.31Å; I882-H886 PolarHBondContact O-CD2 3.4Å; I882-H886 PolarHBondContact O-N 2.98Å; L883-H886 CarbonylContact O-C 3.59Å; L883-H886 PolarHBondContact O-N 2.96Å; L884-H886 VanDerWaalsContact C-N 3.27Å; L884-H886 PolarHBondContact O-N 3.32Å
887	G	87.7	Confident	74.3	Confident	38 Å²	38	71.8 Å²	71.8	39%	0.392	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.9	29.3	167.5	0	0	0	0	0	116.2	K858 L883 L884 Q885	K858-G887 VanDerWaalsContact CE-O 3.28Å; K858-G887 WeakPolarHBondContact CE-O 3.37Å; L883-G887 PolarHBondContact O-N 2.84Å; L883-G887 VanDerWaalsContact O-N 3.1Å; L884-G887 PolarHBondContact O-N 3.07Å; Q885-G887 VanDerWaalsContact C-N 3.32Å
888	C	88.3	Confident	71.4	Confident	7 Å²	7	73.3 Å²	73.3	5%	0.047	44%	0.441	C	S	.	.			trans	-64.7	133.5	170.1	-163.4	0	0	0	0	110.8	V857 L868 L883 N890	V857-C888 HydrophobicContact CG1-CB 3.55Å; V857-C888 PolarHBondContact O-SG 3.19Å; L868-C888 HydrophobicContact CB-CB 4.36Å; L868-C888 VanDerWaalsContact CB-SG 3.57Å; L883-C888 HydrophobicContact CB-CB 3.84Å; L883-C888 WeakPolarHBondContact O-CB 3.27Å; L883-C888 PolarHBondContact O-N 2.62Å; C888-N890 PolarHBondContact O-N 2.79Å
889	P	84.6	Confident	68.8	Low	44 Å²	44	75 Å²	75	29%	0.286	46%	0.459	S	S	.	.			trans	-67	128.5	179.7	25.6	-33.1	0	0	0	112	T866 D891	T866-P889 HydrophobicContact CG2-CG 4.06Å; P889-D891 PolarHBondContact O-N 2.78Å; P889-D891 VanDerWaalsContact O-N 3.15Å
890	N	81.6	Confident	65.8	Low	82 Å²	82	81.2 Å²	81.2	44%	0.439	50%	0.497	S	S	.	.			trans	-81.9	89.6	179	-175.7	18.1	0	0	0	111.1	L868 R872 L884 C888 S892	L868-N890 HydrophobicContact CD2-CB 4.46Å; R872-N890 VanDerWaalsContact CZ-OD1 3.27Å; R872-N890 PolarHBondContact NH1-OD1 2.77Å; R872-N890 PolarHBondContact NH2-OD1 3.38Å; L884-N890 HydrophobicContact CD2-CB 4.31Å; C888-N890 PolarHBondContact O-N 2.79Å; N890-S892 VanDerWaalsContact C-N 3.29Å; N890-S892 PolarHBondContact O-N 2.94Å
891	D	67	Low	62.5	Low	55 Å²	55	87 Å²	87	29%	0.294	54%	0.538	S	S	.	.			trans	-69.8	78.7	176.5	-63.2	-38.6	0	0	0	111.5	R860 T866 P889	R860-D891 IonicContact CZ-OD1 2.69Å; R860-D891 IonicContact CZ-OD2 3.21Å; R860-D891 IonicContact NH1-OD1 3.11Å; R860-D891 PolarHBondContact NH1-OD1 3.08Å; R860-D891 IonicContact NH1-OD2 3.79Å; R860-D891 PolarHBondContact NH1-OD2 2.87Å; R860-D891 IonicContact NH2-OD1 2.7Å; R860-D891 PolarHBondContact NH2-OD1 2.79Å; R860-D891 IonicContact NH2-OD2 3.61Å; R860-D891 PolarHBondContact NH2-OD2 3.3Å; T866-D891 VanDerWaalsContact CG2-OD2 3.31Å; T866-D891 WeakPolarHBondContact CG2-OD2 3.27Å; T866-D891 PolarHBondContact OG1-OD2 3.18Å; P889-D891 PolarHBondContact O-N 2.78Å; P889-D891 VanDerWaalsContact O-N 3.15Å
892	S	53.3	Low	59.4	Low	101 Å²	101	88.4 Å²	88.4	71%	0.706	55%	0.553	S	S	*	*			trans	-94.3	8	-178	58.9	0	0	0	0	114.7	N890	N890-S892 VanDerWaalsContact C-N 3.29Å; N890-S892 PolarHBondContact O-N 2.94Å
893	S	39.3	Very low	56.4	Low	115 Å²	115	95 Å²	95	80%	0.804	59%	0.594	S	S	*	*			trans	-126.3	54.6	-169.2	64.2	0	0	0	0	114.2
894	S	35.8	Very low	53.2	Low	95 Å²	95	100 Å²	100	66%	0.664	63%	0.628	S	S	*	*			trans	-149.5	43	176.4	53.4	0	0	0	0	114.8
895	L	36.5	Very low	50.2	Low	189 Å²	189	105 Å²	105	99%	0.99	66%	0.655	S	S	*	*			trans	-113.4	68.7	166.6	-78	172.9	0	0	0	111.5
896	S	29.9	Very low	47.1	Very low	117 Å²	117	111 Å²	111	82%	0.818	67%	0.672	S	S	*	*			trans	-104.1	130.6	165.4	49.6	0	0	0	0	110.1
897	S	31.3	Very low	44	Very low	116 Å²	116	114.9 Å²	114.9	81%	0.811	70%	0.695	S	S	*	*			trans	-91	146.1	-168.9	50.4	0	0	0	0	114.5
898	V	33.5	Very low	41.9	Very low	144 Å²	144	117.3 Å²	117.3	87%	0.873	70%	0.704	S	S	*	*			trans	-152.4	164.7	152.1	-106.8	0	0	0	0	108.7
899	P	36.2	Very low	38.9	Very low	121 Å²	121	123.9 Å²	123.9	79%	0.786	74%	0.739	S	S	*	*				-118.8	-171	-123.4	43.6	-34.4	0	0	0	116.6
900	T	32.6	Very low	36.2	Very low	130 Å²	130	130 Å²	130	80%	0.798	77%	0.767	S	S	*	*			trans	-61.4	151.6	-172.5	52.9	0	0	0	0	117.3
901	S	23.8	Very low	33.6	Very low	124 Å²	124	133.5 Å²	133.5	87%	0.867	79%	0.786	S	S	*	*			trans	-132.9	154.7	135.7	62.4	0	0	0	0	109.4
902	S	26.5	Very low	31.8	Very low	106 Å²	106	137.4 Å²	137.4	74%	0.741	81%	0.807	S	S	*	*			trans	-147.6	132.8	-164	49.7	0	0	0	0	113.8
903	V	30.2	Very low	30.7	Very low	144 Å²	144	138.8 Å²	138.8	87%	0.873	81%	0.806	S	S	*	*			trans	-144	117.4	166.5	-177	0	0	0	0	111.4
904	S	26.4	Very low	30.1	Very low	103 Å²	103	140.9 Å²	140.9	72%	0.72	81%	0.809	S	S	*	*			trans	39.6	101	150.1	-53.4	0	0	0	0	122.5
905	L	29.8	Very low	29.7	Very low	171 Å²	171	141.4 Å²	141.4	90%	0.895	82%	0.819	S	S	*	*				31.9	113.1	113.1	-74.8	158.3	0	0	0	119.5
906	R	24.9	Very low	29.2	Very low	254 Å²	254	141 Å²	141	96%	0.958	81%	0.812	S	S	*	*				-161.1	137.7	127.9	-114.1	174.9	-173.7	-172.8	2	113
907	N	25.4	Very low	29.1	Very low	156 Å²	156	141.1 Å²	141.1	83%	0.834	81%	0.811	S	S	*	*			trans	-162.3	162.5	169.5	-140.7	18.7	0	0	0	105.9
908	P	42.7	Very low	28.7	Very low	90 Å²	90	144.8 Å²	144.8	58%	0.584	82%	0.816	S	S	*	*			cis	-135.3	-170.9	4.5	44.2	-27	0	0	0	115.6
909	N	25.3	Very low	28.5	Very low	145 Å²	145	146.5 Å²	146.5	78%	0.775	82%	0.819	S	S	*	*			trans	73.5	115.5	157.4	-61.3	-11.8	0	0	0	119.8
910	I	27.4	Very low	28.1	Very low	171 Å²	171	148 Å²	148	88%	0.877	82%	0.821	S	S	*	*				-154.1	149.7	120.8	-101.8	157.5	0	0	0	108.1
911	N	28.8	Very low	27.9	Very low	156 Å²	156	152.9 Å²	152.9	83%	0.834	82%	0.824	S	S	*	*			trans	-86.2	162	179.2	-97.2	-10.9	0	0	0	112.6
912	N	28.9	Very low	28.1	Very low	138 Å²	138	152.2 Å²	152.2	74%	0.738	82%	0.819	S	S	*	*			trans	113.3	117.6	137.1	-151.7	35.8	0	0	0	118.4
913	N	28.5	Very low	28.1	Very low	129 Å²	129	153.9 Å²	153.9	69%	0.69	82%	0.818	S	S	*	*			trans	33.7	135	149.3	-61.6	-6.4	0	0	0	123.7
914	N	28.3	Very low	27.9	Very low	160 Å²	160	152 Å²	152	86%	0.856	81%	0.811	S	S	*	*			trans	60.4	106.5	147.2	-64.2	2.5	0	0	0	120.4
915	A	27.3	Very low	28.1	Very low	106 Å²	106	153.3 Å²	153.3	88%	0.876	81%	0.809	S	S	*	*			trans	-157.9	162.7	139.3	0	0	0	0	0	111
916	Q	26	Very low	28.1	Very low	179 Å²	179	157.1 Å²	157.1	84%	0.836	83%	0.826	S	S	*	*			trans	-94.1	164	175.9	-64.8	156.1	-92.3	0	0	111.5
917	C	26.9	Very low	28.3	Very low	120 Å²	120	152.3 Å²	152.3	81%	0.811	82%	0.819	S	S	*	*			trans	57.1	112.1	158	-62.9	0	0	0	0	118.9
918	E	24	Very low	28.4	Very low	194 Å²	194	152.1 Å²	152.1	91%	0.907	82%	0.818	S	S	*	*				-161.8	110.8	118.5	-116.9	-179.8	-152.7	0	0	111.5
919	L	29.5	Very low	27.6	Very low	179 Å²	179	155.6 Å²	155.6	94%	0.937	83%	0.831	S	S	*	*			trans	-144.1	42.1	166.1	-134.7	171.3	0	0	0	110.6
920	N	27.1	Very low	27.8	Very low	154 Å²	154	156.2 Å²	156.2	82%	0.824	83%	0.834	S	S	*	*			trans	-105	84.3	-175.3	-142	-1.8	0	0	0	109.8
921	R	29.1	Very low	27.8	Very low	232 Å²	232	155.3 Å²	155.3	88%	0.875	83%	0.832	S	S	*	*			trans	-144.7	79.2	168.5	-103.9	-177.2	-165.7	-161.2	3.9	112.1
922	S	27.2	Very low	27.7	Very low	109 Å²	109	155.2 Å²	155.2	76%	0.762	83%	0.832	S	S	*	*			trans	36.9	87.9	136.9	-49.8	0	0	0	0	117.3
923	I	27.2	Very low	27.6	Very low	141 Å²	141	156.4 Å²	156.4	72%	0.723	84%	0.838	S	S	*	*			trans	-100.7	112.6	145.3	-64.6	177.2	0	0	0	105.7
924	S	26.2	Very low	27.6	Very low	104 Å²	104	158.5 Å²	158.5	73%	0.727	85%	0.85	S	S	*	*			trans	-79.1	127.9	-179.4	-63.9	0	0	0	0	110.1
925	I	29.8	Very low	27.5	Very low	131 Å²	131	158.4 Å²	158.4	67%	0.672	85%	0.849	S	S	*	*			trans	-77.7	130.3	170.8	-59.3	170.8	0	0	0	109.2
926	M	30.1	Very low	27.5	Very low	252 Å²	252	163.2 Å²	163.2	100%	1.241	85%	0.847	S	S	*	*			trans	-131	0	146.5	-79.4	-168.3	173.4	0	0	108

Retrieved 926 of 926 residues in 172.5 ms (Link to these results)

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