DHX30_MOUSE Loading...

Isoform 2 of ATP-dependent RNA helicase DHX30 AlphaSync

Canonical isoform description: RNA-dependent helicase¹. Plays an important role in the assembly of the mitochondrial large ribosomal subunit (By similarity). Required for optimal function of the zinc-finger antiviral protein ZC3HAV1 (By similarity). Associates with mitochondrial DNA (By similarity). Involved in nervous system development and differentiation through its involvement in the up-regulation of a number of genes which are required for neurogenesis, including GSC, NCAM1, neurogenin, and NEUROD².

AlphaFold DB , UniProt , Accession Q99PU8-2 (canonical: Q99PU8), Species MOUSE (Mus musculus, Mouse), Gene Dhx30, Length 1,194 aa.

						>DHX30_MOUSE|Q99PU8-2|Dhx30
MFSLDSFRKDRTQHRQRQCKLPPPRLPPMCVNPAPGGTITRASRDLLKEFPQPKNLLNSVIGRALGISHAKDKLVYVHTNGPKKKKVTLHIKWPKSVEVEGYGSKKIDAERQAAAAACQLFKGWGLLGPRNELFDAAKYRVLADRFGSPADSWWRPEPTMPPTSWRQLNPENIRPGGPAGLSRSLGREEEEDEEEELEEGTIDVTEFLSMTQQDSHNPLRDSRGGSFEMTDDDSAIRALTQFPLPKNLLAKVIQIATSSSTAKNLMQFHTVGTKTKLATLTLLWPCPMTFVAKGRRKAEAENKAAALACKKLKSLGLVDRNNEPLTHAMYNLASLRELGETQRRPCTIQVPEPILRKIEAFLSHYPVDSSWISPELRLQSDDILPLGKDSGPLSDPITGKPYMPLSEAEEVRLSQSLLELWRRRGPIWQEAPQLPVDPHRDTILSAIEQHPVVVISGDTGCGKTTRIPQLLLERYVTEGRGARCNVIITQPRRISAVSVAQRVSHELGPSLRRNVGFQVRLESKPPARGGALLFCTVGILLRKLQSNPSLEGVSHVIVDEVHERDVNTDFLLILLKGLQRLNPALRLVLMSATGDNERFSRYFGGCPVIKVPGFMYPVKEHYLEDILAKLGKHQYPHRHRHHESEDECALDLDLVTDLVLHIDARGEPGGILCFLPGWQEIKGVQQRLQEALGMHESKYLILPVHSNIPMMDQKAIFQQPPLGVRKIVLATNIAETSITVNDIVHVVDSGLHKEERYDLKTKVSCLETVWVSRANVIQRRGRAGRCQSGFAYHLFPRSRLEKMVPFQVPEILRTPLENLVLQAKIHMPEKTAVEFLSKAVDSPNIKAVDEAVILLQEIGVLDQREYLTTLGQRLAHISTDPRLAKAIVLAAIFRCLHPLLVVVSCLTRDPFSSSLQNRAEVDKVKALLSHDSGSDHLAFVRAVAGWEEVLRWQDRTSRENYLEENLLYAPSLRFIHGLIKQFSENIYEAFLVGKPSDCTLPSAQCNEYSEEEELVKGVLMAGLYPNLIQVRQGKVTRQGKFKPNSVTYRTKSGNILLHKSTINREATRLRSRWLTYFMAVKSNGSVFVRDSSQVHPLAVLLLTDGDVHIRDDGRRATISLSDSDLLRLEGDSRTVRLLREFRRALGRMVERSLRSELAALPLSVQQEHGQLLALLAELLRGPCGSFDMRKTADD
					

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	27	Very low	28.1	Very low	237 Å²	237	182.7 Å²	182.7	100%	1.167	88%	0.875	S	S	*	*				0	141.7	0	-116.2	178.5	178.6	0	0	107.3
2	F	30.3	Very low	27.9	Very low	204 Å²	204	179.6 Å²	179.6	90%	0.895	88%	0.876	S	S	*	*			trans	97	65.9	-164.1	-57.9	-64.9	0	0	0	114.2
3	S	28.5	Very low	27.9	Very low	105 Å²	105	179.6 Å²	179.6	73%	0.734	87%	0.873	S	S	*	*			trans	-79.5	122.5	154.6	172.7	0	0	0	0	107.7
4	L	32.9	Very low	27.9	Very low	171 Å²	171	180.4 Å²	180.4	90%	0.895	87%	0.874	S	S	*	*			trans	-116.8	65.1	172.8	-85.2	163.9	0	0	0	108.6
5	D	27.6	Very low	27.9	Very low	142 Å²	142	183.5 Å²	183.5	76%	0.759	87%	0.873	S	S	*	*			trans	-102.9	120.4	158.6	-94.9	-31.8	0	0	0	108.5
6	S	28.9	Very low	27.8	Very low	108 Å²	108	183.8 Å²	183.8	76%	0.755	87%	0.873	S	S	*	*			trans	143.2	69.4	149.8	61.2	0	0	0	0	114
7	F	27.8	Very low	27.9	Very low	224 Å²	224	185.8 Å²	185.8	98%	0.982	87%	0.87	S	S	*	*			trans	-137.8	71.8	150	-95.1	-81.2	0	0	0	110.1
8	R	24	Very low	27.9	Very low	247 Å²	247	186.3 Å²	186.3	93%	0.932	87%	0.872	S	S	*	*			trans	-121.1	103	158.7	-93.9	-175.4	175	176	-0.1	107.5
9	K	27.9	Very low	27.8	Very low	195 Å²	195	183.1 Å²	183.1	85%	0.848	87%	0.871	S	S	*	*			trans	-162.5	113.4	153.6	-110.1	172.7	-172.8	-178.2	0	110.5
10	D	26.6	Very low	27.8	Very low	145 Å²	145	184.1 Å²	184.1	78%	0.775	87%	0.872	S	S	*	*			trans	36	116.5	145.1	-62.4	-30.6	0	0	0	119.7
11	R	27.9	Very low	27.8	Very low	232 Å²	232	183.4 Å²	183.4	88%	0.875	87%	0.872	S	S	*	*				-174.5	110.8	106.4	-98.1	165.9	-178.9	-167	0.4	111.2	Q13	R11-Q13 PolarHBondContact O-N 3.44Å
12	T	25.2	Very low	27.8	Very low	145 Å²	145	177.3 Å²	177.3	89%	0.89	85%	0.85	S	S	*	*			trans	-46.4	111.4	154.8	41.5	0	0	0	0	110.9
13	Q	28.3	Very low	27.7	Very low	180 Å²	180	172.9 Å²	172.9	84%	0.841	84%	0.842	S	S	*	*			trans	-116.9	126.2	164.7	-91.2	-173.4	-8.5	0	0	110.6	R11 R15	R11-Q13 PolarHBondContact O-N 3.44Å; Q13-R15 PolarHBondContact O-N 3.5Å
14	H	27.3	Very low	27.7	Very low	190 Å²	190	174.1 Å²	174.1	88%	0.88	85%	0.848	S	S	*	*			trans	-44	116.5	177.6	-75.8	-67.3	0	0	0	113.8
15	R	28.5	Very low	27.5	Very low	228 Å²	228	177.6 Å²	177.6	86%	0.86	85%	0.849	S	S	*	*			trans	-105	90.7	155.2	-83.9	-176.4	169.9	-178.2	-2.9	108.8	Q13 R17	Q13-R15 PolarHBondContact O-N 3.5Å; R15-R17 PolarHBondContact O-N 2.75Å; R15-R17 VanDerWaalsContact O-N 3.08Å
16	Q	26.8	Very low	27.4	Very low	188 Å²	188	178.7 Å²	178.7	88%	0.879	85%	0.854	S	S	*	*			trans	-60.2	103.1	161.7	-79.5	176.1	-20.3	0	0	108.3
17	R	29.5	Very low	27.3	Very low	217 Å²	217	178.9 Å²	178.9	82%	0.819	85%	0.853	S	S	*	*			trans	-90.8	112.5	165.8	-81.5	-175.7	169.7	-173.8	-2.4	107.8	R15 C19	R15-R17 PolarHBondContact O-N 2.75Å; R15-R17 VanDerWaalsContact O-N 3.08Å; R17-C19 PolarHBondContact O-N 3.26Å; R17-C19 VanDerWaalsContact O-N 3.1Å
18	Q	26.9	Very low	27.3	Very low	195 Å²	195	173.1 Å²	173.1	91%	0.911	84%	0.838	S	S	*	*			trans	-53.1	110.1	170.1	-74.8	172	-16.7	0	0	110	K20	Q18-K20 PolarHBondContact O-N 3.21Å
19	C	26.4	Very low	27.3	Very low	125 Å²	125	170.5 Å²	170.5	85%	0.845	84%	0.838	S	S	*	*			trans	-70.8	109.9	169.3	-73.1	0	0	0	0	108.9	R17 L21	R17-C19 PolarHBondContact O-N 3.26Å; R17-C19 VanDerWaalsContact O-N 3.1Å; C19-L21 PolarHBondContact O-N 2.76Å
20	K	28.3	Very low	27.2	Very low	204 Å²	204	165.8 Å²	165.8	89%	0.887	83%	0.829	S	S	*	*			trans	-63.1	114.6	166.1	-77	-177.8	175.1	-179	0	108.6	Q18	Q18-K20 PolarHBondContact O-N 3.21Å
21	L	26.6	Very low	27.2	Very low	169 Å²	169	165.5 Å²	165.5	89%	0.885	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-59.1	126.8	174.4	-83.6	148.7	0	0	0	110.2	C19	C19-L21 PolarHBondContact O-N 2.76Å
22	P	28.8	Very low	27	Very low	109 Å²	109	161.1 Å²	161.1	71%	0.708	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-74.4	153.8	174.4	29.4	-31.3	0	0	0	111.3
23	P	27.9	Very low	27.2	Very low	112 Å²	112	159.7 Å²	159.7	73%	0.727	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-67.3	154.2	-173.3	27.5	-33.7	0	0	0	112.7	R25	P23-R25 PolarHBondContact O-N 2.94Å
24	P	28.1	Very low	27.1	Very low	131 Å²	131	155.4 Å²	155.4	85%	0.851	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-67.7	128.3	-167.4	26.2	-32.7	0	0	0	112.1
25	R	28.1	Very low	27.2	Very low	244 Å²	244	152.9 Å²	152.9	92%	0.921	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-74.3	125	176.2	-69.4	-179.8	178.5	-174	-1.2	109.9	P23	P23-R25 PolarHBondContact O-N 2.94Å
26	L	26.2	Very low	27.1	Very low	164 Å²	164	146 Å²	146	86%	0.859	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-61	137.7	165.4	-79	157.6	0	0	0	109.8
27	P	26.3	Very low	27.1	Very low	113 Å²	113	139.9 Å²	139.9	73%	0.734	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-71.4	134.9	-174.6	27.3	-31	0	0	0	111
28	P	27.9	Very low	27.1	Very low	103 Å²	103	136 Å²	136	67%	0.669	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-74.1	136.2	-176.7	29.3	-32.1	0	0	0	111	C30	P28-C30 PolarHBondContact O-N 3.4Å
29	M	24.2	Very low	27.2	Very low	191 Å²	191	133.4 Å²	133.4	94%	0.941	79%	0.794	S	S	*	*			trans	-66.6	97.9	171.6	-71.1	-167.6	80.5	0	0	109.9	V31	M29-V31 PolarHBondContact O-N 2.86Å
30	C	25.1	Very low	28.1	Very low	96 Å²	96	132.2 Å²	132.2	65%	0.649	78%	0.783	S	S	*	*			trans	-72.4	108.7	167.8	-71.3	0	0	0	0	109.3	P28 N32	P28-C30 PolarHBondContact O-N 3.4Å; C30-N32 VanDerWaalsContact C-N 3.27Å; C30-N32 PolarHBondContact O-N 3.22Å
31	V	26.3	Very low	28.5	Very low	139 Å²	139	132.6 Å²	132.6	84%	0.842	78%	0.779	S	S	*	*			trans	-72.3	90.7	160.9	-178.3	0	0	0	0	106.4	M29 P33	M29-V31 PolarHBondContact O-N 2.86Å; V31-P33 VanDerWaalsContact O-CD 3.31Å; V31-P33 WeakPolarHBondContact O-CD 3.44Å
32	N	25	Very low	29.4	Very low	140 Å²	140	128.2 Å²	128.2	75%	0.749	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-66.1	117.6	174.9	-84.4	-20.1	0	0	0	109.2	C30	C30-N32 VanDerWaalsContact C-N 3.27Å; C30-N32 PolarHBondContact O-N 3.22Å
33	P	27.9	Very low	30.3	Very low	115 Å²	115	125.1 Å²	125.1	75%	0.747	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-73.6	133	170.4	25.6	-20.3	0	0	0	108.7	V31	V31-P33 VanDerWaalsContact O-CD 3.31Å; V31-P33 WeakPolarHBondContact O-CD 3.44Å
34	A	26.9	Very low	31.2	Very low	91 Å²	91	125.9 Å²	125.9	75%	0.752	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-50.3	133.1	-178.6	0	0	0	0	0	111.7	G36	A34-G36 PolarHBondContact O-N 3.17Å
35	P	29.1	Very low	32.9	Very low	136 Å²	136	123.5 Å²	123.5	88%	0.883	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.7	123.2	-176.1	29	-30.5	0	0	0	109.7
36	G	26.7	Very low	35.3	Very low	85 Å²	85	113 Å²	113	88%	0.876	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	124	7	165.9	0	0	0	0	0	117.5	A34	A34-G36 PolarHBondContact O-N 3.17Å
37	G	26.8	Very low	37.8	Very low	59 Å²	59	107.7 Å²	107.7	61%	0.608	65%	0.651	S	S	*	*	S	Bend	trans	-106.8	122.7	174.1	0	0	0	0	0	112.9	I39	G37-I39 PolarHBondContact O-N 3.48Å; G37-I39 VanDerWaalsContact O-N 3.11Å
38	T	29.8	Very low	40.2	Very low	134 Å²	134	108.7 Å²	108.7	82%	0.822	64%	0.644	S	S	*	*			trans	-44.6	108	178.8	-19.2	0	0	0	0	113.2	T40	T38-T40 PolarHBondContact O-N 3.43Å
39	I	29.9	Very low	42.8	Very low	142 Å²	142	107.3 Å²	107.3	73%	0.728	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.8	85	176.6	-56.3	170.2	0	0	0	109.3	G37	G37-I39 PolarHBondContact O-N 3.48Å; G37-I39 VanDerWaalsContact O-N 3.11Å
40	T	45.2	Very low	45.8	Very low	100 Å²	100	98.2 Å²	98.2	61%	0.613	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-147.4	-20.8	166.2	46.9	0	0	0	0	116.1	T38	T38-T40 PolarHBondContact O-N 3.43Å
41	R	36.1	Very low	48.5	Very low	212 Å²	212	97.3 Å²	97.3	80%	0.8	58%	0.576	S	S	*	*	S	Bend	trans	-86.2	-53.9	-179.7	-117.1	176.2	176	174.3	-1.9	113.4	S43 R44 D45	R41-S43 VanDerWaalsContact C-N 3.3Å; R41-S43 PolarHBondContact O-N 2.9Å; R41-S43 VanDerWaalsContact O-N 3.17Å; R41-R44 PolarHBondContact O-N 3.12Å; R41-D45 PolarHBondContact O-N 3.46Å
42	A	44.4	Very low	51.3	Low	76 Å²	76	95.4 Å²	95.4	63%	0.628	56%	0.558	S	S	*	*	H	α-helix	trans	-59	-35.4	-173.7	0	0	0	0	0	114.3
43	S	48.6	Very low	54.4	Low	45 Å²	45	88.9 Å²	88.9	32%	0.315	52%	0.523	S	S	.	.	H	α-helix	trans	-76.3	-30.3	-175.6	-36.6	0	0	0	0	114.1	R41	R41-S43 VanDerWaalsContact C-N 3.3Å; R41-S43 PolarHBondContact O-N 2.9Å; R41-S43 VanDerWaalsContact O-N 3.17Å
44	R	47.4	Very low	57.5	Low	128 Å²	128	86 Å²	86	48%	0.483	50%	0.499	S	S	.	.	H	α-helix	trans	-78.3	-24.9	177	-87	179.8	171.1	-162.7	-10.4	112.1	R41 L46 S184 L185	R41-R44 PolarHBondContact O-N 3.12Å; R44-L46 VanDerWaalsContact C-N 3.35Å; R44-S184 PolarHBondContact NH2-OG 3.06Å; R44-L185 PolarHBondContact NH1-O 3.28Å; R44-L185 PolarHBondContact NH2-O 2.81Å
45	D	63.3	Low	60.3	Low	80 Å²	80	85.5 Å²	85.5	43%	0.428	48%	0.484	S	S	.	.	H	α-helix	trans	-72.4	-29.1	179.6	-68	-27.5	0	0	0	112.1	R41 L47 K48 E49	R41-D45 PolarHBondContact O-N 3.46Å; D45-L47 PolarHBondContact O-N 3.03Å; D45-K48 PolarHBondContact O-N 3.12Å; D45-E49 PolarHBondContact O-N 3.48Å
46	L	78	Confident	63.1	Low	24 Å²	24	80.3 Å²	80.3	13%	0.126	45%	0.449	C	S	.	.	H	α-helix	trans	-66.4	-38.4	179	-62.8	179.8	0	0	0	114.2	R44 K48 E49 F50 A115 A116 Q119	R44-L46 VanDerWaalsContact C-N 3.35Å; L46-K48 VanDerWaalsContact C-N 3.28Å; L46-K48 PolarHBondContact O-N 3.42Å; L46-E49 PolarHBondContact O-N 3.28Å; L46-F50 WeakPolarHBondContact O-CD2 3.48Å; L46-F50 PolarHBondContact O-N 3.49Å; L46-A115 HydrophobicContact CB-CB 4.11Å; L46-A116 HydrophobicContact CD1-CB 4.26Å; L46-Q119 HydrophobicContact CD2-CB 4.12Å; L46-Q119 HydrophobicContact CD2-CG 4Å; L46-Q119 VanDerWaalsContact CD2-OE1 3.24Å
47	L	78.7	Confident	66.1	Low	53 Å²	53	76.3 Å²	76.3	28%	0.277	41%	0.407	S	S	.	.	H	α-helix	trans	-74	-22.1	177.3	-76.1	170.5	0	0	0	112.4	D45 F50 P51 P53 R111 Q112 A115	D45-L47 PolarHBondContact O-N 3.03Å; L47-F50 CarbonylContact O-C 3.54Å; L47-P51 WeakPolarHBondContact O-CA 3.38Å; L47-P53 HydrophobicContact CD2-CG 4.11Å; L47-R111 HydrophobicContact CD2-CB 4.1Å; L47-Q112 HydrophobicContact CD1-CG 4.07Å; L47-A115 HydrophobicContact CD2-CB 3.93Å; L47-A115 HydrophobicContact CG-CB 4.36Å
48	K	77.6	Confident	69	Low	134 Å²	134	76.5 Å²	76.5	58%	0.583	39%	0.394	S	S	*	.	H	α-helix	trans	-74.1	-39.1	168.9	-68.4	-178.3	-177.2	176.8	0	111.3	D45 L46	D45-K48 PolarHBondContact O-N 3.12Å; L46-K48 VanDerWaalsContact C-N 3.28Å; L46-K48 PolarHBondContact O-N 3.42Å
49	E	81.4	Confident	71.8	Confident	74 Å²	74	72.7 Å²	72.7	35%	0.346	37%	0.373	S	S	.	.	H	α-helix	trans	-70.4	-36.4	176.5	-168.9	176.4	-178.7	0	0	111.7	D45 L46 P51 K122 N131	D45-E49 PolarHBondContact O-N 3.48Å; L46-E49 PolarHBondContact O-N 3.28Å; E49-P51 WeakPolarHBondContact O-CD 3.4Å; E49-K122 WeakPolarHBondContact OE1-CD 3.34Å; E49-K122 IonicContact OE1-NZ 3.71Å; E49-K122 PolarHBondContact OE1-NZ 3.19Å; E49-N131 PolarHBondContact O-ND2 3.42Å
50	F	88.1	Confident	74.5	Confident	0 Å²	0	66 Å²	66	0%	0	34%	0.338	C	S	.	.			trans	-124.9	81.1	-179.7	-52.4	-75.6	0	0	0	110.3	L46 L47 Q52 P53 L56 A115 C118 Q119 K122 L127 N131	L46-F50 WeakPolarHBondContact O-CD2 3.48Å; L46-F50 PolarHBondContact O-N 3.49Å; L47-F50 CarbonylContact O-C 3.54Å; F50-Q52 VanDerWaalsContact C-N 3.34Å; F50-Q52 PolarHBondContact O-N 2.87Å; F50-P53 HydrophobicContact CB-CB 4.12Å; F50-P53 VanDerWaalsContact O-CD 3.3Å; F50-P53 WeakPolarHBondContact O-CD 3.42Å; F50-L56 HydrophobicContact CD1-CD2 3.69Å; F50-L56 HydrophobicContact CE1-CD2 4.25Å; F50-A115 HydrophobicContact CB-CB 4.48Å; F50-C118 HydrophobicContact CB-CB 4.24Å; F50-C118 HydrophobicContact CD1-CB 3.47Å; F50-C118 VanDerWaalsContact CD1-CB 3.47Å; F50-C118 HydrophobicContact CD2-CB 3.89Å; F50-C118 HydrophobicContact CE1-CB 3.65Å; F50-C118 HydrophobicContact CE2-CB 4.09Å; F50-C118 HydrophobicContact CG-CB 3.58Å; F50-C118 HydrophobicContact CZ-CB 3.97Å; F50-Q119 HydrophobicContact CE2-CB 3.95Å; F50-Q119 HydrophobicContact CZ-CB 4.43Å; F50-K122 HydrophobicContact CE1-CD 4.27Å; F50-K122 HydrophobicContact CZ-CB 4.34Å; F50-K122 HydrophobicContact CZ-CD 3.9Å; F50-L127 HydrophobicContact CE1-CD1 4.22Å; F50-N131 HydrophobicContact CE1-CB 4.48Å; F50-N131 WeakPolarHBondContact CE1-OD1 3.41Å
51	P	81.1	Confident	76.4	Confident	76 Å²	76	61.2 Å²	61.2	49%	0.494	31%	0.309	S	S	.	.	S	Bend	trans	-64.1	-36.7	-175.3	20.9	-30.5	0	0	0	113.1	L47 E49 P53 R111	L47-P51 WeakPolarHBondContact O-CA 3.38Å; E49-P51 WeakPolarHBondContact O-CD 3.4Å; P51-P53 VanDerWaalsContact C-CD 3.48Å; P51-P53 VanDerWaalsContact O-CD 3.29Å; P51-P53 WeakPolarHBondContact O-CD 3.24Å; P51-R111 PolarHBondContact O-NH2 3.24Å
52	Q	86.3	Confident	78.5	Confident	100 Å²	100	51.6 Å²	51.6	47%	0.467	28%	0.276	S	S	.	.	S	Bend	trans	-118.6	68.6	177.2	-65.8	-171.8	-17.1	0	0	111.8	F50 K54 N55 L56	F50-Q52 VanDerWaalsContact C-N 3.34Å; F50-Q52 PolarHBondContact O-N 2.87Å; Q52-K54 PolarHBondContact O-N 2.97Å; Q52-N55 HydrophobicContact CB-CB 4.3Å; Q52-N55 PolarHBondContact O-N 2.77Å; Q52-L56 WeakPolarHBondContact O-CB 3.42Å; Q52-L56 PolarHBondContact O-N 2.97Å
53	P	90.2	Very high	80.4	Confident	2 Å²	2	54.1 Å²	54.1	1%	0.013	27%	0.269	C	S	.	.	H	α-helix	trans	-71.8	-32.7	-167	29	-33.6	0	0	0	113.1	L47 F50 P51 L56 L57 R111 A114 A115 C118	L47-P53 HydrophobicContact CD2-CG 4.11Å; F50-P53 HydrophobicContact CB-CB 4.12Å; F50-P53 VanDerWaalsContact O-CD 3.3Å; F50-P53 WeakPolarHBondContact O-CD 3.42Å; P51-P53 VanDerWaalsContact C-CD 3.48Å; P51-P53 VanDerWaalsContact O-CD 3.29Å; P51-P53 WeakPolarHBondContact O-CD 3.24Å; P53-L56 PolarHBondContact O-N 3.49Å; P53-L57 WeakPolarHBondContact O-CG 3.42Å; P53-L57 PolarHBondContact O-N 3.4Å; P53-R111 HydrophobicContact CG-CB 4.41Å; P53-R111 WeakPolarHBondContact CG-O 3.28Å; P53-A114 HydrophobicContact CB-CB 3.82Å; P53-A114 HydrophobicContact CG-CB 4.01Å; P53-A115 HydrophobicContact CB-CB 3.94Å; P53-A115 HydrophobicContact CG-CB 4.15Å; P53-C118 PolarHBondContact O-SG 3.01Å; P53-C118 VanDerWaalsContact O-SG 3.36Å
54	K	91.5	Very high	81.9	Confident	56 Å²	56	52.6 Å²	52.6	24%	0.243	26%	0.259	C	S	.	.	H	α-helix	trans	-67.4	-42	178.4	-58.7	-176.4	83	-174.1	0	111.2	Q52 N58 E110 R111 A114	Q52-K54 PolarHBondContact O-N 2.97Å; K54-N58 WeakPolarHBondContact O-CB 3.26Å; K54-N58 PolarHBondContact O-N 2.93Å; K54-N58 PolarHBondContact O-ND2 3.18Å; K54-E110 IonicContact NZ-OE2 2.81Å; K54-E110 PolarHBondContact NZ-OE2 3.11Å; K54-R111 HydrophobicContact CD-CG 4.45Å; K54-A114 HydrophobicContact CG-CB 3.7Å
55	N	86.4	Confident	83.5	Confident	79 Å²	79	49.6 Å²	49.6	42%	0.422	25%	0.253	S	S	.	.	H	α-helix	trans	-67.6	-41.1	176.8	-67.9	-6.4	0	0	0	111	Q52 N58 S59	Q52-N55 HydrophobicContact CB-CB 4.3Å; Q52-N55 PolarHBondContact O-N 2.77Å; N55-N58 PolarHBondContact O-N 3.24Å; N55-S59 VanDerWaalsContact O-CB 3.29Å; N55-S59 WeakPolarHBondContact O-CB 3.12Å; N55-S59 PolarHBondContact O-N 3.28Å; N55-S59 PolarHBondContact O-OG 2.91Å
56	L	88.4	Confident	84.1	Confident	28 Å²	28	48.4 Å²	48.4	15%	0.147	26%	0.259	C	S	.	.	H	α-helix	trans	-62.5	-46.9	177.8	-170.4	63.7	0	0	0	111.7	F50 Q52 P53 S59 V60 C118 L127 N131 L133	F50-L56 HydrophobicContact CD1-CD2 3.69Å; F50-L56 HydrophobicContact CE1-CD2 4.25Å; Q52-L56 WeakPolarHBondContact O-CB 3.42Å; Q52-L56 PolarHBondContact O-N 2.97Å; P53-L56 PolarHBondContact O-N 3.49Å; L56-S59 PolarHBondContact O-N 2.92Å; L56-V60 WeakPolarHBondContact O-CG2 3.32Å; L56-V60 PolarHBondContact O-N 2.81Å; L56-C118 HydrophobicContact CD2-CB 4.38Å; L56-L127 HydrophobicContact CD1-CD2 3.85Å; L56-L127 HydrophobicContact CD2-CD1 3.85Å; L56-L127 HydrophobicContact CD2-CD2 4.08Å; L56-L127 HydrophobicContact CG-CD1 4.33Å; L56-L127 HydrophobicContact CG-CD2 4Å; L56-N131 HydrophobicContact CD2-CB 4.06Å; L56-L133 HydrophobicContact CD1-CD2 4Å
57	L	89.5	Confident	83.9	Confident	1 Å²	1	50.4 Å²	50.4	1%	0.005	27%	0.269	C	S	.	.	H	α-helix	trans	-60.6	-47.1	174.9	-74.6	172.3	0	0	0	112.6	P53 S59 V60 I61 L74 L89 A114 A117 F121	P53-L57 WeakPolarHBondContact O-CG 3.42Å; P53-L57 PolarHBondContact O-N 3.4Å; L57-S59 VanDerWaalsContact C-N 3.26Å; L57-S59 PolarHBondContact O-N 3.15Å; L57-V60 PolarHBondContact O-N 3.08Å; L57-I61 WeakPolarHBondContact O-CG1 3.5Å; L57-I61 PolarHBondContact O-N 2.8Å; L57-L74 HydrophobicContact CB-CD1 3.84Å; L57-L74 HydrophobicContact CD1-CD2 4.36Å; L57-L89 HydrophobicContact CD1-CD2 3.91Å; L57-A114 HydrophobicContact CD1-CB 3.83Å; L57-A117 HydrophobicContact CD1-CB 3.76Å; L57-A117 HydrophobicContact CD2-CB 4.04Å; L57-A117 HydrophobicContact CG-CB 4.49Å; L57-F121 HydrophobicContact CD2-CD1 4.46Å; L57-F121 HydrophobicContact CD2-CD2 3.83Å; L57-F121 HydrophobicContact CD2-CE1 4.37Å; L57-F121 HydrophobicContact CD2-CE2 3.74Å; L57-F121 HydrophobicContact CD2-CG 4.22Å; L57-F121 HydrophobicContact CD2-CZ 4.04Å
58	N	87.6	Confident	83.3	Confident	63 Å²	63	53 Å²	53	34%	0.337	29%	0.291	S	S	.	.	H	α-helix	trans	-59.2	-40.2	176.8	-87.9	-48.2	0	0	0	111.3	K54 N55 G62 A70	K54-N58 WeakPolarHBondContact O-CB 3.26Å; K54-N58 PolarHBondContact O-N 2.93Å; K54-N58 PolarHBondContact O-ND2 3.18Å; N55-N58 PolarHBondContact O-N 3.24Å; N58-G62 WeakPolarHBondContact O-CA 3.29Å; N58-G62 PolarHBondContact O-N 2.9Å; N58-A70 WeakPolarHBondContact OD1-CB 3.2Å
59	S	87.9	Confident	82.5	Confident	54 Å²	54	53.1 Å²	53.1	38%	0.378	29%	0.294	S	S	.	.	H	α-helix	trans	-69.3	-43.2	179.7	-60	0	0	0	0	112.2	N55 L56 L57 R63	N55-S59 VanDerWaalsContact O-CB 3.29Å; N55-S59 WeakPolarHBondContact O-CB 3.12Å; N55-S59 PolarHBondContact O-N 3.28Å; N55-S59 PolarHBondContact O-OG 2.91Å; L56-S59 PolarHBondContact O-N 2.92Å; L57-S59 VanDerWaalsContact C-N 3.26Å; L57-S59 PolarHBondContact O-N 3.15Å; S59-R63 WeakPolarHBondContact O-CB 3.38Å; S59-R63 PolarHBondContact O-N 3.13Å
60	V	86.5	Confident	81.9	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-60.8	-52.5	175.4	173.8	0	0	0	0	110.2	L56 L57 R63 A64 W93 F121 L127 L133 Y139	L56-V60 WeakPolarHBondContact O-CG2 3.32Å; L56-V60 PolarHBondContact O-N 2.81Å; L57-V60 PolarHBondContact O-N 3.08Å; V60-R63 PolarHBondContact O-N 2.9Å; V60-A64 WeakPolarHBondContact O-CB 3.38Å; V60-A64 PolarHBondContact O-N 2.77Å; V60-W93 HydrophobicContact CG1-CZ3 4.1Å; V60-F121 HydrophobicContact CB-CD2 4.12Å; V60-F121 HydrophobicContact CB-CE2 4.18Å; V60-F121 HydrophobicContact CG1-CD2 3.7Å; V60-F121 HydrophobicContact CG1-CE2 3.75Å; V60-F121 HydrophobicContact CG2-CD2 4.38Å; V60-L127 HydrophobicContact CG2-CD2 3.54Å; V60-L127 HydrophobicContact CG2-CG 4.11Å; V60-L133 HydrophobicContact CB-CD2 4.31Å; V60-L133 HydrophobicContact CG2-CD2 3.36Å; V60-Y139 HydrophobicContact CG1-CE1 3.8Å
61	I	85.4	Confident	81	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-68.2	-42.6	-176.5	-63.7	177.1	0	0	0	110.8	L57 R63 A64 L65 I67 A70 K73 L74 I91 W93 F121	L57-I61 WeakPolarHBondContact O-CG1 3.5Å; L57-I61 PolarHBondContact O-N 2.8Å; I61-R63 VanDerWaalsContact C-N 3.34Å; I61-R63 PolarHBondContact O-N 3.23Å; I61-A64 PolarHBondContact O-N 2.9Å; I61-L65 HydrophobicContact CG2-CD1 3.67Å; I61-L65 HydrophobicContact CG2-CG 4.3Å; I61-L65 VanDerWaalsContact O-CB 3.32Å; I61-L65 WeakPolarHBondContact O-CB 3.31Å; I61-L65 WeakPolarHBondContact O-CG 3.28Å; I61-L65 PolarHBondContact O-N 3.32Å; I61-I67 HydrophobicContact CG2-CD1 4.38Å; I61-A70 HydrophobicContact CB-CB 3.86Å; I61-A70 HydrophobicContact CD1-CB 4.42Å; I61-A70 HydrophobicContact CG2-CB 3.59Å; I61-K73 HydrophobicContact CD1-CB 4.47Å; I61-K73 HydrophobicContact CG2-CB 4.13Å; I61-K73 HydrophobicContact CG2-CG 4.24Å; I61-L74 HydrophobicContact CD1-CD1 3.91Å; I61-L74 HydrophobicContact CD1-CD2 3.6Å; I61-L74 HydrophobicContact CD1-CG 3.63Å; I61-I91 HydrophobicContact CD1-CG2 4.34Å; I61-W93 HydrophobicContact CG1-CE3 4.06Å; I61-F121 HydrophobicContact CD1-CE2 4.39Å; I61-F121 HydrophobicContact CD1-CZ 4.22Å; I61-F121 HydrophobicContact CG1-CE2 4.01Å; I61-F121 HydrophobicContact CG1-CZ 4.23Å
62	G	81.1	Confident	80.7	Confident	10 Å²	10	60 Å²	60	10%	0.103	32%	0.321	C	S	.	.	H	α-helix	trans	-60	-43.7	177.2	0	0	0	0	0	112	N58 G66 I67	N58-G62 WeakPolarHBondContact O-CA 3.29Å; N58-G62 PolarHBondContact O-N 2.9Å; G62-G66 CarbonylContact O-C 3.58Å; G62-G66 WeakPolarHBondContact O-CA 3.22Å; G62-G66 PolarHBondContact O-N 2.88Å; G62-I67 CarbonylContact C-O 3.54Å; G62-I67 WeakPolarHBondContact CA-O 3.43Å; G62-I67 PolarHBondContact O-N 2.89Å
63	R	83.5	Confident	80.4	Confident	130 Å²	130	58.9 Å²	58.9	49%	0.491	32%	0.315	S	S	.	.	H	α-helix	trans	-74	-36.4	178.7	-166.3	165.1	179.3	121.8	-1	112.9	S59 V60 I61 F134 A136 Y139	S59-R63 WeakPolarHBondContact O-CB 3.38Å; S59-R63 PolarHBondContact O-N 3.13Å; V60-R63 PolarHBondContact O-N 2.9Å; I61-R63 VanDerWaalsContact C-N 3.34Å; I61-R63 PolarHBondContact O-N 3.23Å; R63-F134 VanDerWaalsContact CD-O 3.24Å; R63-F134 WeakPolarHBondContact CD-O 3.47Å; R63-F134 PolarHBondContact NE-O 3.26Å; R63-A136 WeakPolarHBondContact O-CB 3.43Å; R63-Y139 HydrophobicContact CB-CE2 4.41Å; R63-Y139 HydrophobicContact CG-CD2 4.42Å; R63-Y139 HydrophobicContact CG-CE2 4.37Å
64	A	80.7	Confident	80.2	Confident	12 Å²	12	59.3 Å²	59.3	10%	0.099	32%	0.317	C	S	.	.	H	α-helix	trans	-69.1	-39.9	177.3	0	0	0	0	0	112.6	V60 I61 W93 Y139	V60-A64 WeakPolarHBondContact O-CB 3.38Å; V60-A64 PolarHBondContact O-N 2.77Å; I61-A64 PolarHBondContact O-N 2.9Å; A64-W93 HydrophobicContact CB-CH2 3.24Å; A64-W93 HydrophobicContact CB-CZ2 3.43Å; A64-W93 VanDerWaalsContact CB-CZ2 3.43Å; A64-W93 HydrophobicContact CB-CZ3 3.84Å; A64-Y139 HydrophobicContact CB-CD1 4.24Å; A64-Y139 HydrophobicContact CB-CD2 4.17Å; A64-Y139 HydrophobicContact CB-CG 3.79Å
65	L	79.5	Confident	80	Confident	66 Å²	66	59.4 Å²	59.4	35%	0.346	32%	0.322	S	S	.	.	H	α-helix	trans	-97.3	-9.5	-177	-61.9	-179.3	0	0	0	113.8	I61 I67 K73 W93	I61-L65 HydrophobicContact CG2-CD1 3.67Å; I61-L65 HydrophobicContact CG2-CG 4.3Å; I61-L65 VanDerWaalsContact O-CB 3.32Å; I61-L65 WeakPolarHBondContact O-CB 3.31Å; I61-L65 WeakPolarHBondContact O-CG 3.28Å; I61-L65 PolarHBondContact O-N 3.32Å; L65-I67 VanDerWaalsContact C-N 3.33Å; L65-I67 HydrophobicContact CB-CD1 4.07Å; L65-I67 HydrophobicContact CB-CG1 4.03Å; L65-I67 HydrophobicContact CB-CG2 4.32Å; L65-I67 HydrophobicContact CD1-CD1 3.95Å; L65-K73 HydrophobicContact CD1-CD 4.45Å; L65-K73 HydrophobicContact CD1-CG 4.11Å; L65-W93 HydrophobicContact CD1-CG 4.29Å; L65-W93 HydrophobicContact CD2-CG 4.34Å
66	G	77.4	Confident	80.1	Confident	54 Å²	54	57.9 Å²	57.9	56%	0.557	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.9	32.1	-176	0	0	0	0	0	113.5	G62	G62-G66 CarbonylContact O-C 3.58Å; G62-G66 WeakPolarHBondContact O-CA 3.22Å; G62-G66 PolarHBondContact O-N 2.88Å
67	I	74	Confident	80.1	Confident	66 Å²	66	59.4 Å²	59.4	34%	0.338	32%	0.321	S	S	.	.			trans	-111.5	146.7	180	62.3	-177.1	0	0	0	110.6	I61 G62 L65	I61-I67 HydrophobicContact CG2-CD1 4.38Å; G62-I67 CarbonylContact C-O 3.54Å; G62-I67 WeakPolarHBondContact CA-O 3.43Å; G62-I67 PolarHBondContact O-N 2.89Å; L65-I67 VanDerWaalsContact C-N 3.33Å; L65-I67 HydrophobicContact CB-CD1 4.07Å; L65-I67 HydrophobicContact CB-CG1 4.03Å; L65-I67 HydrophobicContact CB-CG2 4.32Å; L65-I67 HydrophobicContact CD1-CD1 3.95Å
68	S	64.5	Low	79.8	Confident	107 Å²	107	63 Å²	63	75%	0.748	34%	0.338	S	S	*	.	S	Bend	trans	-73.9	-29.7	-180	50.1	0	0	0	0	113.3
69	H	60.8	Low	79.4	Confident	137 Å²	137	63 Å²	63	63%	0.634	34%	0.34	S	S	*	.			trans	-141.1	133.9	-179.9	-59.7	-64	0	0	0	111.4	K71	H69-K71 VanDerWaalsContact C-N 3.33Å; H69-K71 PolarHBondContact O-N 3.24Å
70	A	68.8	Low	78.4	Confident	1 Å²	1	67.7 Å²	67.7	1%	0.008	36%	0.361	C	S	.	.			trans	-93	23.3	-178	0	0	0	0	0	113.7	N58 I61 D72 K73 L74	N58-A70 WeakPolarHBondContact OD1-CB 3.2Å; I61-A70 HydrophobicContact CB-CB 3.86Å; I61-A70 HydrophobicContact CD1-CB 4.42Å; I61-A70 HydrophobicContact CG2-CB 3.59Å; A70-D72 VanDerWaalsContact C-N 3.27Å; A70-D72 PolarHBondContact O-N 2.94Å; A70-K73 HydrophobicContact CB-CB 4.43Å; A70-K73 CarbonylContact O-C 3.58Å; A70-K73 WeakPolarHBondContact O-CA 3.4Å; A70-K73 PolarHBondContact O-N 3.37Å; A70-L74 HydrophobicContact CB-CD1 4.08Å; A70-L74 HydrophobicContact CB-CG 4.37Å; A70-L74 PolarHBondContact O-N 3.47Å
71	K	69.6	Low	77.2	Confident	164 Å²	164	69.2 Å²	69.2	71%	0.713	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	-38.9	-173	-75.6	-173.5	178	179.1	0	113.2	H69 K73	H69-K71 VanDerWaalsContact C-N 3.33Å; H69-K71 PolarHBondContact O-N 3.24Å; K71-K73 PolarHBondContact O-N 2.87Å
72	D	74.7	Confident	75.9	Confident	131 Å²	131	76 Å²	76	70%	0.701	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.2	-10.7	-179.3	-57	-25.1	0	0	0	113.6	A70	A70-D72 VanDerWaalsContact C-N 3.27Å; A70-D72 PolarHBondContact O-N 2.94Å
73	K	80.3	Confident	75.1	Confident	76 Å²	76	85.1 Å²	85.1	33%	0.33	46%	0.457	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.7	-23.5	-178.1	-57.4	-58.9	-176	-177.5	0	113	I61 L65 A70 K71 I91 K92	I61-K73 HydrophobicContact CD1-CB 4.47Å; I61-K73 HydrophobicContact CG2-CB 4.13Å; I61-K73 HydrophobicContact CG2-CG 4.24Å; L65-K73 HydrophobicContact CD1-CD 4.45Å; L65-K73 HydrophobicContact CD1-CG 4.11Å; A70-K73 HydrophobicContact CB-CB 4.43Å; A70-K73 CarbonylContact O-C 3.58Å; A70-K73 WeakPolarHBondContact O-CA 3.4Å; A70-K73 PolarHBondContact O-N 3.37Å; K71-K73 PolarHBondContact O-N 2.87Å; K73-I91 CarbonylContact O-C 3.58Å; K73-I91 VanDerWaalsContact O-CA 3.31Å; K73-I91 WeakPolarHBondContact O-CA 3.39Å; K73-K92 HydrophobicContact CD-CB 4.17Å; K73-K92 PolarHBondContact O-N 3.46Å
74	L	85.7	Confident	74.5	Confident	11 Å²	11	85.2 Å²	85.2	6%	0.058	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	98.1	178	-66.1	173.2	0	0	0	109.4	L57 I61 A70 Y76 L89 I91	L57-L74 HydrophobicContact CB-CD1 3.84Å; L57-L74 HydrophobicContact CD1-CD2 4.36Å; I61-L74 HydrophobicContact CD1-CD1 3.91Å; I61-L74 HydrophobicContact CD1-CD2 3.6Å; I61-L74 HydrophobicContact CD1-CG 3.63Å; A70-L74 HydrophobicContact CB-CD1 4.08Å; A70-L74 HydrophobicContact CB-CG 4.37Å; A70-L74 PolarHBondContact O-N 3.47Å; L74-Y76 HydrophobicContact CB-CE2 4.49Å; L74-L89 HydrophobicContact CB-CD1 4.17Å; L74-L89 HydrophobicContact CD2-CD1 4.21Å; L74-I91 HydrophobicContact CD2-CB 4.31Å; L74-I91 HydrophobicContact CD2-CD1 4.34Å; L74-I91 HydrophobicContact CD2-CG1 3.84Å; L74-I91 HydrophobicContact CD2-CG2 3.96Å
75	V	86.9	Confident	74.2	Confident	57 Å²	57	89.2 Å²	89.2	35%	0.345	48%	0.476	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	116.8	-178.7	-176.7	0	0	0	0	109.6	V77 L89 H90	V75-V77 HydrophobicContact CG1-CG2 4.26Å; V75-L89 WeakPolarHBondContact O-CA 3.39Å; V75-H90 HydrophobicContact CB-CB 4.38Å; V75-H90 PolarHBondContact N-O 2.98Å; V75-H90 PolarHBondContact O-N 2.78Å
76	Y	90.1	Very high	74.5	Confident	47 Å²	47	88.3 Å²	88.3	18%	0.184	47%	0.47	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	122.2	175.3	-63.7	-94.1	0	0	0	109.8	L74 V87 L89 E110 A114	L74-Y76 HydrophobicContact CB-CE2 4.49Å; Y76-V87 HydrophobicContact CD1-CG1 3.8Å; Y76-V87 HydrophobicContact CG-CG1 4.42Å; Y76-L89 HydrophobicContact CD1-CB 4.1Å; Y76-L89 HydrophobicContact CD1-CD1 3.84Å; Y76-L89 HydrophobicContact CD1-CG 4.38Å; Y76-L89 HydrophobicContact CD2-CD1 3.95Å; Y76-L89 HydrophobicContact CE1-CB 4.11Å; Y76-L89 HydrophobicContact CE1-CD1 3.66Å; Y76-L89 HydrophobicContact CE1-CD2 3.81Å; Y76-L89 HydrophobicContact CE1-CG 4.06Å; Y76-L89 HydrophobicContact CE2-CD1 3.77Å; Y76-L89 HydrophobicContact CG-CD1 3.98Å; Y76-E110 HydrophobicContact CD1-CB 4.09Å; Y76-E110 HydrophobicContact CD1-CG 3.94Å; Y76-E110 HydrophobicContact CE1-CB 4.14Å; Y76-E110 HydrophobicContact CE1-CG 4.48Å; Y76-E110 HydrophobicContact CG-CG 4.38Å; Y76-A114 HydrophobicContact CE1-CB 4.48Å
77	V	86.6	Confident	75.2	Confident	60 Å²	60	85.8 Å²	85.8	36%	0.364	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	119.5	177.5	179.3	0	0	0	0	108.9	V75 V87 T88	V75-V77 HydrophobicContact CG1-CG2 4.26Å; V77-V87 CarbonylContact O-C 3.57Å; V77-V87 WeakPolarHBondContact O-CA 3.13Å; V77-T88 PolarHBondContact N-O 3.21Å; V77-T88 PolarHBondContact O-N 3.38Å
78	H	84.4	Confident	75.9	Confident	77 Å²	77	83.3 Å²	83.3	36%	0.356	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	131.7	-176.4	-52.2	-74	0	0	0	110.8	V87 K106 E110	H78-V87 WeakPolarHBondContact ND1-CG2 3.32Å; H78-K106 VanDerWaalsContact CD2-CE 3.46Å; H78-K106 WeakPolarHBondContact CD2-CE 3.35Å; H78-K106 WeakPolarHBondContact CE1-CE 3.49Å; H78-K106 WeakPolarHBondContact ND1-CE 3.38Å; H78-K106 WeakPolarHBondContact NE2-CE 3.43Å; H78-E110 IonicContact CE1-OE1 3.89Å; H78-E110 PolarHBondContact CE1-OE1 2.83Å; H78-E110 IonicContact ND1-OE1 2.78Å; H78-E110 IonicContact NE2-OE1 2.75Å
79	T	78.2	Confident	77.3	Confident	63 Å²	63	78.2 Å²	78.2	39%	0.387	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	132.3	172.2	43.1	0	0	0	0	109.8	G81 K86	T79-G81 PolarHBondContact O-N 3.39Å; T79-K86 PolarHBondContact N-O 2.96Å; T79-K86 PolarHBondContact O-N 2.89Å; T79-K86 WeakPolarHBondContact OG1-CG 3.36Å
80	N	68.5	Low	78.7	Confident	153 Å²	153	74 Å²	74	82%	0.818	38%	0.376	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.6	107.3	178	-81.3	-17.5	0	0	0	109.4
81	G	61.2	Low	79.8	Confident	31 Å²	31	74 Å²	74	32%	0.32	38%	0.376	S	S	.	.			trans	-87.3	156.4	170.8	0	0	0	0	0	111.8	T79 K83 K84	T79-G81 PolarHBondContact O-N 3.39Å; G81-K83 PolarHBondContact O-N 3.39Å; G81-K83 VanDerWaalsContact O-N 3.12Å; G81-K84 WeakPolarHBondContact CA-O 3.5Å; G81-K84 PolarHBondContact N-O 3.17Å
82	P	57.4	Low	80.5	Confident	142 Å²	142	71.7 Å²	71.7	92%	0.922	37%	0.366	S	S	*	.	S	Bend	trans	-66.4	-15.8	-171	22.5	-32.5	0	0	0	115.6
83	K	64.4	Low	81	Confident	203 Å²	203	66.8 Å²	66.8	88%	0.883	34%	0.338	S	S	*	.	S	Bend	trans	-136.9	-14.7	177.8	-71.4	-175.2	178.2	178.6	0	115.2	G81	G81-K83 PolarHBondContact O-N 3.39Å; G81-K83 VanDerWaalsContact O-N 3.12Å
84	K	71.8	Confident	81	Confident	131 Å²	131	64.4 Å²	64.4	57%	0.57	33%	0.33	S	S	*	.	S	Bend	trans	-147.8	145.9	-178.3	-67.9	-174.1	179.9	-179.6	0	109.1	G81 K86	G81-K84 WeakPolarHBondContact CA-O 3.5Å; G81-K84 PolarHBondContact N-O 3.17Å; K84-K86 PolarHBondContact O-N 3.01Å
85	K	74.3	Confident	80.9	Confident	96 Å²	96	68.4 Å²	68.4	42%	0.417	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	126.5	174.6	-63.1	-161.6	178.6	-172.3	0	108.5	Y102 G103 K106 A109	K85-Y102 WeakPolarHBondContact O-CA 3.36Å; K85-G103 PolarHBondContact N-O 3.13Å; K85-G103 PolarHBondContact O-N 3.23Å; K85-K106 HydrophobicContact CD-CB 4.16Å; K85-A109 VanDerWaalsContact O-CB 3.31Å; K85-A109 WeakPolarHBondContact O-CB 3.26Å
86	K	85.8	Confident	80.7	Confident	48 Å²	48	70.6 Å²	70.6	21%	0.209	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	136.8	178.3	177.1	179.5	171	164.9	0	108.8	T79 K84 E100 Y102	T79-K86 PolarHBondContact N-O 2.96Å; T79-K86 PolarHBondContact O-N 2.89Å; T79-K86 WeakPolarHBondContact OG1-CG 3.36Å; K84-K86 PolarHBondContact O-N 3.01Å; K86-E100 WeakPolarHBondContact CE-OE1 3.25Å; K86-E100 WeakPolarHBondContact CE-OE2 3.46Å; K86-E100 IonicContact NZ-OE1 3.15Å; K86-E100 PolarHBondContact NZ-OE1 2.7Å; K86-E100 IonicContact NZ-OE2 2.62Å; K86-E100 PolarHBondContact NZ-OE2 3.26Å; K86-Y102 HydrophobicContact CB-CD1 3.97Å; K86-Y102 HydrophobicContact CB-CE1 3.83Å; K86-Y102 HydrophobicContact CD-CE1 3.68Å; K86-Y102 HydrophobicContact CG-CD1 4.1Å; K86-Y102 HydrophobicContact CG-CE1 3.6Å
87	V	90.3	Very high	80.7	Confident	1 Å²	1	69.9 Å²	69.9	1%	0.006	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	128.1	175	177.8	0	0	0	0	109.4	Y76 V77 H78 E100 G101 A109 E110 A113	Y76-V87 HydrophobicContact CD1-CG1 3.8Å; Y76-V87 HydrophobicContact CG-CG1 4.42Å; V77-V87 CarbonylContact O-C 3.57Å; V77-V87 WeakPolarHBondContact O-CA 3.13Å; H78-V87 WeakPolarHBondContact ND1-CG2 3.32Å; V87-E100 CarbonylContact O-C 3.58Å; V87-E100 WeakPolarHBondContact O-CA 3.35Å; V87-G101 PolarHBondContact N-O 3.31Å; V87-G101 PolarHBondContact O-N 2.99Å; V87-A109 HydrophobicContact CB-CB 4.06Å; V87-A109 HydrophobicContact CG2-CB 3.5Å; V87-E110 HydrophobicContact CG1-CG 4.06Å; V87-E110 HydrophobicContact CG2-CG 4.21Å; V87-A113 HydrophobicContact CG1-CB 4.5Å
88	T	90.1	Very high	80.8	Confident	13 Å²	13	72.7 Å²	72.7	8%	0.08	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	116.2	172.5	-54.8	0	0	0	0	108.2	V77 E98 V99 E100	V77-T88 PolarHBondContact N-O 3.21Å; V77-T88 PolarHBondContact O-N 3.38Å; T88-E98 HydrophobicContact CG2-CB 4.25Å; T88-V99 CarbonylContact C-O 3.58Å; T88-E100 HydrophobicContact CG2-CG 4.27Å
89	L	93.5	Very high	81.1	Confident	0 Å²	0	69.8 Å²	69.8	0%	0	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	114.9	175.5	173.2	57.1	0	0	0	109.3	L57 L74 V75 Y76 I91 E98 V99 A113 A114 A117	L57-L89 HydrophobicContact CD1-CD2 3.91Å; L74-L89 HydrophobicContact CB-CD1 4.17Å; L74-L89 HydrophobicContact CD2-CD1 4.21Å; V75-L89 WeakPolarHBondContact O-CA 3.39Å; Y76-L89 HydrophobicContact CD1-CB 4.1Å; Y76-L89 HydrophobicContact CD1-CD1 3.84Å; Y76-L89 HydrophobicContact CD1-CG 4.38Å; Y76-L89 HydrophobicContact CD2-CD1 3.95Å; Y76-L89 HydrophobicContact CE1-CB 4.11Å; Y76-L89 HydrophobicContact CE1-CD1 3.66Å; Y76-L89 HydrophobicContact CE1-CD2 3.81Å; Y76-L89 HydrophobicContact CE1-CG 4.06Å; Y76-L89 HydrophobicContact CE2-CD1 3.77Å; Y76-L89 HydrophobicContact CG-CD1 3.98Å; L89-I91 HydrophobicContact CD1-CG1 4.42Å; L89-I91 HydrophobicContact CD2-CD1 4.12Å; L89-I91 HydrophobicContact CD2-CG1 4.19Å; L89-I91 HydrophobicContact CG-CD1 4.26Å; L89-I91 HydrophobicContact CG-CG1 3.84Å; L89-E98 WeakPolarHBondContact O-CA 3.5Å; L89-V99 PolarHBondContact N-O 3.31Å; L89-V99 PolarHBondContact O-N 3.36Å; L89-A113 HydrophobicContact CB-CB 3.87Å; L89-A114 HydrophobicContact CD2-CB 4.5Å; L89-A117 HydrophobicContact CD2-CB 3.89Å
90	H	90.2	Very high	81.7	Confident	48 Å²	48	71 Å²	71	22%	0.222	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	122.6	172.4	-56.7	-97.8	0	0	0	109.6	V75 E98	V75-H90 HydrophobicContact CB-CB 4.38Å; V75-H90 PolarHBondContact N-O 2.98Å; V75-H90 PolarHBondContact O-N 2.78Å; H90-E98 IonicContact CE1-OE1 3.71Å; H90-E98 PolarHBondContact CE1-OE1 2.63Å; H90-E98 IonicContact CE1-OE2 3.45Å; H90-E98 WeakPolarHBondContact ND1-CG 3.29Å; H90-E98 IonicContact ND1-OE1 3.53Å; H90-E98 PolarHBondContact ND1-OE1 3.41Å; H90-E98 IonicContact ND1-OE2 2.78Å
91	I	91	Very high	82.6	Confident	2 Å²	2	63.7 Å²	63.7	1%	0.01	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	123.5	-178.2	-49.1	178.5	0	0	0	108	I61 K73 L74 L89 W93 S96 V97 V99 A117 F121	I61-I91 HydrophobicContact CD1-CG2 4.34Å; K73-I91 CarbonylContact O-C 3.58Å; K73-I91 VanDerWaalsContact O-CA 3.31Å; K73-I91 WeakPolarHBondContact O-CA 3.39Å; L74-I91 HydrophobicContact CD2-CB 4.31Å; L74-I91 HydrophobicContact CD2-CD1 4.34Å; L74-I91 HydrophobicContact CD2-CG1 3.84Å; L74-I91 HydrophobicContact CD2-CG2 3.96Å; L89-I91 HydrophobicContact CD1-CG1 4.42Å; L89-I91 HydrophobicContact CD2-CD1 4.12Å; L89-I91 HydrophobicContact CD2-CG1 4.19Å; L89-I91 HydrophobicContact CG-CD1 4.26Å; L89-I91 HydrophobicContact CG-CG1 3.84Å; I91-W93 VanDerWaalsContact CG2-O 3.31Å; I91-W93 WeakPolarHBondContact CG2-O 3.36Å; I91-S96 CarbonylContact O-C 3.49Å; I91-S96 WeakPolarHBondContact O-CA 3.34Å; I91-V97 HydrophobicContact CB-CG1 3.76Å; I91-V97 HydrophobicContact CD1-CG1 4.01Å; I91-V97 HydrophobicContact CG1-CG1 4.2Å; I91-V97 HydrophobicContact CG2-CG1 4.48Å; I91-V97 PolarHBondContact N-O 2.76Å; I91-V97 PolarHBondContact O-N 3.23Å; I91-V99 HydrophobicContact CD1-CG2 4.27Å; I91-A117 HydrophobicContact CD1-CB 3.32Å; I91-F121 HydrophobicContact CD1-CE1 4.39Å; I91-F121 HydrophobicContact CG2-CE1 4.1Å; I91-F121 HydrophobicContact CG2-CZ 3.96Å
92	K	84.2	Confident	83.7	Confident	115 Å²	115	67.1 Å²	67.1	50%	0.5	33%	0.328	S	S	.	.			trans	-98.7	6.6	-175.8	-63.6	-177.9	-176.1	166.4	0	114.7	K73	K73-K92 HydrophobicContact CD-CB 4.17Å; K73-K92 PolarHBondContact O-N 3.46Å
93	W	86.3	Confident	84.9	Confident	29 Å²	29	60.6 Å²	60.6	11%	0.11	29%	0.286	C	S	.	.	S	Bend	trans	-149.8	143.7	-176.2	-176.3	89.3	0	0	0	111.7	V60 I61 A64 L65 I91 K95 F121 L126 Y139 A143	V60-W93 HydrophobicContact CG1-CZ3 4.1Å; I61-W93 HydrophobicContact CG1-CE3 4.06Å; A64-W93 HydrophobicContact CB-CH2 3.24Å; A64-W93 HydrophobicContact CB-CZ2 3.43Å; A64-W93 VanDerWaalsContact CB-CZ2 3.43Å; A64-W93 HydrophobicContact CB-CZ3 3.84Å; L65-W93 HydrophobicContact CD1-CG 4.29Å; L65-W93 HydrophobicContact CD2-CG 4.34Å; I91-W93 VanDerWaalsContact CG2-O 3.31Å; I91-W93 WeakPolarHBondContact CG2-O 3.36Å; W93-K95 VanDerWaalsContact C-N 3.25Å; W93-F121 HydrophobicContact CZ3-CE2 4.49Å; W93-F121 WeakPolarHBondContact O-CZ 3.45Å; W93-L126 HydrophobicContact CH2-CD1 4.5Å; W93-L126 HydrophobicContact CH2-CD2 4.2Å; W93-L126 HydrophobicContact CZ3-CD1 4.11Å; W93-Y139 HydrophobicContact CH2-CD1 4.22Å; W93-A143 HydrophobicContact CZ2-CB 3.97Å
94	P	80.8	Confident	85.6	Confident	25 Å²	25	55.6 Å²	55.6	16%	0.162	28%	0.277	C	S	.	.	S	Bend	cis	-71.1	-15.8	-5.6	31.5	-38.7	0	0	0	113.6	W124 L126 F146	P94-W124 HydrophobicContact CG-CE3 4.05Å; P94-W124 HydrophobicContact CG-CZ3 4.21Å; P94-L126 HydrophobicContact CG-CD1 3.74Å; P94-F146 HydrophobicContact CB-CB 4.37Å; P94-F146 HydrophobicContact CB-CD2 4.01Å; P94-F146 HydrophobicContact CB-CG 4.3Å; P94-F146 HydrophobicContact CG-CD2 3.92Å; P94-F146 HydrophobicContact CG-CE2 4.21Å; P94-F146 HydrophobicContact CG-CG 4.22Å
95	K	82.3	Confident	85.8	Confident	95 Å²	95	54.9 Å²	54.9	41%	0.413	27%	0.274	S	S	.	.	S	Bend	trans	-132.8	159.1	169.2	63.1	-179.5	179.1	-179.6	0	109.8	W93 V97 W124	W93-K95 VanDerWaalsContact C-N 3.25Å; K95-V97 PolarHBondContact O-N 2.93Å; K95-W124 HydrophobicContact CD-CH2 4.3Å; K95-W124 HydrophobicContact CD-CZ2 4.33Å; K95-W124 VanDerWaalsContact CE-CH2 3.45Å; K95-W124 HydrophobicContact CG-CH2 3.85Å; K95-W124 HydrophobicContact CG-CZ2 4.38Å; K95-W124 HydrophobicContact CG-CZ3 4.18Å
96	S	83.2	Confident	86	Confident	103 Å²	103	55.3 Å²	55.3	72%	0.72	28%	0.276	S	S	*	.			trans	-68.2	119.3	174.6	-64.6	0	0	0	0	110.6	I91	I91-S96 CarbonylContact O-C 3.49Å; I91-S96 WeakPolarHBondContact O-CA 3.34Å
97	V	89.9	Confident	85.8	Confident	32 Å²	32	57.8 Å²	57.8	19%	0.194	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	151.5	174.9	68	0	0	0	0	110.3	I91 K95 V99 L120 W124	I91-V97 HydrophobicContact CB-CG1 3.76Å; I91-V97 HydrophobicContact CD1-CG1 4.01Å; I91-V97 HydrophobicContact CG1-CG1 4.2Å; I91-V97 HydrophobicContact CG2-CG1 4.48Å; I91-V97 PolarHBondContact N-O 2.76Å; I91-V97 PolarHBondContact O-N 3.23Å; K95-V97 PolarHBondContact O-N 2.93Å; V97-V99 HydrophobicContact CG2-CG2 4.47Å; V97-L120 HydrophobicContact CG1-CD1 4.45Å; V97-L120 HydrophobicContact CG2-CD1 3.94Å; V97-W124 HydrophobicContact CB-CH2 3.99Å; V97-W124 HydrophobicContact CG1-CH2 3.65Å; V97-W124 HydrophobicContact CG1-CZ3 4.41Å; V97-W124 HydrophobicContact CG2-CH2 4.4Å
98	E	89.5	Confident	85.4	Confident	120 Å²	120	59 Å²	59	56%	0.561	30%	0.297	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.8	136.1	175.3	-56.9	-172.6	172.2	0	0	109.2	T88 L89 H90	T88-E98 HydrophobicContact CG2-CB 4.25Å; L89-E98 WeakPolarHBondContact O-CA 3.5Å; H90-E98 IonicContact CE1-OE1 3.71Å; H90-E98 PolarHBondContact CE1-OE1 2.63Å; H90-E98 IonicContact CE1-OE2 3.45Å; H90-E98 WeakPolarHBondContact ND1-CG 3.29Å; H90-E98 IonicContact ND1-OE1 3.53Å; H90-E98 PolarHBondContact ND1-OE1 3.41Å; H90-E98 IonicContact ND1-OE2 2.78Å
99	V	90.8	Very high	85.2	Confident	16 Å²	16	58.3 Å²	58.3	10%	0.097	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	134.5	-178.2	-166.4	0	0	0	0	109.3	T88 L89 I91 V97 A116 A117 L120	T88-V99 CarbonylContact C-O 3.58Å; L89-V99 PolarHBondContact N-O 3.31Å; L89-V99 PolarHBondContact O-N 3.36Å; I91-V99 HydrophobicContact CD1-CG2 4.27Å; V97-V99 HydrophobicContact CG2-CG2 4.47Å; V99-A116 HydrophobicContact CG1-CB 3.32Å; V99-A117 HydrophobicContact CG2-CB 4.13Å; V99-L120 HydrophobicContact CG2-CD1 3.53Å
100	E	89.4	Confident	85.1	Confident	87 Å²	87	59.4 Å²	59.4	41%	0.407	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	144.6	-177.4	-55.6	-167.7	148.2	0	0	112	K86 V87 T88 Y102	K86-E100 WeakPolarHBondContact CE-OE1 3.25Å; K86-E100 WeakPolarHBondContact CE-OE2 3.46Å; K86-E100 IonicContact NZ-OE1 3.15Å; K86-E100 PolarHBondContact NZ-OE1 2.7Å; K86-E100 IonicContact NZ-OE2 2.62Å; K86-E100 PolarHBondContact NZ-OE2 3.26Å; V87-E100 CarbonylContact O-C 3.58Å; V87-E100 WeakPolarHBondContact O-CA 3.35Å; T88-E100 HydrophobicContact CG2-CG 4.27Å; E100-Y102 HydrophobicContact CB-CE2 4.15Å; E100-Y102 PolarHBondContact OE2-OH 2.94Å; E100-Y102 VanDerWaalsContact OE2-OH 3.13Å
101	G	88	Confident	85.1	Confident	1 Å²	1	61.2 Å²	61.2	1%	0.01	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	150.1	175.5	0	0	0	0	0	112.1	V87	V87-G101 PolarHBondContact N-O 3.31Å; V87-G101 PolarHBondContact O-N 2.99Å
102	Y	85.3	Confident	85	Confident	103 Å²	103	63.6 Å²	63.6	40%	0.404	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	112	-169.6	-66	-90.8	0	0	0	112.5	K85 K86 E100 Q112	K85-Y102 WeakPolarHBondContact O-CA 3.36Å; K86-Y102 HydrophobicContact CB-CD1 3.97Å; K86-Y102 HydrophobicContact CB-CE1 3.83Å; K86-Y102 HydrophobicContact CD-CE1 3.68Å; K86-Y102 HydrophobicContact CG-CD1 4.1Å; K86-Y102 HydrophobicContact CG-CE1 3.6Å; E100-Y102 HydrophobicContact CB-CE2 4.15Å; E100-Y102 PolarHBondContact OE2-OH 2.94Å; E100-Y102 VanDerWaalsContact OE2-OH 3.13Å; Y102-Q112 VanDerWaalsContact C-OE1 3.25Å; Y102-Q112 PolarHBondContact O-OE1 3.21Å
103	G	82.5	Confident	85.3	Confident	4 Å²	4	58.1 Å²	58.1	4%	0.041	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	157.5	-172.9	0	0	0	0	0	114.3	K85 A109	K85-G103 PolarHBondContact N-O 3.13Å; K85-G103 PolarHBondContact O-N 3.23Å; G103-A109 VanDerWaalsContact N-CB 3.34Å
104	S	77.6	Confident	85.6	Confident	99 Å²	99	56.8 Å²	56.8	69%	0.692	29%	0.285	S	S	*	.	S	Bend	trans	-64.7	-47.5	163.2	25.4	0	0	0	0	110.6	D108	S104-D108 PolarHBondContact OG-OD2 3.37Å
105	K	77.2	Confident	86.1	Confident	116 Å²	116	55.6 Å²	55.6	50%	0.504	28%	0.278	S	S	.	.	S	Bend	trans	-103.6	161.7	174.3	-58.1	174.9	-177.3	172.5	0	109.8	I107 D108 A109	K105-I107 HydrophobicContact CB-CG2 4.3Å; K105-I107 PolarHBondContact O-N 3.33Å; K105-D108 WeakPolarHBondContact CB-OD2 3.29Å; K105-D108 PolarHBondContact N-OD2 3.18Å; K105-D108 PolarHBondContact O-N 3.05Å; K105-A109 PolarHBondContact O-N 3.2Å
106	K	77.7	Confident	86.5	Confident	104 Å²	104	52 Å²	52	45%	0.452	27%	0.265	S	S	.	.	H	α-helix	trans	-57.7	-41.6	178.4	-176.7	-174.7	175.4	-174.1	0	110.8	H78 K85 A109 E110	H78-K106 VanDerWaalsContact CD2-CE 3.46Å; H78-K106 WeakPolarHBondContact CD2-CE 3.35Å; H78-K106 WeakPolarHBondContact CE1-CE 3.49Å; H78-K106 WeakPolarHBondContact ND1-CE 3.38Å; H78-K106 WeakPolarHBondContact NE2-CE 3.43Å; K85-K106 HydrophobicContact CD-CB 4.16Å; K106-A109 PolarHBondContact O-N 2.96Å; K106-E110 WeakPolarHBondContact CE-OE1 3.42Å; K106-E110 WeakPolarHBondContact O-CG 3.34Å; K106-E110 PolarHBondContact O-N 2.83Å; K106-E110 VanDerWaalsContact O-N 3.14Å
107	I	81.1	Confident	86.9	Confident	101 Å²	101	47.1 Å²	47.1	52%	0.518	23%	0.231	S	C	.	.	H	α-helix	trans	-67.9	-38.5	-178.1	-156.6	160.9	0	0	0	112.2	K105 A109 E110 R111	K105-I107 HydrophobicContact CB-CG2 4.3Å; K105-I107 PolarHBondContact O-N 3.33Å; I107-A109 VanDerWaalsContact C-N 3.32Å; I107-A109 PolarHBondContact O-N 2.95Å; I107-E110 WeakPolarHBondContact O-CB 3.37Å; I107-E110 PolarHBondContact O-N 2.82Å; I107-R111 WeakPolarHBondContact O-CG 3.25Å; I107-R111 PolarHBondContact O-N 2.97Å
108	D	83.5	Confident	87	Confident	25 Å²	25	45.6 Å²	45.6	13%	0.134	22%	0.222	C	C	.	.	H	α-helix	trans	-63.1	-41.6	177.1	-43.4	-19.7	0	0	0	111.1	S104 K105 R111 Q112	S104-D108 PolarHBondContact OG-OD2 3.37Å; K105-D108 WeakPolarHBondContact CB-OD2 3.29Å; K105-D108 PolarHBondContact N-OD2 3.18Å; K105-D108 PolarHBondContact O-N 3.05Å; D108-R111 PolarHBondContact O-N 3.3Å; D108-Q112 PolarHBondContact O-N 2.89Å
109	A	85.6	Confident	87.1	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-64.6	-41.2	178.2	0	0	0	0	0	111.3	K85 V87 G103 K105 K106 I107 Q112 A113	K85-A109 VanDerWaalsContact O-CB 3.31Å; K85-A109 WeakPolarHBondContact O-CB 3.26Å; V87-A109 HydrophobicContact CB-CB 4.06Å; V87-A109 HydrophobicContact CG2-CB 3.5Å; G103-A109 VanDerWaalsContact N-CB 3.34Å; K105-A109 PolarHBondContact O-N 3.2Å; K106-A109 PolarHBondContact O-N 2.96Å; I107-A109 VanDerWaalsContact C-N 3.32Å; I107-A109 PolarHBondContact O-N 2.95Å; A109-Q112 PolarHBondContact O-N 3.26Å; A109-A113 PolarHBondContact O-N 2.82Å
110	E	90.6	Very high	87	Confident	23 Å²	23	46.5 Å²	46.5	11%	0.107	23%	0.227	C	C	.	.	H	α-helix	trans	-64.5	-44.2	173.5	-70.8	172.8	-163.3	0	0	112.3	K54 Y76 H78 V87 K106 I107 Q112 A113 A114	K54-E110 IonicContact NZ-OE2 2.81Å; K54-E110 PolarHBondContact NZ-OE2 3.11Å; Y76-E110 HydrophobicContact CD1-CB 4.09Å; Y76-E110 HydrophobicContact CD1-CG 3.94Å; Y76-E110 HydrophobicContact CE1-CB 4.14Å; Y76-E110 HydrophobicContact CE1-CG 4.48Å; Y76-E110 HydrophobicContact CG-CG 4.38Å; H78-E110 IonicContact CE1-OE1 3.89Å; H78-E110 PolarHBondContact CE1-OE1 2.83Å; H78-E110 IonicContact ND1-OE1 2.78Å; H78-E110 IonicContact NE2-OE1 2.75Å; V87-E110 HydrophobicContact CG1-CG 4.06Å; V87-E110 HydrophobicContact CG2-CG 4.21Å; K106-E110 WeakPolarHBondContact CE-OE1 3.42Å; K106-E110 WeakPolarHBondContact O-CG 3.34Å; K106-E110 PolarHBondContact O-N 2.83Å; K106-E110 VanDerWaalsContact O-N 3.14Å; I107-E110 WeakPolarHBondContact O-CB 3.37Å; I107-E110 PolarHBondContact O-N 2.82Å; E110-Q112 VanDerWaalsContact C-N 3.32Å; E110-Q112 PolarHBondContact O-N 3.47Å; E110-A113 PolarHBondContact O-N 2.78Å; E110-A114 VanDerWaalsContact O-CB 3.31Å; E110-A114 WeakPolarHBondContact O-CB 3.28Å; E110-A114 PolarHBondContact O-N 2.85Å
111	R	90.8	Very high	87.1	Confident	86 Å²	86	42.4 Å²	42.4	33%	0.325	21%	0.208	S	C	.	.	H	α-helix	trans	-61.7	-41.1	177.6	-75.2	-178.1	75.6	178	7.1	111	L47 P51 P53 K54 I107 D108 A114 A115	L47-R111 HydrophobicContact CD2-CB 4.1Å; P51-R111 PolarHBondContact O-NH2 3.24Å; P53-R111 HydrophobicContact CG-CB 4.41Å; P53-R111 WeakPolarHBondContact CG-O 3.28Å; K54-R111 HydrophobicContact CD-CG 4.45Å; I107-R111 WeakPolarHBondContact O-CG 3.25Å; I107-R111 PolarHBondContact O-N 2.97Å; D108-R111 PolarHBondContact O-N 3.3Å; R111-A114 PolarHBondContact O-N 3.11Å; R111-A115 WeakPolarHBondContact O-CB 3.45Å; R111-A115 PolarHBondContact O-N 2.78Å
112	Q	88	Confident	87.1	Confident	52 Å²	52	44.8 Å²	44.8	24%	0.243	22%	0.218	C	C	.	.	H	α-helix	trans	-65.5	-46.1	175.3	-85.5	-170.8	-5.9	0	0	113.1	L47 Y102 D108 A109 E110 A114 A115 A116	L47-Q112 HydrophobicContact CD1-CG 4.07Å; Y102-Q112 VanDerWaalsContact C-OE1 3.25Å; Y102-Q112 PolarHBondContact O-OE1 3.21Å; D108-Q112 PolarHBondContact O-N 2.89Å; A109-Q112 PolarHBondContact O-N 3.26Å; E110-Q112 VanDerWaalsContact C-N 3.32Å; E110-Q112 PolarHBondContact O-N 3.47Å; Q112-A114 PolarHBondContact O-N 2.92Å; Q112-A115 PolarHBondContact O-N 2.62Å; Q112-A115 VanDerWaalsContact O-N 3.12Å; Q112-A116 PolarHBondContact O-N 3.38Å
113	A	91	Very high	87	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-59	-40	176.8	0	0	0	0	0	110.6	V87 L89 A109 E110 A117	V87-A113 HydrophobicContact CG1-CB 4.5Å; L89-A113 HydrophobicContact CB-CB 3.87Å; A109-A113 PolarHBondContact O-N 2.82Å; E110-A113 PolarHBondContact O-N 2.78Å; A113-A117 WeakPolarHBondContact O-CB 3.46Å; A113-A117 PolarHBondContact O-N 3.49Å; A113-A117 VanDerWaalsContact O-N 3.09Å
114	A	93.2	Very high	87.2	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-66.7	-39.3	174.9	0	0	0	0	0	113.2	P53 K54 L57 Y76 L89 E110 R111 Q112 A117 C118	P53-A114 HydrophobicContact CB-CB 3.82Å; P53-A114 HydrophobicContact CG-CB 4.01Å; K54-A114 HydrophobicContact CG-CB 3.7Å; L57-A114 HydrophobicContact CD1-CB 3.83Å; Y76-A114 HydrophobicContact CE1-CB 4.48Å; L89-A114 HydrophobicContact CD2-CB 4.5Å; E110-A114 VanDerWaalsContact O-CB 3.31Å; E110-A114 WeakPolarHBondContact O-CB 3.28Å; E110-A114 PolarHBondContact O-N 2.85Å; R111-A114 PolarHBondContact O-N 3.11Å; Q112-A114 PolarHBondContact O-N 2.92Å; A114-A117 WeakPolarHBondContact O-CB 3.31Å; A114-A117 PolarHBondContact O-N 2.94Å; A114-C118 PolarHBondContact O-N 3.47Å; A114-C118 PolarHBondContact O-SG 3.34Å
115	A	91.9	Very high	87.6	Confident	1 Å²	1	42.2 Å²	42.2	1%	0.008	22%	0.223	C	C	.	.	H	α-helix	trans	-67.9	-42.4	179.6	0	0	0	0	0	111.4	L46 L47 F50 P53 R111 Q112 A117 C118 Q119	L46-A115 HydrophobicContact CB-CB 4.11Å; L47-A115 HydrophobicContact CD2-CB 3.93Å; L47-A115 HydrophobicContact CG-CB 4.36Å; F50-A115 HydrophobicContact CB-CB 4.48Å; P53-A115 HydrophobicContact CB-CB 3.94Å; P53-A115 HydrophobicContact CG-CB 4.15Å; R111-A115 WeakPolarHBondContact O-CB 3.45Å; R111-A115 PolarHBondContact O-N 2.78Å; Q112-A115 PolarHBondContact O-N 2.62Å; Q112-A115 VanDerWaalsContact O-N 3.12Å; A115-A117 VanDerWaalsContact C-N 3.27Å; A115-A117 PolarHBondContact O-N 3.35Å; A115-C118 WeakPolarHBondContact O-CB 3.35Å; A115-C118 PolarHBondContact O-N 3.01Å; A115-C118 VanDerWaalsContact O-N 3.15Å; A115-Q119 PolarHBondContact O-N 3.24Å
116	A	90	Very high	88.1	Confident	19 Å²	19	36.7 Å²	36.7	16%	0.157	20%	0.199	C	C	.	.	H	α-helix	trans	-62.6	-36.3	173.6	0	0	0	0	0	111.8	L46 V99 Q112 Q119 L120	L46-A116 HydrophobicContact CD1-CB 4.26Å; V99-A116 HydrophobicContact CG1-CB 3.32Å; Q112-A116 PolarHBondContact O-N 3.38Å; A116-Q119 WeakPolarHBondContact O-CB 3.34Å; A116-Q119 PolarHBondContact O-N 3.42Å; A116-L120 PolarHBondContact O-N 2.85Å; A116-L120 VanDerWaalsContact O-N 3.12Å
117	A	92.6	Very high	88.5	Confident	0 Å²	0	32 Å²	32	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-66.5	-38.4	171.8	0	0	0	0	0	113.6	L57 L89 I91 V99 A113 A114 A115 Q119 L120 F121	L57-A117 HydrophobicContact CD1-CB 3.76Å; L57-A117 HydrophobicContact CD2-CB 4.04Å; L57-A117 HydrophobicContact CG-CB 4.49Å; L89-A117 HydrophobicContact CD2-CB 3.89Å; I91-A117 HydrophobicContact CD1-CB 3.32Å; V99-A117 HydrophobicContact CG2-CB 4.13Å; A113-A117 WeakPolarHBondContact O-CB 3.46Å; A113-A117 PolarHBondContact O-N 3.49Å; A113-A117 VanDerWaalsContact O-N 3.09Å; A114-A117 WeakPolarHBondContact O-CB 3.31Å; A114-A117 PolarHBondContact O-N 2.94Å; A115-A117 VanDerWaalsContact C-N 3.27Å; A115-A117 PolarHBondContact O-N 3.35Å; A117-Q119 VanDerWaalsContact C-N 3.29Å; A117-Q119 PolarHBondContact O-N 3.2Å; A117-L120 WeakPolarHBondContact O-CB 3.42Å; A117-L120 PolarHBondContact O-N 3.15Å; A117-F121 WeakPolarHBondContact O-CD1 3.35Å; A117-F121 PolarHBondContact O-N 3.45Å
118	C	91.9	Very high	88.5	Confident	0 Å²	0	27.3 Å²	27.3	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-61.6	-39.5	172.3	-68	0	0	0	0	111.4	F50 P53 L56 A114 A115 L120 F121 K122 L127	F50-C118 HydrophobicContact CB-CB 4.24Å; F50-C118 HydrophobicContact CD1-CB 3.47Å; F50-C118 VanDerWaalsContact CD1-CB 3.47Å; F50-C118 HydrophobicContact CD2-CB 3.89Å; F50-C118 HydrophobicContact CE1-CB 3.65Å; F50-C118 HydrophobicContact CE2-CB 4.09Å; F50-C118 HydrophobicContact CG-CB 3.58Å; F50-C118 HydrophobicContact CZ-CB 3.97Å; P53-C118 PolarHBondContact O-SG 3.01Å; P53-C118 VanDerWaalsContact O-SG 3.36Å; L56-C118 HydrophobicContact CD2-CB 4.38Å; A114-C118 PolarHBondContact O-N 3.47Å; A114-C118 PolarHBondContact O-SG 3.34Å; A115-C118 WeakPolarHBondContact O-CB 3.35Å; A115-C118 PolarHBondContact O-N 3.01Å; A115-C118 VanDerWaalsContact O-N 3.15Å; C118-L120 VanDerWaalsContact C-N 3.34Å; C118-L120 PolarHBondContact O-N 3.48Å; C118-F121 WeakPolarHBondContact O-CB 3.12Å; C118-F121 PolarHBondContact O-N 2.91Å; C118-F121 VanDerWaalsContact O-N 3.17Å; C118-K122 PolarHBondContact O-N 3.02Å; C118-L127 HydrophobicContact CB-CD1 4.34Å
119	Q	90.6	Very high	88.2	Confident	97 Å²	97	31.1 Å²	31.1	45%	0.453	18%	0.181	S	C	.	.	H	α-helix	trans	-61.7	-42.3	175.7	-165.5	-175.9	22.3	0	0	111.9	L46 F50 A115 A116 A117 F121 K122 G123	L46-Q119 HydrophobicContact CD2-CB 4.12Å; L46-Q119 HydrophobicContact CD2-CG 4Å; L46-Q119 VanDerWaalsContact CD2-OE1 3.24Å; F50-Q119 HydrophobicContact CE2-CB 3.95Å; F50-Q119 HydrophobicContact CZ-CB 4.43Å; A115-Q119 PolarHBondContact O-N 3.24Å; A116-Q119 WeakPolarHBondContact O-CB 3.34Å; A116-Q119 PolarHBondContact O-N 3.42Å; A117-Q119 VanDerWaalsContact C-N 3.29Å; A117-Q119 PolarHBondContact O-N 3.2Å; Q119-F121 VanDerWaalsContact C-N 3.34Å; Q119-F121 PolarHBondContact O-N 2.88Å; Q119-K122 PolarHBondContact O-N 3.11Å; Q119-G123 PolarHBondContact O-N 2.75Å
120	L	89.7	Confident	88	Confident	59 Å²	59	41.4 Å²	41.4	31%	0.309	22%	0.219	S	C	.	.	H	α-helix	trans	-60.2	-43.8	172.7	-71.6	174.9	0	0	0	111.6	V97 V99 A116 A117 C118 K122 G123 W124	V97-L120 HydrophobicContact CG1-CD1 4.45Å; V97-L120 HydrophobicContact CG2-CD1 3.94Å; V99-L120 HydrophobicContact CG2-CD1 3.53Å; A116-L120 PolarHBondContact O-N 2.85Å; A116-L120 VanDerWaalsContact O-N 3.12Å; A117-L120 WeakPolarHBondContact O-CB 3.42Å; A117-L120 PolarHBondContact O-N 3.15Å; C118-L120 VanDerWaalsContact C-N 3.34Å; C118-L120 PolarHBondContact O-N 3.48Å; L120-K122 VanDerWaalsContact C-N 3.29Å; L120-K122 PolarHBondContact O-N 3.4Å; L120-G123 PolarHBondContact O-N 2.84Å; L120-W124 HydrophobicContact CB-CZ2 4.25Å; L120-W124 WeakPolarHBondContact O-CB 3.26Å; L120-W124 PolarHBondContact O-N 3.31Å
121	F	90.7	Very high	87.8	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-62.6	-38.7	178.4	-82.9	28.4	0	0	0	111.6	L57 V60 I61 I91 W93 A117 C118 Q119 W124 G125 L126 L127	L57-F121 HydrophobicContact CD2-CD1 4.46Å; L57-F121 HydrophobicContact CD2-CD2 3.83Å; L57-F121 HydrophobicContact CD2-CE1 4.37Å; L57-F121 HydrophobicContact CD2-CE2 3.74Å; L57-F121 HydrophobicContact CD2-CG 4.22Å; L57-F121 HydrophobicContact CD2-CZ 4.04Å; V60-F121 HydrophobicContact CB-CD2 4.12Å; V60-F121 HydrophobicContact CB-CE2 4.18Å; V60-F121 HydrophobicContact CG1-CD2 3.7Å; V60-F121 HydrophobicContact CG1-CE2 3.75Å; V60-F121 HydrophobicContact CG2-CD2 4.38Å; I61-F121 HydrophobicContact CD1-CE2 4.39Å; I61-F121 HydrophobicContact CD1-CZ 4.22Å; I61-F121 HydrophobicContact CG1-CE2 4.01Å; I61-F121 HydrophobicContact CG1-CZ 4.23Å; I91-F121 HydrophobicContact CD1-CE1 4.39Å; I91-F121 HydrophobicContact CG2-CE1 4.1Å; I91-F121 HydrophobicContact CG2-CZ 3.96Å; W93-F121 HydrophobicContact CZ3-CE2 4.49Å; W93-F121 WeakPolarHBondContact O-CZ 3.45Å; A117-F121 WeakPolarHBondContact O-CD1 3.35Å; A117-F121 PolarHBondContact O-N 3.45Å; C118-F121 WeakPolarHBondContact O-CB 3.12Å; C118-F121 PolarHBondContact O-N 2.91Å; C118-F121 VanDerWaalsContact O-N 3.17Å; Q119-F121 VanDerWaalsContact C-N 3.34Å; Q119-F121 PolarHBondContact O-N 2.88Å; F121-W124 AromaticContact CD1-CE3 3.99Å; F121-W124 HydrophobicContact CD1-CE3 3.99Å; F121-W124 AromaticContact CD1-CZ3 3.99Å; F121-W124 HydrophobicContact CD1-CZ3 3.99Å; F121-W124 HydrophobicContact CE1-CE3 4.26Å; F121-W124 AromaticContact CE1-CZ3 3.87Å; F121-W124 HydrophobicContact CE1-CZ3 3.87Å; F121-W124 PolarHBondContact O-N 3.44Å; F121-G125 PolarHBondContact O-N 3.29Å; F121-L126 HydrophobicContact CB-CB 4.18Å; F121-L126 HydrophobicContact CB-CD1 4.42Å; F121-L126 HydrophobicContact CD1-CD1 4.2Å; F121-L126 HydrophobicContact CD2-CD1 4.21Å; F121-L126 HydrophobicContact CG-CB 4.47Å; F121-L126 HydrophobicContact CG-CD1 4.03Å; F121-L126 WeakPolarHBondContact O-CA 3.36Å; F121-L126 WeakPolarHBondContact O-CB 3.39Å; F121-L126 PolarHBondContact O-N 3.17Å; F121-L127 HydrophobicContact CB-CD1 3.89Å; F121-L127 HydrophobicContact CB-CG 4.27Å; F121-L127 PolarHBondContact O-N 3.18Å
122	K	87.7	Confident	87.5	Confident	51 Å²	51	41.9 Å²	41.9	22%	0.222	23%	0.226	C	C	.	.	H	α-helix	trans	-65	-44.7	173.6	-163.5	170.7	-173.4	169.2	0	111.8	E49 F50 C118 Q119 L120 W124 G125 L127 P129 N131	E49-K122 WeakPolarHBondContact OE1-CD 3.34Å; E49-K122 IonicContact OE1-NZ 3.71Å; E49-K122 PolarHBondContact OE1-NZ 3.19Å; F50-K122 HydrophobicContact CE1-CD 4.27Å; F50-K122 HydrophobicContact CZ-CB 4.34Å; F50-K122 HydrophobicContact CZ-CD 3.9Å; C118-K122 PolarHBondContact O-N 3.02Å; Q119-K122 PolarHBondContact O-N 3.11Å; L120-K122 VanDerWaalsContact C-N 3.29Å; L120-K122 PolarHBondContact O-N 3.4Å; K122-W124 VanDerWaalsContact C-N 3.26Å; K122-W124 PolarHBondContact O-N 3.15Å; K122-G125 PolarHBondContact O-N 3.47Å; K122-L127 HydrophobicContact CB-CB 4.17Å; K122-L127 HydrophobicContact CG-CB 4.35Å; K122-P129 VanDerWaalsContact CE-O 3.22Å; K122-P129 WeakPolarHBondContact CE-O 3.39Å; K122-P129 PolarHBondContact NZ-O 3.04Å; K122-N131 PolarHBondContact NZ-OD1 2.88Å
123	G	83.6	Confident	87.4	Confident	70 Å²	70	42.3 Å²	42.3	72%	0.722	23%	0.23	S	C	*	.	H	α-helix	trans	-63	-29.2	174.7	0	0	0	0	0	113.9	Q119 L120 G125	Q119-G123 PolarHBondContact O-N 2.75Å; L120-G123 PolarHBondContact O-N 2.84Å; G123-G125 VanDerWaalsContact C-N 3.25Å; G123-G125 PolarHBondContact O-N 3.13Å
124	W	86.7	Confident	87.3	Confident	50 Å²	50	43.6 Å²	43.6	19%	0.189	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-0.6	173.8	-63.5	-10.3	0	0	0	113.6	P94 K95 V97 L120 F121 K122 L126 F146	P94-W124 HydrophobicContact CG-CE3 4.05Å; P94-W124 HydrophobicContact CG-CZ3 4.21Å; K95-W124 HydrophobicContact CD-CH2 4.3Å; K95-W124 HydrophobicContact CD-CZ2 4.33Å; K95-W124 VanDerWaalsContact CE-CH2 3.45Å; K95-W124 HydrophobicContact CG-CH2 3.85Å; K95-W124 HydrophobicContact CG-CZ2 4.38Å; K95-W124 HydrophobicContact CG-CZ3 4.18Å; V97-W124 HydrophobicContact CB-CH2 3.99Å; V97-W124 HydrophobicContact CG1-CH2 3.65Å; V97-W124 HydrophobicContact CG1-CZ3 4.41Å; V97-W124 HydrophobicContact CG2-CH2 4.4Å; L120-W124 HydrophobicContact CB-CZ2 4.25Å; L120-W124 WeakPolarHBondContact O-CB 3.26Å; L120-W124 PolarHBondContact O-N 3.31Å; F121-W124 AromaticContact CD1-CE3 3.99Å; F121-W124 HydrophobicContact CD1-CE3 3.99Å; F121-W124 AromaticContact CD1-CZ3 3.99Å; F121-W124 HydrophobicContact CD1-CZ3 3.99Å; F121-W124 HydrophobicContact CE1-CE3 4.26Å; F121-W124 AromaticContact CE1-CZ3 3.87Å; F121-W124 HydrophobicContact CE1-CZ3 3.87Å; F121-W124 PolarHBondContact O-N 3.44Å; K122-W124 VanDerWaalsContact C-N 3.26Å; K122-W124 PolarHBondContact O-N 3.15Å; W124-L126 VanDerWaalsContact C-N 3.29Å; W124-L126 HydrophobicContact CB-CD1 4.25Å; W124-L126 HydrophobicContact CB-CG 4.11Å; W124-L126 HydrophobicContact CE3-CD1 3.91Å; W124-L126 PolarHBondContact O-N 3.47Å; W124-F146 HydrophobicContact CB-CE1 4.47Å; W124-F146 HydrophobicContact CB-CZ 3.85Å; W124-F146 HydrophobicContact CG-CE1 4.36Å; W124-F146 HydrophobicContact CG-CZ 4.21Å
125	G	85.4	Confident	86.8	Confident	32 Å²	32	47.8 Å²	47.8	33%	0.33	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.5	23.4	-176.7	0	0	0	0	0	113.8	F121 K122 G123 F134 L142	F121-G125 PolarHBondContact O-N 3.29Å; K122-G125 PolarHBondContact O-N 3.47Å; G123-G125 VanDerWaalsContact C-N 3.25Å; G123-G125 PolarHBondContact O-N 3.13Å; G125-F134 VanDerWaalsContact O-CE2 3.24Å; G125-F134 WeakPolarHBondContact O-CE2 3.25Å; G125-L142 VanDerWaalsContact O-CD1 3.31Å; G125-L142 WeakPolarHBondContact O-CD1 3.42Å
126	L	87.6	Confident	86.1	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	27%	0.27	C	S	.	.	S	Bend	trans	-88.8	-12.2	173.5	-58.5	173.9	0	0	0	112.9	W93 P94 F121 W124 Y139 L142	W93-L126 HydrophobicContact CH2-CD1 4.5Å; W93-L126 HydrophobicContact CH2-CD2 4.2Å; W93-L126 HydrophobicContact CZ3-CD1 4.11Å; P94-L126 HydrophobicContact CG-CD1 3.74Å; F121-L126 HydrophobicContact CB-CB 4.18Å; F121-L126 HydrophobicContact CB-CD1 4.42Å; F121-L126 HydrophobicContact CD1-CD1 4.2Å; F121-L126 HydrophobicContact CD2-CD1 4.21Å; F121-L126 HydrophobicContact CG-CB 4.47Å; F121-L126 HydrophobicContact CG-CD1 4.03Å; F121-L126 WeakPolarHBondContact O-CA 3.36Å; F121-L126 WeakPolarHBondContact O-CB 3.39Å; F121-L126 PolarHBondContact O-N 3.17Å; W124-L126 VanDerWaalsContact C-N 3.29Å; W124-L126 HydrophobicContact CB-CD1 4.25Å; W124-L126 HydrophobicContact CB-CG 4.11Å; W124-L126 HydrophobicContact CE3-CD1 3.91Å; W124-L126 PolarHBondContact O-N 3.47Å; L126-Y139 HydrophobicContact CB-CE1 4.22Å; L126-Y139 HydrophobicContact CD2-CD1 4.29Å; L126-Y139 HydrophobicContact CD2-CE1 4.48Å; L126-Y139 WeakPolarHBondContact O-CE1 3.48Å; L126-Y139 PolarHBondContact O-OH 3Å; L126-L142 HydrophobicContact CD2-CB 3.97Å; L126-L142 HydrophobicContact CD2-CD1 4.29Å
127	L	86.9	Confident	85.6	Confident	7 Å²	7	51.1 Å²	51.1	4%	0.037	29%	0.286	C	S	.	.	S	Bend	trans	-121.5	142.3	170.3	-75.5	165.7	0	0	0	108.7	F50 L56 V60 C118 F121 K122 L133	F50-L127 HydrophobicContact CE1-CD1 4.22Å; L56-L127 HydrophobicContact CD1-CD2 3.85Å; L56-L127 HydrophobicContact CD2-CD1 3.85Å; L56-L127 HydrophobicContact CD2-CD2 4.08Å; L56-L127 HydrophobicContact CG-CD1 4.33Å; L56-L127 HydrophobicContact CG-CD2 4Å; V60-L127 HydrophobicContact CG2-CD2 3.54Å; V60-L127 HydrophobicContact CG2-CG 4.11Å; C118-L127 HydrophobicContact CB-CD1 4.34Å; F121-L127 HydrophobicContact CB-CD1 3.89Å; F121-L127 HydrophobicContact CB-CG 4.27Å; F121-L127 PolarHBondContact O-N 3.18Å; K122-L127 HydrophobicContact CB-CB 4.17Å; K122-L127 HydrophobicContact CG-CB 4.35Å; L127-L133 HydrophobicContact CD2-CD2 4.23Å
128	G	81.1	Confident	85.1	Confident	1 Å²	1	55.8 Å²	55.8	1%	0.01	31%	0.306	C	S	.	.			trans	-67.9	167.6	172.2	0	0	0	0	0	112.8	R130 N131 E132	G128-R130 PolarHBondContact O-N 2.66Å; G128-R130 VanDerWaalsContact O-N 3.14Å; G128-N131 WeakPolarHBondContact O-CA 3.38Å; G128-N131 PolarHBondContact O-N 3.01Å; G128-E132 WeakPolarHBondContact CA-OE1 3.43Å; G128-E132 PolarHBondContact N-O 3.11Å
129	P	77.2	Confident	84.9	Confident	105 Å²	105	55.8 Å²	55.8	68%	0.682	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	-31.4	178.6	17.6	-31.3	0	0	0	114	K122 E132	K122-P129 VanDerWaalsContact CE-O 3.22Å; K122-P129 WeakPolarHBondContact CE-O 3.39Å; K122-P129 PolarHBondContact NZ-O 3.04Å; P129-E132 VanDerWaalsContact CD-OE1 3.29Å; P129-E132 WeakPolarHBondContact CD-OE1 3.24Å
130	R	80.9	Confident	84.1	Confident	216 Å²	216	56.7 Å²	56.7	82%	0.815	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.9	26.1	173.9	-54.3	-179.3	173.7	-174.2	-1.5	113.6	G128 E132	G128-R130 PolarHBondContact O-N 2.66Å; G128-R130 VanDerWaalsContact O-N 3.14Å; R130-E132 WeakPolarHBondContact CB-OE2 3.32Å; R130-E132 PolarHBondContact O-N 3.03Å
131	N	86.3	Confident	83.6	Confident	32 Å²	32	58.1 Å²	58.1	17%	0.171	32%	0.316	C	S	.	.			trans	62.3	21.3	-175.8	-47.9	-28.5	0	0	0	113.6	E49 F50 L56 K122 G128	E49-N131 PolarHBondContact O-ND2 3.42Å; F50-N131 HydrophobicContact CE1-CB 4.48Å; F50-N131 WeakPolarHBondContact CE1-OD1 3.41Å; L56-N131 HydrophobicContact CD2-CB 4.06Å; K122-N131 PolarHBondContact NZ-OD1 2.88Å; G128-N131 WeakPolarHBondContact O-CA 3.38Å; G128-N131 PolarHBondContact O-N 3.01Å
132	E	85.2	Confident	83	Confident	87 Å²	87	59 Å²	59	41%	0.407	32%	0.321	S	S	.	.	P	Polyproline II helix	trans	-67.5	143.4	176.4	66.5	-106.6	171.5	0	0	111.9	G128 P129 R130	G128-E132 WeakPolarHBondContact CA-OE1 3.43Å; G128-E132 PolarHBondContact N-O 3.11Å; P129-E132 VanDerWaalsContact CD-OE1 3.29Å; P129-E132 WeakPolarHBondContact CD-OE1 3.24Å; R130-E132 WeakPolarHBondContact CB-OE2 3.32Å; R130-E132 PolarHBondContact O-N 3.03Å
133	L	86.2	Confident	82.4	Confident	62 Å²	62	57.7 Å²	57.7	33%	0.325	32%	0.32	S	S	.	.	P	Polyproline II helix	trans	-79.8	141	175.7	-61	172.3	0	0	0	109.9	L56 V60 L127	L56-L133 HydrophobicContact CD1-CD2 4Å; V60-L133 HydrophobicContact CB-CD2 4.31Å; V60-L133 HydrophobicContact CG2-CD2 3.36Å; L127-L133 HydrophobicContact CD2-CD2 4.23Å
134	F	87	Confident	81.8	Confident	27 Å²	27	60.1 Å²	60.1	12%	0.118	32%	0.316	C	S	.	.	P	Polyproline II helix	trans	-85.1	164	171.7	-58.2	-49.9	0	0	0	111.8	R63 G125 K138 Y139 L142	R63-F134 VanDerWaalsContact CD-O 3.24Å; R63-F134 WeakPolarHBondContact CD-O 3.47Å; R63-F134 PolarHBondContact NE-O 3.26Å; G125-F134 VanDerWaalsContact O-CE2 3.24Å; G125-F134 WeakPolarHBondContact O-CE2 3.25Å; F134-K138 HydrophobicContact CB-CB 4.05Å; F134-K138 HydrophobicContact CB-CD 3.86Å; F134-K138 HydrophobicContact CB-CG 4.04Å; F134-K138 HydrophobicContact CD1-CD 3.71Å; F134-K138 VanDerWaalsContact CD1-NZ 3.28Å; F134-K138 HydrophobicContact CD2-CD 4.33Å; F134-K138 HydrophobicContact CE1-CD 4.38Å; F134-K138 HydrophobicContact CG-CD 3.69Å; F134-K138 HydrophobicContact CG-CG 4.17Å; F134-Y139 HydrophobicContact CB-CD2 4.14Å; F134-Y139 HydrophobicContact CB-CE1 4.21Å; F134-Y139 HydrophobicContact CB-CE2 3.78Å; F134-Y139 HydrophobicContact CB-CG 4.49Å; F134-Y139 AromaticContact CD2-CE1 3.88Å; F134-Y139 HydrophobicContact CD2-CE1 3.88Å; F134-Y139 PolarHBondContact N-OH 3.33Å; F134-Y139 VanDerWaalsContact N-OH 3.07Å; F134-Y139 WeakPolarHBondContact O-CE2 3.13Å; F134-L142 HydrophobicContact CD2-CD1 3.9Å; F134-L142 HydrophobicContact CE2-CD1 4.2Å
135	D	82.6	Confident	81.3	Confident	88 Å²	88	67.1 Å²	67.1	47%	0.471	34%	0.342	S	S	.	.	P	Polyproline II helix	trans	-68.4	161.9	168.4	67.8	40.9	0	0	0	111.4	A137 K138 Y139	D135-A137 PolarHBondContact O-N 3.32Å; D135-A137 WeakPolarHBondContact OD1-CA 3.27Å; D135-A137 WeakPolarHBondContact OD1-CB 3.29Å; D135-A137 PolarHBondContact OD1-N 3.48Å; D135-K138 PolarHBondContact O-N 3.35Å; D135-K138 WeakPolarHBondContact OD1-CB 3.42Å; D135-K138 PolarHBondContact OD1-N 3.28Å; D135-Y139 VanDerWaalsContact O-CD2 3.3Å; D135-Y139 WeakPolarHBondContact O-CD2 3.21Å; D135-Y139 PolarHBondContact O-N 2.82Å; D135-Y139 VanDerWaalsContact O-N 3.15Å
136	A	78.9	Confident	80.6	Confident	31 Å²	31	69.1 Å²	69.1	26%	0.256	34%	0.342	S	S	.	.	H	α-helix	trans	-63.9	-20.3	-178.2	0	0	0	0	0	113.3	R63 R140	R63-A136 WeakPolarHBondContact O-CB 3.43Å; A136-R140 WeakPolarHBondContact O-CG 3.29Å; A136-R140 PolarHBondContact O-N 3.04Å; A136-R140 PolarHBondContact O-NE 3.01Å
137	A	77.9	Confident	78.8	Confident	59 Å²	59	71.9 Å²	71.9	49%	0.488	37%	0.37	S	S	.	.	H	α-helix	trans	-77.3	-45.4	178.5	0	0	0	0	0	110.7	D135 Y139 R140 V141	D135-A137 PolarHBondContact O-N 3.32Å; D135-A137 WeakPolarHBondContact OD1-CA 3.27Å; D135-A137 WeakPolarHBondContact OD1-CB 3.29Å; D135-A137 PolarHBondContact OD1-N 3.48Å; A137-Y139 VanDerWaalsContact C-N 3.32Å; A137-Y139 PolarHBondContact O-N 3.28Å; A137-R140 WeakPolarHBondContact O-CB 3.25Å; A137-R140 PolarHBondContact O-N 3.04Å; A137-V141 PolarHBondContact O-N 3.23Å
138	K	82.7	Confident	76.3	Confident	98 Å²	98	76.2 Å²	76.2	43%	0.426	40%	0.401	S	S	.	.	H	α-helix	trans	-62.6	-39.3	175.5	-176	168.4	177.3	-170.8	0	111.5	F134 D135 R140 V141 L142	F134-K138 HydrophobicContact CB-CB 4.05Å; F134-K138 HydrophobicContact CB-CD 3.86Å; F134-K138 HydrophobicContact CB-CG 4.04Å; F134-K138 HydrophobicContact CD1-CD 3.71Å; F134-K138 VanDerWaalsContact CD1-NZ 3.28Å; F134-K138 HydrophobicContact CD2-CD 4.33Å; F134-K138 HydrophobicContact CE1-CD 4.38Å; F134-K138 HydrophobicContact CG-CD 3.69Å; F134-K138 HydrophobicContact CG-CG 4.17Å; D135-K138 PolarHBondContact O-N 3.35Å; D135-K138 WeakPolarHBondContact OD1-CB 3.42Å; D135-K138 PolarHBondContact OD1-N 3.28Å; K138-R140 VanDerWaalsContact C-N 3.32Å; K138-R140 PolarHBondContact O-N 3.1Å; K138-V141 PolarHBondContact O-N 3.41Å; K138-L142 HydrophobicContact CG-CD1 4.03Å; K138-L142 HydrophobicContact CG-CG 4.46Å; K138-L142 WeakPolarHBondContact O-CB 3.41Å; K138-L142 VanDerWaalsContact O-CG 3.3Å; K138-L142 WeakPolarHBondContact O-CG 3.37Å; K138-L142 PolarHBondContact O-N 3.08Å
139	Y	88.1	Confident	74.3	Confident	0 Å²	0	82.8 Å²	82.8	0%	0	44%	0.444	C	S	.	.	H	α-helix	trans	-61.3	-37.5	173.9	-80.4	-54.9	0	0	0	113.7	V60 R63 A64 W93 L126 F134 D135 A137 L142 A143	V60-Y139 HydrophobicContact CG1-CE1 3.8Å; R63-Y139 HydrophobicContact CB-CE2 4.41Å; R63-Y139 HydrophobicContact CG-CD2 4.42Å; R63-Y139 HydrophobicContact CG-CE2 4.37Å; A64-Y139 HydrophobicContact CB-CD1 4.24Å; A64-Y139 HydrophobicContact CB-CD2 4.17Å; A64-Y139 HydrophobicContact CB-CG 3.79Å; W93-Y139 HydrophobicContact CH2-CD1 4.22Å; L126-Y139 HydrophobicContact CB-CE1 4.22Å; L126-Y139 HydrophobicContact CD2-CD1 4.29Å; L126-Y139 HydrophobicContact CD2-CE1 4.48Å; L126-Y139 WeakPolarHBondContact O-CE1 3.48Å; L126-Y139 PolarHBondContact O-OH 3Å; F134-Y139 HydrophobicContact CB-CD2 4.14Å; F134-Y139 HydrophobicContact CB-CE1 4.21Å; F134-Y139 HydrophobicContact CB-CE2 3.78Å; F134-Y139 HydrophobicContact CB-CG 4.49Å; F134-Y139 AromaticContact CD2-CE1 3.88Å; F134-Y139 HydrophobicContact CD2-CE1 3.88Å; F134-Y139 PolarHBondContact N-OH 3.33Å; F134-Y139 VanDerWaalsContact N-OH 3.07Å; F134-Y139 WeakPolarHBondContact O-CE2 3.13Å; D135-Y139 VanDerWaalsContact O-CD2 3.3Å; D135-Y139 WeakPolarHBondContact O-CD2 3.21Å; D135-Y139 PolarHBondContact O-N 2.82Å; D135-Y139 VanDerWaalsContact O-N 3.15Å; A137-Y139 VanDerWaalsContact C-N 3.32Å; A137-Y139 PolarHBondContact O-N 3.28Å; Y139-L142 PolarHBondContact O-N 3.12Å; Y139-A143 VanDerWaalsContact O-CB 3.31Å; Y139-A143 WeakPolarHBondContact O-CB 3.3Å; Y139-A143 PolarHBondContact O-N 3.14Å
140	R	73.8	Confident	72	Confident	116 Å²	116	81.3 Å²	81.3	44%	0.438	44%	0.441	S	S	.	.	H	α-helix	trans	-63.5	-47.7	175.1	-72.5	174.2	-134.5	-178.7	-0.2	111.3	A136 A137 K138 L142 A143 D144	A136-R140 WeakPolarHBondContact O-CG 3.29Å; A136-R140 PolarHBondContact O-N 3.04Å; A136-R140 PolarHBondContact O-NE 3.01Å; A137-R140 WeakPolarHBondContact O-CB 3.25Å; A137-R140 PolarHBondContact O-N 3.04Å; K138-R140 VanDerWaalsContact C-N 3.32Å; K138-R140 PolarHBondContact O-N 3.1Å; R140-L142 VanDerWaalsContact C-N 3.28Å; R140-L142 PolarHBondContact O-N 2.91Å; R140-A143 WeakPolarHBondContact O-CB 3.44Å; R140-A143 PolarHBondContact O-N 2.86Å; R140-A143 VanDerWaalsContact O-N 3.14Å; R140-D144 VanDerWaalsContact O-CG 3.27Å; R140-D144 PolarHBondContact O-N 3.43Å
141	V	78.1	Confident	69.5	Low	89 Å²	89	78.7 Å²	78.7	54%	0.539	44%	0.443	S	S	.	.	H	α-helix	trans	-60.7	-39.3	177.3	176.9	0	0	0	0	111.7	A137 K138	A137-V141 PolarHBondContact O-N 3.23Å; K138-V141 PolarHBondContact O-N 3.41Å
142	L	79.6	Confident	66.6	Low	19 Å²	19	82.4 Å²	82.4	10%	0.099	47%	0.472	C	S	.	.	H	α-helix	trans	-69	-38.9	176.2	-71.3	168.4	0	0	0	111.9	G125 L126 F134 K138 Y139 R140 D144 R145 F146	G125-L142 VanDerWaalsContact O-CD1 3.31Å; G125-L142 WeakPolarHBondContact O-CD1 3.42Å; L126-L142 HydrophobicContact CD2-CB 3.97Å; L126-L142 HydrophobicContact CD2-CD1 4.29Å; F134-L142 HydrophobicContact CD2-CD1 3.9Å; F134-L142 HydrophobicContact CE2-CD1 4.2Å; K138-L142 HydrophobicContact CG-CD1 4.03Å; K138-L142 HydrophobicContact CG-CG 4.46Å; K138-L142 WeakPolarHBondContact O-CB 3.41Å; K138-L142 VanDerWaalsContact O-CG 3.3Å; K138-L142 WeakPolarHBondContact O-CG 3.37Å; K138-L142 PolarHBondContact O-N 3.08Å; Y139-L142 PolarHBondContact O-N 3.12Å; R140-L142 VanDerWaalsContact C-N 3.28Å; R140-L142 PolarHBondContact O-N 2.91Å; L142-D144 VanDerWaalsContact C-N 3.32Å; L142-D144 PolarHBondContact O-N 3.37Å; L142-R145 WeakPolarHBondContact O-CB 3.42Å; L142-R145 PolarHBondContact O-N 3.33Å; L142-F146 WeakPolarHBondContact O-CD2 3.41Å; L142-F146 WeakPolarHBondContact O-CE2 3.3Å
143	A	74.5	Confident	63.8	Low	23 Å²	23	89.8 Å²	89.8	19%	0.19	50%	0.496	C	S	.	.	H	α-helix	trans	-63.4	-37.6	177.3	0	0	0	0	0	112.1	W93 Y139 R140 R145 F146 G147	W93-A143 HydrophobicContact CZ2-CB 3.97Å; Y139-A143 VanDerWaalsContact O-CB 3.31Å; Y139-A143 WeakPolarHBondContact O-CB 3.3Å; Y139-A143 PolarHBondContact O-N 3.14Å; R140-A143 WeakPolarHBondContact O-CB 3.44Å; R140-A143 PolarHBondContact O-N 2.86Å; R140-A143 VanDerWaalsContact O-N 3.14Å; A143-R145 PolarHBondContact O-N 2.94Å; A143-F146 PolarHBondContact O-N 3.39Å; A143-G147 PolarHBondContact O-N 2.87Å
144	D	72	Confident	60.9	Low	120 Å²	120	98.7 Å²	98.7	64%	0.642	53%	0.525	S	S	*	.	H	α-helix	trans	-58.8	-29.4	177.7	-65.6	-22	0	0	0	112	R140 L142 F146 G147	R140-D144 VanDerWaalsContact O-CG 3.27Å; R140-D144 PolarHBondContact O-N 3.43Å; L142-D144 VanDerWaalsContact C-N 3.32Å; L142-D144 PolarHBondContact O-N 3.37Å; D144-F146 PolarHBondContact O-N 3.39Å; D144-G147 PolarHBondContact O-N 3.31Å; D144-G147 VanDerWaalsContact O-N 3.15Å
145	R	74.9	Confident	57.8	Low	198 Å²	198	108.6 Å²	108.6	75%	0.747	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66	-20.7	175.4	-62.8	-177.5	176.4	-168.2	-4.2	113.8	L142 A143	L142-R145 WeakPolarHBondContact O-CB 3.42Å; L142-R145 PolarHBondContact O-N 3.33Å; A143-R145 PolarHBondContact O-N 2.94Å
146	F	71.6	Confident	55.2	Low	73 Å²	73	110.2 Å²	110.2	32%	0.32	58%	0.577	S	S	.	*	T	Hydrogen-bonded Turn	trans	-99.3	-5.2	178.1	-58.2	-80.7	0	0	0	112.2	P94 W124 L142 A143 D144	P94-F146 HydrophobicContact CB-CB 4.37Å; P94-F146 HydrophobicContact CB-CD2 4.01Å; P94-F146 HydrophobicContact CB-CG 4.3Å; P94-F146 HydrophobicContact CG-CD2 3.92Å; P94-F146 HydrophobicContact CG-CE2 4.21Å; P94-F146 HydrophobicContact CG-CG 4.22Å; W124-F146 HydrophobicContact CB-CE1 4.47Å; W124-F146 HydrophobicContact CB-CZ 3.85Å; W124-F146 HydrophobicContact CG-CE1 4.36Å; W124-F146 HydrophobicContact CG-CZ 4.21Å; L142-F146 WeakPolarHBondContact O-CD2 3.41Å; L142-F146 WeakPolarHBondContact O-CE2 3.3Å; A143-F146 PolarHBondContact O-N 3.39Å; D144-F146 PolarHBondContact O-N 3.39Å
147	G	48.9	Very low	52.7	Low	58 Å²	58	117.5 Å²	117.5	60%	0.598	61%	0.606	S	S	*	*			trans	-107	72.8	-172.4	0	0	0	0	0	114.2	A143 D144	A143-G147 PolarHBondContact O-N 2.87Å; D144-G147 PolarHBondContact O-N 3.31Å; D144-G147 VanDerWaalsContact O-N 3.15Å
148	S	35	Very low	50.2	Low	98 Å²	98	120 Å²	120	69%	0.685	62%	0.617	S	S	*	*			trans	-163.5	109.8	147.5	-170.2	0	0	0	0	109.9	A150	S148-A150 PolarHBondContact O-N 2.93Å
149	P	39.9	Very low	47.4	Very low	140 Å²	140	121.7 Å²	121.7	91%	0.909	64%	0.636	S	S	*	*			trans	-90.2	73.2	174.3	34	-28.7	0	0	0	110.2
150	A	28.3	Very low	44.3	Very low	74 Å²	74	130 Å²	130	61%	0.612	68%	0.677	S	S	*	*	S	Bend	trans	-171.9	128.6	160.5	0	0	0	0	0	108.7	S148	S148-A150 PolarHBondContact O-N 2.93Å
151	D	27.6	Very low	42	Very low	160 Å²	160	129.7 Å²	129.7	86%	0.856	69%	0.69	S	S	*	*			trans	53.4	101.2	168	-66.5	-17.6	0	0	0	119.1
152	S	26.2	Very low	39.6	Very low	111 Å²	111	131.6 Å²	131.6	78%	0.776	70%	0.704	S	S	*	*			trans	-167.3	83.5	142.8	166.8	0	0	0	0	109.2	W154	S152-W154 PolarHBondContact O-N 3.39Å
153	W	25.1	Very low	37	Very low	242 Å²	242	136.6 Å²	136.6	92%	0.917	74%	0.735	S	S	*	*			trans	-54.6	129.7	159.8	-76.4	5.7	0	0	0	109.8	R155	W153-R155 PolarHBondContact O-N 2.86Å; W153-R155 VanDerWaalsContact O-N 3.12Å
154	W	25.6	Very low	34.5	Very low	248 Å²	248	140.4 Å²	140.4	94%	0.939	76%	0.76	S	S	*	*			trans	-34.9	107.5	177.6	-60.3	86.5	0	0	0	113.5	S152	S152-W154 PolarHBondContact O-N 3.39Å
155	R	22.7	Very low	32.2	Very low	236 Å²	236	146.3 Å²	146.3	89%	0.891	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-89.4	117	154.4	-78.3	-166.3	-171.6	-139.4	3.4	107.5	W153	W153-R155 PolarHBondContact O-N 2.86Å; W153-R155 VanDerWaalsContact O-N 3.12Å
156	P	28.2	Very low	29.7	Very low	122 Å²	122	148 Å²	148	79%	0.792	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-71.4	137.2	-177.8	24.5	-25.1	0	0	0	110.7
157	E	25.4	Very low	27.4	Very low	183 Å²	183	153.3 Å²	153.3	86%	0.855	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-58.4	144.3	174.4	-84.5	177.5	145.6	0	0	111.8	T159	E157-T159 PolarHBondContact O-N 2.66Å; E157-T159 VanDerWaalsContact O-N 3.15Å
158	P	26.2	Very low	26.2	Very low	112 Å²	112	158.9 Å²	158.9	73%	0.727	82%	0.821	S	S	*	*			trans	-73.4	110	-179.2	29.2	-30.4	0	0	0	110.5	M160	P158-M160 PolarHBondContact O-N 3.2Å
159	T	24.1	Very low	25.6	Very low	133 Å²	133	161.3 Å²	161.3	82%	0.816	83%	0.827	S	S	*	*			trans	19.5	97	137.4	52.4	0	0	0	0	116.2	E157	E157-T159 PolarHBondContact O-N 2.66Å; E157-T159 VanDerWaalsContact O-N 3.15Å
160	M	22.8	Very low	25.1	Very low	176 Å²	176	160.6 Å²	160.6	87%	0.867	82%	0.822	S	S	*	*			trans	-84.4	141.5	150.5	-82	-85.9	131.9	0	0	108.7	P158	P158-M160 PolarHBondContact O-N 3.2Å
161	P	26.2	Very low	24.9	Very low	109 Å²	109	165.3 Å²	165.3	71%	0.708	83%	0.832	S	S	*	*			trans	-78.5	157.8	-164.4	24.6	-19.1	0	0	0	113.2	T163	P161-T163 PolarHBondContact O-N 3.37Å
162	P	27.8	Very low	24.8	Very low	128 Å²	128	165.8 Å²	165.8	83%	0.831	83%	0.834	S	S	*	*			trans	-89.6	115	-154.3	33.7	-30.9	0	0	0	111.9	S164	P162-S164 PolarHBondContact O-N 3.34Å
163	T	24.5	Very low	24.6	Very low	124 Å²	124	168.7 Å²	168.7	76%	0.761	84%	0.839	S	S	*	*			trans	-87.5	103.7	160	38.9	0	0	0	0	109.6	P161 W165	P161-T163 PolarHBondContact O-N 3.37Å; T163-W165 PolarHBondContact O-N 2.88Å
164	S	22.1	Very low	24.6	Very low	103 Å²	103	168.8 Å²	168.8	72%	0.72	84%	0.839	S	S	*	*			trans	-27	119.9	164.9	58.1	0	0	0	0	115.7	P162	P162-S164 PolarHBondContact O-N 3.34Å
165	W	23.5	Very low	25.3	Very low	245 Å²	245	163.1 Å²	163.1	93%	0.928	83%	0.834	S	S	*	*			trans	-128.3	107.3	151.5	-73.3	76.7	0	0	0	107.4	T163	T163-W165 PolarHBondContact O-N 2.88Å
166	R	22.5	Very low	25.3	Very low	233 Å²	233	155.8 Å²	155.8	88%	0.879	83%	0.833	S	S	*	*			trans	-59.2	137.9	-179.2	-79.9	179.8	176.8	-169.7	-1.4	110.7
167	Q	21.9	Very low	25.2	Very low	184 Å²	184	153.4 Å²	153.4	86%	0.86	83%	0.83	S	S	*	*			trans	-14.5	121.9	151.5	-72.7	162.4	-29.3	0	0	114.9
168	L	23.8	Very low	25.8	Very low	175 Å²	175	151 Å²	151	92%	0.916	83%	0.83	S	S	*	*			trans	-133.7	118.4	151.5	-99.5	145.7	0	0	0	107.8
169	N	24.3	Very low	25.6	Very low	149 Å²	149	150.9 Å²	150.9	80%	0.797	84%	0.839	S	S	*	*			trans	-57.1	145.3	-171.5	-80.8	-28.6	0	0	0	114
170	P	28	Very low	25.5	Very low	126 Å²	126	148 Å²	148	82%	0.818	84%	0.835	S	S	*	*			trans	-96.4	91	174.2	35.9	-27.5	0	0	0	110.7
171	E	23.5	Very low	25.6	Very low	173 Å²	173	148.5 Å²	148.5	81%	0.808	84%	0.841	S	S	*	*			trans	-145.4	107.6	162.4	-72.4	-166.9	163.2	0	0	108.6
172	N	26.2	Very low	25.4	Very low	169 Å²	169	149.2 Å²	149.2	90%	0.904	85%	0.848	S	S	*	*			trans	176.6	73.7	147.2	-87.5	-23	0	0	0	109.3
173	I	22.7	Very low	25.1	Very low	172 Å²	172	154.5 Å²	154.5	88%	0.882	85%	0.852	S	S	*	*			trans	-108.1	105.6	163.4	-61.8	174.6	0	0	0	106.7
174	R	24.2	Very low	25	Very low	244 Å²	244	153.1 Å²	153.1	92%	0.921	85%	0.847	S	S	*	*			trans	-141	152.6	160	-82.3	-164.3	-179.8	-173.2	1.6	110.8
175	P	41.7	Very low	25.1	Very low	129 Å²	129	155.3 Å²	155.3	84%	0.838	85%	0.85	S	S	*	*			trans	-114.8	160.1	-145	38.4	-26	0	0	0	114.4
176	G	22.8	Very low	24.9	Very low	83 Å²	83	147.1 Å²	147.1	86%	0.856	84%	0.841	S	S	*	*			trans	154.5	135.4	166.7	0	0	0	0	0	109.5
177	G	24.2	Very low	24.9	Very low	71 Å²	71	144.6 Å²	144.6	73%	0.732	83%	0.832	S	S	*	*			cis	-170.1	-179	4.4	0	0	0	0	0	106.7
178	P	38.9	Very low	24.9	Very low	133 Å²	133	144 Å²	144	86%	0.864	83%	0.829	S	S	*	*			trans	-90.2	166.6	-164.3	35.9	-33.2	0	0	0	113.5
179	A	22.1	Very low	24.9	Very low	110 Å²	110	141.9 Å²	141.9	91%	0.909	82%	0.815	S	S	*	*			trans	113.7	140.1	158.6	0	0	0	0	0	115.8
180	G	22.8	Very low	24.9	Very low	72 Å²	72	142.6 Å²	142.6	74%	0.742	81%	0.813	S	S	*	*			trans	134.7	69.5	162.2	0	0	0	0	0	114.8	S182	G180-S182 PolarHBondContact O-N 2.75Å
181	L	24.2	Very low	24.8	Very low	187 Å²	187	143.1 Å²	143.1	98%	0.979	81%	0.805	S	S	*	*			trans	-48.2	117.6	156.4	-74.1	150	0	0	0	109.2
182	S	22.2	Very low	24.9	Very low	124 Å²	124	140.5 Å²	140.5	87%	0.867	80%	0.796	S	S	*	*			trans	-144.7	139.8	164	-154.5	0	0	0	0	113.1	G180	G180-S182 PolarHBondContact O-N 2.75Å
183	R	20.8	Very low	24.9	Very low	239 Å²	239	141.6 Å²	141.6	90%	0.902	80%	0.796	S	S	*	*			trans	-70.8	142.3	-159.8	-75.2	161.8	161.4	169.1	-6.8	111.7	L185	R183-L185 PolarHBondContact O-N 3.26Å
184	S	23.1	Very low	25	Very low	95 Å²	95	140.3 Å²	140.3	66%	0.664	79%	0.786	S	S	*	*			trans	-82.1	113.3	179.4	116.9	0	0	0	0	110	R44	R44-S184 PolarHBondContact NH2-OG 3.06Å
185	L	22.9	Very low	25.3	Very low	149 Å²	149	135.3 Å²	135.3	78%	0.78	77%	0.773	S	S	*	*			trans	-57.2	129	165.8	-76.9	147.8	0	0	0	110.5	R44 R183	R44-L185 PolarHBondContact NH1-O 3.28Å; R44-L185 PolarHBondContact NH2-O 2.81Å; R183-L185 PolarHBondContact O-N 3.26Å
186	G	21	Very low	24.9	Very low	73 Å²	73	136 Å²	136	75%	0.753	77%	0.765	S	S	*	*			trans	-76.8	152.7	171	0	0	0	0	0	111.5
187	R	21.9	Very low	25.4	Very low	180 Å²	180	138.8 Å²	138.8	68%	0.679	76%	0.76	S	S	*	*			trans	-142.6	108.9	174.2	-166.9	178.4	-169.7	-156.3	7.7	108.2
188	E	20.9	Very low	26.3	Very low	172 Å²	172	139.2 Å²	139.2	80%	0.804	74%	0.743	S	S	*	*			trans	36.3	103.8	141.7	-62.3	161.7	176.2	0	0	116.7
189	E	24.4	Very low	26.5	Very low	130 Å²	130	138 Å²	138	61%	0.607	73%	0.725	S	S	*	*			trans	-97.4	115	168	-67.1	-176.9	158.6	0	0	108.2
190	E	24.1	Very low	27.7	Very low	164 Å²	164	133.8 Å²	133.8	77%	0.766	69%	0.693	S	S	*	*			trans	-71.1	126.6	168.2	-70.3	-179.8	140.7	0	0	109.1
191	E	26.3	Very low	29.2	Very low	137 Å²	137	133 Å²	133	64%	0.64	67%	0.674	S	S	*	*			trans	-81	116.2	177	-67.9	177.8	158.6	0	0	109.3	E193 R687	E191-E193 PolarHBondContact O-N 2.83Å; E191-R687 VanDerWaalsContact CD-NH2 3.26Å; E191-R687 IonicContact OE1-CZ 2.68Å; E191-R687 IonicContact OE1-NH1 3.85Å; E191-R687 PolarHBondContact OE1-NH1 2.74Å; E191-R687 IonicContact OE1-NH2 3.77Å; E191-R687 PolarHBondContact OE1-NH2 3.32Å; E191-R687 IonicContact OE2-NH2 2.79Å; E191-R687 PolarHBondContact OE2-NH2 2.99Å
192	D	25.4	Very low	31	Very low	117 Å²	117	125.6 Å²	125.6	63%	0.626	64%	0.635	S	S	*	*			trans	-75.2	100.2	173.5	-70.2	-47.4	0	0	0	109.4	E194	D192-E194 PolarHBondContact O-N 3.23Å; D192-E194 VanDerWaalsContact O-N 3.11Å
193	E	26	Very low	33.1	Very low	193 Å²	193	119.8 Å²	119.8	90%	0.902	59%	0.594	S	S	*	*			trans	-70	90.6	161.3	-71.7	-174.7	159.9	0	0	109.4	E191	E191-E193 PolarHBondContact O-N 2.83Å
194	E	26	Very low	35.2	Very low	144 Å²	144	108.4 Å²	108.4	67%	0.673	55%	0.551	S	S	*	*			trans	-116.5	68.6	166.6	-71.9	-172.8	172	0	0	109.9	D192 E196	D192-E194 PolarHBondContact O-N 3.23Å; D192-E194 VanDerWaalsContact O-N 3.11Å; E194-E196 PolarHBondContact O-N 3.47Å
195	E	30.8	Very low	37.2	Very low	139 Å²	139	104.5 Å²	104.5	65%	0.65	52%	0.523	S	S	*	.			trans	-73.2	93.9	142.6	-82	-166.3	170.9	0	0	105.8	L197	E195-L197 PolarHBondContact O-N 3.46Å
196	E	31.6	Very low	39.3	Very low	143 Å²	143	101.6 Å²	101.6	67%	0.668	51%	0.506	S	S	*	.			trans	-42	106.3	169.8	-72.6	179.3	151.7	0	0	108.4	E194 E198	E194-E196 PolarHBondContact O-N 3.47Å; E196-E198 PolarHBondContact O-N 2.8Å
197	L	34.4	Very low	41.4	Very low	143 Å²	143	99.3 Å²	99.3	75%	0.749	48%	0.475	S	S	*	.			trans	-60.6	88.3	165.6	-76.3	164.8	0	0	0	105.6	E195 E199	E195-L197 PolarHBondContact O-N 3.46Å; L197-E199 PolarHBondContact O-N 2.9Å
198	E	43.4	Very low	43.6	Very low	80 Å²	80	91.6 Å²	91.6	37%	0.374	45%	0.447	S	S	.	.			trans	-56.5	110.3	-179.4	-78.1	-167.4	126.9	0	0	107.3	E196 G200 R1064	E196-E198 PolarHBondContact O-N 2.8Å; E198-G200 PolarHBondContact O-N 2.92Å; E198-G200 VanDerWaalsContact O-N 3.14Å; E198-R1064 VanDerWaalsContact CD-NH2 3.29Å; E198-R1064 IonicContact OE1-CZ 3.64Å; E198-R1064 IonicContact OE1-NH2 2.68Å; E198-R1064 PolarHBondContact OE1-NH2 3.4Å; E198-R1064 IonicContact OE2-CZ 3.43Å; E198-R1064 IonicContact OE2-NH1 2.64Å; E198-R1064 PolarHBondContact OE2-NH1 2.86Å; E198-R1064 IonicContact OE2-NH2 2.69Å; E198-R1064 PolarHBondContact OE2-NH2 2.76Å
199	E	42.2	Very low	45.6	Very low	106 Å²	106	86.3 Å²	86.3	50%	0.495	43%	0.43	S	S	.	.			trans	-46.5	123.4	177	-71.8	178.7	163.4	0	0	109	L197 T201 Q1038	L197-E199 PolarHBondContact O-N 2.9Å; E199-T201 WeakPolarHBondContact O-CG2 3.01Å; E199-T201 PolarHBondContact O-N 2.95Å; E199-Q1038 PolarHBondContact OE1-NE2 3.39Å
200	G	47.5	Very low	47.4	Very low	23 Å²	23	85.2 Å²	85.2	24%	0.237	43%	0.426	C	S	.	.			trans	-46.3	128.6	-179.2	0	0	0	0	0	111.3	E198 R1037	E198-G200 PolarHBondContact O-N 2.92Å; E198-G200 VanDerWaalsContact O-N 3.14Å; G200-R1037 VanDerWaalsContact O-CB 3.23Å; G200-R1037 WeakPolarHBondContact O-CB 3.33Å; G200-R1037 WeakPolarHBondContact O-CG 3.39Å; G200-R1037 PolarHBondContact O-N 3.31Å
201	T	55.3	Low	48.8	Very low	54 Å²	54	78.8 Å²	78.8	33%	0.331	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	146.3	-179.7	51.8	0	0	0	0	109.7	E199 K1034 T1036	E199-T201 WeakPolarHBondContact O-CG2 3.01Å; E199-T201 PolarHBondContact O-N 2.95Å; T201-K1034 HydrophobicContact CG2-CD 4.06Å; T201-K1034 HydrophobicContact CG2-CG 4.43Å; T201-T1036 HydrophobicContact CG2-CG2 4.43Å
202	I	61.2	Low	50	Low	32 Å²	32	79.2 Å²	79.2	16%	0.164	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	134.9	-176	-53.9	171.6	0	0	0	107.3	E206 F207 V1035 R1037	I202-E206 HydrophobicContact CG2-CB 3.83Å; I202-E206 HydrophobicContact CG2-CG 3.82Å; I202-F207 HydrophobicContact CG2-CB 4.11Å; I202-V1035 PolarHBondContact N-O 3.04Å; I202-V1035 PolarHBondContact O-N 2.95Å; I202-V1035 VanDerWaalsContact O-N 3.09Å; I202-R1037 HydrophobicContact CD1-CG 4.49Å
203	D	66.7	Low	50.7	Low	2 Å²	2	81.9 Å²	81.9	1%	0.011	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	148.9	174.2	-178.9	28.4	0	0	0	110	T205 E206 F207 R1031	D203-T205 VanDerWaalsContact C-N 3.26Å; D203-T205 PolarHBondContact O-N 2.73Å; D203-T205 PolarHBondContact OD2-OG1 2.86Å; D203-E206 HydrophobicContact CB-CB 4.3Å; D203-E206 PolarHBondContact O-N 3.03Å; D203-E206 VanDerWaalsContact O-N 3.12Å; D203-F207 PolarHBondContact O-N 3.5Å; D203-R1031 IonicContact OD2-NH1 2.73Å; D203-R1031 PolarHBondContact OD2-NH1 2.85Å
204	V	64.9	Low	51.2	Low	0 Å²	0	79.9 Å²	79.9	0%	0	40%	0.404	C	S	.	.	H	α-helix	trans	-57.2	-42.1	179.4	171.5	0	0	0	0	110.9	E206 F207 L208 L335 L338 V1035 F1041	V204-E206 VanDerWaalsContact C-N 3.34Å; V204-E206 PolarHBondContact O-N 2.87Å; V204-F207 PolarHBondContact O-N 2.93Å; V204-L208 HydrophobicContact CG1-CD1 4.03Å; V204-L208 HydrophobicContact CG1-CG 4.44Å; V204-L208 WeakPolarHBondContact O-CB 3.32Å; V204-L208 VanDerWaalsContact O-CG 3.22Å; V204-L208 WeakPolarHBondContact O-CG 3.33Å; V204-L208 PolarHBondContact O-N 3.41Å; V204-L335 HydrophobicContact CB-CD2 4.23Å; V204-L335 HydrophobicContact CG1-CB 4.22Å; V204-L335 HydrophobicContact CG1-CD2 3.66Å; V204-L335 VanDerWaalsContact CG1-O 3.28Å; V204-L335 WeakPolarHBondContact CG1-O 3.15Å; V204-L335 HydrophobicContact CG2-CD2 3.75Å; V204-L338 HydrophobicContact CG1-CD2 4.39Å; V204-L338 HydrophobicContact CG2-CD2 3.82Å; V204-V1035 HydrophobicContact CG2-CG2 4.41Å; V204-F1041 HydrophobicContact CG2-CE2 4.28Å
205	T	65.2	Low	51.5	Low	13 Å²	13	76.6 Å²	76.6	8%	0.08	40%	0.397	C	S	.	.	H	α-helix	trans	-66.1	-35.8	178.6	57.8	0	0	0	0	113.2	D203 S209 R1031	D203-T205 VanDerWaalsContact C-N 3.26Å; D203-T205 PolarHBondContact O-N 2.73Å; D203-T205 PolarHBondContact OD2-OG1 2.86Å; T205-S209 PolarHBondContact O-N 3.31Å; T205-S209 VanDerWaalsContact O-N 3.09Å; T205-S209 PolarHBondContact O-OG 3.02Å; T205-R1031 PolarHBondContact OG1-NH1 3.03Å; T205-R1031 VanDerWaalsContact OG1-NH1 3.15Å
206	E	66.4	Low	51.4	Low	89 Å²	89	78.8 Å²	78.8	42%	0.416	41%	0.406	S	S	.	.	H	α-helix	trans	-71.3	-44.1	177.8	-173.8	178.2	-169.3	0	0	111.1	I202 D203 V204 L208 S209 M210	I202-E206 HydrophobicContact CG2-CB 3.83Å; I202-E206 HydrophobicContact CG2-CG 3.82Å; D203-E206 HydrophobicContact CB-CB 4.3Å; D203-E206 PolarHBondContact O-N 3.03Å; D203-E206 VanDerWaalsContact O-N 3.12Å; V204-E206 VanDerWaalsContact C-N 3.34Å; V204-E206 PolarHBondContact O-N 2.87Å; E206-L208 VanDerWaalsContact C-N 3.31Å; E206-L208 PolarHBondContact O-N 2.73Å; E206-S209 WeakPolarHBondContact CA-OG 3.29Å; E206-S209 PolarHBondContact O-N 3.37Å; E206-S209 VanDerWaalsContact O-N 3.13Å; E206-S209 PolarHBondContact O-OG 3.41Å; E206-M210 WeakPolarHBondContact O-CG 3.3Å; E206-M210 PolarHBondContact O-N 3.13Å
207	F	65	Low	51.4	Low	25 Å²	25	79.2 Å²	79.2	11%	0.11	41%	0.414	C	S	.	.	H	α-helix	trans	-60.2	-40.5	174.1	-177.2	-94	0	0	0	112.1	I202 D203 V204 M210 T211 A328 L335 V1035	I202-F207 HydrophobicContact CG2-CB 4.11Å; D203-F207 PolarHBondContact O-N 3.5Å; V204-F207 PolarHBondContact O-N 2.93Å; F207-M210 PolarHBondContact O-N 3Å; F207-T211 HydrophobicContact CD1-CG2 4.31Å; F207-T211 HydrophobicContact CE1-CG2 3.82Å; F207-T211 HydrophobicContact CE2-CG2 4.49Å; F207-T211 HydrophobicContact CZ-CG2 3.92Å; F207-T211 PolarHBondContact O-N 3.27Å; F207-T211 PolarHBondContact O-OG1 3.28Å; F207-A328 HydrophobicContact CE1-CB 3.72Å; F207-A328 HydrophobicContact CE2-CB 4.33Å; F207-A328 HydrophobicContact CZ-CB 3.59Å; F207-L335 HydrophobicContact CD1-CD1 4.01Å; F207-L335 HydrophobicContact CE1-CD1 3.92Å; F207-V1035 HydrophobicContact CB-CB 4.42Å; F207-V1035 HydrophobicContact CB-CG2 4.3Å; F207-V1035 HydrophobicContact CD1-CG2 4.28Å; F207-V1035 HydrophobicContact CD2-CB 4.29Å; F207-V1035 HydrophobicContact CD2-CG1 3.76Å; F207-V1035 HydrophobicContact CE2-CG1 3.92Å; F207-V1035 HydrophobicContact CG-CB 4.26Å; F207-V1035 HydrophobicContact CG-CG1 4.12Å; F207-V1035 HydrophobicContact CG-CG2 4.13Å; F207-V1035 HydrophobicContact CZ-CG1 4.41Å
208	L	68	Low	51.3	Low	17 Å²	17	78 Å²	78	9%	0.089	41%	0.414	C	S	.	.	H	α-helix	trans	-65	-37.7	174.8	-73	172.8	0	0	0	112.3	V204 E206 T211 Q212 L332 L335 R336	V204-L208 HydrophobicContact CG1-CD1 4.03Å; V204-L208 HydrophobicContact CG1-CG 4.44Å; V204-L208 WeakPolarHBondContact O-CB 3.32Å; V204-L208 VanDerWaalsContact O-CG 3.22Å; V204-L208 WeakPolarHBondContact O-CG 3.33Å; V204-L208 PolarHBondContact O-N 3.41Å; E206-L208 VanDerWaalsContact C-N 3.31Å; E206-L208 PolarHBondContact O-N 2.73Å; L208-T211 WeakPolarHBondContact CA-OG1 3.41Å; L208-T211 PolarHBondContact O-OG1 2.86Å; L208-T211 VanDerWaalsContact O-OG1 3.1Å; L208-Q212 WeakPolarHBondContact O-CG 3.42Å; L208-Q212 PolarHBondContact O-N 2.87Å; L208-L332 HydrophobicContact CD2-CD2 4.47Å; L208-L335 WeakPolarHBondContact CD1-O 3.29Å; L208-L335 HydrophobicContact CD2-CB 4.13Å; L208-R336 HydrophobicContact CD2-CG 3.88Å
209	S	62.8	Low	50.7	Low	62 Å²	62	80.9 Å²	80.9	43%	0.434	43%	0.431	S	S	.	.	H	α-helix	trans	-67.6	-36.7	174.8	48.2	0	0	0	0	113	T205 E206	T205-S209 PolarHBondContact O-N 3.31Å; T205-S209 VanDerWaalsContact O-N 3.09Å; T205-S209 PolarHBondContact O-OG 3.02Å; E206-S209 WeakPolarHBondContact CA-OG 3.29Å; E206-S209 PolarHBondContact O-N 3.37Å; E206-S209 VanDerWaalsContact O-N 3.13Å; E206-S209 PolarHBondContact O-OG 3.41Å
210	M	61.8	Low	50.1	Low	106 Å²	106	86.8 Å²	86.8	52%	0.522	45%	0.449	S	S	.	.	H	α-helix	trans	-65.7	-42	176.3	-67.9	177.8	72.6	0	0	111.6	E206 F207 Q212 Q213	E206-M210 WeakPolarHBondContact O-CG 3.3Å; E206-M210 PolarHBondContact O-N 3.13Å; F207-M210 PolarHBondContact O-N 3Å; M210-Q212 VanDerWaalsContact C-N 3.35Å; M210-Q212 PolarHBondContact O-N 3.04Å; M210-Q213 PolarHBondContact O-N 3.26Å
211	T	53.2	Low	49.1	Very low	30 Å²	30	93 Å²	93	18%	0.184	48%	0.477	C	S	.	.	H	α-helix	trans	-73.6	-22.5	-178.4	47.7	0	0	0	0	114.1	F207 L208 Q213 D214 S215	F207-T211 HydrophobicContact CD1-CG2 4.31Å; F207-T211 HydrophobicContact CE1-CG2 3.82Å; F207-T211 HydrophobicContact CE2-CG2 4.49Å; F207-T211 HydrophobicContact CZ-CG2 3.92Å; F207-T211 PolarHBondContact O-N 3.27Å; F207-T211 PolarHBondContact O-OG1 3.28Å; L208-T211 WeakPolarHBondContact CA-OG1 3.41Å; L208-T211 PolarHBondContact O-OG1 2.86Å; L208-T211 VanDerWaalsContact O-OG1 3.1Å; T211-Q213 PolarHBondContact O-N 3.08Å; T211-D214 PolarHBondContact O-N 2.95Å; T211-S215 PolarHBondContact O-OG 3.06Å
212	Q	52.2	Low	47.9	Very low	146 Å²	146	95.5 Å²	95.5	68%	0.682	50%	0.497	S	S	*	.	H	α-helix	trans	-66.7	-21.2	173.9	-80.2	179.4	2.6	0	0	113.1	L208 M210 D214	L208-Q212 WeakPolarHBondContact O-CG 3.42Å; L208-Q212 PolarHBondContact O-N 2.87Å; M210-Q212 VanDerWaalsContact C-N 3.35Å; M210-Q212 PolarHBondContact O-N 3.04Å; Q212-D214 VanDerWaalsContact C-N 3.32Å
213	Q	40.8	Very low	46.3	Very low	172 Å²	172	105.7 Å²	105.7	80%	0.804	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.3	-18.9	175.6	-69.7	-176.9	-22.6	0	0	113.3	M210 T211	M210-Q213 PolarHBondContact O-N 3.26Å; T211-Q213 PolarHBondContact O-N 3.08Å
214	D	35.8	Very low	44.5	Very low	152 Å²	152	108.7 Å²	108.7	81%	0.813	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.7	3.1	-169.8	-79.4	-29.3	0	0	0	116.3	T211 Q212	T211-D214 PolarHBondContact O-N 2.95Å; Q212-D214 VanDerWaalsContact C-N 3.32Å
215	S	33.1	Very low	42.9	Very low	74 Å²	74	113 Å²	113	52%	0.517	61%	0.61	S	S	.	*			trans	-117.4	112.9	-169.2	50.3	0	0	0	0	116.3	T211	T211-S215 PolarHBondContact O-OG 3.06Å
216	H	28.3	Very low	41.5	Very low	185 Å²	185	116 Å²	116	86%	0.856	63%	0.631	S	S	*	*			trans	-96.1	139.1	164.6	-90.3	-79.6	0	0	0	112
217	N	30.7	Very low	40	Very low	153 Å²	153	120.9 Å²	120.9	82%	0.818	65%	0.651	S	S	*	*			trans	66.9	119.3	164.4	-80.1	-5.5	0	0	0	121.1
218	P	32.1	Very low	38.9	Very low	117 Å²	117	126.4 Å²	126.4	76%	0.76	68%	0.677	S	S	*	*			trans	-82.2	157	178.1	33.8	-34.3	0	0	0	114.1	R220	P218-R220 PolarHBondContact O-N 2.86Å
219	L	32.1	Very low	37.7	Very low	140 Å²	140	131.8 Å²	131.8	73%	0.733	70%	0.704	S	S	*	*			trans	-50.2	117.4	174.7	-73.2	142.4	0	0	0	111.7
220	R	28.4	Very low	37.3	Very low	231 Å²	231	131.7 Å²	131.7	87%	0.872	70%	0.7	S	S	*	*			trans	-91.5	112.2	173.4	-157.4	177.4	-178.6	-173.4	0.1	108.9	P218 S222	P218-R220 PolarHBondContact O-N 2.86Å; R220-S222 PolarHBondContact O-N 3.14Å
221	D	27.6	Very low	37.4	Very low	152 Å²	152	131.5 Å²	131.5	81%	0.813	70%	0.702	S	S	*	*			trans	-53.1	106.6	174.9	-84.7	-28	0	0	0	110.9
222	S	29.1	Very low	38.5	Very low	108 Å²	108	132 Å²	132	76%	0.755	70%	0.703	S	S	*	*			trans	-110.6	89.7	168.4	-58.8	0	0	0	0	108	R220 G224	R220-S222 PolarHBondContact O-N 3.14Å; S222-G224 PolarHBondContact O-N 2.86Å
223	R	27.6	Very low	39.9	Very low	245 Å²	245	129.3 Å²	129.3	93%	0.925	69%	0.693	S	S	*	*			trans	-70.7	112.2	165	-72	-178.2	-176.7	-175.1	1	107.9
224	G	29.2	Very low	42	Very low	66 Å²	66	121.9 Å²	121.9	68%	0.68	66%	0.661	S	S	*	*			trans	-178.2	81.5	176.7	0	0	0	0	0	110	S222 S226	S222-G224 PolarHBondContact O-N 2.86Å; G224-S226 PolarHBondContact O-N 2.7Å
225	G	31.2	Very low	44.3	Very low	91 Å²	91	114.8 Å²	114.8	94%	0.938	62%	0.623	S	S	*	*			trans	-77.3	90	167.7	0	0	0	0	0	109
226	S	35.3	Very low	46.9	Very low	76 Å²	76	115 Å²	115	53%	0.531	62%	0.617	S	S	.	*			trans	-109.7	128.6	167.6	55.2	0	0	0	0	109.8	G224 E228	G224-S226 PolarHBondContact O-N 2.7Å; S226-E228 PolarHBondContact O-N 2.72Å
227	F	35.7	Very low	49.7	Very low	190 Å²	190	112.9 Å²	112.9	83%	0.833	60%	0.602	S	S	*	*			trans	-67.4	76.8	166.6	-91	-98.5	0	0	0	108.9	M229	F227-M229 PolarHBondContact O-N 2.81Å
228	E	41.6	Very low	52.5	Low	141 Å²	141	105.7 Å²	105.7	66%	0.659	56%	0.563	S	S	*	*			trans	-92.6	103.2	172.7	-80.6	180	-169.9	0	0	109.9	S226 T230	S226-E228 PolarHBondContact O-N 2.72Å; E228-T230 PolarHBondContact O-N 3.3Å
229	M	43.9	Very low	55.2	Low	131 Å²	131	102.3 Å²	102.3	65%	0.645	54%	0.539	S	S	*	.			trans	-55.9	103.2	157.8	-77.2	-83.4	-123	0	0	107.1	F227 L277 V291	F227-M229 PolarHBondContact O-N 2.81Å; M229-L277 HydrophobicContact CE-CD1 3.84Å; M229-L277 HydrophobicContact CE-CD2 3.98Å; M229-L277 HydrophobicContact SD-CD1 4.11Å; M229-V291 HydrophobicContact CE-CG1 4.46Å; M229-V291 HydrophobicContact SD-CB 3.94Å; M229-V291 HydrophobicContact SD-CG1 3.5Å; M229-V291 WeakPolarHBondContact SD-CG1 3.06Å
230	T	54.1	Low	57.9	Low	60 Å²	60	101 Å²	101	37%	0.368	54%	0.536	S	S	.	.			trans	-80.4	140.5	-176.6	34.3	0	0	0	0	109.9	E228 S234 L307	E228-T230 PolarHBondContact O-N 3.3Å; T230-S234 WeakPolarHBondContact CB-OG 3.5Å; T230-L307 VanDerWaalsContact OG1-CD1 3.23Å; T230-L307 WeakPolarHBondContact OG1-CD1 3.46Å
231	D	64	Low	60.8	Low	102 Å²	102	93.6 Å²	93.6	55%	0.545	51%	0.512	S	S	.	.			trans	-47.8	137.5	177.7	-177.9	15.6	0	0	0	111.2	D233 S234 A235	D231-D233 PolarHBondContact O-N 3Å; D231-D233 VanDerWaalsContact O-N 3.17Å; D231-S234 WeakPolarHBondContact O-CB 3.32Å; D231-S234 PolarHBondContact O-N 2.68Å; D231-S234 PolarHBondContact O-OG 3.19Å; D231-A235 PolarHBondContact O-N 2.98Å
232	D	76.7	Confident	63.9	Low	41 Å²	41	86.5 Å²	86.5	22%	0.219	47%	0.474	C	S	.	.	H	α-helix	trans	-58.8	-33.9	-173.8	-155.3	6.8	0	0	0	110.9	S234 A235 I236 K293 K303	D232-S234 VanDerWaalsContact C-N 3.29Å; D232-S234 PolarHBondContact O-N 3.49Å; D232-A235 PolarHBondContact O-N 3.24Å; D232-I236 WeakPolarHBondContact O-CG1 3.06Å; D232-I236 PolarHBondContact O-N 3.48Å; D232-K293 VanDerWaalsContact CG-CE 3.5Å; D232-K293 WeakPolarHBondContact OD2-CE 3.38Å; D232-K303 IonicContact OD1-NZ 3.32Å; D232-K303 PolarHBondContact OD1-NZ 3.41Å; D232-K303 IonicContact OD2-NZ 3.68Å
233	D	81.6	Confident	66.7	Low	88 Å²	88	86.2 Å²	86.2	47%	0.471	47%	0.47	S	S	.	.	H	α-helix	trans	-59.8	-38	174.6	-79.1	3.8	0	0	0	112.7	D231 A235 I236 R237	D231-D233 PolarHBondContact O-N 3Å; D231-D233 VanDerWaalsContact O-N 3.17Å; D233-A235 VanDerWaalsContact C-N 3.33Å; D233-I236 PolarHBondContact O-N 3.04Å; D233-R237 WeakPolarHBondContact O-CG 3.04Å; D233-R237 PolarHBondContact O-N 3.36Å
234	S	83.9	Confident	69.7	Low	17 Å²	17	80 Å²	80	12%	0.119	45%	0.454	C	S	.	.	H	α-helix	trans	-67.5	-37.1	178.4	79	0	0	0	0	111.7	T230 D231 D232 A238	T230-S234 WeakPolarHBondContact CB-OG 3.5Å; D231-S234 WeakPolarHBondContact O-CB 3.32Å; D231-S234 PolarHBondContact O-N 2.68Å; D231-S234 PolarHBondContact O-OG 3.19Å; D232-S234 VanDerWaalsContact C-N 3.29Å; D232-S234 PolarHBondContact O-N 3.49Å; S234-A238 WeakPolarHBondContact O-CB 3.42Å; S234-A238 PolarHBondContact O-N 3.12Å
235	A	85.4	Confident	72.7	Confident	2 Å²	2	77 Å²	77	2%	0.017	42%	0.422	C	S	.	.	H	α-helix	trans	-72	-38	178.3	0	0	0	0	0	111.3	D231 D232 D233 A238 L239 K303 L307	D231-A235 PolarHBondContact O-N 2.98Å; D232-A235 PolarHBondContact O-N 3.24Å; D233-A235 VanDerWaalsContact C-N 3.33Å; A235-A238 PolarHBondContact O-N 2.92Å; A235-L239 WeakPolarHBondContact O-CB 3.47Å; A235-L239 PolarHBondContact O-N 2.82Å; A235-K303 HydrophobicContact CB-CB 4.05Å; A235-K303 HydrophobicContact CB-CD 4.27Å; A235-K303 HydrophobicContact CB-CG 4.25Å; A235-L307 HydrophobicContact CB-CD1 3.96Å; A235-L307 HydrophobicContact CB-CD2 4.23Å; A235-L307 HydrophobicContact CB-CG 4.09Å
236	I	85.6	Confident	75.6	Confident	79 Å²	79	75 Å²	75	41%	0.405	39%	0.388	S	S	.	.	H	α-helix	trans	-62.9	-49.6	173.3	-66.9	165.1	0	0	0	110.2	D232 D233 A238 L239 T240	D232-I236 WeakPolarHBondContact O-CG1 3.06Å; D232-I236 PolarHBondContact O-N 3.48Å; D233-I236 PolarHBondContact O-N 3.04Å; I236-A238 VanDerWaalsContact C-N 3.33Å; I236-A238 PolarHBondContact O-N 2.63Å; I236-L239 PolarHBondContact O-N 2.94Å; I236-L239 VanDerWaalsContact O-N 3.11Å; I236-T240 WeakPolarHBondContact O-CG2 3.44Å; I236-T240 PolarHBondContact O-N 3.36Å
237	R	88.3	Confident	78.2	Confident	141 Å²	141	75.9 Å²	75.9	53%	0.532	39%	0.387	S	S	.	.	H	α-helix	trans	-57.8	-44.5	175.8	-73.5	-172.4	-67.2	-104.1	1.6	111.9	D233 L239 T240 Q241	D233-R237 WeakPolarHBondContact O-CG 3.04Å; D233-R237 PolarHBondContact O-N 3.36Å; R237-L239 VanDerWaalsContact C-N 3.33Å; R237-L239 PolarHBondContact O-N 3.4Å; R237-T240 PolarHBondContact O-N 2.95Å; R237-T240 PolarHBondContact O-OG1 3.45Å; R237-Q241 PolarHBondContact O-N 3.05Å; R237-Q241 VanDerWaalsContact O-N 3.13Å
238	A	88.5	Confident	80.9	Confident	1 Å²	1	67.8 Å²	67.8	1%	0.008	35%	0.352	C	S	.	.	H	α-helix	trans	-61.3	-42	176.1	0	0	0	0	0	111.7	S234 A235 I236 T240 Q241 F242 A306 L307 K310	S234-A238 WeakPolarHBondContact O-CB 3.42Å; S234-A238 PolarHBondContact O-N 3.12Å; A235-A238 PolarHBondContact O-N 2.92Å; I236-A238 VanDerWaalsContact C-N 3.33Å; I236-A238 PolarHBondContact O-N 2.63Å; A238-T240 VanDerWaalsContact C-N 3.32Å; A238-T240 PolarHBondContact O-N 3.07Å; A238-Q241 WeakPolarHBondContact O-CB 3.35Å; A238-Q241 PolarHBondContact O-N 3.49Å; A238-Q241 VanDerWaalsContact O-N 3.1Å; A238-F242 WeakPolarHBondContact O-CD2 3.48Å; A238-F242 PolarHBondContact O-N 2.87Å; A238-A306 HydrophobicContact CB-CB 3.95Å; A238-L307 HydrophobicContact CB-CD2 4.11Å; A238-K310 HydrophobicContact CB-CB 4.32Å; A238-K310 HydrophobicContact CB-CD 4.17Å
239	L	89.5	Confident	83.3	Confident	47 Å²	47	61 Å²	61	25%	0.246	32%	0.32	C	S	.	.	H	α-helix	trans	-66	-33.3	178.6	-171.8	62.6	0	0	0	112.4	A235 I236 R237 Q241 F242 P245 N302 K303 A306	A235-L239 WeakPolarHBondContact O-CB 3.47Å; A235-L239 PolarHBondContact O-N 2.82Å; I236-L239 PolarHBondContact O-N 2.94Å; I236-L239 VanDerWaalsContact O-N 3.11Å; R237-L239 VanDerWaalsContact C-N 3.33Å; R237-L239 PolarHBondContact O-N 3.4Å; L239-Q241 VanDerWaalsContact C-N 3.32Å; L239-F242 CarbonylContact O-C 3.51Å; L239-F242 VanDerWaalsContact O-C 3.26Å; L239-F242 PolarHBondContact O-N 2.96Å; L239-P245 HydrophobicContact CD1-CG 3.95Å; L239-N302 HydrophobicContact CD1-CB 4.01Å; L239-K303 HydrophobicContact CD2-CG 4.09Å; L239-A306 HydrophobicContact CB-CB 4.04Å; L239-A306 HydrophobicContact CD1-CB 4.05Å
240	T	88.9	Confident	85.5	Confident	111 Å²	111	55.9 Å²	55.9	68%	0.681	30%	0.299	S	S	*	.	H	α-helix	trans	-66.5	-34.1	171.1	61.5	0	0	0	0	112.7	I236 R237 A238	I236-T240 WeakPolarHBondContact O-CG2 3.44Å; I236-T240 PolarHBondContact O-N 3.36Å; R237-T240 PolarHBondContact O-N 2.95Å; R237-T240 PolarHBondContact O-OG1 3.45Å; A238-T240 VanDerWaalsContact C-N 3.32Å; A238-T240 PolarHBondContact O-N 3.07Å
241	Q	89.8	Confident	87.1	Confident	77 Å²	77	58.9 Å²	58.9	36%	0.36	31%	0.307	S	S	.	.	H	α-helix	trans	-75.2	-31.5	177.5	-171.9	174.9	25.8	0	0	112.5	R237 A238 L239 N322	R237-Q241 PolarHBondContact O-N 3.05Å; R237-Q241 VanDerWaalsContact O-N 3.13Å; A238-Q241 WeakPolarHBondContact O-CB 3.35Å; A238-Q241 PolarHBondContact O-N 3.49Å; A238-Q241 VanDerWaalsContact O-N 3.1Å; L239-Q241 VanDerWaalsContact C-N 3.32Å; Q241-N322 PolarHBondContact O-ND2 3.31Å
242	F	91.4	Very high	88.2	Confident	2 Å²	2	54 Å²	54	1%	0.009	28%	0.281	C	S	.	.			trans	-126.5	84.2	-177.7	-58.3	-79.4	0	0	0	110	A238 L239 L244 P245 L248 C309 K310 K313 N322	A238-F242 WeakPolarHBondContact O-CD2 3.48Å; A238-F242 PolarHBondContact O-N 2.87Å; L239-F242 CarbonylContact O-C 3.51Å; L239-F242 VanDerWaalsContact O-C 3.26Å; L239-F242 PolarHBondContact O-N 2.96Å; F242-L244 VanDerWaalsContact C-N 3.28Å; F242-L244 PolarHBondContact O-N 2.94Å; F242-P245 HydrophobicContact CB-CB 4.15Å; F242-P245 VanDerWaalsContact O-CD 3.23Å; F242-P245 WeakPolarHBondContact O-CD 3.28Å; F242-L248 HydrophobicContact CD1-CD2 3.54Å; F242-L248 HydrophobicContact CE1-CD2 3.92Å; F242-C309 HydrophobicContact CB-CB 4.11Å; F242-C309 HydrophobicContact CD1-CB 3.65Å; F242-C309 HydrophobicContact CD2-CB 3.66Å; F242-C309 HydrophobicContact CE1-CB 3.87Å; F242-C309 HydrophobicContact CE2-CB 3.93Å; F242-C309 HydrophobicContact CG-CB 3.52Å; F242-C309 HydrophobicContact CZ-CB 4.02Å; F242-K310 HydrophobicContact CE2-CB 3.88Å; F242-K313 HydrophobicContact CE1-CD 4.34Å; F242-K313 HydrophobicContact CZ-CB 4.04Å; F242-K313 HydrophobicContact CZ-CD 3.8Å; F242-N322 HydrophobicContact CD1-CB 4.03Å; F242-N322 HydrophobicContact CE1-CB 3.85Å; F242-N322 VanDerWaalsContact CE1-CG 3.47Å; F242-N322 WeakPolarHBondContact CE1-OD1 3.36Å
243	P	87.7	Confident	88.7	Confident	103 Å²	103	52.1 Å²	52.1	67%	0.669	27%	0.27	S	S	*	.	S	Bend	trans	-66.3	-27.3	-173.2	23.2	-33.1	0	0	0	113.7	P245	P243-P245 VanDerWaalsContact C-CD 3.46Å; P243-P245 WeakPolarHBondContact O-CD 3.37Å
244	L	90.6	Very high	88.9	Confident	115 Å²	115	51.4 Å²	51.4	60%	0.602	26%	0.264	S	S	*	.	S	Bend	trans	-122	62.3	177.9	-64.1	174.9	0	0	0	111.2	F242 K246 N247 L248	F242-L244 VanDerWaalsContact C-N 3.28Å; F242-L244 PolarHBondContact O-N 2.94Å; L244-K246 PolarHBondContact O-N 2.7Å; L244-N247 HydrophobicContact CB-CB 4.29Å; L244-N247 PolarHBondContact O-N 2.71Å; L244-L248 PolarHBondContact O-N 3.33Å
245	P	92.5	Very high	88.9	Confident	2 Å²	2	53.6 Å²	53.6	1%	0.013	27%	0.274	C	S	.	.	H	α-helix	trans	-69.6	-39.7	-163.8	28.4	-32.5	0	0	0	112.4	L239 F242 P243 N247 L248 L249 N302 A305 A306 C309	L239-P245 HydrophobicContact CD1-CG 3.95Å; F242-P245 HydrophobicContact CB-CB 4.15Å; F242-P245 VanDerWaalsContact O-CD 3.23Å; F242-P245 WeakPolarHBondContact O-CD 3.28Å; P243-P245 VanDerWaalsContact C-CD 3.46Å; P243-P245 WeakPolarHBondContact O-CD 3.37Å; P245-N247 VanDerWaalsContact C-N 3.3Å; P245-N247 PolarHBondContact O-N 3.01Å; P245-L248 PolarHBondContact O-N 3.44Å; P245-L249 WeakPolarHBondContact O-CG 3.38Å; P245-L249 PolarHBondContact O-N 2.64Å; P245-N302 HydrophobicContact CG-CB 4.3Å; P245-N302 VanDerWaalsContact CG-O 3.32Å; P245-N302 WeakPolarHBondContact CG-O 3.36Å; P245-A305 HydrophobicContact CB-CB 3.82Å; P245-A305 HydrophobicContact CG-CB 3.93Å; P245-A306 HydrophobicContact CB-CB 3.94Å; P245-A306 HydrophobicContact CG-CB 4.12Å; P245-C309 PolarHBondContact O-SG 2.77Å
246	K	92.7	Very high	88.9	Confident	49 Å²	49	53.7 Å²	53.7	21%	0.213	28%	0.275	C	S	.	.	H	α-helix	trans	-60.3	-39.4	176.3	-66.9	-179.4	176.6	176.8	0	112.6	L244 A250 F268 E301 N302 A305	L244-K246 PolarHBondContact O-N 2.7Å; K246-A250 WeakPolarHBondContact O-CB 3.21Å; K246-A250 PolarHBondContact O-N 3.23Å; K246-F268 HydrophobicContact CD-CZ 4.38Å; K246-F268 HydrophobicContact CG-CE2 4.48Å; K246-F268 HydrophobicContact CG-CZ 4.05Å; K246-E301 VanDerWaalsContact CE-CB 3.43Å; K246-E301 VanDerWaalsContact NZ-CB 3.29Å; K246-E301 IonicContact NZ-OE2 3.17Å; K246-E301 PolarHBondContact NZ-OE2 3.2Å; K246-N302 VanDerWaalsContact CD-OD1 3.25Å; K246-N302 WeakPolarHBondContact CD-OD1 3.39Å; K246-N302 WeakPolarHBondContact CE-OD1 3.27Å; K246-A305 HydrophobicContact CG-CB 3.79Å
247	N	90.9	Very high	88.6	Confident	95 Å²	95	52 Å²	52	51%	0.508	27%	0.268	S	S	.	.	H	α-helix	trans	-69.6	-42.2	178.5	-69.5	-11.5	0	0	0	110.7	L244 P245 A250 K251	L244-N247 HydrophobicContact CB-CB 4.29Å; L244-N247 PolarHBondContact O-N 2.71Å; P245-N247 VanDerWaalsContact C-N 3.3Å; P245-N247 PolarHBondContact O-N 3.01Å; N247-A250 PolarHBondContact O-N 3.06Å; N247-K251 WeakPolarHBondContact O-CB 3.42Å; N247-K251 WeakPolarHBondContact O-CG 3.26Å; N247-K251 PolarHBondContact O-N 2.95Å
248	L	91.4	Very high	88	Confident	19 Å²	19	48.4 Å²	48.4	10%	0.099	27%	0.265	C	S	.	.	H	α-helix	trans	-62	-49.3	175.8	-179.3	59.6	0	0	0	111.1	F242 L244 P245 A250 K251 V252 C309 V318 N322 P324	F242-L248 HydrophobicContact CD1-CD2 3.54Å; F242-L248 HydrophobicContact CE1-CD2 3.92Å; L244-L248 PolarHBondContact O-N 3.33Å; P245-L248 PolarHBondContact O-N 3.44Å; L248-A250 VanDerWaalsContact C-N 3.34Å; L248-A250 PolarHBondContact O-N 2.79Å; L248-K251 PolarHBondContact O-N 2.78Å; L248-V252 HydrophobicContact CD1-CG2 4.05Å; L248-V252 HydrophobicContact CG-CG2 4.33Å; L248-V252 WeakPolarHBondContact O-CB 3.46Å; L248-V252 VanDerWaalsContact O-CG2 3.29Å; L248-V252 WeakPolarHBondContact O-CG2 3.27Å; L248-V252 PolarHBondContact O-N 3.27Å; L248-C309 HydrophobicContact CD2-CB 4.37Å; L248-V318 HydrophobicContact CD2-CG1 4.3Å; L248-N322 VanDerWaalsContact CD1-O 3.26Å; L248-N322 WeakPolarHBondContact CD1-O 3.49Å; L248-N322 HydrophobicContact CD2-CB 4.49Å; L248-N322 WeakPolarHBondContact CD2-O 3.29Å; L248-P324 HydrophobicContact CD1-CG 3.96Å
249	L	91.5	Very high	87.4	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-56.1	-47.5	175.4	-71.3	177.3	0	0	0	111.9	P245 K251 V252 I253 M266 L280 L282 A305 A308 L312	P245-L249 WeakPolarHBondContact O-CG 3.38Å; P245-L249 PolarHBondContact O-N 2.64Å; L249-K251 VanDerWaalsContact C-N 3.35Å; L249-K251 PolarHBondContact O-N 3.37Å; L249-V252 PolarHBondContact O-N 2.98Å; L249-I253 WeakPolarHBondContact O-CB 3.48Å; L249-I253 VanDerWaalsContact O-CG1 3.24Å; L249-I253 WeakPolarHBondContact O-CG1 3.08Å; L249-I253 PolarHBondContact O-N 2.84Å; L249-M266 HydrophobicContact CB-SD 3.74Å; L249-M266 HydrophobicContact CD1-SD 3.83Å; L249-M266 HydrophobicContact CG-SD 4.46Å; L249-L280 HydrophobicContact CD1-CD2 3.84Å; L249-L282 HydrophobicContact CD2-CD1 4.2Å; L249-A305 HydrophobicContact CD1-CB 3.77Å; L249-A308 HydrophobicContact CD1-CB 3.99Å; L249-A308 HydrophobicContact CD2-CB 4.08Å; L249-L312 HydrophobicContact CD2-CD1 3.46Å; L249-L312 VanDerWaalsContact CD2-CD1 3.46Å; L249-L312 HydrophobicContact CD2-CG 4.45Å
250	A	89.8	Confident	86.7	Confident	23 Å²	23	52.8 Å²	52.8	19%	0.19	30%	0.299	C	S	.	.	H	α-helix	trans	-60.6	-44.7	179	0	0	0	0	0	111.7	K246 N247 L248 Q254 A262 M266	K246-A250 WeakPolarHBondContact O-CB 3.21Å; K246-A250 PolarHBondContact O-N 3.23Å; N247-A250 PolarHBondContact O-N 3.06Å; L248-A250 VanDerWaalsContact C-N 3.34Å; L248-A250 PolarHBondContact O-N 2.79Å; A250-Q254 WeakPolarHBondContact O-CB 3.5Å; A250-Q254 WeakPolarHBondContact O-CG 3.43Å; A250-Q254 PolarHBondContact O-N 2.6Å; A250-A262 HydrophobicContact CB-CB 3.98Å; A250-M266 HydrophobicContact CB-CE 4.45Å
251	K	87.7	Confident	86.1	Confident	122 Å²	122	49.3 Å²	49.3	53%	0.53	28%	0.278	S	S	.	.	H	α-helix	trans	-61.8	-48.8	175.7	-77.2	-178.3	177.7	-173.9	0	111.7	N247 L248 L249 I253 Q254 I255 P324	N247-K251 WeakPolarHBondContact O-CB 3.42Å; N247-K251 WeakPolarHBondContact O-CG 3.26Å; N247-K251 PolarHBondContact O-N 2.95Å; L248-K251 PolarHBondContact O-N 2.78Å; L249-K251 VanDerWaalsContact C-N 3.35Å; L249-K251 PolarHBondContact O-N 3.37Å; K251-I253 PolarHBondContact O-N 2.92Å; K251-Q254 PolarHBondContact O-N 3.2Å; K251-I255 HydrophobicContact CB-CD1 4.47Å; K251-I255 WeakPolarHBondContact O-CB 3.27Å; K251-I255 WeakPolarHBondContact O-CD1 3.22Å; K251-I255 WeakPolarHBondContact O-CG1 3.12Å; K251-I255 PolarHBondContact O-N 3.02Å; K251-P324 HydrophobicContact CB-CG 3.9Å
252	V	88.5	Confident	85.8	Confident	0 Å²	0	46 Å²	46	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-57.4	-49.2	178.6	167.9	0	0	0	0	110.5	L248 L249 I255 A256 W284 L312 V318 P324 Y330	L248-V252 HydrophobicContact CD1-CG2 4.05Å; L248-V252 HydrophobicContact CG-CG2 4.33Å; L248-V252 WeakPolarHBondContact O-CB 3.46Å; L248-V252 VanDerWaalsContact O-CG2 3.29Å; L248-V252 WeakPolarHBondContact O-CG2 3.27Å; L248-V252 PolarHBondContact O-N 3.27Å; L249-V252 PolarHBondContact O-N 2.98Å; V252-I255 PolarHBondContact O-N 3.24Å; V252-A256 WeakPolarHBondContact O-CB 3.37Å; V252-A256 PolarHBondContact O-N 3.08Å; V252-W284 HydrophobicContact CG1-CH2 4.12Å; V252-W284 HydrophobicContact CG1-CZ3 3.64Å; V252-L312 HydrophobicContact CG1-CD1 4.13Å; V252-V318 HydrophobicContact CG2-CG2 4.04Å; V252-P324 HydrophobicContact CG2-CB 3.94Å; V252-P324 HydrophobicContact CG2-CG 4.06Å; V252-Y330 HydrophobicContact CG1-CE1 4.21Å; V252-Y330 WeakPolarHBondContact CG1-OH 3.35Å
253	I	87.2	Confident	85.3	Confident	1 Å²	1	52.9 Å²	52.9	1%	0.005	29%	0.294	C	S	.	.	H	α-helix	trans	-62.4	-48.6	179.5	-68.8	167.4	0	0	0	110.9	L249 K251 I255 A256 T257 A262 L265 M266 L282 W284	L249-I253 WeakPolarHBondContact O-CB 3.48Å; L249-I253 VanDerWaalsContact O-CG1 3.24Å; L249-I253 WeakPolarHBondContact O-CG1 3.08Å; L249-I253 PolarHBondContact O-N 2.84Å; K251-I253 PolarHBondContact O-N 2.92Å; I253-I255 VanDerWaalsContact C-N 3.34Å; I253-I255 PolarHBondContact O-N 3.05Å; I253-A256 PolarHBondContact O-N 2.86Å; I253-T257 PolarHBondContact O-N 2.94Å; I253-T257 PolarHBondContact O-OG1 3.38Å; I253-A262 HydrophobicContact CB-CB 4.13Å; I253-A262 HydrophobicContact CD1-CB 4.32Å; I253-A262 HydrophobicContact CG2-CB 3.99Å; I253-L265 HydrophobicContact CG2-CB 3.95Å; I253-L265 HydrophobicContact CG2-CD1 3.53Å; I253-L265 HydrophobicContact CG2-CG 4.35Å; I253-M266 HydrophobicContact CD1-CB 3.92Å; I253-L282 HydrophobicContact CD1-CD2 3.96Å; I253-W284 HydrophobicContact CG1-CE3 4.44Å
254	Q	85.5	Confident	85	Confident	74 Å²	74	53.6 Å²	53.6	35%	0.346	29%	0.292	S	S	.	.	H	α-helix	trans	-61.7	-42.2	179.7	-74.6	176.2	-37	0	0	111.9	A250 K251 S258 S259 S260 A262	A250-Q254 WeakPolarHBondContact O-CB 3.5Å; A250-Q254 WeakPolarHBondContact O-CG 3.43Å; A250-Q254 PolarHBondContact O-N 2.6Å; K251-Q254 PolarHBondContact O-N 3.2Å; Q254-S258 VanDerWaalsContact O-CA 3.25Å; Q254-S258 WeakPolarHBondContact O-CA 3.29Å; Q254-S258 PolarHBondContact O-N 3.31Å; Q254-S259 WeakPolarHBondContact CG-O 3.17Å; Q254-S260 PolarHBondContact NE2-O 3.33Å; Q254-S260 VanDerWaalsContact NE2-O 3.09Å; Q254-A262 HydrophobicContact CG-CB 4.49Å
255	I	84.4	Confident	84.7	Confident	62 Å²	62	50 Å²	50	32%	0.318	27%	0.273	S	S	.	.	H	α-helix	trans	-70.8	-39.4	179	-66.8	165	0	0	0	110.7	K251 V252 I253 P324 L325 H327 Y330	K251-I255 HydrophobicContact CB-CD1 4.47Å; K251-I255 WeakPolarHBondContact O-CB 3.27Å; K251-I255 WeakPolarHBondContact O-CD1 3.22Å; K251-I255 WeakPolarHBondContact O-CG1 3.12Å; K251-I255 PolarHBondContact O-N 3.02Å; V252-I255 PolarHBondContact O-N 3.24Å; I253-I255 VanDerWaalsContact C-N 3.34Å; I253-I255 PolarHBondContact O-N 3.05Å; I255-P324 HydrophobicContact CD1-CB 3.58Å; I255-P324 HydrophobicContact CD1-CG 3.89Å; I255-L325 WeakPolarHBondContact CG2-O 3.33Å; I255-H327 HydrophobicContact CG2-CB 4.19Å; I255-H327 VanDerWaalsContact O-CB 3.31Å; I255-H327 WeakPolarHBondContact O-CB 3.33Å; I255-H327 PolarHBondContact O-CD2 3.49Å; I255-Y330 HydrophobicContact CB-CE2 4.33Å; I255-Y330 HydrophobicContact CG2-CD2 4.02Å; I255-Y330 HydrophobicContact CG2-CE2 3.91Å
256	A	83.7	Confident	84.6	Confident	4 Å²	4	51.2 Å²	51.2	3%	0.033	28%	0.279	C	S	.	.	H	α-helix	trans	-73.4	-40.3	-177.2	0	0	0	0	0	113.3	V252 I253 W284 H327 Y330 N331	V252-A256 WeakPolarHBondContact O-CB 3.37Å; V252-A256 PolarHBondContact O-N 3.08Å; I253-A256 PolarHBondContact O-N 2.86Å; A256-W284 HydrophobicContact CB-CD2 4.44Å; A256-W284 HydrophobicContact CB-CH2 3.69Å; A256-W284 HydrophobicContact CB-CZ2 3.33Å; A256-W284 HydrophobicContact CB-CZ3 4.38Å; A256-H327 PolarHBondContact O-CD2 3.38Å; A256-Y330 HydrophobicContact CB-CD1 3.95Å; A256-Y330 HydrophobicContact CB-CD2 3.61Å; A256-Y330 HydrophobicContact CB-CE1 4.47Å; A256-Y330 HydrophobicContact CB-CE2 4.14Å; A256-Y330 HydrophobicContact CB-CG 3.5Å; A256-Y330 VanDerWaalsContact CB-CG 3.5Å; A256-N331 PolarHBondContact O-ND2 2.98Å
257	T	80.7	Confident	84.5	Confident	43 Å²	43	54.3 Å²	54.3	26%	0.264	29%	0.294	S	S	.	.	H	α-helix	trans	-102.1	-0.2	-174.4	69.6	0	0	0	0	113.7	I253 S259 L265 W284	I253-T257 PolarHBondContact O-N 2.94Å; I253-T257 PolarHBondContact O-OG1 3.38Å; T257-S259 PolarHBondContact O-N 3.25Å; T257-S259 VanDerWaalsContact OG1-CB 3.23Å; T257-S259 WeakPolarHBondContact OG1-CB 3.43Å; T257-S259 PolarHBondContact OG1-N 3.35Å; T257-S259 PolarHBondContact OG1-OG 3.29Å; T257-L265 HydrophobicContact CG2-CD1 3.93Å; T257-W284 HydrophobicContact CG2-CG 4.06Å
258	S	75.5	Confident	84.5	Confident	67 Å²	67	52.6 Å²	52.6	47%	0.469	28%	0.282	S	S	.	.			trans	53	21.3	-171.1	-72.2	0	0	0	0	113.8	Q254 H327	Q254-S258 VanDerWaalsContact O-CA 3.25Å; Q254-S258 WeakPolarHBondContact O-CA 3.29Å; Q254-S258 PolarHBondContact O-N 3.31Å; S258-H327 PolarHBondContact OG-CD2 3.36Å; S258-H327 PolarHBondContact OG-CE1 3.25Å; S258-H327 PolarHBondContact OG-NE2 2.98Å
259	S	75.2	Confident	84.5	Confident	47 Å²	47	57.6 Å²	57.6	33%	0.329	31%	0.305	S	S	.	.			trans	-77.1	140.5	-179.5	-70.1	0	0	0	0	111.4	Q254 T257 T261	Q254-S259 WeakPolarHBondContact CG-O 3.17Å; T257-S259 PolarHBondContact O-N 3.25Å; T257-S259 VanDerWaalsContact OG1-CB 3.23Å; T257-S259 WeakPolarHBondContact OG1-CB 3.43Å; T257-S259 PolarHBondContact OG1-N 3.35Å; T257-S259 PolarHBondContact OG1-OG 3.29Å; S259-T261 PolarHBondContact O-N 2.81Å
260	S	74.8	Confident	84.5	Confident	92 Å²	92	59.2 Å²	59.2	64%	0.643	32%	0.315	S	S	*	.	S	Bend	trans	-65.9	-25.1	176.2	61.3	0	0	0	0	112.8	Q254	Q254-S260 PolarHBondContact NE2-O 3.33Å; Q254-S260 VanDerWaalsContact NE2-O 3.09Å
261	T	77.3	Confident	84.4	Confident	39 Å²	39	61.3 Å²	61.3	24%	0.239	33%	0.325	C	S	.	.			trans	-140.6	144.5	179.1	73.9	0	0	0	0	112.2	S259	S259-T261 PolarHBondContact O-N 2.81Å
262	A	82.4	Confident	84.2	Confident	7 Å²	7	57.6 Å²	57.6	6%	0.058	32%	0.321	C	S	.	.	S	Bend	trans	-85	-10.4	173.9	0	0	0	0	0	113.5	A250 I253 Q254 N264 L265 M266	A250-A262 HydrophobicContact CB-CB 3.98Å; I253-A262 HydrophobicContact CB-CB 4.13Å; I253-A262 HydrophobicContact CD1-CB 4.32Å; I253-A262 HydrophobicContact CG2-CB 3.99Å; Q254-A262 HydrophobicContact CG-CB 4.49Å; A262-N264 VanDerWaalsContact C-N 3.26Å; A262-N264 PolarHBondContact O-N 2.85Å; A262-L265 PolarHBondContact O-N 2.81Å; A262-M266 HydrophobicContact CB-CE 4.49Å; A262-M266 WeakPolarHBondContact O-CB 3.33Å; A262-M266 PolarHBondContact O-N 3.24Å
263	K	81.8	Confident	83.8	Confident	147 Å²	147	63.5 Å²	63.5	64%	0.639	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-33.4	-171.2	-75	-169.3	176.1	-171.5	0	113.7	L265 M266	K263-L265 VanDerWaalsContact C-N 3.3Å; K263-M266 VanDerWaalsContact O-O 3.14Å
264	N	81	Confident	83.6	Confident	118 Å²	118	72.5 Å²	72.5	63%	0.631	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.5	-23.8	-178.6	-63	-7.7	0	0	0	112.2	A262	A262-N264 VanDerWaalsContact C-N 3.26Å; A262-N264 PolarHBondContact O-N 2.85Å
265	L	84.4	Confident	83.6	Confident	39 Å²	39	73.1 Å²	73.1	20%	0.204	41%	0.406	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.2	-8.7	-176.5	-62.9	173.1	0	0	0	112.8	I253 T257 A262 K263 L282 L283	I253-L265 HydrophobicContact CG2-CB 3.95Å; I253-L265 HydrophobicContact CG2-CD1 3.53Å; I253-L265 HydrophobicContact CG2-CG 4.35Å; T257-L265 HydrophobicContact CG2-CD1 3.93Å; A262-L265 PolarHBondContact O-N 2.81Å; K263-L265 VanDerWaalsContact C-N 3.3Å; L265-L282 WeakPolarHBondContact O-CA 3.44Å; L265-L283 HydrophobicContact CD2-CB 4.06Å; L265-L283 PolarHBondContact O-N 2.93Å
266	M	90.4	Very high	83.8	Confident	28 Å²	28	73 Å²	73	14%	0.138	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	108.7	-178	-179.3	179.1	67.3	0	0	110	L249 A250 I253 A262 K263 F268 L280 L282	L249-M266 HydrophobicContact CB-SD 3.74Å; L249-M266 HydrophobicContact CD1-SD 3.83Å; L249-M266 HydrophobicContact CG-SD 4.46Å; A250-M266 HydrophobicContact CB-CE 4.45Å; I253-M266 HydrophobicContact CD1-CB 3.92Å; A262-M266 HydrophobicContact CB-CE 4.49Å; A262-M266 WeakPolarHBondContact O-CB 3.33Å; A262-M266 PolarHBondContact O-N 3.24Å; K263-M266 VanDerWaalsContact O-O 3.14Å; M266-F268 HydrophobicContact CE-CE2 4.13Å; M266-F268 HydrophobicContact CG-CE2 3.97Å; M266-F268 HydrophobicContact SD-CE2 3.94Å; M266-F268 HydrophobicContact SD-CZ 4.32Å; M266-L280 HydrophobicContact CG-CD1 3.5Å; M266-L280 HydrophobicContact SD-CD1 4.37Å; M266-L282 HydrophobicContact CB-CD2 3.7Å; M266-L282 HydrophobicContact CG-CD2 3.59Å; M266-L282 HydrophobicContact SD-CD2 4.27Å
267	Q	90.3	Very high	84.1	Confident	114 Å²	114	75.4 Å²	75.4	53%	0.533	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	134.6	-177	-62.2	-179.6	3.8	0	0	111	L280 T281	Q267-L280 WeakPolarHBondContact O-CA 3.27Å; Q267-L280 WeakPolarHBondContact O-CD1 3.48Å; Q267-T281 PolarHBondContact N-O 3.37Å; Q267-T281 PolarHBondContact O-N 3.11Å
268	F	91.8	Very high	84.7	Confident	59 Å²	59	73.3 Å²	73.3	26%	0.259	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	131	174.9	-70.3	-88.6	0	0	0	110.2	K246 M266 T279 L280 E301 A305	K246-F268 HydrophobicContact CD-CZ 4.38Å; K246-F268 HydrophobicContact CG-CE2 4.48Å; K246-F268 HydrophobicContact CG-CZ 4.05Å; M266-F268 HydrophobicContact CE-CE2 4.13Å; M266-F268 HydrophobicContact CG-CE2 3.97Å; M266-F268 HydrophobicContact SD-CE2 3.94Å; M266-F268 HydrophobicContact SD-CZ 4.32Å; F268-T279 WeakPolarHBondContact CA-O 3.33Å; F268-L280 HydrophobicContact CD1-CB 3.97Å; F268-L280 HydrophobicContact CD1-CD1 3.91Å; F268-L280 HydrophobicContact CD1-CG 4.45Å; F268-L280 HydrophobicContact CD2-CD1 4.03Å; F268-L280 HydrophobicContact CE1-CB 3.76Å; F268-L280 HydrophobicContact CE1-CD1 3.57Å; F268-L280 HydrophobicContact CE1-CD2 3.94Å; F268-L280 HydrophobicContact CE1-CG 3.95Å; F268-L280 HydrophobicContact CE2-CD1 3.68Å; F268-L280 HydrophobicContact CG-CD1 4.13Å; F268-L280 HydrophobicContact CZ-CB 4.45Å; F268-L280 HydrophobicContact CZ-CD1 3.43Å; F268-L280 VanDerWaalsContact CZ-CD1 3.43Å; F268-L280 HydrophobicContact CZ-CD2 3.95Å; F268-L280 HydrophobicContact CZ-CG 4.14Å; F268-E301 HydrophobicContact CB-CG 4.31Å; F268-E301 HydrophobicContact CD1-CB 3.76Å; F268-E301 HydrophobicContact CD1-CG 3.71Å; F268-E301 HydrophobicContact CE1-CB 3.88Å; F268-E301 HydrophobicContact CE1-CG 4.34Å; F268-E301 WeakPolarHBondContact CE1-O 3.43Å; F268-E301 HydrophobicContact CG-CG 4.19Å; F268-A305 HydrophobicContact CE1-CB 4.35Å; F268-A305 HydrophobicContact CZ-CB 4.06Å
269	H	91.5	Very high	85.5	Confident	123 Å²	123	71.7 Å²	71.7	57%	0.569	39%	0.389	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.7	120.5	169.5	-175.1	74.9	0	0	0	108.8	V271 T279	H269-V271 VanDerWaalsContact NE2-CG1 3.3Å; H269-V271 WeakPolarHBondContact NE2-CG1 3.49Å; H269-T279 PolarHBondContact N-O 2.57Å; H269-T279 PolarHBondContact O-N 2.68Å
270	T	89.9	Confident	86.3	Confident	34 Å²	34	69.4 Å²	69.4	21%	0.209	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	128	-178.2	-56.3	0	0	0	0	110.9	K276 L277 A278 K297 E301	T270-K276 HydrophobicContact CG2-CB 3.85Å; T270-K276 HydrophobicContact CG2-CD 4.48Å; T270-L277 CarbonylContact C-O 3.42Å; T270-L277 VanDerWaalsContact CA-O 3.3Å; T270-L277 WeakPolarHBondContact CA-O 3.38Å; T270-A278 HydrophobicContact CG2-CB 4.26Å; T270-A278 WeakPolarHBondContact OG1-CB 3.37Å; T270-K297 HydrophobicContact CG2-CB 4.39Å; T270-K297 HydrophobicContact CG2-CG 4.07Å; T270-E301 PolarHBondContact OG1-OE1 3.34Å
271	V	89	Confident	87.2	Confident	67 Å²	67	67.3 Å²	67.3	41%	0.406	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	163	179	-66.4	0	0	0	0	111.5	H269 K276 L277	H269-V271 VanDerWaalsContact NE2-CG1 3.3Å; H269-V271 WeakPolarHBondContact NE2-CG1 3.49Å; V271-K276 WeakPolarHBondContact O-CA 3.2Å; V271-L277 HydrophobicContact CG2-CB 4.17Å; V271-L277 PolarHBondContact N-O 2.95Å; V271-L277 PolarHBondContact O-N 2.89Å
272	G	83.8	Confident	87.8	Confident	44 Å²	44	65.5 Å²	65.5	45%	0.454	35%	0.345	S	S	.	.			trans	102.6	158.7	176.8	0	0	0	0	0	114.8	K276	G272-K276 WeakPolarHBondContact O-CD 3.35Å; G272-K276 WeakPolarHBondContact O-CE 3.21Å; G272-K276 PolarHBondContact O-NZ 3.18Å
273	T	80.3	Confident	88	Confident	124 Å²	124	69 Å²	69	76%	0.761	36%	0.363	S	S	*	.	S	Bend	trans	-103.2	-71	-176.7	52.8	0	0	0	0	112.3	K276	T273-K276 WeakPolarHBondContact O-CE 3.27Å; T273-K276 PolarHBondContact O-NZ 3.27Å
274	K	82.9	Confident	88.2	Confident	191 Å²	191	64.1 Å²	64.1	83%	0.83	34%	0.34	S	S	*	.	S	Bend	trans	-74.5	-41.8	179.8	-68	-175.5	179	-180	0	112.8
275	T	85.4	Confident	88.2	Confident	87 Å²	87	61.2 Å²	61.2	53%	0.534	33%	0.328	S	S	.	.	S	Bend	trans	-116.1	122.1	173.8	-51.4	0	0	0	0	107.4	K293	T275-K293 HydrophobicContact CG2-CB 4.11Å
276	K	87.7	Confident	88.1	Confident	59 Å²	59	62.4 Å²	62.4	26%	0.257	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	124.5	179	-58.3	-62.1	-179.6	177	0	108.5	T270 V271 G272 T273 K293 G294 A300	T270-K276 HydrophobicContact CG2-CB 3.85Å; T270-K276 HydrophobicContact CG2-CD 4.48Å; V271-K276 WeakPolarHBondContact O-CA 3.2Å; G272-K276 WeakPolarHBondContact O-CD 3.35Å; G272-K276 WeakPolarHBondContact O-CE 3.21Å; G272-K276 PolarHBondContact O-NZ 3.18Å; T273-K276 WeakPolarHBondContact O-CE 3.27Å; T273-K276 PolarHBondContact O-NZ 3.27Å; K276-K293 CarbonylContact O-C 3.55Å; K276-K293 VanDerWaalsContact O-CA 3.31Å; K276-K293 WeakPolarHBondContact O-CA 3.3Å; K276-G294 PolarHBondContact N-O 3.21Å; K276-G294 PolarHBondContact O-N 3.32Å; K276-A300 HydrophobicContact CB-CB 4.14Å; K276-A300 WeakPolarHBondContact O-CB 3.35Å
277	L	90.7	Very high	87.9	Confident	54 Å²	54	66 Å²	66	28%	0.283	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	112.7	172.2	-172	71.3	0	0	0	107.9	M229 T270 V271 V291 K293	M229-L277 HydrophobicContact CE-CD1 3.84Å; M229-L277 HydrophobicContact CE-CD2 3.98Å; M229-L277 HydrophobicContact SD-CD1 4.11Å; T270-L277 CarbonylContact C-O 3.42Å; T270-L277 VanDerWaalsContact CA-O 3.3Å; T270-L277 WeakPolarHBondContact CA-O 3.38Å; V271-L277 HydrophobicContact CG2-CB 4.17Å; V271-L277 PolarHBondContact N-O 2.95Å; V271-L277 PolarHBondContact O-N 2.89Å; L277-V291 HydrophobicContact CD1-CG1 3.58Å; L277-V291 HydrophobicContact CD2-CG1 4.22Å; L277-V291 HydrophobicContact CG-CG1 3.79Å; L277-K293 HydrophobicContact CD1-CB 4.26Å
278	A	91.6	Very high	87.9	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	127.5	179.1	0	0	0	0	0	110.3	T270 V291 A292 A300 E301	T270-A278 HydrophobicContact CG2-CB 4.26Å; T270-A278 WeakPolarHBondContact OG1-CB 3.37Å; A278-V291 WeakPolarHBondContact O-CA 3.35Å; A278-A292 PolarHBondContact N-O 3.41Å; A278-A292 PolarHBondContact O-N 3.29Å; A278-A300 HydrophobicContact CB-CB 3.59Å; A278-E301 HydrophobicContact CB-CB 4.33Å; A278-E301 HydrophobicContact CB-CG 3.77Å
279	T	92.9	Very high	87.9	Confident	32 Å²	32	62.2 Å²	62.2	20%	0.196	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	119.5	173.6	-57.9	0	0	0	0	108.8	F268 H269 T289 F290 V291	F268-T279 WeakPolarHBondContact CA-O 3.33Å; H269-T279 PolarHBondContact N-O 2.57Å; H269-T279 PolarHBondContact O-N 2.68Å; T279-T289 HydrophobicContact CG2-CG2 3.34Å; T279-F290 CarbonylContact C-O 3.51Å; T279-F290 WeakPolarHBondContact CA-O 3.41Å; T279-V291 HydrophobicContact CG2-CG2 3.94Å
280	L	93.3	Very high	88	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	119.4	174.2	170.9	59.8	0	0	0	109.3	L249 M266 Q267 F268 L282 T289 F290 A304 A305 A308	L249-L280 HydrophobicContact CD1-CD2 3.84Å; M266-L280 HydrophobicContact CG-CD1 3.5Å; M266-L280 HydrophobicContact SD-CD1 4.37Å; Q267-L280 WeakPolarHBondContact O-CA 3.27Å; Q267-L280 WeakPolarHBondContact O-CD1 3.48Å; F268-L280 HydrophobicContact CD1-CB 3.97Å; F268-L280 HydrophobicContact CD1-CD1 3.91Å; F268-L280 HydrophobicContact CD1-CG 4.45Å; F268-L280 HydrophobicContact CD2-CD1 4.03Å; F268-L280 HydrophobicContact CE1-CB 3.76Å; F268-L280 HydrophobicContact CE1-CD1 3.57Å; F268-L280 HydrophobicContact CE1-CD2 3.94Å; F268-L280 HydrophobicContact CE1-CG 3.95Å; F268-L280 HydrophobicContact CE2-CD1 3.68Å; F268-L280 HydrophobicContact CG-CD1 4.13Å; F268-L280 HydrophobicContact CZ-CB 4.45Å; F268-L280 HydrophobicContact CZ-CD1 3.43Å; F268-L280 VanDerWaalsContact CZ-CD1 3.43Å; F268-L280 HydrophobicContact CZ-CD2 3.95Å; F268-L280 HydrophobicContact CZ-CG 4.14Å; L280-L282 HydrophobicContact CD1-CD2 4.28Å; L280-L282 HydrophobicContact CD2-CG 4.41Å; L280-L282 HydrophobicContact CG-CG 4.28Å; L280-T289 CarbonylContact O-C 3.54Å; L280-T289 VanDerWaalsContact O-CA 3.28Å; L280-T289 WeakPolarHBondContact O-CA 3.24Å; L280-F290 HydrophobicContact CB-CB 4.37Å; L280-F290 PolarHBondContact N-O 3.02Å; L280-F290 PolarHBondContact O-N 3.3Å; L280-A304 HydrophobicContact CB-CB 4Å; L280-A305 HydrophobicContact CD2-CB 4.25Å; L280-A308 HydrophobicContact CD2-CB 3.76Å
281	T	92.1	Very high	88	Confident	47 Å²	47	56.9 Å²	56.9	29%	0.288	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	119.2	171.9	-52.1	0	0	0	0	109.1	Q267 L283	Q267-T281 PolarHBondContact N-O 3.37Å; Q267-T281 PolarHBondContact O-N 3.11Å; T281-L283 HydrophobicContact CG2-CD2 4.44Å
282	L	90.8	Very high	88.1	Confident	1 Å²	1	54 Å²	54	1%	0.005	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	133.4	171.6	-70.7	-177.9	0	0	0	109.2	L249 I253 L265 M266 L280 P287 M288 F290 A308	L249-L282 HydrophobicContact CD2-CD1 4.2Å; I253-L282 HydrophobicContact CD1-CD2 3.96Å; L265-L282 WeakPolarHBondContact O-CA 3.44Å; M266-L282 HydrophobicContact CB-CD2 3.7Å; M266-L282 HydrophobicContact CG-CD2 3.59Å; M266-L282 HydrophobicContact SD-CD2 4.27Å; L280-L282 HydrophobicContact CD1-CD2 4.28Å; L280-L282 HydrophobicContact CD2-CG 4.41Å; L280-L282 HydrophobicContact CG-CG 4.28Å; L282-P287 CarbonylContact O-C 3.59Å; L282-P287 WeakPolarHBondContact O-CA 3.19Å; L282-M288 PolarHBondContact N-O 3.19Å; L282-M288 PolarHBondContact O-N 2.7Å; L282-F290 HydrophobicContact CD1-CE2 4Å; L282-A308 HydrophobicContact CD1-CB 3.71Å
283	L	86.8	Confident	88.4	Confident	82 Å²	82	56.8 Å²	56.8	43%	0.429	31%	0.309	S	S	.	.			trans	-96.9	-9.3	175.5	-61.8	179.4	0	0	0	113.2	L265 T281 C286 P287	L265-L283 HydrophobicContact CD2-CB 4.06Å; L265-L283 PolarHBondContact O-N 2.93Å; T281-L283 HydrophobicContact CG2-CD2 4.44Å; L283-C286 CarbonylContact C-O 3.59Å; L283-C286 CarbonylContact O-C 3.59Å; L283-P287 HydrophobicContact CD2-CB 4.44Å; L283-P287 HydrophobicContact CD2-CG 4.4Å
284	W	85.7	Confident	88.8	Confident	43 Å²	43	51.1 Å²	51.1	16%	0.163	28%	0.275	C	S	.	.	S	Bend	trans	-123.7	144.6	-179	-178.2	92.3	0	0	0	111.2	V252 I253 A256 T257 L312 L317 Y330	V252-W284 HydrophobicContact CG1-CH2 4.12Å; V252-W284 HydrophobicContact CG1-CZ3 3.64Å; I253-W284 HydrophobicContact CG1-CE3 4.44Å; A256-W284 HydrophobicContact CB-CD2 4.44Å; A256-W284 HydrophobicContact CB-CH2 3.69Å; A256-W284 HydrophobicContact CB-CZ2 3.33Å; A256-W284 HydrophobicContact CB-CZ3 4.38Å; T257-W284 HydrophobicContact CG2-CG 4.06Å; W284-L312 HydrophobicContact CZ3-CD2 4.24Å; W284-L317 HydrophobicContact CH2-CB 4.4Å; W284-L317 HydrophobicContact CH2-CD1 3.91Å; W284-L317 HydrophobicContact CH2-CD2 4.05Å; W284-L317 HydrophobicContact CH2-CG 4.35Å; W284-L317 HydrophobicContact CZ3-CD1 4.08Å; W284-Y330 AromaticContact CH2-CD1 3.71Å; W284-Y330 HydrophobicContact CH2-CD1 3.71Å; W284-Y330 AromaticContact CH2-CE1 3.81Å; W284-Y330 HydrophobicContact CH2-CE1 3.81Å; W284-Y330 HydrophobicContact CZ2-CD1 4Å
285	P	79.7	Confident	89.1	Confident	58 Å²	58	52.1 Å²	52.1	38%	0.377	27%	0.274	S	S	.	.	S	Bend	cis	-66.6	-20	-7.8	31.6	-41.2	0	0	0	113.2	M288 L317	P285-M288 HydrophobicContact CG-CE 4.26Å; P285-L317 HydrophobicContact CB-CD1 4.32Å; P285-L317 HydrophobicContact CG-CD1 3.65Å
286	C	82.9	Confident	89.3	Confident	63 Å²	63	57.1 Å²	57.1	43%	0.426	28%	0.283	S	S	.	.	S	Bend	trans	-141.9	163	171.8	59.2	0	0	0	0	109.2	L283 M288	L283-C286 CarbonylContact C-O 3.59Å; L283-C286 CarbonylContact O-C 3.59Å; C286-M288 PolarHBondContact O-N 3.33Å; C286-M288 VanDerWaalsContact O-N 3.14Å
287	P	86	Confident	89.4	Confident	103 Å²	103	60.1 Å²	60.1	67%	0.669	30%	0.296	S	S	*	.			trans	-55.9	116.8	173.9	-27.4	36.7	0	0	0	112.3	L282 L283	L282-P287 CarbonylContact O-C 3.59Å; L282-P287 WeakPolarHBondContact O-CA 3.19Å; L283-P287 HydrophobicContact CD2-CB 4.44Å; L283-P287 HydrophobicContact CD2-CG 4.4Å
288	M	91.7	Very high	89.3	Confident	28 Å²	28	60.2 Å²	60.2	14%	0.138	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	146.7	176.9	-69.2	-179.4	-76.3	0	0	109.8	L282 P285 C286 F290 K311 L312 L315	L282-M288 PolarHBondContact N-O 3.19Å; L282-M288 PolarHBondContact O-N 2.7Å; P285-M288 HydrophobicContact CG-CE 4.26Å; C286-M288 PolarHBondContact O-N 3.33Å; C286-M288 VanDerWaalsContact O-N 3.14Å; M288-F290 HydrophobicContact CB-CE2 3.72Å; M288-F290 HydrophobicContact CB-CZ 4.08Å; M288-F290 HydrophobicContact SD-CZ 4.2Å; M288-K311 HydrophobicContact SD-CG 4.1Å; M288-L312 HydrophobicContact CE-CD2 4.34Å; M288-L315 HydrophobicContact SD-CD1 4.45Å
289	T	91.3	Very high	89.2	Confident	66 Å²	66	63.1 Å²	63.1	41%	0.405	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	134	-179.6	-54.4	0	0	0	0	110	T279 L280 V291	T279-T289 HydrophobicContact CG2-CG2 3.34Å; L280-T289 CarbonylContact O-C 3.54Å; L280-T289 VanDerWaalsContact O-CA 3.28Å; L280-T289 WeakPolarHBondContact O-CA 3.24Å; T289-V291 HydrophobicContact CG2-CG2 4.4Å
290	F	92.9	Very high	89.1	Confident	28 Å²	28	61.6 Å²	61.6	12%	0.123	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	130.7	179	-57.4	-89.8	0	0	0	109.2	T279 L280 L282 M288 L307 A308 K311	T279-F290 CarbonylContact C-O 3.51Å; T279-F290 WeakPolarHBondContact CA-O 3.41Å; L280-F290 HydrophobicContact CB-CB 4.37Å; L280-F290 PolarHBondContact N-O 3.02Å; L280-F290 PolarHBondContact O-N 3.3Å; L282-F290 HydrophobicContact CD1-CE2 4Å; M288-F290 HydrophobicContact CB-CE2 3.72Å; M288-F290 HydrophobicContact CB-CZ 4.08Å; M288-F290 HydrophobicContact SD-CZ 4.2Å; F290-L307 HydrophobicContact CD1-CB 4.02Å; F290-A308 HydrophobicContact CD1-CB 4.32Å; F290-A308 HydrophobicContact CD2-CB 3.55Å; F290-A308 HydrophobicContact CE1-CB 4.34Å; F290-A308 HydrophobicContact CE2-CB 3.58Å; F290-A308 HydrophobicContact CG-CB 3.93Å; F290-A308 HydrophobicContact CZ-CB 3.99Å; F290-K311 HydrophobicContact CE1-CB 3.68Å; F290-K311 HydrophobicContact CE1-CG 4.08Å; F290-K311 HydrophobicContact CZ-CB 3.72Å; F290-K311 HydrophobicContact CZ-CG 3.89Å
291	V	90.3	Very high	89.2	Confident	17 Å²	17	62.6 Å²	62.6	10%	0.103	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	132	-178.1	-171.2	0	0	0	0	109.3	M229 L277 A278 T279 T289	M229-V291 HydrophobicContact CE-CG1 4.46Å; M229-V291 HydrophobicContact SD-CB 3.94Å; M229-V291 HydrophobicContact SD-CG1 3.5Å; M229-V291 WeakPolarHBondContact SD-CG1 3.06Å; L277-V291 HydrophobicContact CD1-CG1 3.58Å; L277-V291 HydrophobicContact CD2-CG1 4.22Å; L277-V291 HydrophobicContact CG-CG1 3.79Å; A278-V291 WeakPolarHBondContact O-CA 3.35Å; T279-V291 HydrophobicContact CG2-CG2 3.94Å; T289-V291 HydrophobicContact CG2-CG2 4.4Å
292	A	91.5	Very high	89.2	Confident	6 Å²	6	62.8 Å²	62.8	5%	0.05	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	152.4	175.5	0	0	0	0	0	112	A278 K303 A304 L307	A278-A292 PolarHBondContact N-O 3.41Å; A278-A292 PolarHBondContact O-N 3.29Å; A292-K303 HydrophobicContact CB-CB 3.58Å; A292-A304 HydrophobicContact CB-CB 3.99Å; A292-L307 HydrophobicContact CB-CD1 4.35Å
293	K	89.6	Confident	89.4	Confident	103 Å²	103	63.2 Å²	63.2	45%	0.448	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	145.6	177.9	64.9	-175.7	-179.8	-175.4	0	111.7	D232 T275 K276 L277 K303	D232-K293 VanDerWaalsContact CG-CE 3.5Å; D232-K293 WeakPolarHBondContact OD2-CE 3.38Å; T275-K293 HydrophobicContact CG2-CB 4.11Å; K276-K293 CarbonylContact O-C 3.55Å; K276-K293 VanDerWaalsContact O-CA 3.31Å; K276-K293 WeakPolarHBondContact O-CA 3.3Å; L277-K293 HydrophobicContact CD1-CB 4.26Å; K293-K303 VanDerWaalsContact O-CD 3.27Å; K293-K303 WeakPolarHBondContact O-CD 3.24Å; K293-K303 PolarHBondContact O-NZ 2.93Å; K293-K303 VanDerWaalsContact O-NZ 3.13Å
294	G	88.7	Confident	89.6	Confident	6 Å²	6	59.3 Å²	59.3	6%	0.062	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154	162.2	176.4	0	0	0	0	0	111.7	K276 R296	K276-G294 PolarHBondContact N-O 3.21Å; K276-G294 PolarHBondContact O-N 3.32Å; G294-R296 PolarHBondContact O-N 3.47Å
295	R	88.6	Confident	90	Very high	211 Å²	211	57.2 Å²	57.2	80%	0.796	29%	0.286	S	S	*	.	S	Bend	trans	-71.4	-26.9	177.1	-60.9	-178.5	-177.3	-176.8	1.3	111.2	E299	R295-E299 WeakPolarHBondContact CB-OE2 3.33Å; R295-E299 PolarHBondContact N-OE2 3.09Å
296	R	89.5	Confident	90.6	Very high	192 Å²	192	54.5 Å²	54.5	73%	0.725	27%	0.268	S	S	*	.	S	Bend	trans	-125.6	153.3	178.9	-58.4	179.4	-173.9	140.2	-1.1	110.5	G294 A298 E299 A300	G294-R296 PolarHBondContact O-N 3.47Å; R296-A298 VanDerWaalsContact C-N 3.33Å; R296-A298 PolarHBondContact O-N 2.75Å; R296-E299 HydrophobicContact CB-CB 4.36Å; R296-E299 WeakPolarHBondContact O-CB 3.27Å; R296-E299 PolarHBondContact O-N 3.43Å; R296-E299 VanDerWaalsContact O-N 3.12Å; R296-A300 PolarHBondContact O-N 2.83Å
297	K	89.9	Confident	91.1	Very high	122 Å²	122	52.1 Å²	52.1	53%	0.53	25%	0.252	S	S	.	.	H	α-helix	trans	-54	-49.2	178.9	173.5	175.5	178.1	-179.7	0	111.5	T270 E299 A300 E301	T270-K297 HydrophobicContact CG2-CB 4.39Å; T270-K297 HydrophobicContact CG2-CG 4.07Å; K297-E299 VanDerWaalsContact C-N 3.31Å; K297-E299 PolarHBondContact O-N 2.99Å; K297-A300 PolarHBondContact O-N 2.84Å; K297-E301 WeakPolarHBondContact CE-OE1 3.35Å; K297-E301 HydrophobicContact CG-CG 4.34Å; K297-E301 IonicContact NZ-OE1 3.7Å; K297-E301 WeakPolarHBondContact O-CB 3.37Å; K297-E301 WeakPolarHBondContact O-CG 3.49Å; K297-E301 PolarHBondContact O-N 2.69Å
298	A	89.9	Confident	91.4	Very high	56 Å²	56	47.2 Å²	47.2	46%	0.463	22%	0.22	S	C	.	.	H	α-helix	trans	-61.2	-38	179.9	0	0	0	0	0	113	R296 N302	R296-A298 VanDerWaalsContact C-N 3.33Å; R296-A298 PolarHBondContact O-N 2.75Å; A298-N302 VanDerWaalsContact O-CB 3.25Å; A298-N302 WeakPolarHBondContact O-CB 3.37Å; A298-N302 PolarHBondContact O-N 2.89Å; A298-N302 PolarHBondContact O-ND2 3.34Å
299	E	90.1	Very high	91.5	Very high	62 Å²	62	46 Å²	46	29%	0.29	21%	0.213	S	C	.	.	H	α-helix	trans	-66.1	-49.8	177.5	-172.9	-163.2	156.6	0	0	111	R295 R296 K297 E301 N302 K303	R295-E299 WeakPolarHBondContact CB-OE2 3.33Å; R295-E299 PolarHBondContact N-OE2 3.09Å; R296-E299 HydrophobicContact CB-CB 4.36Å; R296-E299 WeakPolarHBondContact O-CB 3.27Å; R296-E299 PolarHBondContact O-N 3.43Å; R296-E299 VanDerWaalsContact O-N 3.12Å; K297-E299 VanDerWaalsContact C-N 3.31Å; K297-E299 PolarHBondContact O-N 2.99Å; E299-E301 PolarHBondContact O-N 3.42Å; E299-N302 PolarHBondContact O-N 2.71Å; E299-K303 WeakPolarHBondContact O-CB 3.35Å; E299-K303 WeakPolarHBondContact O-CG 3.3Å; E299-K303 PolarHBondContact O-N 2.92Å; E299-K303 IonicContact OE1-NZ 3.09Å; E299-K303 PolarHBondContact OE1-NZ 2.98Å
300	A	90.3	Very high	91.5	Very high	0 Å²	0	47 Å²	47	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-59.2	-46.6	178	0	0	0	0	0	111.5	K276 A278 R296 K297 K303 A304	K276-A300 HydrophobicContact CB-CB 4.14Å; K276-A300 WeakPolarHBondContact O-CB 3.35Å; A278-A300 HydrophobicContact CB-CB 3.59Å; R296-A300 PolarHBondContact O-N 2.83Å; K297-A300 PolarHBondContact O-N 2.84Å; A300-K303 PolarHBondContact O-N 3.39Å; A300-A304 PolarHBondContact O-N 3.37Å
301	E	94	Very high	91.4	Very high	21 Å²	21	49.8 Å²	49.8	10%	0.098	23%	0.225	C	C	.	.	H	α-helix	trans	-66.7	-37.9	178.4	-69.1	177	167.6	0	0	112.6	K246 F268 T270 A278 K297 E299 A304 A305	K246-E301 VanDerWaalsContact CE-CB 3.43Å; K246-E301 VanDerWaalsContact NZ-CB 3.29Å; K246-E301 IonicContact NZ-OE2 3.17Å; K246-E301 PolarHBondContact NZ-OE2 3.2Å; F268-E301 HydrophobicContact CB-CG 4.31Å; F268-E301 HydrophobicContact CD1-CB 3.76Å; F268-E301 HydrophobicContact CD1-CG 3.71Å; F268-E301 HydrophobicContact CE1-CB 3.88Å; F268-E301 HydrophobicContact CE1-CG 4.34Å; F268-E301 WeakPolarHBondContact CE1-O 3.43Å; F268-E301 HydrophobicContact CG-CG 4.19Å; T270-E301 PolarHBondContact OG1-OE1 3.34Å; A278-E301 HydrophobicContact CB-CB 4.33Å; A278-E301 HydrophobicContact CB-CG 3.77Å; K297-E301 WeakPolarHBondContact CE-OE1 3.35Å; K297-E301 HydrophobicContact CG-CG 4.34Å; K297-E301 IonicContact NZ-OE1 3.7Å; K297-E301 WeakPolarHBondContact O-CB 3.37Å; K297-E301 WeakPolarHBondContact O-CG 3.49Å; K297-E301 PolarHBondContact O-N 2.69Å; E299-E301 PolarHBondContact O-N 3.42Å; E301-A304 PolarHBondContact O-N 3.42Å; E301-A305 VanDerWaalsContact O-CB 3.3Å; E301-A305 WeakPolarHBondContact O-CB 3.38Å; E301-A305 PolarHBondContact O-N 2.8Å
302	N	93.9	Very high	91.4	Very high	50 Å²	50	49.1 Å²	49.1	27%	0.267	22%	0.22	S	C	.	.	H	α-helix	trans	-67.5	-39.3	176.5	-78.4	-18.1	0	0	0	111.6	L239 P245 K246 A298 E299 A305 A306	L239-N302 HydrophobicContact CD1-CB 4.01Å; P245-N302 HydrophobicContact CG-CB 4.3Å; P245-N302 VanDerWaalsContact CG-O 3.32Å; P245-N302 WeakPolarHBondContact CG-O 3.36Å; K246-N302 VanDerWaalsContact CD-OD1 3.25Å; K246-N302 WeakPolarHBondContact CD-OD1 3.39Å; K246-N302 WeakPolarHBondContact CE-OD1 3.27Å; A298-N302 VanDerWaalsContact O-CB 3.25Å; A298-N302 WeakPolarHBondContact O-CB 3.37Å; A298-N302 PolarHBondContact O-N 2.89Å; A298-N302 PolarHBondContact O-ND2 3.34Å; E299-N302 PolarHBondContact O-N 2.71Å; N302-A305 PolarHBondContact O-N 2.85Å; N302-A306 WeakPolarHBondContact O-CB 3.41Å; N302-A306 PolarHBondContact O-N 3.13Å
303	K	93.2	Very high	91.3	Very high	10 Å²	10	51.4 Å²	51.4	4%	0.043	23%	0.229	C	C	.	.	H	α-helix	trans	-60.5	-47.4	172.6	-78.8	-178.8	179.7	-174.5	0	111.6	D232 A235 L239 A292 K293 E299 A300 A305 A306 L307	D232-K303 IonicContact OD1-NZ 3.32Å; D232-K303 PolarHBondContact OD1-NZ 3.41Å; D232-K303 IonicContact OD2-NZ 3.68Å; A235-K303 HydrophobicContact CB-CB 4.05Å; A235-K303 HydrophobicContact CB-CD 4.27Å; A235-K303 HydrophobicContact CB-CG 4.25Å; L239-K303 HydrophobicContact CD2-CG 4.09Å; A292-K303 HydrophobicContact CB-CB 3.58Å; K293-K303 VanDerWaalsContact O-CD 3.27Å; K293-K303 WeakPolarHBondContact O-CD 3.24Å; K293-K303 PolarHBondContact O-NZ 2.93Å; K293-K303 VanDerWaalsContact O-NZ 3.13Å; E299-K303 WeakPolarHBondContact O-CB 3.35Å; E299-K303 WeakPolarHBondContact O-CG 3.3Å; E299-K303 PolarHBondContact O-N 2.92Å; E299-K303 IonicContact OE1-NZ 3.09Å; E299-K303 PolarHBondContact OE1-NZ 2.98Å; A300-K303 PolarHBondContact O-N 3.39Å; K303-A305 VanDerWaalsContact C-N 3.34Å; K303-A305 PolarHBondContact O-N 3.21Å; K303-A306 PolarHBondContact O-N 3.17Å; K303-L307 WeakPolarHBondContact O-CG 3.29Å; K303-L307 PolarHBondContact O-N 3.11Å
304	A	92.3	Very high	91.2	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-61.2	-42.6	176.2	0	0	0	0	0	111.8	L280 A292 A300 E301 A306 L307 A308	L280-A304 HydrophobicContact CB-CB 4Å; A292-A304 HydrophobicContact CB-CB 3.99Å; A300-A304 PolarHBondContact O-N 3.37Å; E301-A304 PolarHBondContact O-N 3.42Å; A304-A306 PolarHBondContact O-N 2.78Å; A304-L307 PolarHBondContact O-N 2.89Å; A304-A308 PolarHBondContact O-N 3.15Å; A304-A308 VanDerWaalsContact O-N 3.11Å
305	A	94	Very high	91.1	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-63.4	-38.9	174.9	0	0	0	0	0	112.7	P245 K246 L249 F268 L280 E301 N302 K303 A308 C309	P245-A305 HydrophobicContact CB-CB 3.82Å; P245-A305 HydrophobicContact CG-CB 3.93Å; K246-A305 HydrophobicContact CG-CB 3.79Å; L249-A305 HydrophobicContact CD1-CB 3.77Å; F268-A305 HydrophobicContact CE1-CB 4.35Å; F268-A305 HydrophobicContact CZ-CB 4.06Å; L280-A305 HydrophobicContact CD2-CB 4.25Å; E301-A305 VanDerWaalsContact O-CB 3.3Å; E301-A305 WeakPolarHBondContact O-CB 3.38Å; E301-A305 PolarHBondContact O-N 2.8Å; N302-A305 PolarHBondContact O-N 2.85Å; K303-A305 VanDerWaalsContact C-N 3.34Å; K303-A305 PolarHBondContact O-N 3.21Å; A305-A308 WeakPolarHBondContact O-CB 3.39Å; A305-A308 PolarHBondContact O-N 2.96Å; A305-C309 PolarHBondContact O-N 3.39Å; A305-C309 PolarHBondContact O-SG 2.88Å; A305-C309 VanDerWaalsContact O-SG 3.4Å
306	A	93	Very high	90.9	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-67.9	-39	179.3	0	0	0	0	0	112	A238 L239 P245 N302 K303 A304 A308 C309 K310	A238-A306 HydrophobicContact CB-CB 3.95Å; L239-A306 HydrophobicContact CB-CB 4.04Å; L239-A306 HydrophobicContact CD1-CB 4.05Å; P245-A306 HydrophobicContact CB-CB 3.94Å; P245-A306 HydrophobicContact CG-CB 4.12Å; N302-A306 WeakPolarHBondContact O-CB 3.41Å; N302-A306 PolarHBondContact O-N 3.13Å; K303-A306 PolarHBondContact O-N 3.17Å; A304-A306 PolarHBondContact O-N 2.78Å; A306-A308 VanDerWaalsContact C-N 3.28Å; A306-A308 PolarHBondContact O-N 2.84Å; A306-C309 PolarHBondContact O-N 3.45Å; A306-K310 PolarHBondContact O-N 3.47Å
307	L	93.4	Very high	90.8	Very high	14 Å²	14	37.1 Å²	37.1	7%	0.073	20%	0.204	C	C	.	.	H	α-helix	trans	-59.1	-42	170.7	-70.2	171.2	0	0	0	111.4	T230 A235 A238 F290 A292 K303 A304 K310 K311	T230-L307 VanDerWaalsContact OG1-CD1 3.23Å; T230-L307 WeakPolarHBondContact OG1-CD1 3.46Å; A235-L307 HydrophobicContact CB-CD1 3.96Å; A235-L307 HydrophobicContact CB-CD2 4.23Å; A235-L307 HydrophobicContact CB-CG 4.09Å; A238-L307 HydrophobicContact CB-CD2 4.11Å; F290-L307 HydrophobicContact CD1-CB 4.02Å; A292-L307 HydrophobicContact CB-CD1 4.35Å; K303-L307 WeakPolarHBondContact O-CG 3.29Å; K303-L307 PolarHBondContact O-N 3.11Å; A304-L307 PolarHBondContact O-N 2.89Å; L307-K310 WeakPolarHBondContact O-CB 3.08Å; L307-K310 PolarHBondContact O-N 3.33Å; L307-K311 PolarHBondContact O-N 3.29Å
308	A	92.5	Very high	90.6	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-63.7	-44.5	174.7	0	0	0	0	0	112.5	L249 L280 L282 F290 A304 A305 A306 K310 K311 L312	L249-A308 HydrophobicContact CD1-CB 3.99Å; L249-A308 HydrophobicContact CD2-CB 4.08Å; L280-A308 HydrophobicContact CD2-CB 3.76Å; L282-A308 HydrophobicContact CD1-CB 3.71Å; F290-A308 HydrophobicContact CD1-CB 4.32Å; F290-A308 HydrophobicContact CD2-CB 3.55Å; F290-A308 HydrophobicContact CE1-CB 4.34Å; F290-A308 HydrophobicContact CE2-CB 3.58Å; F290-A308 HydrophobicContact CG-CB 3.93Å; F290-A308 HydrophobicContact CZ-CB 3.99Å; A304-A308 PolarHBondContact O-N 3.15Å; A304-A308 VanDerWaalsContact O-N 3.11Å; A305-A308 WeakPolarHBondContact O-CB 3.39Å; A305-A308 PolarHBondContact O-N 2.96Å; A306-A308 VanDerWaalsContact C-N 3.28Å; A306-A308 PolarHBondContact O-N 2.84Å; A308-K310 VanDerWaalsContact C-N 3.31Å; A308-K310 PolarHBondContact O-N 2.99Å; A308-K311 PolarHBondContact O-N 2.9Å; A308-K311 VanDerWaalsContact O-N 3.15Å; A308-L312 WeakPolarHBondContact O-CG 3.27Å; A308-L312 PolarHBondContact O-N 3.36Å
309	C	92.2	Very high	90.4	Very high	1 Å²	1	31.1 Å²	31.1	1%	0.007	17%	0.17	C	C	.	.	H	α-helix	trans	-57.6	-43.9	173.3	-69.8	0	0	0	0	111.9	F242 P245 L248 A305 A306 K311 L312 K313	F242-C309 HydrophobicContact CB-CB 4.11Å; F242-C309 HydrophobicContact CD1-CB 3.65Å; F242-C309 HydrophobicContact CD2-CB 3.66Å; F242-C309 HydrophobicContact CE1-CB 3.87Å; F242-C309 HydrophobicContact CE2-CB 3.93Å; F242-C309 HydrophobicContact CG-CB 3.52Å; F242-C309 HydrophobicContact CZ-CB 4.02Å; P245-C309 PolarHBondContact O-SG 2.77Å; L248-C309 HydrophobicContact CD2-CB 4.37Å; A305-C309 PolarHBondContact O-N 3.39Å; A305-C309 PolarHBondContact O-SG 2.88Å; A305-C309 VanDerWaalsContact O-SG 3.4Å; A306-C309 PolarHBondContact O-N 3.45Å; C309-K311 VanDerWaalsContact C-N 3.31Å; C309-K311 PolarHBondContact O-N 2.89Å; C309-L312 PolarHBondContact O-N 3Å; C309-K313 WeakPolarHBondContact O-CB 3.37Å; C309-K313 PolarHBondContact O-N 3.28Å
310	K	91.2	Very high	90.1	Very high	87 Å²	87	39.3 Å²	39.3	38%	0.378	20%	0.198	S	C	.	.	H	α-helix	trans	-60.6	-42.1	176.4	-173	-178	179.1	-175	0	111.3	A238 F242 A306 L307 A308 K313 S314	A238-K310 HydrophobicContact CB-CB 4.32Å; A238-K310 HydrophobicContact CB-CD 4.17Å; F242-K310 HydrophobicContact CE2-CB 3.88Å; A306-K310 PolarHBondContact O-N 3.47Å; L307-K310 WeakPolarHBondContact O-CB 3.08Å; L307-K310 PolarHBondContact O-N 3.33Å; A308-K310 VanDerWaalsContact C-N 3.31Å; A308-K310 PolarHBondContact O-N 2.99Å; K310-K313 PolarHBondContact O-N 3.45Å; K310-S314 PolarHBondContact O-N 3.4Å
311	K	90.7	Very high	89.8	Confident	88 Å²	88	45.4 Å²	45.4	38%	0.383	23%	0.231	S	C	.	.	H	α-helix	trans	-64.1	-47.1	175.3	-173.4	63.9	175.9	-179.5	0	111.2	M288 F290 L307 A308 C309 K313 S314 L315	M288-K311 HydrophobicContact SD-CG 4.1Å; F290-K311 HydrophobicContact CE1-CB 3.68Å; F290-K311 HydrophobicContact CE1-CG 4.08Å; F290-K311 HydrophobicContact CZ-CB 3.72Å; F290-K311 HydrophobicContact CZ-CG 3.89Å; L307-K311 PolarHBondContact O-N 3.29Å; A308-K311 PolarHBondContact O-N 2.9Å; A308-K311 VanDerWaalsContact O-N 3.15Å; C309-K311 VanDerWaalsContact C-N 3.31Å; C309-K311 PolarHBondContact O-N 2.89Å; K311-K313 VanDerWaalsContact C-N 3.31Å; K311-K313 PolarHBondContact O-N 3.32Å; K311-S314 PolarHBondContact O-N 3.47Å; K311-S314 VanDerWaalsContact O-N 3.12Å; K311-S314 PolarHBondContact O-OG 2.97Å; K311-L315 HydrophobicContact CG-CD1 4.34Å; K311-L315 WeakPolarHBondContact O-CG 3.32Å; K311-L315 PolarHBondContact O-N 3.4Å
312	L	90.3	Very high	89.5	Confident	2 Å²	2	46.5 Å²	46.5	1%	0.01	24%	0.238	C	C	.	.	H	α-helix	trans	-58.9	-41.1	175.9	-67.6	-177.5	0	0	0	112.2	L249 V252 W284 M288 A308 C309 L315 G316 L317 V318	L249-L312 HydrophobicContact CD2-CD1 3.46Å; L249-L312 VanDerWaalsContact CD2-CD1 3.46Å; L249-L312 HydrophobicContact CD2-CG 4.45Å; V252-L312 HydrophobicContact CG1-CD1 4.13Å; W284-L312 HydrophobicContact CZ3-CD2 4.24Å; M288-L312 HydrophobicContact CE-CD2 4.34Å; A308-L312 WeakPolarHBondContact O-CG 3.27Å; A308-L312 PolarHBondContact O-N 3.36Å; C309-L312 PolarHBondContact O-N 3Å; L312-L315 CarbonylContact O-C 3.56Å; L312-L315 PolarHBondContact O-N 3.15Å; L312-G316 PolarHBondContact O-N 3.33Å; L312-L317 HydrophobicContact CB-CB 4.27Å; L312-L317 HydrophobicContact CD2-CB 4.47Å; L312-L317 HydrophobicContact CD2-CD1 3.81Å; L312-L317 WeakPolarHBondContact O-CB 3.33Å; L312-L317 PolarHBondContact O-N 2.83Å; L312-V318 HydrophobicContact CB-CG2 3.98Å
313	K	89.5	Confident	89.1	Confident	54 Å²	54	50 Å²	50	24%	0.235	25%	0.252	C	S	.	.	H	α-helix	trans	-63.3	-41.5	174.2	-170.5	169.2	-171.9	168.7	0	112.2	F242 C309 K310 K311 L315 G316 V318 D319 R320 N322	F242-K313 HydrophobicContact CE1-CD 4.34Å; F242-K313 HydrophobicContact CZ-CB 4.04Å; F242-K313 HydrophobicContact CZ-CD 3.8Å; C309-K313 WeakPolarHBondContact O-CB 3.37Å; C309-K313 PolarHBondContact O-N 3.28Å; K310-K313 PolarHBondContact O-N 3.45Å; K311-K313 VanDerWaalsContact C-N 3.31Å; K311-K313 PolarHBondContact O-N 3.32Å; K313-L315 PolarHBondContact O-N 2.99Å; K313-G316 PolarHBondContact O-N 2.68Å; K313-V318 HydrophobicContact CB-CB 4.16Å; K313-D319 VanDerWaalsContact CE-O 3.24Å; K313-D319 WeakPolarHBondContact CE-O 3.22Å; K313-R320 PolarHBondContact NZ-O 2.91Å; K313-N322 WeakPolarHBondContact CD-OD1 3.36Å; K313-N322 PolarHBondContact NZ-OD1 3.17Å
314	S	88.1	Confident	88.8	Confident	87 Å²	87	51 Å²	51	61%	0.608	26%	0.26	S	S	*	.	H	α-helix	trans	-65.4	-25.8	175.1	74.2	0	0	0	0	113.5	K310 K311 G316	K310-S314 PolarHBondContact O-N 3.4Å; K311-S314 PolarHBondContact O-N 3.47Å; K311-S314 VanDerWaalsContact O-N 3.12Å; K311-S314 PolarHBondContact O-OG 2.97Å; S314-G316 VanDerWaalsContact C-N 3.27Å
315	L	85.9	Confident	88.5	Confident	54 Å²	54	52.4 Å²	52.4	28%	0.283	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	0.5	172.7	-65.1	173.5	0	0	0	112.7	M288 K311 L312 K313 L317	M288-L315 HydrophobicContact SD-CD1 4.45Å; K311-L315 HydrophobicContact CG-CD1 4.34Å; K311-L315 WeakPolarHBondContact O-CG 3.32Å; K311-L315 PolarHBondContact O-N 3.4Å; L312-L315 CarbonylContact O-C 3.56Å; L312-L315 PolarHBondContact O-N 3.15Å; K313-L315 PolarHBondContact O-N 2.99Å; L315-L317 VanDerWaalsContact C-N 3.31Å; L315-L317 HydrophobicContact CB-CD1 4.09Å; L315-L317 HydrophobicContact CB-CG 4.18Å; L315-L317 HydrophobicContact CD1-CD1 4.36Å; L315-L317 PolarHBondContact O-N 3.12Å
316	G	84.4	Confident	87.9	Confident	47 Å²	47	54.9 Å²	54.9	49%	0.485	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	73	17.8	-177.7	0	0	0	0	0	114.5	L312 K313 S314 L325	L312-G316 PolarHBondContact O-N 3.33Å; K313-G316 PolarHBondContact O-N 2.68Å; S314-G316 VanDerWaalsContact C-N 3.27Å; G316-L325 WeakPolarHBondContact O-CD1 3.35Å
317	L	87.6	Confident	87.3	Confident	25 Å²	25	55.8 Å²	55.8	13%	0.131	29%	0.287	C	S	.	.	S	Bend	trans	-93.1	1.3	-178.7	-62.9	172.2	0	0	0	113.5	W284 P285 L312 L315 Y330	W284-L317 HydrophobicContact CH2-CB 4.4Å; W284-L317 HydrophobicContact CH2-CD1 3.91Å; W284-L317 HydrophobicContact CH2-CD2 4.05Å; W284-L317 HydrophobicContact CH2-CG 4.35Å; W284-L317 HydrophobicContact CZ3-CD1 4.08Å; P285-L317 HydrophobicContact CB-CD1 4.32Å; P285-L317 HydrophobicContact CG-CD1 3.65Å; L312-L317 HydrophobicContact CB-CB 4.27Å; L312-L317 HydrophobicContact CD2-CB 4.47Å; L312-L317 HydrophobicContact CD2-CD1 3.81Å; L312-L317 WeakPolarHBondContact O-CB 3.33Å; L312-L317 PolarHBondContact O-N 2.83Å; L315-L317 VanDerWaalsContact C-N 3.31Å; L315-L317 HydrophobicContact CB-CD1 4.09Å; L315-L317 HydrophobicContact CB-CG 4.18Å; L315-L317 HydrophobicContact CD1-CD1 4.36Å; L315-L317 PolarHBondContact O-N 3.12Å; L317-Y330 HydrophobicContact CB-CE1 4.07Å; L317-Y330 HydrophobicContact CD2-CD1 4Å; L317-Y330 HydrophobicContact CD2-CE1 4.1Å; L317-Y330 WeakPolarHBondContact O-CE1 3.41Å; L317-Y330 PolarHBondContact O-OH 3.48Å
318	V	87.4	Confident	86.6	Confident	6 Å²	6	55.1 Å²	55.1	4%	0.036	28%	0.283	C	S	.	.	B	Isolated β-bridge	trans	-136.2	138.5	172.4	177.3	0	0	0	0	105.5	L248 V252 L312 K313 E323	L248-V318 HydrophobicContact CD2-CG1 4.3Å; V252-V318 HydrophobicContact CG2-CG2 4.04Å; L312-V318 HydrophobicContact CB-CG2 3.98Å; K313-V318 HydrophobicContact CB-CB 4.16Å; V318-E323 WeakPolarHBondContact CG1-O 3.37Å
319	D	85.3	Confident	86.1	Confident	46 Å²	46	59.1 Å²	59.1	25%	0.246	30%	0.303	C	S	.	.			trans	-70.8	-176.4	-176.1	80.6	-1.7	0	0	0	112.9	K313 N321 N322 E323 L325	K313-D319 VanDerWaalsContact CE-O 3.24Å; K313-D319 WeakPolarHBondContact CE-O 3.22Å; D319-N321 PolarHBondContact O-N 3.12Å; D319-N321 VanDerWaalsContact OD1-C 3.26Å; D319-N321 VanDerWaalsContact OD1-CA 3.3Å; D319-N321 WeakPolarHBondContact OD1-CA 3.33Å; D319-N321 PolarHBondContact OD1-N 3Å; D319-N322 PolarHBondContact O-N 3.12Å; D319-N322 PolarHBondContact OD1-N 2.77Å; D319-E323 PolarHBondContact N-O 2.88Å; D319-E323 PolarHBondContact OD1-N 3.2Å; D319-L325 HydrophobicContact CB-CD2 3.95Å
320	R	83.4	Confident	85.6	Confident	233 Å²	233	60.5 Å²	60.5	88%	0.879	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-29.4	178.9	-63.4	-176.9	-176.6	-178.1	2.8	112.5	K313	K313-R320 PolarHBondContact NZ-O 2.91Å
321	N	84.5	Confident	85.1	Confident	129 Å²	129	58.2 Å²	58.2	69%	0.69	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90	6.4	-177.1	-63.1	-24.8	0	0	0	113.8	D319 E323	D319-N321 PolarHBondContact O-N 3.12Å; D319-N321 VanDerWaalsContact OD1-C 3.26Å; D319-N321 VanDerWaalsContact OD1-CA 3.3Å; D319-N321 WeakPolarHBondContact OD1-CA 3.33Å; D319-N321 PolarHBondContact OD1-N 3Å; N321-E323 VanDerWaalsContact C-N 3.29Å; N321-E323 HydrophobicContact CB-CG 4.39Å
322	N	86.3	Confident	84.6	Confident	44 Å²	44	55.8 Å²	55.8	24%	0.235	29%	0.291	C	S	.	.	S	Bend	trans	66.8	26.8	-175.1	-54.7	-37.6	0	0	0	113.9	Q241 F242 L248 K313 D319	Q241-N322 PolarHBondContact O-ND2 3.31Å; F242-N322 HydrophobicContact CD1-CB 4.03Å; F242-N322 HydrophobicContact CE1-CB 3.85Å; F242-N322 VanDerWaalsContact CE1-CG 3.47Å; F242-N322 WeakPolarHBondContact CE1-OD1 3.36Å; L248-N322 VanDerWaalsContact CD1-O 3.26Å; L248-N322 WeakPolarHBondContact CD1-O 3.49Å; L248-N322 HydrophobicContact CD2-CB 4.49Å; L248-N322 WeakPolarHBondContact CD2-O 3.29Å; K313-N322 WeakPolarHBondContact CD-OD1 3.36Å; K313-N322 PolarHBondContact NZ-OD1 3.17Å; D319-N322 PolarHBondContact O-N 3.12Å; D319-N322 PolarHBondContact OD1-N 2.77Å
323	E	86.5	Confident	83.9	Confident	123 Å²	123	59.3 Å²	59.3	58%	0.575	32%	0.32	S	S	*	.	P	Polyproline II helix	trans	-100.3	151.2	173.8	-58	-149.7	144.8	0	0	111.8	V318 D319 N321	V318-E323 WeakPolarHBondContact CG1-O 3.37Å; D319-E323 PolarHBondContact N-O 2.88Å; D319-E323 PolarHBondContact OD1-N 3.2Å; N321-E323 VanDerWaalsContact C-N 3.29Å; N321-E323 HydrophobicContact CB-CG 4.39Å
324	P	85.8	Confident	83.3	Confident	32 Å²	32	59.1 Å²	59.1	21%	0.208	33%	0.326	C	S	.	.	B	Isolated β-bridge	trans	-60.8	145	171.3	-17.6	29.9	0	0	0	111.7	L248 K251 V252 I255 Y330	L248-P324 HydrophobicContact CD1-CG 3.96Å; K251-P324 HydrophobicContact CB-CG 3.9Å; V252-P324 HydrophobicContact CG2-CB 3.94Å; V252-P324 HydrophobicContact CG2-CG 4.06Å; I255-P324 HydrophobicContact CD1-CB 3.58Å; I255-P324 HydrophobicContact CD1-CG 3.89Å; P324-Y330 WeakPolarHBondContact CA-OH 3.47Å
325	L	86.4	Confident	82.8	Confident	28 Å²	28	55 Å²	55	15%	0.147	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-70.8	168.6	168.4	-54.4	176.8	0	0	0	110.8	I255 G316 D319 M329 Y330	I255-L325 WeakPolarHBondContact CG2-O 3.33Å; G316-L325 WeakPolarHBondContact O-CD1 3.35Å; D319-L325 HydrophobicContact CB-CD2 3.95Å; L325-M329 HydrophobicContact CB-CB 3.92Å; L325-M329 HydrophobicContact CB-SD 4.27Å; L325-M329 HydrophobicContact CD1-CB 4.22Å; L325-M329 HydrophobicContact CD1-CE 4.27Å; L325-M329 HydrophobicContact CD2-CE 3.95Å; L325-M329 HydrophobicContact CD2-SD 4.2Å; L325-Y330 HydrophobicContact CB-CD2 4.27Å; L325-Y330 HydrophobicContact CB-CE1 4.04Å; L325-Y330 HydrophobicContact CB-CE2 3.8Å; L325-Y330 HydrophobicContact CD1-CD1 4.38Å; L325-Y330 HydrophobicContact CD1-CE1 3.99Å; L325-Y330 HydrophobicContact CG-CE1 4.18Å; L325-Y330 PolarHBondContact N-OH 3.46Å; L325-Y330 WeakPolarHBondContact O-CE2 3.31Å
326	T	81.7	Confident	82.5	Confident	52 Å²	52	58.8 Å²	58.8	32%	0.319	31%	0.308	S	S	.	.	P	Polyproline II helix	trans	-69.3	153.3	170.9	63.1	0	0	0	0	111.2	A328 M329 Y330	T326-A328 PolarHBondContact O-N 3.42Å; T326-A328 VanDerWaalsContact O-N 3.15Å; T326-M329 PolarHBondContact O-N 2.85Å; T326-M329 WeakPolarHBondContact OG1-CG 3.29Å; T326-M329 PolarHBondContact OG1-N 3.03Å; T326-Y330 WeakPolarHBondContact O-CD2 3.36Å; T326-Y330 PolarHBondContact O-N 3.31Å; T326-Y330 VanDerWaalsContact O-N 3.15Å
327	H	81.2	Confident	82.2	Confident	20 Å²	20	62.7 Å²	62.7	9%	0.093	31%	0.313	C	S	.	.	H	α-helix	trans	-56	-33.1	177.6	174.1	-109.6	0	0	0	112.3	I255 A256 S258 Y330 N331 G1039 F1041	I255-H327 HydrophobicContact CG2-CB 4.19Å; I255-H327 VanDerWaalsContact O-CB 3.31Å; I255-H327 WeakPolarHBondContact O-CB 3.33Å; I255-H327 PolarHBondContact O-CD2 3.49Å; A256-H327 PolarHBondContact O-CD2 3.38Å; S258-H327 PolarHBondContact OG-CD2 3.36Å; S258-H327 PolarHBondContact OG-CE1 3.25Å; S258-H327 PolarHBondContact OG-NE2 2.98Å; H327-Y330 PolarHBondContact O-N 2.87Å; H327-N331 PolarHBondContact CD2-ND2 2.93Å; H327-N331 PolarHBondContact NE2-ND2 3.01Å; H327-N331 PolarHBondContact O-N 3.32Å; H327-N331 VanDerWaalsContact O-N 3.13Å; H327-N331 PolarHBondContact O-ND2 3.06Å; H327-G1039 PolarHBondContact N-O 3.24Å; H327-F1041 PolarHBondContact CE1-O 3.41Å; H327-F1041 PolarHBondContact ND1-N 3.09Å; H327-F1041 VanDerWaalsContact ND1-N 3.19Å; H327-F1041 PolarHBondContact ND1-O 2.94Å; H327-F1041 VanDerWaalsContact ND1-O 3.1Å
328	A	78.2	Confident	81.6	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-63.1	-44.4	174.3	0	0	0	0	0	112	F207 T326 Y330 N331 L332 L335 V1035 G1039 F1041	F207-A328 HydrophobicContact CE1-CB 3.72Å; F207-A328 HydrophobicContact CE2-CB 4.33Å; F207-A328 HydrophobicContact CZ-CB 3.59Å; T326-A328 PolarHBondContact O-N 3.42Å; T326-A328 VanDerWaalsContact O-N 3.15Å; A328-Y330 VanDerWaalsContact C-N 3.33Å; A328-Y330 PolarHBondContact O-N 3.23Å; A328-N331 CarbonylContact O-C 3.56Å; A328-N331 VanDerWaalsContact O-C 3.29Å; A328-N331 PolarHBondContact O-N 3.3Å; A328-N331 VanDerWaalsContact O-N 3.1Å; A328-L332 PolarHBondContact O-N 3.48Å; A328-L332 VanDerWaalsContact O-N 3.13Å; A328-L335 HydrophobicContact CB-CD1 3.85Å; A328-L335 VanDerWaalsContact O-CD1 3.23Å; A328-L335 WeakPolarHBondContact O-CD1 3.4Å; A328-V1035 HydrophobicContact CB-CG1 3.8Å; A328-V1035 HydrophobicContact CB-CG2 4.38Å; A328-G1039 WeakPolarHBondContact CB-O 3.24Å; A328-G1039 PolarHBondContact N-O 2.72Å; A328-F1041 HydrophobicContact CB-CB 4.35Å
329	M	81	Confident	81.1	Confident	84 Å²	84	62.5 Å²	62.5	41%	0.414	31%	0.313	S	S	.	.	H	α-helix	trans	-65.7	-34.4	176.8	-70.8	-178	75.4	0	0	112.7	L325 T326 N331 L332	L325-M329 HydrophobicContact CB-CB 3.92Å; L325-M329 HydrophobicContact CB-SD 4.27Å; L325-M329 HydrophobicContact CD1-CB 4.22Å; L325-M329 HydrophobicContact CD1-CE 4.27Å; L325-M329 HydrophobicContact CD2-CE 3.95Å; L325-M329 HydrophobicContact CD2-SD 4.2Å; T326-M329 PolarHBondContact O-N 2.85Å; T326-M329 WeakPolarHBondContact OG1-CG 3.29Å; T326-M329 PolarHBondContact OG1-N 3.03Å; M329-N331 VanDerWaalsContact C-N 3.27Å; M329-N331 PolarHBondContact O-N 3.36Å; M329-L332 WeakPolarHBondContact O-CB 3.3Å
330	Y	83.5	Confident	80.7	Confident	29 Å²	29	65.5 Å²	65.5	11%	0.114	33%	0.325	C	S	.	.	H	α-helix	trans	-67.8	-27.2	172.4	-70.4	-57.1	0	0	0	113.3	V252 I255 A256 W284 L317 P324 L325 T326 H327 A328	V252-Y330 HydrophobicContact CG1-CE1 4.21Å; V252-Y330 WeakPolarHBondContact CG1-OH 3.35Å; I255-Y330 HydrophobicContact CB-CE2 4.33Å; I255-Y330 HydrophobicContact CG2-CD2 4.02Å; I255-Y330 HydrophobicContact CG2-CE2 3.91Å; A256-Y330 HydrophobicContact CB-CD1 3.95Å; A256-Y330 HydrophobicContact CB-CD2 3.61Å; A256-Y330 HydrophobicContact CB-CE1 4.47Å; A256-Y330 HydrophobicContact CB-CE2 4.14Å; A256-Y330 HydrophobicContact CB-CG 3.5Å; A256-Y330 VanDerWaalsContact CB-CG 3.5Å; W284-Y330 AromaticContact CH2-CD1 3.71Å; W284-Y330 HydrophobicContact CH2-CD1 3.71Å; W284-Y330 AromaticContact CH2-CE1 3.81Å; W284-Y330 HydrophobicContact CH2-CE1 3.81Å; W284-Y330 HydrophobicContact CZ2-CD1 4Å; L317-Y330 HydrophobicContact CB-CE1 4.07Å; L317-Y330 HydrophobicContact CD2-CD1 4Å; L317-Y330 HydrophobicContact CD2-CE1 4.1Å; L317-Y330 WeakPolarHBondContact O-CE1 3.41Å; L317-Y330 PolarHBondContact O-OH 3.48Å; P324-Y330 WeakPolarHBondContact CA-OH 3.47Å; L325-Y330 HydrophobicContact CB-CD2 4.27Å; L325-Y330 HydrophobicContact CB-CE1 4.04Å; L325-Y330 HydrophobicContact CB-CE2 3.8Å; L325-Y330 HydrophobicContact CD1-CD1 4.38Å; L325-Y330 HydrophobicContact CD1-CE1 3.99Å; L325-Y330 HydrophobicContact CG-CE1 4.18Å; L325-Y330 PolarHBondContact N-OH 3.46Å; L325-Y330 WeakPolarHBondContact O-CE2 3.31Å; T326-Y330 WeakPolarHBondContact O-CD2 3.36Å; T326-Y330 PolarHBondContact O-N 3.31Å; T326-Y330 VanDerWaalsContact O-N 3.15Å; H327-Y330 PolarHBondContact O-N 2.87Å; A328-Y330 VanDerWaalsContact C-N 3.33Å; A328-Y330 PolarHBondContact O-N 3.23Å
331	N	80.6	Confident	80.2	Confident	40 Å²	40	57.3 Å²	57.3	21%	0.214	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.8	27.2	-179.5	-69.2	-86	0	0	0	112.5	A256 H327 A328 M329 A333 S334 L335 F1041	A256-N331 PolarHBondContact O-ND2 2.98Å; H327-N331 PolarHBondContact CD2-ND2 2.93Å; H327-N331 PolarHBondContact NE2-ND2 3.01Å; H327-N331 PolarHBondContact O-N 3.32Å; H327-N331 VanDerWaalsContact O-N 3.13Å; H327-N331 PolarHBondContact O-ND2 3.06Å; A328-N331 CarbonylContact O-C 3.56Å; A328-N331 VanDerWaalsContact O-C 3.29Å; A328-N331 PolarHBondContact O-N 3.3Å; A328-N331 VanDerWaalsContact O-N 3.1Å; M329-N331 VanDerWaalsContact C-N 3.27Å; M329-N331 PolarHBondContact O-N 3.36Å; N331-A333 VanDerWaalsContact C-N 3.27Å; N331-A333 PolarHBondContact O-N 2.73Å; N331-S334 PolarHBondContact O-N 3.15Å; N331-S334 VanDerWaalsContact O-N 3.14Å; N331-L335 PolarHBondContact O-N 3.43Å; N331-F1041 HydrophobicContact CB-CD1 3.7Å; N331-F1041 HydrophobicContact CB-CE1 4.31Å
332	L	79.1	Confident	79.7	Confident	36 Å²	36	52 Å²	52	19%	0.188	27%	0.273	C	S	.	.	H	α-helix	trans	-62.8	-33	-173.5	-150.4	152.5	0	0	0	112.5	L208 A328 M329 L335 R336	L208-L332 HydrophobicContact CD2-CD2 4.47Å; A328-L332 PolarHBondContact O-N 3.48Å; A328-L332 VanDerWaalsContact O-N 3.13Å; M329-L332 WeakPolarHBondContact O-CB 3.3Å; L332-L335 PolarHBondContact O-N 3.32Å; L332-R336 HydrophobicContact CD2-CG 4.07Å; L332-R336 VanDerWaalsContact CD2-CZ 3.47Å; L332-R336 WeakPolarHBondContact O-CG 3.42Å; L332-R336 PolarHBondContact O-N 2.68Å
333	A	76.5	Confident	79.2	Confident	76 Å²	76	56.8 Å²	56.8	63%	0.628	29%	0.287	S	S	*	.	H	α-helix	trans	-62	-50.2	173.1	0	0	0	0	0	111.7	N331 L335 R336 E337	N331-A333 VanDerWaalsContact C-N 3.27Å; N331-A333 PolarHBondContact O-N 2.73Å; A333-L335 VanDerWaalsContact C-N 3.31Å; A333-L335 PolarHBondContact O-N 3.45Å; A333-R336 PolarHBondContact O-N 3.15Å; A333-E337 PolarHBondContact O-N 3.1Å
334	S	76.1	Confident	78.7	Confident	51 Å²	51	58.5 Å²	58.5	36%	0.357	29%	0.288	S	S	.	.	H	α-helix	trans	-63.7	-35.4	175.9	-52.8	0	0	0	0	112.3	N331 L338	N331-S334 PolarHBondContact O-N 3.15Å; N331-S334 VanDerWaalsContact O-N 3.14Å; S334-L338 WeakPolarHBondContact O-CB 3.4Å; S334-L338 PolarHBondContact O-N 2.79Å
335	L	78.2	Confident	78.6	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-63.9	-43.8	173	-76.2	169.4	0	0	0	111.7	V204 F207 L208 A328 N331 L332 A333 L338 G339 V1035 F1041	V204-L335 HydrophobicContact CB-CD2 4.23Å; V204-L335 HydrophobicContact CG1-CB 4.22Å; V204-L335 HydrophobicContact CG1-CD2 3.66Å; V204-L335 VanDerWaalsContact CG1-O 3.28Å; V204-L335 WeakPolarHBondContact CG1-O 3.15Å; V204-L335 HydrophobicContact CG2-CD2 3.75Å; F207-L335 HydrophobicContact CD1-CD1 4.01Å; F207-L335 HydrophobicContact CE1-CD1 3.92Å; L208-L335 WeakPolarHBondContact CD1-O 3.29Å; L208-L335 HydrophobicContact CD2-CB 4.13Å; A328-L335 HydrophobicContact CB-CD1 3.85Å; A328-L335 VanDerWaalsContact O-CD1 3.23Å; A328-L335 WeakPolarHBondContact O-CD1 3.4Å; N331-L335 PolarHBondContact O-N 3.43Å; L332-L335 PolarHBondContact O-N 3.32Å; A333-L335 VanDerWaalsContact C-N 3.31Å; A333-L335 PolarHBondContact O-N 3.45Å; L335-L338 PolarHBondContact O-N 3.19Å; L335-G339 PolarHBondContact O-N 3.07Å; L335-V1035 HydrophobicContact CD1-CG2 4.36Å; L335-V1035 HydrophobicContact CD2-CG2 3.63Å; L335-F1041 HydrophobicContact CD2-CD1 4.45Å; L335-F1041 HydrophobicContact CD2-CD2 3.31Å; L335-F1041 HydrophobicContact CD2-CE2 3.39Å; L335-F1041 HydrophobicContact CD2-CG 3.87Å; L335-F1041 HydrophobicContact CD2-CZ 4Å; L335-F1041 HydrophobicContact CG-CD1 4.44Å; L335-F1041 HydrophobicContact CG-CD2 4.13Å; L335-F1041 HydrophobicContact CG-CE2 4.23Å; L335-F1041 HydrophobicContact CG-CG 4.22Å; L335-F1041 HydrophobicContact CG-CZ 4.42Å
336	R	79.1	Confident	78.5	Confident	134 Å²	134	58.1 Å²	58.1	51%	0.506	29%	0.288	S	S	.	.	H	α-helix	trans	-63	-48.1	176.7	-76.7	177.8	-175.3	170.2	3.8	111.5	L208 L332 A333 L338 G339 E340	L208-R336 HydrophobicContact CD2-CG 3.88Å; L332-R336 HydrophobicContact CD2-CG 4.07Å; L332-R336 VanDerWaalsContact CD2-CZ 3.47Å; L332-R336 WeakPolarHBondContact O-CG 3.42Å; L332-R336 PolarHBondContact O-N 2.68Å; A333-R336 PolarHBondContact O-N 3.15Å; R336-L338 VanDerWaalsContact C-N 3.31Å; R336-L338 PolarHBondContact O-N 2.73Å; R336-G339 PolarHBondContact O-N 3.41Å; R336-E340 WeakPolarHBondContact O-CB 3.31Å; R336-E340 WeakPolarHBondContact O-CG 3.5Å; R336-E340 PolarHBondContact O-N 3.45Å
337	E	77.3	Confident	78.7	Confident	129 Å²	129	59.3 Å²	59.3	60%	0.603	30%	0.295	S	S	*	.	H	α-helix	trans	-58.7	-44	176.6	-176.7	178.8	-164.2	0	0	111.6	A333 E340 T341	A333-E337 PolarHBondContact O-N 3.1Å; E337-E340 PolarHBondContact O-N 3.43Å; E337-T341 WeakPolarHBondContact O-CB 3.47Å; E337-T341 PolarHBondContact O-N 3.5Å; E337-T341 PolarHBondContact O-OG1 3.45Å
338	L	76.5	Confident	79	Confident	24 Å²	24	59 Å²	59	13%	0.126	29%	0.294	C	S	.	.	H	α-helix	trans	-65.5	-43.3	175.8	-176.1	65.2	0	0	0	112.2	V204 S334 L335 R336 E340 T341 Q342 Q1032 F1041	V204-L338 HydrophobicContact CG1-CD2 4.39Å; V204-L338 HydrophobicContact CG2-CD2 3.82Å; S334-L338 WeakPolarHBondContact O-CB 3.4Å; S334-L338 PolarHBondContact O-N 2.79Å; L335-L338 PolarHBondContact O-N 3.19Å; R336-L338 VanDerWaalsContact C-N 3.31Å; R336-L338 PolarHBondContact O-N 2.73Å; L338-E340 VanDerWaalsContact C-N 3.33Å; L338-E340 PolarHBondContact O-N 3.49Å; L338-T341 WeakPolarHBondContact O-CB 3.47Å; L338-T341 PolarHBondContact O-N 2.77Å; L338-Q342 WeakPolarHBondContact O-CB 3.37Å; L338-Q342 VanDerWaalsContact O-CG 3.27Å; L338-Q342 WeakPolarHBondContact O-CG 3.48Å; L338-Q342 PolarHBondContact O-N 2.89Å; L338-Q1032 HydrophobicContact CD1-CB 4.45Å; L338-Q1032 WeakPolarHBondContact CD1-O 3.48Å; L338-Q1032 WeakPolarHBondContact CD2-O 3.26Å; L338-F1041 HydrophobicContact CD2-CE2 3.67Å; L338-F1041 HydrophobicContact CD2-CZ 3.76Å
339	G	76.3	Confident	79.2	Confident	3 Å²	3	67 Å²	67	3%	0.031	33%	0.331	C	S	.	.	H	α-helix	trans	-63.2	-36.6	175.7	0	0	0	0	0	112.9	L335 R336 R343	L335-G339 PolarHBondContact O-N 3.07Å; R336-G339 PolarHBondContact O-N 3.41Å; G339-R343 VanDerWaalsContact O-CG 3.3Å; G339-R343 WeakPolarHBondContact O-CG 3.42Å; G339-R343 PolarHBondContact O-N 3.26Å
340	E	75.8	Confident	79.6	Confident	108 Å²	108	63.8 Å²	63.8	51%	0.505	32%	0.316	S	S	.	.	H	α-helix	trans	-65.5	-44.6	170.5	-75.3	177.1	-165.8	0	0	111.2	R336 E337 L338 Q342 R343 R344	R336-E340 WeakPolarHBondContact O-CB 3.31Å; R336-E340 WeakPolarHBondContact O-CG 3.5Å; R336-E340 PolarHBondContact O-N 3.45Å; E337-E340 PolarHBondContact O-N 3.43Å; L338-E340 VanDerWaalsContact C-N 3.33Å; L338-E340 PolarHBondContact O-N 3.49Å; E340-Q342 VanDerWaalsContact C-N 3.32Å; E340-Q342 PolarHBondContact O-N 2.97Å; E340-R343 CarbonylContact O-C 3.6Å; E340-R343 PolarHBondContact O-N 2.94Å; E340-R344 WeakPolarHBondContact O-CG 3.34Å; E340-R344 PolarHBondContact O-N 3.16Å
341	T	73.3	Confident	80	Confident	61 Å²	61	65.3 Å²	65.3	37%	0.374	33%	0.33	S	S	.	.	H	α-helix	trans	-63.3	-38.1	179.1	-57	0	0	0	0	111.6	E337 L338 R343 R344	E337-T341 WeakPolarHBondContact O-CB 3.47Å; E337-T341 PolarHBondContact O-N 3.5Å; E337-T341 PolarHBondContact O-OG1 3.45Å; L338-T341 WeakPolarHBondContact O-CB 3.47Å; L338-T341 PolarHBondContact O-N 2.77Å; T341-R343 VanDerWaalsContact C-N 3.27Å; T341-R343 PolarHBondContact O-N 3.33Å; T341-R344 PolarHBondContact O-N 3.46Å
342	Q	75.3	Confident	80.6	Confident	19 Å²	19	66.7 Å²	66.7	9%	0.089	34%	0.335	C	S	.	.	H	α-helix	trans	-66.1	-26.7	172.9	-72.4	178.4	0.7	0	0	113	L338 E340 R1031 Q1032	L338-Q342 WeakPolarHBondContact O-CB 3.37Å; L338-Q342 VanDerWaalsContact O-CG 3.27Å; L338-Q342 WeakPolarHBondContact O-CG 3.48Å; L338-Q342 PolarHBondContact O-N 2.89Å; E340-Q342 VanDerWaalsContact C-N 3.32Å; E340-Q342 PolarHBondContact O-N 2.97Å; Q342-R1031 HydrophobicContact CG-CB 4.39Å; Q342-R1031 HydrophobicContact CG-CG 4.47Å; Q342-Q1032 PolarHBondContact NE2-O 3.48Å
343	R	74.6	Confident	81.3	Confident	144 Å²	144	69.2 Å²	69.2	54%	0.543	35%	0.353	S	S	.	.	H	α-helix	trans	-88.2	-20.6	177.8	-72	173.3	-179.3	-176.8	0.9	113.3	G339 E340 T341 R1127	G339-R343 VanDerWaalsContact O-CG 3.3Å; G339-R343 WeakPolarHBondContact O-CG 3.42Å; G339-R343 PolarHBondContact O-N 3.26Å; E340-R343 CarbonylContact O-C 3.6Å; E340-R343 PolarHBondContact O-N 2.94Å; T341-R343 VanDerWaalsContact C-N 3.27Å; T341-R343 PolarHBondContact O-N 3.33Å; R343-R1127 PolarHBondContact O-NH1 3.39Å
344	R	77.4	Confident	82.2	Confident	159 Å²	159	66.3 Å²	66.3	60%	0.6	33%	0.327	S	S	*	.	S	Bend	trans	-64.9	136.8	178.6	-77.7	178.5	-170.6	-174.8	5.4	110.4	E340 T341	E340-R344 WeakPolarHBondContact O-CG 3.34Å; E340-R344 PolarHBondContact O-N 3.16Å; T341-R344 PolarHBondContact O-N 3.46Å
345	P	83.6	Confident	83	Confident	37 Å²	37	64 Å²	64	24%	0.24	31%	0.311	C	S	.	.	P	Polyproline II helix	trans	-56.1	149.9	171.9	-23.7	34.1	0	0	0	112.1	T1117 R1127 E1129	P345-T1117 HydrophobicContact CB-CG2 4.34Å; P345-T1117 HydrophobicContact CG-CG2 3.82Å; P345-R1127 WeakPolarHBondContact CA-O 3.37Å; P345-R1127 HydrophobicContact CB-CB 4.21Å; P345-R1127 HydrophobicContact CG-CB 4.47Å; P345-E1129 HydrophobicContact CB-CB 3.69Å; P345-E1129 HydrophobicContact CG-CB 4.43Å
346	C	84.3	Confident	83.9	Confident	15 Å²	15	71.7 Å²	71.7	10%	0.101	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	122.7	171.3	-174.4	0	0	0	0	109.5	I348 W1073 R1127 L1128 E1129	C346-I348 PolarHBondContact O-N 2.74Å; C346-W1073 HydrophobicContact CB-CH2 3.88Å; C346-R1127 PolarHBondContact N-O 3.13Å; C346-L1128 HydrophobicContact CB-CD2 3.89Å; C346-L1128 CarbonylContact O-C 3.26Å; C346-L1128 VanDerWaalsContact O-CA 3.25Å; C346-L1128 WeakPolarHBondContact O-CA 3.29Å; C346-E1129 PolarHBondContact O-N 2.86Å
347	T	85.8	Confident	84.8	Confident	76 Å²	76	69.6 Å²	69.6	47%	0.466	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	130.6	176.5	-49.1	0	0	0	0	110.5	E1129	T347-E1129 CarbonylContact C-O 3.46Å; T347-E1129 VanDerWaalsContact CA-O 3.29Å; T347-E1129 WeakPolarHBondContact CA-O 3.44Å
348	I	86.2	Confident	85.7	Confident	13 Å²	13	63.5 Å²	63.5	7%	0.067	31%	0.306	C	S	.	.			trans	-108	139.8	173.3	52.5	163.7	0	0	0	110	C346 L1097 L1128 E1129 T1134 L1138	C346-I348 PolarHBondContact O-N 2.74Å; I348-L1097 HydrophobicContact CD1-CD2 4.31Å; I348-L1097 HydrophobicContact CG2-CD2 4.33Å; I348-L1128 HydrophobicContact CD1-CB 4.35Å; I348-L1128 HydrophobicContact CG1-CB 4.4Å; I348-L1128 HydrophobicContact CG2-CB 3.98Å; I348-L1128 HydrophobicContact CG2-CD1 4.03Å; I348-L1128 HydrophobicContact CG2-CD2 3.91Å; I348-L1128 HydrophobicContact CG2-CG 4.17Å; I348-E1129 VanDerWaalsContact CG1-O 3.26Å; I348-E1129 WeakPolarHBondContact CG1-O 3.48Å; I348-E1129 PolarHBondContact N-O 2.93Å; I348-T1134 HydrophobicContact CD1-CG2 4.34Å; I348-L1138 HydrophobicContact CD1-CD1 3.43Å; I348-L1138 VanDerWaalsContact CD1-CD1 3.43Å
349	Q	83.1	Confident	86.7	Confident	170 Å²	170	66.4 Å²	66.4	79%	0.794	32%	0.319	S	S	*	.			trans	-128.7	120.4	173	-67.8	-174.6	-5.2	0	0	107.9
350	V	89.6	Confident	87.6	Confident	15 Å²	15	69 Å²	69	9%	0.091	34%	0.339	C	S	.	.			trans	-106.8	128.4	174.1	-177.4	0	0	0	0	107.5	E352 I354 L355 L1097 T1134 L1138 L1178	V350-E352 PolarHBondContact O-N 3.29Å; V350-I354 HydrophobicContact CG1-CB 4.22Å; V350-I354 HydrophobicContact CG1-CG2 4.25Å; V350-L355 HydrophobicContact CB-CD1 4.3Å; V350-L355 HydrophobicContact CB-CD2 3.84Å; V350-L355 HydrophobicContact CB-CG 3.93Å; V350-L355 HydrophobicContact CG1-CD2 3.71Å; V350-L355 HydrophobicContact CG1-CG 3.74Å; V350-L355 HydrophobicContact CG2-CD2 4.47Å; V350-L1097 HydrophobicContact CG2-CD1 4.3Å; V350-T1134 HydrophobicContact CB-CG2 4.28Å; V350-T1134 HydrophobicContact CG2-CG2 3.88Å; V350-L1138 HydrophobicContact CG2-CD1 4.36Å; V350-L1178 HydrophobicContact CB-CD1 4.43Å; V350-L1178 HydrophobicContact CG1-CD1 3.5Å; V350-L1178 VanDerWaalsContact CG1-CD1 3.5Å; V350-L1178 HydrophobicContact CG2-CD1 4.07Å
351	P	90.9	Very high	88.7	Confident	62 Å²	62	64.3 Å²	64.3	40%	0.403	32%	0.318	S	S	.	.			trans	-55	132.3	175.9	-26.7	34.5	0	0	0	112.1	P353 I354 L355	P351-P353 VanDerWaalsContact C-N 3.32Å; P351-I354 HydrophobicContact CB-CD1 4.25Å; P351-I354 HydrophobicContact CB-CG1 4.36Å; P351-I354 HydrophobicContact CG-CD1 4.1Å; P351-I354 WeakPolarHBondContact O-CB 3.22Å; P351-I354 PolarHBondContact O-N 2.93Å; P351-L355 PolarHBondContact O-N 3.4Å; P351-L355 VanDerWaalsContact O-N 3.16Å
352	E	93.6	Very high	89.8	Confident	69 Å²	69	62 Å²	62	32%	0.322	30%	0.303	S	S	.	.	H	α-helix	trans	-52.2	-38.7	-179.1	-179	58.5	-154.8	0	0	114.4	V350 I354 L355 R356 R1133	V350-E352 PolarHBondContact O-N 3.29Å; E352-I354 VanDerWaalsContact C-N 3.27Å; E352-I354 PolarHBondContact O-N 3.48Å; E352-L355 PolarHBondContact O-N 3.21Å; E352-R356 WeakPolarHBondContact O-CG 3.34Å; E352-R356 PolarHBondContact O-N 3.05Å; E352-R356 WeakPolarHBondContact OE1-CG 3.39Å; E352-R356 IonicContact OE1-CZ 3.93Å; E352-R356 IonicContact OE1-NE 3.12Å; E352-R356 PolarHBondContact OE1-NE 2.93Å; E352-R356 VanDerWaalsContact OE1-NE 3.08Å; E352-R356 IonicContact OE1-NH2 3.88Å; E352-R1133 VanDerWaalsContact CD-NH1 3.29Å; E352-R1133 IonicContact OE1-CZ 3.64Å; E352-R1133 IonicContact OE1-NH1 2.59Å; E352-R1133 PolarHBondContact OE1-NH1 3.44Å; E352-R1133 IonicContact OE1-NH2 3.69Å; E352-R1133 PolarHBondContact OE1-NH2 3.37Å; E352-R1133 IonicContact OE2-CZ 3.1Å; E352-R1133 IonicContact OE2-NH1 3.56Å; E352-R1133 PolarHBondContact OE2-NH1 3.45Å
353	P	94.4	Very high	90.7	Very high	88 Å²	88	65.5 Å²	65.5	57%	0.571	33%	0.33	S	S	*	.	H	α-helix	trans	-59.4	-36	175.1	-25.3	35.7	0	0	0	113.6	P351 K357	P351-P353 VanDerWaalsContact C-N 3.32Å; P353-K357 WeakPolarHBondContact O-CG 3.5Å; P353-K357 PolarHBondContact O-N 3.25Å
354	I	94.2	Very high	91.6	Very high	15 Å²	15	65 Å²	65	8%	0.077	33%	0.333	C	S	.	.	H	α-helix	trans	-73.9	-41.9	178.6	-59	176.8	0	0	0	109.8	V350 P351 E352 R356 K357 I358 E1177 L1178	V350-I354 HydrophobicContact CG1-CB 4.22Å; V350-I354 HydrophobicContact CG1-CG2 4.25Å; P351-I354 HydrophobicContact CB-CD1 4.25Å; P351-I354 HydrophobicContact CB-CG1 4.36Å; P351-I354 HydrophobicContact CG-CD1 4.1Å; P351-I354 WeakPolarHBondContact O-CB 3.22Å; P351-I354 PolarHBondContact O-N 2.93Å; E352-I354 VanDerWaalsContact C-N 3.27Å; E352-I354 PolarHBondContact O-N 3.48Å; I354-R356 VanDerWaalsContact C-N 3.31Å; I354-R356 PolarHBondContact O-N 3.27Å; I354-K357 WeakPolarHBondContact O-CB 3.19Å; I354-K357 PolarHBondContact O-N 3.33Å; I354-K357 VanDerWaalsContact O-N 3.13Å; I354-I358 HydrophobicContact CG2-CD1 4.04Å; I354-I358 HydrophobicContact CG2-CG1 4.46Å; I354-I358 WeakPolarHBondContact O-CG1 3.4Å; I354-I358 PolarHBondContact O-N 3.02Å; I354-E1177 HydrophobicContact CD1-CG 4.1Å; I354-E1177 HydrophobicContact CG1-CG 4.3Å; I354-L1178 HydrophobicContact CG2-CB 4.33Å; I354-L1178 HydrophobicContact CG2-CD1 4.02Å
355	L	94.6	Very high	92.3	Very high	4 Å²	4	59.8 Å²	59.8	2%	0.021	31%	0.314	C	S	.	.	H	α-helix	trans	-57.2	-43.8	175.2	-71.4	175.7	0	0	0	112	V350 P351 E352 K357 I358 E359 T1134 L1137	V350-L355 HydrophobicContact CB-CD1 4.3Å; V350-L355 HydrophobicContact CB-CD2 3.84Å; V350-L355 HydrophobicContact CB-CG 3.93Å; V350-L355 HydrophobicContact CG1-CD2 3.71Å; V350-L355 HydrophobicContact CG1-CG 3.74Å; V350-L355 HydrophobicContact CG2-CD2 4.47Å; P351-L355 PolarHBondContact O-N 3.4Å; P351-L355 VanDerWaalsContact O-N 3.16Å; E352-L355 PolarHBondContact O-N 3.21Å; L355-K357 VanDerWaalsContact C-N 3.34Å; L355-K357 PolarHBondContact O-N 2.81Å; L355-I358 PolarHBondContact O-N 3.31Å; L355-E359 WeakPolarHBondContact O-CB 3.46Å; L355-E359 PolarHBondContact O-N 2.84Å; L355-T1134 WeakPolarHBondContact CD1-OG1 3.47Å; L355-T1134 HydrophobicContact CD2-CG2 4.25Å; L355-L1137 HydrophobicContact CB-CD1 4.27Å; L355-L1137 HydrophobicContact CD2-CD1 4.05Å
356	R	97	Very high	92.5	Very high	160 Å²	160	62 Å²	62	60%	0.604	33%	0.328	S	S	*	.	H	α-helix	trans	-63.4	-37.9	176.2	-70	-178.9	-171.4	-179.8	-0.2	112.9	E352 I354 E359 A360	E352-R356 WeakPolarHBondContact O-CG 3.34Å; E352-R356 PolarHBondContact O-N 3.05Å; E352-R356 WeakPolarHBondContact OE1-CG 3.39Å; E352-R356 IonicContact OE1-CZ 3.93Å; E352-R356 IonicContact OE1-NE 3.12Å; E352-R356 PolarHBondContact OE1-NE 2.93Å; E352-R356 VanDerWaalsContact OE1-NE 3.08Å; E352-R356 IonicContact OE1-NH2 3.88Å; I354-R356 VanDerWaalsContact C-N 3.31Å; I354-R356 PolarHBondContact O-N 3.27Å; R356-E359 PolarHBondContact O-N 3.47Å; R356-A360 VanDerWaalsContact O-CB 3.29Å; R356-A360 WeakPolarHBondContact O-CB 3.32Å; R356-A360 PolarHBondContact O-N 3.06Å
357	K	97.1	Very high	92.4	Very high	91 Å²	91	62.7 Å²	62.7	40%	0.396	33%	0.332	S	S	.	.	H	α-helix	trans	-66.4	-41.6	175.2	-71.3	173.5	174.7	179.9	0	111.8	P353 I354 L355 A360 F361 L1174 E1177	P353-K357 WeakPolarHBondContact O-CG 3.5Å; P353-K357 PolarHBondContact O-N 3.25Å; I354-K357 WeakPolarHBondContact O-CB 3.19Å; I354-K357 PolarHBondContact O-N 3.33Å; I354-K357 VanDerWaalsContact O-N 3.13Å; L355-K357 VanDerWaalsContact C-N 3.34Å; L355-K357 PolarHBondContact O-N 2.81Å; K357-A360 PolarHBondContact O-N 3.48Å; K357-F361 WeakPolarHBondContact O-CB 3.45Å; K357-F361 PolarHBondContact O-N 3.35Å; K357-L1174 HydrophobicContact CB-CD2 3.52Å; K357-L1174 HydrophobicContact CD-CD2 3.95Å; K357-L1174 HydrophobicContact CG-CD2 4.33Å; K357-E1177 IonicContact NZ-OE1 3.08Å; K357-E1177 PolarHBondContact NZ-OE1 3.46Å; K357-E1177 IonicContact NZ-OE2 3.95Å; K357-E1177 PolarHBondContact NZ-OE2 3.13Å
358	I	96.4	Very high	91.6	Very high	0 Å²	0	63.6 Å²	63.6	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-61.7	-47	174.5	-68.7	169.6	0	0	0	110.2	I354 L355 A360 F361 L362 L1137 F1141 L1178	I354-I358 HydrophobicContact CG2-CD1 4.04Å; I354-I358 HydrophobicContact CG2-CG1 4.46Å; I354-I358 WeakPolarHBondContact O-CG1 3.4Å; I354-I358 PolarHBondContact O-N 3.02Å; L355-I358 PolarHBondContact O-N 3.31Å; I358-A360 PolarHBondContact O-N 3.14Å; I358-F361 PolarHBondContact O-N 3.32Å; I358-L362 HydrophobicContact CG2-CD1 3.7Å; I358-L362 HydrophobicContact CG2-CG 4.3Å; I358-L362 WeakPolarHBondContact O-CB 3.18Å; I358-L362 VanDerWaalsContact O-CG 3.29Å; I358-L362 WeakPolarHBondContact O-CG 3.35Å; I358-L362 PolarHBondContact O-N 3.42Å; I358-L1137 HydrophobicContact CG2-CB 4.4Å; I358-F1141 HydrophobicContact CG1-CD2 4.18Å; I358-F1141 HydrophobicContact CG1-CE2 4.19Å; I358-F1141 HydrophobicContact CG2-CB 4.11Å; I358-F1141 HydrophobicContact CG2-CD2 3.83Å; I358-F1141 HydrophobicContact CG2-CG 4.21Å; I358-L1178 HydrophobicContact CD1-CD2 4.36Å
359	E	96.2	Very high	90.1	Very high	86 Å²	86	67.4 Å²	67.4	40%	0.402	36%	0.362	S	S	.	.	H	α-helix	trans	-61.5	-43.7	177.9	-172.6	165.6	-147.9	0	0	111.7	L355 R356 L362 S363 R1133 L1137	L355-E359 WeakPolarHBondContact O-CB 3.46Å; L355-E359 PolarHBondContact O-N 2.84Å; R356-E359 PolarHBondContact O-N 3.47Å; E359-L362 PolarHBondContact O-N 2.93Å; E359-S363 WeakPolarHBondContact O-CB 3.49Å; E359-S363 PolarHBondContact O-N 2.63Å; E359-R1133 IonicContact OE2-CZ 3.43Å; E359-R1133 IonicContact OE2-NE 2.94Å; E359-R1133 IonicContact OE2-NH2 3.89Å; E359-R1133 PolarHBondContact OE2-NH2 2.86Å; E359-L1137 HydrophobicContact CB-CD1 4.37Å; E359-L1137 HydrophobicContact CB-CD2 3.94Å; E359-L1137 HydrophobicContact CG-CD2 4.18Å
360	A	97.2	Very high	88.3	Confident	56 Å²	56	62.3 Å²	62.3	46%	0.463	35%	0.345	S	S	.	.	H	α-helix	trans	-61.7	-45.1	174	0	0	0	0	0	112	R356 K357 I358 S363 H364	R356-A360 VanDerWaalsContact O-CB 3.29Å; R356-A360 WeakPolarHBondContact O-CB 3.32Å; R356-A360 PolarHBondContact O-N 3.06Å; K357-A360 PolarHBondContact O-N 3.48Å; I358-A360 PolarHBondContact O-N 3.14Å; A360-S363 PolarHBondContact O-N 3.2Å; A360-S363 PolarHBondContact O-OG 2.77Å; A360-H364 PolarHBondContact O-N 2.65Å
361	F	97.3	Very high	85.9	Confident	10 Å²	10	69.2 Å²	69.2	4%	0.044	37%	0.37	C	S	.	.	H	α-helix	trans	-59.5	-48.9	175.7	175.6	-86.6	0	0	0	111.5	K357 I358 S363 H364 Y365 A1144 E1167 Q1170 L1171 L1174	K357-F361 WeakPolarHBondContact O-CB 3.45Å; K357-F361 PolarHBondContact O-N 3.35Å; I358-F361 PolarHBondContact O-N 3.32Å; F361-S363 VanDerWaalsContact C-N 3.28Å; F361-S363 PolarHBondContact O-N 3.19Å; F361-H364 PolarHBondContact O-N 2.76Å; F361-H364 VanDerWaalsContact O-N 3.09Å; F361-Y365 AromaticContact CD2-CD2 3.76Å; F361-Y365 HydrophobicContact CD2-CD2 3.76Å; F361-Y365 HydrophobicContact CD2-CE2 4.13Å; F361-Y365 HydrophobicContact CE1-CD2 4.3Å; F361-Y365 AromaticContact CE2-CD2 3.42Å; F361-Y365 HydrophobicContact CE2-CD2 3.42Å; F361-Y365 VanDerWaalsContact CE2-CD2 3.42Å; F361-Y365 AromaticContact CE2-CE2 3.78Å; F361-Y365 HydrophobicContact CE2-CE2 3.78Å; F361-Y365 HydrophobicContact CE2-CG 4.37Å; F361-Y365 HydrophobicContact CG-CD2 4.33Å; F361-Y365 AromaticContact CZ-CD2 3.71Å; F361-Y365 HydrophobicContact CZ-CD2 3.71Å; F361-Y365 HydrophobicContact CZ-CE2 4.42Å; F361-Y365 HydrophobicContact CZ-CG 4.25Å; F361-Y365 PolarHBondContact O-N 2.77Å; F361-A1144 HydrophobicContact CE1-CB 4.3Å; F361-E1167 HydrophobicContact CE2-CG 4.49Å; F361-E1167 HydrophobicContact CZ-CG 4.18Å; F361-Q1170 HydrophobicContact CD2-CB 4.07Å; F361-Q1170 HydrophobicContact CE2-CB 3.94Å; F361-L1171 HydrophobicContact CD1-CD1 4.31Å; F361-L1171 HydrophobicContact CE1-CB 4.36Å; F361-L1171 HydrophobicContact CE1-CD1 3.74Å; F361-L1171 HydrophobicContact CE1-CG 4.45Å; F361-L1171 HydrophobicContact CE2-CB 4Å; F361-L1171 HydrophobicContact CZ-CB 3.7Å; F361-L1171 HydrophobicContact CZ-CD1 3.97Å; F361-L1171 HydrophobicContact CZ-CD2 4.37Å; F361-L1171 HydrophobicContact CZ-CG 4.22Å; F361-L1174 HydrophobicContact CB-CD1 3.6Å; F361-L1174 HydrophobicContact CD2-CD1 4.17Å; F361-L1174 HydrophobicContact CG-CD1 3.9Å
362	L	95.9	Very high	83.6	Confident	12 Å²	12	70.2 Å²	70.2	6%	0.063	37%	0.371	C	S	.	.	H	α-helix	trans	-66.9	-29.2	180	-68.3	170	0	0	0	112.5	I358 E359 H364 Y365 P366 V367 L1137 E1140 A1144	I358-L362 HydrophobicContact CG2-CD1 3.7Å; I358-L362 HydrophobicContact CG2-CG 4.3Å; I358-L362 WeakPolarHBondContact O-CB 3.18Å; I358-L362 VanDerWaalsContact O-CG 3.29Å; I358-L362 WeakPolarHBondContact O-CG 3.35Å; I358-L362 PolarHBondContact O-N 3.42Å; E359-L362 PolarHBondContact O-N 2.93Å; L362-H364 VanDerWaalsContact C-N 3.35Å; L362-Y365 CarbonylContact O-C 3.32Å; L362-P366 VanDerWaalsContact O-CA 3.26Å; L362-P366 WeakPolarHBondContact O-CA 3.34Å; L362-V367 HydrophobicContact CD2-CG2 3.85Å; L362-L1137 HydrophobicContact CD1-CD2 4.12Å; L362-E1140 HydrophobicContact CD1-CB 3.59Å; L362-E1140 HydrophobicContact CD2-CB 4.18Å; L362-A1144 HydrophobicContact CD2-CB 4.18Å
363	S	94.7	Very high	80.7	Confident	94 Å²	94	69.7 Å²	69.7	66%	0.657	38%	0.375	S	S	*	.	H	α-helix	trans	-69.7	-33.6	172.1	76.4	0	0	0	0	112.5	E359 A360 F361	E359-S363 WeakPolarHBondContact O-CB 3.49Å; E359-S363 PolarHBondContact O-N 2.63Å; A360-S363 PolarHBondContact O-N 3.2Å; A360-S363 PolarHBondContact O-OG 2.77Å; F361-S363 VanDerWaalsContact C-N 3.28Å; F361-S363 PolarHBondContact O-N 3.19Å
364	H	93.8	Very high	78.2	Confident	134 Å²	134	69.9 Å²	69.9	62%	0.62	38%	0.376	S	S	*	.	H	α-helix	trans	-81.2	-34.8	179	-157.9	67	0	0	0	112	A360 F361 L362 P366	A360-H364 PolarHBondContact O-N 2.65Å; F361-H364 PolarHBondContact O-N 2.76Å; F361-H364 VanDerWaalsContact O-N 3.09Å; L362-H364 VanDerWaalsContact C-N 3.35Å; H364-P366 WeakPolarHBondContact O-CD 3.38Å
365	Y	92.3	Very high	75.4	Confident	49 Å²	49	76.8 Å²	76.8	19%	0.192	41%	0.408	C	S	.	.	S	Bend	trans	-122.7	74	178.2	-59	-73.9	0	0	0	110.7	F361 L362 V367 E1167	F361-Y365 AromaticContact CD2-CD2 3.76Å; F361-Y365 HydrophobicContact CD2-CD2 3.76Å; F361-Y365 HydrophobicContact CD2-CE2 4.13Å; F361-Y365 HydrophobicContact CE1-CD2 4.3Å; F361-Y365 AromaticContact CE2-CD2 3.42Å; F361-Y365 HydrophobicContact CE2-CD2 3.42Å; F361-Y365 VanDerWaalsContact CE2-CD2 3.42Å; F361-Y365 AromaticContact CE2-CE2 3.78Å; F361-Y365 HydrophobicContact CE2-CE2 3.78Å; F361-Y365 HydrophobicContact CE2-CG 4.37Å; F361-Y365 HydrophobicContact CG-CD2 4.33Å; F361-Y365 AromaticContact CZ-CD2 3.71Å; F361-Y365 HydrophobicContact CZ-CD2 3.71Å; F361-Y365 HydrophobicContact CZ-CE2 4.42Å; F361-Y365 HydrophobicContact CZ-CG 4.25Å; F361-Y365 PolarHBondContact O-N 2.77Å; L362-Y365 CarbonylContact O-C 3.32Å; Y365-V367 PolarHBondContact O-N 3.25Å; Y365-E1167 HydrophobicContact CD1-CB 4.43Å; Y365-E1167 HydrophobicContact CD1-CG 3.8Å; Y365-E1167 HydrophobicContact CD2-CG 4.18Å; Y365-E1167 HydrophobicContact CE1-CB 3.97Å; Y365-E1167 HydrophobicContact CE1-CG 3.85Å; Y365-E1167 HydrophobicContact CE2-CB 4.43Å; Y365-E1167 HydrophobicContact CE2-CG 4.2Å; Y365-E1167 HydrophobicContact CG-CG 3.97Å
366	P	87.2	Confident	72.3	Confident	82 Å²	82	81.1 Å²	81.1	53%	0.532	43%	0.43	S	S	.	.			trans	-62.1	135.2	-176.1	22.8	-32.3	0	0	0	112.4	L362 H364 D368 R1147	L362-P366 VanDerWaalsContact O-CA 3.26Å; L362-P366 WeakPolarHBondContact O-CA 3.34Å; H364-P366 WeakPolarHBondContact O-CD 3.38Å; P366-D368 PolarHBondContact O-N 3.28Å; P366-R1147 PolarHBondContact O-NH1 2.87Å
367	V	82.2	Confident	69.4	Low	31 Å²	31	82.3 Å²	82.3	19%	0.188	44%	0.435	C	S	.	.			trans	-96.2	91.9	179.9	-168.2	0	0	0	0	109.6	L362 Y365 S369 R1143 A1144 R1147	L362-V367 HydrophobicContact CD2-CG2 3.85Å; Y365-V367 PolarHBondContact O-N 3.25Å; V367-S369 PolarHBondContact O-N 3.25Å; V367-R1143 HydrophobicContact CG1-CB 3.64Å; V367-A1144 HydrophobicContact CG2-CB 3.82Å; V367-R1147 VanDerWaalsContact CA-NH2 3.33Å
368	D	69.3	Low	66.7	Low	94 Å²	94	83.3 Å²	83.3	50%	0.503	44%	0.444	S	S	.	.			trans	-46.9	136.7	170.9	-84.2	-17.5	0	0	0	113.3	P366 W371	P366-D368 PolarHBondContact O-N 3.28Å; D368-W371 VanDerWaalsContact CB-CD1 3.47Å
369	S	56	Low	63.6	Low	93 Å²	93	90.9 Å²	90.9	65%	0.65	48%	0.479	S	S	*	.	G	3₁₀ helix	trans	-76.3	-20.1	179.1	45.5	0	0	0	0	113.6	V367 W371	V367-S369 PolarHBondContact O-N 3.25Å; S369-W371 VanDerWaalsContact C-N 3.31Å; S369-W371 PolarHBondContact O-N 2.87Å
370	S	44.4	Very low	60.6	Low	64 Å²	64	89.2 Å²	89.2	45%	0.448	48%	0.477	S	S	.	.	G	3₁₀ helix	trans	-73.5	-13.9	-173.1	50.8	0	0	0	0	115.1
371	W	40.1	Very low	57.6	Low	160 Å²	160	94.3 Å²	94.3	61%	0.606	50%	0.496	S	S	*	.	G	3₁₀ helix	trans	-88.8	-2.4	-169	-66.4	67.5	0	0	0	114.6	D368 S369	D368-W371 VanDerWaalsContact CB-CD1 3.47Å; S369-W371 VanDerWaalsContact C-N 3.31Å; S369-W371 PolarHBondContact O-N 2.87Å
372	I	41.1	Very low	54.6	Low	83 Å²	83	101.5 Å²	101.5	43%	0.426	54%	0.535	S	S	.	.	G	3₁₀ helix	trans	-103.5	-5.8	-175.6	-55	175.6	0	0	0	112.8	P374 R1143	I372-P374 VanDerWaalsContact O-CD 3.31Å; I372-P374 WeakPolarHBondContact O-CD 3.44Å; I372-R1143 HydrophobicContact CD1-CB 4.31Å; I372-R1143 HydrophobicContact CD1-CG 3.69Å
373	S	34.1	Very low	51.7	Low	58 Å²	58	106 Å²	106	41%	0.406	56%	0.558	S	S	.	*			trans	-62.5	121.6	176.1	-63	0	0	0	0	110.3	E375 L376	S373-E375 PolarHBondContact O-N 3.45Å; S373-L376 PolarHBondContact O-N 2.8Å; S373-L376 VanDerWaalsContact O-N 3.12Å
374	P	42.2	Very low	48.8	Very low	92 Å²	92	107.2 Å²	107.2	60%	0.597	56%	0.557	S	S	*	*	G	3₁₀ helix	trans	-54.5	-25.7	179.9	-24.8	32.8	0	0	0	113.1	I372 L376 R377	I372-P374 VanDerWaalsContact O-CD 3.31Å; I372-P374 WeakPolarHBondContact O-CD 3.44Å; P374-L376 PolarHBondContact O-N 2.78Å; P374-R377 WeakPolarHBondContact O-CB 3.47Å; P374-R377 PolarHBondContact O-N 3.25Å
375	E	34.8	Very low	46	Very low	159 Å²	159	106.1 Å²	106.1	74%	0.743	56%	0.562	S	S	*	*	G	3₁₀ helix	trans	-69.3	-27.2	-177.2	-68.5	165.3	167.1	0	0	113.6	S373	S373-E375 PolarHBondContact O-N 3.45Å
376	L	29.5	Very low	43.5	Very low	95 Å²	95	107.3 Å²	107.3	50%	0.497	57%	0.571	S	S	.	*	G	3₁₀ helix	trans	-84.8	-6.3	176.2	-81.5	166.1	0	0	0	113.6	S373 P374 L378 Q379	S373-L376 PolarHBondContact O-N 2.8Å; S373-L376 VanDerWaalsContact O-N 3.12Å; P374-L376 PolarHBondContact O-N 2.78Å; L376-L378 PolarHBondContact O-N 3.4Å; L376-L378 VanDerWaalsContact O-N 3.09Å; L376-Q379 PolarHBondContact O-N 2.51Å
377	R	35.2	Very low	41.1	Very low	186 Å²	186	105.7 Å²	105.7	70%	0.702	57%	0.569	S	S	*	*	G	3₁₀ helix	trans	-62.7	-12.4	168.2	-66.7	-173.5	177.2	174.3	1.4	112.7	P374	P374-R377 WeakPolarHBondContact O-CB 3.47Å; P374-R377 PolarHBondContact O-N 3.25Å
378	L	40.8	Very low	39.1	Very low	111 Å²	111	113.7 Å²	113.7	58%	0.581	60%	0.602	S	S	*	*	G	3₁₀ helix	trans	-96	-5.9	-179	-72.9	160.3	0	0	0	114.6	L376	L376-L378 PolarHBondContact O-N 3.4Å; L376-L378 VanDerWaalsContact O-N 3.09Å
379	Q	30.8	Very low	37.7	Very low	160 Å²	160	117.3 Å²	117.3	75%	0.748	62%	0.621	S	S	*	*	S	Bend	trans	-133.4	26.7	-168.1	-71.6	-168.2	-8.6	0	0	116.2	L376	L376-Q379 PolarHBondContact O-N 2.51Å
380	S	33.5	Very low	37.4	Very low	50 Å²	50	118.5 Å²	118.5	35%	0.35	63%	0.629	S	S	.	*			trans	-110.8	93.8	166	61.9	0	0	0	0	110.2	D382	S380-D382 PolarHBondContact O-N 2.68Å
381	D	34.7	Very low	38.1	Very low	163 Å²	163	117.7 Å²	117.7	87%	0.872	63%	0.631	S	S	*	*			trans	-70.7	4.3	175.1	-86.7	-25.3	0	0	0	113.8	I383	D381-I383 PolarHBondContact O-N 3.5Å
382	D	33.9	Very low	39.6	Very low	161 Å²	161	114.6 Å²	114.6	86%	0.861	63%	0.631	S	S	*	*			trans	-85.4	30.8	174.1	-73.3	-22.3	0	0	0	113	S380 L384	S380-D382 PolarHBondContact O-N 2.68Å; D382-L384 PolarHBondContact O-N 2.92Å; D382-L384 VanDerWaalsContact O-N 3.08Å
383	I	36	Very low	41.8	Very low	106 Å²	106	113.2 Å²	113.2	54%	0.544	63%	0.625	S	S	.	*			trans	-73.9	100.3	162.6	-59.1	175.2	0	0	0	105.2	D381 P385	D381-I383 PolarHBondContact O-N 3.5Å; I383-P385 VanDerWaalsContact O-CD 3.26Å; I383-P385 WeakPolarHBondContact O-CD 3.26Å
384	L	33.4	Very low	44.5	Very low	121 Å²	121	112 Å²	112	63%	0.634	62%	0.616	S	S	*	*			trans	-38.9	114.5	157.4	-87.1	156.7	0	0	0	106.3	D382 L386	D382-L384 PolarHBondContact O-N 2.92Å; D382-L384 VanDerWaalsContact O-N 3.08Å; L384-L386 PolarHBondContact O-N 2.83Å
385	P	34.6	Very low	46.9	Very low	110 Å²	110	108 Å²	108	71%	0.714	59%	0.589	S	S	*	*			trans	-64.5	94	178.8	23.8	-29.8	0	0	0	106.4	I383 G387	I383-P385 VanDerWaalsContact O-CD 3.26Å; I383-P385 WeakPolarHBondContact O-CD 3.26Å; P385-G387 PolarHBondContact O-N 3.5Å
386	L	40	Very low	49.8	Very low	74 Å²	74	100.4 Å²	100.4	39%	0.387	55%	0.554	S	S	.	*			trans	-67.3	11.4	166.1	-93.4	132.5	0	0	0	110.9	L384 R873 F990	L384-L386 PolarHBondContact O-N 2.83Å; L386-R873 VanDerWaalsContact CD1-NH2 3.34Å; L386-F990 HydrophobicContact CD2-CD2 3.72Å; L386-F990 HydrophobicContact CD2-CE2 3.68Å; L386-F990 HydrophobicContact CD2-CG 4.29Å; L386-F990 HydrophobicContact CD2-CZ 4.24Å
387	G	36.7	Very low	52.9	Low	48 Å²	48	96 Å²	96	50%	0.495	53%	0.531	S	S	.	.	S	Bend	trans	-136.3	128	177	0	0	0	0	0	111.7	P385	P385-G387 PolarHBondContact O-N 3.5Å
388	K	39.9	Very low	55.6	Low	200 Å²	200	88.8 Å²	88.8	87%	0.87	51%	0.508	S	S	*	.			trans	93.4	33.1	163.8	-56.9	-173.9	179	178.4	0	118.8	S390	K388-S390 PolarHBondContact O-N 2.92Å
389	D	39.2	Very low	57.9	Low	170 Å²	170	85.6 Å²	85.6	91%	0.909	50%	0.502	S	S	*	.				-66.8	99.6	129.1	-94.4	-10.3	0	0	0	105.3	G391	D389-G391 PolarHBondContact O-N 3.22Å
390	S	49.7	Very low	60.7	Low	117 Å²	117	85 Å²	85	82%	0.818	50%	0.497	S	S	*	.			trans	-65.8	74	168.4	49.5	0	0	0	0	107.2	K388	K388-S390 PolarHBondContact O-N 2.92Å
391	G	59	Low	63.4	Low	47 Å²	47	86.8 Å²	86.8	49%	0.485	51%	0.507	S	S	.	.	P	Polyproline II helix	trans	-50.7	154.4	164.8	0	0	0	0	0	108.6	D389 L393	D389-G391 PolarHBondContact O-N 3.22Å; G391-L393 PolarHBondContact O-N 3.49Å; G391-L393 VanDerWaalsContact O-N 3.17Å
392	P	72.5	Confident	66.1	Low	95 Å²	95	80.4 Å²	80.4	62%	0.617	47%	0.471	S	S	*	.	P	Polyproline II helix	trans	-50.1	130	179.7	22	-33	0	0	0	109.3	P401	P392-P401 HydrophobicContact CB-CB 4.07Å; P392-P401 HydrophobicContact CG-CB 3.89Å; P392-P401 HydrophobicContact CG-CG 4.46Å
393	L	86.3	Confident	68.7	Low	55 Å²	55	79.8 Å²	79.8	29%	0.288	47%	0.465	S	S	.	.	P	Polyproline II helix	trans	-47	144.9	178.3	-66	173.1	0	0	0	109.4	G391 Y402 E551	G391-L393 PolarHBondContact O-N 3.49Å; G391-L393 VanDerWaalsContact O-N 3.17Å; L393-Y402 WeakPolarHBondContact O-CA 3.31Å; L393-Y402 WeakPolarHBondContact O-CB 3.26Å; L393-Y402 PolarHBondContact O-N 2.9Å; L393-E551 HydrophobicContact CD1-CB 4.25Å; L393-E551 WeakPolarHBondContact CD1-OE2 3.31Å
394	S	90.9	Very high	71.3	Confident	32 Å²	32	79 Å²	79	22%	0.224	47%	0.467	C	S	.	.	B	Isolated β-bridge	trans	-76	134.1	171.5	-170.1	0	0	0	0	109.4	P396 G399 S546 N547	S394-P396 WeakPolarHBondContact O-CD 3.47Å; S394-G399 PolarHBondContact OG-O 3.16Å; S394-S546 WeakPolarHBondContact CB-OG 3.18Å; S394-N547 WeakPolarHBondContact O-CB 3.38Å; S394-N547 PolarHBondContact O-ND2 2.97Å
395	D	93.9	Very high	74	Confident	7 Å²	7	75.6 Å²	75.6	4%	0.037	45%	0.449	C	S	.	.			trans	-63.8	115.5	170.9	177.4	-10.1	0	0	0	109	I397 T398 G399 K400 Y402	D395-I397 PolarHBondContact O-N 2.88Å; D395-I397 VanDerWaalsContact O-N 3.09Å; D395-I397 WeakPolarHBondContact OD1-CB 3.35Å; D395-I397 PolarHBondContact OD1-N 3.36Å; D395-T398 WeakPolarHBondContact CB-OG1 3.32Å; D395-T398 VanDerWaalsContact CG-OG1 3.22Å; D395-T398 PolarHBondContact O-N 3.03Å; D395-T398 PolarHBondContact OD1-N 3.46Å; D395-T398 WeakPolarHBondContact OD2-CG2 3.37Å; D395-T398 PolarHBondContact OD2-OG1 2.98Å; D395-G399 WeakPolarHBondContact O-CA 3.32Å; D395-G399 PolarHBondContact O-N 3.37Å; D395-K400 VanDerWaalsContact CB-O 3.3Å; D395-K400 WeakPolarHBondContact CB-O 3.39Å; D395-K400 PolarHBondContact N-O 2.92Å; D395-Y402 HydrophobicContact CB-CD2 4.39Å
396	P	94.4	Very high	76.8	Confident	1 Å²	1	73 Å²	73	1%	0.006	43%	0.433	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-19.7	-177.7	-24	37.3	0	0	0	113.3	S394 I487 K543 N547 L550 V553	S394-P396 WeakPolarHBondContact O-CD 3.47Å; P396-I487 HydrophobicContact CB-CD1 3.81Å; P396-K543 HydrophobicContact CB-CD 4.47Å; P396-K543 WeakPolarHBondContact O-CD 3.39Å; P396-K543 WeakPolarHBondContact O-CE 3.27Å; P396-K543 PolarHBondContact O-NZ 3.39Å; P396-N547 WeakPolarHBondContact CD-ND2 3.35Å; P396-N547 HydrophobicContact CG-CB 4.04Å; P396-N547 WeakPolarHBondContact CG-ND2 3.12Å; P396-L550 HydrophobicContact CB-CD2 4.15Å; P396-L550 HydrophobicContact CG-CD2 4.02Å; P396-V553 HydrophobicContact CB-CG2 3.67Å; P396-V553 HydrophobicContact CG-CG2 3.82Å
397	I	95.3	Very high	79.3	Confident	1 Å²	1	77.2 Å²	77.2	1%	0.005	45%	0.451	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-55.2	176.6	-57.7	-59.1	0	0	0	110.6	D395 N485 I487 P525 P526 A531 L533	D395-I397 PolarHBondContact O-N 2.88Å; D395-I397 VanDerWaalsContact O-N 3.09Å; D395-I397 WeakPolarHBondContact OD1-CB 3.35Å; D395-I397 PolarHBondContact OD1-N 3.36Å; I397-N485 HydrophobicContact CD1-CB 4.23Å; I397-N485 HydrophobicContact CG1-CB 4.08Å; I397-I487 HydrophobicContact CD1-CD1 4.28Å; I397-I487 HydrophobicContact CD1-CG1 3.74Å; I397-P525 VanDerWaalsContact O-CB 3.27Å; I397-P525 WeakPolarHBondContact O-CB 3.42Å; I397-P526 HydrophobicContact CG2-CG 3.87Å; I397-A531 HydrophobicContact CG1-CB 4.44Å; I397-A531 HydrophobicContact CG2-CB 3.73Å; I397-L533 HydrophobicContact CD1-CB 4.17Å
398	T	92.3	Very high	82.1	Confident	35 Å²	35	78.6 Å²	78.6	22%	0.215	46%	0.457	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.8	-20.2	-168.1	67.2	0	0	0	0	114.4	D395 K400 R528	D395-T398 WeakPolarHBondContact CB-OG1 3.32Å; D395-T398 VanDerWaalsContact CG-OG1 3.22Å; D395-T398 PolarHBondContact O-N 3.03Å; D395-T398 PolarHBondContact OD1-N 3.46Å; D395-T398 WeakPolarHBondContact OD2-CG2 3.37Å; D395-T398 PolarHBondContact OD2-OG1 2.98Å; T398-K400 PolarHBondContact O-N 3.49Å; T398-K400 PolarHBondContact OG1-N 2.86Å; T398-R528 HydrophobicContact CG2-CB 4.24Å
399	G	88.6	Confident	84.6	Confident	45 Å²	45	72.7 Å²	72.7	46%	0.464	43%	0.433	S	S	.	.	S	Bend	trans	76.5	-1.9	-173.3	0	0	0	0	0	114.7	S394 D395	S394-G399 PolarHBondContact OG-O 3.16Å; D395-G399 WeakPolarHBondContact O-CA 3.32Å; D395-G399 PolarHBondContact O-N 3.37Å
400	K	90.2	Very high	87.3	Confident	147 Å²	147	66.3 Å²	66.3	64%	0.639	40%	0.398	S	S	*	.	S	Bend	trans	-82.4	167.1	176.3	-63	-176.9	179.8	-177.7	0	110.7	D395 T398 Y402	D395-K400 VanDerWaalsContact CB-O 3.3Å; D395-K400 WeakPolarHBondContact CB-O 3.39Å; D395-K400 PolarHBondContact N-O 2.92Å; T398-K400 PolarHBondContact O-N 3.49Å; T398-K400 PolarHBondContact OG1-N 2.86Å; K400-Y402 PolarHBondContact O-N 3.17Å
401	P	89.8	Confident	89.5	Confident	87 Å²	87	64.1 Å²	64.1	57%	0.565	38%	0.379	S	S	*	.	B	Isolated β-bridge	trans	-51.4	129.9	167.6	-28.3	36.8	0	0	0	111.4	P392 M403	P392-P401 HydrophobicContact CB-CB 4.07Å; P392-P401 HydrophobicContact CG-CB 3.89Å; P392-P401 HydrophobicContact CG-CG 4.46Å; P401-M403 PolarHBondContact O-N 2.85Å
402	Y	91.3	Very high	91.3	Very high	30 Å²	30	69.4 Å²	69.4	12%	0.118	38%	0.384	C	S	.	.	P	Polyproline II helix	trans	-72.2	121	-178.9	176.3	-96.2	0	0	0	109.8	L393 D395 K400 P404 R528 E551	L393-Y402 WeakPolarHBondContact O-CA 3.31Å; L393-Y402 WeakPolarHBondContact O-CB 3.26Å; L393-Y402 PolarHBondContact O-N 2.9Å; D395-Y402 HydrophobicContact CB-CD2 4.39Å; K400-Y402 PolarHBondContact O-N 3.17Å; Y402-P404 HydrophobicContact CE1-CB 4.4Å; Y402-R528 VanDerWaalsContact CZ-NH2 3.34Å; Y402-R528 PolarHBondContact OH-NH2 2.89Å; Y402-R528 VanDerWaalsContact OH-NH2 3.08Å; Y402-E551 HydrophobicContact CE1-CB 4.42Å; Y402-E551 VanDerWaalsContact CE1-CD 3.49Å; Y402-E551 HydrophobicContact CE1-CG 4.03Å; Y402-E551 WeakPolarHBondContact CE1-OE1 3.48Å; Y402-E551 WeakPolarHBondContact CE2-O 3.31Å; Y402-E551 PolarHBondContact OH-OE1 3.3Å
403	M	89.4	Confident	92.4	Very high	148 Å²	148	67.3 Å²	67.3	73%	0.729	37%	0.368	S	S	*	.			trans	-124.4	123.1	168	-68.2	-170.1	-69.6	0	0	108.4	P401 R528	P401-M403 PolarHBondContact O-N 2.85Å; M403-R528 PolarHBondContact O-NH1 2.93Å
404	P	89.1	Confident	92.9	Very high	90 Å²	90	64.7 Å²	64.7	58%	0.584	35%	0.354	S	S	*	.	P	Polyproline II helix	trans	-61.5	144.8	175.1	26.1	-32.3	0	0	0	110.1	Y402	Y402-P404 HydrophobicContact CE1-CB 4.4Å
405	L	90.8	Very high	93.2	Very high	49 Å²	49	68.7 Å²	68.7	26%	0.257	37%	0.369	S	S	.	.	P	Polyproline II helix	trans	-68.4	137.9	175	-68.9	169.4	0	0	0	109.1	E409 E410 L413 A482	L405-E409 HydrophobicContact CB-CB 4.5Å; L405-E409 HydrophobicContact CD2-CB 4.21Å; L405-E410 HydrophobicContact CB-CB 4.41Å; L405-L413 HydrophobicContact CD1-CD1 3.82Å; L405-L413 HydrophobicContact CD2-CD1 3.77Å; L405-L413 HydrophobicContact CG-CD1 4.46Å; L405-A482 HydrophobicContact CD1-CB 4.28Å
406	S	93.3	Very high	93.3	Very high	56 Å²	56	70.6 Å²	70.6	39%	0.392	38%	0.383	S	S	.	.	P	Polyproline II helix	trans	-65.9	154.7	165.7	62.6	0	0	0	0	110.2	A408 E409 E410	S406-A408 PolarHBondContact O-N 3.49Å; S406-E409 WeakPolarHBondContact CB-OE2 3.35Å; S406-E409 PolarHBondContact N-OE2 3.42Å; S406-E409 PolarHBondContact O-N 2.89Å; S406-E409 WeakPolarHBondContact OG-CB 3.38Å; S406-E409 VanDerWaalsContact OG-CD 3.23Å; S406-E409 WeakPolarHBondContact OG-CG 3.03Å; S406-E409 PolarHBondContact OG-N 3.34Å; S406-E409 PolarHBondContact OG-OE2 3.26Å; S406-E410 PolarHBondContact O-N 3.23Å
407	E	93.6	Very high	93.4	Very high	162 Å²	162	70.9 Å²	70.9	76%	0.757	39%	0.385	S	S	*	.	H	α-helix	trans	-55.7	-40.6	179.1	-171.4	174.3	-169.3	0	0	111.8	E410 V411	E407-E410 PolarHBondContact O-N 2.97Å; E407-V411 WeakPolarHBondContact O-CG2 3.44Å; E407-V411 PolarHBondContact O-N 3.29Å
408	A	94.7	Very high	93.4	Very high	76 Å²	76	72.6 Å²	72.6	63%	0.628	39%	0.394	S	S	*	.	H	α-helix	trans	-63.9	-41.5	175.9	0	0	0	0	0	112.9	S406 R412	S406-A408 PolarHBondContact O-N 3.49Å; A408-R412 VanDerWaalsContact O-CB 3.28Å; A408-R412 WeakPolarHBondContact O-CB 3.23Å; A408-R412 PolarHBondContact O-N 2.97Å
409	E	93.5	Very high	93.5	Very high	76 Å²	76	75.7 Å²	75.7	36%	0.355	41%	0.406	S	S	.	.	H	α-helix	trans	-67.4	-39.5	175.8	-73.2	169.5	133.8	0	0	111.9	L405 S406 R412 L413	L405-E409 HydrophobicContact CB-CB 4.5Å; L405-E409 HydrophobicContact CD2-CB 4.21Å; S406-E409 WeakPolarHBondContact CB-OE2 3.35Å; S406-E409 PolarHBondContact N-OE2 3.42Å; S406-E409 PolarHBondContact O-N 2.89Å; S406-E409 WeakPolarHBondContact OG-CB 3.38Å; S406-E409 VanDerWaalsContact OG-CD 3.23Å; S406-E409 WeakPolarHBondContact OG-CG 3.03Å; S406-E409 PolarHBondContact OG-N 3.34Å; S406-E409 PolarHBondContact OG-OE2 3.26Å; E409-R412 PolarHBondContact O-N 3.28Å; E409-L413 VanDerWaalsContact O-CB 3.25Å; E409-L413 WeakPolarHBondContact O-CB 3.39Å; E409-L413 VanDerWaalsContact O-CG 3.26Å; E409-L413 WeakPolarHBondContact O-CG 3.46Å; E409-L413 PolarHBondContact O-N 3.25Å
410	E	94.5	Very high	93.8	Very high	37 Å²	37	74.7 Å²	74.7	17%	0.173	39%	0.39	C	S	.	.	H	α-helix	trans	-63.3	-46.3	178.3	-166.9	-165.7	111.4	0	0	111.5	L405 S406 E407 L413 S414 A482 R483	L405-E410 HydrophobicContact CB-CB 4.41Å; S406-E410 PolarHBondContact O-N 3.23Å; E407-E410 PolarHBondContact O-N 2.97Å; E410-L413 PolarHBondContact O-N 3.19Å; E410-S414 VanDerWaalsContact O-CB 3.29Å; E410-S414 WeakPolarHBondContact O-CB 3.04Å; E410-S414 PolarHBondContact O-N 2.89Å; E410-S414 PolarHBondContact O-OG 2.76Å; E410-A482 HydrophobicContact CG-CB 3.75Å; E410-A482 WeakPolarHBondContact O-CB 3.38Å; E410-R483 HydrophobicContact CG-CG 4.32Å; E410-R483 IonicContact OE1-CZ 3.97Å; E410-R483 IonicContact OE1-NE 2.93Å; E410-R483 PolarHBondContact OE1-NE 3Å; E410-R483 IonicContact OE1-NH2 3.25Å; E410-R483 PolarHBondContact OE1-NH2 2.89Å; E410-R483 IonicContact OE2-CZ 2.85Å; E410-R483 IonicContact OE2-NE 2.7Å; E410-R483 PolarHBondContact OE2-NE 3.37Å; E410-R483 IonicContact OE2-NH2 3.59Å
411	V	96.3	Very high	93.8	Very high	70 Å²	70	69.3 Å²	69.3	42%	0.424	37%	0.366	S	S	.	.	H	α-helix	trans	-61.7	-48.9	175.6	170.8	0	0	0	0	110.3	E407 L413 S414 Q415	E407-V411 WeakPolarHBondContact O-CG2 3.44Å; E407-V411 PolarHBondContact O-N 3.29Å; V411-L413 PolarHBondContact O-N 3.02Å; V411-S414 PolarHBondContact O-N 3.45Å; V411-Q415 HydrophobicContact CG1-CG 4.46Å; V411-Q415 WeakPolarHBondContact O-CB 3.39Å; V411-Q415 WeakPolarHBondContact O-CG 3.38Å; V411-Q415 PolarHBondContact O-N 3.17Å
412	R	96.5	Very high	93.8	Very high	158 Å²	158	74.2 Å²	74.2	60%	0.596	37%	0.373	S	S	*	.	H	α-helix	trans	-60.4	-45.4	179.6	-175.7	-176.3	66.4	-171.9	-3.6	112.1	A408 E409 S416	A408-R412 VanDerWaalsContact O-CB 3.28Å; A408-R412 WeakPolarHBondContact O-CB 3.23Å; A408-R412 PolarHBondContact O-N 2.97Å; E409-R412 PolarHBondContact O-N 3.28Å; R412-S416 WeakPolarHBondContact O-CB 3.49Å; R412-S416 PolarHBondContact O-N 3.36Å
413	L	95.3	Very high	93.7	Very high	51 Å²	51	81.1 Å²	81.1	27%	0.267	40%	0.398	S	S	.	.	H	α-helix	trans	-65.2	-41	177.8	-77.5	168.4	0	0	0	111.2	L405 E409 E410 V411 S416 L417 A482	L405-L413 HydrophobicContact CD1-CD1 3.82Å; L405-L413 HydrophobicContact CD2-CD1 3.77Å; L405-L413 HydrophobicContact CG-CD1 4.46Å; E409-L413 VanDerWaalsContact O-CB 3.25Å; E409-L413 WeakPolarHBondContact O-CB 3.39Å; E409-L413 VanDerWaalsContact O-CG 3.26Å; E409-L413 WeakPolarHBondContact O-CG 3.46Å; E409-L413 PolarHBondContact O-N 3.25Å; E410-L413 PolarHBondContact O-N 3.19Å; V411-L413 PolarHBondContact O-N 3.02Å; L413-S416 PolarHBondContact O-N 2.95Å; L413-L417 WeakPolarHBondContact O-CB 3.36Å; L413-L417 VanDerWaalsContact O-CG 3.27Å; L413-L417 WeakPolarHBondContact O-CG 3.41Å; L413-L417 PolarHBondContact O-N 3.24Å; L413-A482 HydrophobicContact CB-CB 3.69Å
414	S	97.6	Very high	93	Very high	1 Å²	1	74.9 Å²	74.9	1%	0.007	37%	0.367	C	S	.	.	H	α-helix	trans	-65.8	-41.1	178.2	-60.5	0	0	0	0	112.3	E410 V411 L417 L418 G479 G481 A482	E410-S414 VanDerWaalsContact O-CB 3.29Å; E410-S414 WeakPolarHBondContact O-CB 3.04Å; E410-S414 PolarHBondContact O-N 2.89Å; E410-S414 PolarHBondContact O-OG 2.76Å; V411-S414 PolarHBondContact O-N 3.45Å; S414-L417 PolarHBondContact O-N 3.05Å; S414-L418 WeakPolarHBondContact O-CB 3.18Å; S414-L418 PolarHBondContact O-N 3.47Å; S414-G479 WeakPolarHBondContact CB-O 3.05Å; S414-G481 PolarHBondContact OG-N 3.4Å; S414-A482 VanDerWaalsContact OG-CB 3.24Å; S414-A482 WeakPolarHBondContact OG-CB 3.3Å; S414-A482 PolarHBondContact OG-N 2.89Å
415	Q	97.2	Very high	91.9	Very high	115 Å²	115	72.5 Å²	72.5	54%	0.537	36%	0.359	S	S	.	.	H	α-helix	trans	-62.2	-46	172.6	-72.7	173.2	-6.3	0	0	111.4	V411 L417 L418 E419	V411-Q415 HydrophobicContact CG1-CG 4.46Å; V411-Q415 WeakPolarHBondContact O-CB 3.39Å; V411-Q415 WeakPolarHBondContact O-CG 3.38Å; V411-Q415 PolarHBondContact O-N 3.17Å; Q415-L417 VanDerWaalsContact C-N 3.35Å; Q415-L417 PolarHBondContact O-N 3Å; Q415-L418 WeakPolarHBondContact O-CB 3.21Å; Q415-L418 PolarHBondContact O-N 2.86Å; Q415-E419 PolarHBondContact O-N 2.88Å
416	S	96.1	Very high	90.4	Very high	47 Å²	47	73.6 Å²	73.6	33%	0.329	37%	0.369	S	S	.	.	H	α-helix	trans	-60.5	-43	176.6	-173.7	0	0	0	0	112.1	R412 L413 L418 E419 L420	R412-S416 WeakPolarHBondContact O-CB 3.49Å; R412-S416 PolarHBondContact O-N 3.36Å; L413-S416 PolarHBondContact O-N 2.95Å; S416-L418 VanDerWaalsContact C-N 3.33Å; S416-L418 PolarHBondContact O-N 3.11Å; S416-E419 PolarHBondContact O-N 3.3Å; S416-L420 VanDerWaalsContact O-CG 3.23Å; S416-L420 WeakPolarHBondContact O-CG 3.17Å; S416-L420 PolarHBondContact O-N 3.46Å
417	L	96	Very high	88.8	Confident	7 Å²	7	75.3 Å²	75.3	4%	0.037	37%	0.373	C	S	.	.	H	α-helix	trans	-62.3	-40.5	175.8	-73.3	167.4	0	0	0	112	L413 S414 Q415 L420 W421 V476 L511 N514	L413-L417 WeakPolarHBondContact O-CB 3.36Å; L413-L417 VanDerWaalsContact O-CG 3.27Å; L413-L417 WeakPolarHBondContact O-CG 3.41Å; L413-L417 PolarHBondContact O-N 3.24Å; S414-L417 PolarHBondContact O-N 3.05Å; Q415-L417 VanDerWaalsContact C-N 3.35Å; Q415-L417 PolarHBondContact O-N 3Å; L417-L420 PolarHBondContact O-N 3.03Å; L417-W421 WeakPolarHBondContact O-CB 3.29Å; L417-W421 PolarHBondContact O-N 3.41Å; L417-V476 HydrophobicContact CB-CG1 4.11Å; L417-V476 HydrophobicContact CB-CG2 4Å; L417-V476 HydrophobicContact CD1-CG2 4.44Å; L417-V476 WeakPolarHBondContact O-CG1 3.4Å; L417-L511 HydrophobicContact CD2-CD2 4.22Å; L417-N514 WeakPolarHBondContact CD2-ND2 3.17Å
418	L	95.6	Very high	87.2	Confident	38 Å²	38	70.3 Å²	70.3	20%	0.199	35%	0.347	C	S	.	.	H	α-helix	trans	-63.5	-40.8	176.4	-179	60.8	0	0	0	111.7	S414 Q415 S416 W421 R422 V476	S414-L418 WeakPolarHBondContact O-CB 3.18Å; S414-L418 PolarHBondContact O-N 3.47Å; Q415-L418 WeakPolarHBondContact O-CB 3.21Å; Q415-L418 PolarHBondContact O-N 2.86Å; S416-L418 VanDerWaalsContact C-N 3.33Å; S416-L418 PolarHBondContact O-N 3.11Å; L418-W421 PolarHBondContact O-N 3.41Å; L418-R422 WeakPolarHBondContact O-CG 3.5Å; L418-R422 PolarHBondContact O-N 2.86Å; L418-V476 HydrophobicContact CB-CG1 4.4Å
419	E	94.9	Very high	85.4	Confident	99 Å²	99	75 Å²	75	46%	0.463	36%	0.356	S	S	.	.	H	α-helix	trans	-63.2	-44.6	173.2	-70.7	178.1	-173	0	0	112.2	Q415 S416 W421 R422 R423	Q415-E419 PolarHBondContact O-N 2.88Å; S416-E419 PolarHBondContact O-N 3.3Å; E419-W421 VanDerWaalsContact C-N 3.31Å; E419-W421 PolarHBondContact O-N 2.76Å; E419-R422 PolarHBondContact O-N 3.23Å; E419-R423 VanDerWaalsContact O-CG 3.31Å; E419-R423 WeakPolarHBondContact O-CG 3.5Å; E419-R423 PolarHBondContact O-N 2.83Å
420	L	93.2	Very high	83.9	Confident	25 Å²	25	78.5 Å²	78.5	13%	0.131	37%	0.372	C	S	.	.	H	α-helix	trans	-63.9	-38.3	177.4	-67.1	166.9	0	0	0	111.7	S416 L417 R423 R424 S510 L511	S416-L420 VanDerWaalsContact O-CG 3.23Å; S416-L420 WeakPolarHBondContact O-CG 3.17Å; S416-L420 PolarHBondContact O-N 3.46Å; L417-L420 PolarHBondContact O-N 3.03Å; L420-R423 CarbonylContact O-C 3.59Å; L420-R423 PolarHBondContact O-N 3.36Å; L420-R424 PolarHBondContact O-N 2.9Å; L420-S510 WeakPolarHBondContact O-CB 3.38Å; L420-L511 HydrophobicContact CB-CD2 4Å; L420-L511 HydrophobicContact CB-CG 4.26Å
421	W	91.4	Very high	82.6	Confident	34 Å²	34	78.2 Å²	78.2	13%	0.129	38%	0.376	C	S	.	.	H	α-helix	trans	-62.7	-45.4	174.9	-170.6	-89.3	0	0	0	111.7	L417 L418 E419 R423 R424 E473 V476 L507 L511	L417-W421 WeakPolarHBondContact O-CB 3.29Å; L417-W421 PolarHBondContact O-N 3.41Å; L418-W421 PolarHBondContact O-N 3.41Å; E419-W421 VanDerWaalsContact C-N 3.31Å; E419-W421 PolarHBondContact O-N 2.76Å; W421-R423 PolarHBondContact O-N 3Å; W421-R424 WeakPolarHBondContact O-CB 3.32Å; W421-R424 PolarHBondContact O-N 3.07Å; W421-R424 VanDerWaalsContact O-N 3.14Å; W421-E473 HydrophobicContact CH2-CB 3.39Å; W421-E473 HydrophobicContact CH2-CG 3.79Å; W421-E473 HydrophobicContact CZ2-CB 3.52Å; W421-E473 HydrophobicContact CZ2-CG 3.32Å; W421-E473 HydrophobicContact CZ3-CB 4.14Å; W421-V476 HydrophobicContact CB-CG1 3.67Å; W421-V476 HydrophobicContact CD2-CG1 4.4Å; W421-V476 HydrophobicContact CE3-CG1 4.47Å; W421-V476 HydrophobicContact CG-CG1 4.05Å; W421-L507 HydrophobicContact CH2-CD2 4.47Å; W421-L507 HydrophobicContact CZ3-CD2 3.94Å; W421-L511 HydrophobicContact CB-CD1 4.35Å; W421-L511 HydrophobicContact CD2-CD1 4.16Å; W421-L511 HydrophobicContact CE3-CD1 3.34Å; W421-L511 HydrophobicContact CZ3-CD1 3.89Å
422	R	90.2	Very high	81.3	Confident	190 Å²	190	79.9 Å²	79.9	72%	0.717	39%	0.389	S	S	*	.	H	α-helix	trans	-61.7	-32.1	174.9	-70.9	171.4	-179	175.7	0.3	112.6	L418 E419 R424	L418-R422 WeakPolarHBondContact O-CG 3.5Å; L418-R422 PolarHBondContact O-N 2.86Å; E419-R422 PolarHBondContact O-N 3.23Å; R422-R424 VanDerWaalsContact C-N 3.33Å
423	R	87.7	Confident	80.5	Confident	174 Å²	174	79.5 Å²	79.5	66%	0.657	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.7	2.7	177.4	-67.1	176.7	-169.5	-164.2	5	114.4	E419 L420 W421 G425 S510	E419-R423 VanDerWaalsContact O-CG 3.31Å; E419-R423 WeakPolarHBondContact O-CG 3.5Å; E419-R423 PolarHBondContact O-N 2.83Å; L420-R423 CarbonylContact O-C 3.59Å; L420-R423 PolarHBondContact O-N 3.36Å; W421-R423 PolarHBondContact O-N 3Å; R423-G425 PolarHBondContact O-N 2.93Å; R423-S510 PolarHBondContact O-OG 3Å
424	R	75.7	Confident	79.9	Confident	17 Å²	17	79.1 Å²	79.1	6%	0.064	39%	0.391	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-24.3	-174.5	-175.3	175.6	-178	-169.3	6	113.8	L420 W421 R422 W428 E506 L507	L420-R424 PolarHBondContact O-N 2.9Å; W421-R424 WeakPolarHBondContact O-CB 3.32Å; W421-R424 PolarHBondContact O-N 3.07Å; W421-R424 VanDerWaalsContact O-N 3.14Å; R422-R424 VanDerWaalsContact C-N 3.33Å; R424-W428 VanDerWaalsContact CZ-CG 3.45Å; R424-W428 VanDerWaalsContact NH2-CE2 3.29Å; R424-E506 PolarHBondContact NH2-O 3.49Å; R424-L507 WeakPolarHBondContact CG-O 3.47Å; R424-L507 PolarHBondContact NE-O 3.47Å; R424-L507 VanDerWaalsContact NH2-CA 3.31Å
425	G	65.7	Low	79.3	Confident	41 Å²	41	80.4 Å²	80.4	42%	0.423	40%	0.4	S	S	.	.			trans	79	173.9	178.5	0	0	0	0	0	114	R423 I427	R423-G425 PolarHBondContact O-N 2.93Å; G425-I427 VanDerWaalsContact C-N 3.28Å; G425-I427 PolarHBondContact O-N 2.85Å
426	P	59.2	Low	78.9	Confident	71 Å²	71	75 Å²	75	46%	0.461	37%	0.374	S	S	.	.	G	3₁₀ helix	trans	-72.9	-10.1	-170.7	27.3	-34.1	0	0	0	115.1	W428 Q429 E430	P426-W428 PolarHBondContact O-N 3.39Å; P426-Q429 WeakPolarHBondContact O-CA 3.42Å; P426-Q429 WeakPolarHBondContact O-CB 3.37Å; P426-Q429 PolarHBondContact O-N 2.87Å; P426-E430 PolarHBondContact O-N 3.36Å
427	I	60.4	Low	78.6	Confident	92 Å²	92	74.1 Å²	74.1	47%	0.472	37%	0.366	S	S	.	.	G	3₁₀ helix	trans	-48.6	-34.2	-177.9	-61.6	170.8	0	0	0	112.5	G425 A431	G425-I427 VanDerWaalsContact C-N 3.28Å; G425-I427 PolarHBondContact O-N 2.85Å; I427-A431 PolarHBondContact O-N 2.92Å
428	W	58.7	Low	78.3	Confident	57 Å²	57	77.8 Å²	77.8	22%	0.216	39%	0.391	C	S	.	.	G	3₁₀ helix	trans	-81.6	-33.1	178.2	-137.2	66.6	0	0	0	114.1	R424 P426 E430 A431 Q469 L470	R424-W428 VanDerWaalsContact CZ-CG 3.45Å; R424-W428 VanDerWaalsContact NH2-CE2 3.29Å; P426-W428 PolarHBondContact O-N 3.39Å; W428-E430 VanDerWaalsContact C-N 3.26Å; W428-A431 WeakPolarHBondContact O-CB 3.33Å; W428-A431 PolarHBondContact O-N 3.34Å; W428-Q469 HydrophobicContact CZ2-CB 4.3Å; W428-L470 HydrophobicContact CH2-CD2 4.32Å
429	Q	57.7	Low	78.2	Confident	176 Å²	176	78.5 Å²	78.5	82%	0.822	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.5	-26.8	173.8	-70.1	176.7	-13.1	0	0	111.6	P426	P426-Q429 WeakPolarHBondContact O-CA 3.42Å; P426-Q429 WeakPolarHBondContact O-CB 3.37Å; P426-Q429 PolarHBondContact O-N 2.87Å
430	E	61.9	Low	78.1	Confident	149 Å²	149	76.9 Å²	76.9	70%	0.696	38%	0.382	S	S	*	.	S	Bend	trans	-84.8	-10	174	-67.1	175	-169.8	0	0	113.3	P426 W428	P426-E430 PolarHBondContact O-N 3.36Å; W428-E430 VanDerWaalsContact C-N 3.26Å
431	A	67.4	Low	78.1	Confident	31 Å²	31	80 Å²	80	26%	0.256	40%	0.399	S	S	.	.	S	Bend	trans	-69.3	135.2	-179.8	0	0	0	0	0	110.1	I427 W428 Q433	I427-A431 PolarHBondContact O-N 2.92Å; W428-A431 WeakPolarHBondContact O-CB 3.33Å; W428-A431 PolarHBondContact O-N 3.34Å; A431-Q433 PolarHBondContact O-N 3.26Å
432	P	69.6	Low	78.4	Confident	105 Å²	105	82.3 Å²	82.3	68%	0.682	42%	0.417	S	S	*	.	P	Polyproline II helix	trans	-59	132.9	176.9	21.5	-30.2	0	0	0	110.2	L434	P432-L434 PolarHBondContact O-N 3.14Å
433	Q	79.5	Confident	78.6	Confident	150 Å²	150	73.3 Å²	73.3	70%	0.701	38%	0.383	S	S	*	.	P	Polyproline II helix	trans	-61.4	127.2	178	-167.4	178.7	14.2	0	0	109.6	A431 D437	A431-Q433 PolarHBondContact O-N 3.26Å; Q433-D437 HydrophobicContact CG-CB 3.89Å
434	L	83	Confident	79.1	Confident	42 Å²	42	65.6 Å²	65.6	22%	0.22	36%	0.355	C	S	.	.	P	Polyproline II helix	trans	-96.2	155	177	-64.5	179.9	0	0	0	110.4	P432 V436 D437 P438 R466	P432-L434 PolarHBondContact O-N 3.14Å; L434-V436 HydrophobicContact CB-CG1 4.33Å; L434-V436 PolarHBondContact O-N 3.4Å; L434-D437 PolarHBondContact N-OD2 3.43Å; L434-D437 WeakPolarHBondContact O-CB 3.12Å; L434-D437 PolarHBondContact O-N 3.26Å; L434-P438 WeakPolarHBondContact O-CD 3.49Å; L434-R466 HydrophobicContact CD1-CG 3.85Å
435	P	84.9	Confident	80.1	Confident	29 Å²	29	67.2 Å²	67.2	19%	0.188	37%	0.369	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-22.3	-177.3	-25.4	32.1	0	0	0	115.5	P438 H439 C461 P612 F614	P435-P438 WeakPolarHBondContact O-CD 3.28Å; P435-H439 PolarHBondContact O-CD2 3.31Å; P435-C461 HydrophobicContact CB-CB 3.99Å; P435-C461 HydrophobicContact CG-CB 4.22Å; P435-P612 VanDerWaalsContact CB-O 3.25Å; P435-P612 WeakPolarHBondContact CB-O 3.23Å; P435-F614 HydrophobicContact CG-CB 3.95Å
436	V	89.1	Confident	81.6	Confident	0 Å²	0	65.9 Å²	65.9	0%	0	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-24.5	174.3	69.7	0	0	0	0	113.7	L434 H439 R440 I443 C461 R466 I467 V611	L434-V436 HydrophobicContact CB-CG1 4.33Å; L434-V436 PolarHBondContact O-N 3.4Å; V436-H439 PolarHBondContact O-N 3.35Å; V436-R440 PolarHBondContact O-N 3.42Å; V436-I443 HydrophobicContact CG2-CD1 3.46Å; V436-I443 VanDerWaalsContact CG2-CD1 3.46Å; V436-C461 VanDerWaalsContact CB-O 3.29Å; V436-C461 WeakPolarHBondContact CB-O 3.46Å; V436-C461 VanDerWaalsContact CG1-O 3.27Å; V436-C461 WeakPolarHBondContact CG1-O 3.46Å; V436-C461 PolarHBondContact N-O 3.31Å; V436-R466 HydrophobicContact CG1-CB 3.52Å; V436-R466 HydrophobicContact CG1-CG 3.65Å; V436-I467 HydrophobicContact CG2-CD1 4.4Å; V436-I467 HydrophobicContact CG2-CG1 4.14Å; V436-V611 HydrophobicContact CB-CG1 4.01Å; V436-V611 HydrophobicContact CG2-CG1 4.35Å; V436-V611 HydrophobicContact CG2-CG2 4.27Å
437	D	88.9	Confident	83.5	Confident	29 Å²	29	62.6 Å²	62.6	16%	0.155	33%	0.332	C	S	.	.	G	3₁₀ helix	trans	-65	-41.4	-171.9	-60.7	-27.7	0	0	0	112.8	Q433 L434 H439 R440 R466	Q433-D437 HydrophobicContact CG-CB 3.89Å; L434-D437 PolarHBondContact N-OD2 3.43Å; L434-D437 WeakPolarHBondContact O-CB 3.12Å; L434-D437 PolarHBondContact O-N 3.26Å; D437-H439 PolarHBondContact O-N 2.92Å; D437-R440 VanDerWaalsContact O-CB 3.24Å; D437-R440 WeakPolarHBondContact O-CB 3.34Å; D437-R440 PolarHBondContact O-N 3.45Å; D437-R440 VanDerWaalsContact O-N 3.13Å; D437-R466 WeakPolarHBondContact OD1-CD 3.42Å; D437-R466 IonicContact OD1-NE 2.66Å; D437-R466 IonicContact OD2-NE 3.67Å
438	P	90.3	Very high	85.1	Confident	85 Å²	85	62.2 Å²	62.2	55%	0.552	33%	0.328	S	S	*	.	G	3₁₀ helix	trans	-60.1	-23.1	172.1	-23.4	33.4	0	0	0	114.4	L434 P435	L434-P438 WeakPolarHBondContact O-CD 3.49Å; P435-P438 WeakPolarHBondContact O-CD 3.28Å
439	H	92.1	Very high	86.9	Confident	52 Å²	52	66.1 Å²	66.1	24%	0.241	35%	0.349	C	S	.	.	G	3₁₀ helix	trans	-93.4	5.9	-179.5	-64.8	-87	0	0	0	113	P435 V436 D437 D441 T442 I443 V611 P612	P435-H439 PolarHBondContact O-CD2 3.31Å; V436-H439 PolarHBondContact O-N 3.35Å; D437-H439 PolarHBondContact O-N 2.92Å; H439-D441 PolarHBondContact O-N 2.89Å; H439-T442 PolarHBondContact O-N 3.26Å; H439-I443 HydrophobicContact CB-CD1 3.88Å; H439-I443 HydrophobicContact CB-CG1 4.25Å; H439-I443 WeakPolarHBondContact O-CB 3.18Å; H439-I443 VanDerWaalsContact O-CG1 3.32Å; H439-I443 WeakPolarHBondContact O-CG1 3.45Å; H439-I443 PolarHBondContact O-N 3.09Å; H439-V611 HydrophobicContact CB-CG2 4.47Å; H439-P612 WeakPolarHBondContact NE2-CD 3.41Å
440	R	92.8	Very high	88.8	Confident	66 Å²	66	61 Å²	61	25%	0.249	33%	0.325	C	S	.	.	H	α-helix	trans	-46	-57	-176.7	169.8	177	-179.4	-94.8	17.4	113	V436 D437 T442 I443 L444 L470 E473	V436-R440 PolarHBondContact O-N 3.42Å; D437-R440 VanDerWaalsContact O-CB 3.24Å; D437-R440 WeakPolarHBondContact O-CB 3.34Å; D437-R440 PolarHBondContact O-N 3.45Å; D437-R440 VanDerWaalsContact O-N 3.13Å; R440-T442 PolarHBondContact O-N 3.32Å; R440-I443 PolarHBondContact O-N 3.02Å; R440-L444 HydrophobicContact CG-CD1 3.82Å; R440-L444 WeakPolarHBondContact O-CB 3.16Å; R440-L444 VanDerWaalsContact O-CG 3.3Å; R440-L444 WeakPolarHBondContact O-CG 3.44Å; R440-L444 PolarHBondContact O-N 2.82Å; R440-L470 HydrophobicContact CB-CD1 4.12Å; R440-L470 HydrophobicContact CB-CD2 4.35Å; R440-L470 HydrophobicContact CG-CD1 4.14Å; R440-L470 HydrophobicContact CG-CD2 3.77Å; R440-L470 HydrophobicContact CG-CG 4.44Å; R440-E473 IonicContact CZ-OE1 3.8Å; R440-E473 IonicContact CZ-OE2 3.57Å; R440-E473 IonicContact NE-OE1 2.99Å; R440-E473 IonicContact NE-OE2 3.92Å; R440-E473 PolarHBondContact NE-OE2 3.01Å; R440-E473 IonicContact NH2-OE1 2.75Å; R440-E473 PolarHBondContact NH2-OE1 3.48Å; R440-E473 IonicContact NH2-OE2 3.71Å
441	D	95	Very high	90.5	Very high	91 Å²	91	57 Å²	57	49%	0.487	31%	0.312	S	S	.	.	H	α-helix	trans	-71.1	-33.7	-173.3	-62.1	-29.5	0	0	0	111.8	H439 S445	H439-D441 PolarHBondContact O-N 2.89Å; D441-S445 WeakPolarHBondContact O-CB 3.27Å; D441-S445 PolarHBondContact O-N 2.75Å; D441-S445 PolarHBondContact O-OG 3.02Å
442	T	96.1	Very high	92	Very high	82 Å²	82	55.8 Å²	55.8	50%	0.503	30%	0.301	S	S	.	.	H	α-helix	trans	-63.5	-45.6	173.1	-51.9	0	0	0	0	111.3	H439 R440 A446	H439-T442 PolarHBondContact O-N 3.26Å; R440-T442 PolarHBondContact O-N 3.32Å; T442-A446 WeakPolarHBondContact O-CB 3.06Å; T442-A446 PolarHBondContact O-N 3.42Å
443	I	96	Very high	93.3	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-63.1	-51.7	178.9	-71.4	166.5	0	0	0	110.6	V436 H439 R440 S445 A446 I447 I455 I609 V611	V436-I443 HydrophobicContact CG2-CD1 3.46Å; V436-I443 VanDerWaalsContact CG2-CD1 3.46Å; H439-I443 HydrophobicContact CB-CD1 3.88Å; H439-I443 HydrophobicContact CB-CG1 4.25Å; H439-I443 WeakPolarHBondContact O-CB 3.18Å; H439-I443 VanDerWaalsContact O-CG1 3.32Å; H439-I443 WeakPolarHBondContact O-CG1 3.45Å; H439-I443 PolarHBondContact O-N 3.09Å; R440-I443 PolarHBondContact O-N 3.02Å; I443-S445 PolarHBondContact O-N 2.96Å; I443-A446 PolarHBondContact O-N 3.12Å; I443-I447 HydrophobicContact CG2-CD1 3.69Å; I443-I447 VanDerWaalsContact O-CG1 3.27Å; I443-I447 WeakPolarHBondContact O-CG1 3.45Å; I443-I447 PolarHBondContact O-N 2.89Å; I443-I455 HydrophobicContact CG1-CD1 4.44Å; I443-I455 HydrophobicContact CG2-CD1 3.64Å; I443-I609 HydrophobicContact CB-CD1 4.49Å; I443-I609 HydrophobicContact CG1-CD1 4.16Å; I443-I609 HydrophobicContact CG1-CG2 4.13Å; I443-V611 HydrophobicContact CD1-CG2 3.99Å
444	L	97.4	Very high	94.2	Very high	12 Å²	12	43.7 Å²	43.7	6%	0.063	24%	0.236	C	C	.	.	H	α-helix	trans	-63	-44	-178.1	-68.7	173.2	0	0	0	111.8	R440 A446 I447 E448 L470 L471 R474	R440-L444 HydrophobicContact CG-CD1 3.82Å; R440-L444 WeakPolarHBondContact O-CB 3.16Å; R440-L444 VanDerWaalsContact O-CG 3.3Å; R440-L444 WeakPolarHBondContact O-CG 3.44Å; R440-L444 PolarHBondContact O-N 2.82Å; L444-A446 PolarHBondContact O-N 2.68Å; L444-I447 PolarHBondContact O-N 2.75Å; L444-E448 PolarHBondContact O-N 3.28Å; L444-L470 HydrophobicContact CD1-CB 4.46Å; L444-L470 HydrophobicContact CD2-CB 4.11Å; L444-L470 HydrophobicContact CG-CB 4.47Å; L444-L471 HydrophobicContact CD2-CD2 3.79Å; L444-L471 HydrophobicContact CD2-CG 4.32Å; L444-R474 HydrophobicContact CD1-CB 4.04Å; L444-R474 HydrophobicContact CD1-CG 4.34Å; L444-R474 HydrophobicContact CD2-CB 4.28Å
445	S	97.1	Very high	94.8	Very high	52 Å²	52	41.7 Å²	41.7	36%	0.364	23%	0.225	S	C	.	.	H	α-helix	trans	-62.2	-43.1	178.6	-57.9	0	0	0	0	111.7	D441 I443 E448 Q449	D441-S445 WeakPolarHBondContact O-CB 3.27Å; D441-S445 PolarHBondContact O-N 2.75Å; D441-S445 PolarHBondContact O-OG 3.02Å; I443-S445 PolarHBondContact O-N 2.96Å; S445-E448 PolarHBondContact O-N 2.87Å; S445-Q449 WeakPolarHBondContact O-CB 3.36Å; S445-Q449 WeakPolarHBondContact O-CG 3.42Å; S445-Q449 PolarHBondContact O-N 3.46Å
446	A	97.4	Very high	95.1	Very high	12 Å²	12	41 Å²	41	10%	0.099	22%	0.222	C	C	.	.	H	α-helix	trans	-64.4	-42.4	178.3	0	0	0	0	0	112.3	T442 I443 L444 E448 Q449 H450 V453 I609	T442-A446 WeakPolarHBondContact O-CB 3.06Å; T442-A446 PolarHBondContact O-N 3.42Å; I443-A446 PolarHBondContact O-N 3.12Å; L444-A446 PolarHBondContact O-N 2.68Å; A446-E448 VanDerWaalsContact C-N 3.32Å; A446-E448 PolarHBondContact O-N 3.13Å; A446-Q449 PolarHBondContact O-N 3.4Å; A446-H450 WeakPolarHBondContact O-CB 3.24Å; A446-H450 PolarHBondContact O-N 2.74Å; A446-H450 PolarHBondContact O-ND1 3.45Å; A446-V453 HydrophobicContact CB-CG1 4.38Å; A446-V453 HydrophobicContact CB-CG2 4.24Å; A446-V453 WeakPolarHBondContact O-CG2 3.14Å; A446-I609 HydrophobicContact CB-CD1 3.45Å; A446-I609 VanDerWaalsContact CB-CD1 3.45Å; A446-I609 HydrophobicContact CB-CG1 4.37Å
447	I	97.7	Very high	95	Very high	3 Å²	3	41.2 Å²	41.2	2%	0.015	22%	0.224	C	C	.	.	H	α-helix	trans	-64.3	-37	177.8	-66.3	167.8	0	0	0	111	I443 L444 H450 V453 I455 L471 R586 V588	I443-I447 HydrophobicContact CG2-CD1 3.69Å; I443-I447 VanDerWaalsContact O-CG1 3.27Å; I443-I447 WeakPolarHBondContact O-CG1 3.45Å; I443-I447 PolarHBondContact O-N 2.89Å; L444-I447 PolarHBondContact O-N 2.75Å; I447-H450 VanDerWaalsContact O-O 3.13Å; I447-V453 HydrophobicContact CG1-CB 4.33Å; I447-V453 HydrophobicContact CG1-CG2 4.16Å; I447-I455 HydrophobicContact CD1-CD1 4.25Å; I447-L471 HydrophobicContact CD1-CD2 4.03Å; I447-L471 HydrophobicContact CG2-CD2 4.05Å; I447-R586 HydrophobicContact CG2-CB 4.08Å; I447-R586 HydrophobicContact CG2-CG 4.42Å; I447-R586 WeakPolarHBondContact O-CD 3.36Å; I447-R586 PolarHBondContact O-NE 3.12Å; I447-V588 HydrophobicContact CD1-CG2 3.77Å; I447-V588 HydrophobicContact CG1-CG2 3.91Å; I447-V588 HydrophobicContact CG2-CG2 4.18Å
448	E	95.5	Very high	94.5	Very high	83 Å²	83	43.1 Å²	43.1	39%	0.388	23%	0.234	S	C	.	.	H	α-helix	trans	-70.1	-42.2	178.6	-172.2	158.9	-133.2	0	0	111.9	L444 S445 A446 R480 R586	L444-E448 PolarHBondContact O-N 3.28Å; S445-E448 PolarHBondContact O-N 2.87Å; A446-E448 VanDerWaalsContact C-N 3.32Å; A446-E448 PolarHBondContact O-N 3.13Å; E448-R480 IonicContact OE1-CZ 2.91Å; E448-R480 IonicContact OE1-NH1 3.7Å; E448-R480 IonicContact OE1-NH2 3.74Å; E448-R480 PolarHBondContact OE1-NH2 2.95Å; E448-R586 PolarHBondContact O-NE 2.98Å; E448-R586 PolarHBondContact O-NH2 3.4Å
449	Q	96.2	Very high	93.7	Very high	140 Å²	140	39.7 Å²	39.7	65%	0.654	21%	0.211	S	C	*	.	H	α-helix	trans	-79.1	-25.6	-174.9	-69.6	171.7	8	0	0	114.3	S445 A446	S445-Q449 WeakPolarHBondContact O-CB 3.36Å; S445-Q449 WeakPolarHBondContact O-CG 3.42Å; S445-Q449 PolarHBondContact O-N 3.46Å; A446-Q449 PolarHBondContact O-N 3.4Å
450	H	97.3	Very high	92.7	Very high	67 Å²	67	39.1 Å²	39.1	31%	0.31	22%	0.22	S	C	.	.			trans	-120.6	137.6	-174.1	-56.3	80.7	0	0	0	111.3	A446 I447 V452 V453 R586 P607	A446-H450 WeakPolarHBondContact O-CB 3.24Å; A446-H450 PolarHBondContact O-N 2.74Å; A446-H450 PolarHBondContact O-ND1 3.45Å; I447-H450 VanDerWaalsContact O-O 3.13Å; H450-V452 WeakPolarHBondContact CB-O 3.1Å; H450-V452 PolarHBondContact O-N 2.87Å; H450-V453 HydrophobicContact CB-CG2 4.04Å; H450-R586 WeakPolarHBondContact O-CD 3.46Å; H450-P607 HydrophobicContact CB-CG 4.09Å
451	P	97.1	Very high	92.2	Very high	66 Å²	66	36 Å²	36	43%	0.429	21%	0.208	S	C	.	.	S	Bend	trans	-60.6	-31.5	177	22.1	-31.6	0	0	0	112.8	Q579 L587	P451-Q579 VanDerWaalsContact CB-OE1 3.22Å; P451-L587 PolarHBondContact O-N 3.14Å
452	V	98.2	Very high	91.7	Very high	5 Å²	5	32 Å²	32	3%	0.03	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	140.4	179	-169.8	0	0	0	0	109.4	H450 Q579 L587 L589 F603 C606	H450-V452 WeakPolarHBondContact CB-O 3.1Å; H450-V452 PolarHBondContact O-N 2.87Å; V452-Q579 HydrophobicContact CG2-CG 4.41Å; V452-L587 CarbonylContact C-O 3.55Å; V452-L587 VanDerWaalsContact CA-O 3.27Å; V452-L587 WeakPolarHBondContact CA-O 3.47Å; V452-L587 HydrophobicContact CB-CB 4.46Å; V452-L587 HydrophobicContact CG1-CB 4.2Å; V452-L587 HydrophobicContact CG1-CD2 4.03Å; V452-L587 HydrophobicContact CG1-CG 4.08Å; V452-L587 HydrophobicContact CG2-CB 4.15Å; V452-L587 HydrophobicContact CG2-CD2 4.24Å; V452-L589 HydrophobicContact CG1-CD1 4.47Å; V452-F603 HydrophobicContact CB-CB 4.29Å; V452-F603 HydrophobicContact CB-CG 4.46Å; V452-F603 HydrophobicContact CG1-CB 4.02Å; V452-F603 HydrophobicContact CG1-CD1 4.17Å; V452-F603 HydrophobicContact CG1-CD2 4.21Å; V452-F603 HydrophobicContact CG1-CG 3.88Å; V452-F603 HydrophobicContact CG2-CB 4.33Å; V452-F603 HydrophobicContact CG2-CD1 3.84Å; V452-F603 HydrophobicContact CG2-CE1 4.49Å; V452-F603 HydrophobicContact CG2-CG 4.27Å; V452-C606 HydrophobicContact CB-CB 4.05Å; V452-C606 HydrophobicContact CG1-CB 4.44Å; V452-C606 WeakPolarHBondContact O-CB 3.43Å
453	V	98.2	Very high	91.4	Very high	1 Å²	1	28.6 Å²	28.6	1%	0.006	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	137.3	172.3	-179.2	0	0	0	0	109.6	A446 I447 H450 I455 L587 V588 L589 P607 I609	A446-V453 HydrophobicContact CB-CG1 4.38Å; A446-V453 HydrophobicContact CB-CG2 4.24Å; A446-V453 WeakPolarHBondContact O-CG2 3.14Å; I447-V453 HydrophobicContact CG1-CB 4.33Å; I447-V453 HydrophobicContact CG1-CG2 4.16Å; H450-V453 HydrophobicContact CB-CG2 4.04Å; V453-I455 HydrophobicContact CG1-CG1 4.03Å; V453-L587 PolarHBondContact N-O 3.05Å; V453-V588 WeakPolarHBondContact O-CA 3.43Å; V453-L589 PolarHBondContact O-N 2.73Å; V453-P607 HydrophobicContact CG1-CG 4.42Å; V453-P607 HydrophobicContact CG2-CG 4.09Å; V453-I609 HydrophobicContact CG1-CD1 3.81Å; V453-I609 HydrophobicContact CG1-CG1 4.06Å
454	V	97.7	Very high	91.2	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	125.5	168.8	-176.6	0	0	0	0	108.8	L589 N596 F599 P607 V608 I609	V454-L589 CarbonylContact C-O 3.53Å; V454-L589 WeakPolarHBondContact CA-O 3.41Å; V454-L589 HydrophobicContact CG2-CB 4.32Å; V454-L589 HydrophobicContact CG2-CD1 4.25Å; V454-N596 HydrophobicContact CG1-CB 4.11Å; V454-F599 HydrophobicContact CG2-CB 4.04Å; V454-P607 PolarHBondContact N-O 3.45Å; V454-V608 HydrophobicContact CB-CG1 4.42Å; V454-V608 HydrophobicContact CB-CG2 4.17Å; V454-V608 HydrophobicContact CG1-CG1 4.32Å; V454-V608 CarbonylContact O-C 3.6Å; V454-V608 WeakPolarHBondContact O-CA 3.14Å; V454-I609 PolarHBondContact O-N 3.4Å
455	I	95.8	Very high	90.8	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	107.9	174.5	-56.7	175.7	0	0	0	108.3	I443 I447 V453 K463 I467 V588 L589 M590 S591 V611	I443-I455 HydrophobicContact CG1-CD1 4.44Å; I443-I455 HydrophobicContact CG2-CD1 3.64Å; I447-I455 HydrophobicContact CD1-CD1 4.25Å; V453-I455 HydrophobicContact CG1-CG1 4.03Å; I455-K463 HydrophobicContact CG2-CD 4.13Å; I455-K463 HydrophobicContact CG2-CG 4.25Å; I455-I467 HydrophobicContact CB-CD1 4.39Å; I455-I467 HydrophobicContact CD1-CD1 3.7Å; I455-I467 HydrophobicContact CD1-CG1 4.48Å; I455-I467 HydrophobicContact CD1-CG2 4.43Å; I455-I467 HydrophobicContact CG2-CD1 3.9Å; I455-V588 HydrophobicContact CD1-CG1 3.6Å; I455-V588 HydrophobicContact CG1-CG1 4.09Å; I455-L589 PolarHBondContact N-O 3.41Å; I455-M590 WeakPolarHBondContact O-CA 3.47Å; I455-S591 PolarHBondContact O-N 3.44Å; I455-V611 HydrophobicContact CG2-CG2 3.97Å
456	S	92.2	Very high	90.6	Very high	16 Å²	16	28.1 Å²	28.1	11%	0.112	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	137.3	176.2	178.7	0	0	0	0	109.9	S591 N596 I609 K610 V611	S456-S591 WeakPolarHBondContact CA-O 3.13Å; S456-N596 WeakPolarHBondContact CB-ND2 3.42Å; S456-N596 PolarHBondContact OG-ND2 3.17Å; S456-I609 PolarHBondContact N-O 2.94Å; S456-K610 CarbonylContact O-C 3.49Å; S456-K610 WeakPolarHBondContact O-CA 3.11Å; S456-V611 PolarHBondContact O-N 2.84Å
457	G	87	Confident	90.5	Very high	4 Å²	4	27.5 Å²	27.5	4%	0.041	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-179	152.8	166.9	0	0	0	0	0	111	K463 S591 A592 V611	G457-K463 VanDerWaalsContact O-CE 3.25Å; G457-K463 WeakPolarHBondContact O-CE 3.1Å; G457-K463 PolarHBondContact O-NZ 3.17Å; G457-S591 PolarHBondContact N-O 3.46Å; G457-A592 WeakPolarHBondContact O-CA 3.35Å; G457-V611 WeakPolarHBondContact CA-O 3.3Å
458	D	77.6	Confident	90.4	Very high	68 Å²	68	27.4 Å²	27.4	36%	0.364	16%	0.156	S	C	.	.			trans	-60.5	169.1	-170.3	-58.9	-37.6	0	0	0	113.8	G460 C461 K463	D458-G460 PolarHBondContact O-N 3.03Å; D458-C461 PolarHBondContact O-N 2.9Å; D458-C461 PolarHBondContact O-SG 3.48Å; D458-K463 PolarHBondContact O-NZ 3.35Å; D458-K463 VanDerWaalsContact O-NZ 3.1Å
459	T	73	Confident	90.4	Very high	13 Å²	13	23.4 Å²	23.4	8%	0.08	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	136.7	171.1	46.5	0	0	0	0	112	C461 A592	T459-C461 VanDerWaalsContact C-N 3.34Å; T459-A592 HydrophobicContact CG2-CB 4.08Å
460	G	72.2	Confident	90.4	Very high	41 Å²	41	16.9 Å²	16.9	42%	0.423	11%	0.106	S	C	.	.	T	Hydrogen-bonded Turn	trans	88	-7.6	178.2	0	0	0	0	0	114.7	D458 G462	D458-G460 PolarHBondContact O-N 3.03Å; G460-G462 PolarHBondContact O-N 3.37Å; G460-G462 VanDerWaalsContact O-N 3.08Å
461	C	80.9	Confident	90.3	Very high	0 Å²	0	13.9 Å²	13.9	0%	0	9%	0.093	C	C	.	.	S	Bend	trans	-68.1	-8.8	178.5	69.7	0	0	0	0	114.6	P435 V436 D458 T459 K463 V611	P435-C461 HydrophobicContact CB-CB 3.99Å; P435-C461 HydrophobicContact CG-CB 4.22Å; V436-C461 VanDerWaalsContact CB-O 3.29Å; V436-C461 WeakPolarHBondContact CB-O 3.46Å; V436-C461 VanDerWaalsContact CG1-O 3.27Å; V436-C461 WeakPolarHBondContact CG1-O 3.46Å; V436-C461 PolarHBondContact N-O 3.31Å; D458-C461 PolarHBondContact O-N 2.9Å; D458-C461 PolarHBondContact O-SG 3.48Å; T459-C461 VanDerWaalsContact C-N 3.34Å; C461-K463 VanDerWaalsContact SG-CG 3.55Å; C461-K463 PolarHBondContact SG-NZ 3.09Å; C461-V611 HydrophobicContact CB-CG1 4.25Å
462	G	85.4	Confident	90.3	Very high	8 Å²	8	10.7 Å²	10.7	8%	0.082	7%	0.072	C	C	.	.	S	Bend	trans	101	1.5	173.8	0	0	0	0	0	116.1	G460 T464 T465 R466	G460-G462 PolarHBondContact O-N 3.37Å; G460-G462 VanDerWaalsContact O-N 3.08Å; G462-T464 PolarHBondContact O-N 3.34Å; G462-T465 PolarHBondContact O-N 2.98Å; G462-T465 PolarHBondContact O-OG1 2.84Å; G462-R466 VanDerWaalsContact O-CB 3.27Å; G462-R466 WeakPolarHBondContact O-CB 3.34Å; G462-R466 PolarHBondContact O-N 2.89Å
463	K	89.9	Confident	90.1	Very high	9 Å²	9	11.8 Å²	11.8	4%	0.039	8%	0.077	C	C	.	.	H	α-helix	trans	-45.2	-61.7	-177.9	-70.2	176.3	-43.4	-61.6	0	113.8	I455 G457 D458 C461 T465 I467 M590 S591	I455-K463 HydrophobicContact CG2-CD 4.13Å; I455-K463 HydrophobicContact CG2-CG 4.25Å; G457-K463 VanDerWaalsContact O-CE 3.25Å; G457-K463 WeakPolarHBondContact O-CE 3.1Å; G457-K463 PolarHBondContact O-NZ 3.17Å; D458-K463 PolarHBondContact O-NZ 3.35Å; D458-K463 VanDerWaalsContact O-NZ 3.1Å; C461-K463 VanDerWaalsContact SG-CG 3.55Å; C461-K463 PolarHBondContact SG-NZ 3.09Å; K463-T465 VanDerWaalsContact C-N 3.27Å; K463-T465 PolarHBondContact O-N 2.91Å; K463-I467 HydrophobicContact CB-CD1 3.81Å; K463-I467 HydrophobicContact CG-CD1 3.94Å; K463-I467 WeakPolarHBondContact O-CB 3.42Å; K463-I467 WeakPolarHBondContact O-CG1 3.3Å; K463-I467 PolarHBondContact O-N 3Å; K463-I467 VanDerWaalsContact O-N 3.08Å; K463-M590 HydrophobicContact CB-SD 4.03Å; K463-S591 WeakPolarHBondContact CE-O 3.12Å
464	T	90.7	Very high	90	Very high	22 Å²	22	15.7 Å²	15.7	14%	0.135	9%	0.092	C	C	.	.	H	α-helix	trans	-59.2	-33.2	-174.1	-53.3	0	0	0	0	113.7	G462 V499 D559	G462-T464 PolarHBondContact O-N 3.34Å; T464-V499 HydrophobicContact CG2-CB 4.24Å; T464-V499 HydrophobicContact CG2-CG1 3.51Å; T464-V499 HydrophobicContact CG2-CG2 3.68Å; T464-D559 VanDerWaalsContact CB-OD2 3.23Å; T464-D559 WeakPolarHBondContact CB-OD2 3.49Å; T464-D559 WeakPolarHBondContact CG2-OD2 3.29Å; T464-D559 PolarHBondContact OG1-OD2 3.01Å
465	T	90.1	Very high	89.9	Confident	23 Å²	23	17.3 Å²	17.3	14%	0.141	10%	0.098	C	C	.	.	H	α-helix	trans	-94.4	-43.3	-178.7	53.6	0	0	0	0	112.5	G462 K463 Q469 R502 V503	G462-T465 PolarHBondContact O-N 2.98Å; G462-T465 PolarHBondContact O-OG1 2.84Å; K463-T465 VanDerWaalsContact C-N 3.27Å; K463-T465 PolarHBondContact O-N 2.91Å; T465-Q469 WeakPolarHBondContact O-CG 3.31Å; T465-Q469 PolarHBondContact O-NE2 2.74Å; T465-R502 HydrophobicContact CG2-CG 4.05Å; T465-V503 HydrophobicContact CG2-CG2 4.2Å
466	R	92.1	Very high	90	Very high	9 Å²	9	17.3 Å²	17.3	3%	0.034	10%	0.098	C	C	.	.	H	α-helix	trans	-83.5	-44.3	-171.7	-66.7	-68.5	-171.7	-129.1	6.6	113.5	L434 V436 D437 G462 Q469 L470 E506	L434-R466 HydrophobicContact CD1-CG 3.85Å; V436-R466 HydrophobicContact CG1-CB 3.52Å; V436-R466 HydrophobicContact CG1-CG 3.65Å; D437-R466 WeakPolarHBondContact OD1-CD 3.42Å; D437-R466 IonicContact OD1-NE 2.66Å; D437-R466 IonicContact OD2-NE 3.67Å; G462-R466 VanDerWaalsContact O-CB 3.27Å; G462-R466 WeakPolarHBondContact O-CB 3.34Å; G462-R466 PolarHBondContact O-N 2.89Å; R466-Q469 CarbonylContact O-C 3.56Å; R466-Q469 WeakPolarHBondContact O-CA 3.43Å; R466-Q469 WeakPolarHBondContact O-CB 3.49Å; R466-Q469 PolarHBondContact O-N 3.19Å; R466-L470 WeakPolarHBondContact O-CG 3.41Å; R466-L470 PolarHBondContact O-N 3.43Å; R466-E506 IonicContact CZ-OE2 2.73Å; R466-E506 IonicContact NH1-OE1 3.76Å; R466-E506 IonicContact NH1-OE2 2.7Å; R466-E506 PolarHBondContact NH1-OE2 3Å
467	I	95.5	Very high	90.1	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-57.1	-45.3	-173.7	-67.4	164.8	0	0	0	112.4	V436 I455 K463 Q469 L470 L471 I557 M590	V436-I467 HydrophobicContact CG2-CD1 4.4Å; V436-I467 HydrophobicContact CG2-CG1 4.14Å; I455-I467 HydrophobicContact CB-CD1 4.39Å; I455-I467 HydrophobicContact CD1-CD1 3.7Å; I455-I467 HydrophobicContact CD1-CG1 4.48Å; I455-I467 HydrophobicContact CD1-CG2 4.43Å; I455-I467 HydrophobicContact CG2-CD1 3.9Å; K463-I467 HydrophobicContact CB-CD1 3.81Å; K463-I467 HydrophobicContact CG-CD1 3.94Å; K463-I467 WeakPolarHBondContact O-CB 3.42Å; K463-I467 WeakPolarHBondContact O-CG1 3.3Å; K463-I467 PolarHBondContact O-N 3Å; K463-I467 VanDerWaalsContact O-N 3.08Å; I467-Q469 VanDerWaalsContact C-N 3.28Å; I467-Q469 PolarHBondContact O-N 3.4Å; I467-L470 PolarHBondContact O-N 3.1Å; I467-L471 HydrophobicContact CG2-CD1 4.42Å; I467-L471 PolarHBondContact O-N 3.48Å; I467-L471 VanDerWaalsContact O-N 3.07Å; I467-I557 HydrophobicContact CG2-CD1 4.22Å; I467-M590 HydrophobicContact CB-SD 4.16Å; I467-M590 HydrophobicContact CD1-CG 4.41Å; I467-M590 HydrophobicContact CD1-SD 3.51Å; I467-M590 VanDerWaalsContact CD1-SD 3.51Å; I467-M590 HydrophobicContact CG1-SD 4.42Å; I467-M590 HydrophobicContact CG2-SD 4.33Å
468	P	96.5	Very high	90.5	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-59.9	-37.1	174.1	-23	33.6	0	0	0	113.2	L472 I488 L532 F534 I557	P468-L472 PolarHBondContact O-N 2.83Å; P468-L472 VanDerWaalsContact O-N 3.16Å; P468-I488 HydrophobicContact CB-CD1 4.29Å; P468-I488 HydrophobicContact CB-CG1 4.33Å; P468-I488 HydrophobicContact CG-CD1 4.49Å; P468-I488 HydrophobicContact CG-CG1 4.03Å; P468-L532 HydrophobicContact CB-CD1 4.13Å; P468-L532 HydrophobicContact CB-CD2 4.32Å; P468-F534 HydrophobicContact CB-CZ 4.39Å; P468-F534 HydrophobicContact CG-CZ 4.16Å; P468-I557 HydrophobicContact CG-CD1 4.05Å
469	Q	94.8	Very high	91.3	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-69.8	-40	177.6	-66.8	177.7	64.7	0	0	111.8	W428 T465 R466 I467 L472 E473 V503 E506 L507	W428-Q469 HydrophobicContact CZ2-CB 4.3Å; T465-Q469 WeakPolarHBondContact O-CG 3.31Å; T465-Q469 PolarHBondContact O-NE2 2.74Å; R466-Q469 CarbonylContact O-C 3.56Å; R466-Q469 WeakPolarHBondContact O-CA 3.43Å; R466-Q469 WeakPolarHBondContact O-CB 3.49Å; R466-Q469 PolarHBondContact O-N 3.19Å; I467-Q469 VanDerWaalsContact C-N 3.28Å; I467-Q469 PolarHBondContact O-N 3.4Å; Q469-L472 PolarHBondContact O-N 2.8Å; Q469-E473 VanDerWaalsContact O-CB 3.27Å; Q469-E473 WeakPolarHBondContact O-CB 3.37Å; Q469-E473 PolarHBondContact O-N 3.3Å; Q469-V503 HydrophobicContact CG-CG1 3.8Å; Q469-E506 PolarHBondContact NE2-OE2 3.43Å; Q469-L507 HydrophobicContact CG-CD1 4.34Å; Q469-L507 HydrophobicContact CG-CD2 4.24Å; Q469-L507 HydrophobicContact CG-CG 4.12Å
470	L	95.3	Very high	92.4	Very high	2 Å²	2	23.9 Å²	23.9	1%	0.01	14%	0.136	C	C	.	.	H	α-helix	trans	-63.8	-40.5	177.6	-65.7	179.3	0	0	0	111.5	W428 R440 L444 R466 I467 E473 R474	W428-L470 HydrophobicContact CH2-CD2 4.32Å; R440-L470 HydrophobicContact CB-CD1 4.12Å; R440-L470 HydrophobicContact CB-CD2 4.35Å; R440-L470 HydrophobicContact CG-CD1 4.14Å; R440-L470 HydrophobicContact CG-CD2 3.77Å; R440-L470 HydrophobicContact CG-CG 4.44Å; L444-L470 HydrophobicContact CD1-CB 4.46Å; L444-L470 HydrophobicContact CD2-CB 4.11Å; L444-L470 HydrophobicContact CG-CB 4.47Å; R466-L470 WeakPolarHBondContact O-CG 3.41Å; R466-L470 PolarHBondContact O-N 3.43Å; I467-L470 PolarHBondContact O-N 3.1Å; L470-E473 WeakPolarHBondContact O-CB 3.48Å; L470-E473 PolarHBondContact O-N 3.24Å; L470-R474 WeakPolarHBondContact O-CB 3.31Å; L470-R474 PolarHBondContact O-N 3.29Å
471	L	97.1	Very high	93.6	Very high	4 Å²	4	22 Å²	22	2%	0.021	12%	0.116	C	C	.	.	H	α-helix	trans	-63.1	-46	174.7	-71.9	171.8	0	0	0	111.7	L444 I447 I467 R474 Y475 H555 I557	L444-L471 HydrophobicContact CD2-CD2 3.79Å; L444-L471 HydrophobicContact CD2-CG 4.32Å; I447-L471 HydrophobicContact CD1-CD2 4.03Å; I447-L471 HydrophobicContact CG2-CD2 4.05Å; I467-L471 HydrophobicContact CG2-CD1 4.42Å; I467-L471 PolarHBondContact O-N 3.48Å; I467-L471 VanDerWaalsContact O-N 3.07Å; L471-R474 PolarHBondContact O-N 3.47Å; L471-Y475 WeakPolarHBondContact O-CD2 3.45Å; L471-Y475 PolarHBondContact O-N 2.83Å; L471-H555 HydrophobicContact CD1-CB 4.48Å; L471-I557 HydrophobicContact CD1-CD1 3.93Å
472	L	96.2	Very high	94.3	Very high	0 Å²	0	22 Å²	22	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-62.1	-47.2	176.3	-177.4	63.2	0	0	0	111.1	P468 Q469 R474 Y475 V476 C484 L507 L532	P468-L472 PolarHBondContact O-N 2.83Å; P468-L472 VanDerWaalsContact O-N 3.16Å; Q469-L472 PolarHBondContact O-N 2.8Å; L472-R474 PolarHBondContact O-N 3.28Å; L472-Y475 PolarHBondContact O-N 2.86Å; L472-V476 HydrophobicContact CD1-CG2 3.91Å; L472-V476 HydrophobicContact CG-CG2 4.2Å; L472-V476 WeakPolarHBondContact O-CB 3.47Å; L472-V476 WeakPolarHBondContact O-CG2 3.41Å; L472-V476 PolarHBondContact O-N 2.82Å; L472-C484 HydrophobicContact CD1-CB 4.36Å; L472-L507 HydrophobicContact CD2-CD1 4.22Å; L472-L507 HydrophobicContact CD2-CD2 4.23Å; L472-L532 HydrophobicContact CB-CD1 4.46Å; L472-L532 HydrophobicContact CB-CD2 4.38Å; L472-L532 HydrophobicContact CD2-CD1 4.05Å; L472-L532 HydrophobicContact CD2-CG 4.28Å
473	E	94.1	Very high	94.8	Very high	27 Å²	27	28.5 Å²	28.5	13%	0.126	14%	0.139	C	C	.	.	H	α-helix	trans	-52.6	-52.5	176.8	177.6	178	-174.9	0	0	111.7	W421 R440 Q469 L470 Y475 V476 T477	W421-E473 HydrophobicContact CH2-CB 3.39Å; W421-E473 HydrophobicContact CH2-CG 3.79Å; W421-E473 HydrophobicContact CZ2-CB 3.52Å; W421-E473 HydrophobicContact CZ2-CG 3.32Å; W421-E473 HydrophobicContact CZ3-CB 4.14Å; R440-E473 IonicContact CZ-OE1 3.8Å; R440-E473 IonicContact CZ-OE2 3.57Å; R440-E473 IonicContact NE-OE1 2.99Å; R440-E473 IonicContact NE-OE2 3.92Å; R440-E473 PolarHBondContact NE-OE2 3.01Å; R440-E473 IonicContact NH2-OE1 2.75Å; R440-E473 PolarHBondContact NH2-OE1 3.48Å; R440-E473 IonicContact NH2-OE2 3.71Å; Q469-E473 VanDerWaalsContact O-CB 3.27Å; Q469-E473 WeakPolarHBondContact O-CB 3.37Å; Q469-E473 PolarHBondContact O-N 3.3Å; L470-E473 WeakPolarHBondContact O-CB 3.48Å; L470-E473 PolarHBondContact O-N 3.24Å; E473-Y475 PolarHBondContact O-N 3.4Å; E473-V476 PolarHBondContact O-N 2.94Å; E473-T477 HydrophobicContact CG-CG2 4.26Å; E473-T477 WeakPolarHBondContact O-CB 3.33Å; E473-T477 WeakPolarHBondContact O-CG2 3.36Å; E473-T477 PolarHBondContact O-N 2.9Å; E473-T477 PolarHBondContact O-OG1 2.89Å
474	R	95.4	Very high	95.1	Very high	83 Å²	83	28.1 Å²	28.1	31%	0.313	14%	0.137	S	C	.	.	H	α-helix	trans	-58.3	-50.2	-176.6	-176.7	64.3	-177.3	-158.8	7.9	111.2	L444 L470 L471 L472 V476 T477 E478	L444-R474 HydrophobicContact CD1-CB 4.04Å; L444-R474 HydrophobicContact CD1-CG 4.34Å; L444-R474 HydrophobicContact CD2-CB 4.28Å; L470-R474 WeakPolarHBondContact O-CB 3.31Å; L470-R474 PolarHBondContact O-N 3.29Å; L471-R474 PolarHBondContact O-N 3.47Å; L472-R474 PolarHBondContact O-N 3.28Å; R474-V476 PolarHBondContact O-N 3.02Å; R474-T477 PolarHBondContact O-N 3.34Å; R474-T477 PolarHBondContact O-OG1 3.09Å; R474-E478 IonicContact CZ-OE1 3.84Å; R474-E478 IonicContact NE-OE1 4Å; R474-E478 PolarHBondContact NE-OE1 3.45Å; R474-E478 IonicContact NE-OE2 3.26Å; R474-E478 IonicContact NH2-OE1 2.7Å; R474-E478 PolarHBondContact NH2-OE1 3.41Å; R474-E478 WeakPolarHBondContact O-CB 3.46Å; R474-E478 WeakPolarHBondContact O-CG 3.37Å; R474-E478 PolarHBondContact O-N 2.94Å; R474-E478 VanDerWaalsContact O-N 3.1Å
475	Y	97.1	Very high	95.5	Very high	34 Å²	34	27.3 Å²	27.3	13%	0.133	13%	0.132	C	C	.	.	H	α-helix	trans	-65.7	-39.2	-179.7	-85.3	-115	0	0	0	112.4	L471 L472 E473 G479 R480 G481 R483 C484 H555	L471-Y475 WeakPolarHBondContact O-CD2 3.45Å; L471-Y475 PolarHBondContact O-N 2.83Å; L472-Y475 PolarHBondContact O-N 2.86Å; E473-Y475 PolarHBondContact O-N 3.4Å; Y475-G479 PolarHBondContact O-N 3.21Å; Y475-R480 HydrophobicContact CD1-CG 3.92Å; Y475-R480 HydrophobicContact CG-CG 4.24Å; Y475-R480 CarbonylContact O-C 3.29Å; Y475-R480 WeakPolarHBondContact O-CA 3.14Å; Y475-R480 VanDerWaalsContact O-CG 3.3Å; Y475-R480 WeakPolarHBondContact O-CG 3.27Å; Y475-R480 PolarHBondContact O-N 3.29Å; Y475-R480 PolarHBondContact OH-NH1 3.41Å; Y475-G481 PolarHBondContact O-N 3.05Å; Y475-R483 HydrophobicContact CD1-CB 4.29Å; Y475-R483 HydrophobicContact CE1-CB 4.34Å; Y475-C484 HydrophobicContact CD1-CB 3.76Å; Y475-C484 HydrophobicContact CD2-CB 4.48Å; Y475-C484 HydrophobicContact CG-CB 3.7Å; Y475-H555 AromaticContact CE2-CE1 3.69Å; Y475-H555 AromaticContact CZ-CE1 3.67Å; Y475-H555 PolarHBondContact OH-CE1 2.96Å
476	V	95.9	Very high	95.9	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-68.4	-45.4	179.8	171.4	0	0	0	0	111.3	L417 L418 W421 L472 E473 R474 E478 G479	L417-V476 HydrophobicContact CB-CG1 4.11Å; L417-V476 HydrophobicContact CB-CG2 4Å; L417-V476 HydrophobicContact CD1-CG2 4.44Å; L417-V476 WeakPolarHBondContact O-CG1 3.4Å; L418-V476 HydrophobicContact CB-CG1 4.4Å; W421-V476 HydrophobicContact CB-CG1 3.67Å; W421-V476 HydrophobicContact CD2-CG1 4.4Å; W421-V476 HydrophobicContact CE3-CG1 4.47Å; W421-V476 HydrophobicContact CG-CG1 4.05Å; L472-V476 HydrophobicContact CD1-CG2 3.91Å; L472-V476 HydrophobicContact CG-CG2 4.2Å; L472-V476 WeakPolarHBondContact O-CB 3.47Å; L472-V476 WeakPolarHBondContact O-CG2 3.41Å; L472-V476 PolarHBondContact O-N 2.82Å; E473-V476 PolarHBondContact O-N 2.94Å; R474-V476 PolarHBondContact O-N 3.02Å; V476-E478 VanDerWaalsContact C-N 3.3Å; V476-E478 PolarHBondContact O-N 3.08Å; V476-G479 PolarHBondContact O-N 3.37Å; V476-G479 VanDerWaalsContact O-N 3.09Å
477	T	94.3	Very high	96.2	Very high	65 Å²	65	25.8 Å²	25.8	40%	0.399	12%	0.123	S	C	.	.	H	α-helix	trans	-68.9	-27.6	-178.9	52.2	0	0	0	0	113.2	E473 R474 G479	E473-T477 HydrophobicContact CG-CG2 4.26Å; E473-T477 WeakPolarHBondContact O-CB 3.33Å; E473-T477 WeakPolarHBondContact O-CG2 3.36Å; E473-T477 PolarHBondContact O-N 2.9Å; E473-T477 PolarHBondContact O-OG1 2.89Å; R474-T477 PolarHBondContact O-N 3.34Å; R474-T477 PolarHBondContact O-OG1 3.09Å; T477-G479 VanDerWaalsContact C-N 3.26Å; T477-G479 PolarHBondContact O-N 3.24Å
478	E	95.7	Very high	96.3	Very high	79 Å²	79	25.8 Å²	25.8	37%	0.369	12%	0.123	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.2	6.2	172.1	-69.9	177.6	150.9	0	0	113.9	R474 V476 R480	R474-E478 IonicContact CZ-OE1 3.84Å; R474-E478 IonicContact NE-OE1 4Å; R474-E478 PolarHBondContact NE-OE1 3.45Å; R474-E478 IonicContact NE-OE2 3.26Å; R474-E478 IonicContact NH2-OE1 2.7Å; R474-E478 PolarHBondContact NH2-OE1 3.41Å; R474-E478 WeakPolarHBondContact O-CB 3.46Å; R474-E478 WeakPolarHBondContact O-CG 3.37Å; R474-E478 PolarHBondContact O-N 2.94Å; R474-E478 VanDerWaalsContact O-N 3.1Å; V476-E478 VanDerWaalsContact C-N 3.3Å; V476-E478 PolarHBondContact O-N 3.08Å; E478-R480 VanDerWaalsContact C-N 3.28Å; E478-R480 HydrophobicContact CB-CG 4.07Å; E478-R480 PolarHBondContact O-N 3.47Å; E478-R480 IonicContact OE2-CZ 3.08Å; E478-R480 IonicContact OE2-NE 3.91Å; E478-R480 PolarHBondContact OE2-NE 3.37Å; E478-R480 IonicContact OE2-NH2 2.71Å; E478-R480 PolarHBondContact OE2-NH2 3.39Å
479	G	95.2	Very high	96.4	Very high	41 Å²	41	25.8 Å²	25.8	42%	0.423	12%	0.123	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.5	16	177.3	0	0	0	0	0	114.7	S414 Y475 V476 T477	S414-G479 WeakPolarHBondContact CB-O 3.05Å; Y475-G479 PolarHBondContact O-N 3.21Å; V476-G479 PolarHBondContact O-N 3.37Å; V476-G479 VanDerWaalsContact O-N 3.09Å; T477-G479 VanDerWaalsContact C-N 3.26Å; T477-G479 PolarHBondContact O-N 3.24Å
480	R	96.1	Very high	96.4	Very high	55 Å²	55	25.8 Å²	25.8	21%	0.208	12%	0.123	C	C	.	.			trans	-118.3	24.8	179	59.9	176.8	-179.4	147.3	-9.8	113	E448 Y475 E478 A482 R483	E448-R480 IonicContact OE1-CZ 2.91Å; E448-R480 IonicContact OE1-NH1 3.7Å; E448-R480 IonicContact OE1-NH2 3.74Å; E448-R480 PolarHBondContact OE1-NH2 2.95Å; Y475-R480 HydrophobicContact CD1-CG 3.92Å; Y475-R480 HydrophobicContact CG-CG 4.24Å; Y475-R480 CarbonylContact O-C 3.29Å; Y475-R480 WeakPolarHBondContact O-CA 3.14Å; Y475-R480 VanDerWaalsContact O-CG 3.3Å; Y475-R480 WeakPolarHBondContact O-CG 3.27Å; Y475-R480 PolarHBondContact O-N 3.29Å; Y475-R480 PolarHBondContact OH-NH1 3.41Å; E478-R480 VanDerWaalsContact C-N 3.28Å; E478-R480 HydrophobicContact CB-CG 4.07Å; E478-R480 PolarHBondContact O-N 3.47Å; E478-R480 IonicContact OE2-CZ 3.08Å; E478-R480 IonicContact OE2-NE 3.91Å; E478-R480 PolarHBondContact OE2-NE 3.37Å; E478-R480 IonicContact OE2-NH2 2.71Å; E478-R480 PolarHBondContact OE2-NH2 3.39Å; R480-A482 VanDerWaalsContact C-N 3.26Å; R480-A482 PolarHBondContact O-N 3.28Å; R480-R483 WeakPolarHBondContact O-CB 3.11Å; R480-R483 PolarHBondContact O-N 3.14Å
481	G	96.3	Very high	96.1	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	13%	0.131	C	C	.	.	G	3₁₀ helix	trans	-55.1	-35.5	-173.3	0	0	0	0	0	114.3	S414 Y475 R483 C484 G530	S414-G481 PolarHBondContact OG-N 3.4Å; Y475-G481 PolarHBondContact O-N 3.05Å; G481-R483 PolarHBondContact O-N 3.29Å; G481-C484 WeakPolarHBondContact O-CB 3.43Å; G481-C484 PolarHBondContact O-N 3.15Å; G481-G530 WeakPolarHBondContact O-CA 3.47Å; G481-G530 PolarHBondContact O-N 3.38Å
482	A	96.3	Very high	95.6	Very high	2 Å²	2	29.6 Å²	29.6	2%	0.017	14%	0.141	C	C	.	.	G	3₁₀ helix	trans	-65.5	-20.8	180	0	0	0	0	0	113.6	L405 E410 L413 S414 R480 C484 G529	L405-A482 HydrophobicContact CD1-CB 4.28Å; E410-A482 HydrophobicContact CG-CB 3.75Å; E410-A482 WeakPolarHBondContact O-CB 3.38Å; L413-A482 HydrophobicContact CB-CB 3.69Å; S414-A482 VanDerWaalsContact OG-CB 3.24Å; S414-A482 WeakPolarHBondContact OG-CB 3.3Å; S414-A482 PolarHBondContact OG-N 2.89Å; R480-A482 VanDerWaalsContact C-N 3.26Å; R480-A482 PolarHBondContact O-N 3.28Å; A482-C484 VanDerWaalsContact C-N 3.34Å; A482-G529 WeakPolarHBondContact O-CA 3.46Å
483	R	95.6	Very high	95.3	Very high	144 Å²	144	32.2 Å²	32.2	54%	0.543	15%	0.151	S	C	.	.	G	3₁₀ helix	trans	-80.7	-13.3	174.9	-60.8	-171.2	-179	172.3	10.2	113.3	E410 Y475 R480 G481 N485 S554	E410-R483 HydrophobicContact CG-CG 4.32Å; E410-R483 IonicContact OE1-CZ 3.97Å; E410-R483 IonicContact OE1-NE 2.93Å; E410-R483 PolarHBondContact OE1-NE 3Å; E410-R483 IonicContact OE1-NH2 3.25Å; E410-R483 PolarHBondContact OE1-NH2 2.89Å; E410-R483 IonicContact OE2-CZ 2.85Å; E410-R483 IonicContact OE2-NE 2.7Å; E410-R483 PolarHBondContact OE2-NE 3.37Å; E410-R483 IonicContact OE2-NH2 3.59Å; Y475-R483 HydrophobicContact CD1-CB 4.29Å; Y475-R483 HydrophobicContact CE1-CB 4.34Å; R480-R483 WeakPolarHBondContact O-CB 3.11Å; R480-R483 PolarHBondContact O-N 3.14Å; G481-R483 PolarHBondContact O-N 3.29Å; R483-N485 PolarHBondContact O-N 3.08Å; R483-S554 WeakPolarHBondContact O-CB 3.37Å
484	C	97.3	Very high	94.8	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	15%	0.146	C	C	.	.			trans	-85.4	101	-178.7	-167.9	0	0	0	0	110.5	L472 Y475 G481 A482 G530 A531	L472-C484 HydrophobicContact CD1-CB 4.36Å; Y475-C484 HydrophobicContact CD1-CB 3.76Å; Y475-C484 HydrophobicContact CD2-CB 4.48Å; Y475-C484 HydrophobicContact CG-CB 3.7Å; G481-C484 WeakPolarHBondContact O-CB 3.43Å; G481-C484 PolarHBondContact O-N 3.15Å; A482-C484 VanDerWaalsContact C-N 3.34Å; C484-G530 CarbonylContact O-C 3.56Å; C484-G530 VanDerWaalsContact O-C 3.26Å; C484-G530 WeakPolarHBondContact O-CA 3.18Å; C484-G530 PolarHBondContact O-N 2.77Å; C484-A531 PolarHBondContact O-N 2.89Å
485	N	97.7	Very high	94.5	Very high	5 Å²	5	27.2 Å²	27.2	3%	0.027	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	113.7	170.7	-57.3	-61	0	0	0	108.1	I397 R483 G529 A531 G552 S554 H555	I397-N485 HydrophobicContact CD1-CB 4.23Å; I397-N485 HydrophobicContact CG1-CB 4.08Å; R483-N485 PolarHBondContact O-N 3.08Å; N485-G529 PolarHBondContact OD1-N 3.23Å; N485-A531 CarbonylContact C-O 3.55Å; N485-A531 WeakPolarHBondContact CA-O 3.41Å; N485-A531 HydrophobicContact CB-CB 4.46Å; N485-A531 WeakPolarHBondContact OD1-CB 3.48Å; N485-G552 WeakPolarHBondContact CB-O 3.36Å; N485-G552 PolarHBondContact ND2-O 3.17Å; N485-S554 VanDerWaalsContact C-OG 3.31Å; N485-S554 PolarHBondContact N-OG 2.93Å; N485-S554 PolarHBondContact O-N 2.72Å; N485-S554 PolarHBondContact O-OG 2.84Å; N485-H555 PolarHBondContact O-N 3.3Å
486	V	98.5	Very high	94.3	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	128.7	-172.1	-173.3	0	0	0	0	109.2	I488 A531 L532 L533 H555 I557	V486-I488 HydrophobicContact CB-CD1 4.14Å; V486-I488 HydrophobicContact CG1-CD1 3.67Å; V486-I488 HydrophobicContact CG1-CG1 3.91Å; V486-A531 PolarHBondContact N-O 2.85Å; V486-L532 HydrophobicContact CB-CD2 3.68Å; V486-L532 HydrophobicContact CG1-CD2 4.49Å; V486-L532 HydrophobicContact CG2-CD2 3.72Å; V486-L533 PolarHBondContact O-N 3.35Å; V486-H555 WeakPolarHBondContact CA-O 3.15Å; V486-H555 HydrophobicContact CB-CB 4.42Å; V486-H555 HydrophobicContact CG1-CB 4Å; V486-H555 HydrophobicContact CG2-CB 4.1Å; V486-I557 HydrophobicContact CG1-CD1 3.8Å; V486-I557 HydrophobicContact CG1-CG1 3.87Å
487	I	98.6	Very high	94	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	127	168	-61.3	179.8	0	0	0	108.1	P396 I397 L533 L540 V553 H555 V556 I557	P396-I487 HydrophobicContact CB-CD1 3.81Å; I397-I487 HydrophobicContact CD1-CD1 4.28Å; I397-I487 HydrophobicContact CD1-CG1 3.74Å; I487-L533 WeakPolarHBondContact CA-O 3.32Å; I487-L540 HydrophobicContact CD1-CD1 3.97Å; I487-L540 HydrophobicContact CG2-CD1 4.19Å; I487-L540 HydrophobicContact CG2-CD2 4.18Å; I487-V553 HydrophobicContact CD1-CG1 4.2Å; I487-V553 HydrophobicContact CD1-CG2 3.72Å; I487-V553 HydrophobicContact CG1-CG1 4.1Å; I487-V553 HydrophobicContact CG1-CG2 4.29Å; I487-H555 PolarHBondContact N-O 3.02Å; I487-V556 CarbonylContact O-C 3.02Å; I487-V556 WeakPolarHBondContact O-CA 3.31Å; I487-I557 PolarHBondContact O-N 2.9Å
488	I	98.4	Very high	93.7	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	113.2	178.6	-52.8	89.8	0	0	0	108.2	P468 V486 L532 L533 F534 C535 I557	P468-I488 HydrophobicContact CB-CD1 4.29Å; P468-I488 HydrophobicContact CB-CG1 4.33Å; P468-I488 HydrophobicContact CG-CD1 4.49Å; P468-I488 HydrophobicContact CG-CG1 4.03Å; V486-I488 HydrophobicContact CB-CD1 4.14Å; V486-I488 HydrophobicContact CG1-CD1 3.67Å; V486-I488 HydrophobicContact CG1-CG1 3.91Å; I488-L532 HydrophobicContact CD1-CB 4.31Å; I488-L533 PolarHBondContact N-O 2.96Å; I488-F534 HydrophobicContact CB-CD1 3.73Å; I488-F534 HydrophobicContact CB-CE1 3.82Å; I488-F534 HydrophobicContact CB-CG 4.31Å; I488-F534 HydrophobicContact CB-CZ 4.47Å; I488-F534 HydrophobicContact CD1-CD2 4.4Å; I488-F534 HydrophobicContact CD1-CE1 4.31Å; I488-F534 HydrophobicContact CD1-CE2 4.16Å; I488-F534 HydrophobicContact CD1-CZ 4.11Å; I488-F534 HydrophobicContact CG1-CD1 4.41Å; I488-F534 HydrophobicContact CG1-CE1 4.09Å; I488-F534 HydrophobicContact CG1-CZ 4.29Å; I488-F534 HydrophobicContact CG2-CD1 3.78Å; I488-F534 HydrophobicContact CG2-CE1 3.68Å; I488-F534 CarbonylContact O-C 3.35Å; I488-F534 VanDerWaalsContact O-CA 3.3Å; I488-F534 WeakPolarHBondContact O-CA 3.45Å; I488-C535 PolarHBondContact O-N 3.01Å; I488-I557 CarbonylContact C-O 3.52Å; I488-I557 WeakPolarHBondContact CA-O 3.4Å; I488-I557 HydrophobicContact CB-CB 4.38Å; I488-I557 HydrophobicContact CG1-CB 4.11Å; I488-I557 HydrophobicContact CG1-CD1 4Å; I488-I557 HydrophobicContact CG1-CG1 4.3Å; I488-I557 HydrophobicContact CG2-CB 4.13Å; I488-I557 HydrophobicContact CG2-CG2 4.22Å
489	T	98	Very high	93.5	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	140	176.4	64.2	0	0	0	0	111.3	C535 L540 I557 V558 D559 L571	T489-C535 CarbonylContact C-O 3.51Å; T489-C535 VanDerWaalsContact CA-O 3.27Å; T489-C535 WeakPolarHBondContact CA-O 3.41Å; T489-L540 HydrophobicContact CG2-CB 3.89Å; T489-L540 HydrophobicContact CG2-CD2 3.45Å; T489-L540 VanDerWaalsContact CG2-CD2 3.45Å; T489-L540 HydrophobicContact CG2-CG 4.32Å; T489-I557 PolarHBondContact N-O 2.98Å; T489-I557 PolarHBondContact OG1-O 3.05Å; T489-V558 WeakPolarHBondContact OG1-CA 3.12Å; T489-D559 WeakPolarHBondContact O-CB 3.35Å; T489-D559 PolarHBondContact O-N 3.21Å; T489-L571 HydrophobicContact CG2-CD2 4.04Å
490	Q	94.9	Very high	93.5	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	141.5	171.5	-67.4	-70.5	-33.5	0	0	108.8	R492 A496 C535 T536 V537 D559	Q490-R492 VanDerWaalsContact C-N 3.29Å; Q490-R492 PolarHBondContact O-N 2.66Å; Q490-A496 HydrophobicContact CB-CB 4.03Å; Q490-A496 HydrophobicContact CG-CB 4.37Å; Q490-C535 PolarHBondContact N-O 3.15Å; Q490-T536 WeakPolarHBondContact O-CA 3.24Å; Q490-V537 PolarHBondContact O-N 3.1Å; Q490-D559 VanDerWaalsContact NE2-CB 3.32Å; Q490-D559 PolarHBondContact NE2-OD2 3.22Å
491	P	89.6	Confident	93.3	Very high	26 Å²	26	20.5 Å²	20.5	17%	0.169	9%	0.091	C	C	.	.	S	Bend	trans	-66.9	-34.3	-179.1	23.5	-31	0	0	0	111.6	E560 E563	P491-E560 HydrophobicContact CG-CB 4Å; P491-E560 HydrophobicContact CG-CG 4.36Å; P491-E563 WeakPolarHBondContact CG-OE1 3.45Å
492	R	87.5	Confident	92.9	Very high	61 Å²	61	25.7 Å²	25.7	23%	0.23	11%	0.111	C	C	.	.	S	Bend	trans	-111.1	142.1	-174.1	-54.5	177	-170.9	-82.8	-13.2	112	Q490 I494 S495 A496 E563 T736	Q490-R492 VanDerWaalsContact C-N 3.29Å; Q490-R492 PolarHBondContact O-N 2.66Å; R492-I494 VanDerWaalsContact C-N 3.32Å; R492-I494 HydrophobicContact CB-CG2 4.11Å; R492-I494 PolarHBondContact O-N 3.13Å; R492-S495 WeakPolarHBondContact O-CB 3.47Å; R492-S495 PolarHBondContact O-N 2.82Å; R492-A496 PolarHBondContact O-N 3.32Å; R492-A496 VanDerWaalsContact O-N 3.08Å; R492-E563 IonicContact CZ-OE2 3.71Å; R492-E563 IonicContact NE-OE1 2.7Å; R492-E563 IonicContact NE-OE2 3.09Å; R492-E563 PolarHBondContact NE-OE2 3.44Å; R492-E563 IonicContact NH2-OE2 3.95Å; R492-E563 PolarHBondContact NH2-OE2 3.04Å; R492-T736 PolarHBondContact NE-OG1 2.84Å
493	R	88.4	Confident	92.7	Very high	55 Å²	55	25.6 Å²	25.6	21%	0.208	11%	0.11	C	C	.	.	H	α-helix	trans	-55.6	-45	174.4	174.5	172	178	177.8	0.8	112.5	S495 A496 V497 V519 R520 E522 T536 M710	R493-S495 VanDerWaalsContact C-N 3.27Å; R493-S495 PolarHBondContact O-N 2.95Å; R493-A496 PolarHBondContact O-N 3.25Å; R493-V497 WeakPolarHBondContact O-CG2 3.45Å; R493-V497 PolarHBondContact O-N 2.92Å; R493-V497 VanDerWaalsContact O-N 3.14Å; R493-V519 HydrophobicContact CG-CB 3.91Å; R493-V519 HydrophobicContact CG-CG1 4.11Å; R493-V519 HydrophobicContact CG-CG2 3.79Å; R493-R520 PolarHBondContact NH1-O 3.48Å; R493-E522 IonicContact CZ-OE1 3.71Å; R493-E522 IonicContact NH2-OE1 2.85Å; R493-E522 PolarHBondContact NH2-OE1 3.19Å; R493-T536 HydrophobicContact CB-CG2 4.31Å; R493-M710 HydrophobicContact CG-SD 4.36Å
494	I	83.9	Confident	92.6	Very high	5 Å²	5	19.7 Å²	19.7	3%	0.026	9%	0.091	C	C	.	.	H	α-helix	trans	-59.1	-41.2	-179.4	-173.7	154.5	0	0	0	111.8	R492 S498 M710 Q713 F717 I738	R492-I494 VanDerWaalsContact C-N 3.32Å; R492-I494 HydrophobicContact CB-CG2 4.11Å; R492-I494 PolarHBondContact O-N 3.13Å; I494-S498 VanDerWaalsContact O-CB 3.28Å; I494-S498 WeakPolarHBondContact O-CB 3.41Å; I494-S498 PolarHBondContact O-N 3.35Å; I494-S498 PolarHBondContact O-OG 3.36Å; I494-M710 VanDerWaalsContact CA-CE 3.5Å; I494-M710 HydrophobicContact CB-CE 3.54Å; I494-M710 HydrophobicContact CB-SD 3.88Å; I494-M710 HydrophobicContact CD1-CE 4.05Å; I494-M710 HydrophobicContact CG1-CE 3.74Å; I494-Q713 HydrophobicContact CD1-CB 3.83Å; I494-F717 HydrophobicContact CD1-CE2 3.95Å; I494-F717 HydrophobicContact CD1-CZ 4.13Å; I494-F717 HydrophobicContact CG1-CE2 4.12Å; I494-F717 HydrophobicContact CG1-CZ 4.12Å; I494-I738 HydrophobicContact CD1-CD1 4.04Å; I494-I738 HydrophobicContact CG1-CD1 4.35Å; I494-I738 HydrophobicContact CG2-CD1 3.74Å; I494-I738 HydrophobicContact CG2-CG1 4.06Å
495	S	88.8	Confident	92.2	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-67.1	-48.1	178.5	-44.7	0	0	0	0	111.9	R492 R493 V497 S498 V499 S737	R492-S495 WeakPolarHBondContact O-CB 3.47Å; R492-S495 PolarHBondContact O-N 2.82Å; R493-S495 VanDerWaalsContact C-N 3.27Å; R493-S495 PolarHBondContact O-N 2.95Å; S495-V497 VanDerWaalsContact C-N 3.27Å; S495-V497 PolarHBondContact O-N 3.3Å; S495-S498 PolarHBondContact O-N 3.43Å; S495-S498 PolarHBondContact O-OG 3.28Å; S495-V499 WeakPolarHBondContact O-CB 3.39Å; S495-V499 WeakPolarHBondContact O-CG2 3.37Å; S495-V499 PolarHBondContact O-N 3.12Å; S495-S737 VanDerWaalsContact CB-CB 3.5Å; S495-S737 WeakPolarHBondContact OG-CB 3.34Å
496	A	92.6	Very high	91.8	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-54.6	-44.6	176.9	0	0	0	0	0	112	Q490 R492 R493 A500 V519	Q490-A496 HydrophobicContact CB-CB 4.03Å; Q490-A496 HydrophobicContact CG-CB 4.37Å; R492-A496 PolarHBondContact O-N 3.32Å; R492-A496 VanDerWaalsContact O-N 3.08Å; R493-A496 PolarHBondContact O-N 3.25Å; A496-A500 VanDerWaalsContact O-CB 3.22Å; A496-A500 WeakPolarHBondContact O-CB 3.5Å; A496-A500 PolarHBondContact O-N 3.46Å; A496-V519 HydrophobicContact CB-CG1 3.64Å
497	V	90.8	Very high	91.3	Very high	2 Å²	2	27.1 Å²	27.1	1%	0.012	13%	0.125	C	C	.	.	H	α-helix	trans	-73.2	-49.2	-179.3	178.9	0	0	0	0	111.7	R493 S495 A500 Q501 F517 V519	R493-V497 WeakPolarHBondContact O-CG2 3.45Å; R493-V497 PolarHBondContact O-N 2.92Å; R493-V497 VanDerWaalsContact O-N 3.14Å; S495-V497 VanDerWaalsContact C-N 3.27Å; S495-V497 PolarHBondContact O-N 3.3Å; V497-A500 PolarHBondContact O-N 3.43Å; V497-Q501 VanDerWaalsContact O-CG 3.26Å; V497-Q501 WeakPolarHBondContact O-CG 3.34Å; V497-Q501 PolarHBondContact O-N 2.77Å; V497-F517 HydrophobicContact CG1-CE1 4.37Å; V497-F517 HydrophobicContact CG1-CE2 4.4Å; V497-F517 HydrophobicContact CG1-CZ 4.19Å; V497-F517 HydrophobicContact CG2-CD2 3.78Å; V497-F517 HydrophobicContact CG2-CE2 3.79Å; V497-F517 HydrophobicContact CG2-CG 4.38Å; V497-F517 HydrophobicContact CG2-CZ 4.41Å; V497-V519 HydrophobicContact CG2-CG1 4.21Å; V497-V519 HydrophobicContact CG2-CG2 4.19Å
498	S	87.8	Confident	90.9	Very high	20 Å²	20	27.4 Å²	27.4	14%	0.14	13%	0.127	C	C	.	.	H	α-helix	trans	-68.1	-40.9	-174.6	65.8	0	0	0	0	112.1	I494 S495 Q501 R502	I494-S498 VanDerWaalsContact O-CB 3.28Å; I494-S498 WeakPolarHBondContact O-CB 3.41Å; I494-S498 PolarHBondContact O-N 3.35Å; I494-S498 PolarHBondContact O-OG 3.36Å; S495-S498 PolarHBondContact O-N 3.43Å; S495-S498 PolarHBondContact O-OG 3.28Å; S498-Q501 PolarHBondContact O-N 2.77Å; S498-R502 WeakPolarHBondContact O-CB 3.38Å; S498-R502 PolarHBondContact O-N 2.84Å
499	V	91.2	Very high	90.3	Very high	10 Å²	10	32 Å²	32	6%	0.061	16%	0.157	C	C	.	.	H	α-helix	trans	-66.1	-44.6	177.2	175.7	0	0	0	0	110.4	T464 S495 Q501 R502 V503 F534	T464-V499 HydrophobicContact CG2-CB 4.24Å; T464-V499 HydrophobicContact CG2-CG1 3.51Å; T464-V499 HydrophobicContact CG2-CG2 3.68Å; S495-V499 WeakPolarHBondContact O-CB 3.39Å; S495-V499 WeakPolarHBondContact O-CG2 3.37Å; S495-V499 PolarHBondContact O-N 3.12Å; V499-Q501 VanDerWaalsContact C-N 3.3Å; V499-Q501 PolarHBondContact O-N 2.91Å; V499-R502 WeakPolarHBondContact O-CB 3.45Å; V499-R502 PolarHBondContact O-N 3.38Å; V499-R502 VanDerWaalsContact O-N 3.16Å; V499-V503 HydrophobicContact CG1-CG2 4.15Å; V499-V503 WeakPolarHBondContact O-CG2 3.27Å; V499-V503 PolarHBondContact O-N 3.47Å; V499-F534 HydrophobicContact CB-CD1 4.3Å; V499-F534 HydrophobicContact CB-CE1 4.28Å; V499-F534 HydrophobicContact CG1-CD1 3.8Å; V499-F534 HydrophobicContact CG1-CE1 3.31Å; V499-F534 HydrophobicContact CG1-CZ 3.88Å
500	A	94.9	Very high	90	Very high	3 Å²	3	33.2 Å²	33.2	3%	0.025	17%	0.166	C	C	.	.	H	α-helix	trans	-58.2	-44.1	176	0	0	0	0	0	111.9	A496 V497 R502 V503 S504 V515 F517 F534	A496-A500 VanDerWaalsContact O-CB 3.22Å; A496-A500 WeakPolarHBondContact O-CB 3.5Å; A496-A500 PolarHBondContact O-N 3.46Å; V497-A500 PolarHBondContact O-N 3.43Å; A500-R502 VanDerWaalsContact C-N 3.35Å; A500-V503 PolarHBondContact O-N 3.35Å; A500-S504 WeakPolarHBondContact O-CB 3.23Å; A500-S504 PolarHBondContact O-N 3.46Å; A500-V515 HydrophobicContact CB-CG1 4.18Å; A500-V515 WeakPolarHBondContact O-CG1 3.39Å; A500-F517 HydrophobicContact CB-CB 3.79Å; A500-F517 HydrophobicContact CB-CD1 4.11Å; A500-F517 HydrophobicContact CB-CG 4.37Å; A500-F534 HydrophobicContact CB-CB 3.91Å; A500-F534 HydrophobicContact CB-CD2 3.71Å; A500-F534 HydrophobicContact CB-CG 3.94Å
501	Q	92	Very high	89.9	Confident	98 Å²	98	33.2 Å²	33.2	46%	0.458	17%	0.166	S	C	.	.	H	α-helix	trans	-62.9	-42.3	176.6	-72.7	176.2	-21.7	0	0	111.8	V497 S498 V499 S504 H505	V497-Q501 VanDerWaalsContact O-CG 3.26Å; V497-Q501 WeakPolarHBondContact O-CG 3.34Å; V497-Q501 PolarHBondContact O-N 2.77Å; S498-Q501 PolarHBondContact O-N 2.77Å; V499-Q501 VanDerWaalsContact C-N 3.3Å; V499-Q501 PolarHBondContact O-N 2.91Å; Q501-S504 PolarHBondContact O-N 3.15Å; Q501-H505 WeakPolarHBondContact O-CB 3.32Å; Q501-H505 PolarHBondContact O-N 3.33Å
502	R	88.2	Confident	90	Very high	109 Å²	109	39.2 Å²	39.2	41%	0.411	19%	0.185	S	C	.	.	H	α-helix	trans	-63.2	-49.5	177.4	179.1	60.9	-176.1	-109.3	-6.4	111.8	T465 S498 V499 A500 S504 H505 E506	T465-R502 HydrophobicContact CG2-CG 4.05Å; S498-R502 WeakPolarHBondContact O-CB 3.38Å; S498-R502 PolarHBondContact O-N 2.84Å; V499-R502 WeakPolarHBondContact O-CB 3.45Å; V499-R502 PolarHBondContact O-N 3.38Å; V499-R502 VanDerWaalsContact O-N 3.16Å; A500-R502 VanDerWaalsContact C-N 3.35Å; R502-S504 VanDerWaalsContact C-N 3.34Å; R502-S504 PolarHBondContact O-N 3.25Å; R502-H505 WeakPolarHBondContact O-CB 3.34Å; R502-H505 PolarHBondContact O-N 3.39Å; R502-E506 IonicContact CZ-OE1 3.77Å; R502-E506 VanDerWaalsContact CZ-OE1 3.25Å; R502-E506 IonicContact NE-OE1 3.14Å; R502-E506 PolarHBondContact NE-OE1 3.41Å; R502-E506 IonicContact NH2-OE1 3.41Å; R502-E506 PolarHBondContact NH2-OE1 3.4Å; R502-E506 WeakPolarHBondContact O-CG 3.23Å; R502-E506 PolarHBondContact O-N 3.19Å
503	V	92.8	Very high	90.3	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-65.6	-38.2	179.1	174.2	0	0	0	0	111.1	T465 Q469 V499 A500 H505 E506 L507 V515 L532 F534	T465-V503 HydrophobicContact CG2-CG2 4.2Å; Q469-V503 HydrophobicContact CG-CG1 3.8Å; V499-V503 HydrophobicContact CG1-CG2 4.15Å; V499-V503 WeakPolarHBondContact O-CG2 3.27Å; V499-V503 PolarHBondContact O-N 3.47Å; A500-V503 PolarHBondContact O-N 3.35Å; V503-H505 VanDerWaalsContact C-N 3.33Å; V503-H505 PolarHBondContact O-N 3.19Å; V503-E506 PolarHBondContact O-N 3.18Å; V503-L507 HydrophobicContact CG1-CD1 3.94Å; V503-L507 WeakPolarHBondContact O-CB 3.46Å; V503-L507 WeakPolarHBondContact O-CG 3.22Å; V503-L507 PolarHBondContact O-N 2.86Å; V503-V515 HydrophobicContact CG1-CG1 4.48Å; V503-V515 HydrophobicContact CG1-CG2 4.02Å; V503-L532 HydrophobicContact CG1-CD1 4.25Å; V503-F534 HydrophobicContact CB-CE2 4.2Å; V503-F534 HydrophobicContact CB-CZ 4.25Å; V503-F534 HydrophobicContact CG1-CE2 4.28Å; V503-F534 HydrophobicContact CG1-CZ 4.4Å; V503-F534 HydrophobicContact CG2-CE2 4.36Å; V503-F534 HydrophobicContact CG2-CZ 3.9Å
504	S	93.1	Very high	90.7	Very high	20 Å²	20	41.8 Å²	41.8	14%	0.14	20%	0.196	C	C	.	.	H	α-helix	trans	-60.4	-41.6	173.5	-173.3	0	0	0	0	111.9	A500 Q501 R502 R512	A500-S504 WeakPolarHBondContact O-CB 3.23Å; A500-S504 PolarHBondContact O-N 3.46Å; Q501-S504 PolarHBondContact O-N 3.15Å; R502-S504 VanDerWaalsContact C-N 3.34Å; R502-S504 PolarHBondContact O-N 3.25Å; S504-R512 VanDerWaalsContact O-CB 3.29Å; S504-R512 WeakPolarHBondContact O-CB 3.3Å; S504-R512 VanDerWaalsContact OG-CB 3.32Å; S504-R512 WeakPolarHBondContact OG-CB 3.38Å; S504-R512 PolarHBondContact OG-O 3.41Å
505	H	89.1	Confident	91.3	Very high	145 Å²	145	42.2 Å²	42.2	67%	0.671	20%	0.198	S	C	*	.	H	α-helix	trans	-67.8	-46.1	175.4	-178.9	72.9	0	0	0	112.1	Q501 R502 V503 L507 G508	Q501-H505 WeakPolarHBondContact O-CB 3.32Å; Q501-H505 PolarHBondContact O-N 3.33Å; R502-H505 WeakPolarHBondContact O-CB 3.34Å; R502-H505 PolarHBondContact O-N 3.39Å; V503-H505 VanDerWaalsContact C-N 3.33Å; V503-H505 PolarHBondContact O-N 3.19Å; H505-L507 VanDerWaalsContact C-N 3.3Å; H505-L507 PolarHBondContact O-N 2.98Å; H505-G508 PolarHBondContact O-N 3.19Å
506	E	88	Confident	91.7	Very high	16 Å²	16	42.4 Å²	42.4	8%	0.075	20%	0.2	C	C	.	.	H	α-helix	trans	-64.4	-31.4	177.8	-71.4	-179.1	179.9	0	0	112.9	R424 R466 Q469 R502 V503 G508	R424-E506 PolarHBondContact NH2-O 3.49Å; R466-E506 IonicContact CZ-OE2 2.73Å; R466-E506 IonicContact NH1-OE1 3.76Å; R466-E506 IonicContact NH1-OE2 2.7Å; R466-E506 PolarHBondContact NH1-OE2 3Å; Q469-E506 PolarHBondContact NE2-OE2 3.43Å; R502-E506 IonicContact CZ-OE1 3.77Å; R502-E506 VanDerWaalsContact CZ-OE1 3.25Å; R502-E506 IonicContact NE-OE1 3.14Å; R502-E506 PolarHBondContact NE-OE1 3.41Å; R502-E506 IonicContact NH2-OE1 3.41Å; R502-E506 PolarHBondContact NH2-OE1 3.4Å; R502-E506 WeakPolarHBondContact O-CG 3.23Å; R502-E506 PolarHBondContact O-N 3.19Å; V503-E506 PolarHBondContact O-N 3.18Å; E506-G508 PolarHBondContact O-N 3.22Å
507	L	89.9	Confident	91.9	Very high	0 Å²	0	43 Å²	43	0%	0	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-13	172.7	-81	166.2	0	0	0	114	W421 R424 Q469 L472 V503 H505 L511 V515 L532	W421-L507 HydrophobicContact CH2-CD2 4.47Å; W421-L507 HydrophobicContact CZ3-CD2 3.94Å; R424-L507 WeakPolarHBondContact CG-O 3.47Å; R424-L507 PolarHBondContact NE-O 3.47Å; R424-L507 VanDerWaalsContact NH2-CA 3.31Å; Q469-L507 HydrophobicContact CG-CD1 4.34Å; Q469-L507 HydrophobicContact CG-CD2 4.24Å; Q469-L507 HydrophobicContact CG-CG 4.12Å; L472-L507 HydrophobicContact CD2-CD1 4.22Å; L472-L507 HydrophobicContact CD2-CD2 4.23Å; V503-L507 HydrophobicContact CG1-CD1 3.94Å; V503-L507 WeakPolarHBondContact O-CB 3.46Å; V503-L507 WeakPolarHBondContact O-CG 3.22Å; V503-L507 PolarHBondContact O-N 2.86Å; H505-L507 VanDerWaalsContact C-N 3.3Å; H505-L507 PolarHBondContact O-N 2.98Å; L507-L511 HydrophobicContact CB-CB 4.01Å; L507-L511 HydrophobicContact CD2-CB 4.35Å; L507-L511 HydrophobicContact CD2-CD1 4.29Å; L507-V515 HydrophobicContact CD1-CG2 3.34Å; L507-L532 HydrophobicContact CD1-CD1 4.01Å
508	G	88.2	Confident	92.2	Very high	5 Å²	5	44.9 Å²	44.9	5%	0.052	21%	0.212	C	C	.	.	H	α-helix	trans	74.4	171.3	178	0	0	0	0	0	113.5	H505 E506 S510 L511 R512	H505-G508 PolarHBondContact O-N 3.19Å; E506-G508 PolarHBondContact O-N 3.22Å; G508-S510 PolarHBondContact O-N 3.37Å; G508-S510 VanDerWaalsContact O-N 3.17Å; G508-L511 PolarHBondContact O-N 2.59Å; G508-R512 WeakPolarHBondContact O-CB 3.39Å; G508-R512 PolarHBondContact O-N 3.06Å
509	P	87.7	Confident	92.4	Very high	96 Å²	96	44.1 Å²	44.1	62%	0.623	21%	0.206	S	C	*	.	H	α-helix	trans	-61.4	-28.6	-171.3	24.2	-33.5	0	0	0	114.1
510	S	90.5	Very high	92.2	Very high	26 Å²	26	47.6 Å²	47.6	18%	0.182	22%	0.218	C	C	.	.	H	α-helix	trans	-71.4	-31.8	-178.6	-55.2	0	0	0	0	113.3	L420 R423 G508	L420-S510 WeakPolarHBondContact O-CB 3.38Å; R423-S510 PolarHBondContact O-OG 3Å; G508-S510 PolarHBondContact O-N 3.37Å; G508-S510 VanDerWaalsContact O-N 3.17Å
511	L	93.1	Very high	91.6	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-119.1	-6	-173.2	-73.9	163.9	0	0	0	113.6	L417 L420 W421 L507 G508 R513 N514	L417-L511 HydrophobicContact CD2-CD2 4.22Å; L420-L511 HydrophobicContact CB-CD2 4Å; L420-L511 HydrophobicContact CB-CG 4.26Å; W421-L511 HydrophobicContact CB-CD1 4.35Å; W421-L511 HydrophobicContact CD2-CD1 4.16Å; W421-L511 HydrophobicContact CE3-CD1 3.34Å; W421-L511 HydrophobicContact CZ3-CD1 3.89Å; L507-L511 HydrophobicContact CB-CB 4.01Å; L507-L511 HydrophobicContact CD2-CB 4.35Å; L507-L511 HydrophobicContact CD2-CD1 4.29Å; G508-L511 PolarHBondContact O-N 2.59Å; L511-R513 PolarHBondContact O-N 2.94Å; L511-N514 VanDerWaalsContact O-CB 3.23Å; L511-N514 WeakPolarHBondContact O-CB 3.11Å; L511-N514 PolarHBondContact O-N 3.35Å; L511-N514 PolarHBondContact O-OD1 3.03Å
512	R	91.7	Very high	91.3	Very high	153 Å²	153	49.5 Å²	49.5	58%	0.577	23%	0.228	S	C	*	.	G	3₁₀ helix	trans	-52.3	-28.2	-179.5	67	177.5	-73.1	-173.1	-2.7	114.7	S504 G508 N514 V515	S504-R512 VanDerWaalsContact O-CB 3.29Å; S504-R512 WeakPolarHBondContact O-CB 3.3Å; S504-R512 VanDerWaalsContact OG-CB 3.32Å; S504-R512 WeakPolarHBondContact OG-CB 3.38Å; S504-R512 PolarHBondContact OG-O 3.41Å; G508-R512 WeakPolarHBondContact O-CB 3.39Å; G508-R512 PolarHBondContact O-N 3.06Å; R512-N514 VanDerWaalsContact C-N 3.29Å; R512-V515 PolarHBondContact O-N 3.14Å
513	R	93.6	Very high	91.5	Very high	158 Å²	158	47.6 Å²	47.6	60%	0.596	23%	0.232	S	C	*	.	G	3₁₀ helix	trans	-74	-17.3	179.4	66.5	-176.8	176.3	-167.4	1.1	114.1	L511	L511-R513 PolarHBondContact O-N 2.94Å
514	N	96.4	Very high	91.6	Very high	11 Å²	11	54.3 Å²	54.3	6%	0.059	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-78.4	-12.4	175.8	-70.4	77.5	0	0	0	112	L417 L511 R512 P526 G530 L532	L417-N514 WeakPolarHBondContact CD2-ND2 3.17Å; L511-N514 VanDerWaalsContact O-CB 3.23Å; L511-N514 WeakPolarHBondContact O-CB 3.11Å; L511-N514 PolarHBondContact O-N 3.35Å; L511-N514 PolarHBondContact O-OD1 3.03Å; R512-N514 VanDerWaalsContact C-N 3.29Å; N514-P526 VanDerWaalsContact O-CB 3.27Å; N514-P526 WeakPolarHBondContact O-CB 3.43Å; N514-G530 VanDerWaalsContact CB-O 3.28Å; N514-G530 WeakPolarHBondContact CB-O 3.46Å; N514-G530 PolarHBondContact ND2-O 2.83Å; N514-L532 PolarHBondContact O-N 2.85Å
515	V	97.7	Very high	91.7	Very high	14 Å²	14	55.8 Å²	55.8	9%	0.085	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	129.7	174.4	-170.6	0	0	0	0	109.4	A500 V503 L507 R512 L532 F534	A500-V515 HydrophobicContact CB-CG1 4.18Å; A500-V515 WeakPolarHBondContact O-CG1 3.39Å; V503-V515 HydrophobicContact CG1-CG1 4.48Å; V503-V515 HydrophobicContact CG1-CG2 4.02Å; L507-V515 HydrophobicContact CD1-CG2 3.34Å; R512-V515 PolarHBondContact O-N 3.14Å; V515-L532 WeakPolarHBondContact CA-O 3.32Å; V515-L532 HydrophobicContact CG2-CB 4.38Å; V515-L532 HydrophobicContact CG2-CD1 4.27Å; V515-F534 HydrophobicContact CG1-CD2 3.9Å; V515-F534 HydrophobicContact CG1-CE2 3.82Å
516	G	97.2	Very high	92	Very high	4 Å²	4	49.2 Å²	49.2	4%	0.041	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	177	170.3	0	0	0	0	0	111.9	K524 L532 F534	G516-K524 CarbonylContact C-O 3.58Å; G516-K524 WeakPolarHBondContact CA-O 3.26Å; G516-L532 PolarHBondContact N-O 3.24Å; G516-F534 PolarHBondContact O-N 3.15Å
517	F	96.8	Very high	92.1	Very high	13 Å²	13	52 Å²	52	6%	0.057	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	155.9	172.6	66.7	-91.7	0	0	0	112.2	V497 A500 E522 K524 F534	V497-F517 HydrophobicContact CG1-CE1 4.37Å; V497-F517 HydrophobicContact CG1-CE2 4.4Å; V497-F517 HydrophobicContact CG1-CZ 4.19Å; V497-F517 HydrophobicContact CG2-CD2 3.78Å; V497-F517 HydrophobicContact CG2-CE2 3.79Å; V497-F517 HydrophobicContact CG2-CG 4.38Å; V497-F517 HydrophobicContact CG2-CZ 4.41Å; A500-F517 HydrophobicContact CB-CB 3.79Å; A500-F517 HydrophobicContact CB-CD1 4.11Å; A500-F517 HydrophobicContact CB-CG 4.37Å; F517-E522 HydrophobicContact CE2-CB 4.19Å; F517-K524 HydrophobicContact CD1-CB 4.37Å; F517-K524 HydrophobicContact CE1-CB 4.07Å; F517-K524 HydrophobicContact CE1-CD 3.87Å; F517-K524 HydrophobicContact CE1-CG 4.26Å; F517-K524 HydrophobicContact CZ-CB 4.24Å; F517-K524 HydrophobicContact CZ-CD 3.83Å; F517-K524 HydrophobicContact CZ-CG 4.06Å; F517-K524 PolarHBondContact N-O 3.32Å; F517-K524 CarbonylContact O-C 3.59Å; F517-K524 VanDerWaalsContact O-C 3.32Å; F517-K524 PolarHBondContact O-N 2.95Å; F517-F534 CarbonylContact C-O 3.56Å; F517-F534 WeakPolarHBondContact CA-O 3.49Å; F517-F534 HydrophobicContact CB-CB 4.31Å; F517-F534 VanDerWaalsContact CB-O 3.32Å; F517-F534 WeakPolarHBondContact CB-O 3.42Å
518	Q	96.5	Very high	92.1	Very high	41 Å²	41	54.1 Å²	54.1	19%	0.192	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	120.1	172.9	-170.7	175.7	7.5	0	0	110.7	L533 F534 C535 T536 I539	Q518-L533 HydrophobicContact CB-CD1 4.07Å; Q518-F534 PolarHBondContact N-O 3.25Å; Q518-C535 HydrophobicContact CB-CB 4.35Å; Q518-C535 WeakPolarHBondContact O-CA 3.09Å; Q518-C535 WeakPolarHBondContact O-CB 3.29Å; Q518-T536 PolarHBondContact O-N 3.29Å; Q518-I539 HydrophobicContact CB-CG2 4.13Å; Q518-I539 HydrophobicContact CG-CD1 4.31Å; Q518-I539 HydrophobicContact CG-CG1 4.49Å; Q518-I539 HydrophobicContact CG-CG2 3.82Å
519	V	92.5	Very high	92.2	Very high	4 Å²	4	54 Å²	54	2%	0.024	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	169.2	178.6	-58.4	0	0	0	0	109	R493 A496 V497 L521 E522 T536	R493-V519 HydrophobicContact CG-CB 3.91Å; R493-V519 HydrophobicContact CG-CG1 4.11Å; R493-V519 HydrophobicContact CG-CG2 3.79Å; A496-V519 HydrophobicContact CB-CG1 3.64Å; V497-V519 HydrophobicContact CG2-CG1 4.21Å; V497-V519 HydrophobicContact CG2-CG2 4.19Å; V519-L521 PolarHBondContact O-N 3.25Å; V519-E522 HydrophobicContact CG2-CB 3.71Å; V519-E522 PolarHBondContact N-O 2.86Å; V519-E522 CarbonylContact O-C 3.53Å; V519-E522 PolarHBondContact O-N 3.19Å; V519-E522 VanDerWaalsContact O-N 3.1Å; V519-T536 HydrophobicContact CB-CG2 4.3Å; V519-T536 HydrophobicContact CG1-CG2 3.92Å
520	R	87.1	Confident	92.6	Very high	83 Å²	83	49.5 Å²	49.5	31%	0.313	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.1	126.6	178.2	-163.7	179.6	179.1	157.3	5.3	110.4	R493 E522 S878	R493-R520 PolarHBondContact NH1-O 3.48Å; R520-E522 PolarHBondContact O-N 3.43Å; R520-S878 PolarHBondContact NH2-O 3.3Å
521	L	82.5	Confident	92.9	Very high	69 Å²	69	48.2 Å²	48.2	36%	0.361	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	66.3	2	-177.8	-54.6	173.9	0	0	0	116.9	V519 F974 G977 L978 Q981	V519-L521 PolarHBondContact O-N 3.25Å; L521-F974 HydrophobicContact CD1-CD2 3.96Å; L521-F974 HydrophobicContact CD1-CE2 3.75Å; L521-F974 HydrophobicContact CD1-CZ 4.28Å; L521-G977 WeakPolarHBondContact CD2-O 3.39Å; L521-L978 HydrophobicContact CD1-CD2 4.28Å; L521-Q981 HydrophobicContact CD2-CB 3.76Å; L521-Q981 HydrophobicContact CD2-CG 4.35Å
522	E	85.8	Confident	93.1	Very high	72 Å²	72	48.2 Å²	48.2	34%	0.336	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	122.9	174.4	-75.2	-179.5	-146	0	0	110.9	R493 F517 V519 R520	R493-E522 IonicContact CZ-OE1 3.71Å; R493-E522 IonicContact NH2-OE1 2.85Å; R493-E522 PolarHBondContact NH2-OE1 3.19Å; F517-E522 HydrophobicContact CE2-CB 4.19Å; V519-E522 HydrophobicContact CG2-CB 3.71Å; V519-E522 PolarHBondContact N-O 2.86Å; V519-E522 CarbonylContact O-C 3.53Å; V519-E522 PolarHBondContact O-N 3.19Å; V519-E522 VanDerWaalsContact O-N 3.1Å; R520-E522 PolarHBondContact O-N 3.43Å
523	S	91.4	Very high	93.5	Very high	69 Å²	69	41 Å²	41	48%	0.483	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	124.3	-177.9	-166.4	0	0	0	0	110.5	P525	S523-P525 WeakPolarHBondContact OG-CD 3.32Å
524	K	94.4	Very high	93.7	Very high	141 Å²	141	33.4 Å²	33.4	61%	0.613	18%	0.179	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-139.6	67.8	171	-65.9	-170.8	-177.1	-178.1	0	108.5	G516 F517	G516-K524 CarbonylContact C-O 3.58Å; G516-K524 WeakPolarHBondContact CA-O 3.26Å; F517-K524 HydrophobicContact CD1-CB 4.37Å; F517-K524 HydrophobicContact CE1-CB 4.07Å; F517-K524 HydrophobicContact CE1-CD 3.87Å; F517-K524 HydrophobicContact CE1-CG 4.26Å; F517-K524 HydrophobicContact CZ-CB 4.24Å; F517-K524 HydrophobicContact CZ-CD 3.83Å; F517-K524 HydrophobicContact CZ-CG 4.06Å; F517-K524 PolarHBondContact N-O 3.32Å; F517-K524 CarbonylContact O-C 3.59Å; F517-K524 VanDerWaalsContact O-C 3.32Å; F517-K524 PolarHBondContact O-N 2.95Å
525	P	94.9	Very high	93.7	Very high	52 Å²	52	32.9 Å²	32.9	34%	0.338	18%	0.177	S	C	.	.	P	Polyproline II helix	trans	-69.7	147.6	-178.5	30	-33.4	0	0	0	110.4	I397 S523 L533	I397-P525 VanDerWaalsContact O-CB 3.27Å; I397-P525 WeakPolarHBondContact O-CB 3.42Å; S523-P525 WeakPolarHBondContact OG-CD 3.32Å; P525-L533 HydrophobicContact CB-CD1 4.48Å
526	P	95.4	Very high	93.7	Very high	7 Å²	7	33.4 Å²	33.4	5%	0.045	18%	0.18	C	C	.	.	P	Polyproline II helix	trans	-73.9	166.3	171.3	34.9	-33.9	0	0	0	110.6	I397 N514 A531	I397-P526 HydrophobicContact CG2-CG 3.87Å; N514-P526 VanDerWaalsContact O-CB 3.27Å; N514-P526 WeakPolarHBondContact O-CB 3.43Å; P526-A531 HydrophobicContact CB-CB 4.41Å; P526-A531 HydrophobicContact CG-CB 3.83Å
527	A	92	Very high	93.6	Very high	74 Å²	74	33.4 Å²	33.4	61%	0.612	18%	0.179	S	C	*	.	P	Polyproline II helix	trans	-69.5	152.5	166.4	0	0	0	0	0	110.4	A531	A527-A531 WeakPolarHBondContact O-CB 3.42Å
528	R	88.2	Confident	93.5	Very high	44 Å²	44	34.6 Å²	34.6	17%	0.166	20%	0.195	C	C	.	.	S	Bend	trans	-68.2	147.2	176	-175.7	174.6	177	175.2	-0.2	111.3	T398 Y402 M403	T398-R528 HydrophobicContact CG2-CB 4.24Å; Y402-R528 VanDerWaalsContact CZ-NH2 3.34Å; Y402-R528 PolarHBondContact OH-NH2 2.89Å; Y402-R528 VanDerWaalsContact OH-NH2 3.08Å; M403-R528 PolarHBondContact O-NH1 2.93Å
529	G	90.4	Very high	93.4	Very high	4 Å²	4	33.7 Å²	33.7	4%	0.041	19%	0.191	C	C	.	.	S	Bend	trans	96.3	94.2	179	0	0	0	0	0	111.3	A482 N485	A482-G529 WeakPolarHBondContact O-CA 3.46Å; N485-G529 PolarHBondContact OD1-N 3.23Å
530	G	95.7	Very high	93.6	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	19%	0.19	C	C	.	.	S	Bend	trans	78.4	37.3	-172.2	0	0	0	0	0	112.3	G481 C484 N514	G481-G530 WeakPolarHBondContact O-CA 3.47Å; G481-G530 PolarHBondContact O-N 3.38Å; C484-G530 CarbonylContact O-C 3.56Å; C484-G530 VanDerWaalsContact O-C 3.26Å; C484-G530 WeakPolarHBondContact O-CA 3.18Å; C484-G530 PolarHBondContact O-N 2.77Å; N514-G530 VanDerWaalsContact CB-O 3.28Å; N514-G530 WeakPolarHBondContact CB-O 3.46Å; N514-G530 PolarHBondContact ND2-O 2.83Å
531	A	97.4	Very high	94	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	134.7	-170.9	0	0	0	0	0	113.1	I397 C484 N485 V486 P526 A527	I397-A531 HydrophobicContact CG1-CB 4.44Å; I397-A531 HydrophobicContact CG2-CB 3.73Å; C484-A531 PolarHBondContact O-N 2.89Å; N485-A531 CarbonylContact C-O 3.55Å; N485-A531 WeakPolarHBondContact CA-O 3.41Å; N485-A531 HydrophobicContact CB-CB 4.46Å; N485-A531 WeakPolarHBondContact OD1-CB 3.48Å; V486-A531 PolarHBondContact N-O 2.85Å; P526-A531 HydrophobicContact CB-CB 4.41Å; P526-A531 HydrophobicContact CG-CB 3.83Å; A527-A531 WeakPolarHBondContact O-CB 3.42Å
532	L	98.5	Very high	94.4	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	105.5	169	-57.1	-176.8	0	0	0	109.4	P468 L472 V486 I488 V503 L507 N514 V515 G516 F534	P468-L532 HydrophobicContact CB-CD1 4.13Å; P468-L532 HydrophobicContact CB-CD2 4.32Å; L472-L532 HydrophobicContact CB-CD1 4.46Å; L472-L532 HydrophobicContact CB-CD2 4.38Å; L472-L532 HydrophobicContact CD2-CD1 4.05Å; L472-L532 HydrophobicContact CD2-CG 4.28Å; V486-L532 HydrophobicContact CB-CD2 3.68Å; V486-L532 HydrophobicContact CG1-CD2 4.49Å; V486-L532 HydrophobicContact CG2-CD2 3.72Å; I488-L532 HydrophobicContact CD1-CB 4.31Å; V503-L532 HydrophobicContact CG1-CD1 4.25Å; L507-L532 HydrophobicContact CD1-CD1 4.01Å; N514-L532 PolarHBondContact O-N 2.85Å; V515-L532 WeakPolarHBondContact CA-O 3.32Å; V515-L532 HydrophobicContact CG2-CB 4.38Å; V515-L532 HydrophobicContact CG2-CD1 4.27Å; G516-L532 PolarHBondContact N-O 3.24Å; L532-F534 HydrophobicContact CB-CE2 4.45Å
533	L	98.4	Very high	94.8	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	111	179.3	177.2	64.1	0	0	0	110.7	I397 V486 I487 I488 Q518 P525	I397-L533 HydrophobicContact CD1-CB 4.17Å; V486-L533 PolarHBondContact O-N 3.35Å; I487-L533 WeakPolarHBondContact CA-O 3.32Å; I488-L533 PolarHBondContact N-O 2.96Å; Q518-L533 HydrophobicContact CB-CD1 4.07Å; P525-L533 HydrophobicContact CB-CD1 4.48Å
534	F	98.3	Very high	94.9	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	125.6	170.3	-69	-94.6	0	0	0	110.5	P468 I488 V499 A500 V503 V515 G516 F517 Q518 L532	P468-F534 HydrophobicContact CB-CZ 4.39Å; P468-F534 HydrophobicContact CG-CZ 4.16Å; I488-F534 HydrophobicContact CB-CD1 3.73Å; I488-F534 HydrophobicContact CB-CE1 3.82Å; I488-F534 HydrophobicContact CB-CG 4.31Å; I488-F534 HydrophobicContact CB-CZ 4.47Å; I488-F534 HydrophobicContact CD1-CD2 4.4Å; I488-F534 HydrophobicContact CD1-CE1 4.31Å; I488-F534 HydrophobicContact CD1-CE2 4.16Å; I488-F534 HydrophobicContact CD1-CZ 4.11Å; I488-F534 HydrophobicContact CG1-CD1 4.41Å; I488-F534 HydrophobicContact CG1-CE1 4.09Å; I488-F534 HydrophobicContact CG1-CZ 4.29Å; I488-F534 HydrophobicContact CG2-CD1 3.78Å; I488-F534 HydrophobicContact CG2-CE1 3.68Å; I488-F534 CarbonylContact O-C 3.35Å; I488-F534 VanDerWaalsContact O-CA 3.3Å; I488-F534 WeakPolarHBondContact O-CA 3.45Å; V499-F534 HydrophobicContact CB-CD1 4.3Å; V499-F534 HydrophobicContact CB-CE1 4.28Å; V499-F534 HydrophobicContact CG1-CD1 3.8Å; V499-F534 HydrophobicContact CG1-CE1 3.31Å; V499-F534 HydrophobicContact CG1-CZ 3.88Å; A500-F534 HydrophobicContact CB-CB 3.91Å; A500-F534 HydrophobicContact CB-CD2 3.71Å; A500-F534 HydrophobicContact CB-CG 3.94Å; V503-F534 HydrophobicContact CB-CE2 4.2Å; V503-F534 HydrophobicContact CB-CZ 4.25Å; V503-F534 HydrophobicContact CG1-CE2 4.28Å; V503-F534 HydrophobicContact CG1-CZ 4.4Å; V503-F534 HydrophobicContact CG2-CE2 4.36Å; V503-F534 HydrophobicContact CG2-CZ 3.9Å; V515-F534 HydrophobicContact CG1-CD2 3.9Å; V515-F534 HydrophobicContact CG1-CE2 3.82Å; G516-F534 PolarHBondContact O-N 3.15Å; F517-F534 CarbonylContact C-O 3.56Å; F517-F534 WeakPolarHBondContact CA-O 3.49Å; F517-F534 HydrophobicContact CB-CB 4.31Å; F517-F534 VanDerWaalsContact CB-O 3.32Å; F517-F534 WeakPolarHBondContact CB-O 3.42Å; Q518-F534 PolarHBondContact N-O 3.25Å; L532-F534 HydrophobicContact CB-CE2 4.45Å
535	C	97.8	Very high	94.8	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	162.2	-179.4	67.1	0	0	0	0	112.8	I488 T489 Q490 Q518 I539	I488-C535 PolarHBondContact O-N 3.01Å; T489-C535 CarbonylContact C-O 3.51Å; T489-C535 VanDerWaalsContact CA-O 3.27Å; T489-C535 WeakPolarHBondContact CA-O 3.41Å; Q490-C535 PolarHBondContact N-O 3.15Å; Q518-C535 HydrophobicContact CB-CB 4.35Å; Q518-C535 WeakPolarHBondContact O-CA 3.09Å; Q518-C535 WeakPolarHBondContact O-CB 3.29Å; C535-I539 HydrophobicContact CB-CB 4.05Å; C535-I539 HydrophobicContact CB-CG2 3.92Å
536	T	95.8	Very high	94.5	Very high	24 Å²	24	22.5 Å²	22.5	15%	0.147	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	148.9	166.9	45.8	0	0	0	0	110.2	Q490 R493 Q518 V519 G538 I539	Q490-T536 WeakPolarHBondContact O-CA 3.24Å; R493-T536 HydrophobicContact CB-CG2 4.31Å; Q518-T536 PolarHBondContact O-N 3.29Å; V519-T536 HydrophobicContact CB-CG2 4.3Å; V519-T536 HydrophobicContact CG1-CG2 3.92Å; T536-G538 VanDerWaalsContact C-N 3.26Å; T536-G538 PolarHBondContact O-N 3.23Å; T536-G538 VanDerWaalsContact O-N 3.16Å; T536-I539 WeakPolarHBondContact O-CB 3.37Å; T536-I539 PolarHBondContact O-N 3.37Å; T536-I539 VanDerWaalsContact OG1-CG1 3.28Å; T536-I539 WeakPolarHBondContact OG1-CG1 3.45Å
537	V	96.4	Very high	94.4	Very high	5 Å²	5	22.2 Å²	22.2	3%	0.03	13%	0.13	C	C	.	.	H	α-helix	trans	-49.2	-45.6	180	-179.6	0	0	0	0	112.6	Q490 I539 L540 L541 N567 L571	Q490-V537 PolarHBondContact O-N 3.1Å; V537-I539 PolarHBondContact O-N 3.21Å; V537-I539 VanDerWaalsContact O-N 3.13Å; V537-L540 PolarHBondContact O-N 2.78Å; V537-L541 HydrophobicContact CG1-CD1 4.37Å; V537-L541 HydrophobicContact CG1-CG 4.43Å; V537-L541 PolarHBondContact O-N 3.18Å; V537-N567 HydrophobicContact CB-CB 4.26Å; V537-N567 HydrophobicContact CG1-CB 3.74Å; V537-N567 WeakPolarHBondContact CG1-O 3.26Å; V537-L571 HydrophobicContact CG1-CB 4.02Å; V537-L571 HydrophobicContact CG1-CD2 3.94Å
538	G	93.4	Very high	94.5	Very high	38 Å²	38	22 Å²	22	39%	0.392	12%	0.123	S	C	.	.	H	α-helix	trans	-60.3	-23.8	178.2	0	0	0	0	0	115.2	T536 R542	T536-G538 VanDerWaalsContact C-N 3.26Å; T536-G538 PolarHBondContact O-N 3.23Å; T536-G538 VanDerWaalsContact O-N 3.16Å; G538-R542 PolarHBondContact O-N 3.06Å; G538-R542 VanDerWaalsContact O-N 3.16Å
539	I	94.6	Very high	94.8	Very high	22 Å²	22	21.5 Å²	21.5	11%	0.113	13%	0.126	C	C	.	.	H	α-helix	trans	-74.5	-39.8	174.1	-66.1	-69.6	0	0	0	110.5	Q518 C535 T536 V537 R542 K543	Q518-I539 HydrophobicContact CB-CG2 4.13Å; Q518-I539 HydrophobicContact CG-CD1 4.31Å; Q518-I539 HydrophobicContact CG-CG1 4.49Å; Q518-I539 HydrophobicContact CG-CG2 3.82Å; C535-I539 HydrophobicContact CB-CB 4.05Å; C535-I539 HydrophobicContact CB-CG2 3.92Å; T536-I539 WeakPolarHBondContact O-CB 3.37Å; T536-I539 PolarHBondContact O-N 3.37Å; T536-I539 VanDerWaalsContact OG1-CG1 3.28Å; T536-I539 WeakPolarHBondContact OG1-CG1 3.45Å; V537-I539 PolarHBondContact O-N 3.21Å; V537-I539 VanDerWaalsContact O-N 3.13Å; I539-R542 PolarHBondContact O-N 3.3Å; I539-K543 HydrophobicContact CG2-CD 4.18Å; I539-K543 VanDerWaalsContact CG2-CE 3.48Å; I539-K543 WeakPolarHBondContact O-CG 3.37Å; I539-K543 PolarHBondContact O-N 3.24Å
540	L	97.4	Very high	95	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-67.4	-39.7	174.5	-178.9	54.9	0	0	0	111.4	I487 T489 V537 R542 K543 L544 L550 V556 L571	I487-L540 HydrophobicContact CD1-CD1 3.97Å; I487-L540 HydrophobicContact CG2-CD1 4.19Å; I487-L540 HydrophobicContact CG2-CD2 4.18Å; T489-L540 HydrophobicContact CG2-CB 3.89Å; T489-L540 HydrophobicContact CG2-CD2 3.45Å; T489-L540 VanDerWaalsContact CG2-CD2 3.45Å; T489-L540 HydrophobicContact CG2-CG 4.32Å; V537-L540 PolarHBondContact O-N 2.78Å; L540-R542 VanDerWaalsContact C-N 3.32Å; L540-R542 PolarHBondContact O-N 2.8Å; L540-K543 HydrophobicContact CD1-CB 4.44Å; L540-K543 PolarHBondContact O-N 3.16Å; L540-K543 VanDerWaalsContact O-N 3.12Å; L540-L544 HydrophobicContact CG-CD1 4.37Å; L540-L544 PolarHBondContact O-N 3.11Å; L540-L550 HydrophobicContact CD1-CD1 4.12Å; L540-L550 HydrophobicContact CD1-CD2 4.06Å; L540-V556 HydrophobicContact CD2-CG1 3.86Å; L540-L571 HydrophobicContact CD2-CD1 3.88Å; L540-L571 HydrophobicContact CD2-CD2 3.89Å; L540-L571 HydrophobicContact CG-CD1 4.06Å
541	L	95.5	Very high	94.9	Very high	5 Å²	5	25.2 Å²	25.2	3%	0.026	14%	0.142	C	C	.	.	H	α-helix	trans	-55.7	-47.1	172.8	-67.9	178	0	0	0	111.3	V537 K543 L544 Q545 N567 F570 L571 L574 H826	V537-L541 HydrophobicContact CG1-CD1 4.37Å; V537-L541 HydrophobicContact CG1-CG 4.43Å; V537-L541 PolarHBondContact O-N 3.18Å; L541-K543 VanDerWaalsContact C-N 3.35Å; L541-K543 PolarHBondContact O-N 3.37Å; L541-L544 WeakPolarHBondContact O-CB 3.3Å; L541-L544 PolarHBondContact O-N 3.11Å; L541-Q545 PolarHBondContact O-N 3.36Å; L541-N567 HydrophobicContact CD1-CB 4.05Å; L541-F570 HydrophobicContact CD1-CD1 4.15Å; L541-F570 HydrophobicContact CD2-CD1 3.69Å; L541-F570 HydrophobicContact CD2-CE1 4.08Å; L541-L571 HydrophobicContact CD2-CB 3.98Å; L541-L571 HydrophobicContact CD2-CD1 3.97Å; L541-L574 HydrophobicContact CD2-CD1 3.78Å; L541-H826 PolarHBondContact O-CE1 3.34Å; L541-H826 PolarHBondContact O-NE2 3.47Å
542	R	91	Very high	94.7	Very high	101 Å²	101	26.1 Å²	26.1	38%	0.381	15%	0.151	S	C	.	.	H	α-helix	trans	-61.4	-40.6	175.2	-171	176	-63.8	-169	-3.7	113	G538 I539 L540 L544 Q545 S878	G538-R542 PolarHBondContact O-N 3.06Å; G538-R542 VanDerWaalsContact O-N 3.16Å; I539-R542 PolarHBondContact O-N 3.3Å; L540-R542 VanDerWaalsContact C-N 3.32Å; L540-R542 PolarHBondContact O-N 2.8Å; R542-L544 VanDerWaalsContact C-N 3.29Å; R542-L544 PolarHBondContact O-N 3.22Å; R542-Q545 WeakPolarHBondContact O-CB 3.49Å; R542-Q545 PolarHBondContact O-N 2.97Å; R542-Q545 VanDerWaalsContact O-N 3.12Å; R542-S878 PolarHBondContact NH2-OG 3.49Å
543	K	93.7	Very high	94.7	Very high	17 Å²	17	26.5 Å²	26.5	7%	0.074	15%	0.154	C	C	.	.	H	α-helix	trans	-64.3	-33.7	177.5	-71.3	166.9	-177.7	-67.5	0	112.5	P396 I539 L540 L541 Q545 S546 N547	P396-K543 HydrophobicContact CB-CD 4.47Å; P396-K543 WeakPolarHBondContact O-CD 3.39Å; P396-K543 WeakPolarHBondContact O-CE 3.27Å; P396-K543 PolarHBondContact O-NZ 3.39Å; I539-K543 HydrophobicContact CG2-CD 4.18Å; I539-K543 VanDerWaalsContact CG2-CE 3.48Å; I539-K543 WeakPolarHBondContact O-CG 3.37Å; I539-K543 PolarHBondContact O-N 3.24Å; L540-K543 HydrophobicContact CD1-CB 4.44Å; L540-K543 PolarHBondContact O-N 3.16Å; L540-K543 VanDerWaalsContact O-N 3.12Å; L541-K543 VanDerWaalsContact C-N 3.35Å; L541-K543 PolarHBondContact O-N 3.37Å; K543-Q545 PolarHBondContact O-N 2.95Å; K543-S546 PolarHBondContact O-N 3.3Å; K543-S546 PolarHBondContact O-OG 2.64Å; K543-N547 PolarHBondContact O-N 3.34Å
544	L	94.9	Very high	94.6	Very high	8 Å²	8	27.3 Å²	27.3	4%	0.042	16%	0.159	C	C	.	.	H	α-helix	trans	-66	-19.8	174.5	-78.9	163.8	0	0	0	113.2	L540 L541 R542 P548 L550 L571 L574 L578	L540-L544 HydrophobicContact CG-CD1 4.37Å; L540-L544 PolarHBondContact O-N 3.11Å; L541-L544 WeakPolarHBondContact O-CB 3.3Å; L541-L544 PolarHBondContact O-N 3.11Å; R542-L544 VanDerWaalsContact C-N 3.29Å; R542-L544 PolarHBondContact O-N 3.22Å; L544-P548 VanDerWaalsContact O-CA 3.27Å; L544-P548 WeakPolarHBondContact O-CA 3.44Å; L544-L550 HydrophobicContact CD2-CD1 3.89Å; L544-L550 HydrophobicContact CD2-CD2 3.76Å; L544-L550 HydrophobicContact CD2-CG 3.55Å; L544-L550 HydrophobicContact CG-CD2 4.09Å; L544-L550 HydrophobicContact CG-CG 4.36Å; L544-L571 HydrophobicContact CD1-CD1 3.64Å; L544-L574 HydrophobicContact CD1-CB 4.29Å; L544-L574 HydrophobicContact CD1-CD1 3.92Å; L544-L578 HydrophobicContact CD2-CD2 4.07Å
545	Q	91	Very high	94.6	Very high	69 Å²	69	27.4 Å²	27.4	32%	0.322	16%	0.16	S	C	.	.	H	α-helix	trans	-73.6	-41.7	176.2	-60.1	173.7	-2.9	0	0	111.2	L541 R542 K543 Q822 I825 H826	L541-Q545 PolarHBondContact O-N 3.36Å; R542-Q545 WeakPolarHBondContact O-CB 3.49Å; R542-Q545 PolarHBondContact O-N 2.97Å; R542-Q545 VanDerWaalsContact O-N 3.12Å; K543-Q545 PolarHBondContact O-N 2.95Å; Q545-Q822 VanDerWaalsContact NE2-OE1 3.15Å; Q545-I825 HydrophobicContact CG-CG2 4.01Å; Q545-H826 WeakPolarHBondContact CG-CE1 3.48Å; Q545-H826 PolarHBondContact NE2-NE2 3.44Å
546	S	89.1	Confident	94.7	Very high	55 Å²	55	27.4 Å²	27.4	39%	0.385	16%	0.16	S	C	.	.	H	α-helix	trans	-90	-18.3	180	57.4	0	0	0	0	114	S394 K543	S394-S546 WeakPolarHBondContact CB-OG 3.18Å; K543-S546 PolarHBondContact O-N 3.3Å; K543-S546 PolarHBondContact O-OG 2.64Å
547	N	94.2	Very high	94.8	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	15%	0.153	C	C	.	.			trans	-139.5	80.2	174.4	-168.3	-25.5	0	0	0	110.6	S394 P396 K543 S549 L550 E551	S394-N547 WeakPolarHBondContact O-CB 3.38Å; S394-N547 PolarHBondContact O-ND2 2.97Å; P396-N547 WeakPolarHBondContact CD-ND2 3.35Å; P396-N547 HydrophobicContact CG-CB 4.04Å; P396-N547 WeakPolarHBondContact CG-ND2 3.12Å; K543-N547 PolarHBondContact O-N 3.34Å; N547-S549 PolarHBondContact O-N 3.18Å; N547-S549 PolarHBondContact OD1-OG 3.37Å; N547-L550 PolarHBondContact O-N 3.33Å; N547-L550 WeakPolarHBondContact OD1-CA 3.47Å; N547-L550 PolarHBondContact OD1-N 3.39Å; N547-E551 PolarHBondContact ND2-N 2.95Å; N547-E551 PolarHBondContact ND2-O 3.01Å; N547-E551 PolarHBondContact OD1-N 3.15Å
548	P	92.8	Very high	94.9	Very high	71 Å²	71	26 Å²	26	46%	0.461	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-23.7	-174.5	-24.3	34.8	0	0	0	114.6	L544 L578	L544-P548 VanDerWaalsContact O-CA 3.27Å; L544-P548 WeakPolarHBondContact O-CA 3.44Å; P548-L578 WeakPolarHBondContact O-CD1 3.41Å
549	S	93.8	Very high	95	Very high	33 Å²	33	24.3 Å²	24.3	23%	0.231	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-7.5	176.8	56.9	0	0	0	0	113.3	N547 E551 N582	N547-S549 PolarHBondContact O-N 3.18Å; N547-S549 PolarHBondContact OD1-OG 3.37Å; S549-E551 PolarHBondContact O-N 3.28Å; S549-N582 WeakPolarHBondContact O-CB 3.33Å; S549-N582 PolarHBondContact O-ND2 3.37Å
550	L	96	Very high	94.8	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	13%	0.131	C	C	.	.			trans	47.2	43.5	-166.1	-64.9	-178.4	0	0	0	112.4	P396 L540 L544 N547 G552 V553 V556 L575 L578 L585	P396-L550 HydrophobicContact CB-CD2 4.15Å; P396-L550 HydrophobicContact CG-CD2 4.02Å; L540-L550 HydrophobicContact CD1-CD1 4.12Å; L540-L550 HydrophobicContact CD1-CD2 4.06Å; L544-L550 HydrophobicContact CD2-CD1 3.89Å; L544-L550 HydrophobicContact CD2-CD2 3.76Å; L544-L550 HydrophobicContact CD2-CG 3.55Å; L544-L550 HydrophobicContact CG-CD2 4.09Å; L544-L550 HydrophobicContact CG-CG 4.36Å; N547-L550 PolarHBondContact O-N 3.33Å; N547-L550 WeakPolarHBondContact OD1-CA 3.47Å; N547-L550 PolarHBondContact OD1-N 3.39Å; L550-G552 PolarHBondContact O-N 3.27Å; L550-V553 HydrophobicContact CB-CB 4.14Å; L550-V553 HydrophobicContact CB-CG2 4.12Å; L550-V553 WeakPolarHBondContact O-CB 3.21Å; L550-V553 PolarHBondContact O-N 2.84Å; L550-V556 HydrophobicContact CD1-CG2 3.74Å; L550-L575 HydrophobicContact CD1-CD2 4.44Å; L550-L578 HydrophobicContact CB-CD2 4.25Å; L550-L578 HydrophobicContact CD1-CD2 3.64Å; L550-L578 HydrophobicContact CG-CD2 3.86Å; L550-L585 HydrophobicContact CD1-CD2 4.33Å
551	E	93.6	Very high	94.7	Very high	81 Å²	81	23.9 Å²	23.9	38%	0.379	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	135.4	178.1	-155.1	-171.9	145.8	0	0	110.8	L393 Y402 N547 S549 V553	L393-E551 HydrophobicContact CD1-CB 4.25Å; L393-E551 WeakPolarHBondContact CD1-OE2 3.31Å; Y402-E551 HydrophobicContact CE1-CB 4.42Å; Y402-E551 VanDerWaalsContact CE1-CD 3.49Å; Y402-E551 HydrophobicContact CE1-CG 4.03Å; Y402-E551 WeakPolarHBondContact CE1-OE1 3.48Å; Y402-E551 WeakPolarHBondContact CE2-O 3.31Å; Y402-E551 PolarHBondContact OH-OE1 3.3Å; N547-E551 PolarHBondContact ND2-N 2.95Å; N547-E551 PolarHBondContact ND2-O 3.01Å; N547-E551 PolarHBondContact OD1-N 3.15Å; S549-E551 PolarHBondContact O-N 3.28Å; E551-V553 VanDerWaalsContact C-N 3.35Å
552	G	93.2	Very high	94.4	Very high	19 Å²	19	25 Å²	25	20%	0.196	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	90.6	-13.7	-173.4	0	0	0	0	0	115.7	N485 L550	N485-G552 WeakPolarHBondContact CB-O 3.36Å; N485-G552 PolarHBondContact ND2-O 3.17Å; L550-G552 PolarHBondContact O-N 3.27Å
553	V	97.2	Very high	94.2	Very high	8 Å²	8	21.9 Å²	21.9	5%	0.048	13%	0.125	C	C	.	.			trans	-92	130	175.7	-175.4	0	0	0	0	109.1	P396 I487 L550 E551 H555 V556 L585	P396-V553 HydrophobicContact CB-CG2 3.67Å; P396-V553 HydrophobicContact CG-CG2 3.82Å; I487-V553 HydrophobicContact CD1-CG1 4.2Å; I487-V553 HydrophobicContact CD1-CG2 3.72Å; I487-V553 HydrophobicContact CG1-CG1 4.1Å; I487-V553 HydrophobicContact CG1-CG2 4.29Å; L550-V553 HydrophobicContact CB-CB 4.14Å; L550-V553 HydrophobicContact CB-CG2 4.12Å; L550-V553 WeakPolarHBondContact O-CB 3.21Å; L550-V553 PolarHBondContact O-N 2.84Å; E551-V553 VanDerWaalsContact C-N 3.35Å; V553-H555 VanDerWaalsContact CG1-O 3.26Å; V553-H555 WeakPolarHBondContact CG1-O 3.39Å; V553-V556 HydrophobicContact CG1-CG2 4.13Å; V553-L585 HydrophobicContact CB-CD1 4.1Å; V553-L585 HydrophobicContact CG1-CD1 3.88Å; V553-L585 VanDerWaalsContact O-CD1 3.3Å; V553-L585 WeakPolarHBondContact O-CD1 3.43Å
554	S	97.5	Very high	94.1	Very high	17 Å²	17	22.4 Å²	22.4	12%	0.119	13%	0.127	C	C	.	.			trans	-90.3	-38.2	177.8	61.6	0	0	0	0	112.4	R483 N485 R586	R483-S554 WeakPolarHBondContact O-CB 3.37Å; N485-S554 VanDerWaalsContact C-OG 3.31Å; N485-S554 PolarHBondContact N-OG 2.93Å; N485-S554 PolarHBondContact O-N 2.72Å; N485-S554 PolarHBondContact O-OG 2.84Å; S554-R586 PolarHBondContact O-N 2.81Å
555	H	98.6	Very high	94	Very high	3 Å²	3	23.5 Å²	23.5	1%	0.014	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	141	-175.8	-56.5	77	0	0	0	110.6	L471 Y475 N485 V486 I487 V553 R586	L471-H555 HydrophobicContact CD1-CB 4.48Å; Y475-H555 AromaticContact CE2-CE1 3.69Å; Y475-H555 AromaticContact CZ-CE1 3.67Å; Y475-H555 PolarHBondContact OH-CE1 2.96Å; N485-H555 PolarHBondContact O-N 3.3Å; V486-H555 WeakPolarHBondContact CA-O 3.15Å; V486-H555 HydrophobicContact CB-CB 4.42Å; V486-H555 HydrophobicContact CG1-CB 4Å; V486-H555 HydrophobicContact CG2-CB 4.1Å; I487-H555 PolarHBondContact N-O 3.02Å; V553-H555 VanDerWaalsContact CG1-O 3.26Å; V553-H555 WeakPolarHBondContact CG1-O 3.39Å; H555-R586 CarbonylContact C-O 3.6Å; H555-R586 VanDerWaalsContact CA-O 3.24Å; H555-R586 WeakPolarHBondContact CA-O 3.29Å; H555-R586 VanDerWaalsContact CD2-CB 3.47Å; H555-R586 WeakPolarHBondContact CD2-CB 3.37Å
556	V	98.7	Very high	94.1	Very high	0 Å²	0	21 Å²	21	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	127.5	163.3	174.9	0	0	0	0	107.9	I487 L540 L550 V553 V558 L575 L585 R586 L587 V588	I487-V556 CarbonylContact O-C 3.02Å; I487-V556 WeakPolarHBondContact O-CA 3.31Å; L540-V556 HydrophobicContact CD2-CG1 3.86Å; L550-V556 HydrophobicContact CD1-CG2 3.74Å; V553-V556 HydrophobicContact CG1-CG2 4.13Å; V556-V558 HydrophobicContact CG1-CG2 4.14Å; V556-L575 HydrophobicContact CG1-CD1 3.94Å; V556-L575 HydrophobicContact CG1-CD2 4.3Å; V556-L575 HydrophobicContact CG2-CD2 4.47Å; V556-L585 HydrophobicContact CG2-CD1 4.23Å; V556-L585 HydrophobicContact CG2-CD2 4.18Å; V556-R586 PolarHBondContact N-O 2.77Å; V556-L587 HydrophobicContact CB-CD1 4.21Å; V556-L587 HydrophobicContact CG1-CD1 4.14Å; V556-L587 WeakPolarHBondContact O-CA 3.44Å; V556-L587 WeakPolarHBondContact O-CD1 3.46Å; V556-V588 PolarHBondContact O-N 3.19Å
557	I	98.6	Very high	94.4	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	117.9	173.3	-53.5	-175.3	0	0	0	107.7	I467 P468 L471 V486 I487 I488 T489 V588 M590	I467-I557 HydrophobicContact CG2-CD1 4.22Å; P468-I557 HydrophobicContact CG-CD1 4.05Å; L471-I557 HydrophobicContact CD1-CD1 3.93Å; V486-I557 HydrophobicContact CG1-CD1 3.8Å; V486-I557 HydrophobicContact CG1-CG1 3.87Å; I487-I557 PolarHBondContact O-N 2.9Å; I488-I557 CarbonylContact C-O 3.52Å; I488-I557 WeakPolarHBondContact CA-O 3.4Å; I488-I557 HydrophobicContact CB-CB 4.38Å; I488-I557 HydrophobicContact CG1-CB 4.11Å; I488-I557 HydrophobicContact CG1-CD1 4Å; I488-I557 HydrophobicContact CG1-CG1 4.3Å; I488-I557 HydrophobicContact CG2-CB 4.13Å; I488-I557 HydrophobicContact CG2-CG2 4.22Å; T489-I557 PolarHBondContact N-O 2.98Å; T489-I557 PolarHBondContact OG1-O 3.05Å; I557-V588 CarbonylContact C-O 3.58Å; I557-V588 VanDerWaalsContact CA-O 3.32Å; I557-V588 WeakPolarHBondContact CA-O 3.28Å; I557-V588 HydrophobicContact CB-CB 4.46Å; I557-V588 HydrophobicContact CG1-CB 4.08Å; I557-V588 HydrophobicContact CG1-CG2 4.35Å; I557-V588 HydrophobicContact CG2-CB 4.3Å; I557-V588 HydrophobicContact CG2-CG1 4.5Å; I557-M590 HydrophobicContact CG2-CE 3.37Å; I557-M590 HydrophobicContact CG2-CG 3.93Å; I557-M590 HydrophobicContact CG2-SD 3.74Å
558	V	97.8	Very high	94.5	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	102	171.1	-170.3	0	0	0	0	107.7	T489 V556 V561 T568 L571 L572 L575 L587 V588 L589 M590	T489-V558 WeakPolarHBondContact OG1-CA 3.12Å; V556-V558 HydrophobicContact CG1-CG2 4.14Å; V558-V561 HydrophobicContact CB-CG1 4.01Å; V558-V561 HydrophobicContact CG1-CG1 3.6Å; V558-V561 WeakPolarHBondContact O-CG1 3.33Å; V558-T568 HydrophobicContact CG1-CG2 3.77Å; V558-L571 HydrophobicContact CG2-CD2 4.05Å; V558-L572 HydrophobicContact CG2-CD2 4.37Å; V558-L575 HydrophobicContact CG2-CD1 3.68Å; V558-L587 HydrophobicContact CG2-CD1 3.98Å; V558-V588 PolarHBondContact N-O 2.91Å; V558-L589 HydrophobicContact CB-CD2 3.84Å; V558-L589 HydrophobicContact CG2-CD2 4.07Å; V558-M590 PolarHBondContact O-N 3.13Å
559	D	95.4	Very high	94.6	Very high	2 Å²	2	17.9 Å²	17.9	1%	0.011	10%	0.098	C	C	.	.			trans	-83.5	158.3	178.5	-156.7	3.4	0	0	0	111.7	T464 T489 Q490 V561 M590	T464-D559 VanDerWaalsContact CB-OD2 3.23Å; T464-D559 WeakPolarHBondContact CB-OD2 3.49Å; T464-D559 WeakPolarHBondContact CG2-OD2 3.29Å; T464-D559 PolarHBondContact OG1-OD2 3.01Å; T489-D559 WeakPolarHBondContact O-CB 3.35Å; T489-D559 PolarHBondContact O-N 3.21Å; Q490-D559 VanDerWaalsContact NE2-CB 3.32Å; Q490-D559 PolarHBondContact NE2-OD2 3.22Å; D559-V561 VanDerWaalsContact C-N 3.29Å; D559-V561 PolarHBondContact O-N 2.95Å; D559-M590 HydrophobicContact CB-CE 3.64Å; D559-M590 WeakPolarHBondContact OD1-CB 3.37Å; D559-M590 VanDerWaalsContact OD1-CE 3.32Å; D559-M590 WeakPolarHBondContact OD1-CE 3.44Å; D559-M590 WeakPolarHBondContact OD2-CE 3.34Å
560	E	91.8	Very high	94.8	Very high	12 Å²	12	16.4 Å²	16.4	6%	0.056	9%	0.087	C	C	.	.			trans	56.3	35.8	174.4	-48.2	-75.8	-156.6	0	0	114.1	P491 H562 E563 M590 S737	P491-E560 HydrophobicContact CG-CB 4Å; P491-E560 HydrophobicContact CG-CG 4.36Å; E560-H562 PolarHBondContact O-N 2.9Å; E560-H562 IonicContact OE2-CE1 3.63Å; E560-H562 PolarHBondContact OE2-CE1 3.45Å; E560-H562 IonicContact OE2-ND1 3.65Å; E560-H562 IonicContact OE2-NE2 2.9Å; E560-E563 HydrophobicContact CB-CG 4.34Å; E560-E563 PolarHBondContact O-N 3.5Å; E560-M590 PolarHBondContact N-O 2.72Å; E560-S737 VanDerWaalsContact CD-OG 3.26Å; E560-S737 VanDerWaalsContact CG-OG 3.26Å; E560-S737 WeakPolarHBondContact CG-OG 3.43Å; E560-S737 WeakPolarHBondContact OE1-CA 3.46Å; E560-S737 WeakPolarHBondContact OE1-CB 3.3Å; E560-S737 PolarHBondContact OE1-N 2.8Å; E560-S737 PolarHBondContact OE1-OG 3.33Å
561	V	94	Very high	94.8	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	9%	0.087	C	C	.	.	G	3₁₀ helix	trans	-59.5	-16.2	-177.1	-64.7	0	0	0	0	114	V558 D559 E563 R564 T568 L589 M590 F599	V558-V561 HydrophobicContact CB-CG1 4.01Å; V558-V561 HydrophobicContact CG1-CG1 3.6Å; V558-V561 WeakPolarHBondContact O-CG1 3.33Å; D559-V561 VanDerWaalsContact C-N 3.29Å; D559-V561 PolarHBondContact O-N 2.95Å; V561-E563 VanDerWaalsContact C-N 3.29Å; V561-E563 PolarHBondContact O-N 2.9Å; V561-R564 VanDerWaalsContact O-CD 3.26Å; V561-R564 WeakPolarHBondContact O-CD 3.25Å; V561-R564 PolarHBondContact O-N 3.25Å; V561-T568 HydrophobicContact CG1-CG2 4.46Å; V561-L589 HydrophobicContact CG1-CB 4.32Å; V561-L589 HydrophobicContact CG1-CD2 4.3Å; V561-L589 HydrophobicContact CG2-CB 4.5Å; V561-M590 PolarHBondContact N-O 3.22Å; V561-F599 HydrophobicContact CB-CE1 4.3Å; V561-F599 HydrophobicContact CB-CE2 4.11Å; V561-F599 HydrophobicContact CB-CZ 3.84Å; V561-F599 HydrophobicContact CG2-CD2 3.99Å; V561-F599 HydrophobicContact CG2-CE1 4.48Å; V561-F599 HydrophobicContact CG2-CE2 3.59Å; V561-F599 HydrophobicContact CG2-CZ 3.86Å; V561-F599 WeakPolarHBondContact O-CZ 3.28Å
562	H	89.5	Confident	95	Very high	29 Å²	29	12.6 Å²	12.6	13%	0.134	7%	0.069	C	C	.	.	G	3₁₀ helix	trans	-75.3	-11.8	174.1	59.9	-86.9	0	0	0	114.7	E560 R564 S591 A592 T593 Q778	E560-H562 PolarHBondContact O-N 2.9Å; E560-H562 IonicContact OE2-CE1 3.63Å; E560-H562 PolarHBondContact OE2-CE1 3.45Å; E560-H562 IonicContact OE2-ND1 3.65Å; E560-H562 IonicContact OE2-NE2 2.9Å; H562-R564 PolarHBondContact O-N 3.05Å; H562-S591 WeakPolarHBondContact CB-OG 3.48Å; H562-S591 PolarHBondContact ND1-OG 3.28Å; H562-A592 PolarHBondContact CE1-N 3.46Å; H562-A592 PolarHBondContact ND1-N 2.93Å; H562-T593 VanDerWaalsContact CB-O 3.27Å; H562-T593 WeakPolarHBondContact CB-O 3.27Å; H562-T593 PolarHBondContact CD2-OG1 2.74Å; H562-Q778 PolarHBondContact CD2-NE2 2.87Å; H562-Q778 PolarHBondContact NE2-NE2 3.49Å
563	E	87.3	Confident	95.2	Very high	35 Å²	35	12.1 Å²	12.1	16%	0.164	6%	0.062	C	C	.	.	G	3₁₀ helix	trans	-65.7	-22.3	170.8	-75	-164.4	-135.3	0	0	111.8	P491 R492 E560 V561 D565 T736	P491-E563 WeakPolarHBondContact CG-OE1 3.45Å; R492-E563 IonicContact CZ-OE2 3.71Å; R492-E563 IonicContact NE-OE1 2.7Å; R492-E563 IonicContact NE-OE2 3.09Å; R492-E563 PolarHBondContact NE-OE2 3.44Å; R492-E563 IonicContact NH2-OE2 3.95Å; R492-E563 PolarHBondContact NH2-OE2 3.04Å; E560-E563 HydrophobicContact CB-CG 4.34Å; E560-E563 PolarHBondContact O-N 3.5Å; V561-E563 VanDerWaalsContact C-N 3.29Å; V561-E563 PolarHBondContact O-N 2.9Å; E563-D565 PolarHBondContact O-N 2.84Å; E563-T736 HydrophobicContact CG-CG2 3.83Å; E563-T736 WeakPolarHBondContact OE1-CB 3.28Å; E563-T736 PolarHBondContact OE1-OG1 3.42Å
564	R	91.9	Very high	95.2	Very high	28 Å²	28	12.1 Å²	12.1	11%	0.106	6%	0.062	C	C	.	.			trans	50.3	40.7	179.9	-58.1	-55.4	-56.9	-79.4	-4.4	112.8	V561 H562 D569 P809 E810 D841	V561-R564 VanDerWaalsContact O-CD 3.26Å; V561-R564 WeakPolarHBondContact O-CD 3.25Å; V561-R564 PolarHBondContact O-N 3.25Å; H562-R564 PolarHBondContact O-N 3.05Å; R564-D569 IonicContact CZ-OD1 3.01Å; R564-D569 IonicContact CZ-OD2 3.61Å; R564-D569 IonicContact NE-OD1 2.94Å; R564-D569 PolarHBondContact NE-OD1 3.16Å; R564-D569 VanDerWaalsContact NE-OD1 3.1Å; R564-D569 IonicContact NE-OD2 3.1Å; R564-D569 PolarHBondContact NE-OD2 2.81Å; R564-D569 IonicContact NH2-OD1 3.55Å; R564-D569 IonicContact NH2-OD2 3.69Å; R564-D569 PolarHBondContact NH2-OD2 2.81Å; R564-P809 HydrophobicContact CB-CB 4.01Å; R564-P809 HydrophobicContact CB-CG 4.37Å; R564-P809 HydrophobicContact CG-CG 4.45Å; R564-E810 WeakPolarHBondContact O-CB 3.38Å; R564-E810 PolarHBondContact O-N 3.07Å; R564-D841 IonicContact CZ-OD2 3.13Å; R564-D841 IonicContact NH1-OD2 3.26Å; R564-D841 PolarHBondContact NH1-OD2 3.26Å; R564-D841 IonicContact NH2-OD2 2.99Å; R564-D841 PolarHBondContact NH2-OD2 3.15Å
565	D	92.1	Very high	95.2	Very high	32 Å²	32	11.3 Å²	11.3	17%	0.171	6%	0.056	C	C	.	.			trans	-63.6	142.7	171.8	161.8	96.1	0	0	0	110.5	E563 N567 T568 D569 E810	E563-D565 PolarHBondContact O-N 2.84Å; D565-N567 VanDerWaalsContact C-N 3.33Å; D565-N567 PolarHBondContact O-N 2.84Å; D565-N567 WeakPolarHBondContact OD2-CA 3.49Å; D565-N567 WeakPolarHBondContact OD2-CB 3.41Å; D565-N567 PolarHBondContact OD2-N 3.38Å; D565-T568 WeakPolarHBondContact O-CB 3.37Å; D565-T568 PolarHBondContact O-N 3.49Å; D565-T568 VanDerWaalsContact O-N 3.09Å; D565-T568 PolarHBondContact OD2-N 3.08Å; D565-T568 PolarHBondContact OD2-OG1 3.03Å; D565-T568 VanDerWaalsContact OD2-OG1 3.09Å; D565-D569 PolarHBondContact O-N 2.92Å; D565-E810 WeakPolarHBondContact CA-OE2 3.42Å
566	V	93.6	Very high	95.1	Very high	15 Å²	15	15.2 Å²	15.2	9%	0.091	7%	0.073	C	C	.	.	H	α-helix	trans	-61.9	-38.7	-172.6	67.2	0	0	0	0	113.1	T568 F570 E810 I811 L819	V566-T568 VanDerWaalsContact C-N 3.32Å; V566-F570 WeakPolarHBondContact O-CB 3.33Å; V566-F570 PolarHBondContact O-N 2.89Å; V566-F570 VanDerWaalsContact O-N 3.08Å; V566-E810 HydrophobicContact CB-CB 4.08Å; V566-E810 HydrophobicContact CB-CG 3.92Å; V566-E810 HydrophobicContact CG1-CG 4.34Å; V566-E810 PolarHBondContact N-OE2 2.82Å; V566-I811 HydrophobicContact CG2-CB 4.1Å; V566-I811 HydrophobicContact CG2-CG1 4.3Å; V566-L819 HydrophobicContact CG1-CD1 4.46Å; V566-L819 HydrophobicContact CG2-CD1 3.48Å; V566-L819 VanDerWaalsContact CG2-CD1 3.48Å; V566-L819 HydrophobicContact CG2-CD2 3.34Å; V566-L819 HydrophobicContact CG2-CG 3.99Å
567	N	94.6	Very high	94.8	Very high	58 Å²	58	16.6 Å²	16.6	31%	0.31	9%	0.087	S	C	.	.	H	α-helix	trans	-73.3	-30.9	178.4	-64.2	-63.4	0	0	0	111.2	V537 L541 D565 F570 L571	V537-N567 HydrophobicContact CB-CB 4.26Å; V537-N567 HydrophobicContact CG1-CB 3.74Å; V537-N567 WeakPolarHBondContact CG1-O 3.26Å; L541-N567 HydrophobicContact CD1-CB 4.05Å; D565-N567 VanDerWaalsContact C-N 3.33Å; D565-N567 PolarHBondContact O-N 2.84Å; D565-N567 WeakPolarHBondContact OD2-CA 3.49Å; D565-N567 WeakPolarHBondContact OD2-CB 3.41Å; D565-N567 PolarHBondContact OD2-N 3.38Å; N567-F570 PolarHBondContact O-N 2.87Å; N567-L571 VanDerWaalsContact O-CB 3.29Å; N567-L571 WeakPolarHBondContact O-CB 3.4Å; N567-L571 PolarHBondContact O-N 2.97Å
568	T	95.8	Very high	94.7	Very high	4 Å²	4	16.8 Å²	16.8	3%	0.025	9%	0.088	C	C	.	.	H	α-helix	trans	-65.3	-50.1	176	-56.3	0	0	0	0	110.3	V558 V561 D565 V566 F570 L571 L572	V558-T568 HydrophobicContact CG1-CG2 3.77Å; V561-T568 HydrophobicContact CG1-CG2 4.46Å; D565-T568 WeakPolarHBondContact O-CB 3.37Å; D565-T568 PolarHBondContact O-N 3.49Å; D565-T568 VanDerWaalsContact O-N 3.09Å; D565-T568 PolarHBondContact OD2-N 3.08Å; D565-T568 PolarHBondContact OD2-OG1 3.03Å; D565-T568 VanDerWaalsContact OD2-OG1 3.09Å; V566-T568 VanDerWaalsContact C-N 3.32Å; T568-F570 VanDerWaalsContact C-N 3.3Å; T568-F570 PolarHBondContact O-N 3.02Å; T568-L571 WeakPolarHBondContact O-CB 3.36Å; T568-L571 PolarHBondContact O-N 2.98Å; T568-L571 VanDerWaalsContact O-N 3.16Å; T568-L572 WeakPolarHBondContact O-CG 2.99Å; T568-L572 PolarHBondContact O-N 2.87Å
569	D	95.5	Very high	94.5	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-60.8	-40.2	176.3	-83.2	11.5	0	0	0	111.4	R564 D565 L572 I573 I811	R564-D569 IonicContact CZ-OD1 3.01Å; R564-D569 IonicContact CZ-OD2 3.61Å; R564-D569 IonicContact NE-OD1 2.94Å; R564-D569 PolarHBondContact NE-OD1 3.16Å; R564-D569 VanDerWaalsContact NE-OD1 3.1Å; R564-D569 IonicContact NE-OD2 3.1Å; R564-D569 PolarHBondContact NE-OD2 2.81Å; R564-D569 IonicContact NH2-OD1 3.55Å; R564-D569 IonicContact NH2-OD2 3.69Å; R564-D569 PolarHBondContact NH2-OD2 2.81Å; D565-D569 PolarHBondContact O-N 2.92Å; D569-L572 PolarHBondContact O-N 3.09Å; D569-I573 PolarHBondContact O-N 3.16Å; D569-I811 HydrophobicContact CB-CD1 4.46Å
570	F	97.1	Very high	94.3	Very high	2 Å²	2	28.9 Å²	28.9	1%	0.009	14%	0.135	C	C	.	.	H	α-helix	trans	-61.3	-45.1	173.5	-172.8	-84.3	0	0	0	112.4	L541 V566 N567 T568 L572 I573 L574 L819 Q822 A823 H826 F835 L836	L541-F570 HydrophobicContact CD1-CD1 4.15Å; L541-F570 HydrophobicContact CD2-CD1 3.69Å; L541-F570 HydrophobicContact CD2-CE1 4.08Å; V566-F570 WeakPolarHBondContact O-CB 3.33Å; V566-F570 PolarHBondContact O-N 2.89Å; V566-F570 VanDerWaalsContact O-N 3.08Å; N567-F570 PolarHBondContact O-N 2.87Å; T568-F570 VanDerWaalsContact C-N 3.3Å; T568-F570 PolarHBondContact O-N 3.02Å; F570-L572 VanDerWaalsContact C-N 3.3Å; F570-L572 PolarHBondContact O-N 3.05Å; F570-I573 WeakPolarHBondContact O-CB 3.43Å; F570-I573 PolarHBondContact O-N 2.95Å; F570-L574 HydrophobicContact CD1-CD1 4.17Å; F570-L574 HydrophobicContact CD1-CG 4.44Å; F570-L574 HydrophobicContact CE1-CD1 3.71Å; F570-L574 HydrophobicContact CE1-CG 4.11Å; F570-L574 PolarHBondContact O-N 3.13Å; F570-L819 HydrophobicContact CD2-CD2 4.4Å; F570-L819 HydrophobicContact CD2-CG 4.03Å; F570-L819 WeakPolarHBondContact CE2-O 3.44Å; F570-Q822 HydrophobicContact CE1-CB 4.03Å; F570-Q822 HydrophobicContact CE2-CB 3.94Å; F570-Q822 HydrophobicContact CZ-CB 3.54Å; F570-A823 HydrophobicContact CE2-CB 4.06Å; F570-A823 HydrophobicContact CZ-CB 4.41Å; F570-H826 AromaticContact CE1-CD2 3.9Å; F570-F835 AromaticContact CD2-CE1 3.77Å; F570-F835 HydrophobicContact CD2-CE1 3.77Å; F570-F835 HydrophobicContact CD2-CZ 4.48Å; F570-F835 HydrophobicContact CE1-CE1 4.49Å; F570-F835 HydrophobicContact CE1-CZ 4.37Å; F570-F835 HydrophobicContact CE2-CD1 4.13Å; F570-F835 AromaticContact CE2-CE1 3.29Å; F570-F835 HydrophobicContact CE2-CE1 3.29Å; F570-F835 AromaticContact CE2-CZ 3.93Å; F570-F835 HydrophobicContact CE2-CZ 3.93Å; F570-F835 AromaticContact CZ-CE1 3.69Å; F570-F835 HydrophobicContact CZ-CE1 3.69Å; F570-F835 AromaticContact CZ-CZ 3.83Å; F570-F835 HydrophobicContact CZ-CZ 3.83Å; F570-L836 HydrophobicContact CD2-CD2 4.39Å
571	L	97.8	Very high	94.4	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-59.5	-39.9	175.4	174.8	65.5	0	0	0	111.4	T489 V537 L540 L541 L544 V558 N567 T568 I573 L574 L575	T489-L571 HydrophobicContact CG2-CD2 4.04Å; V537-L571 HydrophobicContact CG1-CB 4.02Å; V537-L571 HydrophobicContact CG1-CD2 3.94Å; L540-L571 HydrophobicContact CD2-CD1 3.88Å; L540-L571 HydrophobicContact CD2-CD2 3.89Å; L540-L571 HydrophobicContact CG-CD1 4.06Å; L541-L571 HydrophobicContact CD2-CB 3.98Å; L541-L571 HydrophobicContact CD2-CD1 3.97Å; L544-L571 HydrophobicContact CD1-CD1 3.64Å; V558-L571 HydrophobicContact CG2-CD2 4.05Å; N567-L571 VanDerWaalsContact O-CB 3.29Å; N567-L571 WeakPolarHBondContact O-CB 3.4Å; N567-L571 PolarHBondContact O-N 2.97Å; T568-L571 WeakPolarHBondContact O-CB 3.36Å; T568-L571 PolarHBondContact O-N 2.98Å; T568-L571 VanDerWaalsContact O-N 3.16Å; L571-I573 VanDerWaalsContact C-N 3.28Å; L571-I573 PolarHBondContact O-N 2.9Å; L571-L574 PolarHBondContact O-N 2.95Å; L571-L574 VanDerWaalsContact O-N 3.15Å; L571-L575 HydrophobicContact CD1-CD1 3.92Å; L571-L575 HydrophobicContact CD1-CD2 4.27Å; L571-L575 HydrophobicContact CD1-CG 3.81Å; L571-L575 HydrophobicContact CD2-CD1 4.06Å; L571-L575 HydrophobicContact CG-CD1 3.65Å; L571-L575 HydrophobicContact CG-CG 4Å; L571-L575 WeakPolarHBondContact O-CB 3.41Å; L571-L575 WeakPolarHBondContact O-CG 3.27Å; L571-L575 PolarHBondContact O-N 3.07Å
572	L	97.7	Very high	94.4	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-63.7	-31.7	178.1	-65.8	-179.7	0	0	0	112.8	V558 T568 D569 F570 K576 L589 F599 Y602 F603 V840	V558-L572 HydrophobicContact CG2-CD2 4.37Å; T568-L572 WeakPolarHBondContact O-CG 2.99Å; T568-L572 PolarHBondContact O-N 2.87Å; D569-L572 PolarHBondContact O-N 3.09Å; F570-L572 VanDerWaalsContact C-N 3.3Å; F570-L572 PolarHBondContact O-N 3.05Å; L572-K576 VanDerWaalsContact O-CB 3.29Å; L572-K576 WeakPolarHBondContact O-CB 3.47Å; L572-K576 PolarHBondContact O-N 3.35Å; L572-L589 HydrophobicContact CD2-CD2 3.63Å; L572-F599 HydrophobicContact CD1-CD1 4.2Å; L572-F599 HydrophobicContact CD1-CE1 3.82Å; L572-Y602 HydrophobicContact CB-CE1 4.38Å; L572-F603 HydrophobicContact CB-CZ 4.38Å; L572-F603 HydrophobicContact CD2-CE2 4.19Å; L572-F603 HydrophobicContact CD2-CZ 4.12Å; L572-V840 HydrophobicContact CD1-CG2 4.03Å
573	I	97	Very high	94.7	Very high	10 Å²	10	38 Å²	38	5%	0.051	19%	0.189	C	C	.	.	H	α-helix	trans	-62	-50.7	171.5	-61.6	164.6	0	0	0	109.8	D569 F570 L571 K576 G577 F835 K838 A839	D569-I573 PolarHBondContact O-N 3.16Å; F570-I573 WeakPolarHBondContact O-CB 3.43Å; F570-I573 PolarHBondContact O-N 2.95Å; L571-I573 VanDerWaalsContact C-N 3.28Å; L571-I573 PolarHBondContact O-N 2.9Å; I573-K576 PolarHBondContact O-N 3.1Å; I573-G577 PolarHBondContact O-N 2.62Å; I573-F835 HydrophobicContact CB-CE1 4.23Å; I573-F835 HydrophobicContact CB-CZ 3.97Å; I573-F835 HydrophobicContact CD1-CD1 4.29Å; I573-F835 HydrophobicContact CD1-CE1 3.81Å; I573-F835 HydrophobicContact CD1-CZ 4.41Å; I573-F835 HydrophobicContact CG2-CD1 4.42Å; I573-F835 HydrophobicContact CG2-CD2 4.22Å; I573-F835 HydrophobicContact CG2-CE1 3.88Å; I573-F835 HydrophobicContact CG2-CE2 3.66Å; I573-F835 HydrophobicContact CG2-CZ 3.47Å; I573-F835 VanDerWaalsContact CG2-CZ 3.47Å; I573-K838 HydrophobicContact CG2-CB 4.03Å; I573-A839 HydrophobicContact CD1-CB 3.95Å; I573-A839 HydrophobicContact CG1-CB 4.4Å
574	L	97.1	Very high	95.1	Very high	8 Å²	8	39.9 Å²	39.9	4%	0.042	21%	0.211	C	C	.	.	H	α-helix	trans	-62.5	-47.2	-179.1	-65.8	-177.1	0	0	0	111.7	L541 L544 F570 L571 K576 G577 L578 H826 M827 F835	L541-L574 HydrophobicContact CD2-CD1 3.78Å; L544-L574 HydrophobicContact CD1-CB 4.29Å; L544-L574 HydrophobicContact CD1-CD1 3.92Å; F570-L574 HydrophobicContact CD1-CD1 4.17Å; F570-L574 HydrophobicContact CD1-CG 4.44Å; F570-L574 HydrophobicContact CE1-CD1 3.71Å; F570-L574 HydrophobicContact CE1-CG 4.11Å; F570-L574 PolarHBondContact O-N 3.13Å; L571-L574 PolarHBondContact O-N 2.95Å; L571-L574 VanDerWaalsContact O-N 3.15Å; L574-K576 VanDerWaalsContact C-N 3.29Å; L574-K576 PolarHBondContact O-N 2.87Å; L574-G577 PolarHBondContact O-N 2.95Å; L574-G577 VanDerWaalsContact O-N 3.11Å; L574-L578 WeakPolarHBondContact O-CB 3.24Å; L574-L578 PolarHBondContact O-N 2.95Å; L574-H826 HydrophobicContact CD1-CB 4.39Å; L574-H826 HydrophobicContact CD2-CB 3.86Å; L574-M827 HydrophobicContact CD2-CE 4.18Å; L574-F835 HydrophobicContact CD2-CE2 3.7Å; L574-F835 HydrophobicContact CD2-CZ 3.62Å; L574-F835 HydrophobicContact CG-CZ 4.17Å
575	L	97.5	Very high	95.3	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-63.9	-34.2	-179.6	-68.7	176.7	0	0	0	112.3	L550 V556 V558 L571 L578 Q579 L587	L550-L575 HydrophobicContact CD1-CD2 4.44Å; V556-L575 HydrophobicContact CG1-CD1 3.94Å; V556-L575 HydrophobicContact CG1-CD2 4.3Å; V556-L575 HydrophobicContact CG2-CD2 4.47Å; V558-L575 HydrophobicContact CG2-CD1 3.68Å; L571-L575 HydrophobicContact CD1-CD1 3.92Å; L571-L575 HydrophobicContact CD1-CD2 4.27Å; L571-L575 HydrophobicContact CD1-CG 3.81Å; L571-L575 HydrophobicContact CD2-CD1 4.06Å; L571-L575 HydrophobicContact CG-CD1 3.65Å; L571-L575 HydrophobicContact CG-CG 4Å; L571-L575 WeakPolarHBondContact O-CB 3.41Å; L571-L575 WeakPolarHBondContact O-CG 3.27Å; L571-L575 PolarHBondContact O-N 3.07Å; L575-L578 HydrophobicContact CD2-CD2 3.88Å; L575-L578 WeakPolarHBondContact O-CB 3.37Å; L575-L578 PolarHBondContact O-N 2.84Å; L575-Q579 WeakPolarHBondContact O-CG 3.29Å; L575-Q579 PolarHBondContact O-N 2.77Å; L575-L587 HydrophobicContact CB-CD2 4.08Å; L575-L587 HydrophobicContact CD1-CD1 3.73Å; L575-L587 HydrophobicContact CD1-CD2 4.4Å
576	K	96.1	Very high	95.6	Very high	85 Å²	85	39.9 Å²	39.9	37%	0.37	21%	0.209	S	C	.	.	H	α-helix	trans	-64.5	-41	173.1	-175.8	170.9	175	174.7	0	112	L572 I573 L574 Y602 F603	L572-K576 VanDerWaalsContact O-CB 3.29Å; L572-K576 WeakPolarHBondContact O-CB 3.47Å; L572-K576 PolarHBondContact O-N 3.35Å; I573-K576 PolarHBondContact O-N 3.1Å; L574-K576 VanDerWaalsContact C-N 3.29Å; L574-K576 PolarHBondContact O-N 2.87Å; K576-Y602 HydrophobicContact CB-CE1 4.45Å; K576-Y602 HydrophobicContact CD-CD1 4.35Å; K576-Y602 HydrophobicContact CD-CE1 3.67Å; K576-Y602 HydrophobicContact CD-CE2 4.08Å; K576-Y602 WeakPolarHBondContact CD-OH 3.33Å; K576-Y602 VanDerWaalsContact CE-O 3.31Å; K576-Y602 WeakPolarHBondContact CE-O 3.25Å; K576-Y602 PolarHBondContact NZ-O 2.86Å; K576-F603 HydrophobicContact CB-CD1 4.34Å; K576-F603 HydrophobicContact CB-CE1 3.66Å; K576-F603 HydrophobicContact CB-CZ 4.32Å; K576-F603 HydrophobicContact CG-CD1 4.32Å; K576-F603 HydrophobicContact CG-CE1 4.13Å
577	G	93.1	Very high	95.9	Very high	29 Å²	29	39.2 Å²	39.2	30%	0.299	21%	0.205	S	C	.	.	H	α-helix	trans	-65.8	-39.9	172.4	0	0	0	0	0	112.5	I573 L574 Q579 R580	I573-G577 PolarHBondContact O-N 2.62Å; L574-G577 PolarHBondContact O-N 2.95Å; L574-G577 VanDerWaalsContact O-N 3.11Å; G577-Q579 VanDerWaalsContact C-N 3.26Å; G577-Q579 PolarHBondContact O-N 3.18Å; G577-R580 PolarHBondContact O-N 3.28Å; G577-R580 VanDerWaalsContact O-N 3.11Å
578	L	95.1	Very high	96	Very high	4 Å²	4	36.5 Å²	36.5	2%	0.021	19%	0.19	C	C	.	.	H	α-helix	trans	-60.9	-30.3	-178.1	-174.2	56.3	0	0	0	113.5	L544 P548 L550 L574 L575 R580 L581 N582 L585	L544-L578 HydrophobicContact CD2-CD2 4.07Å; P548-L578 WeakPolarHBondContact O-CD1 3.41Å; L550-L578 HydrophobicContact CB-CD2 4.25Å; L550-L578 HydrophobicContact CD1-CD2 3.64Å; L550-L578 HydrophobicContact CG-CD2 3.86Å; L574-L578 WeakPolarHBondContact O-CB 3.24Å; L574-L578 PolarHBondContact O-N 2.95Å; L575-L578 HydrophobicContact CD2-CD2 3.88Å; L575-L578 WeakPolarHBondContact O-CB 3.37Å; L575-L578 PolarHBondContact O-N 2.84Å; L578-R580 PolarHBondContact O-N 3.09Å; L578-L581 HydrophobicContact CD1-CB 4.11Å; L578-L581 HydrophobicContact CD1-CD1 4.49Å; L578-L581 PolarHBondContact O-N 2.91Å; L578-N582 HydrophobicContact CD1-CB 4.33Å; L578-N582 PolarHBondContact O-N 3.09Å; L578-L585 HydrophobicContact CD2-CD2 3.51Å; L578-L585 HydrophobicContact CG-CD2 4.03Å
579	Q	94.1	Very high	96.1	Very high	31 Å²	31	36.3 Å²	36.3	15%	0.145	19%	0.189	C	C	.	.	H	α-helix	trans	-55.3	-24.8	175.3	-66.9	-58.8	-57.4	0	0	113.3	P451 V452 L575 G577	P451-Q579 VanDerWaalsContact CB-OE1 3.22Å; V452-Q579 HydrophobicContact CG2-CG 4.41Å; L575-Q579 WeakPolarHBondContact O-CG 3.29Å; L575-Q579 PolarHBondContact O-N 2.77Å; G577-Q579 VanDerWaalsContact C-N 3.26Å; G577-Q579 PolarHBondContact O-N 3.18Å
580	R	92.1	Very high	96.1	Very high	225 Å²	225	36.3 Å²	36.3	85%	0.849	19%	0.189	S	C	*	.	H	α-helix	trans	-84	-33.4	175.4	-59.4	179.1	-176.6	177.6	-1.5	112.8	G577 L578	G577-R580 PolarHBondContact O-N 3.28Å; G577-R580 VanDerWaalsContact O-N 3.11Å; L578-R580 PolarHBondContact O-N 3.09Å
581	L	92.5	Very high	95.9	Very high	115 Å²	115	36.2 Å²	36.2	60%	0.602	19%	0.189	S	C	*	.	H	α-helix	trans	-81.6	-32.9	-179.2	-65.3	175.1	0	0	0	112.1	L578	L578-L581 HydrophobicContact CD1-CB 4.11Å; L578-L581 HydrophobicContact CD1-CD1 4.49Å; L578-L581 PolarHBondContact O-N 2.91Å
582	N	95.8	Very high	95.2	Very high	27 Å²	27	36.4 Å²	36.4	14%	0.144	19%	0.19	C	C	.	.			trans	-135.6	83.2	177.4	-174.7	-5.5	0	0	0	110.3	S549 L578 A584 L585	S549-N582 WeakPolarHBondContact O-CB 3.33Å; S549-N582 PolarHBondContact O-ND2 3.37Å; L578-N582 HydrophobicContact CD1-CB 4.33Å; L578-N582 PolarHBondContact O-N 3.09Å; N582-A584 PolarHBondContact O-N 2.91Å; N582-A584 PolarHBondContact OD1-N 2.82Å; N582-L585 HydrophobicContact CB-CB 4.31Å; N582-L585 WeakPolarHBondContact O-CB 3.5Å; N582-L585 PolarHBondContact O-N 3.47Å; N582-L585 PolarHBondContact OD1-N 2.71Å
583	P	95	Very high	94	Very high	89 Å²	89	37.4 Å²	37.4	58%	0.578	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67	-15.7	-179.8	-21.1	33.7	0	0	0	114.5	R586	P583-R586 PolarHBondContact O-NH1 3.18Å
584	A	94.8	Very high	92.9	Very high	75 Å²	75	38 Å²	38	62%	0.62	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-23	177.2	0	0	0	0	0	112.2	N582 R586	N582-A584 PolarHBondContact O-N 2.91Å; N582-A584 PolarHBondContact OD1-N 2.82Å; A584-R586 PolarHBondContact O-N 3.35Å
585	L	97.5	Very high	92.1	Very high	1 Å²	1	39.8 Å²	39.8	1%	0.005	22%	0.215	C	C	.	.			trans	-65.9	130.5	179.4	-171.2	73	0	0	0	110.8	L550 V553 V556 L578 N582	L550-L585 HydrophobicContact CD1-CD2 4.33Å; V553-L585 HydrophobicContact CB-CD1 4.1Å; V553-L585 HydrophobicContact CG1-CD1 3.88Å; V553-L585 VanDerWaalsContact O-CD1 3.3Å; V553-L585 WeakPolarHBondContact O-CD1 3.43Å; V556-L585 HydrophobicContact CG2-CD1 4.23Å; V556-L585 HydrophobicContact CG2-CD2 4.18Å; L578-L585 HydrophobicContact CD2-CD2 3.51Å; L578-L585 HydrophobicContact CG-CD2 4.03Å; N582-L585 HydrophobicContact CB-CB 4.31Å; N582-L585 WeakPolarHBondContact O-CB 3.5Å; N582-L585 PolarHBondContact O-N 3.47Å; N582-L585 PolarHBondContact OD1-N 2.71Å
586	R	98.3	Very high	91.8	Very high	59 Å²	59	40.6 Å²	40.6	22%	0.223	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	130.2	173.9	-62	-59.2	-176.8	-113.6	3.7	111.4	I447 E448 H450 S554 H555 V556 P583 A584	I447-R586 HydrophobicContact CG2-CB 4.08Å; I447-R586 HydrophobicContact CG2-CG 4.42Å; I447-R586 WeakPolarHBondContact O-CD 3.36Å; I447-R586 PolarHBondContact O-NE 3.12Å; E448-R586 PolarHBondContact O-NE 2.98Å; E448-R586 PolarHBondContact O-NH2 3.4Å; H450-R586 WeakPolarHBondContact O-CD 3.46Å; S554-R586 PolarHBondContact O-N 2.81Å; H555-R586 CarbonylContact C-O 3.6Å; H555-R586 VanDerWaalsContact CA-O 3.24Å; H555-R586 WeakPolarHBondContact CA-O 3.29Å; H555-R586 VanDerWaalsContact CD2-CB 3.47Å; H555-R586 WeakPolarHBondContact CD2-CB 3.37Å; V556-R586 PolarHBondContact N-O 2.77Å; P583-R586 PolarHBondContact O-NH1 3.18Å; A584-R586 PolarHBondContact O-N 3.35Å
587	L	98.5	Very high	91.6	Very high	2 Å²	2	40.9 Å²	40.9	1%	0.01	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	125.9	179	178.1	58.4	0	0	0	110.8	P451 V452 V453 V556 V558 L575 L589 F603	P451-L587 PolarHBondContact O-N 3.14Å; V452-L587 CarbonylContact C-O 3.55Å; V452-L587 VanDerWaalsContact CA-O 3.27Å; V452-L587 WeakPolarHBondContact CA-O 3.47Å; V452-L587 HydrophobicContact CB-CB 4.46Å; V452-L587 HydrophobicContact CG1-CB 4.2Å; V452-L587 HydrophobicContact CG1-CD2 4.03Å; V452-L587 HydrophobicContact CG1-CG 4.08Å; V452-L587 HydrophobicContact CG2-CB 4.15Å; V452-L587 HydrophobicContact CG2-CD2 4.24Å; V453-L587 PolarHBondContact N-O 3.05Å; V556-L587 HydrophobicContact CB-CD1 4.21Å; V556-L587 HydrophobicContact CG1-CD1 4.14Å; V556-L587 WeakPolarHBondContact O-CA 3.44Å; V556-L587 WeakPolarHBondContact O-CD1 3.46Å; V558-L587 HydrophobicContact CG2-CD1 3.98Å; L575-L587 HydrophobicContact CB-CD2 4.08Å; L575-L587 HydrophobicContact CD1-CD1 3.73Å; L575-L587 HydrophobicContact CD1-CD2 4.4Å; L587-L589 HydrophobicContact CD1-CD2 3.92Å; L587-L589 HydrophobicContact CD2-CD2 4.15Å; L587-L589 HydrophobicContact CG-CD2 3.95Å; L587-L589 HydrophobicContact CG-CG 4.42Å; L587-F603 HydrophobicContact CD2-CD1 4.44Å; L587-F603 HydrophobicContact CD2-CE1 3.7Å; L587-F603 HydrophobicContact CD2-CE2 4.45Å; L587-F603 HydrophobicContact CD2-CZ 3.72Å
588	V	98.5	Very high	91.6	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	122.2	174.8	-172.9	0	0	0	0	109	I447 V453 I455 V556 I557 V558 M590	I447-V588 HydrophobicContact CD1-CG2 3.77Å; I447-V588 HydrophobicContact CG1-CG2 3.91Å; I447-V588 HydrophobicContact CG2-CG2 4.18Å; V453-V588 WeakPolarHBondContact O-CA 3.43Å; I455-V588 HydrophobicContact CD1-CG1 3.6Å; I455-V588 HydrophobicContact CG1-CG1 4.09Å; V556-V588 PolarHBondContact O-N 3.19Å; I557-V588 CarbonylContact C-O 3.58Å; I557-V588 VanDerWaalsContact CA-O 3.32Å; I557-V588 WeakPolarHBondContact CA-O 3.28Å; I557-V588 HydrophobicContact CB-CB 4.46Å; I557-V588 HydrophobicContact CG1-CB 4.08Å; I557-V588 HydrophobicContact CG1-CG2 4.35Å; I557-V588 HydrophobicContact CG2-CB 4.3Å; I557-V588 HydrophobicContact CG2-CG1 4.5Å; V558-V588 PolarHBondContact N-O 2.91Å; V588-M590 HydrophobicContact CG1-CG 4Å
589	L	97.9	Very high	91.6	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	119	173.8	-53.7	-177.9	0	0	0	108.3	V452 V453 V454 I455 V558 V561 L572 L587 F599 F603	V452-L589 HydrophobicContact CG1-CD1 4.47Å; V453-L589 PolarHBondContact O-N 2.73Å; V454-L589 CarbonylContact C-O 3.53Å; V454-L589 WeakPolarHBondContact CA-O 3.41Å; V454-L589 HydrophobicContact CG2-CB 4.32Å; V454-L589 HydrophobicContact CG2-CD1 4.25Å; I455-L589 PolarHBondContact N-O 3.41Å; V558-L589 HydrophobicContact CB-CD2 3.84Å; V558-L589 HydrophobicContact CG2-CD2 4.07Å; V561-L589 HydrophobicContact CG1-CB 4.32Å; V561-L589 HydrophobicContact CG1-CD2 4.3Å; V561-L589 HydrophobicContact CG2-CB 4.5Å; L572-L589 HydrophobicContact CD2-CD2 3.63Å; L587-L589 HydrophobicContact CD1-CD2 3.92Å; L587-L589 HydrophobicContact CD2-CD2 4.15Å; L587-L589 HydrophobicContact CG-CD2 3.95Å; L587-L589 HydrophobicContact CG-CG 4.42Å; L589-F599 HydrophobicContact CD1-CB 4.16Å; L589-F599 HydrophobicContact CD1-CD1 4.49Å; L589-F603 HydrophobicContact CD1-CD2 3.7Å; L589-F603 HydrophobicContact CD1-CE2 3.5Å; L589-F603 VanDerWaalsContact CD1-CE2 3.5Å; L589-F603 HydrophobicContact CD1-CZ 4.46Å
590	M	95.5	Very high	91.7	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	131.2	-180	-57.7	-171.2	-52.9	0	0	110.3	I455 K463 I467 I557 V558 D559 E560 V561 V588	I455-M590 WeakPolarHBondContact O-CA 3.47Å; K463-M590 HydrophobicContact CB-SD 4.03Å; I467-M590 HydrophobicContact CB-SD 4.16Å; I467-M590 HydrophobicContact CD1-CG 4.41Å; I467-M590 HydrophobicContact CD1-SD 3.51Å; I467-M590 VanDerWaalsContact CD1-SD 3.51Å; I467-M590 HydrophobicContact CG1-SD 4.42Å; I467-M590 HydrophobicContact CG2-SD 4.33Å; I557-M590 HydrophobicContact CG2-CE 3.37Å; I557-M590 HydrophobicContact CG2-CG 3.93Å; I557-M590 HydrophobicContact CG2-SD 3.74Å; V558-M590 PolarHBondContact O-N 3.13Å; D559-M590 HydrophobicContact CB-CE 3.64Å; D559-M590 WeakPolarHBondContact OD1-CB 3.37Å; D559-M590 VanDerWaalsContact OD1-CE 3.32Å; D559-M590 WeakPolarHBondContact OD1-CE 3.44Å; D559-M590 WeakPolarHBondContact OD2-CE 3.34Å; E560-M590 PolarHBondContact N-O 2.72Å; V561-M590 PolarHBondContact N-O 3.22Å; V588-M590 HydrophobicContact CG1-CG 4Å
591	S	91.4	Very high	91.9	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	142.7	179.7	-159.7	0	0	0	0	112.6	I455 S456 G457 K463 H562 T593 N596	I455-S591 PolarHBondContact O-N 3.44Å; S456-S591 WeakPolarHBondContact CA-O 3.13Å; G457-S591 PolarHBondContact N-O 3.46Å; K463-S591 WeakPolarHBondContact CE-O 3.12Å; H562-S591 WeakPolarHBondContact CB-OG 3.48Å; H562-S591 PolarHBondContact ND1-OG 3.28Å; S591-T593 PolarHBondContact OG-O 2.99Å; S591-N596 VanDerWaalsContact CB-OD1 3.24Å; S591-N596 WeakPolarHBondContact CB-OD1 3.37Å
592	A	83	Confident	92.1	Very high	4 Å²	4	35.3 Å²	35.3	3%	0.033	18%	0.184	C	C	.	.	S	Bend	trans	-97.4	-30.7	174.3	0	0	0	0	0	113.9	G457 T459 H562	G457-A592 WeakPolarHBondContact O-CA 3.35Å; T459-A592 HydrophobicContact CG2-CB 4.08Å; H562-A592 PolarHBondContact CE1-N 3.46Å; H562-A592 PolarHBondContact ND1-N 2.93Å
593	T	73.9	Confident	92.1	Very high	21 Å²	21	35.3 Å²	35.3	13%	0.129	18%	0.183	C	C	.	.	S	Bend	trans	-138.5	-177.4	176.6	50.3	0	0	0	0	108.9	H562 S591 I777 Q778	H562-T593 VanDerWaalsContact CB-O 3.27Å; H562-T593 WeakPolarHBondContact CB-O 3.27Å; H562-T593 PolarHBondContact CD2-OG1 2.74Å; S591-T593 PolarHBondContact OG-O 2.99Å; T593-I777 HydrophobicContact CG2-CG2 4.14Å; T593-Q778 HydrophobicContact CG2-CG 4.05Å; T593-Q778 PolarHBondContact OG1-NE2 2.74Å
594	G	72.7	Confident	92.1	Very high	23 Å²	23	34.6 Å²	34.6	24%	0.237	19%	0.192	C	C	.	.	S	Bend	trans	100.2	173.8	173.1	0	0	0	0	0	116.2	N596	G594-N596 VanDerWaalsContact C-N 3.34Å; G594-N596 PolarHBondContact O-N 2.98Å; G594-N596 PolarHBondContact O-ND2 3.36Å
595	D	81.8	Confident	92.1	Very high	45 Å²	45	33.6 Å²	33.6	24%	0.241	19%	0.188	C	C	.	.			trans	-79.4	74.7	179.1	-174.6	-0.8	0	0	0	110.4	E597 R598 R601 F806	D595-E597 PolarHBondContact O-N 3.17Å; D595-R598 HydrophobicContact CB-CB 4.05Å; D595-R598 VanDerWaalsContact CG-CB 3.49Å; D595-R598 WeakPolarHBondContact O-CB 3.26Å; D595-R598 PolarHBondContact O-N 3.11Å; D595-R598 PolarHBondContact OD1-N 2.91Å; D595-R598 VanDerWaalsContact OD1-N 3.12Å; D595-R598 WeakPolarHBondContact OD2-CB 3.49Å; D595-R598 IonicContact OD2-CZ 3.89Å; D595-R598 IonicContact OD2-NE 3.49Å; D595-R598 PolarHBondContact OD2-NE 2.89Å; D595-R598 IonicContact OD2-NH2 2.62Å; D595-R598 PolarHBondContact OD2-NH2 2.96Å; D595-R601 IonicContact OD2-NH2 2.77Å; D595-F806 HydrophobicContact CB-CE2 4.29Å
596	N	90.3	Very high	92	Very high	18 Å²	18	34.1 Å²	34.1	10%	0.096	19%	0.192	C	C	.	.	H	α-helix	trans	-59.3	-30	-179.2	-60.5	-57.2	0	0	0	112.9	V454 S456 S591 G594 R598 F599 S600 V608	V454-N596 HydrophobicContact CG1-CB 4.11Å; S456-N596 WeakPolarHBondContact CB-ND2 3.42Å; S456-N596 PolarHBondContact OG-ND2 3.17Å; S591-N596 VanDerWaalsContact CB-OD1 3.24Å; S591-N596 WeakPolarHBondContact CB-OD1 3.37Å; G594-N596 VanDerWaalsContact C-N 3.34Å; G594-N596 PolarHBondContact O-N 2.98Å; G594-N596 PolarHBondContact O-ND2 3.36Å; N596-R598 PolarHBondContact O-N 3.39Å; N596-F599 PolarHBondContact O-N 3.46Å; N596-S600 PolarHBondContact O-N 3.24Å; N596-V608 HydrophobicContact CB-CG1 4.01Å
597	E	92.2	Very high	92	Very high	90 Å²	90	33.1 Å²	33.1	42%	0.421	19%	0.193	S	C	.	.	H	α-helix	trans	-65.3	-28.8	174.7	-61.3	-56.6	151.7	0	0	111.9	D595 R601	D595-E597 PolarHBondContact O-N 3.17Å; E597-R601 WeakPolarHBondContact O-CB 3.34Å; E597-R601 VanDerWaalsContact O-CG 3.27Å; E597-R601 WeakPolarHBondContact O-CG 3.01Å; E597-R601 PolarHBondContact O-N 2.96Å; E597-R601 PolarHBondContact O-NE 2.84Å
598	R	92.7	Very high	91.9	Very high	81 Å²	81	34.7 Å²	34.7	31%	0.306	20%	0.203	S	C	.	.	H	α-helix	trans	-64.7	-44.9	171.5	-170.6	179.6	-61.8	-152.7	-3.3	111.7	D595 N596 R601 Y602 V840 D841	D595-R598 HydrophobicContact CB-CB 4.05Å; D595-R598 VanDerWaalsContact CG-CB 3.49Å; D595-R598 WeakPolarHBondContact O-CB 3.26Å; D595-R598 PolarHBondContact O-N 3.11Å; D595-R598 PolarHBondContact OD1-N 2.91Å; D595-R598 VanDerWaalsContact OD1-N 3.12Å; D595-R598 WeakPolarHBondContact OD2-CB 3.49Å; D595-R598 IonicContact OD2-CZ 3.89Å; D595-R598 IonicContact OD2-NE 3.49Å; D595-R598 PolarHBondContact OD2-NE 2.89Å; D595-R598 IonicContact OD2-NH2 2.62Å; D595-R598 PolarHBondContact OD2-NH2 2.96Å; N596-R598 PolarHBondContact O-N 3.39Å; R598-R601 PolarHBondContact O-N 2.88Å; R598-Y602 VanDerWaalsContact O-CB 3.22Å; R598-Y602 WeakPolarHBondContact O-CB 3.3Å; R598-Y602 PolarHBondContact O-N 3.22Å; R598-V840 HydrophobicContact CG-CG1 3.92Å; R598-D841 IonicContact CZ-OD1 3.3Å; R598-D841 IonicContact NH1-OD1 2.97Å; R598-D841 PolarHBondContact NH1-OD1 3.23Å; R598-D841 IonicContact NH1-OD2 3.33Å; R598-D841 PolarHBondContact NH1-OD2 3.43Å
599	F	95.2	Very high	91.7	Very high	5 Å²	5	35.5 Å²	35.5	2%	0.022	21%	0.207	C	C	.	.	H	α-helix	trans	-65.3	-41.5	176	-67	-64	0	0	0	111.6	V454 V561 L572 L589 N596 Y602 F603 V840	V454-F599 HydrophobicContact CG2-CB 4.04Å; V561-F599 HydrophobicContact CB-CE1 4.3Å; V561-F599 HydrophobicContact CB-CE2 4.11Å; V561-F599 HydrophobicContact CB-CZ 3.84Å; V561-F599 HydrophobicContact CG2-CD2 3.99Å; V561-F599 HydrophobicContact CG2-CE1 4.48Å; V561-F599 HydrophobicContact CG2-CE2 3.59Å; V561-F599 HydrophobicContact CG2-CZ 3.86Å; V561-F599 WeakPolarHBondContact O-CZ 3.28Å; L572-F599 HydrophobicContact CD1-CD1 4.2Å; L572-F599 HydrophobicContact CD1-CE1 3.82Å; L589-F599 HydrophobicContact CD1-CB 4.16Å; L589-F599 HydrophobicContact CD1-CD1 4.49Å; N596-F599 PolarHBondContact O-N 3.46Å; F599-Y602 PolarHBondContact O-N 3.25Å; F599-F603 WeakPolarHBondContact O-CD2 3.35Å; F599-F603 PolarHBondContact O-N 3.43Å; F599-V840 HydrophobicContact CD1-CG2 4.34Å; F599-V840 HydrophobicContact CE1-CG1 4.4Å; F599-V840 HydrophobicContact CE1-CG2 4.19Å
600	S	96.4	Very high	91.4	Very high	10 Å²	10	42.2 Å²	42.2	7%	0.07	24%	0.236	C	C	.	.	H	α-helix	trans	-55.5	-55.4	173.4	174.4	0	0	0	0	111.4	N596 Y602 F603 G604 G605 C606	N596-S600 PolarHBondContact O-N 3.24Å; S600-Y602 VanDerWaalsContact C-N 3.32Å; S600-Y602 PolarHBondContact O-N 2.75Å; S600-F603 CarbonylContact O-C 3.54Å; S600-F603 PolarHBondContact O-N 3.07Å; S600-F603 VanDerWaalsContact O-N 3.15Å; S600-G604 PolarHBondContact O-N 3.31Å; S600-G605 WeakPolarHBondContact O-CA 3.49Å; S600-G605 PolarHBondContact O-N 3.24Å; S600-G605 WeakPolarHBondContact OG-CA 3.39Å; S600-C606 WeakPolarHBondContact CB-O 3.32Å; S600-C606 PolarHBondContact O-N 3.49Å; S600-C606 PolarHBondContact OG-N 2.73Å; S600-C606 PolarHBondContact OG-O 3.13Å
601	R	96.4	Very high	91.1	Very high	162 Å²	162	42.3 Å²	42.3	61%	0.611	24%	0.237	S	C	*	.	H	α-helix	trans	-58	-43	177.4	-74.4	179.9	-68.2	144.1	-5.8	112.3	D595 E597 R598 F603 G604	D595-R601 IonicContact OD2-NH2 2.77Å; E597-R601 WeakPolarHBondContact O-CB 3.34Å; E597-R601 VanDerWaalsContact O-CG 3.27Å; E597-R601 WeakPolarHBondContact O-CG 3.01Å; E597-R601 PolarHBondContact O-N 2.96Å; E597-R601 PolarHBondContact O-NE 2.84Å; R598-R601 PolarHBondContact O-N 2.88Å; R601-F603 VanDerWaalsContact C-N 3.26Å; R601-F603 PolarHBondContact O-N 3.4Å; R601-G604 PolarHBondContact O-N 2.83Å
602	Y	95.9	Very high	90.3	Very high	29 Å²	29	46.2 Å²	46.2	11%	0.114	26%	0.262	C	S	.	.	H	α-helix	trans	-60.5	-35.4	179.5	176.2	-101.3	0	0	0	112.5	L572 K576 R598 F599 S600 K838 V840	L572-Y602 HydrophobicContact CB-CE1 4.38Å; K576-Y602 HydrophobicContact CB-CE1 4.45Å; K576-Y602 HydrophobicContact CD-CD1 4.35Å; K576-Y602 HydrophobicContact CD-CE1 3.67Å; K576-Y602 HydrophobicContact CD-CE2 4.08Å; K576-Y602 WeakPolarHBondContact CD-OH 3.33Å; K576-Y602 VanDerWaalsContact CE-O 3.31Å; K576-Y602 WeakPolarHBondContact CE-O 3.25Å; K576-Y602 PolarHBondContact NZ-O 2.86Å; R598-Y602 VanDerWaalsContact O-CB 3.22Å; R598-Y602 WeakPolarHBondContact O-CB 3.3Å; R598-Y602 PolarHBondContact O-N 3.22Å; F599-Y602 PolarHBondContact O-N 3.25Å; S600-Y602 VanDerWaalsContact C-N 3.32Å; S600-Y602 PolarHBondContact O-N 2.75Å; Y602-K838 WeakPolarHBondContact CE2-O 3.02Å; Y602-K838 PolarHBondContact OH-O 3.15Å; Y602-V840 HydrophobicContact CD1-CG2 3.85Å; Y602-V840 HydrophobicContact CD2-CB 4.48Å; Y602-V840 HydrophobicContact CD2-CG2 4.07Å; Y602-V840 HydrophobicContact CE1-CG2 3.96Å; Y602-V840 HydrophobicContact CE2-CG2 4.17Å; Y602-V840 HydrophobicContact CG-CG2 3.91Å
603	F	96.5	Very high	89.5	Confident	27 Å²	27	47.2 Å²	47.2	12%	0.118	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.2	23.8	174.4	-75.5	-79.1	0	0	0	113.9	V452 L572 K576 L587 L589 F599 S600 R601 C606	V452-F603 HydrophobicContact CB-CB 4.29Å; V452-F603 HydrophobicContact CB-CG 4.46Å; V452-F603 HydrophobicContact CG1-CB 4.02Å; V452-F603 HydrophobicContact CG1-CD1 4.17Å; V452-F603 HydrophobicContact CG1-CD2 4.21Å; V452-F603 HydrophobicContact CG1-CG 3.88Å; V452-F603 HydrophobicContact CG2-CB 4.33Å; V452-F603 HydrophobicContact CG2-CD1 3.84Å; V452-F603 HydrophobicContact CG2-CE1 4.49Å; V452-F603 HydrophobicContact CG2-CG 4.27Å; L572-F603 HydrophobicContact CB-CZ 4.38Å; L572-F603 HydrophobicContact CD2-CE2 4.19Å; L572-F603 HydrophobicContact CD2-CZ 4.12Å; K576-F603 HydrophobicContact CB-CD1 4.34Å; K576-F603 HydrophobicContact CB-CE1 3.66Å; K576-F603 HydrophobicContact CB-CZ 4.32Å; K576-F603 HydrophobicContact CG-CD1 4.32Å; K576-F603 HydrophobicContact CG-CE1 4.13Å; L587-F603 HydrophobicContact CD2-CD1 4.44Å; L587-F603 HydrophobicContact CD2-CE1 3.7Å; L587-F603 HydrophobicContact CD2-CE2 4.45Å; L587-F603 HydrophobicContact CD2-CZ 3.72Å; L589-F603 HydrophobicContact CD1-CD2 3.7Å; L589-F603 HydrophobicContact CD1-CE2 3.5Å; L589-F603 VanDerWaalsContact CD1-CE2 3.5Å; L589-F603 HydrophobicContact CD1-CZ 4.46Å; F599-F603 WeakPolarHBondContact O-CD2 3.35Å; F599-F603 PolarHBondContact O-N 3.43Å; S600-F603 CarbonylContact O-C 3.54Å; S600-F603 PolarHBondContact O-N 3.07Å; S600-F603 VanDerWaalsContact O-N 3.15Å; R601-F603 VanDerWaalsContact C-N 3.26Å; R601-F603 PolarHBondContact O-N 3.4Å; F603-C606 HydrophobicContact CB-CB 4.43Å
604	G	94.5	Very high	89.1	Confident	75 Å²	75	52.3 Å²	52.3	77%	0.773	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.1	29.7	171.9	0	0	0	0	0	114.9	S600 R601	S600-G604 PolarHBondContact O-N 3.31Å; R601-G604 PolarHBondContact O-N 2.83Å
605	G	94.8	Very high	88.9	Confident	53 Å²	53	53.5 Å²	53.5	55%	0.546	29%	0.293	S	S	.	.	S	Bend	trans	80.6	33.3	178.7	0	0	0	0	0	113.4	S600	S600-G605 WeakPolarHBondContact O-CA 3.49Å; S600-G605 PolarHBondContact O-N 3.24Å; S600-G605 WeakPolarHBondContact OG-CA 3.39Å
606	C	96.5	Very high	88.7	Confident	13 Å²	13	55.6 Å²	55.6	9%	0.088	30%	0.299	C	S	.	.			trans	-64.9	153.3	-180	72	0	0	0	0	112	V452 S600 F603	V452-C606 HydrophobicContact CB-CB 4.05Å; V452-C606 HydrophobicContact CG1-CB 4.44Å; V452-C606 WeakPolarHBondContact O-CB 3.43Å; S600-C606 WeakPolarHBondContact CB-O 3.32Å; S600-C606 PolarHBondContact O-N 3.49Å; S600-C606 PolarHBondContact OG-N 2.73Å; S600-C606 PolarHBondContact OG-O 3.13Å; F603-C606 HydrophobicContact CB-CB 4.43Å
607	P	97.2	Very high	88.5	Confident	38 Å²	38	59.1 Å²	59.1	25%	0.247	32%	0.323	C	S	.	.			trans	-64	140	-173.4	25.7	-35.7	0	0	0	112.4	H450 V453 V454	H450-P607 HydrophobicContact CB-CG 4.09Å; V453-P607 HydrophobicContact CG1-CG 4.42Å; V453-P607 HydrophobicContact CG2-CG 4.09Å; V454-P607 PolarHBondContact N-O 3.45Å
608	V	96.3	Very high	88.3	Confident	35 Å²	35	56 Å²	56	21%	0.212	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	109.1	172.3	-174.2	0	0	0	0	109	V454 N596 K610	V454-V608 HydrophobicContact CB-CG1 4.42Å; V454-V608 HydrophobicContact CB-CG2 4.17Å; V454-V608 HydrophobicContact CG1-CG1 4.32Å; V454-V608 CarbonylContact O-C 3.6Å; V454-V608 WeakPolarHBondContact O-CA 3.14Å; N596-V608 HydrophobicContact CB-CG1 4.01Å; V608-K610 HydrophobicContact CG1-CG 4.45Å
609	I	95	Very high	88.5	Confident	17 Å²	17	58 Å²	58	9%	0.087	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	116.6	174.5	-53.6	177.3	0	0	0	108.1	I443 A446 V453 V454 S456 V611	I443-I609 HydrophobicContact CB-CD1 4.49Å; I443-I609 HydrophobicContact CG1-CD1 4.16Å; I443-I609 HydrophobicContact CG1-CG2 4.13Å; A446-I609 HydrophobicContact CB-CD1 3.45Å; A446-I609 VanDerWaalsContact CB-CD1 3.45Å; A446-I609 HydrophobicContact CB-CG1 4.37Å; V453-I609 HydrophobicContact CG1-CD1 3.81Å; V453-I609 HydrophobicContact CG1-CG1 4.06Å; V454-I609 PolarHBondContact O-N 3.4Å; S456-I609 PolarHBondContact N-O 2.94Å; I609-V611 HydrophobicContact CG2-CG2 4.47Å
610	K	92.2	Very high	88.5	Confident	140 Å²	140	60.4 Å²	60.4	61%	0.609	33%	0.332	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.1	112.1	173.5	-66.2	179.1	-176.4	172.7	0	108.8	S456 V608 P612	S456-K610 CarbonylContact O-C 3.49Å; S456-K610 WeakPolarHBondContact O-CA 3.11Å; V608-K610 HydrophobicContact CG1-CG 4.45Å; K610-P612 WeakPolarHBondContact O-CD 3.17Å
611	V	87.6	Confident	88.5	Confident	3 Å²	3	60.5 Å²	60.5	2%	0.018	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	105.3	169	179.8	0	0	0	0	106.4	V436 H439 I443 I455 S456 G457 C461 I609 G613	V436-V611 HydrophobicContact CB-CG1 4.01Å; V436-V611 HydrophobicContact CG2-CG1 4.35Å; V436-V611 HydrophobicContact CG2-CG2 4.27Å; H439-V611 HydrophobicContact CB-CG2 4.47Å; I443-V611 HydrophobicContact CD1-CG2 3.99Å; I455-V611 HydrophobicContact CG2-CG2 3.97Å; S456-V611 PolarHBondContact O-N 2.84Å; G457-V611 WeakPolarHBondContact CA-O 3.3Å; C461-V611 HydrophobicContact CB-CG1 4.25Å; I609-V611 HydrophobicContact CG2-CG2 4.47Å; V611-G613 PolarHBondContact O-N 3.37Å; V611-G613 VanDerWaalsContact O-N 3.17Å
612	P	76.2	Confident	88.5	Confident	82 Å²	82	53.9 Å²	53.9	53%	0.532	31%	0.306	S	S	.	.			trans	-57.3	124.6	175.5	24.5	-31.2	0	0	0	108.5	P435 H439 K610	P435-P612 VanDerWaalsContact CB-O 3.25Å; P435-P612 WeakPolarHBondContact CB-O 3.23Å; H439-P612 WeakPolarHBondContact NE2-CD 3.41Å; K610-P612 WeakPolarHBondContact O-CD 3.17Å
613	G	66.3	Low	88.4	Confident	25 Å²	25	53.6 Å²	53.6	26%	0.258	31%	0.307	S	S	.	.			trans	-72.9	147.2	170.7	0	0	0	0	0	110.1	V611	V611-G613 PolarHBondContact O-N 3.37Å; V611-G613 VanDerWaalsContact O-N 3.17Å
614	F	65.7	Low	88.2	Confident	127 Å²	127	55.8 Å²	55.8	56%	0.557	32%	0.317	S	S	*	.			trans	-101.3	107.5	152.9	-178.9	-96.9	0	0	0	106.3	P435 Y616	P435-F614 HydrophobicContact CG-CB 3.95Å; F614-Y616 HydrophobicContact CD1-CD2 4.38Å; F614-Y616 HydrophobicContact CD1-CE2 4.34Å; F614-Y616 AromaticContact CE1-CD1 3.84Å; F614-Y616 HydrophobicContact CE1-CD1 3.84Å; F614-Y616 AromaticContact CE1-CD2 3.9Å; F614-Y616 HydrophobicContact CE1-CD2 3.9Å; F614-Y616 AromaticContact CE1-CE1 3.82Å; F614-Y616 HydrophobicContact CE1-CE1 3.82Å; F614-Y616 AromaticContact CE1-CE2 3.88Å; F614-Y616 HydrophobicContact CE1-CE2 3.88Å; F614-Y616 AromaticContact CE1-CG 3.88Å; F614-Y616 HydrophobicContact CE1-CG 3.88Å; F614-Y616 AromaticContact CE1-CZ 3.84Å; F614-Y616 HydrophobicContact CZ-CD1 4.26Å; F614-Y616 HydrophobicContact CZ-CE1 4.37Å
615	M	67.6	Low	88.1	Confident	48 Å²	48	54.3 Å²	54.3	24%	0.236	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-97.3	136	159.2	-64	-161	-38.6	0	0	107.3
616	Y	78.1	Confident	88.1	Confident	90 Å²	90	51.8 Å²	51.8	35%	0.353	27%	0.265	S	S	.	.	P	Polyproline II helix	trans	-59.5	147.5	164.4	-69.9	-92.9	0	0	0	109.1	F614 V618 G784 C786 Q787 S788	F614-Y616 HydrophobicContact CD1-CD2 4.38Å; F614-Y616 HydrophobicContact CD1-CE2 4.34Å; F614-Y616 AromaticContact CE1-CD1 3.84Å; F614-Y616 HydrophobicContact CE1-CD1 3.84Å; F614-Y616 AromaticContact CE1-CD2 3.9Å; F614-Y616 HydrophobicContact CE1-CD2 3.9Å; F614-Y616 AromaticContact CE1-CE1 3.82Å; F614-Y616 HydrophobicContact CE1-CE1 3.82Å; F614-Y616 AromaticContact CE1-CE2 3.88Å; F614-Y616 HydrophobicContact CE1-CE2 3.88Å; F614-Y616 AromaticContact CE1-CG 3.88Å; F614-Y616 HydrophobicContact CE1-CG 3.88Å; F614-Y616 AromaticContact CE1-CZ 3.84Å; F614-Y616 HydrophobicContact CZ-CD1 4.26Å; F614-Y616 HydrophobicContact CZ-CE1 4.37Å; Y616-V618 PolarHBondContact O-N 2.93Å; Y616-G784 PolarHBondContact N-O 3.36Å; Y616-C786 VanDerWaalsContact CE2-C 3.4Å; Y616-C786 VanDerWaalsContact CE2-O 3.26Å; Y616-C786 WeakPolarHBondContact CE2-O 3.16Å; Y616-Q787 WeakPolarHBondContact CB-O 3.48Å; Y616-Q787 VanDerWaalsContact CG-C 3.4Å; Y616-S788 VanDerWaalsContact CB-N 3.3Å
617	P	84.4	Confident	87.9	Confident	92 Å²	92	52.2 Å²	52.2	60%	0.597	27%	0.267	S	S	*	.	P	Polyproline II helix	trans	-57.8	128.8	-178.2	22.2	-32.1	0	0	0	110.5	S788 G789	P617-S788 WeakPolarHBondContact O-CA 3.37Å; P617-G789 PolarHBondContact O-N 3.42Å
618	V	89.6	Confident	87.6	Confident	23 Å²	23	53.4 Å²	53.4	14%	0.139	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	117	174.2	-177.7	0	0	0	0	108.1	Y616 E620 R780 A783 G784 G789 A791	Y616-V618 PolarHBondContact O-N 2.93Å; V618-E620 PolarHBondContact O-N 3.09Å; V618-R780 HydrophobicContact CB-CG 4.12Å; V618-R780 HydrophobicContact CG1-CG 3.78Å; V618-A783 HydrophobicContact CG1-CB 4.33Å; V618-A783 HydrophobicContact CG2-CB 4.49Å; V618-G784 VanDerWaalsContact CG2-CA 3.41Å; V618-G789 CarbonylContact C-O 3.55Å; V618-G789 VanDerWaalsContact CA-O 3.31Å; V618-G789 WeakPolarHBondContact CA-O 3.41Å; V618-A791 HydrophobicContact CG1-CB 3.68Å
619	K	95.5	Very high	87.3	Confident	125 Å²	125	55.8 Å²	55.8	54%	0.543	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	118.9	176.1	-171.2	175.7	-172.9	173.5	0	109.4	G789 F790 A791	K619-G789 PolarHBondContact N-O 3.39Å; K619-F790 HydrophobicContact CB-CD1 3.83Å; K619-F790 HydrophobicContact CB-CE1 4.14Å; K619-F790 HydrophobicContact CD-CD1 4.27Å; K619-F790 HydrophobicContact CD-CE1 4.05Å; K619-F790 HydrophobicContact CG-CD1 4.47Å; K619-F790 WeakPolarHBondContact O-CA 3.34Å; K619-A791 PolarHBondContact O-N 2.99Å
620	E	96	Very high	87.1	Confident	54 Å²	54	56.7 Å²	56.7	25%	0.252	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	134	-178.1	-58.5	-171.5	-132.4	0	0	111.2	V618 Y622 R780 A791 H793	V618-E620 PolarHBondContact O-N 3.09Å; E620-Y622 HydrophobicContact CB-CE2 3.92Å; E620-Y622 PolarHBondContact OE2-OH 3.3Å; E620-R780 HydrophobicContact CG-CG 4.45Å; E620-R780 WeakPolarHBondContact OE1-CD 3.47Å; E620-R780 IonicContact OE1-CZ 2.64Å; E620-R780 IonicContact OE1-NE 2.62Å; E620-R780 IonicContact OE1-NH1 3.22Å; E620-R780 PolarHBondContact OE1-NH1 3.46Å; E620-A791 CarbonylContact C-O 3.6Å; E620-A791 WeakPolarHBondContact CA-O 3.49Å; E620-A791 HydrophobicContact CG-CB 4.48Å; E620-H793 IonicContact OE2-CD2 2.78Å; E620-H793 IonicContact OE2-NE2 3.65Å; E620-H793 PolarHBondContact OE2-NE2 2.91Å
621	H	96.8	Very high	86.8	Confident	13 Å²	13	52.5 Å²	52.5	6%	0.06	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	119.5	174.8	-69.8	-61.2	0	0	0	108.3	D625 I626 K629 A791 Y792 H793	H621-D625 HydrophobicContact CB-CB 4.23Å; H621-I626 HydrophobicContact CB-CG1 4.15Å; H621-K629 WeakPolarHBondContact CE1-CE 3.37Å; H621-K629 WeakPolarHBondContact ND1-CE 3.48Å; H621-A791 PolarHBondContact N-O 3.02Å; H621-Y792 HydrophobicContact CB-CD1 3.73Å; H621-Y792 HydrophobicContact CB-CE1 4.22Å; H621-Y792 HydrophobicContact CB-CG 4.49Å; H621-Y792 AromaticContact CD2-CD1 3.9Å; H621-Y792 AromaticContact CD2-CE1 3.5Å; H621-Y792 VanDerWaalsContact CD2-CE1 3.5Å; H621-Y792 WeakPolarHBondContact CD2-CE1 3.14Å; H621-Y792 CarbonylContact O-C 3.57Å; H621-Y792 WeakPolarHBondContact O-CA 3.12Å; H621-H793 PolarHBondContact O-N 3.34Å
622	Y	95.9	Very high	86.5	Confident	22 Å²	22	55.7 Å²	55.7	9%	0.086	30%	0.302	C	S	.	.			trans	-93.4	173.3	177.7	-70.1	-96.3	0	0	0	110.6	E620 E624 D625 I626 H793 F795 R797 L800	E620-Y622 HydrophobicContact CB-CE2 3.92Å; E620-Y622 PolarHBondContact OE2-OH 3.3Å; Y622-E624 VanDerWaalsContact C-N 3.26Å; Y622-E624 PolarHBondContact O-N 2.96Å; Y622-E624 VanDerWaalsContact O-N 3.15Å; Y622-D625 PolarHBondContact N-OD2 2.84Å; Y622-D625 WeakPolarHBondContact O-CA 3.36Å; Y622-D625 WeakPolarHBondContact O-CB 3.35Å; Y622-D625 PolarHBondContact O-N 3.04Å; Y622-I626 WeakPolarHBondContact O-CG1 3.45Å; Y622-I626 PolarHBondContact O-N 3.3Å; Y622-H793 CarbonylContact C-O 3.59Å; Y622-H793 HydrophobicContact CD1-CB 4.1Å; Y622-H793 HydrophobicContact CE1-CB 4.37Å; Y622-H793 AromaticContact CE1-CD2 3.65Å; Y622-H793 AromaticContact CZ-CD2 3.63Å; Y622-F795 HydrophobicContact CD1-CE2 4.5Å; Y622-F795 HydrophobicContact CE1-CE2 4.28Å; Y622-R797 HydrophobicContact CD1-CB 4.44Å; Y622-R797 HydrophobicContact CD1-CG 3.64Å; Y622-R797 HydrophobicContact CD2-CG 3.68Å; Y622-R797 HydrophobicContact CE1-CG 4.05Å; Y622-R797 HydrophobicContact CE2-CG 4.12Å; Y622-R797 HydrophobicContact CG-CG 3.43Å; Y622-R797 VanDerWaalsContact CG-CG 3.43Å; Y622-L800 HydrophobicContact CE1-CB 4.39Å; Y622-L800 HydrophobicContact CE1-CD2 3.79Å; Y622-L800 VanDerWaalsContact OH-CD2 3.29Å; Y622-L800 WeakPolarHBondContact OH-CD2 3.26Å
623	L	93.2	Very high	85.9	Confident	24 Å²	24	60.1 Å²	60.1	13%	0.126	32%	0.315	C	S	.	.	H	α-helix	trans	-50	-45.3	-173.6	-174	61.6	0	0	0	113.1	D625 I626 L627 Y635 L654 H793 F795	L623-D625 VanDerWaalsContact C-N 3.33Å; L623-D625 PolarHBondContact O-N 2.81Å; L623-I626 PolarHBondContact O-N 2.91Å; L623-L627 HydrophobicContact CD1-CD1 4.29Å; L623-L627 HydrophobicContact CD1-CG 4.28Å; L623-L627 HydrophobicContact CG-CD1 3.96Å; L623-L627 HydrophobicContact CG-CG 4.4Å; L623-L627 WeakPolarHBondContact O-CB 3.44Å; L623-L627 WeakPolarHBondContact O-CG 3.48Å; L623-L627 PolarHBondContact O-N 2.93Å; L623-Y635 HydrophobicContact CD1-CE2 3.86Å; L623-Y635 HydrophobicContact CD2-CE2 4.2Å; L623-Y635 HydrophobicContact CG-CE2 4.35Å; L623-L654 HydrophobicContact CD1-CD2 3.83Å; L623-H793 PolarHBondContact N-O 3.46Å; L623-H793 VanDerWaalsContact N-O 3.08Å; L623-F795 VanDerWaalsContact CB-C 3.42Å; L623-F795 PolarHBondContact N-O 3.4Å
624	E	91.5	Very high	85.5	Confident	73 Å²	73	65.5 Å²	65.5	34%	0.341	33%	0.334	S	S	.	.	H	α-helix	trans	-58.8	-39.8	175.6	55.6	-87.8	-160.8	0	0	113.5	Y622 A628 P796 R797	Y622-E624 VanDerWaalsContact C-N 3.26Å; Y622-E624 PolarHBondContact O-N 2.96Å; Y622-E624 VanDerWaalsContact O-N 3.15Å; E624-A628 WeakPolarHBondContact O-CB 3.33Å; E624-A628 PolarHBondContact O-N 2.66Å; E624-P796 VanDerWaalsContact OE2-CA 3.28Å; E624-P796 WeakPolarHBondContact OE2-CA 3.32Å; E624-R797 WeakPolarHBondContact OE1-CD 3.42Å; E624-R797 VanDerWaalsContact OE1-CG 3.26Å; E624-R797 WeakPolarHBondContact OE1-CG 3.47Å; E624-R797 IonicContact OE1-CZ 3.66Å; E624-R797 PolarHBondContact OE1-N 3.16Å; E624-R797 IonicContact OE1-NE 3.91Å; E624-R797 IonicContact OE1-NH1 2.75Å; E624-R797 PolarHBondContact OE1-NH1 3.4Å
625	D	94.3	Very high	85	Confident	43 Å²	43	63 Å²	63	23%	0.23	32%	0.322	C	S	.	.	H	α-helix	trans	-72.6	-38.1	178.8	-50.1	-41.1	0	0	0	110.9	H621 Y622 L623 K629 R797	H621-D625 HydrophobicContact CB-CB 4.23Å; Y622-D625 PolarHBondContact N-OD2 2.84Å; Y622-D625 WeakPolarHBondContact O-CA 3.36Å; Y622-D625 WeakPolarHBondContact O-CB 3.35Å; Y622-D625 PolarHBondContact O-N 3.04Å; L623-D625 VanDerWaalsContact C-N 3.33Å; L623-D625 PolarHBondContact O-N 2.81Å; D625-K629 VanDerWaalsContact O-CG 3.28Å; D625-K629 WeakPolarHBondContact O-CG 3.48Å; D625-K629 PolarHBondContact O-N 2.93Å; D625-R797 IonicContact OD1-CZ 3.97Å; D625-R797 IonicContact OD1-NH1 3.26Å; D625-R797 PolarHBondContact OD1-NH1 2.75Å; D625-R797 IonicContact OD1-NH2 3.65Å; D625-R797 IonicContact OD2-CZ 3.39Å; D625-R797 IonicContact OD2-NH1 3.21Å; D625-R797 PolarHBondContact OD2-NH1 2.82Å; D625-R797 IonicContact OD2-NH2 2.76Å; D625-R797 PolarHBondContact OD2-NH2 2.76Å
626	I	94	Very high	84.3	Confident	0 Å²	0	64.5 Å²	64.5	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-66	-48	179.3	-68.7	166.2	0	0	0	110.2	H621 Y622 L623 A628 K629 L630 L658 Y792 H793 L794	H621-I626 HydrophobicContact CB-CG1 4.15Å; Y622-I626 WeakPolarHBondContact O-CG1 3.45Å; Y622-I626 PolarHBondContact O-N 3.3Å; L623-I626 PolarHBondContact O-N 2.91Å; I626-A628 VanDerWaalsContact C-N 3.32Å; I626-A628 PolarHBondContact O-N 2.71Å; I626-K629 WeakPolarHBondContact O-CB 3.29Å; I626-K629 PolarHBondContact O-N 2.8Å; I626-K629 VanDerWaalsContact O-N 3.12Å; I626-L630 HydrophobicContact CG2-CD1 3.88Å; I626-L630 HydrophobicContact CG2-CG 4.37Å; I626-L630 WeakPolarHBondContact O-CG 3.23Å; I626-L630 PolarHBondContact O-N 3.43Å; I626-L658 HydrophobicContact CD1-CD2 4.18Å; I626-L658 HydrophobicContact CG2-CD1 4.03Å; I626-L658 HydrophobicContact CG2-CD2 4.25Å; I626-Y792 HydrophobicContact CG1-CD1 4.25Å; I626-H793 VanDerWaalsContact CD1-O 3.28Å; I626-H793 WeakPolarHBondContact CD1-O 3.41Å; I626-L794 HydrophobicContact CD1-CD2 4.1Å; I626-L794 HydrophobicContact CG2-CD2 4.49Å
627	L	91.9	Very high	82.7	Confident	23 Å²	23	65.4 Å²	65.4	12%	0.12	34%	0.342	C	S	.	.	H	α-helix	trans	-60.4	-43.5	178.3	-72.6	171	0	0	0	111.7	L623 K629 L630 G631 K632 Y635 L654	L623-L627 HydrophobicContact CD1-CD1 4.29Å; L623-L627 HydrophobicContact CD1-CG 4.28Å; L623-L627 HydrophobicContact CG-CD1 3.96Å; L623-L627 HydrophobicContact CG-CG 4.4Å; L623-L627 WeakPolarHBondContact O-CB 3.44Å; L623-L627 WeakPolarHBondContact O-CG 3.48Å; L623-L627 PolarHBondContact O-N 2.93Å; L627-K629 VanDerWaalsContact C-N 3.34Å; L627-K629 PolarHBondContact O-N 3.18Å; L627-L630 PolarHBondContact O-N 2.9Å; L627-G631 PolarHBondContact O-N 2.94Å; L627-G631 VanDerWaalsContact O-N 3.12Å; L627-K632 CarbonylContact C-O 3.58Å; L627-K632 WeakPolarHBondContact CB-O 3.45Å; L627-K632 HydrophobicContact CD2-CB 3.96Å; L627-K632 HydrophobicContact CD2-CD 4.49Å; L627-K632 PolarHBondContact O-N 3.38Å; L627-Y635 HydrophobicContact CD1-CD2 3.5Å; L627-Y635 VanDerWaalsContact CD1-CD2 3.5Å; L627-Y635 HydrophobicContact CD1-CE2 4.06Å; L627-Y635 HydrophobicContact CD2-CD2 3.62Å; L627-Y635 HydrophobicContact CD2-CE2 3.82Å; L627-Y635 HydrophobicContact CG-CD2 4.12Å; L627-Y635 HydrophobicContact CG-CE2 4.37Å; L627-L654 HydrophobicContact CD2-CD1 4.18Å
628	A	90.7	Very high	80.8	Confident	63 Å²	63	70.9 Å²	70.9	52%	0.521	35%	0.35	S	S	.	.	H	α-helix	trans	-59.7	-43.6	173.7	0	0	0	0	0	112	E624 I626 L630 G631	E624-A628 WeakPolarHBondContact O-CB 3.33Å; E624-A628 PolarHBondContact O-N 2.66Å; I626-A628 VanDerWaalsContact C-N 3.32Å; I626-A628 PolarHBondContact O-N 2.71Å; A628-L630 PolarHBondContact O-N 2.98Å; A628-G631 PolarHBondContact O-N 3.36Å
629	K	90.4	Very high	78.7	Confident	84 Å²	84	75 Å²	75	37%	0.365	37%	0.368	S	S	.	.	H	α-helix	trans	-64.6	-35.8	176.8	-77.5	169.4	171.9	-69.6	0	113.7	H621 D625 I626 L627 G631 H661	H621-K629 WeakPolarHBondContact CE1-CE 3.37Å; H621-K629 WeakPolarHBondContact ND1-CE 3.48Å; D625-K629 VanDerWaalsContact O-CG 3.28Å; D625-K629 WeakPolarHBondContact O-CG 3.48Å; D625-K629 PolarHBondContact O-N 2.93Å; I626-K629 WeakPolarHBondContact O-CB 3.29Å; I626-K629 PolarHBondContact O-N 2.8Å; I626-K629 VanDerWaalsContact O-N 3.12Å; L627-K629 VanDerWaalsContact C-N 3.34Å; L627-K629 PolarHBondContact O-N 3.18Å; K629-G631 PolarHBondContact O-N 2.82Å; K629-H661 PolarHBondContact O-CE1 3Å; K629-H661 VanDerWaalsContact O-CE1 3.28Å
630	L	90.8	Very high	76.1	Confident	36 Å²	36	79 Å²	79	19%	0.188	38%	0.38	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-4.8	176.9	-66.3	177.3	0	0	0	112.8	I626 L627 A628 K632 L654 D657 H661	I626-L630 HydrophobicContact CG2-CD1 3.88Å; I626-L630 HydrophobicContact CG2-CG 4.37Å; I626-L630 WeakPolarHBondContact O-CG 3.23Å; I626-L630 PolarHBondContact O-N 3.43Å; L627-L630 PolarHBondContact O-N 2.9Å; A628-L630 PolarHBondContact O-N 2.98Å; L630-K632 HydrophobicContact CB-CD 4.46Å; L630-K632 HydrophobicContact CB-CG 4.18Å; L630-K632 PolarHBondContact O-N 2.87Å; L630-L654 HydrophobicContact CD1-CD1 3.56Å; L630-D657 HydrophobicContact CD1-CB 4.29Å; L630-D657 HydrophobicContact CD2-CB 4.44Å; L630-H661 HydrophobicContact CD2-CB 3.57Å
631	G	86.8	Confident	73.3	Confident	52 Å²	52	83.5 Å²	83.5	54%	0.536	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.7	19.8	-175.5	0	0	0	0	0	113.4	L627 A628 K629	L627-G631 PolarHBondContact O-N 2.94Å; L627-G631 VanDerWaalsContact O-N 3.12Å; A628-G631 PolarHBondContact O-N 3.36Å; K629-G631 PolarHBondContact O-N 2.82Å
632	K	79.8	Confident	70.3	Confident	71 Å²	71	90.4 Å²	90.4	31%	0.309	43%	0.432	S	S	.	.			trans	-97	93.9	177.7	-65.3	-173	178.6	-175.2	0	108.7	L627 L630 Q634 D657	L627-K632 CarbonylContact C-O 3.58Å; L627-K632 WeakPolarHBondContact CB-O 3.45Å; L627-K632 HydrophobicContact CD2-CB 3.96Å; L627-K632 HydrophobicContact CD2-CD 4.49Å; L627-K632 PolarHBondContact O-N 3.38Å; L630-K632 HydrophobicContact CB-CD 4.46Å; L630-K632 HydrophobicContact CB-CG 4.18Å; L630-K632 PolarHBondContact O-N 2.87Å; K632-Q634 VanDerWaalsContact C-N 3.33Å; K632-D657 WeakPolarHBondContact CE-OD2 3.47Å; K632-D657 IonicContact NZ-OD2 3.45Å; K632-D657 PolarHBondContact NZ-OD2 3.05Å
633	H	64.7	Low	67.6	Low	174 Å²	174	96 Å²	96	81%	0.806	46%	0.459	S	S	*	.			trans	-78.3	-13.9	-178.9	-67.5	-61.3	0	0	0	114.4
634	Q	57.8	Low	65.4	Low	139 Å²	139	99.1 Å²	99.1	65%	0.65	48%	0.483	S	S	*	.	S	Bend	trans	-130.8	119	177	-73.3	174.7	1.4	0	0	108.9	K632	K632-Q634 VanDerWaalsContact C-N 3.33Å
635	Y	56.1	Low	63.6	Low	75 Å²	75	102.5 Å²	102.5	29%	0.294	50%	0.499	S	S	.	.			trans	-62.1	131.5	157.8	-135.7	-101.1	0	0	0	106.7	L623 L627 H637 L654	L623-Y635 HydrophobicContact CD1-CE2 3.86Å; L623-Y635 HydrophobicContact CD2-CE2 4.2Å; L623-Y635 HydrophobicContact CG-CE2 4.35Å; L627-Y635 HydrophobicContact CD1-CD2 3.5Å; L627-Y635 VanDerWaalsContact CD1-CD2 3.5Å; L627-Y635 HydrophobicContact CD1-CE2 4.06Å; L627-Y635 HydrophobicContact CD2-CD2 3.62Å; L627-Y635 HydrophobicContact CD2-CE2 3.82Å; L627-Y635 HydrophobicContact CG-CD2 4.12Å; L627-Y635 HydrophobicContact CG-CE2 4.37Å; Y635-H637 PolarHBondContact O-N 2.76Å; Y635-H637 VanDerWaalsContact O-N 3.13Å; Y635-L654 HydrophobicContact CE2-CD2 3.65Å; Y635-L654 WeakPolarHBondContact OH-CD2 3.21Å
636	P	52.4	Low	62.1	Low	78 Å²	78	106 Å²	106	51%	0.506	52%	0.518	S	S	.	.			trans	-50.5	126.9	-178.3	16.8	-28.4	0	0	0	109.8	R638	P636-R638 PolarHBondContact O-N 3Å
637	H	43.6	Very low	60.8	Low	110 Å²	110	111 Å²	111	51%	0.509	54%	0.542	S	S	.	.	G	3₁₀ helix	trans	-56	-2.5	-174.5	-76.6	-82.1	0	0	0	115.2	Y635 H639 R640	Y635-H637 PolarHBondContact O-N 2.76Å; Y635-H637 VanDerWaalsContact O-N 3.13Å; H637-H639 PolarHBondContact O-N 3.27Å; H637-H639 VanDerWaalsContact O-N 3.11Å; H637-R640 PolarHBondContact O-N 3.11Å
638	R	46	Very low	59.8	Low	206 Å²	206	111.7 Å²	111.7	78%	0.777	55%	0.547	S	S	*	.	G	3₁₀ helix	trans	-58.6	-17.4	176.6	-102.9	-175.7	176.9	166.6	2	114.3	P636	P636-R638 PolarHBondContact O-N 3Å
639	H	45.2	Very low	59.2	Low	111 Å²	111	111.6 Å²	111.6	51%	0.514	55%	0.547	S	S	.	.	G	3₁₀ helix	trans	-109.1	1.9	179.9	-62.4	-67.2	0	0	0	115.7	H637	H637-H639 PolarHBondContact O-N 3.27Å; H637-H639 VanDerWaalsContact O-N 3.11Å
640	R	40.6	Very low	59	Low	209 Å²	209	109.4 Å²	109.4	79%	0.789	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.9	-18.3	179.6	-108	-172.6	-177.5	-177.5	2.2	114.5	H637	H637-R640 PolarHBondContact O-N 3.11Å
641	H	36.4	Very low	58.9	Low	148 Å²	148	110 Å²	110	69%	0.685	54%	0.542	S	S	*	.	S	Bend	trans	-128.5	105.9	-177.6	-70.5	-67.3	0	0	0	108.2
642	H	35.2	Very low	59.2	Low	157 Å²	157	109 Å²	109	73%	0.727	52%	0.524	S	S	*	.	S	Bend	trans	71.6	122.3	-170	-66.5	-95	0	0	0	111.8
643	E	37.5	Very low	59.8	Low	139 Å²	139	109.5 Å²	109.5	65%	0.65	53%	0.531	S	S	*	.	S	Bend	cis	-156.2	132.4	17.9	-92.7	153.2	-171.8	0	0	108.2
644	S	48.6	Very low	61.2	Low	91 Å²	91	101.4 Å²	101.4	64%	0.636	49%	0.493	S	S	*	.			trans	56.3	125.9	172.8	73.4	0	0	0	0	118.4	D646 E647	S644-D646 PolarHBondContact O-N 2.82Å; S644-E647 PolarHBondContact O-N 2.95Å
645	E	52.2	Low	63	Low	143 Å²	143	94.8 Å²	94.8	67%	0.668	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-3.3	170.2	-72.5	-167	144.5	0	0	114	R799 K802	E645-R799 PolarHBondContact O-NH1 3.03Å; E645-R799 PolarHBondContact O-NH2 3.19Å; E645-K802 VanDerWaalsContact CD-NZ 3.3Å; E645-K802 IonicContact OE1-NZ 2.73Å; E645-K802 PolarHBondContact OE1-NZ 2.79Å; E645-K802 IonicContact OE2-NZ 3.75Å; E645-K802 PolarHBondContact OE2-NZ 3.19Å
646	D	62.8	Low	64.9	Low	118 Å²	118	91.5 Å²	91.5	63%	0.631	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107	3.9	-174.6	-79.8	-30.8	0	0	0	115.1	S644 C648 R799	S644-D646 PolarHBondContact O-N 2.82Å; D646-C648 PolarHBondContact O-N 2.9Å; D646-C648 PolarHBondContact O-SG 3.43Å; D646-R799 IonicContact OD1-NH1 2.7Å
647	E	66.4	Low	66.9	Low	105 Å²	105	90.7 Å²	90.7	49%	0.491	44%	0.441	S	S	.	.			trans	-62.6	121.8	178.5	-160.9	175.8	-157.5	0	0	111.5	S644 A649	S644-E647 PolarHBondContact O-N 2.95Å; E647-A649 PolarHBondContact O-N 3.16Å
648	C	72.3	Confident	69.5	Low	36 Å²	36	85.5 Å²	85.5	24%	0.243	42%	0.417	C	S	.	.			trans	-99.1	59.6	-174.8	-67.5	0	0	0	0	111.2	D646 L751 T768 W770	D646-C648 PolarHBondContact O-N 2.9Å; D646-C648 PolarHBondContact O-SG 3.43Å; C648-L751 HydrophobicContact CB-CD2 3.89Å; C648-T768 HydrophobicContact CB-CG2 4.09Å; C648-T768 VanDerWaalsContact CB-O 3.29Å; C648-T768 WeakPolarHBondContact CB-O 3.27Å; C648-W770 PolarHBondContact SG-NE1 2.98Å; C648-W770 VanDerWaalsContact SG-NE1 3.37Å
649	A	76.7	Confident	71.9	Confident	61 Å²	61	75.8 Å²	75.8	50%	0.504	38%	0.381	S	S	.	.			trans	-100.8	138.2	178.9	0	0	0	0	0	111.8	E647	E647-A649 PolarHBondContact O-N 3.16Å
650	L	86.3	Confident	74.3	Confident	38 Å²	38	72.6 Å²	72.6	20%	0.199	37%	0.367	C	S	.	.			trans	-112	124.3	-179.8	-178.4	62.4	0	0	0	111.2	L652 V655 L675 P676 E680 L751 L794	L650-L652 HydrophobicContact CD2-CD2 4.1Å; L650-L652 HydrophobicContact CG-CD2 4.23Å; L650-L652 PolarHBondContact O-N 3.3Å; L650-V655 HydrophobicContact CD1-CG2 3.97Å; L650-V655 HydrophobicContact CD2-CG2 4.27Å; L650-V655 HydrophobicContact CG-CG2 4.21Å; L650-L675 HydrophobicContact CD2-CD2 3.73Å; L650-P676 HydrophobicContact CD2-CG 4.07Å; L650-E680 HydrophobicContact CD2-CB 4.41Å; L650-E680 HydrophobicContact CD2-CG 4.42Å; L650-L751 HydrophobicContact CB-CD1 4.1Å; L650-L794 HydrophobicContact CD1-CD1 4.23Å
651	D	89.5	Confident	76.9	Confident	48 Å²	48	64.4 Å²	64.4	26%	0.257	34%	0.338	S	S	.	.			trans	-78.9	106.9	172.2	-178	-15.7	0	0	0	110.5	D653 L654 V655	D651-D653 VanDerWaalsContact C-N 3.33Å; D651-D653 WeakPolarHBondContact OD1-CA 3.32Å; D651-D653 WeakPolarHBondContact OD1-CB 3.25Å; D651-D653 PolarHBondContact OD1-N 2.83Å; D651-L654 HydrophobicContact CB-CB 3.89Å; D651-L654 PolarHBondContact O-N 3.32Å; D651-L654 PolarHBondContact OD1-N 3.05Å; D651-V655 WeakPolarHBondContact O-CG2 3.43Å; D651-V655 PolarHBondContact O-N 3.33Å
652	L	93.1	Very high	79.7	Confident	32 Å²	32	57.3 Å²	57.3	17%	0.168	31%	0.305	C	S	.	.	H	α-helix	trans	-71.4	-27.8	-179.4	-55	-174.5	0	0	0	112.8	L650 T656 E680 V684	L650-L652 HydrophobicContact CD2-CD2 4.1Å; L650-L652 HydrophobicContact CG-CD2 4.23Å; L650-L652 PolarHBondContact O-N 3.3Å; L652-T656 WeakPolarHBondContact O-CB 3.48Å; L652-T656 PolarHBondContact O-N 2.99Å; L652-T656 PolarHBondContact O-OG1 3.39Å; L652-E680 HydrophobicContact CD2-CB 3.95Å; L652-E680 HydrophobicContact CD2-CG 4.2Å; L652-V684 HydrophobicContact CB-CG2 4.37Å; L652-V684 HydrophobicContact CD2-CG2 4.09Å
653	D	93	Very high	82.5	Confident	82 Å²	82	51.8 Å²	51.8	44%	0.439	28%	0.281	S	S	.	.	H	α-helix	trans	-71	-40.7	176.8	-66.2	-29.6	0	0	0	109.5	D651 V655 T656 D657 R687	D651-D653 VanDerWaalsContact C-N 3.33Å; D651-D653 WeakPolarHBondContact OD1-CA 3.32Å; D651-D653 WeakPolarHBondContact OD1-CB 3.25Å; D651-D653 PolarHBondContact OD1-N 2.83Å; D653-V655 PolarHBondContact O-N 3.32Å; D653-T656 PolarHBondContact O-N 2.9Å; D653-D657 WeakPolarHBondContact O-CB 3.3Å; D653-D657 VanDerWaalsContact O-CG 3.27Å; D653-D657 PolarHBondContact O-N 3.34Å; D653-R687 WeakPolarHBondContact OD1-CD 3.38Å; D653-R687 IonicContact OD1-CZ 3.73Å; D653-R687 IonicContact OD1-NE 3.26Å; D653-R687 PolarHBondContact OD1-NE 2.88Å; D653-R687 IonicContact OD1-NH2 2.64Å
654	L	93.2	Very high	85	Confident	3 Å²	3	48.9 Å²	48.9	2%	0.016	28%	0.281	C	S	.	.	H	α-helix	trans	-61.1	-43.7	173.6	-178.6	64.6	0	0	0	112.7	L623 L627 L630 Y635 D651 T656 L658 L794	L623-L654 HydrophobicContact CD1-CD2 3.83Å; L627-L654 HydrophobicContact CD2-CD1 4.18Å; L630-L654 HydrophobicContact CD1-CD1 3.56Å; Y635-L654 HydrophobicContact CE2-CD2 3.65Å; Y635-L654 WeakPolarHBondContact OH-CD2 3.21Å; D651-L654 HydrophobicContact CB-CB 3.89Å; D651-L654 PolarHBondContact O-N 3.32Å; D651-L654 PolarHBondContact OD1-N 3.05Å; L654-T656 VanDerWaalsContact C-N 3.3Å; L654-T656 PolarHBondContact O-N 3.24Å; L654-L658 WeakPolarHBondContact O-CB 3.14Å; L654-L658 PolarHBondContact O-N 3.26Å; L654-L794 HydrophobicContact CD2-CD2 3.93Å; L654-L794 HydrophobicContact CG-CD2 4.02Å
655	V	96.1	Very high	87.1	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-58.6	-47.2	174.8	177.9	0	0	0	0	109.9	L650 D651 D653 L658 V659 L675 V684 L794	L650-V655 HydrophobicContact CD1-CG2 3.97Å; L650-V655 HydrophobicContact CD2-CG2 4.27Å; L650-V655 HydrophobicContact CG-CG2 4.21Å; D651-V655 WeakPolarHBondContact O-CG2 3.43Å; D651-V655 PolarHBondContact O-N 3.33Å; D653-V655 PolarHBondContact O-N 3.32Å; V655-L658 PolarHBondContact O-N 2.86Å; V655-V659 WeakPolarHBondContact O-CG2 3.33Å; V655-V659 PolarHBondContact O-N 3.5Å; V655-L675 HydrophobicContact CG1-CD2 4.24Å; V655-L675 HydrophobicContact CG2-CD2 4.31Å; V655-V684 HydrophobicContact CB-CG2 4.01Å; V655-V684 HydrophobicContact CG1-CG1 3.94Å; V655-V684 HydrophobicContact CG1-CG2 3.78Å; V655-L794 HydrophobicContact CB-CD1 4.32Å; V655-L794 HydrophobicContact CG2-CD1 3.41Å; V655-L794 VanDerWaalsContact CG2-CD1 3.41Å
656	T	96.2	Very high	89	Confident	7 Å²	7	48.1 Å²	48.1	4%	0.043	27%	0.265	C	S	.	.	H	α-helix	trans	-62.2	-49.7	-178.3	-56.2	0	0	0	0	111	L652 D653 L654 L658 V659 L660 R687 L688	L652-T656 WeakPolarHBondContact O-CB 3.48Å; L652-T656 PolarHBondContact O-N 2.99Å; L652-T656 PolarHBondContact O-OG1 3.39Å; D653-T656 PolarHBondContact O-N 2.9Å; L654-T656 VanDerWaalsContact C-N 3.3Å; L654-T656 PolarHBondContact O-N 3.24Å; T656-L658 VanDerWaalsContact C-N 3.29Å; T656-L658 PolarHBondContact O-N 2.92Å; T656-V659 PolarHBondContact O-N 3.02Å; T656-V659 VanDerWaalsContact O-N 3.15Å; T656-L660 HydrophobicContact CG2-CD1 4.06Å; T656-L660 HydrophobicContact CG2-CG 4.46Å; T656-L660 WeakPolarHBondContact O-CG 3.37Å; T656-L660 PolarHBondContact O-N 3.18Å; T656-R687 HydrophobicContact CG2-CB 3.8Å; T656-L688 HydrophobicContact CG2-CD2 3.88Å; T656-L688 HydrophobicContact CG2-CG 4.22Å
657	D	95.1	Very high	90.3	Very high	60 Å²	60	48 Å²	48	32%	0.321	26%	0.261	S	S	.	.	H	α-helix	trans	-59.2	-40.3	178.8	-74.7	-16.7	0	0	0	112	L630 K632 D653 L660 H661	L630-D657 HydrophobicContact CD1-CB 4.29Å; L630-D657 HydrophobicContact CD2-CB 4.44Å; K632-D657 WeakPolarHBondContact CE-OD2 3.47Å; K632-D657 IonicContact NZ-OD2 3.45Å; K632-D657 PolarHBondContact NZ-OD2 3.05Å; D653-D657 WeakPolarHBondContact O-CB 3.3Å; D653-D657 VanDerWaalsContact O-CG 3.27Å; D653-D657 PolarHBondContact O-N 3.34Å; D657-L660 PolarHBondContact O-N 2.84Å; D657-H661 VanDerWaalsContact O-CB 3.29Å; D657-H661 WeakPolarHBondContact O-CB 3.37Å; D657-H661 PolarHBondContact O-N 3.3Å
658	L	96.6	Very high	91.5	Very high	2 Å²	2	47.9 Å²	47.9	1%	0.01	27%	0.269	C	S	.	.	H	α-helix	trans	-64.9	-45	175.8	175.3	59.3	0	0	0	111.8	I626 L654 V655 T656 L660 H661 I662 V747 Y792 L794	I626-L658 HydrophobicContact CD1-CD2 4.18Å; I626-L658 HydrophobicContact CG2-CD1 4.03Å; I626-L658 HydrophobicContact CG2-CD2 4.25Å; L654-L658 WeakPolarHBondContact O-CB 3.14Å; L654-L658 PolarHBondContact O-N 3.26Å; V655-L658 PolarHBondContact O-N 2.86Å; T656-L658 VanDerWaalsContact C-N 3.29Å; T656-L658 PolarHBondContact O-N 2.92Å; L658-L660 VanDerWaalsContact C-N 3.34Å; L658-L660 PolarHBondContact O-N 3.38Å; L658-H661 WeakPolarHBondContact O-CB 3.47Å; L658-H661 PolarHBondContact O-N 3.2Å; L658-I662 HydrophobicContact CD1-CD1 3.84Å; L658-I662 HydrophobicContact CD1-CG1 4.04Å; L658-I662 HydrophobicContact CG-CD1 3.86Å; L658-I662 HydrophobicContact CG-CG1 4.49Å; L658-I662 VanDerWaalsContact O-CG1 3.26Å; L658-I662 WeakPolarHBondContact O-CG1 3.2Å; L658-I662 PolarHBondContact O-N 2.94Å; L658-V747 HydrophobicContact CD2-CB 4.49Å; L658-V747 HydrophobicContact CD2-CG1 3.73Å; L658-V747 HydrophobicContact CD2-CG2 4.03Å; L658-V747 HydrophobicContact CG-CG2 4.3Å; L658-Y792 HydrophobicContact CD1-CD1 3.9Å; L658-Y792 HydrophobicContact CD1-CE1 4.41Å; L658-Y792 HydrophobicContact CD1-CG 4.2Å; L658-Y792 HydrophobicContact CD2-CG 4.36Å; L658-L794 HydrophobicContact CD2-CD2 3.74Å; L658-L794 HydrophobicContact CD2-CG 4.43Å
659	V	96.8	Very high	92.4	Very high	1 Å²	1	47.5 Å²	47.5	1%	0.006	27%	0.271	C	S	.	.	H	α-helix	trans	-61.4	-44.6	177.4	171.1	0	0	0	0	110.7	V655 T656 H661 I662 D663 I671 C673 L688 I727 V747	V655-V659 WeakPolarHBondContact O-CG2 3.33Å; V655-V659 PolarHBondContact O-N 3.5Å; T656-V659 PolarHBondContact O-N 3.02Å; T656-V659 VanDerWaalsContact O-N 3.15Å; V659-H661 VanDerWaalsContact C-N 3.33Å; V659-H661 PolarHBondContact O-N 3.21Å; V659-I662 PolarHBondContact O-N 3.12Å; V659-D663 WeakPolarHBondContact O-CB 3.25Å; V659-D663 PolarHBondContact O-N 3.04Å; V659-I671 HydrophobicContact CG1-CD1 4.07Å; V659-C673 VanDerWaalsContact CG2-SG 3.56Å; V659-L688 HydrophobicContact CB-CD2 4Å; V659-L688 HydrophobicContact CG1-CD1 4.03Å; V659-L688 HydrophobicContact CG1-CD2 3.65Å; V659-I727 HydrophobicContact CG1-CD1 3.93Å; V659-I727 HydrophobicContact CG1-CG2 4.16Å; V659-V747 HydrophobicContact CG2-CG2 4.42Å
660	L	95.1	Very high	93.2	Very high	45 Å²	45	44.7 Å²	44.7	24%	0.236	25%	0.248	C	C	.	.	H	α-helix	trans	-64.3	-37.1	176.4	-66.8	174.1	0	0	0	112.1	T656 D657 L658 D663 A664 L688 A691 L692	T656-L660 HydrophobicContact CG2-CD1 4.06Å; T656-L660 HydrophobicContact CG2-CG 4.46Å; T656-L660 WeakPolarHBondContact O-CG 3.37Å; T656-L660 PolarHBondContact O-N 3.18Å; D657-L660 PolarHBondContact O-N 2.84Å; L658-L660 VanDerWaalsContact C-N 3.34Å; L658-L660 PolarHBondContact O-N 3.38Å; L660-D663 PolarHBondContact O-N 3.05Å; L660-A664 WeakPolarHBondContact O-CB 3.33Å; L660-A664 PolarHBondContact O-N 3.05Å; L660-L688 HydrophobicContact CD2-CD2 4Å; L660-L688 HydrophobicContact CG-CD2 4.09Å; L660-A691 HydrophobicContact CD1-CB 3.78Å; L660-A691 HydrophobicContact CD2-CB 4.36Å; L660-L692 HydrophobicContact CD2-CD2 3.51Å; L660-L692 HydrophobicContact CD2-CG 4.01Å
661	H	95.5	Very high	93.7	Very high	36 Å²	36	42.9 Å²	42.9	17%	0.167	24%	0.238	C	C	.	.	H	α-helix	trans	-65.2	-44.8	174.7	-178.3	96.5	0	0	0	112.1	K629 L630 D657 L658 V659 D663 A664 R665	K629-H661 PolarHBondContact O-CE1 3Å; K629-H661 VanDerWaalsContact O-CE1 3.28Å; L630-H661 HydrophobicContact CD2-CB 3.57Å; D657-H661 VanDerWaalsContact O-CB 3.29Å; D657-H661 WeakPolarHBondContact O-CB 3.37Å; D657-H661 PolarHBondContact O-N 3.3Å; L658-H661 WeakPolarHBondContact O-CB 3.47Å; L658-H661 PolarHBondContact O-N 3.2Å; V659-H661 VanDerWaalsContact C-N 3.33Å; V659-H661 PolarHBondContact O-N 3.21Å; H661-D663 VanDerWaalsContact C-N 3.31Å; H661-A664 PolarHBondContact O-N 2.88Å; H661-R665 WeakPolarHBondContact O-CB 3.46Å; H661-R665 PolarHBondContact O-N 3Å
662	I	95.7	Very high	94	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-63.4	-40.6	176.9	-68.6	165.1	0	0	0	110.4	L658 V659 G666 I671 R725 H745 V747 Y792	L658-I662 HydrophobicContact CD1-CD1 3.84Å; L658-I662 HydrophobicContact CD1-CG1 4.04Å; L658-I662 HydrophobicContact CG-CD1 3.86Å; L658-I662 HydrophobicContact CG-CG1 4.49Å; L658-I662 VanDerWaalsContact O-CG1 3.26Å; L658-I662 WeakPolarHBondContact O-CG1 3.2Å; L658-I662 PolarHBondContact O-N 2.94Å; V659-I662 PolarHBondContact O-N 3.12Å; I662-G666 WeakPolarHBondContact O-CA 2.84Å; I662-G666 PolarHBondContact O-N 3.4Å; I662-I671 HydrophobicContact CB-CD1 4.12Å; I662-I671 HydrophobicContact CG2-CD1 3.66Å; I662-I671 HydrophobicContact CG2-CG1 4Å; I662-R725 VanDerWaalsContact CG2-NH2 3.31Å; I662-H745 HydrophobicContact CG2-CB 3.97Å; I662-V747 HydrophobicContact CD1-CG2 3.72Å; I662-Y792 HydrophobicContact CD1-CD1 4.48Å; I662-Y792 HydrophobicContact CD1-CD2 3.51Å; I662-Y792 HydrophobicContact CD1-CE1 4.44Å; I662-Y792 HydrophobicContact CD1-CE2 3.46Å; I662-Y792 VanDerWaalsContact CD1-CE2 3.46Å; I662-Y792 HydrophobicContact CD1-CG 4.05Å; I662-Y792 HydrophobicContact CG1-CD2 4.3Å; I662-Y792 HydrophobicContact CG1-CE1 4.33Å; I662-Y792 HydrophobicContact CG1-CE2 3.8Å
663	D	93	Very high	94.2	Very high	40 Å²	40	39.2 Å²	39.2	21%	0.214	22%	0.219	C	C	.	.	H	α-helix	trans	-62.9	-45.6	176.1	-178.6	67.1	0	0	0	112.1	V659 L660 H661 Y699 R725	V659-D663 WeakPolarHBondContact O-CB 3.25Å; V659-D663 PolarHBondContact O-N 3.04Å; L660-D663 PolarHBondContact O-N 3.05Å; H661-D663 VanDerWaalsContact C-N 3.31Å; D663-Y699 WeakPolarHBondContact OD1-CE1 3.15Å; D663-Y699 WeakPolarHBondContact OD2-CE1 3.35Å; D663-Y699 PolarHBondContact OD2-OH 3.44Å; D663-R725 WeakPolarHBondContact OD1-CG 3.34Å
664	A	92.1	Very high	94.4	Very high	78 Å²	78	35.3 Å²	35.3	65%	0.645	20%	0.198	S	C	*	.	H	α-helix	trans	-74.5	-30	-176.8	0	0	0	0	0	114.4	L660 H661	L660-A664 WeakPolarHBondContact O-CB 3.33Å; L660-A664 PolarHBondContact O-N 3.05Å; H661-A664 PolarHBondContact O-N 2.88Å
665	R	92.3	Very high	94.6	Very high	195 Å²	195	35.3 Å²	35.3	74%	0.736	20%	0.198	S	C	*	.	H	α-helix	trans	-132.4	-11.3	-169.2	-60.3	-173	-179.4	-176.2	1.4	115.2	H661	H661-R665 WeakPolarHBondContact O-CB 3.46Å; H661-R665 PolarHBondContact O-N 3Å
666	G	90.8	Very high	94.4	Very high	24 Å²	24	35.7 Å²	35.7	25%	0.247	20%	0.201	C	C	.	.	S	Bend	trans	-83.8	160.5	-178.8	0	0	0	0	0	112.4	I662	I662-G666 WeakPolarHBondContact O-CA 2.84Å; I662-G666 PolarHBondContact O-N 3.4Å
667	E	91.6	Very high	94	Very high	115 Å²	115	35.4 Å²	35.4	54%	0.537	20%	0.199	S	C	.	.	P	Polyproline II helix	trans	-55.3	154.3	174.9	-64.5	-58.8	142.4	0	0	112.5	R725 H745 F790	E667-R725 PolarHBondContact O-NH1 2.7Å; E667-H745 PolarHBondContact O-NE2 3.49Å; E667-F790 HydrophobicContact CB-CE2 4.01Å; E667-F790 HydrophobicContact CG-CE2 3.63Å; E667-F790 HydrophobicContact CG-CZ 3.85Å
668	P	90.4	Very high	93.5	Very high	103 Å²	103	35.3 Å²	35.3	67%	0.669	19%	0.194	S	C	*	.	S	Bend	trans	-56.7	146.8	173.7	-23.4	33.7	0	0	0	112.7
669	G	91.4	Very high	92.9	Very high	27 Å²	27	39.3 Å²	39.3	28%	0.278	21%	0.213	S	C	.	.	S	Bend	trans	135.9	171.2	178.2	0	0	0	0	0	113.1	R725	G669-R725 WeakPolarHBondContact O-CD 3.32Å; G669-R725 PolarHBondContact O-NE 3.46Å; G669-R725 PolarHBondContact O-NH1 3.39Å; G669-R725 PolarHBondContact O-NH2 3.44Å
670	G	94	Very high	92.6	Very high	2 Å²	2	40.7 Å²	40.7	2%	0.021	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	153	178.2	0	0	0	0	0	113	K726 D742 V744 H745	G670-K726 CarbonylContact C-O 3.54Å; G670-K726 WeakPolarHBondContact CA-O 3.17Å; G670-D742 WeakPolarHBondContact CA-O 3.5Å; G670-D742 PolarHBondContact N-O 3.22Å; G670-V744 PolarHBondContact O-N 2.88Å; G670-H745 PolarHBondContact O-N 3.2Å; G670-H745 VanDerWaalsContact O-N 3.11Å
671	I	96.5	Very high	92.5	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	132.9	173.9	-52.8	175.3	0	0	0	108.4	V659 I662 K726 I727 V728 H745 V747	V659-I671 HydrophobicContact CG1-CD1 4.07Å; I662-I671 HydrophobicContact CB-CD1 4.12Å; I662-I671 HydrophobicContact CG2-CD1 3.66Å; I662-I671 HydrophobicContact CG2-CG1 4Å; I671-K726 PolarHBondContact N-O 3.04Å; I671-I727 HydrophobicContact CD1-CG1 4.36Å; I671-I727 CarbonylContact O-C 3.59Å; I671-I727 WeakPolarHBondContact O-CA 3.5Å; I671-V728 PolarHBondContact O-N 2.83Å; I671-H745 CarbonylContact C-O 3.55Å; I671-H745 WeakPolarHBondContact CA-O 3.49Å; I671-H745 HydrophobicContact CG1-CB 4.18Å; I671-H745 HydrophobicContact CG2-CB 4.42Å; I671-V747 HydrophobicContact CG2-CG2 4.14Å
672	L	96.2	Very high	92.2	Very high	4 Å²	4	40.1 Å²	40.1	2%	0.021	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	117.5	171.9	174.2	61.6	0	0	0	109.5	F674 V728 A730 A734 I743 H745 V746 V747 R782	L672-F674 HydrophobicContact CD2-CE2 3.77Å; L672-F674 HydrophobicContact CD2-CZ 3.67Å; L672-F674 HydrophobicContact CG-CE2 4.03Å; L672-F674 HydrophobicContact CG-CZ 4.2Å; L672-V728 CarbonylContact C-O 3.55Å; L672-V728 WeakPolarHBondContact CA-O 3.45Å; L672-V728 HydrophobicContact CD1-CB 3.77Å; L672-V728 HydrophobicContact CD1-CG1 3.61Å; L672-A730 HydrophobicContact CD1-CB 3.88Å; L672-A734 HydrophobicContact CD1-CB 4.1Å; L672-A734 HydrophobicContact CD2-CB 4.34Å; L672-I743 HydrophobicContact CB-CD1 4Å; L672-I743 HydrophobicContact CB-CG1 4.11Å; L672-I743 HydrophobicContact CB-CG2 3.75Å; L672-H745 PolarHBondContact N-O 2.85Å; L672-V746 CarbonylContact O-C 3.58Å; L672-V746 VanDerWaalsContact O-CA 3.31Å; L672-V746 WeakPolarHBondContact O-CA 3.18Å; L672-V747 PolarHBondContact O-N 3.45Å; L672-R782 HydrophobicContact CD2-CB 3.95Å; L672-R782 HydrophobicContact CD2-CG 4.09Å
673	C	97.6	Very high	91.9	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	122.1	178.3	-55.3	0	0	0	0	110.4	V659 L675 V728 L729 A730 V747	V659-C673 VanDerWaalsContact CG2-SG 3.56Å; C673-L675 HydrophobicContact CB-CG 4.48Å; C673-V728 PolarHBondContact N-O 3.09Å; C673-L729 HydrophobicContact CB-CD2 3.71Å; C673-A730 PolarHBondContact O-N 3.22Å; C673-A730 VanDerWaalsContact O-O 3.11Å; C673-V747 CarbonylContact C-O 3.56Å; C673-V747 VanDerWaalsContact CA-O 3.3Å; C673-V747 WeakPolarHBondContact CA-O 3.5Å; C673-V747 HydrophobicContact CB-CB 4.22Å
674	F	97.5	Very high	92	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	113.4	172	-71.7	-77.5	0	0	0	110.7	L672 A730 A734 E735 V746 V747 S749 R779 R782	L672-F674 HydrophobicContact CD2-CE2 3.77Å; L672-F674 HydrophobicContact CD2-CZ 3.67Å; L672-F674 HydrophobicContact CG-CE2 4.03Å; L672-F674 HydrophobicContact CG-CZ 4.2Å; F674-A730 CarbonylContact C-O 3.55Å; F674-A730 WeakPolarHBondContact CA-O 3.45Å; F674-A734 HydrophobicContact CE1-CB 3.94Å; F674-A734 HydrophobicContact CZ-CB 4.34Å; F674-E735 HydrophobicContact CE1-CB 4.01Å; F674-V746 HydrophobicContact CD2-CG1 3.81Å; F674-V746 HydrophobicContact CE2-CG1 3.84Å; F674-V747 PolarHBondContact N-O 2.9Å; F674-S749 VanDerWaalsContact O-CB 3.29Å; F674-S749 WeakPolarHBondContact O-CB 3.33Å; F674-S749 PolarHBondContact O-N 3.01Å; F674-S749 PolarHBondContact O-OG 2.93Å; F674-R779 HydrophobicContact CD1-CG 4.09Å; F674-R779 HydrophobicContact CD2-CB 3.74Å; F674-R779 HydrophobicContact CD2-CG 3.63Å; F674-R779 HydrophobicContact CE1-CG 4.06Å; F674-R779 HydrophobicContact CE2-CB 3.57Å; F674-R779 HydrophobicContact CE2-CG 3.59Å; F674-R779 HydrophobicContact CG-CB 4.47Å; F674-R779 HydrophobicContact CG-CG 3.88Å; F674-R779 HydrophobicContact CZ-CB 4.19Å; F674-R779 HydrophobicContact CZ-CG 3.82Å; F674-R782 HydrophobicContact CE2-CG 4.3Å; F674-R782 HydrophobicContact CZ-CG 4.06Å
675	L	96.3	Very high	92	Very high	3 Å²	3	35.8 Å²	35.8	2%	0.016	18%	0.183	C	C	.	.			trans	-119.9	151.6	-176.3	-64.9	172.1	0	0	0	111.3	L650 V655 C673 G677 E680 I681 V684 L729 A730 T731	L650-L675 HydrophobicContact CD2-CD2 3.73Å; V655-L675 HydrophobicContact CG1-CD2 4.24Å; V655-L675 HydrophobicContact CG2-CD2 4.31Å; C673-L675 HydrophobicContact CB-CG 4.48Å; L675-G677 PolarHBondContact O-N 3Å; L675-E680 HydrophobicContact CB-CB 4.24Å; L675-I681 HydrophobicContact CB-CG1 3.9Å; L675-I681 HydrophobicContact CD1-CB 4.37Å; L675-I681 HydrophobicContact CD1-CG1 3.86Å; L675-I681 HydrophobicContact CG-CG1 4.49Å; L675-V684 HydrophobicContact CD1-CB 4.19Å; L675-V684 HydrophobicContact CD1-CG2 4.07Å; L675-V684 HydrophobicContact CD2-CG2 4.36Å; L675-L729 HydrophobicContact CD1-CB 4.29Å; L675-L729 HydrophobicContact CD1-CD2 4.38Å; L675-A730 PolarHBondContact N-O 2.82Å; L675-T731 WeakPolarHBondContact O-CA 3.42Å
676	P	92	Very high	91.9	Very high	7 Å²	7	30 Å²	30	5%	0.045	16%	0.164	C	C	.	.	S	Bend	trans	-60.2	-39.6	-174.5	-26.7	33.8	0	0	0	114.7	L650 E680 L751 K753 T768	L650-P676 HydrophobicContact CD2-CG 4.07Å; P676-E680 HydrophobicContact CB-CG 4.34Å; P676-E680 HydrophobicContact CG-CG 4.14Å; P676-L751 HydrophobicContact CG-CB 3.81Å; P676-K753 HydrophobicContact CB-CG 4.19Å; P676-K753 WeakPolarHBondContact O-CG 3.37Å; P676-K753 PolarHBondContact O-N 3.03Å; P676-T768 HydrophobicContact CB-CG2 4.13Å; P676-T768 HydrophobicContact CG-CG2 4.29Å
677	G	88.2	Confident	92.1	Very high	2 Å²	2	30.8 Å²	30.8	2%	0.021	16%	0.159	C	C	.	.	S	Bend	trans	-169.5	-166.7	-175.2	0	0	0	0	0	113.8	L675 Q679 E680 I681	L675-G677 PolarHBondContact O-N 3Å; G677-Q679 PolarHBondContact O-N 2.79Å; G677-E680 WeakPolarHBondContact CA-OE2 3.1Å; G677-E680 PolarHBondContact N-OE2 3.13Å; G677-E680 PolarHBondContact O-N 3.3Å; G677-E680 VanDerWaalsContact O-OE2 3.09Å; G677-I681 VanDerWaalsContact O-CG1 3.27Å; G677-I681 WeakPolarHBondContact O-CG1 3.46Å; G677-I681 PolarHBondContact O-N 3.19Å
678	W	83.9	Confident	92.2	Very high	57 Å²	57	25.3 Å²	25.3	22%	0.216	13%	0.134	C	C	.	.	H	α-helix	trans	-65.3	-36.3	-174	-173.5	-116	0	0	0	114.4	E680 I681 K682 P703 H705 I708	W678-E680 VanDerWaalsContact C-N 3.34Å; W678-I681 HydrophobicContact CE3-CG2 4.41Å; W678-I681 HydrophobicContact CZ3-CG2 4.43Å; W678-K682 HydrophobicContact CD2-CG 4.16Å; W678-K682 VanDerWaalsContact CH2-CE 3.48Å; W678-K682 HydrophobicContact CZ2-CD 4.17Å; W678-K682 HydrophobicContact CZ2-CG 4.03Å; W678-K682 WeakPolarHBondContact O-CB 3.13Å; W678-K682 PolarHBondContact O-N 3.1Å; W678-P703 HydrophobicContact CZ3-CB 4.27Å; W678-H705 HydrophobicContact CE3-CB 3.74Å; W678-H705 AromaticContact CE3-CG 3.92Å; W678-H705 HydrophobicContact CZ3-CB 3.93Å; W678-I708 HydrophobicContact CH2-CD1 4.01Å; W678-I708 HydrophobicContact CH2-CG1 4.13Å; W678-I708 HydrophobicContact CZ3-CD1 3.69Å; W678-I708 HydrophobicContact CZ3-CG1 3.98Å
679	Q	83.5	Confident	92.2	Very high	87 Å²	87	24 Å²	24	41%	0.407	12%	0.119	S	C	.	.	H	α-helix	trans	-58.8	-49.5	178	-80.3	165.3	-47.3	0	0	110.6	G677 K682 G683 L915	G677-Q679 PolarHBondContact O-N 2.79Å; Q679-K682 PolarHBondContact O-N 2.88Å; Q679-G683 PolarHBondContact O-N 3.32Å; Q679-L915 HydrophobicContact CB-CD1 4.07Å; Q679-L915 HydrophobicContact CG-CD1 3.25Å; Q679-L915 HydrophobicContact CG-CD2 3.38Å; Q679-L915 HydrophobicContact CG-CG 3.89Å; Q679-L915 VanDerWaalsContact NE2-CD2 3.26Å
680	E	92.4	Very high	92.1	Very high	29 Å²	29	28.4 Å²	28.4	14%	0.136	13%	0.132	C	C	.	.	H	α-helix	trans	-70.9	-41.5	-176.4	-55.9	78.1	-168.5	0	0	110.3	L650 L652 L675 P676 G677 W678 K682 G683 V684 K753	L650-E680 HydrophobicContact CD2-CB 4.41Å; L650-E680 HydrophobicContact CD2-CG 4.42Å; L652-E680 HydrophobicContact CD2-CB 3.95Å; L652-E680 HydrophobicContact CD2-CG 4.2Å; L675-E680 HydrophobicContact CB-CB 4.24Å; P676-E680 HydrophobicContact CB-CG 4.34Å; P676-E680 HydrophobicContact CG-CG 4.14Å; G677-E680 WeakPolarHBondContact CA-OE2 3.1Å; G677-E680 PolarHBondContact N-OE2 3.13Å; G677-E680 PolarHBondContact O-N 3.3Å; G677-E680 VanDerWaalsContact O-OE2 3.09Å; W678-E680 VanDerWaalsContact C-N 3.34Å; E680-K682 VanDerWaalsContact C-N 3.34Å; E680-K682 PolarHBondContact O-N 3.31Å; E680-G683 PolarHBondContact O-N 2.7Å; E680-V684 WeakPolarHBondContact O-CG2 3.37Å; E680-V684 PolarHBondContact O-N 3.26Å; E680-K753 WeakPolarHBondContact OE1-CE 3.31Å; E680-K753 IonicContact OE1-NZ 3.7Å; E680-K753 PolarHBondContact OE1-NZ 3.14Å; E680-K753 IonicContact OE2-NZ 3.27Å; E680-K753 PolarHBondContact OE2-NZ 2.79Å
681	I	92	Very high	91.8	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-56	-47.9	172.6	-72	168.3	0	0	0	111.1	L675 G677 W678 Q685 P703 H705 L729 T731	L675-I681 HydrophobicContact CB-CG1 3.9Å; L675-I681 HydrophobicContact CD1-CB 4.37Å; L675-I681 HydrophobicContact CD1-CG1 3.86Å; L675-I681 HydrophobicContact CG-CG1 4.49Å; G677-I681 VanDerWaalsContact O-CG1 3.27Å; G677-I681 WeakPolarHBondContact O-CG1 3.46Å; G677-I681 PolarHBondContact O-N 3.19Å; W678-I681 HydrophobicContact CE3-CG2 4.41Å; W678-I681 HydrophobicContact CZ3-CG2 4.43Å; I681-Q685 WeakPolarHBondContact O-CB 3.13Å; I681-Q685 PolarHBondContact O-N 2.64Å; I681-P703 HydrophobicContact CG2-CB 3.62Å; I681-H705 HydrophobicContact CD1-CB 4.39Å; I681-L729 HydrophobicContact CG1-CB 4.44Å; I681-L729 HydrophobicContact CG2-CB 3.99Å; I681-T731 HydrophobicContact CD1-CG2 3.77Å
682	K	88.2	Confident	91.3	Very high	69 Å²	69	32.2 Å²	32.2	30%	0.3	16%	0.16	S	C	.	.	H	α-helix	trans	-71.1	-39.4	-179.3	-78.3	-69.4	176.5	-169.1	0	112.8	W678 Q679 E680 Q685 Q686	W678-K682 HydrophobicContact CD2-CG 4.16Å; W678-K682 VanDerWaalsContact CH2-CE 3.48Å; W678-K682 HydrophobicContact CZ2-CD 4.17Å; W678-K682 HydrophobicContact CZ2-CG 4.03Å; W678-K682 WeakPolarHBondContact O-CB 3.13Å; W678-K682 PolarHBondContact O-N 3.1Å; Q679-K682 PolarHBondContact O-N 2.88Å; E680-K682 VanDerWaalsContact C-N 3.34Å; E680-K682 PolarHBondContact O-N 3.31Å; K682-Q685 PolarHBondContact O-N 3.02Å; K682-Q686 WeakPolarHBondContact O-CB 3.4Å; K682-Q686 PolarHBondContact O-N 2.82Å
683	G	90.8	Very high	90.4	Very high	10 Å²	10	33.5 Å²	33.5	10%	0.103	18%	0.175	C	C	.	.	H	α-helix	trans	-61.2	-45.3	177.1	0	0	0	0	0	112.1	Q679 E680 R687	Q679-G683 PolarHBondContact O-N 3.32Å; E680-G683 PolarHBondContact O-N 2.7Å; G683-R687 WeakPolarHBondContact O-CB 3.2Å; G683-R687 WeakPolarHBondContact O-CD 3.37Å; G683-R687 VanDerWaalsContact O-CG 3.29Å; G683-R687 WeakPolarHBondContact O-CG 3.36Å; G683-R687 PolarHBondContact O-N 3Å; G683-R687 VanDerWaalsContact O-N 3.11Å
684	V	95.2	Very high	88.8	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-68.4	-42.8	175	175.6	0	0	0	0	111.2	L652 V655 L675 E680 Q686 R687 L688 L729	L652-V684 HydrophobicContact CB-CG2 4.37Å; L652-V684 HydrophobicContact CD2-CG2 4.09Å; V655-V684 HydrophobicContact CB-CG2 4.01Å; V655-V684 HydrophobicContact CG1-CG1 3.94Å; V655-V684 HydrophobicContact CG1-CG2 3.78Å; L675-V684 HydrophobicContact CD1-CB 4.19Å; L675-V684 HydrophobicContact CD1-CG2 4.07Å; L675-V684 HydrophobicContact CD2-CG2 4.36Å; E680-V684 WeakPolarHBondContact O-CG2 3.37Å; E680-V684 PolarHBondContact O-N 3.26Å; V684-Q686 VanDerWaalsContact C-N 3.34Å; V684-Q686 PolarHBondContact O-N 2.8Å; V684-R687 PolarHBondContact O-N 2.87Å; V684-L688 HydrophobicContact CG1-CD1 3.81Å; V684-L688 HydrophobicContact CG1-CG 4.22Å; V684-L688 WeakPolarHBondContact O-CB 3.2Å; V684-L688 VanDerWaalsContact O-CG 3.28Å; V684-L688 WeakPolarHBondContact O-CG 3.28Å; V684-L688 PolarHBondContact O-N 2.86Å; V684-L729 HydrophobicContact CB-CD1 4.42Å; V684-L729 HydrophobicContact CG1-CD1 4.19Å; V684-L729 HydrophobicContact CG1-CD2 4Å
685	Q	92.3	Very high	87.6	Confident	18 Å²	18	47.1 Å²	47.1	8%	0.084	24%	0.241	C	C	.	.	H	α-helix	trans	-56.3	-49	177	-179.6	171.2	33.6	0	0	111.4	I681 K682 L688 Q689 I701 L729	I681-Q685 WeakPolarHBondContact O-CB 3.13Å; I681-Q685 PolarHBondContact O-N 2.64Å; K682-Q685 PolarHBondContact O-N 3.02Å; Q685-L688 PolarHBondContact O-N 3.26Å; Q685-Q689 WeakPolarHBondContact O-CG 3.5Å; Q685-Q689 PolarHBondContact O-N 2.74Å; Q685-I701 HydrophobicContact CG-CG2 4.05Å; Q685-L729 HydrophobicContact CB-CD1 3.76Å
686	Q	89.9	Confident	86.2	Confident	72 Å²	72	52.3 Å²	52.3	34%	0.336	27%	0.265	S	S	.	.	H	α-helix	trans	-62.6	-49.1	-179.6	-179.3	180	-11.1	0	0	111.3	K682 V684 L688 Q689 E690 Q916	K682-Q686 WeakPolarHBondContact O-CB 3.4Å; K682-Q686 PolarHBondContact O-N 2.82Å; V684-Q686 VanDerWaalsContact C-N 3.34Å; V684-Q686 PolarHBondContact O-N 2.8Å; Q686-L688 VanDerWaalsContact C-N 3.3Å; Q686-L688 PolarHBondContact O-N 3.49Å; Q686-Q689 PolarHBondContact O-N 3.46Å; Q686-Q689 VanDerWaalsContact O-N 3.15Å; Q686-E690 HydrophobicContact CG-CG 4.42Å; Q686-E690 WeakPolarHBondContact CG-OE1 3.48Å; Q686-E690 PolarHBondContact NE2-OE1 3.04Å; Q686-E690 WeakPolarHBondContact O-CG 3.31Å; Q686-E690 PolarHBondContact O-N 2.79Å; Q686-Q916 VanDerWaalsContact OE1-NE2 3.14Å
687	R	94	Very high	85.7	Confident	41 Å²	41	56.9 Å²	56.9	16%	0.155	30%	0.297	C	S	.	.	H	α-helix	trans	-59.2	-40.4	178.6	-74.2	168.3	164.6	72.1	-3.3	112.1	E191 D653 T656 G683 V684 E690 A691	E191-R687 VanDerWaalsContact CD-NH2 3.26Å; E191-R687 IonicContact OE1-CZ 2.68Å; E191-R687 IonicContact OE1-NH1 3.85Å; E191-R687 PolarHBondContact OE1-NH1 2.74Å; E191-R687 IonicContact OE1-NH2 3.77Å; E191-R687 PolarHBondContact OE1-NH2 3.32Å; E191-R687 IonicContact OE2-NH2 2.79Å; E191-R687 PolarHBondContact OE2-NH2 2.99Å; D653-R687 WeakPolarHBondContact OD1-CD 3.38Å; D653-R687 IonicContact OD1-CZ 3.73Å; D653-R687 IonicContact OD1-NE 3.26Å; D653-R687 PolarHBondContact OD1-NE 2.88Å; D653-R687 IonicContact OD1-NH2 2.64Å; T656-R687 HydrophobicContact CG2-CB 3.8Å; G683-R687 WeakPolarHBondContact O-CB 3.2Å; G683-R687 WeakPolarHBondContact O-CD 3.37Å; G683-R687 VanDerWaalsContact O-CG 3.29Å; G683-R687 WeakPolarHBondContact O-CG 3.36Å; G683-R687 PolarHBondContact O-N 3Å; G683-R687 VanDerWaalsContact O-N 3.11Å; V684-R687 PolarHBondContact O-N 2.87Å; R687-E690 PolarHBondContact O-N 2.98Å; R687-A691 VanDerWaalsContact O-CB 3.27Å; R687-A691 WeakPolarHBondContact O-CB 3.37Å; R687-A691 PolarHBondContact O-N 2.84Å
688	L	93.9	Very high	85.7	Confident	0 Å²	0	62 Å²	62	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-63.8	-46.9	173.7	-72.5	172.3	0	0	0	111.8	T656 V659 L660 V684 Q685 Q686 E690 A691 L692 I701 I727 L729	T656-L688 HydrophobicContact CG2-CD2 3.88Å; T656-L688 HydrophobicContact CG2-CG 4.22Å; V659-L688 HydrophobicContact CB-CD2 4Å; V659-L688 HydrophobicContact CG1-CD1 4.03Å; V659-L688 HydrophobicContact CG1-CD2 3.65Å; L660-L688 HydrophobicContact CD2-CD2 4Å; L660-L688 HydrophobicContact CG-CD2 4.09Å; V684-L688 HydrophobicContact CG1-CD1 3.81Å; V684-L688 HydrophobicContact CG1-CG 4.22Å; V684-L688 WeakPolarHBondContact O-CB 3.2Å; V684-L688 VanDerWaalsContact O-CG 3.28Å; V684-L688 WeakPolarHBondContact O-CG 3.28Å; V684-L688 PolarHBondContact O-N 2.86Å; Q685-L688 PolarHBondContact O-N 3.26Å; Q686-L688 VanDerWaalsContact C-N 3.3Å; Q686-L688 PolarHBondContact O-N 3.49Å; L688-E690 VanDerWaalsContact C-N 3.32Å; L688-E690 PolarHBondContact O-N 2.77Å; L688-A691 PolarHBondContact O-N 2.7Å; L688-L692 HydrophobicContact CB-CD1 4.26Å; L688-L692 WeakPolarHBondContact O-CB 3.01Å; L688-L692 WeakPolarHBondContact O-CD1 3.33Å; L688-L692 WeakPolarHBondContact O-CG 3.42Å; L688-L692 PolarHBondContact O-N 2.8Å; L688-I701 HydrophobicContact CB-CD1 3.98Å; L688-I727 HydrophobicContact CD1-CG2 4.17Å; L688-L729 HydrophobicContact CD1-CD1 4.5Å; L688-L729 HydrophobicContact CD1-CD2 4.48Å
689	Q	90.1	Very high	86.1	Confident	77 Å²	77	61.3 Å²	61.3	36%	0.36	32%	0.316	S	S	.	.	H	α-helix	trans	-61.5	-40.8	178.5	-73	178.3	-57.9	0	0	112	Q685 Q686 G693 E696 I701	Q685-Q689 WeakPolarHBondContact O-CG 3.5Å; Q685-Q689 PolarHBondContact O-N 2.74Å; Q686-Q689 PolarHBondContact O-N 3.46Å; Q686-Q689 VanDerWaalsContact O-N 3.15Å; Q689-G693 PolarHBondContact O-N 2.91Å; Q689-E696 PolarHBondContact NE2-OE1 3.2Å; Q689-I701 HydrophobicContact CG-CD1 4.01Å
690	E	89.9	Confident	86.5	Confident	119 Å²	119	59.9 Å²	59.9	56%	0.556	31%	0.311	S	S	*	.	H	α-helix	trans	-65.9	-42.9	176.3	-71.2	176.4	-174.4	0	0	112.2	Q686 R687 L688	Q686-E690 HydrophobicContact CG-CG 4.42Å; Q686-E690 WeakPolarHBondContact CG-OE1 3.48Å; Q686-E690 PolarHBondContact NE2-OE1 3.04Å; Q686-E690 WeakPolarHBondContact O-CG 3.31Å; Q686-E690 PolarHBondContact O-N 2.79Å; R687-E690 PolarHBondContact O-N 2.98Å; L688-E690 VanDerWaalsContact C-N 3.32Å; L688-E690 PolarHBondContact O-N 2.77Å
691	A	88.5	Confident	86.5	Confident	62 Å²	62	59.7 Å²	59.7	51%	0.512	31%	0.311	S	S	.	.	H	α-helix	trans	-70.8	-37.5	179.1	0	0	0	0	0	113.1	L660 R687 L688	L660-A691 HydrophobicContact CD1-CB 3.78Å; L660-A691 HydrophobicContact CD2-CB 4.36Å; R687-A691 VanDerWaalsContact O-CB 3.27Å; R687-A691 WeakPolarHBondContact O-CB 3.37Å; R687-A691 PolarHBondContact O-N 2.84Å; L688-A691 PolarHBondContact O-N 2.7Å
692	L	86	Confident	86.4	Confident	19 Å²	19	61 Å²	61	10%	0.099	32%	0.317	C	S	.	.	H	α-helix	trans	-82	-25.6	-177.3	-62.8	170.1	0	0	0	112.5	L660 L688 M694 H695 Y699 I701	L660-L692 HydrophobicContact CD2-CD2 3.51Å; L660-L692 HydrophobicContact CD2-CG 4.01Å; L688-L692 HydrophobicContact CB-CD1 4.26Å; L688-L692 WeakPolarHBondContact O-CB 3.01Å; L688-L692 WeakPolarHBondContact O-CD1 3.33Å; L688-L692 WeakPolarHBondContact O-CG 3.42Å; L688-L692 PolarHBondContact O-N 2.8Å; L692-M694 PolarHBondContact O-N 3.36Å; L692-H695 PolarHBondContact O-N 2.89Å; L692-Y699 HydrophobicContact CB-CD2 4.06Å; L692-Y699 HydrophobicContact CB-CE2 4Å; L692-Y699 HydrophobicContact CD1-CD1 4.12Å; L692-Y699 HydrophobicContact CD1-CD2 3.79Å; L692-Y699 HydrophobicContact CD1-CE1 4.48Å; L692-Y699 HydrophobicContact CD1-CE2 4.13Å; L692-Y699 HydrophobicContact CD1-CG 3.79Å; L692-Y699 HydrophobicContact CD2-CD2 4.17Å; L692-Y699 HydrophobicContact CD2-CE1 4.09Å; L692-Y699 HydrophobicContact CD2-CE2 3.63Å; L692-Y699 HydrophobicContact CG-CD2 4.21Å; L692-Y699 HydrophobicContact CG-CE2 4.12Å; L692-I701 HydrophobicContact CD1-CD1 4.18Å
693	G	76	Confident	86.5	Confident	32 Å²	32	59.1 Å²	59.1	33%	0.33	31%	0.312	S	S	.	.	G	3₁₀ helix	trans	48.9	-120.9	167	0	0	0	0	0	114.7	Q689 H695 E696	Q689-G693 PolarHBondContact O-N 2.91Å; G693-H695 PolarHBondContact O-N 3.5Å; G693-H695 VanDerWaalsContact O-N 3.08Å; G693-E696 PolarHBondContact O-N 3.15Å
694	M	63.5	Low	86.3	Confident	181 Å²	181	58.6 Å²	58.6	89%	0.892	31%	0.308	S	S	*	.	G	3₁₀ helix	trans	-65.3	-9.2	-176.7	-61.1	-74.6	89.9	0	0	114.6	L692	L692-M694 PolarHBondContact O-N 3.36Å
695	H	72.1	Confident	85.8	Confident	105 Å²	105	59.8 Å²	59.8	49%	0.486	31%	0.313	S	S	.	.	G	3₁₀ helix	trans	-95.9	13.8	178.6	-63.7	-54.8	0	0	0	113.2	L692 G693 S697 K698 Y699	L692-H695 PolarHBondContact O-N 2.89Å; G693-H695 PolarHBondContact O-N 3.5Å; G693-H695 VanDerWaalsContact O-N 3.08Å; H695-S697 PolarHBondContact O-N 3.38Å; H695-K698 HydrophobicContact CB-CD 4.48Å; H695-K698 WeakPolarHBondContact O-CB 3.34Å; H695-K698 PolarHBondContact O-N 3.42Å; H695-Y699 HydrophobicContact CB-CE2 3.81Å; H695-Y699 WeakPolarHBondContact O-CD2 3.44Å; H695-Y699 VanDerWaalsContact O-CE2 3.27Å; H695-Y699 WeakPolarHBondContact O-CE2 3.38Å
696	E	68.5	Low	84.9	Confident	111 Å²	111	62.6 Å²	62.6	52%	0.519	33%	0.334	S	S	.	.	G	3₁₀ helix	trans	-51.1	-33.6	-177.1	-166.9	170.2	-159.5	0	0	113.5	Q689 G693 K698 Y699	Q689-E696 PolarHBondContact NE2-OE1 3.2Å; G693-E696 PolarHBondContact O-N 3.15Å; E696-K698 PolarHBondContact O-N 2.87Å; E696-K698 VanDerWaalsContact O-N 3.13Å; E696-Y699 PolarHBondContact O-N 3.28Å; E696-Y699 VanDerWaalsContact O-O 3.05Å
697	S	80.4	Confident	83.9	Confident	104 Å²	104	63.8 Å²	63.8	73%	0.727	34%	0.343	S	S	*	.	G	3₁₀ helix	trans	-64.2	-16.5	176.8	59.6	0	0	0	0	115	H695 Y699	H695-S697 PolarHBondContact O-N 3.38Å; S697-Y699 VanDerWaalsContact C-N 3.35Å
698	K	89.2	Confident	82.8	Confident	108 Å²	108	62.8 Å²	62.8	47%	0.47	34%	0.341	S	S	.	.	G	3₁₀ helix	trans	-86.5	-4.6	174.7	-63.8	-173.9	176.4	-177.2	0	113.2	H695 E696 V724 R725	H695-K698 HydrophobicContact CB-CD 4.48Å; H695-K698 WeakPolarHBondContact O-CB 3.34Å; H695-K698 PolarHBondContact O-N 3.42Å; E696-K698 PolarHBondContact O-N 2.87Å; E696-K698 VanDerWaalsContact O-N 3.13Å; K698-V724 CarbonylContact O-C 3.32Å; K698-V724 VanDerWaalsContact O-CA 3.26Å; K698-V724 WeakPolarHBondContact O-CA 3.39Å; K698-R725 PolarHBondContact O-N 3.11Å
699	Y	91.7	Very high	81.4	Confident	43 Å²	43	63.8 Å²	63.8	17%	0.169	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	136.6	-173.6	-52.5	-77.5	0	0	0	111.2	D663 L692 H695 E696 S697 R725 I727	D663-Y699 WeakPolarHBondContact OD1-CE1 3.15Å; D663-Y699 WeakPolarHBondContact OD2-CE1 3.35Å; D663-Y699 PolarHBondContact OD2-OH 3.44Å; L692-Y699 HydrophobicContact CB-CD2 4.06Å; L692-Y699 HydrophobicContact CB-CE2 4Å; L692-Y699 HydrophobicContact CD1-CD1 4.12Å; L692-Y699 HydrophobicContact CD1-CD2 3.79Å; L692-Y699 HydrophobicContact CD1-CE1 4.48Å; L692-Y699 HydrophobicContact CD1-CE2 4.13Å; L692-Y699 HydrophobicContact CD1-CG 3.79Å; L692-Y699 HydrophobicContact CD2-CD2 4.17Å; L692-Y699 HydrophobicContact CD2-CE1 4.09Å; L692-Y699 HydrophobicContact CD2-CE2 3.63Å; L692-Y699 HydrophobicContact CG-CD2 4.21Å; L692-Y699 HydrophobicContact CG-CE2 4.12Å; H695-Y699 HydrophobicContact CB-CE2 3.81Å; H695-Y699 WeakPolarHBondContact O-CD2 3.44Å; H695-Y699 VanDerWaalsContact O-CE2 3.27Å; H695-Y699 WeakPolarHBondContact O-CE2 3.38Å; E696-Y699 PolarHBondContact O-N 3.28Å; E696-Y699 VanDerWaalsContact O-O 3.05Å; S697-Y699 VanDerWaalsContact C-N 3.35Å; Y699-R725 CarbonylContact C-O 3.53Å; Y699-R725 WeakPolarHBondContact CA-O 3.27Å; Y699-R725 HydrophobicContact CD1-CB 3.92Å; Y699-R725 HydrophobicContact CE1-CB 4.25Å; Y699-I727 HydrophobicContact CD1-CD1 4.4Å
700	L	91.7	Very high	80.6	Confident	58 Å²	58	61.8 Å²	61.8	30%	0.304	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	93.4	171.9	-179	61.6	0	0	0	108.7	L702 V724 R725 K726 I727	L700-L702 HydrophobicContact CD1-CD2 3.82Å; L700-L702 HydrophobicContact CD1-CG 4.3Å; L700-L702 HydrophobicContact CD2-CD1 4.08Å; L700-L702 HydrophobicContact CD2-CG 4.44Å; L700-L702 HydrophobicContact CG-CD1 4.09Å; L700-L702 HydrophobicContact CG-CD2 3.99Å; L700-L702 HydrophobicContact CG-CG 3.9Å; L700-V724 HydrophobicContact CB-CG1 3.87Å; L700-R725 PolarHBondContact N-O 3.23Å; L700-K726 HydrophobicContact CD2-CG 4.44Å; L700-K726 WeakPolarHBondContact O-CA 3.4Å; L700-I727 PolarHBondContact O-N 3.4Å
701	I	92.2	Very high	79.6	Confident	25 Å²	25	63.5 Å²	63.5	13%	0.128	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	110.8	-178.6	-52.5	175.5	0	0	0	109.7	Q685 L688 Q689 L692 I727 L729	Q685-I701 HydrophobicContact CG-CG2 4.05Å; L688-I701 HydrophobicContact CB-CD1 3.98Å; Q689-I701 HydrophobicContact CG-CD1 4.01Å; L692-I701 HydrophobicContact CD1-CD1 4.18Å; I701-I727 CarbonylContact C-O 3.53Å; I701-I727 WeakPolarHBondContact CA-O 3.47Å; I701-I727 HydrophobicContact CG1-CB 4.38Å; I701-I727 HydrophobicContact CG1-CD1 4.41Å; I701-L729 HydrophobicContact CG2-CD1 3.94Å; I701-L729 HydrophobicContact CG2-CG 4.36Å
702	L	91.4	Very high	78.9	Confident	26 Å²	26	64.4 Å²	64.4	14%	0.136	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	104.3	-173.8	-61	177.2	0	0	0	110.8	L700 A715 I716 K726 I727 V728 L729	L700-L702 HydrophobicContact CD1-CD2 3.82Å; L700-L702 HydrophobicContact CD1-CG 4.3Å; L700-L702 HydrophobicContact CD2-CD1 4.08Å; L700-L702 HydrophobicContact CD2-CG 4.44Å; L700-L702 HydrophobicContact CG-CD1 4.09Å; L700-L702 HydrophobicContact CG-CD2 3.99Å; L700-L702 HydrophobicContact CG-CG 3.9Å; L702-A715 HydrophobicContact CD1-CB 4.43Å; L702-A715 HydrophobicContact CD2-CB 4.33Å; L702-I716 HydrophobicContact CB-CG2 4.36Å; L702-I716 HydrophobicContact CD1-CG2 4.23Å; L702-K726 HydrophobicContact CD1-CG 4.3Å; L702-I727 PolarHBondContact N-O 3.43Å; L702-V728 CarbonylContact O-C 3.55Å; L702-V728 WeakPolarHBondContact O-CA 3.25Å; L702-L729 PolarHBondContact O-N 2.89Å
703	P	90.2	Very high	78.5	Confident	30 Å²	30	63.8 Å²	63.8	20%	0.195	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	142.3	169.4	30.4	-33.4	0	0	0	110.4	W678 I681 I708 L729	W678-P703 HydrophobicContact CZ3-CB 4.27Å; I681-P703 HydrophobicContact CG2-CB 3.62Å; P703-I708 VanDerWaalsContact C-CD1 3.48Å; P703-I708 HydrophobicContact CB-CD1 3.9Å; P703-I708 HydrophobicContact CG-CD1 3.97Å; P703-I708 WeakPolarHBondContact O-CD1 3.42Å; P703-L729 CarbonylContact C-O 3.56Å; P703-L729 WeakPolarHBondContact CA-O 3.28Å
704	V	85.9	Confident	78.7	Confident	0 Å²	0	65.2 Å²	65.2	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	116.6	176.9	-163.8	0	0	0	0	109.3	Q713 I716 V728 L729 A730 T731 I733	V704-Q713 HydrophobicContact CG1-CG 4.28Å; V704-I716 HydrophobicContact CG1-CD1 4.45Å; V704-I716 HydrophobicContact CG2-CD1 4.48Å; V704-I716 HydrophobicContact CG2-CG2 3.45Å; V704-I716 VanDerWaalsContact CG2-CG2 3.45Å; V704-V728 HydrophobicContact CG2-CG1 3.46Å; V704-V728 VanDerWaalsContact CG2-CG1 3.46Å; V704-L729 PolarHBondContact N-O 3.46Å; V704-A730 HydrophobicContact CB-CB 3.84Å; V704-A730 HydrophobicContact CG2-CB 4.25Å; V704-A730 WeakPolarHBondContact O-CA 3.24Å; V704-T731 PolarHBondContact O-N 2.91Å; V704-I733 HydrophobicContact CB-CG2 4.25Å; V704-I733 HydrophobicContact CG1-CG2 3.62Å
705	H	84.9	Confident	79.6	Confident	25 Å²	25	57.9 Å²	57.9	12%	0.116	31%	0.306	C	S	.	.			trans	-150.2	154.6	-178.2	-174.7	-90.5	0	0	0	108.5	W678 I681 N707 I708 Q713 T731	W678-H705 HydrophobicContact CE3-CB 3.74Å; W678-H705 AromaticContact CE3-CG 3.92Å; W678-H705 HydrophobicContact CZ3-CB 3.93Å; I681-H705 HydrophobicContact CD1-CB 4.39Å; H705-N707 WeakPolarHBondContact ND1-CB 3.26Å; H705-N707 PolarHBondContact ND1-N 3.49Å; H705-N707 PolarHBondContact O-N 2.64Å; H705-N707 VanDerWaalsContact O-N 3.08Å; H705-I708 HydrophobicContact CB-CD1 4.36Å; H705-I708 HydrophobicContact CB-CG1 4.33Å; H705-I708 WeakPolarHBondContact O-CB 3.41Å; H705-I708 PolarHBondContact O-N 2.97Å; H705-Q713 PolarHBondContact O-NE2 2.88Å; H705-Q713 VanDerWaalsContact O-NE2 3.15Å; H705-T731 VanDerWaalsContact CD2-CG2 3.49Å; H705-T731 WeakPolarHBondContact CD2-CG2 3.39Å
706	S	73.5	Confident	80.2	Confident	76 Å²	76	53 Å²	53	53%	0.531	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.9	-31.2	178	53.9	0	0	0	0	113.2	I708	S706-I708 VanDerWaalsContact C-N 3.32Å; S706-I708 PolarHBondContact O-N 3.35Å
707	N	68.1	Low	81	Confident	97 Å²	97	50.7 Å²	50.7	52%	0.519	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-15.2	176.9	-66	-4.8	0	0	0	114.4	H705 R908	H705-N707 WeakPolarHBondContact ND1-CB 3.26Å; H705-N707 PolarHBondContact ND1-N 3.49Å; H705-N707 PolarHBondContact O-N 2.64Å; H705-N707 VanDerWaalsContact O-N 3.08Å; N707-R908 PolarHBondContact O-NH1 2.9Å; N707-R908 VanDerWaalsContact O-NH1 3.13Å; N707-R908 PolarHBondContact O-NH2 2.87Å
708	I	71	Confident	81.2	Confident	20 Å²	20	52.1 Å²	52.1	10%	0.103	27%	0.267	C	S	.	.	S	Bend	trans	-79.4	136	178	-67.4	179.6	0	0	0	109.5	W678 P703 H705 S706 D712 Q713	W678-I708 HydrophobicContact CH2-CD1 4.01Å; W678-I708 HydrophobicContact CH2-CG1 4.13Å; W678-I708 HydrophobicContact CZ3-CD1 3.69Å; W678-I708 HydrophobicContact CZ3-CG1 3.98Å; P703-I708 VanDerWaalsContact C-CD1 3.48Å; P703-I708 HydrophobicContact CB-CD1 3.9Å; P703-I708 HydrophobicContact CG-CD1 3.97Å; P703-I708 WeakPolarHBondContact O-CD1 3.42Å; H705-I708 HydrophobicContact CB-CD1 4.36Å; H705-I708 HydrophobicContact CB-CG1 4.33Å; H705-I708 WeakPolarHBondContact O-CB 3.41Å; H705-I708 PolarHBondContact O-N 2.97Å; S706-I708 VanDerWaalsContact C-N 3.32Å; S706-I708 PolarHBondContact O-N 3.35Å; I708-D712 HydrophobicContact CG2-CB 3.63Å; I708-Q713 HydrophobicContact CB-CG 4.14Å; I708-Q713 HydrophobicContact CG2-CG 3.9Å; I708-Q713 PolarHBondContact O-NE2 2.79Å
709	P	65.4	Low	80.9	Confident	22 Å²	22	55 Å²	55	14%	0.143	28%	0.282	C	S	.	.			trans	-56.8	147.5	177.4	-26.2	35.9	0	0	0	113.5	M711 D712 Q713 Y968 P970	P709-M711 PolarHBondContact O-N 2.92Å; P709-M711 VanDerWaalsContact O-N 3.15Å; P709-D712 WeakPolarHBondContact CD-OD2 3.34Å; P709-D712 PolarHBondContact O-N 2.74Å; P709-Q713 PolarHBondContact O-N 2.7Å; P709-Y968 WeakPolarHBondContact CD-OH 3.48Å; P709-Y968 HydrophobicContact CG-CE1 3.54Å; P709-Y968 WeakPolarHBondContact CG-OH 3.5Å; P709-P970 HydrophobicContact CB-CB 4.08Å; P709-P970 HydrophobicContact CG-CB 3.43Å; P709-P970 VanDerWaalsContact CG-CB 3.43Å; P709-P970 HydrophobicContact CG-CG 4Å
710	M	72	Confident	80.7	Confident	34 Å²	34	54.3 Å²	54.3	17%	0.167	28%	0.283	C	S	.	.	H	α-helix	trans	-54.1	-34.9	178.7	-83.6	-59.9	-50.1	0	0	114.3	R493 I494 K714	R493-M710 HydrophobicContact CG-SD 4.36Å; I494-M710 VanDerWaalsContact CA-CE 3.5Å; I494-M710 HydrophobicContact CB-CE 3.54Å; I494-M710 HydrophobicContact CB-SD 3.88Å; I494-M710 HydrophobicContact CD1-CE 4.05Å; I494-M710 HydrophobicContact CG1-CE 3.74Å; M710-K714 VanDerWaalsContact O-CG 3.32Å; M710-K714 WeakPolarHBondContact O-CG 3.48Å; M710-K714 PolarHBondContact O-N 3.47Å; M710-K714 VanDerWaalsContact O-N 3.17Å
711	M	70.2	Confident	80.5	Confident	155 Å²	155	55.7 Å²	55.7	76%	0.764	30%	0.295	S	S	*	.	H	α-helix	trans	-66.5	-39.5	177.7	-70.6	-110.1	-98.6	0	0	111.7	P709 K714	P709-M711 PolarHBondContact O-N 2.92Å; P709-M711 VanDerWaalsContact O-N 3.15Å; M711-K714 WeakPolarHBondContact O-CB 3.3Å; M711-K714 PolarHBondContact O-N 2.76Å
712	D	72.6	Confident	80.2	Confident	81 Å²	81	63.2 Å²	63.2	43%	0.433	34%	0.335	S	S	.	.	H	α-helix	trans	-77.1	-37.2	-179.6	-56.4	-22.3	0	0	0	110.5	I708 P709 K714 A715 Y968	I708-D712 HydrophobicContact CG2-CB 3.63Å; P709-D712 WeakPolarHBondContact CD-OD2 3.34Å; P709-D712 PolarHBondContact O-N 2.74Å; D712-K714 PolarHBondContact O-N 2.87Å; D712-A715 WeakPolarHBondContact O-CB 3.34Å; D712-A715 PolarHBondContact O-N 3.08Å; D712-Y968 PolarHBondContact OD2-OH 3.23Å
713	Q	77.2	Confident	80	Confident	7 Å²	7	65.7 Å²	65.7	3%	0.033	37%	0.366	C	S	.	.	H	α-helix	trans	-59	-31.7	171.5	-67	-174.1	26.2	0	0	111.8	I494 V704 H705 I708 P709 A715 I716 I733	I494-Q713 HydrophobicContact CD1-CB 3.83Å; V704-Q713 HydrophobicContact CG1-CG 4.28Å; H705-Q713 PolarHBondContact O-NE2 2.88Å; H705-Q713 VanDerWaalsContact O-NE2 3.15Å; I708-Q713 HydrophobicContact CB-CG 4.14Å; I708-Q713 HydrophobicContact CG2-CG 3.9Å; I708-Q713 PolarHBondContact O-NE2 2.79Å; P709-Q713 PolarHBondContact O-N 2.7Å; Q713-A715 PolarHBondContact O-N 3.07Å; Q713-I716 WeakPolarHBondContact O-CD1 3.22Å; Q713-I716 WeakPolarHBondContact O-CG1 3.45Å; Q713-I716 PolarHBondContact O-N 3.48Å; Q713-I733 VanDerWaalsContact OE1-CD1 3.32Å
714	K	80.4	Confident	80.1	Confident	62 Å²	62	65.7 Å²	65.7	27%	0.27	37%	0.366	S	S	.	.	G	3₁₀ helix	trans	-66.7	-17.5	176.4	-75.9	171.6	-179.1	-179.5	0	113.6	M710 M711 D712 I716 F717	M710-K714 VanDerWaalsContact O-CG 3.32Å; M710-K714 WeakPolarHBondContact O-CG 3.48Å; M710-K714 PolarHBondContact O-N 3.47Å; M710-K714 VanDerWaalsContact O-N 3.17Å; M711-K714 WeakPolarHBondContact O-CB 3.3Å; M711-K714 PolarHBondContact O-N 2.76Å; D712-K714 PolarHBondContact O-N 2.87Å; K714-I716 PolarHBondContact O-N 3.34Å; K714-I716 VanDerWaalsContact O-N 3.17Å; K714-F717 HydrophobicContact CB-CD2 4.2Å; K714-F717 HydrophobicContact CG-CD2 4.26Å; K714-F717 HydrophobicContact CG-CE2 4.28Å; K714-F717 WeakPolarHBondContact O-CD2 3.17Å; K714-F717 PolarHBondContact O-N 2.9Å
715	A	82.8	Confident	80.5	Confident	26 Å²	26	66.9 Å²	66.9	22%	0.215	37%	0.371	C	S	.	.	G	3₁₀ helix	trans	-59	-26.9	175.5	0	0	0	0	0	111.8	L702 D712 Q713 F717 Q718	L702-A715 HydrophobicContact CD1-CB 4.43Å; L702-A715 HydrophobicContact CD2-CB 4.33Å; D712-A715 WeakPolarHBondContact O-CB 3.34Å; D712-A715 PolarHBondContact O-N 3.08Å; Q713-A715 PolarHBondContact O-N 3.07Å; A715-F717 PolarHBondContact O-N 3.41Å; A715-Q718 PolarHBondContact O-N 3.32Å; A715-Q718 VanDerWaalsContact O-N 3.13Å
716	I	84.8	Confident	81	Confident	3 Å²	3	65.8 Å²	65.8	2%	0.015	37%	0.365	C	S	.	.	G	3₁₀ helix	trans	-66	-17.6	176.4	77.2	-167.8	0	0	0	113.6	L702 V704 Q713 K714 K726 V728 I738 V740	L702-I716 HydrophobicContact CB-CG2 4.36Å; L702-I716 HydrophobicContact CD1-CG2 4.23Å; V704-I716 HydrophobicContact CG1-CD1 4.45Å; V704-I716 HydrophobicContact CG2-CD1 4.48Å; V704-I716 HydrophobicContact CG2-CG2 3.45Å; V704-I716 VanDerWaalsContact CG2-CG2 3.45Å; Q713-I716 WeakPolarHBondContact O-CD1 3.22Å; Q713-I716 WeakPolarHBondContact O-CG1 3.45Å; Q713-I716 PolarHBondContact O-N 3.48Å; K714-I716 PolarHBondContact O-N 3.34Å; K714-I716 VanDerWaalsContact O-N 3.17Å; I716-K726 WeakPolarHBondContact O-CE 3.4Å; I716-K726 PolarHBondContact O-NZ 2.64Å; I716-V728 HydrophobicContact CG2-CG1 4.08Å; I716-I738 HydrophobicContact CD1-CD1 4.39Å; I716-I738 HydrophobicContact CD1-CG2 3.63Å; I716-I738 HydrophobicContact CG1-CG2 4.41Å; I716-V740 HydrophobicContact CB-CG2 4.45Å; I716-V740 HydrophobicContact CD1-CG2 4.26Å; I716-V740 HydrophobicContact CG1-CG2 4.05Å; I716-V740 VanDerWaalsContact O-CG1 3.27Å; I716-V740 WeakPolarHBondContact O-CG1 3.39Å
717	F	84.6	Confident	82	Confident	63 Å²	63	62.2 Å²	62.2	28%	0.276	34%	0.34	S	S	.	.	G	3₁₀ helix	trans	-85.8	-14.8	177.1	-58.7	-64.3	0	0	0	112.7	I494 K714 A715 I738 T739	I494-F717 HydrophobicContact CD1-CE2 3.95Å; I494-F717 HydrophobicContact CD1-CZ 4.13Å; I494-F717 HydrophobicContact CG1-CE2 4.12Å; I494-F717 HydrophobicContact CG1-CZ 4.12Å; K714-F717 HydrophobicContact CB-CD2 4.2Å; K714-F717 HydrophobicContact CG-CD2 4.26Å; K714-F717 HydrophobicContact CG-CE2 4.28Å; K714-F717 WeakPolarHBondContact O-CD2 3.17Å; K714-F717 PolarHBondContact O-N 2.9Å; A715-F717 PolarHBondContact O-N 3.41Å; F717-I738 HydrophobicContact CE1-CG2 3.48Å; F717-I738 VanDerWaalsContact CE1-CG2 3.48Å; F717-I738 HydrophobicContact CZ-CG2 3.69Å; F717-T739 WeakPolarHBondContact CD1-O 3.27Å
718	Q	84.8	Confident	83.3	Confident	134 Å²	134	57.7 Å²	57.7	63%	0.626	32%	0.316	S	S	*	.	S	Bend	trans	-76.9	136.2	-179.9	-61.5	179.7	6	0	0	109.8	A715 K726	A715-Q718 PolarHBondContact O-N 3.32Å; A715-Q718 VanDerWaalsContact O-N 3.13Å; Q718-K726 PolarHBondContact O-NZ 3.27Å
719	Q	84.2	Confident	84.5	Confident	167 Å²	167	56.7 Å²	56.7	78%	0.78	31%	0.311	S	S	*	.	P	Polyproline II helix	trans	-72.1	135	173.8	-166.2	168.2	0.6	0	0	108.9
720	P	87.8	Confident	85.8	Confident	29 Å²	29	55.7 Å²	55.7	19%	0.188	30%	0.304	C	S	.	.	P	Polyproline II helix	trans	-66.8	153.2	179.1	28.1	-35.6	0	0	0	110.5	V724 K726 D742	P720-V724 HydrophobicContact CB-CB 4.31Å; P720-V724 HydrophobicContact CB-CG1 4.34Å; P720-K726 HydrophobicContact CB-CB 4.17Å; P720-K726 HydrophobicContact CG-CB 4.04Å; P720-D742 WeakPolarHBondContact CD-OD2 3.44Å
721	P	87.3	Confident	86.8	Confident	87 Å²	87	54.5 Å²	54.5	57%	0.565	30%	0.299	S	S	*	.	P	Polyproline II helix	trans	-54.8	155.3	169.1	-22.9	33.1	0	0	0	112	G723 V724	P721-G723 PolarHBondContact O-N 3.4Å; P721-V724 HydrophobicContact CB-CB 4.43Å; P721-V724 HydrophobicContact CB-CG2 3.93Å; P721-V724 HydrophobicContact CG-CG2 4.29Å; P721-V724 WeakPolarHBondContact O-CB 3.42Å; P721-V724 PolarHBondContact O-N 2.91Å
722	L	86.1	Confident	87.6	Confident	184 Å²	184	49.6 Å²	49.6	96%	0.963	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	132.2	177.6	-72.5	167.7	0	0	0	111	V724	L722-V724 VanDerWaalsContact C-N 3.26Å; L722-V724 PolarHBondContact O-N 3.46Å
723	G	86.8	Confident	88.1	Confident	77 Å²	77	46.3 Å²	46.3	79%	0.794	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.6	0.2	-178.2	0	0	0	0	0	115.2	P721	P721-G723 PolarHBondContact O-N 3.4Å
724	V	92.1	Very high	88.5	Confident	30 Å²	30	46.2 Å²	46.2	18%	0.182	26%	0.258	C	S	.	.	P	Polyproline II helix	trans	-97.2	124.6	175.8	177.7	0	0	0	0	110.2	K698 L700 P720 P721 L722	K698-V724 CarbonylContact O-C 3.32Å; K698-V724 VanDerWaalsContact O-CA 3.26Å; K698-V724 WeakPolarHBondContact O-CA 3.39Å; L700-V724 HydrophobicContact CB-CG1 3.87Å; P720-V724 HydrophobicContact CB-CB 4.31Å; P720-V724 HydrophobicContact CB-CG1 4.34Å; P721-V724 HydrophobicContact CB-CB 4.43Å; P721-V724 HydrophobicContact CB-CG2 3.93Å; P721-V724 HydrophobicContact CG-CG2 4.29Å; P721-V724 WeakPolarHBondContact O-CB 3.42Å; P721-V724 PolarHBondContact O-N 2.91Å; L722-V724 VanDerWaalsContact C-N 3.26Å; L722-V724 PolarHBondContact O-N 3.46Å
725	R	93.8	Very high	88.7	Confident	26 Å²	26	43.7 Å²	43.7	10%	0.098	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	122.8	173.7	-174.6	90.1	-179.7	-169.8	10.1	109.5	I662 D663 E667 G669 K698 Y699 L700 I727 H745	I662-R725 VanDerWaalsContact CG2-NH2 3.31Å; D663-R725 WeakPolarHBondContact OD1-CG 3.34Å; E667-R725 PolarHBondContact O-NH1 2.7Å; G669-R725 WeakPolarHBondContact O-CD 3.32Å; G669-R725 PolarHBondContact O-NE 3.46Å; G669-R725 PolarHBondContact O-NH1 3.39Å; G669-R725 PolarHBondContact O-NH2 3.44Å; K698-R725 PolarHBondContact O-N 3.11Å; Y699-R725 CarbonylContact C-O 3.53Å; Y699-R725 WeakPolarHBondContact CA-O 3.27Å; Y699-R725 HydrophobicContact CD1-CB 3.92Å; Y699-R725 HydrophobicContact CE1-CB 4.25Å; L700-R725 PolarHBondContact N-O 3.23Å; R725-I727 HydrophobicContact CG-CG1 4.29Å; R725-H745 PolarHBondContact NH2-CD2 2.95Å; R725-H745 PolarHBondContact NH2-NE2 3.21Å
726	K	94.8	Very high	88.2	Confident	1 Å²	1	42.6 Å²	42.6	0%	0.004	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	131.2	173.9	-175.2	-177	178.8	177.5	0	110.8	G670 I671 L700 L702 I716 Q718 P720 V728 D742	G670-K726 CarbonylContact C-O 3.54Å; G670-K726 WeakPolarHBondContact CA-O 3.17Å; I671-K726 PolarHBondContact N-O 3.04Å; L700-K726 HydrophobicContact CD2-CG 4.44Å; L700-K726 WeakPolarHBondContact O-CA 3.4Å; L702-K726 HydrophobicContact CD1-CG 4.3Å; I716-K726 WeakPolarHBondContact O-CE 3.4Å; I716-K726 PolarHBondContact O-NZ 2.64Å; Q718-K726 PolarHBondContact O-NZ 3.27Å; P720-K726 HydrophobicContact CB-CB 4.17Å; P720-K726 HydrophobicContact CG-CB 4.04Å; K726-V728 HydrophobicContact CD-CG2 4.31Å; K726-V728 HydrophobicContact CG-CG2 4.05Å; K726-D742 WeakPolarHBondContact CD-OD2 3.48Å; K726-D742 IonicContact NZ-OD1 3.55Å; K726-D742 PolarHBondContact NZ-OD1 3.18Å; K726-D742 IonicContact NZ-OD2 3Å; K726-D742 PolarHBondContact NZ-OD2 2.97Å
727	I	95.6	Very high	87.5	Confident	1 Å²	1	43 Å²	43	1%	0.005	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	107.7	178.9	-54.7	174.9	0	0	0	107.7	V659 I671 L688 Y699 L700 I701 L702 R725 L729	V659-I727 HydrophobicContact CG1-CD1 3.93Å; V659-I727 HydrophobicContact CG1-CG2 4.16Å; I671-I727 HydrophobicContact CD1-CG1 4.36Å; I671-I727 CarbonylContact O-C 3.59Å; I671-I727 WeakPolarHBondContact O-CA 3.5Å; L688-I727 HydrophobicContact CD1-CG2 4.17Å; Y699-I727 HydrophobicContact CD1-CD1 4.4Å; L700-I727 PolarHBondContact O-N 3.4Å; I701-I727 CarbonylContact C-O 3.53Å; I701-I727 WeakPolarHBondContact CA-O 3.47Å; I701-I727 HydrophobicContact CG1-CB 4.38Å; I701-I727 HydrophobicContact CG1-CD1 4.41Å; L702-I727 PolarHBondContact N-O 3.43Å; R725-I727 HydrophobicContact CG-CG1 4.29Å; I727-L729 HydrophobicContact CG2-CD2 3.95Å; I727-L729 HydrophobicContact CG2-CG 4.44Å
728	V	95.3	Very high	86.9	Confident	2 Å²	2	40 Å²	40	1%	0.012	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	120.8	180	-174.8	0	0	0	0	108.8	I671 L672 C673 L702 V704 I716 K726 A730 I743	I671-V728 PolarHBondContact O-N 2.83Å; L672-V728 CarbonylContact C-O 3.55Å; L672-V728 WeakPolarHBondContact CA-O 3.45Å; L672-V728 HydrophobicContact CD1-CB 3.77Å; L672-V728 HydrophobicContact CD1-CG1 3.61Å; C673-V728 PolarHBondContact N-O 3.09Å; L702-V728 CarbonylContact O-C 3.55Å; L702-V728 WeakPolarHBondContact O-CA 3.25Å; V704-V728 HydrophobicContact CG2-CG1 3.46Å; V704-V728 VanDerWaalsContact CG2-CG1 3.46Å; I716-V728 HydrophobicContact CG2-CG1 4.08Å; K726-V728 HydrophobicContact CD-CG2 4.31Å; K726-V728 HydrophobicContact CG-CG2 4.05Å; V728-A730 HydrophobicContact CG1-CB 4.4Å; V728-I743 HydrophobicContact CG2-CD1 4.2Å
729	L	95.6	Very high	86.2	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	104.5	178.4	-56.1	178.8	0	0	0	108.4	C673 L675 I681 V684 Q685 L688 I701 L702 P703 V704 I727	C673-L729 HydrophobicContact CB-CD2 3.71Å; L675-L729 HydrophobicContact CD1-CB 4.29Å; L675-L729 HydrophobicContact CD1-CD2 4.38Å; I681-L729 HydrophobicContact CG1-CB 4.44Å; I681-L729 HydrophobicContact CG2-CB 3.99Å; V684-L729 HydrophobicContact CB-CD1 4.42Å; V684-L729 HydrophobicContact CG1-CD1 4.19Å; V684-L729 HydrophobicContact CG1-CD2 4Å; Q685-L729 HydrophobicContact CB-CD1 3.76Å; L688-L729 HydrophobicContact CD1-CD1 4.5Å; L688-L729 HydrophobicContact CD1-CD2 4.48Å; I701-L729 HydrophobicContact CG2-CD1 3.94Å; I701-L729 HydrophobicContact CG2-CG 4.36Å; L702-L729 PolarHBondContact O-N 2.89Å; P703-L729 CarbonylContact C-O 3.56Å; P703-L729 WeakPolarHBondContact CA-O 3.28Å; V704-L729 PolarHBondContact N-O 3.46Å; I727-L729 HydrophobicContact CG2-CD2 3.95Å; I727-L729 HydrophobicContact CG2-CG 4.44Å
730	A	93.9	Very high	85.9	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	152.2	-167.2	0	0	0	0	0	113.3	L672 C673 F674 L675 V704 V728 A734	L672-A730 HydrophobicContact CD1-CB 3.88Å; C673-A730 PolarHBondContact O-N 3.22Å; C673-A730 VanDerWaalsContact O-O 3.11Å; F674-A730 CarbonylContact C-O 3.55Å; F674-A730 WeakPolarHBondContact CA-O 3.45Å; L675-A730 PolarHBondContact N-O 2.82Å; V704-A730 HydrophobicContact CB-CB 3.84Å; V704-A730 HydrophobicContact CG2-CB 4.25Å; V704-A730 WeakPolarHBondContact O-CA 3.24Å; V728-A730 HydrophobicContact CG1-CB 4.4Å; A730-A734 HydrophobicContact CB-CB 3.61Å
731	T	91.9	Very high	85.5	Confident	9 Å²	9	32.4 Å²	32.4	6%	0.055	20%	0.198	C	C	.	.			trans	-80.6	-168.5	160.9	64.3	0	0	0	0	110.8	L675 I681 V704 H705 I733 A734	L675-T731 WeakPolarHBondContact O-CA 3.42Å; I681-T731 HydrophobicContact CD1-CG2 3.77Å; V704-T731 PolarHBondContact O-N 2.91Å; H705-T731 VanDerWaalsContact CD2-CG2 3.49Å; H705-T731 WeakPolarHBondContact CD2-CG2 3.39Å; T731-I733 PolarHBondContact O-N 3.4Å; T731-I733 PolarHBondContact OG1-N 3.35Å; T731-A734 PolarHBondContact O-N 3.35Å
732	N	88.3	Confident	85.6	Confident	52 Å²	52	29.2 Å²	29.2	28%	0.278	18%	0.177	S	C	.	.	G	3₁₀ helix	trans	-54.4	-8.7	170.5	67.3	-21.5	0	0	0	114.7	A734 E735	N732-A734 PolarHBondContact O-N 2.82Å; N732-E735 HydrophobicContact CB-CB 4.4Å; N732-E735 WeakPolarHBondContact O-CB 3.4Å; N732-E735 PolarHBondContact O-N 2.84Å
733	I	82.6	Confident	85.8	Confident	13 Å²	13	20.8 Å²	20.8	7%	0.067	13%	0.133	C	C	.	.	G	3₁₀ helix	trans	-58.2	-30.1	173.2	-166.9	166.9	0	0	0	113.4	V704 Q713 T731 E735 I738	V704-I733 HydrophobicContact CB-CG2 4.25Å; V704-I733 HydrophobicContact CG1-CG2 3.62Å; Q713-I733 VanDerWaalsContact OE1-CD1 3.32Å; T731-I733 PolarHBondContact O-N 3.4Å; T731-I733 PolarHBondContact OG1-N 3.35Å; I733-E735 VanDerWaalsContact C-N 3.33Å; I733-I738 HydrophobicContact CG1-CD1 4.33Å; I733-I738 WeakPolarHBondContact O-CD1 3.16Å
734	A	85.6	Confident	86.2	Confident	4 Å²	4	17.3 Å²	17.3	3%	0.033	10%	0.096	C	C	.	.	G	3₁₀ helix	trans	-88.1	-1.8	176.7	0	0	0	0	0	113.3	L672 F674 A730 T731 N732 R782	L672-A734 HydrophobicContact CD1-CB 4.1Å; L672-A734 HydrophobicContact CD2-CB 4.34Å; F674-A734 HydrophobicContact CE1-CB 3.94Å; F674-A734 HydrophobicContact CZ-CB 4.34Å; A730-A734 HydrophobicContact CB-CB 3.61Å; T731-A734 PolarHBondContact O-N 3.35Å; N732-A734 PolarHBondContact O-N 2.82Å; A734-R782 PolarHBondContact O-NE 3.49Å
735	E	84.1	Confident	86.4	Confident	9 Å²	9	15.9 Å²	15.9	4%	0.042	9%	0.087	C	C	.	.	S	Bend	trans	-76.5	-29	-170.3	-171.4	177.2	138	0	0	113.5	F674 N732 I733 N775 Q778 R779 R782	F674-E735 HydrophobicContact CE1-CB 4.01Å; N732-E735 HydrophobicContact CB-CB 4.4Å; N732-E735 WeakPolarHBondContact O-CB 3.4Å; N732-E735 PolarHBondContact O-N 2.84Å; I733-E735 VanDerWaalsContact C-N 3.33Å; E735-N775 WeakPolarHBondContact OE1-CA 3.47Å; E735-N775 VanDerWaalsContact OE1-CB 3.24Å; E735-N775 WeakPolarHBondContact OE1-CB 3.29Å; E735-N775 PolarHBondContact OE1-ND2 3.45Å; E735-Q778 HydrophobicContact CG-CB 3.98Å; E735-R779 HydrophobicContact CG-CG 3.91Å; E735-R779 IonicContact OE2-CZ 3.02Å; E735-R779 IonicContact OE2-NE 3.64Å; E735-R779 PolarHBondContact OE2-NE 3.42Å; E735-R779 VanDerWaalsContact OE2-NE 3.09Å; E735-R779 IonicContact OE2-NH2 2.7Å; E735-R779 PolarHBondContact OE2-NH2 3.34Å; E735-R782 VanDerWaalsContact C-CZ 3.41Å; E735-R782 PolarHBondContact O-NE 2.92Å; E735-R782 VanDerWaalsContact O-NE 3.11Å; E735-R782 PolarHBondContact O-NH2 3.14Å
736	T	73	Confident	86.6	Confident	4 Å²	4	14.7 Å²	14.7	3%	0.025	8%	0.083	C	C	.	.	S	Bend	trans	-132.2	149.3	-176.1	55.4	0	0	0	0	111	R492 E563 I738	R492-T736 PolarHBondContact NE-OG1 2.84Å; E563-T736 HydrophobicContact CG-CG2 3.83Å; E563-T736 WeakPolarHBondContact OE1-CB 3.28Å; E563-T736 PolarHBondContact OE1-OG1 3.42Å; T736-I738 PolarHBondContact O-N 3.45Å
737	S	69	Low	86.7	Confident	10 Å²	10	14.7 Å²	14.7	7%	0.07	8%	0.083	C	C	.	.	S	Bend	trans	53	-12.8	173.4	-30.6	0	0	0	0	121.3	S495 E560	S495-S737 VanDerWaalsContact CB-CB 3.5Å; S495-S737 WeakPolarHBondContact OG-CB 3.34Å; E560-S737 VanDerWaalsContact CD-OG 3.26Å; E560-S737 VanDerWaalsContact CG-OG 3.26Å; E560-S737 WeakPolarHBondContact CG-OG 3.43Å; E560-S737 WeakPolarHBondContact OE1-CA 3.46Å; E560-S737 WeakPolarHBondContact OE1-CB 3.3Å; E560-S737 PolarHBondContact OE1-N 2.8Å; E560-S737 PolarHBondContact OE1-OG 3.33Å
738	I	72.4	Confident	86.8	Confident	2 Å²	2	14.7 Å²	14.7	1%	0.01	8%	0.083	C	C	.	.			trans	-87.2	110.4	176.6	-61.3	-171.6	0	0	0	109.1	I494 I716 F717 I733 T736 V740 R782 R785	I494-I738 HydrophobicContact CD1-CD1 4.04Å; I494-I738 HydrophobicContact CG1-CD1 4.35Å; I494-I738 HydrophobicContact CG2-CD1 3.74Å; I494-I738 HydrophobicContact CG2-CG1 4.06Å; I716-I738 HydrophobicContact CD1-CD1 4.39Å; I716-I738 HydrophobicContact CD1-CG2 3.63Å; I716-I738 HydrophobicContact CG1-CG2 4.41Å; F717-I738 HydrophobicContact CE1-CG2 3.48Å; F717-I738 VanDerWaalsContact CE1-CG2 3.48Å; F717-I738 HydrophobicContact CZ-CG2 3.69Å; I733-I738 HydrophobicContact CG1-CD1 4.33Å; I733-I738 WeakPolarHBondContact O-CD1 3.16Å; T736-I738 PolarHBondContact O-N 3.45Å; I738-V740 HydrophobicContact CG2-CG2 3.84Å; I738-R782 PolarHBondContact O-NH1 3.43Å; I738-R785 PolarHBondContact O-NH1 3.21Å
739	T	69.5	Low	86.9	Confident	64 Å²	64	14.7 Å²	14.7	39%	0.393	8%	0.083	S	C	.	.			trans	-90	105.8	175.5	49.5	0	0	0	0	110.9	F717	F717-T739 WeakPolarHBondContact CD1-O 3.27Å
740	V	79.2	Confident	86.9	Confident	15 Å²	15	14.7 Å²	14.7	9%	0.091	8%	0.083	C	C	.	.			trans	-106.5	102	170.9	-172	0	0	0	0	107.8	I716 I738 D742 I743	I716-V740 HydrophobicContact CB-CG2 4.45Å; I716-V740 HydrophobicContact CD1-CG2 4.26Å; I716-V740 HydrophobicContact CG1-CG2 4.05Å; I716-V740 VanDerWaalsContact O-CG1 3.27Å; I716-V740 WeakPolarHBondContact O-CG1 3.39Å; I738-V740 HydrophobicContact CG2-CG2 3.84Å; V740-D742 VanDerWaalsContact C-N 3.26Å; V740-D742 WeakPolarHBondContact CG1-OD1 3.33Å; V740-D742 PolarHBondContact O-N 3.29Å; V740-I743 HydrophobicContact CB-CG1 3.81Å; V740-I743 HydrophobicContact CG1-CD1 3.99Å; V740-I743 HydrophobicContact CG1-CG1 3.56Å
741	N	79.3	Confident	86.9	Confident	90 Å²	90	14.8 Å²	14.8	48%	0.481	8%	0.084	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-22.4	-166.7	-61.8	-18.5	0	0	0	113.5
742	D	88.2	Confident	86.9	Confident	21 Å²	21	14.6 Å²	14.6	11%	0.112	8%	0.082	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.1	2	-173.2	59.2	-40.3	0	0	0	113.9	G670 P720 K726 V740	G670-D742 WeakPolarHBondContact CA-O 3.5Å; G670-D742 PolarHBondContact N-O 3.22Å; P720-D742 WeakPolarHBondContact CD-OD2 3.44Å; K726-D742 WeakPolarHBondContact CD-OD2 3.48Å; K726-D742 IonicContact NZ-OD1 3.55Å; K726-D742 PolarHBondContact NZ-OD1 3.18Å; K726-D742 IonicContact NZ-OD2 3Å; K726-D742 PolarHBondContact NZ-OD2 2.97Å; V740-D742 VanDerWaalsContact C-N 3.26Å; V740-D742 WeakPolarHBondContact CG1-OD1 3.33Å; V740-D742 PolarHBondContact O-N 3.29Å
743	I	91.8	Very high	87	Confident	7 Å²	7	14.3 Å²	14.3	4%	0.036	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	126.6	175.6	-60.4	-54.3	0	0	0	110.7	L672 V728 V740 V746	L672-I743 HydrophobicContact CB-CD1 4Å; L672-I743 HydrophobicContact CB-CG1 4.11Å; L672-I743 HydrophobicContact CB-CG2 3.75Å; V728-I743 HydrophobicContact CG2-CD1 4.2Å; V740-I743 HydrophobicContact CB-CG1 3.81Å; V740-I743 HydrophobicContact CG1-CD1 3.99Å; V740-I743 HydrophobicContact CG1-CG1 3.56Å; I743-V746 HydrophobicContact CG2-CG2 4.25Å
744	V	94.4	Very high	87.2	Confident	4 Å²	4	14.3 Å²	14.3	2%	0.024	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	-24.9	176	177.4	0	0	0	0	111.4	G670 A783 Q787 G789 F790	G670-V744 PolarHBondContact O-N 2.88Å; V744-A783 VanDerWaalsContact O-CB 3.25Å; V744-A783 WeakPolarHBondContact O-CB 3.09Å; V744-Q787 HydrophobicContact CG2-CG 4.11Å; V744-G789 CarbonylContact O-C 3.56Å; V744-G789 WeakPolarHBondContact O-CA 3.28Å; V744-F790 HydrophobicContact CG1-CD2 4.33Å; V744-F790 PolarHBondContact O-N 3.31Å
745	H	97.2	Very high	87.1	Confident	0 Å²	0	17.8 Å²	17.8	0%	0	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	126.2	-176.9	-56	-93.9	0	0	0	109.9	I662 E667 G670 I671 L672 R725 F790 Y792	I662-H745 HydrophobicContact CG2-CB 3.97Å; E667-H745 PolarHBondContact O-NE2 3.49Å; G670-H745 PolarHBondContact O-N 3.2Å; G670-H745 VanDerWaalsContact O-N 3.11Å; I671-H745 CarbonylContact C-O 3.55Å; I671-H745 WeakPolarHBondContact CA-O 3.49Å; I671-H745 HydrophobicContact CG1-CB 4.18Å; I671-H745 HydrophobicContact CG2-CB 4.42Å; L672-H745 PolarHBondContact N-O 2.85Å; R725-H745 PolarHBondContact NH2-CD2 2.95Å; R725-H745 PolarHBondContact NH2-NE2 3.21Å; H745-F790 CarbonylContact C-O 3.44Å; H745-F790 WeakPolarHBondContact CA-O 3.16Å; H745-F790 AromaticContact CE1-CD2 3.5Å; H745-F790 AromaticContact ND1-CD2 3.67Å; H745-Y792 HydrophobicContact CB-CE2 4.33Å; H745-Y792 AromaticContact ND1-CE2 3.78Å
746	V	96.6	Very high	87.1	Confident	0 Å²	0	22 Å²	22	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	129.3	170.2	173.3	0	0	0	0	109.4	L672 F674 I743 R782 A783 F790 A791 Y792	L672-V746 CarbonylContact O-C 3.58Å; L672-V746 VanDerWaalsContact O-CA 3.31Å; L672-V746 WeakPolarHBondContact O-CA 3.18Å; F674-V746 HydrophobicContact CD2-CG1 3.81Å; F674-V746 HydrophobicContact CE2-CG1 3.84Å; I743-V746 HydrophobicContact CG2-CG2 4.25Å; V746-R782 HydrophobicContact CG2-CB 3.85Å; V746-A783 HydrophobicContact CG2-CB 3.82Å; V746-F790 PolarHBondContact N-O 3.12Å; V746-A791 CarbonylContact O-C 3.52Å; V746-A791 WeakPolarHBondContact O-CA 3.46Å; V746-Y792 WeakPolarHBondContact O-CD2 3.14Å; V746-Y792 PolarHBondContact O-N 3.42Å
747	V	98	Very high	87.5	Confident	2 Å²	2	24.2 Å²	24.2	1%	0.012	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	119	166.5	178.7	0	0	0	0	107.4	L658 V659 I662 I671 L672 C673 F674 Y792 L794	L658-V747 HydrophobicContact CD2-CB 4.49Å; L658-V747 HydrophobicContact CD2-CG1 3.73Å; L658-V747 HydrophobicContact CD2-CG2 4.03Å; L658-V747 HydrophobicContact CG-CG2 4.3Å; V659-V747 HydrophobicContact CG2-CG2 4.42Å; I662-V747 HydrophobicContact CD1-CG2 3.72Å; I671-V747 HydrophobicContact CG2-CG2 4.14Å; L672-V747 PolarHBondContact O-N 3.45Å; C673-V747 CarbonylContact C-O 3.56Å; C673-V747 VanDerWaalsContact CA-O 3.3Å; C673-V747 WeakPolarHBondContact CA-O 3.5Å; C673-V747 HydrophobicContact CB-CB 4.22Å; F674-V747 PolarHBondContact N-O 2.9Å; V747-Y792 CarbonylContact C-O 3.54Å; V747-Y792 WeakPolarHBondContact CA-O 3.47Å; V747-L794 HydrophobicContact CG1-CD1 4.04Å; V747-L794 HydrophobicContact CG1-CG 4.37Å
748	D	97.5	Very high	88	Confident	0 Å²	0	25.5 Å²	25.5	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	116.6	-178.6	-169.2	0.1	0	0	0	110.4	G750 R779 Y792 H793 L794	D748-G750 PolarHBondContact O-N 3.29Å; D748-G750 PolarHBondContact OD1-N 3.04Å; D748-R779 VanDerWaalsContact CG-CD 3.42Å; D748-R779 VanDerWaalsContact OD1-CD 3.29Å; D748-R779 WeakPolarHBondContact OD1-CD 3.46Å; D748-R779 IonicContact OD1-CZ 3.9Å; D748-R779 IonicContact OD1-NE 3.86Å; D748-R779 IonicContact OD1-NH1 2.76Å; D748-R779 PolarHBondContact OD1-NH1 3.45Å; D748-R779 WeakPolarHBondContact OD2-CD 3.15Å; D748-Y792 PolarHBondContact N-O 3.36Å; D748-H793 IonicContact OD2-ND1 2.97Å; D748-L794 PolarHBondContact O-N 3.33Å
749	S	96.4	Very high	88	Confident	2 Å²	2	28.7 Å²	28.7	1%	0.014	14%	0.14	C	C	.	.			trans	-67.1	-18.8	172.8	58	0	0	0	0	113.2	F674 L751	F674-S749 VanDerWaalsContact O-CB 3.29Å; F674-S749 WeakPolarHBondContact O-CB 3.33Å; F674-S749 PolarHBondContact O-N 3.01Å; F674-S749 PolarHBondContact O-OG 2.93Å; S749-L751 PolarHBondContact O-N 2.98Å; S749-L751 PolarHBondContact OG-N 3.38Å; S749-L751 PolarHBondContact OG-O 3.21Å
750	G	95.3	Very high	88.1	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	16%	0.161	C	C	.	.	S	Bend	trans	71.8	4.5	-171.1	0	0	0	0	0	114	D748 W770 V771 F795	D748-G750 PolarHBondContact O-N 3.29Å; D748-G750 PolarHBondContact OD1-N 3.04Å; G750-W770 WeakPolarHBondContact O-CA 3.47Å; G750-W770 VanDerWaalsContact O-CE3 3.25Å; G750-V771 PolarHBondContact O-N 3.18Å; G750-F795 VanDerWaalsContact CA-CD1 3.46Å
751	L	94.8	Very high	87.7	Confident	2 Å²	2	35.4 Å²	35.4	1%	0.01	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	152.9	-175	-63.6	173.8	0	0	0	110.6	C648 L650 P676 S749 T768 V769 W770 R779	C648-L751 HydrophobicContact CB-CD2 3.89Å; L650-L751 HydrophobicContact CB-CD1 4.1Å; P676-L751 HydrophobicContact CG-CB 3.81Å; S749-L751 PolarHBondContact O-N 2.98Å; S749-L751 PolarHBondContact OG-N 3.38Å; S749-L751 PolarHBondContact OG-O 3.21Å; L751-T768 HydrophobicContact CB-CG2 4.06Å; L751-T768 HydrophobicContact CD1-CG2 4.25Å; L751-T768 HydrophobicContact CD2-CG2 4.34Å; L751-T768 HydrophobicContact CG-CG2 4.45Å; L751-V769 WeakPolarHBondContact CA-O 3.41Å; L751-W770 HydrophobicContact CD2-CD2 3.61Å; L751-W770 HydrophobicContact CD2-CE3 3.61Å; L751-W770 HydrophobicContact CD2-CG 4.14Å; L751-W770 HydrophobicContact CD2-CH2 4.12Å; L751-W770 HydrophobicContact CD2-CZ2 4.11Å; L751-W770 HydrophobicContact CD2-CZ3 3.87Å; L751-W770 HydrophobicContact CG-CE3 4.26Å; L751-W770 HydrophobicContact CG-CH2 4.47Å; L751-W770 HydrophobicContact CG-CZ3 4.14Å; L751-R779 PolarHBondContact O-NH1 2.81Å
752	H	92.7	Very high	87.4	Confident	5 Å²	5	35.5 Å²	35.5	2%	0.023	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	167	162.8	65.5	-159.2	0	0	0	111	T768 V769 V771 Q807	H752-T768 CarbonylContact O-C 3.55Å; H752-T768 WeakPolarHBondContact O-CA 3.24Å; H752-V769 VanDerWaalsContact CD2-CG2 3.42Å; H752-V769 WeakPolarHBondContact CD2-CG2 3.2Å; H752-V769 PolarHBondContact N-O 2.74Å; H752-V769 WeakPolarHBondContact NE2-CG2 3.19Å; H752-V769 PolarHBondContact O-N 2.74Å; H752-V771 HydrophobicContact CB-CG1 4.06Å; H752-Q807 PolarHBondContact CE1-NE2 2.68Å
753	K	88.6	Confident	86.9	Confident	47 Å²	47	35.2 Å²	35.2	20%	0.204	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	124.7	167	-70.2	-178.9	-174.9	176.1	0	109.4	P676 E680 L766 E767	P676-K753 HydrophobicContact CB-CG 4.19Å; P676-K753 WeakPolarHBondContact O-CG 3.37Å; P676-K753 PolarHBondContact O-N 3.03Å; E680-K753 WeakPolarHBondContact OE1-CE 3.31Å; E680-K753 IonicContact OE1-NZ 3.7Å; E680-K753 PolarHBondContact OE1-NZ 3.14Å; E680-K753 IonicContact OE2-NZ 3.27Å; E680-K753 PolarHBondContact OE2-NZ 2.79Å; K753-L766 HydrophobicContact CB-CD1 3.9Å; K753-L766 HydrophobicContact CB-CD2 4.19Å; K753-L766 HydrophobicContact CB-CG 3.94Å; K753-L766 HydrophobicContact CD-CD2 4.12Å; K753-E767 CarbonylContact C-O 3.52Å; K753-E767 WeakPolarHBondContact CA-O 3.4Å
754	E	87	Confident	86.2	Confident	12 Å²	12	36.1 Å²	36.1	6%	0.056	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	133.2	179.2	-175.5	175.3	76.6	0	0	110.3	R756 E767 V769 Q807 R813	E754-R756 IonicContact OE1-CZ 3.62Å; E754-R756 IonicContact OE1-NE 2.63Å; E754-R756 PolarHBondContact OE1-NE 2.87Å; E754-R756 IonicContact OE1-NH2 3.59Å; E754-E767 PolarHBondContact N-O 3.08Å; E754-E767 PolarHBondContact O-N 3.19Å; E754-V769 HydrophobicContact CB-CG2 3.69Å; E754-Q807 PolarHBondContact OE2-NE2 2.95Å; E754-R813 IonicContact OE2-NE 2.67Å
755	E	84.1	Confident	85.4	Confident	77 Å²	77	36.5 Å²	36.5	36%	0.36	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	127.9	172.5	-172.6	176.1	-179.4	0	0	110	S764 C765 L766 R813	E755-S764 WeakPolarHBondContact OE1-CB 3.48Å; E755-S764 PolarHBondContact OE1-OG 3.27Å; E755-C765 WeakPolarHBondContact CA-O 3.37Å; E755-L766 HydrophobicContact CB-CD1 4.42Å; E755-R813 PolarHBondContact O-NH1 2.86Å
756	R	84	Confident	84.6	Confident	98 Å²	98	41.3 Å²	41.3	37%	0.37	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	147.5	174.9	-68.4	176.1	174.8	-178.1	-8.2	109.8	E754 S764 C765 E767 R813	E754-R756 IonicContact OE1-CZ 3.62Å; E754-R756 IonicContact OE1-NE 2.63Å; E754-R756 PolarHBondContact OE1-NE 2.87Å; E754-R756 IonicContact OE1-NH2 3.59Å; R756-S764 CarbonylContact O-C 3.55Å; R756-S764 VanDerWaalsContact O-CA 3.3Å; R756-S764 WeakPolarHBondContact O-CA 3.4Å; R756-C765 PolarHBondContact N-O 2.78Å; R756-C765 PolarHBondContact O-N 2.95Å; R756-E767 WeakPolarHBondContact CD-OE2 3.5Å; R756-E767 IonicContact CZ-OE2 3.89Å; R756-E767 IonicContact NE-OE2 3.98Å; R756-E767 IonicContact NH1-OE2 2.78Å; R756-E767 PolarHBondContact NH1-OE2 3.04Å; R756-R813 CarbonylContact C-O 3.6Å; R756-R813 WeakPolarHBondContact CA-O 3.46Å
757	Y	82	Confident	83.9	Confident	51 Å²	51	45.1 Å²	45.1	20%	0.2	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	123.6	-179.4	-173.7	-112.8	0	0	0	111.2	L759 K762 R813 P815	Y757-L759 HydrophobicContact CD1-CD2 4Å; Y757-L759 HydrophobicContact CD1-CG 4.5Å; Y757-L759 HydrophobicContact CE1-CD2 3.86Å; Y757-K762 WeakPolarHBondContact OH-CA 3.2Å; Y757-R813 WeakPolarHBondContact CB-O 3.47Å; Y757-R813 PolarHBondContact N-O 3.18Å; Y757-P815 HydrophobicContact CD2-CB 4.2Å; Y757-P815 HydrophobicContact CD2-CG 3.53Å; Y757-P815 HydrophobicContact CE2-CB 4.08Å; Y757-P815 HydrophobicContact CE2-CG 3.74Å; Y757-P815 HydrophobicContact CG-CG 4.09Å
758	D	78.2	Confident	83.5	Confident	37 Å²	37	47.1 Å²	47.1	20%	0.198	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	107	175.2	-177.3	-6.9	0	0	0	110.2	K760 T761 K762 V763 K1081	D758-K760 PolarHBondContact O-N 3.14Å; D758-K760 WeakPolarHBondContact OD1-CA 3.45Å; D758-K760 VanDerWaalsContact OD1-CB 3.26Å; D758-K760 WeakPolarHBondContact OD1-CB 3.41Å; D758-K760 PolarHBondContact OD1-N 2.98Å; D758-T761 WeakPolarHBondContact CB-OG1 3.32Å; D758-T761 VanDerWaalsContact CG-OG1 3.26Å; D758-T761 PolarHBondContact O-N 3.38Å; D758-T761 PolarHBondContact OD2-OG1 2.84Å; D758-T761 VanDerWaalsContact OD2-OG1 3.1Å; D758-K762 WeakPolarHBondContact O-CA 3.32Å; D758-K762 PolarHBondContact O-N 3.22Å; D758-V763 PolarHBondContact N-O 2.91Å; D758-V763 VanDerWaalsContact N-O 3.07Å; D758-K1081 IonicContact OD2-NZ 3.99Å; D758-K1081 PolarHBondContact OD2-NZ 3.43Å
759	L	72.5	Confident	83.1	Confident	68 Å²	68	48 Å²	48	36%	0.356	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-27.2	177.4	-68.3	170.2	0	0	0	113.3	Y757 A847	Y757-L759 HydrophobicContact CD1-CD2 4Å; Y757-L759 HydrophobicContact CD1-CG 4.5Å; Y757-L759 HydrophobicContact CE1-CD2 3.86Å; L759-A847 HydrophobicContact CD1-CB 4.27Å; L759-A847 HydrophobicContact CD2-CB 3.77Å
760	K	73.2	Confident	83	Confident	191 Å²	191	50.4 Å²	50.4	83%	0.83	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.5	-44.2	-179.8	-174.8	-179.5	178.3	-179.9	0	111.4	D758	D758-K760 PolarHBondContact O-N 3.14Å; D758-K760 WeakPolarHBondContact OD1-CA 3.45Å; D758-K760 VanDerWaalsContact OD1-CB 3.26Å; D758-K760 WeakPolarHBondContact OD1-CB 3.41Å; D758-K760 PolarHBondContact OD1-N 2.98Å
761	T	70.3	Confident	83	Confident	29 Å²	29	50.4 Å²	50.4	18%	0.178	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.3	-6.9	-178.3	54.1	0	0	0	0	113.5	D758 V763 K1081 V1086	D758-T761 WeakPolarHBondContact CB-OG1 3.32Å; D758-T761 VanDerWaalsContact CG-OG1 3.26Å; D758-T761 PolarHBondContact O-N 3.38Å; D758-T761 PolarHBondContact OD2-OG1 2.84Å; D758-T761 VanDerWaalsContact OD2-OG1 3.1Å; T761-V763 PolarHBondContact O-N 3.37Å; T761-V763 WeakPolarHBondContact OG1-CG2 3.17Å; T761-K1081 HydrophobicContact CG2-CD 4.39Å; T761-V1086 HydrophobicContact CG2-CG2 4.28Å
762	K	73.7	Confident	82.9	Confident	92 Å²	92	50.5 Å²	50.5	40%	0.4	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	54	35.4	-176.7	-57.1	-170.2	175.5	-160.1	0	113.6	Y757 D758 E850	Y757-K762 WeakPolarHBondContact OH-CA 3.2Å; D758-K762 WeakPolarHBondContact O-CA 3.32Å; D758-K762 PolarHBondContact O-N 3.22Å; K762-E850 WeakPolarHBondContact CE-OE2 3.39Å; K762-E850 IonicContact NZ-OE2 3.49Å; K762-E850 PolarHBondContact NZ-OE2 3.26Å
763	V	75.7	Confident	83	Confident	16 Å²	16	55 Å²	55	10%	0.097	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	148.7	-179.5	-68.7	0	0	0	0	111.1	D758 T761 A1079 K1081 V1086	D758-V763 PolarHBondContact N-O 2.91Å; D758-V763 VanDerWaalsContact N-O 3.07Å; T761-V763 PolarHBondContact O-N 3.37Å; T761-V763 WeakPolarHBondContact OG1-CG2 3.17Å; V763-A1079 HydrophobicContact CG1-CB 3.77Å; V763-K1081 HydrophobicContact CG2-CB 3.79Å; V763-V1086 HydrophobicContact CG1-CG1 4.06Å; V763-V1086 HydrophobicContact CG2-CG1 4.38Å; V763-V1086 HydrophobicContact CG2-CG2 4.04Å
764	S	78.6	Confident	83	Confident	25 Å²	25	53.3 Å²	53.3	18%	0.175	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	143.7	171.2	-59	0	0	0	0	110.9	E755 R756 V1080 K1081	E755-S764 WeakPolarHBondContact OE1-CB 3.48Å; E755-S764 PolarHBondContact OE1-OG 3.27Å; R756-S764 CarbonylContact O-C 3.55Å; R756-S764 VanDerWaalsContact O-CA 3.3Å; R756-S764 WeakPolarHBondContact O-CA 3.4Å; S764-V1080 WeakPolarHBondContact O-CA 3.44Å; S764-V1080 WeakPolarHBondContact O-CG1 3.38Å; S764-K1081 PolarHBondContact O-N 3.33Å
765	C	77.2	Confident	83.2	Confident	12 Å²	12	53.5 Å²	53.5	8%	0.081	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	147.1	161.7	59.7	0	0	0	0	109.4	E755 R756 E767 K1081	E755-C765 WeakPolarHBondContact CA-O 3.37Å; R756-C765 PolarHBondContact N-O 2.78Å; R756-C765 PolarHBondContact O-N 2.95Å; C765-E767 HydrophobicContact CB-CG 4.38Å; C765-E767 PolarHBondContact SG-OE1 2.98Å; C765-K1081 HydrophobicContact CB-CB 4.33Å; C765-K1081 WeakPolarHBondContact CB-O 3.23Å
766	L	79.9	Confident	83.7	Confident	102 Å²	102	50 Å²	50	53%	0.534	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	104.5	173.1	-175.1	71.6	0	0	0	107.1	K753 E755	K753-L766 HydrophobicContact CB-CD1 3.9Å; K753-L766 HydrophobicContact CB-CD2 4.19Å; K753-L766 HydrophobicContact CB-CG 3.94Å; K753-L766 HydrophobicContact CD-CD2 4.12Å; E755-L766 HydrophobicContact CB-CD1 4.42Å
767	E	82.8	Confident	83.9	Confident	79 Å²	79	48.8 Å²	48.8	37%	0.369	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	140.7	-174.3	-69.4	175.8	-178.8	0	0	110.1	K753 E754 R756 C765 V769	K753-E767 CarbonylContact C-O 3.52Å; K753-E767 WeakPolarHBondContact CA-O 3.4Å; E754-E767 PolarHBondContact N-O 3.08Å; E754-E767 PolarHBondContact O-N 3.19Å; R756-E767 WeakPolarHBondContact CD-OE2 3.5Å; R756-E767 IonicContact CZ-OE2 3.89Å; R756-E767 IonicContact NE-OE2 3.98Å; R756-E767 IonicContact NH1-OE2 2.78Å; R756-E767 PolarHBondContact NH1-OE2 3.04Å; C765-E767 HydrophobicContact CB-CG 4.38Å; C765-E767 PolarHBondContact SG-OE1 2.98Å; E767-V769 HydrophobicContact CB-CG1 4.15Å
768	T	88.1	Confident	84.2	Confident	45 Å²	45	46.5 Å²	46.5	28%	0.276	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	121.4	167.5	-56.8	0	0	0	0	108	C648 P676 L751 H752	C648-T768 HydrophobicContact CB-CG2 4.09Å; C648-T768 VanDerWaalsContact CB-O 3.29Å; C648-T768 WeakPolarHBondContact CB-O 3.27Å; P676-T768 HydrophobicContact CB-CG2 4.13Å; P676-T768 HydrophobicContact CG-CG2 4.29Å; L751-T768 HydrophobicContact CB-CG2 4.06Å; L751-T768 HydrophobicContact CD1-CG2 4.25Å; L751-T768 HydrophobicContact CD2-CG2 4.34Å; L751-T768 HydrophobicContact CG-CG2 4.45Å; H752-T768 CarbonylContact O-C 3.55Å; H752-T768 WeakPolarHBondContact O-CA 3.24Å
769	V	90.7	Very high	84.8	Confident	17 Å²	17	44.8 Å²	44.8	10%	0.103	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	158.5	-177.7	-60.1	0	0	0	0	111	L751 H752 E754 E767	L751-V769 WeakPolarHBondContact CA-O 3.41Å; H752-V769 VanDerWaalsContact CD2-CG2 3.42Å; H752-V769 WeakPolarHBondContact CD2-CG2 3.2Å; H752-V769 PolarHBondContact N-O 2.74Å; H752-V769 WeakPolarHBondContact NE2-CG2 3.19Å; H752-V769 PolarHBondContact O-N 2.74Å; E754-V769 HydrophobicContact CB-CG2 3.69Å; E767-V769 HydrophobicContact CB-CG1 4.15Å
770	W	93.9	Very high	85.7	Confident	53 Å²	53	44.3 Å²	44.3	20%	0.201	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	136.6	169.2	-66.9	100.1	0	0	0	110.9	C648 G750 L751 F795 R799 M803	C648-W770 PolarHBondContact SG-NE1 2.98Å; C648-W770 VanDerWaalsContact SG-NE1 3.37Å; G750-W770 WeakPolarHBondContact O-CA 3.47Å; G750-W770 VanDerWaalsContact O-CE3 3.25Å; L751-W770 HydrophobicContact CD2-CD2 3.61Å; L751-W770 HydrophobicContact CD2-CE3 3.61Å; L751-W770 HydrophobicContact CD2-CG 4.14Å; L751-W770 HydrophobicContact CD2-CH2 4.12Å; L751-W770 HydrophobicContact CD2-CZ2 4.11Å; L751-W770 HydrophobicContact CD2-CZ3 3.87Å; L751-W770 HydrophobicContact CG-CE3 4.26Å; L751-W770 HydrophobicContact CG-CH2 4.47Å; L751-W770 HydrophobicContact CG-CZ3 4.14Å; W770-F795 HydrophobicContact CH2-CB 4.06Å; W770-F795 HydrophobicContact CZ3-CB 3.71Å; W770-F795 HydrophobicContact CZ3-CD1 4.24Å; W770-F795 HydrophobicContact CZ3-CG 4.17Å; W770-R799 HydrophobicContact CD2-CG 4.21Å; W770-R799 HydrophobicContact CE3-CG 4Å; W770-R799 HydrophobicContact CH2-CG 4.3Å; W770-R799 HydrophobicContact CZ2-CG 4.49Å; W770-R799 HydrophobicContact CZ3-CG 4.06Å; W770-R799 VanDerWaalsContact NE1-CZ 3.28Å; W770-M803 HydrophobicContact CB-CE 4.32Å; W770-M803 HydrophobicContact CD2-CE 4.21Å; W770-M803 HydrophobicContact CE3-CE 3.4Å; W770-M803 HydrophobicContact CZ3-CE 4.11Å
771	V	94.3	Very high	86.2	Confident	1 Å²	1	35.2 Å²	35.2	1%	0.006	17%	0.173	C	C	.	.	P	Polyproline II helix	trans	-73.6	162.6	176	-54.2	0	0	0	0	111.5	G750 H752 N775 V776 M803	G750-V771 PolarHBondContact O-N 3.18Å; H752-V771 HydrophobicContact CB-CG1 4.06Å; V771-N775 HydrophobicContact CB-CB 3.75Å; V771-N775 HydrophobicContact CG2-CB 4Å; V771-V776 HydrophobicContact CG2-CG2 3.68Å; V771-M803 HydrophobicContact CG2-CE 4.46Å; V771-M803 WeakPolarHBondContact O-CG 3.4Å
772	S	93.7	Very high	87	Confident	3 Å²	3	34.3 Å²	34.3	2%	0.021	17%	0.166	C	C	.	.	P	Polyproline II helix	trans	-76.2	161.4	173.4	75.6	0	0	0	0	112	A774 N775 V776 V804 F806 Q807	S772-A774 PolarHBondContact O-N 2.91Å; S772-N775 VanDerWaalsContact CB-OD1 3.3Å; S772-N775 WeakPolarHBondContact CB-OD1 3.33Å; S772-N775 PolarHBondContact N-OD1 3.4Å; S772-N775 WeakPolarHBondContact O-CB 3.25Å; S772-N775 PolarHBondContact O-N 2.81Å; S772-N775 VanDerWaalsContact OG-CG 3.29Å; S772-N775 PolarHBondContact OG-N 3.34Å; S772-N775 PolarHBondContact OG-OD1 2.99Å; S772-V776 PolarHBondContact O-N 2.81Å; S772-V776 VanDerWaalsContact O-N 3.14Å; S772-V804 CarbonylContact C-O 3.59Å; S772-V804 VanDerWaalsContact CA-O 3.25Å; S772-V804 WeakPolarHBondContact CA-O 3.05Å; S772-V804 VanDerWaalsContact CB-O 3.29Å; S772-V804 WeakPolarHBondContact CB-O 3.46Å; S772-F806 VanDerWaalsContact CB-C 3.41Å; S772-Q807 PolarHBondContact OG-N 3.37Å
773	R	93.7	Very high	87.6	Confident	100 Å²	100	30 Å²	30	38%	0.377	15%	0.147	S	C	.	.	H	α-helix	trans	-58	-36	174	-62.6	-173.8	-172.6	158.8	4	112.1	N775 V776 I777 L800 E801 M803 V804	R773-N775 VanDerWaalsContact C-N 3.33Å; R773-N775 PolarHBondContact O-N 3.5Å; R773-V776 PolarHBondContact O-N 2.92Å; R773-I777 WeakPolarHBondContact O-CG1 3.35Å; R773-I777 PolarHBondContact O-N 3.02Å; R773-L800 HydrophobicContact CG-CD1 4.04Å; R773-L800 PolarHBondContact NE-O 2.83Å; R773-E801 PolarHBondContact NH2-O 2.88Å; R773-M803 HydrophobicContact CG-CB 4Å; R773-M803 PolarHBondContact NE-O 3.21Å; R773-V804 PolarHBondContact N-O 3.2Å
774	A	89.7	Confident	87.7	Confident	11 Å²	11	29.2 Å²	29.2	9%	0.091	14%	0.143	C	C	.	.	H	α-helix	trans	-60.9	-41.2	174.1	0	0	0	0	0	112	S772 I777 Q778 P805 F806	S772-A774 PolarHBondContact O-N 2.91Å; A774-I777 PolarHBondContact O-N 3.37Å; A774-Q778 VanDerWaalsContact O-CG 3.3Å; A774-Q778 WeakPolarHBondContact O-CG 3.42Å; A774-Q778 PolarHBondContact O-N 3.13Å; A774-P805 WeakPolarHBondContact CB-O 3.23Å; A774-P805 PolarHBondContact N-O 3.01Å; A774-P805 VanDerWaalsContact N-O 3.11Å; A774-F806 HydrophobicContact CB-CD1 3.84Å; A774-F806 HydrophobicContact CB-CE1 4.29Å
775	N	91.6	Very high	87.5	Confident	16 Å²	16	30 Å²	30	9%	0.086	14%	0.142	C	C	.	.	H	α-helix	trans	-62.9	-43.4	175.5	-57	116.3	0	0	0	111.1	E735 V771 S772 R773 I777 Q778 R779	E735-N775 WeakPolarHBondContact OE1-CA 3.47Å; E735-N775 VanDerWaalsContact OE1-CB 3.24Å; E735-N775 WeakPolarHBondContact OE1-CB 3.29Å; E735-N775 PolarHBondContact OE1-ND2 3.45Å; V771-N775 HydrophobicContact CB-CB 3.75Å; V771-N775 HydrophobicContact CG2-CB 4Å; S772-N775 VanDerWaalsContact CB-OD1 3.3Å; S772-N775 WeakPolarHBondContact CB-OD1 3.33Å; S772-N775 PolarHBondContact N-OD1 3.4Å; S772-N775 WeakPolarHBondContact O-CB 3.25Å; S772-N775 PolarHBondContact O-N 2.81Å; S772-N775 VanDerWaalsContact OG-CG 3.29Å; S772-N775 PolarHBondContact OG-N 3.34Å; S772-N775 PolarHBondContact OG-OD1 2.99Å; R773-N775 VanDerWaalsContact C-N 3.33Å; R773-N775 PolarHBondContact O-N 3.5Å; N775-I777 VanDerWaalsContact C-N 3.32Å; N775-I777 PolarHBondContact O-N 3.45Å; N775-Q778 WeakPolarHBondContact O-CB 3.47Å; N775-Q778 PolarHBondContact O-N 3.33Å; N775-Q778 VanDerWaalsContact O-N 3.12Å; N775-R779 VanDerWaalsContact O-CG 3.3Å; N775-R779 WeakPolarHBondContact O-CG 3.31Å; N775-R779 PolarHBondContact O-N 2.94Å
776	V	93.2	Very high	87.2	Confident	5 Å²	5	32.4 Å²	32.4	3%	0.03	16%	0.158	C	C	.	.	H	α-helix	trans	-58.7	-44	176.6	179.5	0	0	0	0	111.2	V771 S772 R773 Q778 R779 R780 F795 L800 M803	V771-V776 HydrophobicContact CG2-CG2 3.68Å; S772-V776 PolarHBondContact O-N 2.81Å; S772-V776 VanDerWaalsContact O-N 3.14Å; R773-V776 PolarHBondContact O-N 2.92Å; V776-Q778 VanDerWaalsContact C-N 3.32Å; V776-Q778 PolarHBondContact O-N 2.81Å; V776-R779 PolarHBondContact O-N 3.18Å; V776-R780 VanDerWaalsContact O-CB 3.29Å; V776-R780 WeakPolarHBondContact O-CB 3.44Å; V776-R780 PolarHBondContact O-N 3.05Å; V776-F795 HydrophobicContact CG1-CZ 4.05Å; V776-F795 HydrophobicContact CG2-CZ 3.86Å; V776-L800 HydrophobicContact CB-CD1 4.3Å; V776-L800 HydrophobicContact CG1-CD1 4.26Å; V776-L800 HydrophobicContact CG2-CD1 4.08Å; V776-M803 HydrophobicContact CG2-SD 4.08Å
777	I	88.7	Confident	87.2	Confident	71 Å²	71	32 Å²	32	36%	0.364	15%	0.153	S	C	.	.	H	α-helix	trans	-60.2	-43.5	176	-69	165.8	0	0	0	110.7	T593 R773 A774 N775 G781	T593-I777 HydrophobicContact CG2-CG2 4.14Å; R773-I777 WeakPolarHBondContact O-CG1 3.35Å; R773-I777 PolarHBondContact O-N 3.02Å; A774-I777 PolarHBondContact O-N 3.37Å; N775-I777 VanDerWaalsContact C-N 3.32Å; N775-I777 PolarHBondContact O-N 3.45Å; I777-G781 PolarHBondContact O-N 2.94Å
778	Q	87.4	Confident	87.5	Confident	4 Å²	4	31.2 Å²	31.2	2%	0.019	16%	0.157	C	C	.	.	H	α-helix	trans	-64.4	-42.5	178	-69.8	-69.1	16.3	0	0	112.8	H562 T593 E735 A774 N775 V776 G781	H562-Q778 PolarHBondContact CD2-NE2 2.87Å; H562-Q778 PolarHBondContact NE2-NE2 3.49Å; T593-Q778 HydrophobicContact CG2-CG 4.05Å; T593-Q778 PolarHBondContact OG1-NE2 2.74Å; E735-Q778 HydrophobicContact CG-CB 3.98Å; A774-Q778 VanDerWaalsContact O-CG 3.3Å; A774-Q778 WeakPolarHBondContact O-CG 3.42Å; A774-Q778 PolarHBondContact O-N 3.13Å; N775-Q778 WeakPolarHBondContact O-CB 3.47Å; N775-Q778 PolarHBondContact O-N 3.33Å; N775-Q778 VanDerWaalsContact O-N 3.12Å; V776-Q778 VanDerWaalsContact C-N 3.32Å; V776-Q778 PolarHBondContact O-N 2.81Å; Q778-G781 PolarHBondContact O-N 3.21Å
779	R	91.8	Very high	87.8	Confident	1 Å²	1	29.2 Å²	29.2	0%	0.004	15%	0.145	C	C	.	.	H	α-helix	trans	-65.4	-50.1	177.5	-70.1	178.9	179.5	-165.2	-1.1	110.9	F674 E735 D748 L751 N775 V776 G781 R782	F674-R779 HydrophobicContact CD1-CG 4.09Å; F674-R779 HydrophobicContact CD2-CB 3.74Å; F674-R779 HydrophobicContact CD2-CG 3.63Å; F674-R779 HydrophobicContact CE1-CG 4.06Å; F674-R779 HydrophobicContact CE2-CB 3.57Å; F674-R779 HydrophobicContact CE2-CG 3.59Å; F674-R779 HydrophobicContact CG-CB 4.47Å; F674-R779 HydrophobicContact CG-CG 3.88Å; F674-R779 HydrophobicContact CZ-CB 4.19Å; F674-R779 HydrophobicContact CZ-CG 3.82Å; E735-R779 HydrophobicContact CG-CG 3.91Å; E735-R779 IonicContact OE2-CZ 3.02Å; E735-R779 IonicContact OE2-NE 3.64Å; E735-R779 PolarHBondContact OE2-NE 3.42Å; E735-R779 VanDerWaalsContact OE2-NE 3.09Å; E735-R779 IonicContact OE2-NH2 2.7Å; E735-R779 PolarHBondContact OE2-NH2 3.34Å; D748-R779 VanDerWaalsContact CG-CD 3.42Å; D748-R779 VanDerWaalsContact OD1-CD 3.29Å; D748-R779 WeakPolarHBondContact OD1-CD 3.46Å; D748-R779 IonicContact OD1-CZ 3.9Å; D748-R779 IonicContact OD1-NE 3.86Å; D748-R779 IonicContact OD1-NH1 2.76Å; D748-R779 PolarHBondContact OD1-NH1 3.45Å; D748-R779 WeakPolarHBondContact OD2-CD 3.15Å; L751-R779 PolarHBondContact O-NH1 2.81Å; N775-R779 VanDerWaalsContact O-CG 3.3Å; N775-R779 WeakPolarHBondContact O-CG 3.31Å; N775-R779 PolarHBondContact O-N 2.94Å; V776-R779 PolarHBondContact O-N 3.18Å; R779-G781 VanDerWaalsContact C-N 3.25Å; R779-G781 PolarHBondContact O-N 3.25Å; R779-R782 WeakPolarHBondContact O-CB 3.49Å; R779-R782 VanDerWaalsContact O-CG 3.32Å; R779-R782 WeakPolarHBondContact O-CG 3.48Å; R779-R782 PolarHBondContact O-N 3.46Å
780	R	90.4	Very high	88	Confident	57 Å²	57	30.5 Å²	30.5	22%	0.215	15%	0.15	C	C	.	.	H	α-helix	trans	-53.9	-43.4	173.1	179.8	-166.4	67.8	-178.3	-0.1	111.7	V618 E620 V776 R782 A783 A791	V618-R780 HydrophobicContact CB-CG 4.12Å; V618-R780 HydrophobicContact CG1-CG 3.78Å; E620-R780 HydrophobicContact CG-CG 4.45Å; E620-R780 WeakPolarHBondContact OE1-CD 3.47Å; E620-R780 IonicContact OE1-CZ 2.64Å; E620-R780 IonicContact OE1-NE 2.62Å; E620-R780 IonicContact OE1-NH1 3.22Å; E620-R780 PolarHBondContact OE1-NH1 3.46Å; V776-R780 VanDerWaalsContact O-CB 3.29Å; V776-R780 WeakPolarHBondContact O-CB 3.44Å; V776-R780 PolarHBondContact O-N 3.05Å; R780-R782 PolarHBondContact O-N 3.4Å; R780-A783 PolarHBondContact O-N 3.46Å; R780-A791 HydrophobicContact CB-CB 4.24Å; R780-A791 HydrophobicContact CG-CB 3.81Å
781	G	84.9	Confident	88.2	Confident	0 Å²	0	28 Å²	28	0%	0	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-3.4	179.2	0	0	0	0	0	114.9	I777 Q778 R779 R785	I777-G781 PolarHBondContact O-N 2.94Å; Q778-G781 PolarHBondContact O-N 3.21Å; R779-G781 VanDerWaalsContact C-N 3.25Å; R779-G781 PolarHBondContact O-N 3.25Å; G781-R785 WeakPolarHBondContact O-CG 3.3Å; G781-R785 PolarHBondContact O-NE 2.95Å
782	R	86.8	Confident	88.4	Confident	11 Å²	11	28.4 Å²	28.4	4%	0.042	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-26.9	174.4	-56.2	-71.6	153	173	-11.6	113.7	L672 F674 A734 E735 I738 V746 R779 R780 R785	L672-R782 HydrophobicContact CD2-CB 3.95Å; L672-R782 HydrophobicContact CD2-CG 4.09Å; F674-R782 HydrophobicContact CE2-CG 4.3Å; F674-R782 HydrophobicContact CZ-CG 4.06Å; A734-R782 PolarHBondContact O-NE 3.49Å; E735-R782 VanDerWaalsContact C-CZ 3.41Å; E735-R782 PolarHBondContact O-NE 2.92Å; E735-R782 VanDerWaalsContact O-NE 3.11Å; E735-R782 PolarHBondContact O-NH2 3.14Å; I738-R782 PolarHBondContact O-NH1 3.43Å; V746-R782 HydrophobicContact CG2-CB 3.85Å; R779-R782 WeakPolarHBondContact O-CB 3.49Å; R779-R782 VanDerWaalsContact O-CG 3.32Å; R779-R782 WeakPolarHBondContact O-CG 3.48Å; R779-R782 PolarHBondContact O-N 3.46Å; R780-R782 PolarHBondContact O-N 3.4Å; R782-R785 VanDerWaalsContact CZ-CZ 3.45Å; R782-R785 VanDerWaalsContact NH1-CZ 3.3Å; R782-R785 VanDerWaalsContact NH1-NH1 3.16Å
783	A	87.4	Confident	88.5	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-24.5	175	0	0	0	0	0	113.6	V618 V744 V746 R780 Q787	V618-A783 HydrophobicContact CG1-CB 4.33Å; V618-A783 HydrophobicContact CG2-CB 4.49Å; V744-A783 VanDerWaalsContact O-CB 3.25Å; V744-A783 WeakPolarHBondContact O-CB 3.09Å; V746-A783 HydrophobicContact CG2-CB 3.82Å; R780-A783 PolarHBondContact O-N 3.46Å; A783-Q787 VanDerWaalsContact O-O 3.07Å
784	G	77.9	Confident	88.6	Confident	0 Å²	0	24.1 Å²	24.1	0%	0	13%	0.126	C	C	.	.	S	Bend	trans	-96.9	14.6	-172.9	0	0	0	0	0	115.9	Y616 V618	Y616-G784 PolarHBondContact N-O 3.36Å; V618-G784 VanDerWaalsContact CG2-CA 3.41Å
785	R	72.8	Confident	88.8	Confident	41 Å²	41	23.6 Å²	23.6	16%	0.155	12%	0.121	C	C	.	.	S	Bend	trans	-80.2	-51.2	-170.8	-63.7	-169.8	162.7	-166.2	-12.2	113.9	I738 G781 R782	I738-R785 PolarHBondContact O-NH1 3.21Å; G781-R785 WeakPolarHBondContact O-CG 3.3Å; G781-R785 PolarHBondContact O-NE 2.95Å; R782-R785 VanDerWaalsContact CZ-CZ 3.45Å; R782-R785 VanDerWaalsContact NH1-CZ 3.3Å; R782-R785 VanDerWaalsContact NH1-NH1 3.16Å
786	C	70.8	Confident	88.8	Confident	64 Å²	64	24.8 Å²	24.8	43%	0.432	13%	0.13	S	C	.	.	S	Bend	trans	-104.9	-22.8	-172.9	-63.8	0	0	0	0	112.5	Y616	Y616-C786 VanDerWaalsContact CE2-C 3.4Å; Y616-C786 VanDerWaalsContact CE2-O 3.26Å; Y616-C786 WeakPolarHBondContact CE2-O 3.16Å
787	Q	81.2	Confident	88.9	Confident	92 Å²	92	29.1 Å²	29.1	43%	0.43	15%	0.146	S	C	.	.	S	Bend	trans	-160.1	169.6	-179	58.1	-169.2	-22.2	0	0	109.5	Y616 V744 A783	Y616-Q787 WeakPolarHBondContact CB-O 3.48Å; Y616-Q787 VanDerWaalsContact CG-C 3.4Å; V744-Q787 HydrophobicContact CG2-CG 4.11Å; A783-Q787 VanDerWaalsContact O-O 3.07Å
788	S	88.8	Confident	89	Confident	63 Å²	63	28.9 Å²	28.9	44%	0.441	15%	0.151	S	C	.	.			trans	-59.8	147.5	173.5	-55.9	0	0	0	0	110.6	Y616 P617	Y616-S788 VanDerWaalsContact CB-N 3.3Å; P617-S788 WeakPolarHBondContact O-CA 3.37Å
789	G	93.1	Very high	89.3	Confident	3 Å²	3	30.7 Å²	30.7	3%	0.031	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	-169.2	-173.9	0	0	0	0	0	113.9	P617 V618 K619 V744	P617-G789 PolarHBondContact O-N 3.42Å; V618-G789 CarbonylContact C-O 3.55Å; V618-G789 VanDerWaalsContact CA-O 3.31Å; V618-G789 WeakPolarHBondContact CA-O 3.41Å; K619-G789 PolarHBondContact N-O 3.39Å; V744-G789 CarbonylContact O-C 3.56Å; V744-G789 WeakPolarHBondContact O-CA 3.28Å
790	F	96.8	Very high	89.4	Confident	45 Å²	45	32.2 Å²	32.2	20%	0.197	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	138.8	-174.9	-56.8	-96.2	0	0	0	110.1	K619 E667 V744 H745 V746 Y792	K619-F790 HydrophobicContact CB-CD1 3.83Å; K619-F790 HydrophobicContact CB-CE1 4.14Å; K619-F790 HydrophobicContact CD-CD1 4.27Å; K619-F790 HydrophobicContact CD-CE1 4.05Å; K619-F790 HydrophobicContact CG-CD1 4.47Å; K619-F790 WeakPolarHBondContact O-CA 3.34Å; E667-F790 HydrophobicContact CB-CE2 4.01Å; E667-F790 HydrophobicContact CG-CE2 3.63Å; E667-F790 HydrophobicContact CG-CZ 3.85Å; V744-F790 HydrophobicContact CG1-CD2 4.33Å; V744-F790 PolarHBondContact O-N 3.31Å; H745-F790 CarbonylContact C-O 3.44Å; H745-F790 WeakPolarHBondContact CA-O 3.16Å; H745-F790 AromaticContact CE1-CD2 3.5Å; H745-F790 AromaticContact ND1-CD2 3.67Å; V746-F790 PolarHBondContact N-O 3.12Å; F790-Y792 HydrophobicContact CB-CD2 4.3Å; F790-Y792 HydrophobicContact CB-CE2 3.46Å; F790-Y792 VanDerWaalsContact CB-CE2 3.46Å; F790-Y792 HydrophobicContact CG-CE2 4.45Å
791	A	96.7	Very high	89.6	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	126.8	172.4	0	0	0	0	0	109.4	V618 K619 E620 H621 V746 R780	V618-A791 HydrophobicContact CG1-CB 3.68Å; K619-A791 PolarHBondContact O-N 2.99Å; E620-A791 CarbonylContact C-O 3.6Å; E620-A791 WeakPolarHBondContact CA-O 3.49Å; E620-A791 HydrophobicContact CG-CB 4.48Å; H621-A791 PolarHBondContact N-O 3.02Å; V746-A791 CarbonylContact O-C 3.52Å; V746-A791 WeakPolarHBondContact O-CA 3.46Å; R780-A791 HydrophobicContact CB-CB 4.24Å; R780-A791 HydrophobicContact CG-CB 3.81Å
792	Y	98	Very high	89.9	Confident	10 Å²	10	42 Å²	42	4%	0.039	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	106.3	-178	-57.2	-93.6	0	0	0	108.7	H621 I626 L658 I662 H745 V746 V747 D748 F790	H621-Y792 HydrophobicContact CB-CD1 3.73Å; H621-Y792 HydrophobicContact CB-CE1 4.22Å; H621-Y792 HydrophobicContact CB-CG 4.49Å; H621-Y792 AromaticContact CD2-CD1 3.9Å; H621-Y792 AromaticContact CD2-CE1 3.5Å; H621-Y792 VanDerWaalsContact CD2-CE1 3.5Å; H621-Y792 WeakPolarHBondContact CD2-CE1 3.14Å; H621-Y792 CarbonylContact O-C 3.57Å; H621-Y792 WeakPolarHBondContact O-CA 3.12Å; I626-Y792 HydrophobicContact CG1-CD1 4.25Å; L658-Y792 HydrophobicContact CD1-CD1 3.9Å; L658-Y792 HydrophobicContact CD1-CE1 4.41Å; L658-Y792 HydrophobicContact CD1-CG 4.2Å; L658-Y792 HydrophobicContact CD2-CG 4.36Å; I662-Y792 HydrophobicContact CD1-CD1 4.48Å; I662-Y792 HydrophobicContact CD1-CD2 3.51Å; I662-Y792 HydrophobicContact CD1-CE1 4.44Å; I662-Y792 HydrophobicContact CD1-CE2 3.46Å; I662-Y792 VanDerWaalsContact CD1-CE2 3.46Å; I662-Y792 HydrophobicContact CD1-CG 4.05Å; I662-Y792 HydrophobicContact CG1-CD2 4.3Å; I662-Y792 HydrophobicContact CG1-CE1 4.33Å; I662-Y792 HydrophobicContact CG1-CE2 3.8Å; H745-Y792 HydrophobicContact CB-CE2 4.33Å; H745-Y792 AromaticContact ND1-CE2 3.78Å; V746-Y792 WeakPolarHBondContact O-CD2 3.14Å; V746-Y792 PolarHBondContact O-N 3.42Å; V747-Y792 CarbonylContact C-O 3.54Å; V747-Y792 WeakPolarHBondContact CA-O 3.47Å; D748-Y792 PolarHBondContact N-O 3.36Å; F790-Y792 HydrophobicContact CB-CD2 4.3Å; F790-Y792 HydrophobicContact CB-CE2 3.46Å; F790-Y792 VanDerWaalsContact CB-CE2 3.46Å; F790-Y792 HydrophobicContact CG-CE2 4.45Å
793	H	97.3	Very high	90.3	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	116.5	-176.4	-57	-56.1	0	0	0	110	E620 H621 Y622 L623 I626 D748 F795	E620-H793 IonicContact OE2-CD2 2.78Å; E620-H793 IonicContact OE2-NE2 3.65Å; E620-H793 PolarHBondContact OE2-NE2 2.91Å; H621-H793 PolarHBondContact O-N 3.34Å; Y622-H793 CarbonylContact C-O 3.59Å; Y622-H793 HydrophobicContact CD1-CB 4.1Å; Y622-H793 HydrophobicContact CE1-CB 4.37Å; Y622-H793 AromaticContact CE1-CD2 3.65Å; Y622-H793 AromaticContact CZ-CD2 3.63Å; L623-H793 PolarHBondContact N-O 3.46Å; L623-H793 VanDerWaalsContact N-O 3.08Å; I626-H793 VanDerWaalsContact CD1-O 3.28Å; I626-H793 WeakPolarHBondContact CD1-O 3.41Å; D748-H793 IonicContact OD2-ND1 2.97Å; H793-F795 HydrophobicContact CB-CD1 4.17Å; H793-F795 HydrophobicContact CB-CD2 4.4Å; H793-F795 HydrophobicContact CB-CE1 3.72Å; H793-F795 HydrophobicContact CB-CE2 3.97Å; H793-F795 HydrophobicContact CB-CG 4.5Å; H793-F795 HydrophobicContact CB-CZ 3.62Å; H793-F795 AromaticContact CG-CZ 3.84Å; H793-F795 AromaticContact ND1-CZ 3.9Å; H793-F795 PolarHBondContact O-N 3.05Å
794	L	95.3	Very high	90.5	Very high	12 Å²	12	45.9 Å²	45.9	6%	0.063	24%	0.236	C	C	.	.	S	Bend	trans	-79.1	32.6	-179	-63.1	174.7	0	0	0	113.1	I626 L650 L654 V655 L658 V747 D748	I626-L794 HydrophobicContact CD1-CD2 4.1Å; I626-L794 HydrophobicContact CG2-CD2 4.49Å; L650-L794 HydrophobicContact CD1-CD1 4.23Å; L654-L794 HydrophobicContact CD2-CD2 3.93Å; L654-L794 HydrophobicContact CG-CD2 4.02Å; V655-L794 HydrophobicContact CB-CD1 4.32Å; V655-L794 HydrophobicContact CG2-CD1 3.41Å; V655-L794 VanDerWaalsContact CG2-CD1 3.41Å; L658-L794 HydrophobicContact CD2-CD2 3.74Å; L658-L794 HydrophobicContact CD2-CG 4.43Å; V747-L794 HydrophobicContact CG1-CD1 4.04Å; V747-L794 HydrophobicContact CG1-CG 4.37Å; D748-L794 PolarHBondContact O-N 3.33Å
795	F	93.9	Very high	91.2	Very high	1 Å²	1	49.3 Å²	49.3	0%	0.004	26%	0.258	C	S	.	.	S	Bend	trans	-142.4	151.8	175.4	51.8	-91.6	0	0	0	109.6	Y622 L623 G750 W770 V776 H793 R799 L800 M803	Y622-F795 HydrophobicContact CD1-CE2 4.5Å; Y622-F795 HydrophobicContact CE1-CE2 4.28Å; L623-F795 VanDerWaalsContact CB-C 3.42Å; L623-F795 PolarHBondContact N-O 3.4Å; G750-F795 VanDerWaalsContact CA-CD1 3.46Å; W770-F795 HydrophobicContact CH2-CB 4.06Å; W770-F795 HydrophobicContact CZ3-CB 3.71Å; W770-F795 HydrophobicContact CZ3-CD1 4.24Å; W770-F795 HydrophobicContact CZ3-CG 4.17Å; V776-F795 HydrophobicContact CG1-CZ 4.05Å; V776-F795 HydrophobicContact CG2-CZ 3.86Å; H793-F795 HydrophobicContact CB-CD1 4.17Å; H793-F795 HydrophobicContact CB-CD2 4.4Å; H793-F795 HydrophobicContact CB-CE1 3.72Å; H793-F795 HydrophobicContact CB-CE2 3.97Å; H793-F795 HydrophobicContact CB-CG 4.5Å; H793-F795 HydrophobicContact CB-CZ 3.62Å; H793-F795 AromaticContact CG-CZ 3.84Å; H793-F795 AromaticContact ND1-CZ 3.9Å; H793-F795 PolarHBondContact O-N 3.05Å; F795-R799 HydrophobicContact CB-CB 4.17Å; F795-R799 HydrophobicContact CB-CG 4.04Å; F795-R799 HydrophobicContact CD2-CB 4.38Å; F795-R799 HydrophobicContact CD2-CG 4.34Å; F795-R799 HydrophobicContact CG-CG 4.43Å; F795-L800 HydrophobicContact CE2-CB 4.1Å; F795-L800 HydrophobicContact CE2-CD1 4.28Å; F795-M803 HydrophobicContact CD1-CE 4.3Å; F795-M803 HydrophobicContact CD2-CE 4.05Å; F795-M803 HydrophobicContact CE1-CE 4.29Å; F795-M803 HydrophobicContact CE2-CE 4.04Å; F795-M803 HydrophobicContact CE2-SD 4.28Å; F795-M803 HydrophobicContact CG-CE 4.17Å; F795-M803 HydrophobicContact CZ-CE 4.16Å
796	P	92.4	Very high	92.1	Very high	40 Å²	40	52 Å²	52	26%	0.26	27%	0.271	S	S	.	.			trans	-73.8	160	-177.8	30.1	-34.8	0	0	0	111.7	E624 S798 R799 L800	E624-P796 VanDerWaalsContact OE2-CA 3.28Å; E624-P796 WeakPolarHBondContact OE2-CA 3.32Å; P796-S798 PolarHBondContact O-N 2.68Å; P796-R799 HydrophobicContact CG-CB 3.91Å; P796-R799 WeakPolarHBondContact O-CB 3.4Å; P796-R799 PolarHBondContact O-N 2.94Å; P796-L800 PolarHBondContact O-N 3.01Å
797	R	93.6	Very high	92.9	Very high	96 Å²	96	51.4 Å²	51.4	36%	0.362	26%	0.262	S	S	.	.	H	α-helix	trans	-54.6	-39.1	174.5	-73	174	179	92.5	0.1	112.8	Y622 E624 D625 R799 L800 E801	Y622-R797 HydrophobicContact CD1-CB 4.44Å; Y622-R797 HydrophobicContact CD1-CG 3.64Å; Y622-R797 HydrophobicContact CD2-CG 3.68Å; Y622-R797 HydrophobicContact CE1-CG 4.05Å; Y622-R797 HydrophobicContact CE2-CG 4.12Å; Y622-R797 HydrophobicContact CG-CG 3.43Å; Y622-R797 VanDerWaalsContact CG-CG 3.43Å; E624-R797 WeakPolarHBondContact OE1-CD 3.42Å; E624-R797 VanDerWaalsContact OE1-CG 3.26Å; E624-R797 WeakPolarHBondContact OE1-CG 3.47Å; E624-R797 IonicContact OE1-CZ 3.66Å; E624-R797 PolarHBondContact OE1-N 3.16Å; E624-R797 IonicContact OE1-NE 3.91Å; E624-R797 IonicContact OE1-NH1 2.75Å; E624-R797 PolarHBondContact OE1-NH1 3.4Å; D625-R797 IonicContact OD1-CZ 3.97Å; D625-R797 IonicContact OD1-NH1 3.26Å; D625-R797 PolarHBondContact OD1-NH1 2.75Å; D625-R797 IonicContact OD1-NH2 3.65Å; D625-R797 IonicContact OD2-CZ 3.39Å; D625-R797 IonicContact OD2-NH1 3.21Å; D625-R797 PolarHBondContact OD2-NH1 2.82Å; D625-R797 IonicContact OD2-NH2 2.76Å; D625-R797 PolarHBondContact OD2-NH2 2.76Å; R797-R799 PolarHBondContact O-N 3.43Å; R797-L800 WeakPolarHBondContact O-CB 3.27Å; R797-L800 PolarHBondContact O-N 2.99Å; R797-E801 PolarHBondContact O-N 3.27Å; R797-E801 VanDerWaalsContact O-N 3.13Å
798	S	92.2	Very high	93.4	Very high	67 Å²	67	50.8 Å²	50.8	47%	0.469	26%	0.264	S	S	.	.	H	α-helix	trans	-61	-27.9	176.1	58.8	0	0	0	0	113.5	P796 K802	P796-S798 PolarHBondContact O-N 2.68Å; S798-K802 WeakPolarHBondContact O-CG 3.41Å; S798-K802 PolarHBondContact O-N 3.36Å
799	R	93.2	Very high	93.6	Very high	41 Å²	41	48.3 Å²	48.3	16%	0.155	25%	0.247	C	C	.	.	H	α-helix	trans	-71.7	-43.1	172.4	174	65.1	68.9	167.8	3.6	111	E645 D646 W770 F795 P796 R797 E801 K802 M803	E645-R799 PolarHBondContact O-NH1 3.03Å; E645-R799 PolarHBondContact O-NH2 3.19Å; D646-R799 IonicContact OD1-NH1 2.7Å; W770-R799 HydrophobicContact CD2-CG 4.21Å; W770-R799 HydrophobicContact CE3-CG 4Å; W770-R799 HydrophobicContact CH2-CG 4.3Å; W770-R799 HydrophobicContact CZ2-CG 4.49Å; W770-R799 HydrophobicContact CZ3-CG 4.06Å; W770-R799 VanDerWaalsContact NE1-CZ 3.28Å; F795-R799 HydrophobicContact CB-CB 4.17Å; F795-R799 HydrophobicContact CB-CG 4.04Å; F795-R799 HydrophobicContact CD2-CB 4.38Å; F795-R799 HydrophobicContact CD2-CG 4.34Å; F795-R799 HydrophobicContact CG-CG 4.43Å; P796-R799 HydrophobicContact CG-CB 3.91Å; P796-R799 WeakPolarHBondContact O-CB 3.4Å; P796-R799 PolarHBondContact O-N 2.94Å; R797-R799 PolarHBondContact O-N 3.43Å; R799-E801 PolarHBondContact O-N 3.4Å; R799-K802 PolarHBondContact O-N 3.35Å; R799-M803 HydrophobicContact CG-CE 3.88Å; R799-M803 HydrophobicContact CG-CG 4.49Å; R799-M803 WeakPolarHBondContact O-CG 3.39Å; R799-M803 PolarHBondContact O-N 2.91Å
800	L	94.2	Very high	93.6	Very high	34 Å²	34	50.1 Å²	50.1	18%	0.178	25%	0.254	C	S	.	.	H	α-helix	trans	-58.1	-38.8	177.2	-178.2	64.5	0	0	0	111.4	Y622 R773 V776 F795 P796 R797 K802 M803	Y622-L800 HydrophobicContact CE1-CB 4.39Å; Y622-L800 HydrophobicContact CE1-CD2 3.79Å; Y622-L800 VanDerWaalsContact OH-CD2 3.29Å; Y622-L800 WeakPolarHBondContact OH-CD2 3.26Å; R773-L800 HydrophobicContact CG-CD1 4.04Å; R773-L800 PolarHBondContact NE-O 2.83Å; V776-L800 HydrophobicContact CB-CD1 4.3Å; V776-L800 HydrophobicContact CG1-CD1 4.26Å; V776-L800 HydrophobicContact CG2-CD1 4.08Å; F795-L800 HydrophobicContact CE2-CB 4.1Å; F795-L800 HydrophobicContact CE2-CD1 4.28Å; P796-L800 PolarHBondContact O-N 3.01Å; R797-L800 WeakPolarHBondContact O-CB 3.27Å; R797-L800 PolarHBondContact O-N 2.99Å; L800-K802 VanDerWaalsContact C-N 3.28Å; L800-K802 PolarHBondContact O-N 3.45Å; L800-M803 HydrophobicContact CD1-SD 3.9Å; L800-M803 PolarHBondContact O-N 3.09Å
801	E	93.5	Very high	93.4	Very high	139 Å²	139	48.1 Å²	48.1	65%	0.65	25%	0.246	S	C	*	.	H	α-helix	trans	-65.9	-26.8	175	-68.5	171.9	-172.9	0	0	113.2	R773 R797 R799	R773-E801 PolarHBondContact NH2-O 2.88Å; R797-E801 PolarHBondContact O-N 3.27Å; R797-E801 VanDerWaalsContact O-N 3.13Å; R799-E801 PolarHBondContact O-N 3.4Å
802	K	92.5	Very high	93.3	Very high	122 Å²	122	51.8 Å²	51.8	53%	0.53	27%	0.265	S	S	.	.	H	α-helix	trans	-88.6	-19.5	175.3	-68.7	178.5	179.3	-179.1	0	113.6	E645 S798 R799 L800	E645-K802 VanDerWaalsContact CD-NZ 3.3Å; E645-K802 IonicContact OE1-NZ 2.73Å; E645-K802 PolarHBondContact OE1-NZ 2.79Å; E645-K802 IonicContact OE2-NZ 3.75Å; E645-K802 PolarHBondContact OE2-NZ 3.19Å; S798-K802 WeakPolarHBondContact O-CG 3.41Å; S798-K802 PolarHBondContact O-N 3.36Å; R799-K802 PolarHBondContact O-N 3.35Å; L800-K802 VanDerWaalsContact C-N 3.28Å; L800-K802 PolarHBondContact O-N 3.45Å
803	M	94	Very high	92.9	Very high	10 Å²	10	53 Å²	53	5%	0.049	27%	0.27	C	S	.	.	S	Bend	trans	-62.5	141.9	178.4	-74.8	167.4	168.5	0	0	111.9	W770 V771 R773 V776 F795 R799 L800	W770-M803 HydrophobicContact CB-CE 4.32Å; W770-M803 HydrophobicContact CD2-CE 4.21Å; W770-M803 HydrophobicContact CE3-CE 3.4Å; W770-M803 HydrophobicContact CZ3-CE 4.11Å; V771-M803 HydrophobicContact CG2-CE 4.46Å; V771-M803 WeakPolarHBondContact O-CG 3.4Å; R773-M803 HydrophobicContact CG-CB 4Å; R773-M803 PolarHBondContact NE-O 3.21Å; V776-M803 HydrophobicContact CG2-SD 4.08Å; F795-M803 HydrophobicContact CD1-CE 4.3Å; F795-M803 HydrophobicContact CD2-CE 4.05Å; F795-M803 HydrophobicContact CE1-CE 4.29Å; F795-M803 HydrophobicContact CE2-CE 4.04Å; F795-M803 HydrophobicContact CE2-SD 4.28Å; F795-M803 HydrophobicContact CG-CE 4.17Å; F795-M803 HydrophobicContact CZ-CE 4.16Å; R799-M803 HydrophobicContact CG-CE 3.88Å; R799-M803 HydrophobicContact CG-CG 4.49Å; R799-M803 WeakPolarHBondContact O-CG 3.39Å; R799-M803 PolarHBondContact O-N 2.91Å; L800-M803 HydrophobicContact CD1-SD 3.9Å; L800-M803 PolarHBondContact O-N 3.09Å
804	V	93.1	Very high	92.5	Very high	84 Å²	84	53.9 Å²	53.9	51%	0.509	28%	0.275	S	S	.	.			trans	-62.7	146.9	176	-64.6	0	0	0	0	110.9	S772 R773 F806	S772-V804 CarbonylContact C-O 3.59Å; S772-V804 VanDerWaalsContact CA-O 3.25Å; S772-V804 WeakPolarHBondContact CA-O 3.05Å; S772-V804 VanDerWaalsContact CB-O 3.29Å; S772-V804 WeakPolarHBondContact CB-O 3.46Å; R773-V804 PolarHBondContact N-O 3.2Å; V804-F806 VanDerWaalsContact C-N 3.35Å; V804-F806 WeakPolarHBondContact CG2-O 3.42Å; V804-F806 PolarHBondContact O-N 3.07Å
805	P	92.2	Very high	92.2	Very high	72 Å²	72	55 Å²	55	47%	0.468	28%	0.283	S	S	.	.	S	Bend	trans	-62	-41	-178.7	-24.8	34.5	0	0	0	113.4	A774	A774-P805 WeakPolarHBondContact CB-O 3.23Å; A774-P805 PolarHBondContact N-O 3.01Å; A774-P805 VanDerWaalsContact N-O 3.11Å
806	F	90.5	Very high	92.2	Very high	98 Å²	98	55.2 Å²	55.2	43%	0.43	28%	0.284	S	S	.	.	S	Bend	trans	-135.4	150.6	-176.4	-51.4	-65.5	0	0	0	110.1	D595 S772 A774 V804	D595-F806 HydrophobicContact CB-CE2 4.29Å; S772-F806 VanDerWaalsContact CB-C 3.41Å; A774-F806 HydrophobicContact CB-CD1 3.84Å; A774-F806 HydrophobicContact CB-CE1 4.29Å; V804-F806 VanDerWaalsContact C-N 3.35Å; V804-F806 WeakPolarHBondContact CG2-O 3.42Å; V804-F806 PolarHBondContact O-N 3.07Å
807	Q	89	Confident	92.2	Very high	51 Å²	51	54 Å²	54	24%	0.238	27%	0.274	C	S	.	.	P	Polyproline II helix	trans	-66.8	148.3	175	-170.8	173.3	-1.2	0	0	110.8	H752 E754 S772	H752-Q807 PolarHBondContact CE1-NE2 2.68Å; E754-Q807 PolarHBondContact OE2-NE2 2.95Å; S772-Q807 PolarHBondContact OG-N 3.37Å
808	V	91	Very high	92.2	Very high	78 Å²	78	52.4 Å²	52.4	47%	0.473	27%	0.273	S	S	.	.	P	Polyproline II helix	trans	-66.1	127.5	172.2	-179.5	0	0	0	0	108.9	L812 R813	V808-L812 HydrophobicContact CG1-CB 4.08Å; V808-L812 HydrophobicContact CG1-CD1 4.21Å; V808-R813 PolarHBondContact O-NE 3.13Å
809	P	92.6	Very high	92.2	Very high	12 Å²	12	49.7 Å²	49.7	8%	0.078	25%	0.253	C	S	.	.	P	Polyproline II helix	trans	-54.5	142.6	179.4	-27.5	35	0	0	0	113	R564 I811 L812 D841	R564-P809 HydrophobicContact CB-CB 4.01Å; R564-P809 HydrophobicContact CB-CG 4.37Å; R564-P809 HydrophobicContact CG-CG 4.45Å; P809-I811 VanDerWaalsContact C-N 3.27Å; P809-I811 HydrophobicContact CB-CG2 4.08Å; P809-I811 PolarHBondContact O-N 3.39Å; P809-L812 HydrophobicContact CB-CD1 4.49Å; P809-L812 HydrophobicContact CB-CG 4.31Å; P809-L812 HydrophobicContact CG-CD1 4.32Å; P809-L812 PolarHBondContact O-N 3.29Å; P809-D841 HydrophobicContact CG-CB 4.33Å
810	E	92.6	Very high	92.4	Very high	41 Å²	41	47.7 Å²	47.7	19%	0.192	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-61.8	-35.6	-175.2	-171.6	167.5	-141.5	0	0	113.2	R564 D565 V566 L812 R813 T814	R564-E810 WeakPolarHBondContact O-CB 3.38Å; R564-E810 PolarHBondContact O-N 3.07Å; D565-E810 WeakPolarHBondContact CA-OE2 3.42Å; V566-E810 HydrophobicContact CB-CB 4.08Å; V566-E810 HydrophobicContact CB-CG 3.92Å; V566-E810 HydrophobicContact CG1-CG 4.34Å; V566-E810 PolarHBondContact N-OE2 2.82Å; E810-L812 PolarHBondContact O-N 3.41Å; E810-R813 WeakPolarHBondContact O-CG 3.39Å; E810-R813 PolarHBondContact O-N 2.94Å; E810-R813 IonicContact OE1-NH2 3.96Å; E810-T814 HydrophobicContact CG-CG2 3.49Å; E810-T814 VanDerWaalsContact CG-CG2 3.49Å; E810-T814 PolarHBondContact O-N 2.98Å; E810-T814 VanDerWaalsContact O-N 3.13Å; E810-T814 PolarHBondContact O-OG1 3.47Å; E810-T814 VanDerWaalsContact O-OG1 3.05Å
811	I	93.7	Very high	92.4	Very high	2 Å²	2	46.5 Å²	46.5	1%	0.01	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-57.9	-19.3	176.1	-165.1	166.9	0	0	0	113.7	V566 D569 P809 L816 L819 A839	V566-I811 HydrophobicContact CG2-CB 4.1Å; V566-I811 HydrophobicContact CG2-CG1 4.3Å; D569-I811 HydrophobicContact CB-CD1 4.46Å; P809-I811 VanDerWaalsContact C-N 3.27Å; P809-I811 HydrophobicContact CB-CG2 4.08Å; P809-I811 PolarHBondContact O-N 3.39Å; I811-L816 HydrophobicContact CG1-CD2 4.19Å; I811-L819 HydrophobicContact CD1-CD2 3.85Å; I811-L819 HydrophobicContact CG1-CD2 3.86Å; I811-A839 HydrophobicContact CD1-CB 3.99Å
812	L	93.4	Very high	92.4	Very high	77 Å²	77	42.3 Å²	42.3	40%	0.403	22%	0.22	S	C	.	.	G	3₁₀ helix	trans	-93	-6.5	178.5	-54.7	-175.1	0	0	0	113.5	V808 P809 E810 D841 S842 P843	V808-L812 HydrophobicContact CG1-CB 4.08Å; V808-L812 HydrophobicContact CG1-CD1 4.21Å; P809-L812 HydrophobicContact CB-CD1 4.49Å; P809-L812 HydrophobicContact CB-CG 4.31Å; P809-L812 HydrophobicContact CG-CD1 4.32Å; P809-L812 PolarHBondContact O-N 3.29Å; E810-L812 PolarHBondContact O-N 3.41Å; L812-D841 HydrophobicContact CD1-CB 4.16Å; L812-D841 HydrophobicContact CD2-CB 4.42Å; L812-S842 WeakPolarHBondContact CD2-O 3.39Å; L812-P843 HydrophobicContact CD2-CB 4.39Å
813	R	91	Very high	92.6	Very high	37 Å²	37	36.6 Å²	36.6	14%	0.14	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-132.5	-4.4	-169.6	57.8	175.9	-176.4	71.7	7.4	114.8	E754 E755 R756 Y757 V808 E810	E754-R813 IonicContact OE2-NE 2.67Å; E755-R813 PolarHBondContact O-NH1 2.86Å; R756-R813 CarbonylContact C-O 3.6Å; R756-R813 WeakPolarHBondContact CA-O 3.46Å; Y757-R813 WeakPolarHBondContact CB-O 3.47Å; Y757-R813 PolarHBondContact N-O 3.18Å; V808-R813 PolarHBondContact O-NE 3.13Å; E810-R813 WeakPolarHBondContact O-CG 3.39Å; E810-R813 PolarHBondContact O-N 2.94Å; E810-R813 IonicContact OE1-NH2 3.96Å
814	T	88.7	Confident	92.6	Very high	18 Å²	18	36.4 Å²	36.4	11%	0.11	19%	0.194	C	C	.	.	S	Bend	trans	-111	159.5	178	55.9	0	0	0	0	112.4	E810	E810-T814 HydrophobicContact CG-CG2 3.49Å; E810-T814 VanDerWaalsContact CG-CG2 3.49Å; E810-T814 PolarHBondContact O-N 2.98Å; E810-T814 VanDerWaalsContact O-N 3.13Å; E810-T814 PolarHBondContact O-OG1 3.47Å; E810-T814 VanDerWaalsContact O-OG1 3.05Å
815	P	89.6	Confident	92.6	Very high	35 Å²	35	34.1 Å²	34.1	23%	0.227	18%	0.179	C	C	.	.			trans	-58.1	138.1	171	-14.9	23.9	0	0	0	111.8	Y757 E817	Y757-P815 HydrophobicContact CD2-CB 4.2Å; Y757-P815 HydrophobicContact CD2-CG 3.53Å; Y757-P815 HydrophobicContact CE2-CB 4.08Å; Y757-P815 HydrophobicContact CE2-CG 3.74Å; Y757-P815 HydrophobicContact CG-CG 4.09Å; P815-E817 WeakPolarHBondContact CB-OE2 3.26Å
816	L	93.1	Very high	92.6	Very high	6 Å²	6	32.1 Å²	32.1	3%	0.031	16%	0.163	C	C	.	.			trans	-100.4	-1.1	-170.9	-63.4	179.3	0	0	0	114.3	I811 N818 L819 V820 P843 A847 V848 A851	I811-L816 HydrophobicContact CG1-CD2 4.19Å; L816-N818 VanDerWaalsContact C-N 3.34Å; L816-N818 PolarHBondContact O-N 2.89Å; L816-L819 HydrophobicContact CD2-CD2 4.05Å; L816-L819 CarbonylContact O-C 3.22Å; L816-L819 WeakPolarHBondContact O-CA 3.39Å; L816-L819 WeakPolarHBondContact O-CB 3.33Å; L816-L819 PolarHBondContact O-N 3.12Å; L816-V820 WeakPolarHBondContact O-CG2 3.21Å; L816-V820 PolarHBondContact O-N 3.31Å; L816-P843 HydrophobicContact CD1-CB 3.67Å; L816-P843 HydrophobicContact CD1-CG 4.08Å; L816-A847 HydrophobicContact CD1-CB 4.03Å; L816-V848 HydrophobicContact CD1-CG2 3.83Å; L816-A851 HydrophobicContact CB-CB 3.89Å
817	E	93.4	Very high	92.7	Very high	13 Å²	13	29.3 Å²	29.3	6%	0.061	15%	0.152	C	C	.	.	H	α-helix	trans	-62.7	-40.7	-172.1	-51.9	86.8	170.2	0	0	112	P815 L819 V820 L821 A851 L854 L855	P815-E817 WeakPolarHBondContact CB-OE2 3.26Å; E817-L819 VanDerWaalsContact C-N 3.29Å; E817-L819 PolarHBondContact O-N 2.93Å; E817-V820 PolarHBondContact O-N 2.83Å; E817-L821 WeakPolarHBondContact O-CB 3.28Å; E817-L821 PolarHBondContact O-N 2.92Å; E817-A851 HydrophobicContact CB-CB 4.47Å; E817-A851 HydrophobicContact CG-CB 3.86Å; E817-L854 HydrophobicContact CG-CB 4.3Å; E817-L854 HydrophobicContact CG-CD2 3.6Å; E817-L854 HydrophobicContact CG-CG 4.34Å; E817-L854 WeakPolarHBondContact OE1-CD2 3.35Å; E817-L855 HydrophobicContact CB-CD2 4.21Å; E817-L855 HydrophobicContact CB-CG 4.23Å
818	N	92.1	Very high	92.8	Very high	64 Å²	64	30 Å²	30	34%	0.342	16%	0.161	S	C	.	.	H	α-helix	trans	-61.8	-39.4	172.6	-80.4	-45.8	0	0	0	111.7	L816 L821 Q822 P881	L816-N818 VanDerWaalsContact C-N 3.34Å; L816-N818 PolarHBondContact O-N 2.89Å; N818-L821 PolarHBondContact O-N 3.32Å; N818-Q822 VanDerWaalsContact O-CG 3.28Å; N818-Q822 WeakPolarHBondContact O-CG 3.37Å; N818-Q822 PolarHBondContact O-N 3.31Å; N818-P881 VanDerWaalsContact OD1-CD 3.31Å; N818-P881 WeakPolarHBondContact OD1-CD 3.35Å
819	L	93.5	Very high	92.8	Very high	9 Å²	9	31.6 Å²	31.6	5%	0.047	16%	0.163	C	C	.	.	H	α-helix	trans	-69.9	-41.2	179.1	-98.7	68	0	0	0	111.9	V566 F570 I811 L816 E817 Q822 A823 L836	V566-L819 HydrophobicContact CG1-CD1 4.46Å; V566-L819 HydrophobicContact CG2-CD1 3.48Å; V566-L819 VanDerWaalsContact CG2-CD1 3.48Å; V566-L819 HydrophobicContact CG2-CD2 3.34Å; V566-L819 HydrophobicContact CG2-CG 3.99Å; F570-L819 HydrophobicContact CD2-CD2 4.4Å; F570-L819 HydrophobicContact CD2-CG 4.03Å; F570-L819 WeakPolarHBondContact CE2-O 3.44Å; I811-L819 HydrophobicContact CD1-CD2 3.85Å; I811-L819 HydrophobicContact CG1-CD2 3.86Å; L816-L819 HydrophobicContact CD2-CD2 4.05Å; L816-L819 CarbonylContact O-C 3.22Å; L816-L819 WeakPolarHBondContact O-CA 3.39Å; L816-L819 WeakPolarHBondContact O-CB 3.33Å; L816-L819 PolarHBondContact O-N 3.12Å; E817-L819 VanDerWaalsContact C-N 3.29Å; E817-L819 PolarHBondContact O-N 2.93Å; L819-Q822 PolarHBondContact O-N 2.87Å; L819-A823 WeakPolarHBondContact O-CB 3.34Å; L819-A823 PolarHBondContact O-N 2.92Å; L819-L836 HydrophobicContact CB-CD2 4.49Å; L819-L836 HydrophobicContact CD2-CD2 4.28Å
820	V	96.3	Very high	92.9	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-61.3	-46.6	174.8	173.3	0	0	0	0	109.8	L816 E817 Q822 A823 K824 A832 L836 V848 A851 V852 L855 L861	L816-V820 WeakPolarHBondContact O-CG2 3.21Å; L816-V820 PolarHBondContact O-N 3.31Å; E817-V820 PolarHBondContact O-N 2.83Å; V820-Q822 PolarHBondContact O-N 2.87Å; V820-A823 WeakPolarHBondContact O-CB 3.3Å; V820-A823 PolarHBondContact O-N 3.5Å; V820-K824 WeakPolarHBondContact O-CG 3.36Å; V820-K824 PolarHBondContact O-N 3.05Å; V820-A832 HydrophobicContact CB-CB 4.45Å; V820-A832 HydrophobicContact CG1-CB 3.76Å; V820-A832 HydrophobicContact CG2-CB 4.06Å; V820-L836 HydrophobicContact CG2-CD1 4.11Å; V820-V848 HydrophobicContact CG2-CG1 4.36Å; V820-A851 HydrophobicContact CG2-CB 3.88Å; V820-V852 HydrophobicContact CG1-CG2 3.86Å; V820-V852 HydrophobicContact CG2-CG2 4.41Å; V820-L855 HydrophobicContact CB-CD1 3.76Å; V820-L855 HydrophobicContact CG1-CD1 3.5Å; V820-L861 HydrophobicContact CG1-CD1 4.01Å
821	L	95.2	Very high	93.1	Very high	8 Å²	8	33.8 Å²	33.8	4%	0.042	18%	0.175	C	C	.	.	H	α-helix	trans	-58.8	-47.7	175.3	177.4	55.2	0	0	0	111.5	E817 N818 A823 K824 I825 L855 V860 L867 P881	E817-L821 WeakPolarHBondContact O-CB 3.28Å; E817-L821 PolarHBondContact O-N 2.92Å; N818-L821 PolarHBondContact O-N 3.32Å; L821-A823 VanDerWaalsContact C-N 3.32Å; L821-A823 PolarHBondContact O-N 3.14Å; L821-K824 PolarHBondContact O-N 3.09Å; L821-I825 HydrophobicContact CD1-CD1 4.18Å; L821-I825 HydrophobicContact CD1-CG1 4.36Å; L821-I825 HydrophobicContact CG-CD1 4.08Å; L821-I825 VanDerWaalsContact O-CG1 3.31Å; L821-I825 WeakPolarHBondContact O-CG1 3.14Å; L821-I825 PolarHBondContact O-N 3.31Å; L821-L855 HydrophobicContact CB-CD1 4.31Å; L821-V860 HydrophobicContact CD1-CG1 3.82Å; L821-L867 HydrophobicContact CD1-CD2 3.56Å; L821-P881 HydrophobicContact CD2-CB 4.43Å; L821-P881 HydrophobicContact CD2-CG 4.06Å
822	Q	93.4	Very high	93.2	Very high	52 Å²	52	33.7 Å²	33.7	24%	0.243	17%	0.174	C	C	.	.	H	α-helix	trans	-60.4	-40.6	175.5	-69.9	-59.9	-47.9	0	0	112.2	Q545 F570 N818 L819 V820 K824 I825 H826	Q545-Q822 VanDerWaalsContact NE2-OE1 3.15Å; F570-Q822 HydrophobicContact CE1-CB 4.03Å; F570-Q822 HydrophobicContact CE2-CB 3.94Å; F570-Q822 HydrophobicContact CZ-CB 3.54Å; N818-Q822 VanDerWaalsContact O-CG 3.28Å; N818-Q822 WeakPolarHBondContact O-CG 3.37Å; N818-Q822 PolarHBondContact O-N 3.31Å; L819-Q822 PolarHBondContact O-N 2.87Å; V820-Q822 PolarHBondContact O-N 2.87Å; Q822-K824 VanDerWaalsContact C-N 3.29Å; Q822-K824 PolarHBondContact O-N 3.13Å; Q822-I825 PolarHBondContact O-N 3.06Å; Q822-H826 PolarHBondContact O-CD2 2.87Å; Q822-H826 VanDerWaalsContact O-CD2 3.25Å; Q822-H826 PolarHBondContact O-N 2.98Å
823	A	95.3	Very high	93.4	Very high	2 Å²	2	31.9 Å²	31.9	2%	0.017	17%	0.166	C	C	.	.	H	α-helix	trans	-58.5	-43.8	176.2	0	0	0	0	0	110.9	F570 L819 V820 L821 I825 H826 M827 F835	F570-A823 HydrophobicContact CE2-CB 4.06Å; F570-A823 HydrophobicContact CZ-CB 4.41Å; L819-A823 WeakPolarHBondContact O-CB 3.34Å; L819-A823 PolarHBondContact O-N 2.92Å; V820-A823 WeakPolarHBondContact O-CB 3.3Å; V820-A823 PolarHBondContact O-N 3.5Å; L821-A823 VanDerWaalsContact C-N 3.32Å; L821-A823 PolarHBondContact O-N 3.14Å; A823-I825 PolarHBondContact O-N 2.89Å; A823-H826 PolarHBondContact O-N 3.23Å; A823-M827 CarbonylContact O-C 3.46Å; A823-M827 WeakPolarHBondContact O-CA 3.49Å; A823-M827 PolarHBondContact O-N 2.99Å; A823-F835 HydrophobicContact CB-CB 4.23Å; A823-F835 HydrophobicContact CB-CD1 3.5Å; A823-F835 VanDerWaalsContact CB-CD1 3.5Å; A823-F835 HydrophobicContact CB-CE1 4Å; A823-F835 HydrophobicContact CB-CG 3.84Å
824	K	94.9	Very high	93.6	Very high	5 Å²	5	34.8 Å²	34.8	2%	0.022	18%	0.182	C	C	.	.	H	α-helix	trans	-70.4	-28.7	178.2	-63.9	-48.8	-44.6	-155	0	113.9	V820 L821 Q822 P828 K830 L861 E865 L867	V820-K824 WeakPolarHBondContact O-CG 3.36Å; V820-K824 PolarHBondContact O-N 3.05Å; L821-K824 PolarHBondContact O-N 3.09Å; Q822-K824 VanDerWaalsContact C-N 3.29Å; Q822-K824 PolarHBondContact O-N 3.13Å; K824-P828 WeakPolarHBondContact CE-O 3.43Å; K824-P828 PolarHBondContact NZ-O 3.13Å; K824-P828 VanDerWaalsContact O-CA 3.31Å; K824-P828 WeakPolarHBondContact O-CA 3.31Å; K824-P828 WeakPolarHBondContact O-CB 3.41Å; K824-K830 PolarHBondContact NZ-O 3.09Å; K824-L861 HydrophobicContact CB-CD2 4.32Å; K824-L861 HydrophobicContact CG-CD1 4.3Å; K824-L861 HydrophobicContact CG-CD2 3.92Å; K824-E865 HydrophobicContact CD-CB 4.38Å; K824-E865 WeakPolarHBondContact CD-O 3.24Å; K824-E865 WeakPolarHBondContact CE-O 3.28Å; K824-E865 PolarHBondContact NZ-O 2.94Å; K824-L867 HydrophobicContact CB-CD2 4.37Å; K824-L867 HydrophobicContact CB-CG 4.24Å
825	I	92	Very high	94	Very high	37 Å²	37	34.2 Å²	34.2	19%	0.19	18%	0.178	C	C	.	.	H	α-helix	trans	-69.1	-43.6	172.3	-66.5	165.3	0	0	0	110.7	Q545 L821 Q822 A823 L867 A875	Q545-I825 HydrophobicContact CG-CG2 4.01Å; L821-I825 HydrophobicContact CD1-CD1 4.18Å; L821-I825 HydrophobicContact CD1-CG1 4.36Å; L821-I825 HydrophobicContact CG-CD1 4.08Å; L821-I825 VanDerWaalsContact O-CG1 3.31Å; L821-I825 WeakPolarHBondContact O-CG1 3.14Å; L821-I825 PolarHBondContact O-N 3.31Å; Q822-I825 PolarHBondContact O-N 3.06Å; A823-I825 PolarHBondContact O-N 2.89Å; I825-L867 HydrophobicContact CG1-CD1 4.19Å; I825-A875 HydrophobicContact CD1-CB 3.57Å; I825-A875 HydrophobicContact CG1-CB 3.7Å
826	H	92.3	Very high	94.3	Very high	29 Å²	29	32.6 Å²	32.6	13%	0.134	17%	0.167	C	C	.	.	H	α-helix	trans	-84.1	-32.8	-174.5	-79.2	-76.3	0	0	0	114.5	L541 Q545 F570 L574 Q822 A823	L541-H826 PolarHBondContact O-CE1 3.34Å; L541-H826 PolarHBondContact O-NE2 3.47Å; Q545-H826 WeakPolarHBondContact CG-CE1 3.48Å; Q545-H826 PolarHBondContact NE2-NE2 3.44Å; F570-H826 AromaticContact CE1-CD2 3.9Å; L574-H826 HydrophobicContact CD1-CB 4.39Å; L574-H826 HydrophobicContact CD2-CB 3.86Å; Q822-H826 PolarHBondContact O-CD2 2.87Å; Q822-H826 VanDerWaalsContact O-CD2 3.25Å; Q822-H826 PolarHBondContact O-N 2.98Å; A823-H826 PolarHBondContact O-N 3.23Å
827	M	92.8	Very high	94.5	Very high	40 Å²	40	35.3 Å²	35.3	20%	0.197	19%	0.187	C	C	.	.			trans	-139.7	67.6	-175.2	-64.6	-77.7	172.3	0	0	109.4	L574 A823 E829 K830 F835	L574-M827 HydrophobicContact CD2-CE 4.18Å; A823-M827 CarbonylContact O-C 3.46Å; A823-M827 WeakPolarHBondContact O-CA 3.49Å; A823-M827 PolarHBondContact O-N 2.99Å; M827-E829 VanDerWaalsContact C-OE2 3.24Å; M827-E829 WeakPolarHBondContact CA-OE2 2.95Å; M827-E829 PolarHBondContact O-N 3.1Å; M827-E829 VanDerWaalsContact O-N 3.09Å; M827-K830 HydrophobicContact CB-CB 4.49Å; M827-K830 PolarHBondContact O-N 3.44Å; M827-K830 VanDerWaalsContact O-N 3.16Å; M827-K830 PolarHBondContact SD-NZ 2.93Å; M827-K830 VanDerWaalsContact SD-NZ 3.37Å; M827-F835 HydrophobicContact CB-CD2 3.98Å; M827-F835 HydrophobicContact CB-CE2 4.28Å; M827-F835 HydrophobicContact CG-CD2 3.77Å; M827-F835 HydrophobicContact CG-CE2 3.64Å
828	P	91.5	Very high	94.6	Very high	64 Å²	64	39.2 Å²	39.2	42%	0.416	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-24.4	-174.1	24.3	-34.5	0	0	0	113.5	K824 Y866	K824-P828 WeakPolarHBondContact CE-O 3.43Å; K824-P828 PolarHBondContact NZ-O 3.13Å; K824-P828 VanDerWaalsContact O-CA 3.31Å; K824-P828 WeakPolarHBondContact O-CA 3.31Å; K824-P828 WeakPolarHBondContact O-CB 3.41Å; P828-Y866 WeakPolarHBondContact O-CE1 3.36Å
829	E	91.4	Very high	94.7	Very high	112 Å²	112	36.6 Å²	36.6	52%	0.523	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-17.2	-178.2	78.8	-67.7	166.1	0	0	114.7	M827	M827-E829 VanDerWaalsContact C-OE2 3.24Å; M827-E829 WeakPolarHBondContact CA-OE2 2.95Å; M827-E829 PolarHBondContact O-N 3.1Å; M827-E829 VanDerWaalsContact O-N 3.09Å
830	K	94	Very high	94.8	Very high	53 Å²	53	37.1 Å²	37.1	23%	0.23	19%	0.194	C	C	.	.	S	Bend	trans	-98.2	149.9	179.5	-62.6	-170.3	-176.3	75	0	111.1	K824 M827 E834	K824-K830 PolarHBondContact NZ-O 3.09Å; M827-K830 HydrophobicContact CB-CB 4.49Å; M827-K830 PolarHBondContact O-N 3.44Å; M827-K830 VanDerWaalsContact O-N 3.16Å; M827-K830 PolarHBondContact SD-NZ 2.93Å; M827-K830 VanDerWaalsContact SD-NZ 3.37Å; K830-E834 HydrophobicContact CB-CB 4.46Å
831	T	96.5	Very high	94.7	Very high	47 Å²	47	38.7 Å²	38.7	29%	0.288	20%	0.202	S	C	.	.			trans	-69.9	157.6	166.5	63.9	0	0	0	0	110.8	V833 E834 F835 E865	T831-V833 VanDerWaalsContact C-N 3.26Å; T831-V833 PolarHBondContact O-N 3.27Å; T831-E834 PolarHBondContact N-OE2 2.66Å; T831-E834 PolarHBondContact O-N 3.41Å; T831-E834 VanDerWaalsContact OG1-CB 3.28Å; T831-E834 WeakPolarHBondContact OG1-CB 3.06Å; T831-E834 VanDerWaalsContact OG1-CD 3.22Å; T831-E834 WeakPolarHBondContact OG1-CG 3.2Å; T831-E834 PolarHBondContact OG1-N 3.02Å; T831-E834 VanDerWaalsContact OG1-N 3.16Å; T831-E834 PolarHBondContact OG1-OE2 2.94Å; T831-F835 PolarHBondContact O-N 3.15Å; T831-E865 WeakPolarHBondContact CA-OE2 3.2Å; T831-E865 WeakPolarHBondContact CB-OE2 3.43Å
832	A	96.6	Very high	94.6	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-57.1	-41.8	175.8	0	0	0	0	0	111.6	V820 F835 L836 V848 V852 E865	V820-A832 HydrophobicContact CB-CB 4.45Å; V820-A832 HydrophobicContact CG1-CB 3.76Å; V820-A832 HydrophobicContact CG2-CB 4.06Å; A832-F835 PolarHBondContact O-N 2.95Å; A832-L836 WeakPolarHBondContact O-CB 3.38Å; A832-L836 WeakPolarHBondContact O-CG 3.46Å; A832-L836 PolarHBondContact O-N 3.41Å; A832-V848 HydrophobicContact CB-CG1 3.77Å; A832-V852 HydrophobicContact CB-CG2 3.57Å; A832-E865 PolarHBondContact N-OE2 2.85Å
833	V	96.9	Very high	94.6	Very high	38 Å²	38	39 Å²	39	23%	0.23	21%	0.211	C	C	.	.	H	α-helix	trans	-65.3	-47.1	177.6	176.9	0	0	0	0	111.2	T831 F835 S837 I845 V848	T831-V833 VanDerWaalsContact C-N 3.26Å; T831-V833 PolarHBondContact O-N 3.27Å; V833-F835 VanDerWaalsContact C-N 3.25Å; V833-F835 PolarHBondContact O-N 3.06Å; V833-S837 WeakPolarHBondContact O-CB 3.12Å; V833-S837 PolarHBondContact O-N 3.18Å; V833-S837 PolarHBondContact O-OG 3.12Å; V833-I845 HydrophobicContact CG1-CG2 4.32Å; V833-I845 HydrophobicContact CG2-CG2 4.27Å; V833-V848 HydrophobicContact CG2-CB 4.21Å; V833-V848 HydrophobicContact CG2-CG1 3.74Å
834	E	96.2	Very high	94.4	Very high	99 Å²	99	43.4 Å²	43.4	46%	0.463	23%	0.234	S	C	.	.	H	α-helix	trans	-62.9	-31.5	177.1	-75.2	168.7	161.5	0	0	113.3	K830 T831 S837 K838	K830-E834 HydrophobicContact CB-CB 4.46Å; T831-E834 PolarHBondContact N-OE2 2.66Å; T831-E834 PolarHBondContact O-N 3.41Å; T831-E834 VanDerWaalsContact OG1-CB 3.28Å; T831-E834 WeakPolarHBondContact OG1-CB 3.06Å; T831-E834 VanDerWaalsContact OG1-CD 3.22Å; T831-E834 WeakPolarHBondContact OG1-CG 3.2Å; T831-E834 PolarHBondContact OG1-N 3.02Å; T831-E834 VanDerWaalsContact OG1-N 3.16Å; T831-E834 PolarHBondContact OG1-OE2 2.94Å; E834-S837 PolarHBondContact O-OG 2.89Å; E834-K838 WeakPolarHBondContact O-CE 3.49Å
835	F	96.5	Very high	94.4	Very high	6 Å²	6	47.7 Å²	47.7	3%	0.026	26%	0.256	C	S	.	.	H	α-helix	trans	-76.8	-54.7	176.4	-176.5	-88.7	0	0	0	111.4	F570 I573 L574 A823 M827 T831 A832 V833 S837 K838	F570-F835 AromaticContact CD2-CE1 3.77Å; F570-F835 HydrophobicContact CD2-CE1 3.77Å; F570-F835 HydrophobicContact CD2-CZ 4.48Å; F570-F835 HydrophobicContact CE1-CE1 4.49Å; F570-F835 HydrophobicContact CE1-CZ 4.37Å; F570-F835 HydrophobicContact CE2-CD1 4.13Å; F570-F835 AromaticContact CE2-CE1 3.29Å; F570-F835 HydrophobicContact CE2-CE1 3.29Å; F570-F835 AromaticContact CE2-CZ 3.93Å; F570-F835 HydrophobicContact CE2-CZ 3.93Å; F570-F835 AromaticContact CZ-CE1 3.69Å; F570-F835 HydrophobicContact CZ-CE1 3.69Å; F570-F835 AromaticContact CZ-CZ 3.83Å; F570-F835 HydrophobicContact CZ-CZ 3.83Å; I573-F835 HydrophobicContact CB-CE1 4.23Å; I573-F835 HydrophobicContact CB-CZ 3.97Å; I573-F835 HydrophobicContact CD1-CD1 4.29Å; I573-F835 HydrophobicContact CD1-CE1 3.81Å; I573-F835 HydrophobicContact CD1-CZ 4.41Å; I573-F835 HydrophobicContact CG2-CD1 4.42Å; I573-F835 HydrophobicContact CG2-CD2 4.22Å; I573-F835 HydrophobicContact CG2-CE1 3.88Å; I573-F835 HydrophobicContact CG2-CE2 3.66Å; I573-F835 HydrophobicContact CG2-CZ 3.47Å; I573-F835 VanDerWaalsContact CG2-CZ 3.47Å; L574-F835 HydrophobicContact CD2-CE2 3.7Å; L574-F835 HydrophobicContact CD2-CZ 3.62Å; L574-F835 HydrophobicContact CG-CZ 4.17Å; A823-F835 HydrophobicContact CB-CB 4.23Å; A823-F835 HydrophobicContact CB-CD1 3.5Å; A823-F835 VanDerWaalsContact CB-CD1 3.5Å; A823-F835 HydrophobicContact CB-CE1 4Å; A823-F835 HydrophobicContact CB-CG 3.84Å; M827-F835 HydrophobicContact CB-CD2 3.98Å; M827-F835 HydrophobicContact CB-CE2 4.28Å; M827-F835 HydrophobicContact CG-CD2 3.77Å; M827-F835 HydrophobicContact CG-CE2 3.64Å; T831-F835 PolarHBondContact O-N 3.15Å; A832-F835 PolarHBondContact O-N 2.95Å; V833-F835 VanDerWaalsContact C-N 3.25Å; V833-F835 PolarHBondContact O-N 3.06Å; F835-S837 VanDerWaalsContact C-N 3.34Å; F835-S837 PolarHBondContact O-N 2.99Å; F835-K838 WeakPolarHBondContact O-CB 3.42Å; F835-K838 PolarHBondContact O-N 2.86Å; F835-K838 VanDerWaalsContact O-N 3.16Å
836	L	96.7	Very high	94.4	Very high	1 Å²	1	53.1 Å²	53.1	1%	0.005	28%	0.278	C	S	.	.	H	α-helix	trans	-72.9	-24	-173.8	-67.4	174.9	0	0	0	113.3	F570 L819 V820 A832 K838 A839 P843 V848	F570-L836 HydrophobicContact CD2-CD2 4.39Å; L819-L836 HydrophobicContact CB-CD2 4.49Å; L819-L836 HydrophobicContact CD2-CD2 4.28Å; V820-L836 HydrophobicContact CG2-CD1 4.11Å; A832-L836 WeakPolarHBondContact O-CB 3.38Å; A832-L836 WeakPolarHBondContact O-CG 3.46Å; A832-L836 PolarHBondContact O-N 3.41Å; L836-K838 PolarHBondContact O-N 3.4Å; L836-K838 VanDerWaalsContact O-N 3.11Å; L836-A839 VanDerWaalsContact O-CB 3.25Å; L836-A839 WeakPolarHBondContact O-CB 3.41Å; L836-A839 PolarHBondContact O-N 2.84Å; L836-P843 HydrophobicContact CB-CG 3.95Å; L836-P843 HydrophobicContact CD1-CG 4.5Å; L836-V848 HydrophobicContact CB-CG2 4.43Å; L836-V848 HydrophobicContact CD1-CG1 3.95Å; L836-V848 HydrophobicContact CD1-CG2 3.88Å
837	S	96.3	Very high	94.4	Very high	63 Å²	63	52.6 Å²	52.6	44%	0.441	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-16.3	170.7	57.5	0	0	0	0	113.7	V833 E834 F835 A839	V833-S837 WeakPolarHBondContact O-CB 3.12Å; V833-S837 PolarHBondContact O-N 3.18Å; V833-S837 PolarHBondContact O-OG 3.12Å; E834-S837 PolarHBondContact O-OG 2.89Å; F835-S837 VanDerWaalsContact C-N 3.34Å; F835-S837 PolarHBondContact O-N 2.99Å; S837-A839 VanDerWaalsContact C-N 3.33Å
838	K	95.9	Very high	94.6	Very high	95 Å²	95	50.9 Å²	50.9	41%	0.413	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.7	-1.3	174.5	-61.3	173.2	-177.2	164.1	0	113	I573 Y602 E834 F835 L836	I573-K838 HydrophobicContact CG2-CB 4.03Å; Y602-K838 WeakPolarHBondContact CE2-O 3.02Å; Y602-K838 PolarHBondContact OH-O 3.15Å; E834-K838 WeakPolarHBondContact O-CE 3.49Å; F835-K838 WeakPolarHBondContact O-CB 3.42Å; F835-K838 PolarHBondContact O-N 2.86Å; F835-K838 VanDerWaalsContact O-N 3.16Å; L836-K838 PolarHBondContact O-N 3.4Å; L836-K838 VanDerWaalsContact O-N 3.11Å
839	A	95.6	Very high	94.8	Very high	8 Å²	8	50.9 Å²	50.9	7%	0.066	27%	0.268	C	S	.	.	S	Bend	trans	-58.3	159.2	173.4	0	0	0	0	0	111.3	I573 I811 L836 S837 D841	I573-A839 HydrophobicContact CD1-CB 3.95Å; I573-A839 HydrophobicContact CG1-CB 4.4Å; I811-A839 HydrophobicContact CD1-CB 3.99Å; L836-A839 VanDerWaalsContact O-CB 3.25Å; L836-A839 WeakPolarHBondContact O-CB 3.41Å; L836-A839 PolarHBondContact O-N 2.84Å; S837-A839 VanDerWaalsContact C-N 3.33Å; A839-D841 WeakPolarHBondContact CB-O 3.41Å; A839-D841 PolarHBondContact O-N 3.22Å
840	V	93.9	Very high	94.8	Very high	20 Å²	20	48.8 Å²	48.8	12%	0.121	26%	0.258	C	S	.	.	S	Bend	trans	-57.3	-42.6	174.2	177.6	0	0	0	0	110.7	L572 R598 F599 Y602	L572-V840 HydrophobicContact CD1-CG2 4.03Å; R598-V840 HydrophobicContact CG-CG1 3.92Å; F599-V840 HydrophobicContact CD1-CG2 4.34Å; F599-V840 HydrophobicContact CE1-CG1 4.4Å; F599-V840 HydrophobicContact CE1-CG2 4.19Å; Y602-V840 HydrophobicContact CD1-CG2 3.85Å; Y602-V840 HydrophobicContact CD2-CB 4.48Å; Y602-V840 HydrophobicContact CD2-CG2 4.07Å; Y602-V840 HydrophobicContact CE1-CG2 3.96Å; Y602-V840 HydrophobicContact CE2-CG2 4.17Å; Y602-V840 HydrophobicContact CG-CG2 3.91Å
841	D	93.9	Very high	94.8	Very high	33 Å²	33	46.3 Å²	46.3	18%	0.176	25%	0.247	C	C	.	.	S	Bend	trans	-122	111.4	167	-67.8	-76.4	0	0	0	107.6	R564 R598 P809 L812 A839	R564-D841 IonicContact CZ-OD2 3.13Å; R564-D841 IonicContact NH1-OD2 3.26Å; R564-D841 PolarHBondContact NH1-OD2 3.26Å; R564-D841 IonicContact NH2-OD2 2.99Å; R564-D841 PolarHBondContact NH2-OD2 3.15Å; R598-D841 IonicContact CZ-OD1 3.3Å; R598-D841 IonicContact NH1-OD1 2.97Å; R598-D841 PolarHBondContact NH1-OD1 3.23Å; R598-D841 IonicContact NH1-OD2 3.33Å; R598-D841 PolarHBondContact NH1-OD2 3.43Å; P809-D841 HydrophobicContact CG-CB 4.33Å; L812-D841 HydrophobicContact CD1-CB 4.16Å; L812-D841 HydrophobicContact CD2-CB 4.42Å; A839-D841 WeakPolarHBondContact CB-O 3.41Å; A839-D841 PolarHBondContact O-N 3.22Å
842	S	93.6	Very high	94.8	Very high	62 Å²	62	44.4 Å²	44.4	43%	0.434	24%	0.235	S	C	.	.	P	Polyproline II helix	trans	-65.1	130.8	-179	178.2	0	0	0	0	110.4	L812	L812-S842 WeakPolarHBondContact CD2-O 3.39Å
843	P	93.9	Very high	94.7	Very high	5 Å²	5	48 Å²	48	3%	0.032	25%	0.254	C	S	.	.	P	Polyproline II helix	trans	-62.2	160.4	168.9	27	-32.5	0	0	0	111.2	L812 L816 L836 I845 V848	L812-P843 HydrophobicContact CD2-CB 4.39Å; L816-P843 HydrophobicContact CD1-CB 3.67Å; L816-P843 HydrophobicContact CD1-CG 4.08Å; L836-P843 HydrophobicContact CB-CG 3.95Å; L836-P843 HydrophobicContact CD1-CG 4.5Å; P843-I845 PolarHBondContact O-N 3.13Å; P843-V848 HydrophobicContact CB-CG2 4.17Å; P843-V848 HydrophobicContact CG-CG2 3.7Å
844	N	91.8	Very high	94.5	Very high	94 Å²	94	47.1 Å²	47.1	50%	0.503	25%	0.248	S	C	.	.	P	Polyproline II helix	trans	-60.8	127.9	172.4	-176.9	-22.4	0	0	0	109.2	K846 A847 V848	N844-K846 PolarHBondContact O-N 2.85Å; N844-K846 WeakPolarHBondContact OD1-CB 3.43Å; N844-K846 PolarHBondContact OD1-N 3.1Å; N844-A847 HydrophobicContact CB-CB 4.29Å; N844-A847 WeakPolarHBondContact O-CA 3.37Å; N844-A847 WeakPolarHBondContact O-CB 3.32Å; N844-A847 PolarHBondContact O-N 3.37Å; N844-V848 PolarHBondContact O-N 3.06Å
845	I	94.6	Very high	94.5	Very high	96 Å²	96	42.4 Å²	42.4	49%	0.492	23%	0.226	S	C	.	.	H	α-helix	trans	-52.2	-41.7	179.4	-60.7	171.8	0	0	0	110.8	V833 P843 A847 V848 D849	V833-I845 HydrophobicContact CG1-CG2 4.32Å; V833-I845 HydrophobicContact CG2-CG2 4.27Å; P843-I845 PolarHBondContact O-N 3.13Å; I845-A847 VanDerWaalsContact C-N 3.27Å; I845-A847 PolarHBondContact O-N 3.04Å; I845-V848 WeakPolarHBondContact O-CA 3.23Å; I845-V848 WeakPolarHBondContact O-CB 3.13Å; I845-V848 PolarHBondContact O-N 3.19Å; I845-D849 VanDerWaalsContact O-CG 3.29Å; I845-D849 PolarHBondContact O-N 2.83Å
846	K	92	Very high	94.5	Very high	150 Å²	150	45.1 Å²	45.1	65%	0.652	24%	0.238	S	C	*	.	H	α-helix	trans	-60.3	-35.4	177.2	-65.2	-174.7	177.5	-176.5	0	113.2	N844 E850	N844-K846 PolarHBondContact O-N 2.85Å; N844-K846 WeakPolarHBondContact OD1-CB 3.43Å; N844-K846 PolarHBondContact OD1-N 3.1Å; K846-E850 WeakPolarHBondContact O-CB 3.36Å; K846-E850 VanDerWaalsContact O-CG 3.3Å; K846-E850 WeakPolarHBondContact O-CG 3.15Å; K846-E850 PolarHBondContact O-N 3.11Å
847	A	92.4	Very high	94.2	Very high	19 Å²	19	48 Å²	48	16%	0.157	25%	0.252	C	S	.	.	H	α-helix	trans	-70.7	-35.4	177.3	0	0	0	0	0	111.4	L759 L816 N844 I845 A851	L759-A847 HydrophobicContact CD1-CB 4.27Å; L759-A847 HydrophobicContact CD2-CB 3.77Å; L816-A847 HydrophobicContact CD1-CB 4.03Å; N844-A847 HydrophobicContact CB-CB 4.29Å; N844-A847 WeakPolarHBondContact O-CA 3.37Å; N844-A847 WeakPolarHBondContact O-CB 3.32Å; N844-A847 PolarHBondContact O-N 3.37Å; I845-A847 VanDerWaalsContact C-N 3.27Å; I845-A847 PolarHBondContact O-N 3.04Å; A847-A851 WeakPolarHBondContact O-CB 3.46Å; A847-A851 PolarHBondContact O-N 3.11Å
848	V	96.1	Very high	94.1	Very high	3 Å²	3	45.2 Å²	45.2	2%	0.018	23%	0.232	C	C	.	.	H	α-helix	trans	-67.1	-46.9	173.5	-178.3	0	0	0	0	110.3	L816 V820 A832 V833 L836 P843 N844 I845 E850 A851 V852	L816-V848 HydrophobicContact CD1-CG2 3.83Å; V820-V848 HydrophobicContact CG2-CG1 4.36Å; A832-V848 HydrophobicContact CB-CG1 3.77Å; V833-V848 HydrophobicContact CG2-CB 4.21Å; V833-V848 HydrophobicContact CG2-CG1 3.74Å; L836-V848 HydrophobicContact CB-CG2 4.43Å; L836-V848 HydrophobicContact CD1-CG1 3.95Å; L836-V848 HydrophobicContact CD1-CG2 3.88Å; P843-V848 HydrophobicContact CB-CG2 4.17Å; P843-V848 HydrophobicContact CG-CG2 3.7Å; N844-V848 PolarHBondContact O-N 3.06Å; I845-V848 WeakPolarHBondContact O-CA 3.23Å; I845-V848 WeakPolarHBondContact O-CB 3.13Å; I845-V848 PolarHBondContact O-N 3.19Å; V848-E850 PolarHBondContact O-N 2.53Å; V848-A851 WeakPolarHBondContact O-CB 3.34Å; V848-A851 PolarHBondContact O-N 3.36Å; V848-A851 VanDerWaalsContact O-N 3.13Å; V848-V852 HydrophobicContact CG1-CG2 4.5Å; V848-V852 WeakPolarHBondContact O-CG2 3.33Å; V848-V852 PolarHBondContact O-N 2.98Å
849	D	95.4	Very high	94	Very high	65 Å²	65	41.9 Å²	41.9	35%	0.348	23%	0.225	S	C	.	.	H	α-helix	trans	-60.4	-44.4	179	-65.7	-20.9	0	0	0	111.5	I845 A851 V852 I853	I845-D849 VanDerWaalsContact O-CG 3.29Å; I845-D849 PolarHBondContact O-N 2.83Å; D849-A851 VanDerWaalsContact C-N 3.28Å; D849-A851 PolarHBondContact O-N 2.92Å; D849-V852 PolarHBondContact O-N 3.45Å; D849-I853 WeakPolarHBondContact O-CB 3.49Å; D849-I853 VanDerWaalsContact O-CG1 3.23Å; D849-I853 WeakPolarHBondContact O-CG1 3.47Å; D849-I853 PolarHBondContact O-N 3.46Å
850	E	92	Very high	94	Very high	67 Å²	67	41.5 Å²	41.5	31%	0.313	22%	0.221	S	C	.	.	H	α-helix	trans	-61.9	-36.5	175.7	-74.8	-65	149.7	0	0	112.5	K762 K846 V848 I853 L854	K762-E850 WeakPolarHBondContact CE-OE2 3.39Å; K762-E850 IonicContact NZ-OE2 3.49Å; K762-E850 PolarHBondContact NZ-OE2 3.26Å; K846-E850 WeakPolarHBondContact O-CB 3.36Å; K846-E850 VanDerWaalsContact O-CG 3.3Å; K846-E850 WeakPolarHBondContact O-CG 3.15Å; K846-E850 PolarHBondContact O-N 3.11Å; V848-E850 PolarHBondContact O-N 2.53Å; E850-I853 PolarHBondContact O-N 2.93Å; E850-L854 WeakPolarHBondContact O-CB 3.37Å; E850-L854 PolarHBondContact O-N 3.09Å
851	A	94.4	Very high	94.1	Very high	2 Å²	2	40.7 Å²	40.7	2%	0.017	22%	0.217	C	C	.	.	H	α-helix	trans	-68.6	-39.9	175.3	0	0	0	0	0	112.1	L816 E817 V820 A847 V848 D849 L854 L855	L816-A851 HydrophobicContact CB-CB 3.89Å; E817-A851 HydrophobicContact CB-CB 4.47Å; E817-A851 HydrophobicContact CG-CB 3.86Å; V820-A851 HydrophobicContact CG2-CB 3.88Å; A847-A851 WeakPolarHBondContact O-CB 3.46Å; A847-A851 PolarHBondContact O-N 3.11Å; V848-A851 WeakPolarHBondContact O-CB 3.34Å; V848-A851 PolarHBondContact O-N 3.36Å; V848-A851 VanDerWaalsContact O-N 3.13Å; D849-A851 VanDerWaalsContact C-N 3.28Å; D849-A851 PolarHBondContact O-N 2.92Å; A851-L854 PolarHBondContact O-N 3.42Å; A851-L855 WeakPolarHBondContact O-CG 3.31Å; A851-L855 PolarHBondContact O-N 3.39Å
852	V	97.3	Very high	94.2	Very high	6 Å²	6	41.5 Å²	41.5	4%	0.036	22%	0.221	C	C	.	.	H	α-helix	trans	-62	-48.5	172.4	171.4	0	0	0	0	110.4	V820 A832 V848 D849 L854 L855 Q856 E865	V820-V852 HydrophobicContact CG1-CG2 3.86Å; V820-V852 HydrophobicContact CG2-CG2 4.41Å; A832-V852 HydrophobicContact CB-CG2 3.57Å; V848-V852 HydrophobicContact CG1-CG2 4.5Å; V848-V852 WeakPolarHBondContact O-CG2 3.33Å; V848-V852 PolarHBondContact O-N 2.98Å; D849-V852 PolarHBondContact O-N 3.45Å; V852-L854 VanDerWaalsContact C-N 3.3Å; V852-L854 PolarHBondContact O-N 3.41Å; V852-L855 PolarHBondContact O-N 3.18Å; V852-L855 VanDerWaalsContact O-N 3.16Å; V852-Q856 HydrophobicContact CG1-CG 4.34Å; V852-Q856 WeakPolarHBondContact O-CG 3.08Å; V852-Q856 PolarHBondContact O-N 3.41Å; V852-E865 HydrophobicContact CG1-CG 3.89Å
853	I	94.3	Very high	94.3	Very high	75 Å²	75	46 Å²	46	39%	0.385	24%	0.235	S	C	.	.	H	α-helix	trans	-57.6	-44.2	178	-70.6	164.4	0	0	0	110.4	D849 E850 Q856 E857	D849-I853 WeakPolarHBondContact O-CB 3.49Å; D849-I853 VanDerWaalsContact O-CG1 3.23Å; D849-I853 WeakPolarHBondContact O-CG1 3.47Å; D849-I853 PolarHBondContact O-N 3.46Å; E850-I853 PolarHBondContact O-N 2.93Å; I853-Q856 PolarHBondContact O-N 3.49Å; I853-E857 WeakPolarHBondContact O-CB 3.37Å; I853-E857 PolarHBondContact O-N 3.17Å
854	L	92.5	Very high	94.3	Very high	20 Å²	20	53.5 Å²	53.5	11%	0.105	26%	0.263	C	S	.	.	H	α-helix	trans	-62.6	-46	177.2	-179.4	60.6	0	0	0	111.6	E817 E850 A851 V852 Q856 E857 I858	E817-L854 HydrophobicContact CG-CB 4.3Å; E817-L854 HydrophobicContact CG-CD2 3.6Å; E817-L854 HydrophobicContact CG-CG 4.34Å; E817-L854 WeakPolarHBondContact OE1-CD2 3.35Å; E850-L854 WeakPolarHBondContact O-CB 3.37Å; E850-L854 PolarHBondContact O-N 3.09Å; A851-L854 PolarHBondContact O-N 3.42Å; V852-L854 VanDerWaalsContact C-N 3.3Å; V852-L854 PolarHBondContact O-N 3.41Å; L854-Q856 VanDerWaalsContact C-N 3.26Å; L854-Q856 PolarHBondContact O-N 3.05Å; L854-E857 PolarHBondContact O-N 2.82Å; L854-I858 HydrophobicContact CD1-CG2 4.13Å; L854-I858 WeakPolarHBondContact O-CG1 3.1Å; L854-I858 PolarHBondContact O-N 3.26Å
855	L	96.2	Very high	94.5	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-63.7	-32	177.8	-71.9	177.5	0	0	0	112.7	E817 V820 L821 A851 V852 I858 G859 V860 L861 P881	E817-L855 HydrophobicContact CB-CD2 4.21Å; E817-L855 HydrophobicContact CB-CG 4.23Å; V820-L855 HydrophobicContact CB-CD1 3.76Å; V820-L855 HydrophobicContact CG1-CD1 3.5Å; L821-L855 HydrophobicContact CB-CD1 4.31Å; A851-L855 WeakPolarHBondContact O-CG 3.31Å; A851-L855 PolarHBondContact O-N 3.39Å; V852-L855 PolarHBondContact O-N 3.18Å; V852-L855 VanDerWaalsContact O-N 3.16Å; L855-I858 HydrophobicContact CD2-CD1 4.16Å; L855-G859 PolarHBondContact O-N 3.02Å; L855-V860 HydrophobicContact CB-CB 4.31Å; L855-V860 HydrophobicContact CD2-CB 4.12Å; L855-V860 HydrophobicContact CD2-CG1 4.17Å; L855-V860 HydrophobicContact CD2-CG2 4.16Å; L855-V860 WeakPolarHBondContact O-CB 3.42Å; L855-V860 PolarHBondContact O-N 2.95Å; L855-L861 HydrophobicContact CB-CB 4.38Å; L855-L861 HydrophobicContact CB-CD1 3.83Å; L855-L861 HydrophobicContact CB-CG 3.91Å; L855-L861 HydrophobicContact CD1-CD1 3.77Å; L855-L861 HydrophobicContact CD1-CG 4.29Å; L855-L861 PolarHBondContact O-N 2.84Å; L855-L861 VanDerWaalsContact O-N 3.16Å; L855-P881 HydrophobicContact CD2-CB 3.92Å; L855-P881 HydrophobicContact CD2-CG 3.88Å
856	Q	95.7	Very high	94.6	Very high	63 Å²	63	51 Å²	51	29%	0.294	24%	0.242	S	C	.	.	H	α-helix	trans	-70.7	-44.7	171.5	-71.4	172.1	-19.9	0	0	111.7	V852 I853 L854 I858 G859 L861 D862	V852-Q856 HydrophobicContact CG1-CG 4.34Å; V852-Q856 WeakPolarHBondContact O-CG 3.08Å; V852-Q856 PolarHBondContact O-N 3.41Å; I853-Q856 PolarHBondContact O-N 3.49Å; L854-Q856 VanDerWaalsContact C-N 3.26Å; L854-Q856 PolarHBondContact O-N 3.05Å; Q856-I858 VanDerWaalsContact C-N 3.29Å; Q856-I858 PolarHBondContact O-N 2.96Å; Q856-G859 PolarHBondContact O-N 2.82Å; Q856-L861 WeakPolarHBondContact CA-O 3.43Å; Q856-L861 HydrophobicContact CG-CB 3.95Å; Q856-D862 WeakPolarHBondContact CG-O 3.47Å; Q856-D862 PolarHBondContact NE2-O 2.88Å
857	E	91.3	Very high	94.7	Very high	63 Å²	63	45.5 Å²	45.5	29%	0.294	22%	0.22	S	C	.	.	H	α-helix	trans	-60.5	-37.5	178.7	-174.6	174.8	-157.3	0	0	111.8	I853 L854 G859 K1051	I853-E857 WeakPolarHBondContact O-CB 3.37Å; I853-E857 PolarHBondContact O-N 3.17Å; L854-E857 PolarHBondContact O-N 2.82Å; E857-G859 VanDerWaalsContact C-N 3.32Å; E857-K1051 IonicContact OE1-NZ 3.52Å; E857-K1051 PolarHBondContact OE1-NZ 2.87Å
858	I	93.3	Very high	94.9	Very high	3 Å²	3	46.4 Å²	46.4	2%	0.015	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87	0.6	176.2	72.3	179.8	0	0	0	113.7	L854 L855 Q856 V860 P881 R882 K885 Y1024	L854-I858 HydrophobicContact CD1-CG2 4.13Å; L854-I858 WeakPolarHBondContact O-CG1 3.1Å; L854-I858 PolarHBondContact O-N 3.26Å; L855-I858 HydrophobicContact CD2-CD1 4.16Å; Q856-I858 VanDerWaalsContact C-N 3.29Å; Q856-I858 PolarHBondContact O-N 2.96Å; I858-V860 HydrophobicContact CD1-CG2 3.79Å; I858-V860 HydrophobicContact CG1-CB 4.43Å; I858-V860 HydrophobicContact CG1-CG2 3.69Å; I858-P881 HydrophobicContact CD1-CB 3.87Å; I858-R882 HydrophobicContact CD1-CG 4.1Å; I858-R882 HydrophobicContact CG2-CG 4.5Å; I858-K885 PolarHBondContact O-NZ 3.39Å; I858-Y1024 WeakPolarHBondContact CG2-O 3.44Å
859	G	93.9	Very high	94.8	Very high	25 Å²	25	48 Å²	48	26%	0.258	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	81	14.4	173.4	0	0	0	0	0	115.9	L855 Q856 E857 T868	L855-G859 PolarHBondContact O-N 3.02Å; Q856-G859 PolarHBondContact O-N 2.82Å; E857-G859 VanDerWaalsContact C-N 3.32Å; G859-T868 WeakPolarHBondContact O-CG2 3.29Å; G859-T868 PolarHBondContact O-OG1 2.77Å
860	V	95.8	Very high	94.8	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	22%	0.221	C	C	.	.	S	Bend	trans	-74.7	-40.9	175.4	174.1	0	0	0	0	111.1	L821 L855 I858 L867 T868 G871 L874 P881	L821-V860 HydrophobicContact CD1-CG1 3.82Å; L855-V860 HydrophobicContact CB-CB 4.31Å; L855-V860 HydrophobicContact CD2-CB 4.12Å; L855-V860 HydrophobicContact CD2-CG1 4.17Å; L855-V860 HydrophobicContact CD2-CG2 4.16Å; L855-V860 WeakPolarHBondContact O-CB 3.42Å; L855-V860 PolarHBondContact O-N 2.95Å; I858-V860 HydrophobicContact CD1-CG2 3.79Å; I858-V860 HydrophobicContact CG1-CB 4.43Å; I858-V860 HydrophobicContact CG1-CG2 3.69Å; V860-L867 HydrophobicContact CG1-CD2 4.2Å; V860-T868 PolarHBondContact O-N 3.31Å; V860-T868 PolarHBondContact O-OG1 3.16Å; V860-G871 WeakPolarHBondContact O-CA 3.4Å; V860-L874 HydrophobicContact CB-CD1 4.42Å; V860-L874 HydrophobicContact CG2-CD1 3.4Å; V860-P881 HydrophobicContact CG2-CB 4.36Å
861	L	96.9	Very high	94.9	Very high	4 Å²	4	42.6 Å²	42.6	2%	0.021	21%	0.206	C	C	.	.	B	Isolated β-bridge	trans	-113.6	148.8	178.8	-62.3	-178.6	0	0	0	111.1	V820 K824 L855 Q856 Y866 L867	V820-L861 HydrophobicContact CG1-CD1 4.01Å; K824-L861 HydrophobicContact CB-CD2 4.32Å; K824-L861 HydrophobicContact CG-CD1 4.3Å; K824-L861 HydrophobicContact CG-CD2 3.92Å; L855-L861 HydrophobicContact CB-CB 4.38Å; L855-L861 HydrophobicContact CB-CD1 3.83Å; L855-L861 HydrophobicContact CB-CG 3.91Å; L855-L861 HydrophobicContact CD1-CD1 3.77Å; L855-L861 HydrophobicContact CD1-CG 4.29Å; L855-L861 PolarHBondContact O-N 2.84Å; L855-L861 VanDerWaalsContact O-N 3.16Å; Q856-L861 WeakPolarHBondContact CA-O 3.43Å; Q856-L861 HydrophobicContact CG-CB 3.95Å; L861-Y866 WeakPolarHBondContact CA-O 3.39Å; L861-L867 HydrophobicContact CD2-CD2 3.8Å; L861-L867 HydrophobicContact CD2-CG 4.32Å
862	D	95.5	Very high	94.9	Very high	50 Å²	50	45.9 Å²	45.9	27%	0.267	22%	0.221	S	C	.	.			trans	-84.5	179.2	167.1	72.3	12.5	0	0	0	111.6	Q856 R864 E865 Y866 T868	Q856-D862 WeakPolarHBondContact CG-O 3.47Å; Q856-D862 PolarHBondContact NE2-O 2.88Å; D862-R864 PolarHBondContact O-N 3.26Å; D862-R864 VanDerWaalsContact O-N 3.13Å; D862-R864 VanDerWaalsContact OD1-C 3.23Å; D862-R864 VanDerWaalsContact OD1-CA 3.29Å; D862-R864 WeakPolarHBondContact OD1-CA 3.42Å; D862-R864 WeakPolarHBondContact OD1-CB 3.25Å; D862-R864 PolarHBondContact OD1-N 3.2Å; D862-E865 PolarHBondContact O-N 3.43Å; D862-E865 PolarHBondContact OD1-N 3.49Å; D862-Y866 PolarHBondContact N-O 2.87Å; D862-Y866 PolarHBondContact OD1-N 3.36Å; D862-T868 HydrophobicContact CB-CG2 4.23Å
863	Q	94.5	Very high	94.7	Very high	155 Å²	155	45.9 Å²	45.9	72%	0.724	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-14.9	179.4	-63.5	84.5	-0.7	0	0	113.7
864	R	94.9	Very high	94.6	Very high	164 Å²	164	42.4 Å²	42.4	62%	0.619	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100.8	9.8	176.8	-62.3	179.1	-178.3	178.9	1.4	112.1	D862 Y866	D862-R864 PolarHBondContact O-N 3.26Å; D862-R864 VanDerWaalsContact O-N 3.13Å; D862-R864 VanDerWaalsContact OD1-C 3.23Å; D862-R864 VanDerWaalsContact OD1-CA 3.29Å; D862-R864 WeakPolarHBondContact OD1-CA 3.42Å; D862-R864 WeakPolarHBondContact OD1-CB 3.25Å; D862-R864 PolarHBondContact OD1-N 3.2Å; R864-Y866 HydrophobicContact CB-CD2 3.69Å; R864-Y866 HydrophobicContact CB-CE2 3.9Å; R864-Y866 PolarHBondContact O-N 3.01Å
865	E	96	Very high	94.5	Very high	26 Å²	26	42.4 Å²	42.4	12%	0.121	21%	0.206	C	C	.	.	S	Bend	trans	62.9	19.7	-176.4	-50.6	-176.5	-171.7	0	0	114.9	K824 T831 A832 V852 D862	K824-E865 HydrophobicContact CD-CB 4.38Å; K824-E865 WeakPolarHBondContact CD-O 3.24Å; K824-E865 WeakPolarHBondContact CE-O 3.28Å; K824-E865 PolarHBondContact NZ-O 2.94Å; T831-E865 WeakPolarHBondContact CA-OE2 3.2Å; T831-E865 WeakPolarHBondContact CB-OE2 3.43Å; A832-E865 PolarHBondContact N-OE2 2.85Å; V852-E865 HydrophobicContact CG1-CG 3.89Å; D862-E865 PolarHBondContact O-N 3.43Å; D862-E865 PolarHBondContact OD1-N 3.49Å
866	Y	96.4	Very high	94.2	Very high	112 Å²	112	46 Å²	46	44%	0.439	22%	0.222	S	C	.	.	P	Polyproline II helix	trans	-80.8	148.9	169.2	-66.7	-72.2	0	0	0	110.5	P828 L861 D862 R864 T868	P828-Y866 WeakPolarHBondContact O-CE1 3.36Å; L861-Y866 WeakPolarHBondContact CA-O 3.39Å; D862-Y866 PolarHBondContact N-O 2.87Å; D862-Y866 PolarHBondContact OD1-N 3.36Å; R864-Y866 HydrophobicContact CB-CD2 3.69Å; R864-Y866 HydrophobicContact CB-CE2 3.9Å; R864-Y866 PolarHBondContact O-N 3.01Å; Y866-T868 PolarHBondContact O-N 3.22Å
867	L	95.2	Very high	94	Very high	34 Å²	34	43.3 Å²	43.3	18%	0.178	21%	0.21	C	C	.	.	B	Isolated β-bridge	trans	-63.6	121.2	172.3	-70.2	168.5	0	0	0	109.1	L821 K824 I825 V860 L861 Q872	L821-L867 HydrophobicContact CD1-CD2 3.56Å; K824-L867 HydrophobicContact CB-CD2 4.37Å; K824-L867 HydrophobicContact CB-CG 4.24Å; I825-L867 HydrophobicContact CG1-CD1 4.19Å; V860-L867 HydrophobicContact CG1-CD2 4.2Å; L861-L867 HydrophobicContact CD2-CD2 3.8Å; L861-L867 HydrophobicContact CD2-CG 4.32Å; L867-Q872 HydrophobicContact CB-CG 4.01Å; L867-Q872 PolarHBondContact O-NE2 3.03Å
868	T	95.7	Very high	93.7	Very high	37 Å²	37	41.8 Å²	41.8	23%	0.227	21%	0.206	C	C	.	.	P	Polyproline II helix	trans	-66.8	172.1	169.4	69.7	0	0	0	0	109.8	G859 V860 D862 Y866 L870 G871 Q872	G859-T868 WeakPolarHBondContact O-CG2 3.29Å; G859-T868 PolarHBondContact O-OG1 2.77Å; V860-T868 PolarHBondContact O-N 3.31Å; V860-T868 PolarHBondContact O-OG1 3.16Å; D862-T868 HydrophobicContact CB-CG2 4.23Å; Y866-T868 PolarHBondContact O-N 3.22Å; T868-L870 PolarHBondContact O-N 3.27Å; T868-L870 PolarHBondContact OG1-N 2.84Å; T868-G871 CarbonylContact O-C 3.55Å; T868-G871 WeakPolarHBondContact O-CA 3.23Å; T868-G871 PolarHBondContact O-N 3.14Å; T868-G871 PolarHBondContact OG1-N 2.98Å; T868-Q872 VanDerWaalsContact O-CG 3.32Å; T868-Q872 WeakPolarHBondContact O-CG 3.36Å; T868-Q872 PolarHBondContact O-N 2.83Å
869	T	93.9	Very high	93.5	Very high	38 Å²	38	43 Å²	43	23%	0.233	21%	0.213	C	C	.	.	H	α-helix	trans	-57.5	-37	172.3	-39.9	0	0	0	0	111.8	Q872 R873 L1153	T869-Q872 PolarHBondContact O-N 3.36Å; T869-R873 WeakPolarHBondContact O-CG 3.44Å; T869-R873 PolarHBondContact O-N 2.8Å; T869-L1153 VanDerWaalsContact CG2-C 3.46Å; T869-L1153 HydrophobicContact CG2-CB 3.76Å; T869-L1153 WeakPolarHBondContact CG2-O 3.45Å
870	L	95.3	Very high	93.4	Very high	17 Å²	17	43 Å²	43	9%	0.089	21%	0.207	C	C	.	.	H	α-helix	trans	-62.8	-48.8	171.4	175.5	61.3	0	0	0	110.7	T868 Q872 R873 L874 K885 V888 L1153	T868-L870 PolarHBondContact O-N 3.27Å; T868-L870 PolarHBondContact OG1-N 2.84Å; L870-Q872 VanDerWaalsContact C-N 3.29Å; L870-Q872 PolarHBondContact O-N 2.77Å; L870-R873 PolarHBondContact O-N 2.88Å; L870-R873 VanDerWaalsContact O-N 3.14Å; L870-L874 HydrophobicContact CD1-CD1 3.95Å; L870-L874 HydrophobicContact CD1-CG 4.12Å; L870-L874 HydrophobicContact CD2-CD1 4.35Å; L870-L874 HydrophobicContact CG-CD1 3.69Å; L870-L874 HydrophobicContact CG-CG 4.3Å; L870-L874 VanDerWaalsContact O-CG 3.22Å; L870-L874 WeakPolarHBondContact O-CG 3.5Å; L870-L874 PolarHBondContact O-N 3.45Å; L870-K885 HydrophobicContact CD2-CD 4.24Å; L870-K885 HydrophobicContact CD2-CG 4.24Å; L870-V888 HydrophobicContact CD1-CB 4.31Å; L870-V888 HydrophobicContact CD1-CG1 3.91Å; L870-L1153 HydrophobicContact CB-CD1 4Å; L870-L1153 HydrophobicContact CD1-CD1 4.44Å; L870-L1153 HydrophobicContact CD1-CD2 4.24Å
871	G	95	Very high	93.4	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-57.8	-38	177.8	0	0	0	0	0	113.8	V860 T868 L874 A875	V860-G871 WeakPolarHBondContact O-CA 3.4Å; T868-G871 CarbonylContact O-C 3.55Å; T868-G871 WeakPolarHBondContact O-CA 3.23Å; T868-G871 PolarHBondContact O-N 3.14Å; T868-G871 PolarHBondContact OG1-N 2.98Å; G871-L874 PolarHBondContact O-N 2.94Å; G871-A875 PolarHBondContact O-N 3.17Å
872	Q	93	Very high	93.3	Very high	72 Å²	72	45.1 Å²	45.1	34%	0.336	22%	0.216	S	C	.	.	H	α-helix	trans	-62.9	-43.3	175.4	-69.7	169	7.8	0	0	111.7	L867 T868 T869 L870 A875 H876	L867-Q872 HydrophobicContact CB-CG 4.01Å; L867-Q872 PolarHBondContact O-NE2 3.03Å; T868-Q872 VanDerWaalsContact O-CG 3.32Å; T868-Q872 WeakPolarHBondContact O-CG 3.36Å; T868-Q872 PolarHBondContact O-N 2.83Å; T869-Q872 PolarHBondContact O-N 3.36Å; L870-Q872 VanDerWaalsContact C-N 3.29Å; L870-Q872 PolarHBondContact O-N 2.77Å; Q872-A875 PolarHBondContact O-N 3.41Å; Q872-H876 PolarHBondContact O-CD2 3.16Å; Q872-H876 VanDerWaalsContact O-CD2 3.26Å
873	R	93	Very high	93.3	Very high	6 Å²	6	42.9 Å²	42.9	2%	0.023	20%	0.204	C	C	.	.	H	α-helix	trans	-64.5	-42.2	174.4	-58.5	-67.3	173.3	-151.9	-2	111.4	L386 T869 L870 A875 H876 V888 A989 L1153 S1155	L386-R873 VanDerWaalsContact CD1-NH2 3.34Å; T869-R873 WeakPolarHBondContact O-CG 3.44Å; T869-R873 PolarHBondContact O-N 2.8Å; L870-R873 PolarHBondContact O-N 2.88Å; L870-R873 VanDerWaalsContact O-N 3.14Å; R873-A875 VanDerWaalsContact C-N 3.32Å; R873-A875 PolarHBondContact O-N 2.81Å; R873-H876 PolarHBondContact O-N 3.09Å; R873-V888 HydrophobicContact CB-CG1 4.41Å; R873-V888 HydrophobicContact CB-CG2 4.24Å; R873-A989 WeakPolarHBondContact CD-O 3.39Å; R873-A989 PolarHBondContact NH1-O 3.26Å; R873-L1153 HydrophobicContact CB-CD2 4.5Å; R873-L1153 HydrophobicContact CG-CD2 3.81Å; R873-L1153 PolarHBondContact NE-O 2.89Å; R873-L1153 VanDerWaalsContact NE-O 3.11Å; R873-L1153 PolarHBondContact NH2-O 2.98Å; R873-S1155 PolarHBondContact NH2-O 3.5Å
874	L	93	Very high	93.4	Very high	2 Å²	2	35.5 Å²	35.5	1%	0.01	17%	0.169	C	C	.	.	H	α-helix	trans	-65.1	-33.3	-179.4	-68.4	170.6	0	0	0	113.3	V860 L870 G871 H876 I877 A884 K885 V888	V860-L874 HydrophobicContact CB-CD1 4.42Å; V860-L874 HydrophobicContact CG2-CD1 3.4Å; L870-L874 HydrophobicContact CD1-CD1 3.95Å; L870-L874 HydrophobicContact CD1-CG 4.12Å; L870-L874 HydrophobicContact CD2-CD1 4.35Å; L870-L874 HydrophobicContact CG-CD1 3.69Å; L870-L874 HydrophobicContact CG-CG 4.3Å; L870-L874 VanDerWaalsContact O-CG 3.22Å; L870-L874 WeakPolarHBondContact O-CG 3.5Å; L870-L874 PolarHBondContact O-N 3.45Å; G871-L874 PolarHBondContact O-N 2.94Å; L874-H876 PolarHBondContact O-N 2.71Å; L874-H876 VanDerWaalsContact O-N 3.11Å; L874-I877 PolarHBondContact O-N 3.29Å; L874-A884 HydrophobicContact CD2-CB 3.33Å; L874-A884 WeakPolarHBondContact CD2-O 3.37Å; L874-K885 HydrophobicContact CD1-CB 4.39Å; L874-K885 VanDerWaalsContact CD2-CA 3.48Å; L874-K885 HydrophobicContact CD2-CB 4.15Å; L874-V888 HydrophobicContact CD2-CG2 3.65Å; L874-V888 HydrophobicContact CG-CG2 4.26Å
875	A	90.3	Very high	93.5	Very high	20 Å²	20	27.8 Å²	27.8	17%	0.165	14%	0.14	C	C	.	.	H	α-helix	trans	-55.8	-29.2	-178.9	0	0	0	0	0	113.5	I825 G871 Q872 R873	I825-A875 HydrophobicContact CD1-CB 3.57Å; I825-A875 HydrophobicContact CG1-CB 3.7Å; G871-A875 PolarHBondContact O-N 3.17Å; Q872-A875 PolarHBondContact O-N 3.41Å; R873-A875 VanDerWaalsContact C-N 3.32Å; R873-A875 PolarHBondContact O-N 2.81Å
876	H	88.9	Confident	93.6	Very high	75 Å²	75	26.5 Å²	26.5	35%	0.347	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76	-21.5	176.5	-64.7	-81.2	0	0	0	113.1	Q872 R873 L874 N985 E988 A989	Q872-H876 PolarHBondContact O-CD2 3.16Å; Q872-H876 VanDerWaalsContact O-CD2 3.26Å; R873-H876 PolarHBondContact O-N 3.09Å; L874-H876 PolarHBondContact O-N 2.71Å; L874-H876 VanDerWaalsContact O-N 3.11Å; H876-N985 VanDerWaalsContact O-CB 3.3Å; H876-N985 WeakPolarHBondContact O-CB 3.32Å; H876-N985 VanDerWaalsContact O-CG 3.29Å; H876-E988 HydrophobicContact CB-CB 4.47Å; H876-A989 HydrophobicContact CB-CB 4.07Å
877	I	91.6	Very high	93.7	Very high	7 Å²	7	21.2 Å²	21.2	4%	0.036	11%	0.113	C	C	.	.	S	Bend	trans	-96	108.7	-172	-49.2	178	0	0	0	110.6	L874 T879 A884 I887 V888 F982 N985	L874-I877 PolarHBondContact O-N 3.29Å; I877-T879 VanDerWaalsContact C-N 3.33Å; I877-T879 HydrophobicContact CG2-CG2 3.93Å; I877-T879 PolarHBondContact O-N 3.16Å; I877-A884 HydrophobicContact CB-CB 3.98Å; I877-A884 HydrophobicContact CD1-CB 4.47Å; I877-A884 HydrophobicContact CG2-CB 4.03Å; I877-I887 HydrophobicContact CD1-CB 4.34Å; I877-I887 HydrophobicContact CD1-CG2 3.95Å; I877-I887 HydrophobicContact CG2-CD1 4.17Å; I877-V888 HydrophobicContact CD1-CG2 3.63Å; I877-F982 HydrophobicContact CG2-CD1 4.28Å; I877-N985 HydrophobicContact CG1-CB 4.41Å
878	S	84.9	Confident	93.8	Very high	31 Å²	31	19.6 Å²	19.6	22%	0.217	11%	0.105	C	C	.	.			trans	-77.3	67.4	-177.1	47.4	0	0	0	0	115.8	R520 R542 Q981 N985	R520-S878 PolarHBondContact NH2-O 3.3Å; R542-S878 PolarHBondContact NH2-OG 3.49Å; S878-Q981 PolarHBondContact OG-NE2 3.43Å; S878-N985 PolarHBondContact N-ND2 3.12Å; S878-N985 PolarHBondContact OG-ND2 3.37Å; S878-N985 VanDerWaalsContact OG-ND2 3.09Å
879	T	90.1	Very high	93.9	Very high	27 Å²	27	18.1 Å²	18.1	17%	0.166	10%	0.096	C	C	.	.	S	Bend	trans	-152.2	-178.1	174.8	-165.8	0	0	0	0	111.4	I877 L883 A884 V903	I877-T879 VanDerWaalsContact C-N 3.33Å; I877-T879 HydrophobicContact CG2-CG2 3.93Å; I877-T879 PolarHBondContact O-N 3.16Å; T879-L883 HydrophobicContact CG2-CB 3.93Å; T879-A884 HydrophobicContact CG2-CB 3.77Å; T879-V903 HydrophobicContact CG2-CG1 4.25Å
880	D	91.8	Very high	94.1	Very high	25 Å²	25	16.3 Å²	16.3	13%	0.134	9%	0.085	C	C	.	.			trans	-54.5	140.2	174.1	178.4	-75.2	0	0	0	111	R882 L883 A884 F1077	D880-R882 PolarHBondContact O-N 3.25Å; D880-R882 VanDerWaalsContact O-N 3.13Å; D880-R882 VanDerWaalsContact OD1-CB 3.28Å; D880-R882 WeakPolarHBondContact OD1-CB 3.43Å; D880-R882 IonicContact OD1-CZ 2.73Å; D880-R882 PolarHBondContact OD1-N 3.38Å; D880-R882 IonicContact OD1-NE 3.19Å; D880-R882 PolarHBondContact OD1-NE 2.96Å; D880-R882 VanDerWaalsContact OD1-NE 3.08Å; D880-R882 IonicContact OD1-NH2 3.96Å; D880-R882 IonicContact OD2-CZ 3.1Å; D880-R882 IonicContact OD2-NE 3.63Å; D880-R882 IonicContact OD2-NH2 2.79Å; D880-R882 PolarHBondContact OD2-NH2 3.2Å; D880-L883 HydrophobicContact CB-CB 4.41Å; D880-L883 HydrophobicContact CB-CD1 4.3Å; D880-L883 HydrophobicContact CB-CG 4.23Å; D880-L883 PolarHBondContact O-N 2.88Å; D880-A884 WeakPolarHBondContact O-CB 3.43Å; D880-A884 PolarHBondContact O-N 3.11Å; D880-F1077 HydrophobicContact CB-CE2 4.06Å; D880-F1077 HydrophobicContact CB-CZ 3.93Å
881	P	94.7	Very high	94.2	Very high	3 Å²	3	15.5 Å²	15.5	2%	0.019	8%	0.081	C	C	.	.	H	α-helix	trans	-59.4	-31.5	-173	-24.8	37.2	0	0	0	113.4	N818 L821 L855 I858 V860 K885	N818-P881 VanDerWaalsContact OD1-CD 3.31Å; N818-P881 WeakPolarHBondContact OD1-CD 3.35Å; L821-P881 HydrophobicContact CD2-CB 4.43Å; L821-P881 HydrophobicContact CD2-CG 4.06Å; L855-P881 HydrophobicContact CD2-CB 3.92Å; L855-P881 HydrophobicContact CD2-CG 3.88Å; I858-P881 HydrophobicContact CD1-CB 3.87Å; V860-P881 HydrophobicContact CG2-CB 4.36Å; P881-K885 VanDerWaalsContact O-CB 3.31Å; P881-K885 WeakPolarHBondContact O-CB 3.42Å; P881-K885 PolarHBondContact O-N 2.99Å
882	R	95	Very high	94.3	Very high	46 Å²	46	15.8 Å²	15.8	17%	0.174	8%	0.082	C	C	.	.	H	α-helix	trans	-72	-40.6	176.9	-64.2	165.8	-70.4	-166.1	-5.6	111.8	I858 D880 K885 A886 G1022 L1023	I858-R882 HydrophobicContact CD1-CG 4.1Å; I858-R882 HydrophobicContact CG2-CG 4.5Å; D880-R882 PolarHBondContact O-N 3.25Å; D880-R882 VanDerWaalsContact O-N 3.13Å; D880-R882 VanDerWaalsContact OD1-CB 3.28Å; D880-R882 WeakPolarHBondContact OD1-CB 3.43Å; D880-R882 IonicContact OD1-CZ 2.73Å; D880-R882 PolarHBondContact OD1-N 3.38Å; D880-R882 IonicContact OD1-NE 3.19Å; D880-R882 PolarHBondContact OD1-NE 2.96Å; D880-R882 VanDerWaalsContact OD1-NE 3.08Å; D880-R882 IonicContact OD1-NH2 3.96Å; D880-R882 IonicContact OD2-CZ 3.1Å; D880-R882 IonicContact OD2-NE 3.63Å; D880-R882 IonicContact OD2-NH2 2.79Å; D880-R882 PolarHBondContact OD2-NH2 3.2Å; R882-K885 WeakPolarHBondContact O-CB 3.44Å; R882-K885 PolarHBondContact O-N 2.84Å; R882-A886 PolarHBondContact O-N 3.35Å; R882-G1022 CarbonylContact C-O 3.5Å; R882-G1022 WeakPolarHBondContact CA-O 3.45Å; R882-G1022 WeakPolarHBondContact CB-O 3.3Å; R882-G1022 CarbonylContact O-C 3.54Å; R882-G1022 VanDerWaalsContact O-O 3.06Å; R882-L1023 HydrophobicContact CB-CD2 4.1Å
883	L	96.1	Very high	94.6	Very high	3 Å²	3	12.6 Å²	12.6	2%	0.016	7%	0.067	C	C	.	.	H	α-helix	trans	-68.7	-39.5	174.5	-64.5	-176.6	0	0	0	111.5	T879 D880 K885 A886 I887 V903 L906 L1023 F1077	T879-L883 HydrophobicContact CG2-CB 3.93Å; D880-L883 HydrophobicContact CB-CB 4.41Å; D880-L883 HydrophobicContact CB-CD1 4.3Å; D880-L883 HydrophobicContact CB-CG 4.23Å; D880-L883 PolarHBondContact O-N 2.88Å; L883-K885 VanDerWaalsContact C-N 3.29Å; L883-K885 PolarHBondContact O-N 3.13Å; L883-A886 WeakPolarHBondContact O-CB 3.46Å; L883-A886 PolarHBondContact O-N 3.1Å; L883-I887 WeakPolarHBondContact O-CG1 3.43Å; L883-I887 PolarHBondContact O-N 3.33Å; L883-V903 HydrophobicContact CB-CG1 4.05Å; L883-V903 HydrophobicContact CB-CG2 3.92Å; L883-V903 HydrophobicContact CD1-CG1 4.15Å; L883-V903 HydrophobicContact CD2-CG2 4.15Å; L883-V903 HydrophobicContact CG-CG2 4.45Å; L883-L906 HydrophobicContact CD1-CB 4.5Å; L883-L906 HydrophobicContact CD2-CD1 3.71Å; L883-L1023 HydrophobicContact CD2-CD2 3.82Å; L883-F1077 HydrophobicContact CD1-CD1 4.18Å; L883-F1077 HydrophobicContact CD1-CD2 4.33Å; L883-F1077 HydrophobicContact CD1-CE1 3.66Å; L883-F1077 HydrophobicContact CD1-CE2 3.82Å; L883-F1077 HydrophobicContact CD1-CZ 3.46Å; L883-F1077 VanDerWaalsContact CD1-CZ 3.46Å; L883-F1077 HydrophobicContact CD2-CD1 4.3Å; L883-F1077 HydrophobicContact CD2-CD2 3.66Å; L883-F1077 HydrophobicContact CD2-CE2 3.88Å; L883-F1077 HydrophobicContact CD2-CG 3.89Å; L883-F1077 HydrophobicContact CD2-CZ 4.31Å; L883-F1077 HydrophobicContact CG-CD2 3.89Å; L883-F1077 HydrophobicContact CG-CE1 4.27Å; L883-F1077 HydrophobicContact CG-CE2 3.54Å; L883-F1077 HydrophobicContact CG-CG 4.39Å; L883-F1077 HydrophobicContact CG-CZ 3.76Å
884	A	96.5	Very high	94.8	Very high	1 Å²	1	13.3 Å²	13.3	1%	0.008	7%	0.07	C	C	.	.	H	α-helix	trans	-60.9	-42.2	173.1	0	0	0	0	0	110.1	L874 I877 T879 D880 A886 I887 V888	L874-A884 HydrophobicContact CD2-CB 3.33Å; L874-A884 WeakPolarHBondContact CD2-O 3.37Å; I877-A884 HydrophobicContact CB-CB 3.98Å; I877-A884 HydrophobicContact CD1-CB 4.47Å; I877-A884 HydrophobicContact CG2-CB 4.03Å; T879-A884 HydrophobicContact CG2-CB 3.77Å; D880-A884 WeakPolarHBondContact O-CB 3.43Å; D880-A884 PolarHBondContact O-N 3.11Å; A884-A886 PolarHBondContact O-N 2.87Å; A884-I887 WeakPolarHBondContact O-CB 2.87Å; A884-I887 PolarHBondContact O-N 3.08Å; A884-I887 VanDerWaalsContact O-N 3.16Å; A884-V888 WeakPolarHBondContact O-CG2 3.33Å; A884-V888 PolarHBondContact O-N 2.88Å
885	K	97.5	Very high	95	Very high	1 Å²	1	13.2 Å²	13.2	0%	0.004	7%	0.069	C	C	.	.	H	α-helix	trans	-61.3	-44.1	175.2	-175.8	-178	173.7	174.3	0	111.8	I858 L870 L874 P881 R882 L883 I887 V888 L889 D1104	I858-K885 PolarHBondContact O-NZ 3.39Å; L870-K885 HydrophobicContact CD2-CD 4.24Å; L870-K885 HydrophobicContact CD2-CG 4.24Å; L874-K885 HydrophobicContact CD1-CB 4.39Å; L874-K885 VanDerWaalsContact CD2-CA 3.48Å; L874-K885 HydrophobicContact CD2-CB 4.15Å; P881-K885 VanDerWaalsContact O-CB 3.31Å; P881-K885 WeakPolarHBondContact O-CB 3.42Å; P881-K885 PolarHBondContact O-N 2.99Å; R882-K885 WeakPolarHBondContact O-CB 3.44Å; R882-K885 PolarHBondContact O-N 2.84Å; L883-K885 VanDerWaalsContact C-N 3.29Å; L883-K885 PolarHBondContact O-N 3.13Å; K885-I887 VanDerWaalsContact C-N 3.27Å; K885-I887 PolarHBondContact O-N 2.89Å; K885-V888 PolarHBondContact O-N 3.04Å; K885-L889 HydrophobicContact CG-CD1 4.05Å; K885-L889 HydrophobicContact CG-CG 4.35Å; K885-L889 WeakPolarHBondContact O-CB 3.48Å; K885-L889 VanDerWaalsContact O-CG 3.32Å; K885-L889 WeakPolarHBondContact O-CG 3.31Å; K885-L889 PolarHBondContact O-N 2.89Å; K885-D1104 WeakPolarHBondContact CE-OD2 3.35Å; K885-D1104 IonicContact NZ-OD2 3.5Å; K885-D1104 PolarHBondContact NZ-OD2 3.19Å
886	A	97.8	Very high	95.4	Very high	0 Å²	0	12.3 Å²	12.3	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-56.9	-41.8	174.5	0	0	0	0	0	111.9	R882 L883 A884 A890 L899 L1019	R882-A886 PolarHBondContact O-N 3.35Å; L883-A886 WeakPolarHBondContact O-CB 3.46Å; L883-A886 PolarHBondContact O-N 3.1Å; A884-A886 PolarHBondContact O-N 2.87Å; A886-A890 VanDerWaalsContact O-CB 3.22Å; A886-A890 WeakPolarHBondContact O-CB 3.33Å; A886-A890 PolarHBondContact O-N 2.76Å; A886-L899 HydrophobicContact CB-CD1 4.3Å; A886-L1019 HydrophobicContact CB-CD1 4.34Å
887	I	97.7	Very high	95.8	Very high	0 Å²	0	10.4 Å²	10.4	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-65.2	-47.2	176.7	-71.2	169.5	0	0	0	111.8	I877 L883 A884 K885 L889 A890 A891 L896 L900 V903 I986	I877-I887 HydrophobicContact CD1-CB 4.34Å; I877-I887 HydrophobicContact CD1-CG2 3.95Å; I877-I887 HydrophobicContact CG2-CD1 4.17Å; L883-I887 WeakPolarHBondContact O-CG1 3.43Å; L883-I887 PolarHBondContact O-N 3.33Å; A884-I887 WeakPolarHBondContact O-CB 2.87Å; A884-I887 PolarHBondContact O-N 3.08Å; A884-I887 VanDerWaalsContact O-N 3.16Å; K885-I887 VanDerWaalsContact C-N 3.27Å; K885-I887 PolarHBondContact O-N 2.89Å; I887-L889 VanDerWaalsContact C-N 3.34Å; I887-L889 PolarHBondContact O-N 3.27Å; I887-A890 PolarHBondContact O-N 2.97Å; I887-A891 PolarHBondContact O-N 3.22Å; I887-L896 HydrophobicContact CG2-CD1 4.03Å; I887-L900 HydrophobicContact CD1-CD2 4.12Å; I887-L900 HydrophobicContact CG1-CD2 4.32Å; I887-L900 HydrophobicContact CG2-CD2 4.35Å; I887-V903 HydrophobicContact CD1-CB 4.02Å; I887-V903 HydrophobicContact CD1-CG1 3.86Å; I887-V903 HydrophobicContact CD1-CG2 3.88Å; I887-V903 HydrophobicContact CG1-CB 4.47Å; I887-V903 HydrophobicContact CG1-CG2 3.89Å; I887-I986 HydrophobicContact CG2-CD1 3.4Å; I887-I986 HydrophobicContact CG2-CG1 3.56Å
888	V	97.6	Very high	96.1	Very high	0 Å²	0	10.3 Å²	10.3	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-59.6	-48.2	179.2	174.8	0	0	0	0	110.4	L870 R873 L874 I877 A884 K885 A890 A891 I892 L991 L1153	L870-V888 HydrophobicContact CD1-CB 4.31Å; L870-V888 HydrophobicContact CD1-CG1 3.91Å; R873-V888 HydrophobicContact CB-CG1 4.41Å; R873-V888 HydrophobicContact CB-CG2 4.24Å; L874-V888 HydrophobicContact CD2-CG2 3.65Å; L874-V888 HydrophobicContact CG-CG2 4.26Å; I877-V888 HydrophobicContact CD1-CG2 3.63Å; A884-V888 WeakPolarHBondContact O-CG2 3.33Å; A884-V888 PolarHBondContact O-N 2.88Å; K885-V888 PolarHBondContact O-N 3.04Å; V888-A890 VanDerWaalsContact C-N 3.33Å; V888-A890 PolarHBondContact O-N 3.09Å; V888-A891 PolarHBondContact O-N 2.97Å; V888-I892 HydrophobicContact CG1-CD1 4.19Å; V888-I892 WeakPolarHBondContact O-CG1 3.33Å; V888-I892 PolarHBondContact O-N 3.3Å; V888-L991 HydrophobicContact CB-CD1 4.15Å; V888-L991 HydrophobicContact CG1-CD1 4Å; V888-L991 HydrophobicContact CG1-CD2 4.29Å; V888-L991 HydrophobicContact CG2-CD1 3.85Å; V888-L1153 HydrophobicContact CG1-CD2 3.72Å
889	L	98	Very high	96.8	Very high	6 Å²	6	8.9 Å²	8.9	3%	0.031	4%	0.043	C	C	.	.	H	α-helix	trans	-62.4	-41.1	176.5	-65	176.9	0	0	0	110.9	K885 I887 A891 I892 F893 V1018 A1021 V1149	K885-L889 HydrophobicContact CG-CD1 4.05Å; K885-L889 HydrophobicContact CG-CG 4.35Å; K885-L889 WeakPolarHBondContact O-CB 3.48Å; K885-L889 VanDerWaalsContact O-CG 3.32Å; K885-L889 WeakPolarHBondContact O-CG 3.31Å; K885-L889 PolarHBondContact O-N 2.89Å; I887-L889 VanDerWaalsContact C-N 3.34Å; I887-L889 PolarHBondContact O-N 3.27Å; L889-A891 VanDerWaalsContact C-N 3.28Å; L889-A891 PolarHBondContact O-N 3.5Å; L889-I892 PolarHBondContact O-N 3.39Å; L889-F893 HydrophobicContact CB-CD2 4.22Å; L889-F893 HydrophobicContact CD2-CE2 4.27Å; L889-F893 WeakPolarHBondContact O-CB 3.31Å; L889-F893 VanDerWaalsContact O-CD2 3.26Å; L889-F893 WeakPolarHBondContact O-CD2 3.41Å; L889-F893 PolarHBondContact O-N 3.34Å; L889-V1018 HydrophobicContact CB-CG1 3.79Å; L889-A1021 HydrophobicContact CD1-CB 3.78Å; L889-V1149 HydrophobicContact CD2-CG1 4.11Å; L889-V1149 HydrophobicContact CD2-CG2 4.45Å
890	A	98.3	Very high	97.1	Very high	0 Å²	0	7.6 Å²	7.6	0%	0	4%	0.035	C	C	.	.	H	α-helix	trans	-61.4	-34.7	178.5	0	0	0	0	0	113.6	A886 I887 V888 R894 C895 L896 L899 V1018	A886-A890 VanDerWaalsContact O-CB 3.22Å; A886-A890 WeakPolarHBondContact O-CB 3.33Å; A886-A890 PolarHBondContact O-N 2.76Å; I887-A890 PolarHBondContact O-N 2.97Å; V888-A890 VanDerWaalsContact C-N 3.33Å; V888-A890 PolarHBondContact O-N 3.09Å; A890-R894 PolarHBondContact O-N 3.26Å; A890-C895 PolarHBondContact O-N 2.89Å; A890-L896 HydrophobicContact CB-CD1 4.11Å; A890-L896 PolarHBondContact O-N 2.8Å; A890-L899 HydrophobicContact CB-CB 3.66Å; A890-L899 HydrophobicContact CB-CD2 4.18Å; A890-L899 HydrophobicContact CB-CG 3.69Å; A890-V1018 HydrophobicContact CB-CG1 4.05Å
891	A	97.4	Very high	97.5	Very high	1 Å²	1	6.5 Å²	6.5	1%	0.008	3%	0.029	C	C	.	.	H	α-helix	trans	-64.4	-45.1	171.5	0	0	0	0	0	111.6	I887 V888 L889 R894 L896 L991 L1157	I887-A891 PolarHBondContact O-N 3.22Å; V888-A891 PolarHBondContact O-N 2.97Å; L889-A891 VanDerWaalsContact C-N 3.28Å; L889-A891 PolarHBondContact O-N 3.5Å; A891-R894 PolarHBondContact O-N 3.4Å; A891-L896 HydrophobicContact CB-CD1 4.28Å; A891-L896 HydrophobicContact CB-CD2 4.25Å; A891-L991 HydrophobicContact CB-CB 4.05Å; A891-L991 HydrophobicContact CB-CD1 4.49Å; A891-L1157 HydrophobicContact CB-CD2 4.32Å
892	I	97.4	Very high	97.6	Very high	5 Å²	5	6.5 Å²	6.5	3%	0.026	3%	0.029	C	C	.	.	H	α-helix	trans	-66.5	-44.1	180	-63.7	173.7	0	0	0	111.6	V888 L889 R894 M1148 V1149 L1153 L1157	V888-I892 HydrophobicContact CG1-CD1 4.19Å; V888-I892 WeakPolarHBondContact O-CG1 3.33Å; V888-I892 PolarHBondContact O-N 3.3Å; L889-I892 PolarHBondContact O-N 3.39Å; I892-R894 PolarHBondContact O-N 3.15Å; I892-M1148 HydrophobicContact CG2-CE 4.07Å; I892-V1149 HydrophobicContact CD1-CG1 4.24Å; I892-V1149 HydrophobicContact CG2-CG2 4.2Å; I892-L1153 HydrophobicContact CD1-CD2 3.92Å; I892-L1153 HydrophobicContact CD1-CG 4.03Å; I892-L1157 HydrophobicContact CG1-CD2 4.28Å
893	F	98.2	Very high	97.7	Very high	6 Å²	6	4.3 Å²	4.3	3%	0.026	2%	0.02	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.9	7.1	178.3	-75.3	-87.1	0	0	0	113.3	L889 C895 L1014 V1018 L1102 L1145 M1148 V1149 L1172 L1175	L889-F893 HydrophobicContact CB-CD2 4.22Å; L889-F893 HydrophobicContact CD2-CE2 4.27Å; L889-F893 WeakPolarHBondContact O-CB 3.31Å; L889-F893 VanDerWaalsContact O-CD2 3.26Å; L889-F893 WeakPolarHBondContact O-CD2 3.41Å; L889-F893 PolarHBondContact O-N 3.34Å; F893-C895 VanDerWaalsContact C-N 3.33Å; F893-C895 PolarHBondContact O-N 3.01Å; F893-L1014 HydrophobicContact CD1-CD1 4.24Å; F893-V1018 HydrophobicContact CB-CG2 3.62Å; F893-V1018 HydrophobicContact CD1-CG2 4.25Å; F893-V1018 HydrophobicContact CD2-CG2 4.05Å; F893-V1018 HydrophobicContact CG-CG2 3.72Å; F893-L1102 HydrophobicContact CD1-CD2 4.35Å; F893-L1102 HydrophobicContact CE1-CD2 3.44Å; F893-L1102 VanDerWaalsContact CE1-CD2 3.44Å; F893-L1102 HydrophobicContact CE2-CD2 4.5Å; F893-L1102 HydrophobicContact CZ-CD2 3.54Å; F893-L1145 HydrophobicContact CE1-CD2 4.1Å; F893-M1148 HydrophobicContact CD1-CE 4.07Å; F893-M1148 HydrophobicContact CE1-CE 3.67Å; F893-M1148 HydrophobicContact CE2-CE 4.31Å; F893-M1148 HydrophobicContact CZ-CE 3.79Å; F893-V1149 HydrophobicContact CE2-CG2 3.68Å; F893-V1149 HydrophobicContact CZ-CG2 3.92Å; F893-L1172 HydrophobicContact CB-CD2 4.37Å; F893-L1172 HydrophobicContact CD1-CD2 3.44Å; F893-L1172 VanDerWaalsContact CD1-CD2 3.44Å; F893-L1172 HydrophobicContact CE1-CD2 4.06Å; F893-L1172 HydrophobicContact CG-CD2 4.23Å; F893-L1175 HydrophobicContact CD1-CD2 3.89Å; F893-L1175 HydrophobicContact CE1-CD2 3.71Å
894	R	97.9	Very high	97.7	Very high	21 Å²	21	4.1 Å²	4.1	8%	0.079	2%	0.02	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.1	38.6	173.7	-57.9	-179.2	-172.1	176.8	6.8	114.7	A890 A891 I892 Q1004 C1005 N1006 E1007 Y1008 Q1165 L1172	A890-R894 PolarHBondContact O-N 3.26Å; A891-R894 PolarHBondContact O-N 3.4Å; I892-R894 PolarHBondContact O-N 3.15Å; R894-Q1004 VanDerWaalsContact CB-O 3.25Å; R894-Q1004 WeakPolarHBondContact CB-O 3.28Å; R894-Q1004 WeakPolarHBondContact CD-O 3.31Å; R894-Q1004 VanDerWaalsContact CG-O 3.31Å; R894-Q1004 WeakPolarHBondContact CG-O 3.44Å; R894-C1005 CarbonylContact C-O 3.49Å; R894-C1005 WeakPolarHBondContact CA-O 3.38Å; R894-N1006 CarbonylContact O-C 3.35Å; R894-N1006 WeakPolarHBondContact O-CA 3.49Å; R894-E1007 HydrophobicContact CB-CB 4.16Å; R894-E1007 VanDerWaalsContact CD-OE2 3.27Å; R894-E1007 WeakPolarHBondContact CD-OE2 3.3Å; R894-E1007 IonicContact CZ-OE2 3.49Å; R894-E1007 IonicContact NE-OE2 2.8Å; R894-E1007 IonicContact NH1-OE2 3.55Å; R894-E1007 PolarHBondContact NH1-OE2 3.11Å; R894-E1007 PolarHBondContact O-N 3.27Å; R894-E1007 VanDerWaalsContact O-N 3.14Å; R894-Y1008 HydrophobicContact CB-CD2 3.95Å; R894-Y1008 HydrophobicContact CB-CE2 4.48Å; R894-Y1008 PolarHBondContact O-N 3.39Å; R894-Q1165 PolarHBondContact NH2-O 3.09Å; R894-L1172 HydrophobicContact CB-CD1 4.34Å; R894-L1172 HydrophobicContact CG-CD1 3.88Å
895	C	97.8	Very high	97.6	Very high	0 Å²	0	4.2 Å²	4.2	0%	0	2%	0.02	C	C	.	.			trans	-131.8	42.1	175.5	56.3	0	0	0	0	111.3	A890 F893 P898 C1005 V1015	A890-C895 PolarHBondContact O-N 2.89Å; F893-C895 VanDerWaalsContact C-N 3.33Å; F893-C895 PolarHBondContact O-N 3.01Å; C895-P898 WeakPolarHBondContact O-CD 3.47Å; C895-C1005 PolarHBondContact N-O 3.1Å; C895-V1015 HydrophobicContact CB-CG2 3.96Å
896	L	98.3	Very high	97.4	Very high	0 Å²	0	5.1 Å²	5.1	0%	0	3%	0.025	C	C	.	.	H	α-helix	trans	-68.1	-47.1	-165.2	-179.8	57.1	0	0	0	114.4	I887 A890 A891 L899 L900 I986 V992 C998 C1005 N1006	I887-L896 HydrophobicContact CG2-CD1 4.03Å; A890-L896 HydrophobicContact CB-CD1 4.11Å; A890-L896 PolarHBondContact O-N 2.8Å; A891-L896 HydrophobicContact CB-CD1 4.28Å; A891-L896 HydrophobicContact CB-CD2 4.25Å; L896-L899 PolarHBondContact O-N 2.67Å; L896-L899 VanDerWaalsContact O-N 3.1Å; L896-L900 HydrophobicContact CD1-CD1 4.27Å; L896-L900 HydrophobicContact CD1-CG 4.04Å; L896-L900 HydrophobicContact CD2-CD1 4.44Å; L896-L900 HydrophobicContact CG-CD1 3.95Å; L896-L900 HydrophobicContact CG-CG 4.21Å; L896-L900 PolarHBondContact O-N 2.77Å; L896-I986 HydrophobicContact CD1-CD1 3.99Å; L896-I986 HydrophobicContact CD2-CD1 4.24Å; L896-I986 HydrophobicContact CD2-CG2 4.25Å; L896-V992 HydrophobicContact CD2-CG1 3.97Å; L896-C998 HydrophobicContact CD2-CB 4.09Å; L896-C1005 HydrophobicContact CB-CB 4.43Å; L896-C1005 WeakPolarHBondContact CB-O 3.3Å; L896-C1005 HydrophobicContact CD2-CB 4.32Å; L896-C1005 PolarHBondContact N-O 3.3Å; L896-N1006 PolarHBondContact N-OD1 2.96Å
897	H	98	Very high	96.9	Very high	35 Å²	35	8 Å²	8	16%	0.162	4%	0.043	C	C	.	.	H	α-helix	trans	-57.7	-48.9	-171.4	-177	-110.2	0	0	0	113.7	L899 L900 V901 E947 C998 N1006	H897-L899 VanDerWaalsContact C-N 3.26Å; H897-L899 PolarHBondContact O-N 3.15Å; H897-L900 WeakPolarHBondContact O-CB 3.5Å; H897-L900 PolarHBondContact O-N 2.94Å; H897-V901 WeakPolarHBondContact O-CG2 3.36Å; H897-V901 PolarHBondContact O-N 2.78Å; H897-V901 VanDerWaalsContact O-N 3.1Å; H897-E947 IonicContact CE1-OE2 3.8Å; H897-C998 WeakPolarHBondContact CB-O 3.47Å; H897-N1006 WeakPolarHBondContact CB-OD1 3.43Å; H897-N1006 PolarHBondContact N-OD1 3.46Å
898	P	98.2	Very high	96.3	Very high	6 Å²	6	10 Å²	10	4%	0.039	5%	0.05	C	C	.	.	H	α-helix	trans	-54.9	-40.1	175.3	-25.5	33.2	0	0	0	113.1	C895 V901 V902 V940 S1009 V1015	C895-P898 WeakPolarHBondContact O-CD 3.47Å; P898-V901 PolarHBondContact O-N 3.13Å; P898-V902 VanDerWaalsContact O-CG2 3.3Å; P898-V902 WeakPolarHBondContact O-CG2 3.48Å; P898-V902 PolarHBondContact O-N 3.32Å; P898-V940 HydrophobicContact CB-CG1 4.2Å; P898-V940 HydrophobicContact CB-CG2 3.96Å; P898-S1009 WeakPolarHBondContact CG-O 3.48Å; P898-V1015 HydrophobicContact CB-CG1 3.91Å; P898-V1015 HydrophobicContact CB-CG2 4.26Å; P898-V1015 HydrophobicContact CG-CG2 4.14Å
899	L	98.2	Very high	95.9	Very high	1 Å²	1	12.7 Å²	12.7	1%	0.005	7%	0.065	C	C	.	.	H	α-helix	trans	-72.6	-34.4	-178.6	-86.3	-60.7	0	0	0	112.3	A886 A890 L896 H897 V901 V902 V903 V1015 L1019	A886-L899 HydrophobicContact CB-CD1 4.3Å; A890-L899 HydrophobicContact CB-CB 3.66Å; A890-L899 HydrophobicContact CB-CD2 4.18Å; A890-L899 HydrophobicContact CB-CG 3.69Å; L896-L899 PolarHBondContact O-N 2.67Å; L896-L899 VanDerWaalsContact O-N 3.1Å; H897-L899 VanDerWaalsContact C-N 3.26Å; H897-L899 PolarHBondContact O-N 3.15Å; L899-V901 VanDerWaalsContact C-N 3.31Å; L899-V901 PolarHBondContact O-N 3.26Å; L899-V902 PolarHBondContact O-N 2.99Å; L899-V903 WeakPolarHBondContact O-CB 3.44Å; L899-V903 WeakPolarHBondContact O-CG2 3.16Å; L899-V903 PolarHBondContact O-N 3.27Å; L899-V1015 HydrophobicContact CD2-CB 4.43Å; L899-V1015 HydrophobicContact CD2-CG1 3.68Å; L899-L1019 HydrophobicContact CD1-CB 3.76Å; L899-L1019 HydrophobicContact CD1-CD1 3.6Å; L899-L1019 HydrophobicContact CD1-CG 4.2Å
900	L	97.8	Very high	95.5	Very high	0 Å²	0	12.4 Å²	12.4	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-60.1	-43	170.7	-78.3	177.3	0	0	0	111.9	I887 L896 H897 S904 F982 I986 C998	I887-L900 HydrophobicContact CD1-CD2 4.12Å; I887-L900 HydrophobicContact CG1-CD2 4.32Å; I887-L900 HydrophobicContact CG2-CD2 4.35Å; L896-L900 HydrophobicContact CD1-CD1 4.27Å; L896-L900 HydrophobicContact CD1-CG 4.04Å; L896-L900 HydrophobicContact CD2-CD1 4.44Å; L896-L900 HydrophobicContact CG-CD1 3.95Å; L896-L900 HydrophobicContact CG-CG 4.21Å; L896-L900 PolarHBondContact O-N 2.77Å; H897-L900 WeakPolarHBondContact O-CB 3.5Å; H897-L900 PolarHBondContact O-N 2.94Å; L900-S904 VanDerWaalsContact O-CB 3.28Å; L900-S904 WeakPolarHBondContact O-CB 3.13Å; L900-S904 PolarHBondContact O-N 2.91Å; L900-S904 PolarHBondContact O-OG 2.95Å; L900-F982 HydrophobicContact CD2-CB 3.46Å; L900-F982 VanDerWaalsContact CD2-CB 3.46Å; L900-F982 HydrophobicContact CD2-CD2 4.37Å; L900-F982 HydrophobicContact CD2-CG 4.29Å; L900-I986 HydrophobicContact CD1-CD1 4.09Å; L900-I986 HydrophobicContact CD2-CD1 3.52Å; L900-I986 HydrophobicContact CG-CD1 4.17Å; L900-C998 HydrophobicContact CD1-CB 3.7Å
901	V	98.2	Very high	95.1	Very high	2 Å²	2	12.7 Å²	12.7	1%	0.012	6%	0.064	C	C	.	.	H	α-helix	trans	-63.7	-47.8	175.6	175.2	0	0	0	0	110.5	H897 P898 L899 S904 C905 V940 V943 I979	H897-V901 WeakPolarHBondContact O-CG2 3.36Å; H897-V901 PolarHBondContact O-N 2.78Å; H897-V901 VanDerWaalsContact O-N 3.1Å; P898-V901 PolarHBondContact O-N 3.13Å; L899-V901 VanDerWaalsContact C-N 3.31Å; L899-V901 PolarHBondContact O-N 3.26Å; V901-S904 PolarHBondContact O-N 2.71Å; V901-C905 WeakPolarHBondContact O-CB 3.27Å; V901-C905 PolarHBondContact O-N 2.95Å; V901-C905 PolarHBondContact O-SG 3.44Å; V901-V940 HydrophobicContact CB-CG2 4.48Å; V901-V940 HydrophobicContact CG1-CG2 4.45Å; V901-V943 HydrophobicContact CG1-CB 3.72Å; V901-V943 HydrophobicContact CG1-CG1 4.11Å; V901-V943 HydrophobicContact CG1-CG2 3.7Å; V901-V943 HydrophobicContact CG2-CG1 4.31Å; V901-I979 HydrophobicContact CG2-CD1 3.89Å
902	V	98	Very high	94	Very high	2 Å²	2	14.7 Å²	14.7	1%	0.012	8%	0.078	C	C	.	.	H	α-helix	trans	-57.4	-52.9	178.8	166.5	0	0	0	0	111.5	P898 L899 S904 C905 L906 H936 V940 L1019	P898-V902 VanDerWaalsContact O-CG2 3.3Å; P898-V902 WeakPolarHBondContact O-CG2 3.48Å; P898-V902 PolarHBondContact O-N 3.32Å; L899-V902 PolarHBondContact O-N 2.99Å; V902-S904 VanDerWaalsContact C-N 3.26Å; V902-S904 PolarHBondContact O-N 3.06Å; V902-C905 PolarHBondContact O-N 2.89Å; V902-C905 VanDerWaalsContact O-N 3.14Å; V902-L906 HydrophobicContact CG1-CD1 3.84Å; V902-L906 HydrophobicContact CG1-CG 4.34Å; V902-L906 WeakPolarHBondContact O-CG 3.15Å; V902-L906 PolarHBondContact O-N 3.45Å; V902-H936 HydrophobicContact CG1-CB 4.1Å; V902-H936 HydrophobicContact CG2-CB 3.86Å; V902-H936 WeakPolarHBondContact CG2-O 3.37Å; V902-V940 HydrophobicContact CG2-CG2 3.74Å; V902-L1019 HydrophobicContact CG1-CD1 4.11Å; V902-L1019 HydrophobicContact CG1-CD2 4.35Å
903	V	96.9	Very high	92.4	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-61.1	-38.2	-179.8	171.4	0	0	0	0	111.5	T879 L883 I887 L899 L906 T907 F982	T879-V903 HydrophobicContact CG2-CG1 4.25Å; L883-V903 HydrophobicContact CB-CG1 4.05Å; L883-V903 HydrophobicContact CB-CG2 3.92Å; L883-V903 HydrophobicContact CD1-CG1 4.15Å; L883-V903 HydrophobicContact CD2-CG2 4.15Å; L883-V903 HydrophobicContact CG-CG2 4.45Å; I887-V903 HydrophobicContact CD1-CB 4.02Å; I887-V903 HydrophobicContact CD1-CG1 3.86Å; I887-V903 HydrophobicContact CD1-CG2 3.88Å; I887-V903 HydrophobicContact CG1-CB 4.47Å; I887-V903 HydrophobicContact CG1-CG2 3.89Å; L899-V903 WeakPolarHBondContact O-CB 3.44Å; L899-V903 WeakPolarHBondContact O-CG2 3.16Å; L899-V903 PolarHBondContact O-N 3.27Å; V903-L906 PolarHBondContact O-N 3.06Å; V903-T907 PolarHBondContact O-N 3.28Å; V903-T907 PolarHBondContact O-OG1 3.39Å; V903-F982 HydrophobicContact CG1-CE2 3.86Å; V903-F982 HydrophobicContact CG1-CZ 4.03Å
904	S	96	Very high	90.2	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-66.7	-40.2	176.6	-58.8	0	0	0	0	112.1	L900 V901 V902 T907 R908 I979	L900-S904 VanDerWaalsContact O-CB 3.28Å; L900-S904 WeakPolarHBondContact O-CB 3.13Å; L900-S904 PolarHBondContact O-N 2.91Å; L900-S904 PolarHBondContact O-OG 2.95Å; V901-S904 PolarHBondContact O-N 2.71Å; V902-S904 VanDerWaalsContact C-N 3.26Å; V902-S904 PolarHBondContact O-N 3.06Å; S904-T907 WeakPolarHBondContact O-CB 3.33Å; S904-T907 PolarHBondContact O-N 2.91Å; S904-R908 PolarHBondContact O-N 3.41Å; S904-I979 WeakPolarHBondContact OG-CG1 3.39Å
905	C	94.7	Very high	88	Confident	3 Å²	3	20.1 Å²	20.1	2%	0.02	12%	0.116	C	C	.	.	H	α-helix	trans	-71.8	-33.5	177.2	-66.7	0	0	0	0	113.1	V901 V902 T907 R908 D909 P910 F939	V901-C905 WeakPolarHBondContact O-CB 3.27Å; V901-C905 PolarHBondContact O-N 2.95Å; V901-C905 PolarHBondContact O-SG 3.44Å; V902-C905 PolarHBondContact O-N 2.89Å; V902-C905 VanDerWaalsContact O-N 3.14Å; C905-T907 VanDerWaalsContact C-N 3.28Å; C905-R908 CarbonylContact C-O 3.56Å; C905-R908 VanDerWaalsContact CA-O 3.32Å; C905-R908 WeakPolarHBondContact CA-O 3.42Å; C905-R908 CarbonylContact O-C 3.57Å; C905-R908 PolarHBondContact O-N 2.9Å; C905-D909 PolarHBondContact O-N 2.72Å; C905-P910 HydrophobicContact CB-CG 4.48Å; C905-F939 HydrophobicContact CB-CB 3.81Å; C905-F939 HydrophobicContact CB-CD1 3.99Å; C905-F939 HydrophobicContact CB-CD2 3.72Å; C905-F939 HydrophobicContact CB-CE1 4.47Å; C905-F939 HydrophobicContact CB-CE2 4.25Å; C905-F939 HydrophobicContact CB-CG 3.6Å
906	L	92.4	Very high	85.8	Confident	19 Å²	19	27.1 Å²	27.1	10%	0.099	15%	0.149	C	C	.	.	H	α-helix	trans	-68.2	-30.1	172	-70.6	172.8	0	0	0	111.8	L883 V902 V903 F939 F1077 M1078	L883-L906 HydrophobicContact CD1-CB 4.5Å; L883-L906 HydrophobicContact CD2-CD1 3.71Å; V902-L906 HydrophobicContact CG1-CD1 3.84Å; V902-L906 HydrophobicContact CG1-CG 4.34Å; V902-L906 WeakPolarHBondContact O-CG 3.15Å; V902-L906 PolarHBondContact O-N 3.45Å; V903-L906 PolarHBondContact O-N 3.06Å; L906-F939 HydrophobicContact CD2-CE2 4.1Å; L906-F1077 HydrophobicContact CB-CD1 4.24Å; L906-F1077 HydrophobicContact CD1-CB 3.98Å; L906-F1077 HydrophobicContact CD1-CD1 3.97Å; L906-F1077 HydrophobicContact CD1-CG 4.11Å; L906-F1077 HydrophobicContact CD2-CB 4.48Å; L906-F1077 HydrophobicContact CD2-CD1 4.27Å; L906-F1077 HydrophobicContact CG-CD1 4.39Å; L906-M1078 HydrophobicContact CD2-CE 4.03Å
907	T	87.5	Confident	84.5	Confident	61 Å²	61	28 Å²	28	37%	0.374	15%	0.154	S	C	.	.	H	α-helix	trans	-75.9	-35.2	172.3	-54.6	0	0	0	0	111.8	V903 S904 C905 L978	V903-T907 PolarHBondContact O-N 3.28Å; V903-T907 PolarHBondContact O-OG1 3.39Å; S904-T907 WeakPolarHBondContact O-CB 3.33Å; S904-T907 PolarHBondContact O-N 2.91Å; C905-T907 VanDerWaalsContact C-N 3.28Å; T907-L978 HydrophobicContact CG2-CD1 3.78Å
908	R	86.3	Confident	83.3	Confident	43 Å²	43	32 Å²	32	16%	0.162	17%	0.167	C	C	.	.	S	Bend	trans	-144.5	113.4	-179.5	-179.8	66.6	-179	-166.5	1.9	110.7	N707 S904 C905 S971 F974 I975	N707-R908 PolarHBondContact O-NH1 2.9Å; N707-R908 VanDerWaalsContact O-NH1 3.13Å; N707-R908 PolarHBondContact O-NH2 2.87Å; S904-R908 PolarHBondContact O-N 3.41Å; C905-R908 CarbonylContact C-O 3.56Å; C905-R908 VanDerWaalsContact CA-O 3.32Å; C905-R908 WeakPolarHBondContact CA-O 3.42Å; C905-R908 CarbonylContact O-C 3.57Å; C905-R908 PolarHBondContact O-N 2.9Å; R908-S971 PolarHBondContact NE-OG 2.74Å; R908-S971 PolarHBondContact NH2-OG 2.89Å; R908-F974 HydrophobicContact CB-CD1 3.74Å; R908-F974 HydrophobicContact CB-CE1 4.09Å; R908-F974 HydrophobicContact CG-CD1 3.77Å; R908-F974 HydrophobicContact CG-CE1 4.44Å; R908-I975 HydrophobicContact CB-CG1 4.25Å; R908-I975 HydrophobicContact CG-CG1 4.42Å; R908-I975 WeakPolarHBondContact O-CD1 3.44Å
909	D	88	Confident	82.4	Confident	56 Å²	56	34.8 Å²	34.8	30%	0.299	19%	0.191	S	C	.	.			trans	-62.2	127.4	179.1	-165.3	-50.6	0	0	0	111.3	C905 F911 S971	C905-D909 PolarHBondContact O-N 2.72Å; D909-F911 WeakPolarHBondContact OD1-CA 3.49Å; D909-F911 VanDerWaalsContact OD1-CB 3.31Å; D909-F911 WeakPolarHBondContact OD1-CB 3.4Å; D909-F911 WeakPolarHBondContact OD1-CD2 3.22Å; D909-F911 PolarHBondContact OD1-N 3.05Å; D909-S971 VanDerWaalsContact O-CB 3.27Å; D909-S971 WeakPolarHBondContact O-CB 3.35Å; D909-S971 PolarHBondContact O-OG 3.31Å
910	P	90.6	Very high	81.7	Confident	0 Å²	0	40 Å²	40	0%	0	22%	0.215	C	C	.	.			trans	-76	-22.8	179.2	29.5	-34.2	0	0	0	113.5	C905 F939 L967 Y968 L972 I975	C905-P910 HydrophobicContact CB-CG 4.48Å; P910-F939 HydrophobicContact CG-CD1 3.85Å; P910-F939 HydrophobicContact CG-CE1 4.2Å; P910-L967 HydrophobicContact CB-CD2 4.23Å; P910-Y968 PolarHBondContact O-N 3.49Å; P910-L972 HydrophobicContact CB-CD2 3.96Å; P910-I975 HydrophobicContact CB-CD1 3.64Å; P910-I975 HydrophobicContact CG-CD1 4.4Å
911	F	88.9	Confident	81.1	Confident	6 Å²	6	40.1 Å²	40.1	3%	0.026	22%	0.216	C	C	.	.	B	Isolated β-bridge	trans	-79.4	147.9	-176.8	-60.3	-81.6	0	0	0	111.2	D909 S913 V921 V924 K925 L928 F939 A942 N965 L966 L967	D909-F911 WeakPolarHBondContact OD1-CA 3.49Å; D909-F911 VanDerWaalsContact OD1-CB 3.31Å; D909-F911 WeakPolarHBondContact OD1-CB 3.4Å; D909-F911 WeakPolarHBondContact OD1-CD2 3.22Å; D909-F911 PolarHBondContact OD1-N 3.05Å; F911-S913 PolarHBondContact O-N 2.74Å; F911-V921 HydrophobicContact CB-CG1 3.78Å; F911-V921 HydrophobicContact CB-CG2 4.47Å; F911-V921 HydrophobicContact CD1-CG1 4.04Å; F911-V921 HydrophobicContact CD2-CG1 4.32Å; F911-V921 HydrophobicContact CG-CG1 3.79Å; F911-V924 HydrophobicContact CE1-CG1 4.03Å; F911-K925 VanDerWaalsContact CD2-CE 3.44Å; F911-K925 HydrophobicContact CD2-CG 4.4Å; F911-K925 HydrophobicContact CE1-CG 4.27Å; F911-K925 HydrophobicContact CE2-CD 4.19Å; F911-K925 VanDerWaalsContact CE2-CE 3.41Å; F911-K925 HydrophobicContact CE2-CG 3.73Å; F911-K925 HydrophobicContact CZ-CG 3.66Å; F911-L928 HydrophobicContact CE1-CD1 3.95Å; F911-L928 HydrophobicContact CZ-CD1 3.91Å; F911-F939 HydrophobicContact CD2-CE1 4.17Å; F911-F939 AromaticContact CE2-CD1 3.81Å; F911-F939 HydrophobicContact CE2-CD1 3.81Å; F911-F939 AromaticContact CE2-CE1 3.74Å; F911-F939 HydrophobicContact CE2-CE1 3.74Å; F911-A942 HydrophobicContact CZ-CB 4.38Å; F911-N965 WeakPolarHBondContact CD1-O 3.1Å; F911-L966 CarbonylContact C-O 3.58Å; F911-L966 WeakPolarHBondContact CA-O 3.42Å; F911-L967 HydrophobicContact CD1-CD2 3.62Å; F911-L967 HydrophobicContact CE1-CD2 3.69Å; F911-L967 HydrophobicContact CG-CD2 4.25Å; F911-L967 HydrophobicContact CZ-CD2 4.37Å
912	S	75.2	Confident	80.5	Confident	43 Å²	43	41.9 Å²	41.9	30%	0.301	23%	0.225	S	C	.	.			trans	-76.8	52.9	171.7	63	0	0	0	0	110.8	S914 N917 L966	S912-S914 PolarHBondContact O-N 3.34Å; S912-N917 PolarHBondContact O-ND2 2.71Å; S912-N917 PolarHBondContact O-OD1 2.85Å; S912-L966 PolarHBondContact N-O 2.79Å; S912-L966 PolarHBondContact OG-O 2.96Å
913	S	62.5	Low	80	Confident	58 Å²	58	48.9 Å²	48.9	41%	0.406	26%	0.256	S	S	.	.			trans	-68.9	95.9	-177.4	54.9	0	0	0	0	111.2	F911	F911-S913 PolarHBondContact O-N 2.74Å
914	S	52.3	Low	79.7	Confident	35 Å²	35	49.8 Å²	49.8	25%	0.245	26%	0.261	C	S	.	.			trans	-84	162	156	76.8	0	0	0	0	108.9	S912 Q916 N917 R918	S912-S914 PolarHBondContact O-N 3.34Å; S914-Q916 PolarHBondContact O-N 2.93Å; S914-Q916 PolarHBondContact OG-N 3.14Å; S914-N917 WeakPolarHBondContact CA-OD1 3.27Å; S914-N917 WeakPolarHBondContact CB-OD1 3.28Å; S914-N917 PolarHBondContact N-OD1 3.21Å; S914-N917 PolarHBondContact O-N 3.37Å; S914-N917 PolarHBondContact O-OD1 3.49Å; S914-N917 VanDerWaalsContact OG-CG 3.31Å; S914-N917 PolarHBondContact OG-N 3.02Å; S914-N917 PolarHBondContact OG-OD1 3.05Å; S914-R918 WeakPolarHBondContact O-CG 3.5Å
915	L	51.3	Low	79.5	Confident	53 Å²	53	50.6 Å²	50.6	28%	0.277	27%	0.265	S	S	.	.	S	Bend	trans	-62.2	-26.9	172.4	-73.6	121.9	0	0	0	112.7	Q679	Q679-L915 HydrophobicContact CB-CD1 4.07Å; Q679-L915 HydrophobicContact CG-CD1 3.25Å; Q679-L915 HydrophobicContact CG-CD2 3.38Å; Q679-L915 HydrophobicContact CG-CG 3.89Å; Q679-L915 VanDerWaalsContact NE2-CD2 3.26Å
916	Q	53.4	Low	79.2	Confident	146 Å²	146	52.8 Å²	52.8	68%	0.682	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-30.5	-175.1	-64.2	177.4	-5.2	0	0	112.7	Q686 S914	Q686-Q916 VanDerWaalsContact OE1-NE2 3.14Å; S914-Q916 PolarHBondContact O-N 2.93Å; S914-Q916 PolarHBondContact OG-N 3.14Å
917	N	69.6	Low	79.2	Confident	20 Å²	20	57.7 Å²	57.7	11%	0.107	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.6	12.5	-178.1	70.2	-19.7	0	0	0	113.9	S912 S914 A919 E920 V921	S912-N917 PolarHBondContact O-ND2 2.71Å; S912-N917 PolarHBondContact O-OD1 2.85Å; S914-N917 WeakPolarHBondContact CA-OD1 3.27Å; S914-N917 WeakPolarHBondContact CB-OD1 3.28Å; S914-N917 PolarHBondContact N-OD1 3.21Å; S914-N917 PolarHBondContact O-N 3.37Å; S914-N917 PolarHBondContact O-OD1 3.49Å; S914-N917 VanDerWaalsContact OG-CG 3.31Å; S914-N917 PolarHBondContact OG-N 3.02Å; S914-N917 PolarHBondContact OG-OD1 3.05Å; N917-A919 VanDerWaalsContact C-N 3.34Å; N917-A919 PolarHBondContact O-N 3Å; N917-E920 HydrophobicContact CB-CB 4.47Å; N917-E920 WeakPolarHBondContact O-CB 3.37Å; N917-E920 PolarHBondContact O-N 3.38Å; N917-V921 WeakPolarHBondContact O-CG2 3.33Å; N917-V921 PolarHBondContact O-N 3.46Å
918	R	73.6	Confident	79.5	Confident	117 Å²	117	55.6 Å²	55.6	44%	0.442	30%	0.295	S	S	.	.	H	α-helix	trans	-51.5	-50.3	-179.6	-76.8	-176	176	176.6	-0.4	112.6	S914 E920 V921 D922	S914-R918 WeakPolarHBondContact O-CG 3.5Å; R918-E920 PolarHBondContact O-N 3.14Å; R918-V921 PolarHBondContact O-N 3.45Å; R918-D922 PolarHBondContact O-N 3.06Å; R918-D922 VanDerWaalsContact O-OD2 3.11Å
919	A	78.9	Confident	79.7	Confident	65 Å²	65	53.7 Å²	53.7	54%	0.537	29%	0.288	S	S	.	.	H	α-helix	trans	-64.7	-24.3	179.9	0	0	0	0	0	113.7	N917 K923	N917-A919 VanDerWaalsContact C-N 3.34Å; N917-A919 PolarHBondContact O-N 3Å; A919-K923 VanDerWaalsContact O-CG 3.29Å; A919-K923 WeakPolarHBondContact O-CG 3.41Å; A919-K923 PolarHBondContact O-N 3.24Å
920	E	84	Confident	79.7	Confident	111 Å²	111	57 Å²	57	52%	0.519	30%	0.302	S	S	.	.	H	α-helix	trans	-81.1	-42.5	174.9	-62.5	177.6	165.8	0	0	110.7	N917 R918 D922 K923 V924 L966	N917-E920 HydrophobicContact CB-CB 4.47Å; N917-E920 WeakPolarHBondContact O-CB 3.37Å; N917-E920 PolarHBondContact O-N 3.38Å; R918-E920 PolarHBondContact O-N 3.14Å; E920-D922 VanDerWaalsContact C-N 3.3Å; E920-D922 PolarHBondContact O-N 3.4Å; E920-K923 WeakPolarHBondContact O-CB 3.46Å; E920-K923 PolarHBondContact O-N 3.38Å; E920-V924 WeakPolarHBondContact O-CG2 3.28Å; E920-V924 PolarHBondContact O-N 3.17Å; E920-L966 HydrophobicContact CB-CD1 3.71Å
921	V	85.8	Confident	79.5	Confident	3 Å²	3	62.4 Å²	62.4	2%	0.018	33%	0.331	C	S	.	.	H	α-helix	trans	-58.7	-42.5	172.4	172.9	0	0	0	0	110.8	F911 N917 R918 K923 V924 K925 L966	F911-V921 HydrophobicContact CB-CG1 3.78Å; F911-V921 HydrophobicContact CB-CG2 4.47Å; F911-V921 HydrophobicContact CD1-CG1 4.04Å; F911-V921 HydrophobicContact CD2-CG1 4.32Å; F911-V921 HydrophobicContact CG-CG1 3.79Å; N917-V921 WeakPolarHBondContact O-CG2 3.33Å; N917-V921 PolarHBondContact O-N 3.46Å; R918-V921 PolarHBondContact O-N 3.45Å; V921-K923 VanDerWaalsContact C-N 3.31Å; V921-K923 PolarHBondContact O-N 2.85Å; V921-V924 PolarHBondContact O-N 3.12Å; V921-K925 HydrophobicContact CG1-CD 4.27Å; V921-K925 HydrophobicContact CG1-CG 4.42Å; V921-K925 WeakPolarHBondContact O-CG 3.45Å; V921-K925 PolarHBondContact O-N 3.48Å; V921-L966 HydrophobicContact CG2-CB 4.28Å; V921-L966 HydrophobicContact CG2-CD1 3.92Å
922	D	84.4	Confident	79.5	Confident	38 Å²	38	62.4 Å²	62.4	20%	0.203	33%	0.332	C	S	.	.	H	α-helix	trans	-65.4	-34.6	178.9	-63.4	-28.4	0	0	0	111.6	R918 E920 K925 A926	R918-D922 PolarHBondContact O-N 3.06Å; R918-D922 VanDerWaalsContact O-OD2 3.11Å; E920-D922 VanDerWaalsContact C-N 3.3Å; E920-D922 PolarHBondContact O-N 3.4Å; D922-K925 PolarHBondContact O-N 3.49Å; D922-A926 WeakPolarHBondContact O-CB 3.34Å; D922-A926 PolarHBondContact O-N 3.3Å
923	K	88.4	Confident	80.2	Confident	149 Å²	149	60.8 Å²	60.8	65%	0.648	32%	0.322	S	S	*	.	H	α-helix	trans	-66.3	-42.3	171.7	-72.8	169.5	-172.5	173.2	0	112.1	A919 E920 V921 A926 L927	A919-K923 VanDerWaalsContact O-CG 3.29Å; A919-K923 WeakPolarHBondContact O-CG 3.41Å; A919-K923 PolarHBondContact O-N 3.24Å; E920-K923 WeakPolarHBondContact O-CB 3.46Å; E920-K923 PolarHBondContact O-N 3.38Å; V921-K923 VanDerWaalsContact C-N 3.31Å; V921-K923 PolarHBondContact O-N 2.85Å; K923-A926 PolarHBondContact O-N 3.09Å; K923-L927 PolarHBondContact O-N 3.29Å
924	V	90.7	Very high	81.8	Confident	19 Å²	19	58.1 Å²	58.1	12%	0.115	30%	0.303	C	S	.	.	H	α-helix	trans	-64	-44.6	176	172.5	0	0	0	0	110.4	F911 E920 V921 A926 L927 L928 N965 L966	F911-V924 HydrophobicContact CE1-CG1 4.03Å; E920-V924 WeakPolarHBondContact O-CG2 3.28Å; E920-V924 PolarHBondContact O-N 3.17Å; V921-V924 PolarHBondContact O-N 3.12Å; V924-A926 VanDerWaalsContact C-N 3.32Å; V924-A926 PolarHBondContact O-N 3.43Å; V924-L927 WeakPolarHBondContact O-CB 3.47Å; V924-L927 PolarHBondContact O-N 3.42Å; V924-L927 VanDerWaalsContact O-N 3.16Å; V924-L928 HydrophobicContact CG1-CD1 3.75Å; V924-L928 HydrophobicContact CG1-CG 4.25Å; V924-L928 WeakPolarHBondContact O-CB 3.4Å; V924-L928 WeakPolarHBondContact O-CG 3.46Å; V924-L928 PolarHBondContact O-N 3.5Å; V924-N965 HydrophobicContact CG1-CB 4.2Å; V924-L966 HydrophobicContact CG2-CD1 4.04Å; V924-L966 HydrophobicContact CG2-CG 4.26Å
925	K	91.1	Very high	83.8	Confident	17 Å²	17	56.6 Å²	56.6	7%	0.074	29%	0.292	C	S	.	.	H	α-helix	trans	-58.6	-42.8	174.2	-75.2	178.5	175.7	-179.4	0	111.9	F911 V921 D922 L928 S929 I1062	F911-K925 VanDerWaalsContact CD2-CE 3.44Å; F911-K925 HydrophobicContact CD2-CG 4.4Å; F911-K925 HydrophobicContact CE1-CG 4.27Å; F911-K925 HydrophobicContact CE2-CD 4.19Å; F911-K925 VanDerWaalsContact CE2-CE 3.41Å; F911-K925 HydrophobicContact CE2-CG 3.73Å; F911-K925 HydrophobicContact CZ-CG 3.66Å; V921-K925 HydrophobicContact CG1-CD 4.27Å; V921-K925 HydrophobicContact CG1-CG 4.42Å; V921-K925 WeakPolarHBondContact O-CG 3.45Å; V921-K925 PolarHBondContact O-N 3.48Å; D922-K925 PolarHBondContact O-N 3.49Å; K925-L928 PolarHBondContact O-N 3.15Å; K925-S929 VanDerWaalsContact O-CB 3.27Å; K925-S929 WeakPolarHBondContact O-CB 3.42Å; K925-S929 PolarHBondContact O-N 3.39Å; K925-I1062 HydrophobicContact CB-CG2 3.75Å
926	A	89.4	Confident	86	Confident	49 Å²	49	54.2 Å²	54.2	41%	0.405	28%	0.279	S	S	.	.	H	α-helix	trans	-62.8	-41.7	175.8	0	0	0	0	0	111.8	D922 K923 V924 S929 H930 I1062	D922-A926 WeakPolarHBondContact O-CB 3.34Å; D922-A926 PolarHBondContact O-N 3.3Å; K923-A926 PolarHBondContact O-N 3.09Å; V924-A926 VanDerWaalsContact C-N 3.32Å; V924-A926 PolarHBondContact O-N 3.43Å; A926-S929 PolarHBondContact O-N 3.34Å; A926-H930 PolarHBondContact O-N 2.78Å; A926-I1062 HydrophobicContact CB-CG2 4.22Å
927	L	91.8	Very high	88.1	Confident	122 Å²	122	47.7 Å²	47.7	64%	0.639	25%	0.249	S	C	*	.	H	α-helix	trans	-62.7	-47.7	175.3	-177.8	65.5	0	0	0	111.7	K923 V924 S929 H930	K923-L927 PolarHBondContact O-N 3.29Å; V924-L927 WeakPolarHBondContact O-CB 3.47Å; V924-L927 PolarHBondContact O-N 3.42Å; V924-L927 VanDerWaalsContact O-N 3.16Å; L927-S929 VanDerWaalsContact C-N 3.34Å; L927-S929 PolarHBondContact O-N 3.41Å; L927-H930 PolarHBondContact O-N 2.84Å; L927-H930 VanDerWaalsContact O-N 3.15Å; L927-H930 PolarHBondContact O-ND1 3.09Å
928	L	93.5	Very high	89.3	Confident	18 Å²	18	46.8 Å²	46.8	9%	0.094	24%	0.244	C	C	.	.	H	α-helix	trans	-66.8	-32.8	178.3	-72.9	170.3	0	0	0	112.4	F911 V924 K925 H930 A938 R941 A942	F911-L928 HydrophobicContact CE1-CD1 3.95Å; F911-L928 HydrophobicContact CZ-CD1 3.91Å; V924-L928 HydrophobicContact CG1-CD1 3.75Å; V924-L928 HydrophobicContact CG1-CG 4.25Å; V924-L928 WeakPolarHBondContact O-CB 3.4Å; V924-L928 WeakPolarHBondContact O-CG 3.46Å; V924-L928 PolarHBondContact O-N 3.5Å; K925-L928 PolarHBondContact O-N 3.15Å; L928-H930 PolarHBondContact O-N 3.16Å; L928-A938 HydrophobicContact CB-CB 3.98Å; L928-R941 HydrophobicContact CD2-CB 4.46Å; L928-R941 WeakPolarHBondContact O-CD 3.44Å; L928-R941 PolarHBondContact O-NH1 2.84Å; L928-A942 HydrophobicContact CD1-CB 3.95Å
929	S	90.5	Very high	90.4	Very high	3 Å²	3	41.6 Å²	41.6	2%	0.021	23%	0.225	C	C	.	.	H	α-helix	trans	-68.6	-15.6	174.9	176.4	0	0	0	0	112.5	K925 A926 L927 D931 S932 G933 S934 R941 I1062	K925-S929 VanDerWaalsContact O-CB 3.27Å; K925-S929 WeakPolarHBondContact O-CB 3.42Å; K925-S929 PolarHBondContact O-N 3.39Å; A926-S929 PolarHBondContact O-N 3.34Å; L927-S929 VanDerWaalsContact C-N 3.34Å; L927-S929 PolarHBondContact O-N 3.41Å; S929-D931 PolarHBondContact O-N 3.49Å; S929-D931 VanDerWaalsContact O-N 3.12Å; S929-S932 WeakPolarHBondContact O-CB 3.39Å; S929-S932 PolarHBondContact O-N 3.25Å; S929-S932 PolarHBondContact O-OG 3.43Å; S929-S932 PolarHBondContact OG-OG 2.95Å; S929-G933 PolarHBondContact OG-N 3.22Å; S929-S934 PolarHBondContact OG-N 3.48Å; S929-S934 VanDerWaalsContact OG-N 3.13Å; S929-R941 PolarHBondContact O-NH1 3.39Å; S929-I1062 WeakPolarHBondContact OG-CD1 3.27Å
930	H	87.5	Confident	91.3	Very high	125 Å²	125	39.6 Å²	39.6	58%	0.579	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	45.6	-122.3	-171.5	-58	-41.4	0	0	0	109.6	A926 L927 L928 R941	A926-H930 PolarHBondContact O-N 2.78Å; L927-H930 PolarHBondContact O-N 2.84Å; L927-H930 VanDerWaalsContact O-N 3.15Å; L927-H930 PolarHBondContact O-ND1 3.09Å; L928-H930 PolarHBondContact O-N 3.16Å; H930-R941 PolarHBondContact CD2-NH1 3.49Å
931	D	86.3	Confident	91.9	Very high	114 Å²	114	36.6 Å²	36.6	61%	0.61	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-101	-0.2	-175.1	-96.3	13.4	0	0	0	113.2	S929 G933 R1070	S929-D931 PolarHBondContact O-N 3.49Å; S929-D931 VanDerWaalsContact O-N 3.12Å; D931-G933 VanDerWaalsContact C-N 3.33Å; D931-G933 PolarHBondContact O-N 3.43Å; D931-R1070 PolarHBondContact O-NE 3.03Å; D931-R1070 PolarHBondContact O-NH1 3.38Å; D931-R1070 IonicContact OD1-NH2 2.87Å; D931-R1070 IonicContact OD2-CZ 3.92Å; D931-R1070 IonicContact OD2-NH2 3.67Å; D931-R1070 PolarHBondContact OD2-NH2 2.69Å
932	S	88.7	Confident	92.4	Very high	6 Å²	6	36.4 Å²	36.4	4%	0.042	19%	0.189	C	C	.	.	S	Bend	trans	-75.6	-18.1	-171.1	71.3	0	0	0	0	114.5	S929 S934 E1012 K1016	S929-S932 WeakPolarHBondContact O-CB 3.39Å; S929-S932 PolarHBondContact O-N 3.25Å; S929-S932 PolarHBondContact O-OG 3.43Å; S929-S932 PolarHBondContact OG-OG 2.95Å; S932-S934 VanDerWaalsContact C-N 3.3Å; S932-S934 PolarHBondContact O-N 3.46Å; S932-E1012 WeakPolarHBondContact CB-OE2 3.39Å; S932-K1016 PolarHBondContact O-NZ 3.06Å
933	G	90.9	Very high	92.9	Very high	9 Å²	9	34.6 Å²	34.6	9%	0.093	18%	0.179	C	C	.	.			trans	60.5	36.3	-175.8	0	0	0	0	0	113.5	S929 D931 N1063 Q1093	S929-G933 PolarHBondContact OG-N 3.22Å; D931-G933 VanDerWaalsContact C-N 3.33Å; D931-G933 PolarHBondContact O-N 3.43Å; G933-N1063 PolarHBondContact O-ND2 2.99Å; G933-N1063 PolarHBondContact O-OD1 3.42Å; G933-Q1093 WeakPolarHBondContact O-CG 3.36Å; G933-Q1093 PolarHBondContact O-N 2.96Å
934	S	95.3	Very high	93.2	Very high	1 Å²	1	29.8 Å²	29.8	1%	0.007	17%	0.167	C	C	.	.	B	Isolated β-bridge	trans	-134.5	109.8	-168.7	-178.5	0	0	0	0	112.3	S929 S932 H936 L937 A938 S1092	S929-S934 PolarHBondContact OG-N 3.48Å; S929-S934 VanDerWaalsContact OG-N 3.13Å; S932-S934 VanDerWaalsContact C-N 3.3Å; S932-S934 PolarHBondContact O-N 3.46Å; S934-H936 PolarHBondContact O-N 3.49Å; S934-L937 PolarHBondContact O-N 3.38Å; S934-L937 WeakPolarHBondContact OG-CG 3.2Å; S934-L937 PolarHBondContact OG-N 3.47Å; S934-L937 VanDerWaalsContact OG-N 3.12Å; S934-A938 PolarHBondContact O-N 2.93Å; S934-A938 VanDerWaalsContact O-N 3.12Å; S934-S1092 WeakPolarHBondContact CA-OG 3.26Å; S934-S1092 WeakPolarHBondContact CB-OG 3.42Å; S934-S1092 WeakPolarHBondContact OG-CB 3.3Å; S934-S1092 PolarHBondContact OG-OG 3.22Å
935	D	95.4	Very high	93.4	Very high	4 Å²	4	29.4 Å²	29.4	2%	0.021	17%	0.167	C	C	.	.	H	α-helix	trans	-58.6	-38.1	170.9	-69	-42.6	0	0	0	110.8	L937 A938 F939 T1061 I1062 S1091	D935-L937 PolarHBondContact O-N 2.84Å; D935-A938 VanDerWaalsContact O-CB 3.31Å; D935-A938 WeakPolarHBondContact O-CB 3.37Å; D935-A938 PolarHBondContact O-N 2.9Å; D935-A938 VanDerWaalsContact O-N 3.17Å; D935-F939 PolarHBondContact O-N 3.2Å; D935-F939 VanDerWaalsContact O-N 3.14Å; D935-T1061 WeakPolarHBondContact OD2-CA 3.37Å; D935-T1061 WeakPolarHBondContact OD2-CB 3.28Å; D935-T1061 PolarHBondContact OD2-OG1 2.95Å; D935-I1062 VanDerWaalsContact OD1-CG1 3.28Å; D935-I1062 WeakPolarHBondContact OD1-CG1 3.3Å; D935-I1062 WeakPolarHBondContact OD1-CG2 3.23Å; D935-I1062 PolarHBondContact OD1-N 3.25Å; D935-S1091 PolarHBondContact N-O 3.07Å; D935-S1091 PolarHBondContact OD2-N 3.4Å
936	H	97.2	Very high	93.5	Very high	2 Å²	2	29.3 Å²	29.3	1%	0.009	17%	0.166	C	C	.	.	H	α-helix	trans	-65.9	-38.5	-179.1	-59.4	105.4	0	0	0	112.5	V902 S934 A938 F939 V940 L1019 D1090 S1092	V902-H936 HydrophobicContact CG1-CB 4.1Å; V902-H936 HydrophobicContact CG2-CB 3.86Å; V902-H936 WeakPolarHBondContact CG2-O 3.37Å; S934-H936 PolarHBondContact O-N 3.49Å; H936-A938 VanDerWaalsContact C-N 3.33Å; H936-F939 WeakPolarHBondContact O-CB 3.31Å; H936-F939 PolarHBondContact O-N 2.91Å; H936-V940 WeakPolarHBondContact O-CG2 3.28Å; H936-V940 PolarHBondContact O-N 2.8Å; H936-L1019 HydrophobicContact CB-CD2 3.7Å; H936-L1019 VanDerWaalsContact CG-CD2 3.43Å; H936-D1090 IonicContact CE1-OD2 3.42Å; H936-D1090 PolarHBondContact CE1-OD2 3.42Å; H936-D1090 VanDerWaalsContact CE1-OD2 3.26Å; H936-D1090 IonicContact NE2-OD2 2.81Å; H936-D1090 PolarHBondContact NE2-OD2 3.07Å; H936-D1090 VanDerWaalsContact NE2-OD2 3.13Å; H936-S1092 PolarHBondContact ND1-OG 3.14Å
937	L	97.2	Very high	93.6	Very high	10 Å²	10	29.4 Å²	29.4	5%	0.052	16%	0.158	C	C	.	.	H	α-helix	trans	-73.6	-26.8	174.1	-67.4	176.6	0	0	0	112.1	S934 D935 F939 V940 R941 E1012 V1015 K1016	S934-L937 PolarHBondContact O-N 3.38Å; S934-L937 WeakPolarHBondContact OG-CG 3.2Å; S934-L937 PolarHBondContact OG-N 3.47Å; S934-L937 VanDerWaalsContact OG-N 3.12Å; D935-L937 PolarHBondContact O-N 2.84Å; L937-F939 VanDerWaalsContact C-N 3.27Å; L937-F939 PolarHBondContact O-N 3.33Å; L937-V940 HydrophobicContact CD2-CG2 4.39Å; L937-V940 PolarHBondContact O-N 3.01Å; L937-R941 WeakPolarHBondContact O-CG 3.05Å; L937-R941 PolarHBondContact O-N 2.8Å; L937-E1012 HydrophobicContact CD1-CB 3.86Å; L937-E1012 HydrophobicContact CD1-CG 3.97Å; L937-V1015 HydrophobicContact CD2-CG1 3.85Å; L937-K1016 HydrophobicContact CD1-CD 3.89Å; L937-K1016 HydrophobicContact CD1-CG 4.03Å; L937-K1016 HydrophobicContact CG-CG 4.4Å
938	A	96.2	Very high	93.6	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-61.6	-37.6	169.8	0	0	0	0	0	111.4	L928 S934 D935 H936 A942	L928-A938 HydrophobicContact CB-CB 3.98Å; S934-A938 PolarHBondContact O-N 2.93Å; S934-A938 VanDerWaalsContact O-N 3.12Å; D935-A938 VanDerWaalsContact O-CB 3.31Å; D935-A938 WeakPolarHBondContact O-CB 3.37Å; D935-A938 PolarHBondContact O-N 2.9Å; D935-A938 VanDerWaalsContact O-N 3.17Å; H936-A938 VanDerWaalsContact C-N 3.33Å; A938-A942 WeakPolarHBondContact O-CB 3.36Å; A938-A942 PolarHBondContact O-N 2.61Å
939	F	96.7	Very high	93.5	Very high	8 Å²	8	29.2 Å²	29.2	4%	0.035	16%	0.155	C	C	.	.	H	α-helix	trans	-62.8	-46.6	171.1	-63.3	-39.7	0	0	0	112.5	C905 L906 P910 F911 D935 H936 L937 R941 A942 V943	C905-F939 HydrophobicContact CB-CB 3.81Å; C905-F939 HydrophobicContact CB-CD1 3.99Å; C905-F939 HydrophobicContact CB-CD2 3.72Å; C905-F939 HydrophobicContact CB-CE1 4.47Å; C905-F939 HydrophobicContact CB-CE2 4.25Å; C905-F939 HydrophobicContact CB-CG 3.6Å; L906-F939 HydrophobicContact CD2-CE2 4.1Å; P910-F939 HydrophobicContact CG-CD1 3.85Å; P910-F939 HydrophobicContact CG-CE1 4.2Å; F911-F939 HydrophobicContact CD2-CE1 4.17Å; F911-F939 AromaticContact CE2-CD1 3.81Å; F911-F939 HydrophobicContact CE2-CD1 3.81Å; F911-F939 AromaticContact CE2-CE1 3.74Å; F911-F939 HydrophobicContact CE2-CE1 3.74Å; D935-F939 PolarHBondContact O-N 3.2Å; D935-F939 VanDerWaalsContact O-N 3.14Å; H936-F939 WeakPolarHBondContact O-CB 3.31Å; H936-F939 PolarHBondContact O-N 2.91Å; L937-F939 VanDerWaalsContact C-N 3.27Å; L937-F939 PolarHBondContact O-N 3.33Å; F939-R941 VanDerWaalsContact C-N 3.31Å; F939-R941 PolarHBondContact O-N 2.99Å; F939-A942 PolarHBondContact O-N 3.23Å; F939-V943 WeakPolarHBondContact O-CG2 3.38Å; F939-V943 PolarHBondContact O-N 2.71Å
940	V	97.4	Very high	93.4	Very high	24 Å²	24	31.6 Å²	31.6	15%	0.145	17%	0.167	C	C	.	.	H	α-helix	trans	-56.4	-47.4	179	177.9	0	0	0	0	110.7	P898 V901 V902 H936 L937 V943 A944	P898-V940 HydrophobicContact CB-CG1 4.2Å; P898-V940 HydrophobicContact CB-CG2 3.96Å; V901-V940 HydrophobicContact CB-CG2 4.48Å; V901-V940 HydrophobicContact CG1-CG2 4.45Å; V902-V940 HydrophobicContact CG2-CG2 3.74Å; H936-V940 WeakPolarHBondContact O-CG2 3.28Å; H936-V940 PolarHBondContact O-N 2.8Å; L937-V940 HydrophobicContact CD2-CG2 4.39Å; L937-V940 PolarHBondContact O-N 3.01Å; V940-V943 PolarHBondContact O-N 3.36Å; V940-A944 VanDerWaalsContact O-CB 3.28Å; V940-A944 WeakPolarHBondContact O-CB 3.49Å; V940-A944 PolarHBondContact O-N 2.84Å
941	R	96.7	Very high	93.4	Very high	47 Å²	47	34.9 Å²	34.9	18%	0.177	17%	0.174	C	C	.	.	H	α-helix	trans	-70.5	-36.4	-178.9	-68.7	167.8	-175.6	160.6	3.6	113.3	L928 S929 H930 L937 F939 V943 A944 G945 Y961 E1012	L928-R941 HydrophobicContact CD2-CB 4.46Å; L928-R941 WeakPolarHBondContact O-CD 3.44Å; L928-R941 PolarHBondContact O-NH1 2.84Å; S929-R941 PolarHBondContact O-NH1 3.39Å; H930-R941 PolarHBondContact CD2-NH1 3.49Å; L937-R941 WeakPolarHBondContact O-CG 3.05Å; L937-R941 PolarHBondContact O-N 2.8Å; F939-R941 VanDerWaalsContact C-N 3.31Å; F939-R941 PolarHBondContact O-N 2.99Å; R941-V943 VanDerWaalsContact C-N 3.33Å; R941-V943 PolarHBondContact O-N 3Å; R941-A944 PolarHBondContact O-N 3.23Å; R941-G945 PolarHBondContact O-N 3.13Å; R941-Y961 PolarHBondContact O-OH 3.37Å; R941-E1012 IonicContact CZ-OE1 3.89Å; R941-E1012 IonicContact NH2-OE1 3.45Å; R941-E1012 PolarHBondContact NH2-OE1 3.3Å; R941-E1012 IonicContact NH2-OE2 2.66Å; R941-E1012 PolarHBondContact NH2-OE2 3.45Å; R941-E1012 VanDerWaalsContact NH2-OE2 3.15Å
942	A	95.7	Very high	93.2	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-59.8	-44.1	173.8	0	0	0	0	0	111.9	F911 L928 A938 F939 W946 Y961 L967	F911-A942 HydrophobicContact CZ-CB 4.38Å; L928-A942 HydrophobicContact CD1-CB 3.95Å; A938-A942 WeakPolarHBondContact O-CB 3.36Å; A938-A942 PolarHBondContact O-N 2.61Å; F939-A942 PolarHBondContact O-N 3.23Å; A942-W946 PolarHBondContact O-N 2.96Å; A942-Y961 PolarHBondContact O-OH 3.35Å; A942-Y961 VanDerWaalsContact O-OH 3.09Å; A942-L967 HydrophobicContact CB-CD1 4.47Å; A942-L967 HydrophobicContact CB-CD2 4.15Å
943	V	95.7	Very high	92.6	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-74.4	-41.9	179.6	175.7	0	0	0	0	110.9	V901 F939 V940 R941 G945 W946 E947 L972 I975	V901-V943 HydrophobicContact CG1-CB 3.72Å; V901-V943 HydrophobicContact CG1-CG1 4.11Å; V901-V943 HydrophobicContact CG1-CG2 3.7Å; V901-V943 HydrophobicContact CG2-CG1 4.31Å; F939-V943 WeakPolarHBondContact O-CG2 3.38Å; F939-V943 PolarHBondContact O-N 2.71Å; V940-V943 PolarHBondContact O-N 3.36Å; R941-V943 VanDerWaalsContact C-N 3.33Å; R941-V943 PolarHBondContact O-N 3Å; V943-G945 PolarHBondContact O-N 3.16Å; V943-W946 WeakPolarHBondContact O-CB 3.38Å; V943-W946 PolarHBondContact O-N 3.02Å; V943-W946 VanDerWaalsContact O-N 3.15Å; V943-E947 HydrophobicContact CG1-CG 4.26Å; V943-E947 WeakPolarHBondContact O-CG 3.27Å; V943-E947 PolarHBondContact O-N 2.87Å; V943-L972 HydrophobicContact CG2-CD2 4.12Å; V943-I975 HydrophobicContact CG2-CG2 4.4Å
944	A	94.4	Very high	92.4	Very high	47 Å²	47	48.2 Å²	48.2	39%	0.388	22%	0.224	S	C	.	.	H	α-helix	trans	-58.9	-45.1	177.6	0	0	0	0	0	112.3	V940 R941 W946 E947 E948	V940-A944 VanDerWaalsContact O-CB 3.28Å; V940-A944 WeakPolarHBondContact O-CB 3.49Å; V940-A944 PolarHBondContact O-N 2.84Å; R941-A944 PolarHBondContact O-N 3.23Å; A944-W946 VanDerWaalsContact C-N 3.33Å; A944-W946 PolarHBondContact O-N 2.67Å; A944-E947 PolarHBondContact O-N 2.96Å; A944-E948 PolarHBondContact O-N 3.49Å
945	G	94.1	Very high	92	Very high	11 Å²	11	56.5 Å²	56.5	11%	0.113	26%	0.255	C	S	.	.	H	α-helix	trans	-66.8	-34.4	176.4	0	0	0	0	0	112.8	R941 V943 E948 V949 Y961	R941-G945 PolarHBondContact O-N 3.13Å; V943-G945 PolarHBondContact O-N 3.16Å; G945-E948 PolarHBondContact O-N 2.83Å; G945-V949 VanDerWaalsContact O-CG2 3.29Å; G945-V949 WeakPolarHBondContact O-CG2 3.43Å; G945-V949 PolarHBondContact O-N 3.33Å; G945-Y961 VanDerWaalsContact C-CZ 3.45Å; G945-Y961 WeakPolarHBondContact CA-OH 3.45Å
946	W	93.3	Very high	91.8	Very high	16 Å²	16	60.1 Å²	60.1	6%	0.061	28%	0.278	C	S	.	.	H	α-helix	trans	-64.6	-44	172	175	-116.7	0	0	0	112.4	A942 V943 A944 E948 V949 L950 R958 Y961 L962 L972 H976	A942-W946 PolarHBondContact O-N 2.96Å; V943-W946 WeakPolarHBondContact O-CB 3.38Å; V943-W946 PolarHBondContact O-N 3.02Å; V943-W946 VanDerWaalsContact O-N 3.15Å; A944-W946 VanDerWaalsContact C-N 3.33Å; A944-W946 PolarHBondContact O-N 2.67Å; W946-E948 VanDerWaalsContact C-N 3.32Å; W946-E948 PolarHBondContact O-N 2.83Å; W946-V949 PolarHBondContact O-N 3.3Å; W946-L950 HydrophobicContact CD2-CD1 4.39Å; W946-L950 HydrophobicContact CD2-CG 4.25Å; W946-L950 HydrophobicContact CG-CD1 4.44Å; W946-L950 HydrophobicContact CH2-CD2 4.2Å; W946-L950 HydrophobicContact CZ2-CD1 4.22Å; W946-L950 HydrophobicContact CZ2-CD2 3.75Å; W946-L950 HydrophobicContact CZ2-CG 4Å; W946-L950 WeakPolarHBondContact O-CG 3.29Å; W946-L950 PolarHBondContact O-N 2.94Å; W946-R958 HydrophobicContact CH2-CB 4.02Å; W946-R958 HydrophobicContact CH2-CG 4.26Å; W946-R958 HydrophobicContact CZ3-CB 3.8Å; W946-R958 HydrophobicContact CZ3-CG 4.12Å; W946-Y961 HydrophobicContact CB-CD1 4.26Å; W946-Y961 HydrophobicContact CB-CE1 3.88Å; W946-Y961 HydrophobicContact CE3-CD1 4.08Å; W946-Y961 VanDerWaalsContact N-CE1 3.31Å; W946-L962 HydrophobicContact CD2-CD2 4.44Å; W946-L962 HydrophobicContact CE3-CD2 3.94Å; W946-L962 HydrophobicContact CE3-CG 4.17Å; W946-L962 HydrophobicContact CH2-CD1 3.91Å; W946-L962 HydrophobicContact CH2-CD2 4.17Å; W946-L962 HydrophobicContact CH2-CG 4.13Å; W946-L962 HydrophobicContact CZ3-CD1 3.88Å; W946-L962 HydrophobicContact CZ3-CD2 3.79Å; W946-L962 HydrophobicContact CZ3-CG 3.63Å; W946-L972 HydrophobicContact CB-CD1 4.28Å; W946-L972 HydrophobicContact CD2-CD1 3.82Å; W946-L972 HydrophobicContact CE3-CD1 4.48Å; W946-L972 HydrophobicContact CG-CD1 3.7Å; W946-L972 HydrophobicContact CG-CD2 4.46Å; W946-H976 AromaticContact CD1-CE1 3.85Å; W946-H976 AromaticContact CD1-NE2 3.87Å; W946-H976 AromaticContact NE1-CE1 3.99Å
947	E	91.7	Very high	91.4	Very high	50 Å²	50	62.4 Å²	62.4	23%	0.234	29%	0.294	C	S	.	.	H	α-helix	trans	-62.2	-38.3	176	-73.4	179	167.4	0	0	112.2	H897 V943 A944 L950 R951 H976	H897-E947 IonicContact CE1-OE2 3.8Å; V943-E947 HydrophobicContact CG1-CG 4.26Å; V943-E947 WeakPolarHBondContact O-CG 3.27Å; V943-E947 PolarHBondContact O-N 2.87Å; A944-E947 PolarHBondContact O-N 2.96Å; E947-L950 PolarHBondContact O-N 3.29Å; E947-R951 WeakPolarHBondContact O-CG 3.45Å; E947-R951 PolarHBondContact O-N 3.14Å; E947-H976 IonicContact OE1-NE2 3.45Å
948	E	91.2	Very high	91	Very high	115 Å²	115	65.2 Å²	65.2	54%	0.537	30%	0.304	S	S	.	.	H	α-helix	trans	-61.6	-53.6	174.4	-174.9	174.8	-173.1	0	0	110.7	A944 G945 W946 L950 R951	A944-E948 PolarHBondContact O-N 3.49Å; G945-E948 PolarHBondContact O-N 2.83Å; W946-E948 VanDerWaalsContact C-N 3.32Å; W946-E948 PolarHBondContact O-N 2.83Å; E948-L950 PolarHBondContact O-N 3.48Å; E948-R951 WeakPolarHBondContact O-CB 3.33Å; E948-R951 PolarHBondContact O-N 3.43Å
949	V	91.5	Very high	90.7	Very high	21 Å²	21	69 Å²	69	13%	0.127	32%	0.322	C	S	.	.	H	α-helix	trans	-63	-27.4	-180	179.1	0	0	0	0	112.4	G945 W946 R951 S957 R958 Y961	G945-V949 VanDerWaalsContact O-CG2 3.29Å; G945-V949 WeakPolarHBondContact O-CG2 3.43Å; G945-V949 PolarHBondContact O-N 3.33Å; W946-V949 PolarHBondContact O-N 3.3Å; V949-R951 VanDerWaalsContact C-N 3.34Å; V949-R951 PolarHBondContact O-N 3.48Å; V949-S957 WeakPolarHBondContact CG1-O 3.28Å; V949-R958 VanDerWaalsContact CG1-CA 3.46Å; V949-R958 HydrophobicContact CG1-CB 4.14Å; V949-R958 HydrophobicContact CG1-CG 3.63Å; V949-R958 VanDerWaalsContact CG1-N 3.35Å; V949-Y961 HydrophobicContact CG2-CD2 4.06Å; V949-Y961 HydrophobicContact CG2-CG 4.12Å
950	L	88	Confident	90.5	Very high	54 Å²	54	72.2 Å²	72.2	28%	0.283	34%	0.339	S	S	.	.	H	α-helix	trans	-64.7	-34.3	171.3	-80.5	174.1	0	0	0	113.1	W946 E947 E948 R958	W946-L950 HydrophobicContact CD2-CD1 4.39Å; W946-L950 HydrophobicContact CD2-CG 4.25Å; W946-L950 HydrophobicContact CG-CD1 4.44Å; W946-L950 HydrophobicContact CH2-CD2 4.2Å; W946-L950 HydrophobicContact CZ2-CD1 4.22Å; W946-L950 HydrophobicContact CZ2-CD2 3.75Å; W946-L950 HydrophobicContact CZ2-CG 4Å; W946-L950 WeakPolarHBondContact O-CG 3.29Å; W946-L950 PolarHBondContact O-N 2.94Å; E947-L950 PolarHBondContact O-N 3.29Å; E948-L950 PolarHBondContact O-N 3.48Å; L950-R958 PolarHBondContact O-NH2 3.01Å
951	R	87.1	Confident	90.3	Very high	193 Å²	193	72.7 Å²	72.7	73%	0.728	34%	0.339	S	S	*	.	H	α-helix	trans	-68	-34.9	-179.2	-66.9	176.5	-172.5	-140.6	3.2	113.1	E947 E948 V949 Q953	E947-R951 WeakPolarHBondContact O-CG 3.45Å; E947-R951 PolarHBondContact O-N 3.14Å; E948-R951 WeakPolarHBondContact O-CB 3.33Å; E948-R951 PolarHBondContact O-N 3.43Å; V949-R951 VanDerWaalsContact C-N 3.34Å; V949-R951 PolarHBondContact O-N 3.48Å; R951-Q953 PolarHBondContact O-N 3.26Å
952	W	83.2	Confident	90.1	Very high	184 Å²	184	71.8 Å²	71.8	70%	0.697	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	-11.2	-177.4	-63.9	96.3	0	0	0	114.3	D954	W952-D954 PolarHBondContact O-N 3.26Å
953	Q	75.9	Confident	89.8	Confident	162 Å²	162	78.5 Å²	78.5	76%	0.757	37%	0.369	S	S	*	.			trans	58.2	1.8	-179.4	-63.2	-172.1	-5.9	0	0	117	R951	R951-Q953 PolarHBondContact O-N 3.26Å
954	D	86.9	Confident	89.6	Confident	63 Å²	63	85.1 Å²	85.1	34%	0.337	40%	0.4	S	S	.	.			trans	-77.3	128.2	172.5	176.2	36.4	0	0	0	111.7	W952 T956 S957 R958	W952-D954 PolarHBondContact O-N 3.26Å; D954-T956 PolarHBondContact OD1-N 3.29Å; D954-T956 VanDerWaalsContact OD1-N 3.14Å; D954-T956 PolarHBondContact OD1-OG1 2.87Å; D954-S957 VanDerWaalsContact OD2-CB 3.27Å; D954-S957 WeakPolarHBondContact OD2-CB 3.35Å; D954-S957 PolarHBondContact OD2-N 3.26Å; D954-S957 PolarHBondContact OD2-OG 3.41Å; D954-R958 VanDerWaalsContact O-CD 3.28Å; D954-R958 WeakPolarHBondContact O-CD 3.27Å; D954-R958 VanDerWaalsContact O-CG 3.24Å; D954-R958 WeakPolarHBondContact O-CG 3.42Å
955	R	87.3	Confident	89.5	Confident	175 Å²	175	83.7 Å²	83.7	66%	0.66	39%	0.386	S	S	*	.	H	α-helix	trans	-71.6	-37.7	178.6	-176	176.6	174.7	-179.6	-3.4	111.9	R958 E959	R955-R958 WeakPolarHBondContact O-CB 3.27Å; R955-R958 PolarHBondContact O-N 3.14Å; R955-E959 IonicContact CZ-OE1 3.7Å; R955-E959 IonicContact NE-OE1 2.83Å; R955-E959 PolarHBondContact NE-OE1 3.35Å; R955-E959 IonicContact NH2-OE1 3.9Å; R955-E959 PolarHBondContact NH2-OE1 3.25Å; R955-E959 VanDerWaalsContact NH2-OE1 3.14Å; R955-E959 PolarHBondContact O-N 2.63Å
956	T	90	Very high	89.4	Confident	81 Å²	81	85 Å²	85	50%	0.497	39%	0.389	S	S	.	.	H	α-helix	trans	-66.6	-46.8	-174.9	-39.4	0	0	0	0	110.4	D954 R958 E959 N960	D954-T956 PolarHBondContact OD1-N 3.29Å; D954-T956 VanDerWaalsContact OD1-N 3.14Å; D954-T956 PolarHBondContact OD1-OG1 2.87Å; T956-R958 VanDerWaalsContact C-N 3.27Å; T956-R958 PolarHBondContact O-N 2.55Å; T956-E959 PolarHBondContact O-N 2.93Å; T956-N960 WeakPolarHBondContact O-CB 3.44Å; T956-N960 PolarHBondContact O-N 3.47Å; T956-N960 PolarHBondContact O-OD1 3.32Å
957	S	89.3	Confident	89.3	Confident	50 Å²	50	84.7 Å²	84.7	35%	0.35	39%	0.389	S	S	.	.	H	α-helix	trans	-58.4	-39.1	176	-60.2	0	0	0	0	112.1	V949 D954 Y961	V949-S957 WeakPolarHBondContact CG1-O 3.28Å; D954-S957 VanDerWaalsContact OD2-CB 3.27Å; D954-S957 WeakPolarHBondContact OD2-CB 3.35Å; D954-S957 PolarHBondContact OD2-N 3.26Å; D954-S957 PolarHBondContact OD2-OG 3.41Å; S957-Y961 WeakPolarHBondContact O-CB 3.22Å; S957-Y961 PolarHBondContact O-N 3.16Å
958	R	89.3	Confident	89	Confident	69 Å²	69	85.9 Å²	85.9	26%	0.26	39%	0.392	S	S	.	.	H	α-helix	trans	-64.1	-47.7	176.4	-69.1	165	-178.2	175.2	-11.3	111.8	W946 V949 L950 D954 R955 T956 Y961 L962	W946-R958 HydrophobicContact CH2-CB 4.02Å; W946-R958 HydrophobicContact CH2-CG 4.26Å; W946-R958 HydrophobicContact CZ3-CB 3.8Å; W946-R958 HydrophobicContact CZ3-CG 4.12Å; V949-R958 VanDerWaalsContact CG1-CA 3.46Å; V949-R958 HydrophobicContact CG1-CB 4.14Å; V949-R958 HydrophobicContact CG1-CG 3.63Å; V949-R958 VanDerWaalsContact CG1-N 3.35Å; L950-R958 PolarHBondContact O-NH2 3.01Å; D954-R958 VanDerWaalsContact O-CD 3.28Å; D954-R958 WeakPolarHBondContact O-CD 3.27Å; D954-R958 VanDerWaalsContact O-CG 3.24Å; D954-R958 WeakPolarHBondContact O-CG 3.42Å; R955-R958 WeakPolarHBondContact O-CB 3.27Å; R955-R958 PolarHBondContact O-N 3.14Å; T956-R958 VanDerWaalsContact C-N 3.27Å; T956-R958 PolarHBondContact O-N 2.55Å; R958-Y961 PolarHBondContact O-N 3.49Å; R958-L962 VanDerWaalsContact O-CG 3.25Å; R958-L962 WeakPolarHBondContact O-CG 3.33Å; R958-L962 PolarHBondContact O-N 2.98Å
959	E	89.2	Confident	88.8	Confident	80 Å²	80	81.3 Å²	81.3	37%	0.374	37%	0.374	S	S	.	.	H	α-helix	trans	-63.7	-45.6	178.6	-71.8	173.4	178.8	0	0	110.5	R955 T956 Y961 L962 E963	R955-E959 IonicContact CZ-OE1 3.7Å; R955-E959 IonicContact NE-OE1 2.83Å; R955-E959 PolarHBondContact NE-OE1 3.35Å; R955-E959 IonicContact NH2-OE1 3.9Å; R955-E959 PolarHBondContact NH2-OE1 3.25Å; R955-E959 VanDerWaalsContact NH2-OE1 3.14Å; R955-E959 PolarHBondContact O-N 2.63Å; T956-E959 PolarHBondContact O-N 2.93Å; E959-Y961 PolarHBondContact O-N 2.96Å; E959-L962 PolarHBondContact O-N 3.03Å; E959-E963 WeakPolarHBondContact O-CG 3.45Å; E959-E963 PolarHBondContact O-N 3.27Å
960	N	92.8	Very high	88.3	Confident	75 Å²	75	81.6 Å²	81.6	40%	0.401	38%	0.376	S	S	.	.	H	α-helix	trans	-58.5	-47	176.2	-67.9	-10.5	0	0	0	112.3	T956 L962 E963 E964	T956-N960 WeakPolarHBondContact O-CB 3.44Å; T956-N960 PolarHBondContact O-N 3.47Å; T956-N960 PolarHBondContact O-OD1 3.32Å; N960-L962 VanDerWaalsContact C-N 3.3Å; N960-L962 PolarHBondContact O-N 3.14Å; N960-E963 PolarHBondContact O-N 3.31Å; N960-E964 WeakPolarHBondContact O-CB 3.44Å; N960-E964 VanDerWaalsContact O-CG 3.29Å; N960-E964 WeakPolarHBondContact O-CG 3.29Å; N960-E964 PolarHBondContact O-N 3.23Å
961	Y	94	Very high	88.3	Confident	33 Å²	33	79.2 Å²	79.2	13%	0.129	36%	0.364	C	S	.	.	H	α-helix	trans	-62.5	-38	-179.5	-173.4	-92.4	0	0	0	112.5	R941 A942 G945 W946 V949 S957 R958 E959 N965 L967	R941-Y961 PolarHBondContact O-OH 3.37Å; A942-Y961 PolarHBondContact O-OH 3.35Å; A942-Y961 VanDerWaalsContact O-OH 3.09Å; G945-Y961 VanDerWaalsContact C-CZ 3.45Å; G945-Y961 WeakPolarHBondContact CA-OH 3.45Å; W946-Y961 HydrophobicContact CB-CD1 4.26Å; W946-Y961 HydrophobicContact CB-CE1 3.88Å; W946-Y961 HydrophobicContact CE3-CD1 4.08Å; W946-Y961 VanDerWaalsContact N-CE1 3.31Å; V949-Y961 HydrophobicContact CG2-CD2 4.06Å; V949-Y961 HydrophobicContact CG2-CG 4.12Å; S957-Y961 WeakPolarHBondContact O-CB 3.22Å; S957-Y961 PolarHBondContact O-N 3.16Å; R958-Y961 PolarHBondContact O-N 3.49Å; E959-Y961 PolarHBondContact O-N 2.96Å; Y961-N965 WeakPolarHBondContact CD2-ND2 3.22Å; Y961-N965 VanDerWaalsContact CE2-ND2 3.27Å; Y961-N965 WeakPolarHBondContact CE2-ND2 3.47Å; Y961-N965 WeakPolarHBondContact O-CB 3.44Å; Y961-N965 PolarHBondContact O-N 3.44Å; Y961-N965 VanDerWaalsContact O-N 3.16Å; Y961-N965 PolarHBondContact O-ND2 2.84Å; Y961-L967 HydrophobicContact CD1-CD1 3.95Å; Y961-L967 HydrophobicContact CE1-CD1 3.44Å; Y961-L967 VanDerWaalsContact CE1-CD1 3.44Å
962	L	91.8	Very high	88.5	Confident	28 Å²	28	70 Å²	70	15%	0.147	33%	0.329	C	S	.	.	H	α-helix	trans	-65.6	-43.5	175.9	-67.8	168.1	0	0	0	111.5	W946 R958 E959 N960 L966 L967 A969 L972	W946-L962 HydrophobicContact CD2-CD2 4.44Å; W946-L962 HydrophobicContact CE3-CD2 3.94Å; W946-L962 HydrophobicContact CE3-CG 4.17Å; W946-L962 HydrophobicContact CH2-CD1 3.91Å; W946-L962 HydrophobicContact CH2-CD2 4.17Å; W946-L962 HydrophobicContact CH2-CG 4.13Å; W946-L962 HydrophobicContact CZ3-CD1 3.88Å; W946-L962 HydrophobicContact CZ3-CD2 3.79Å; W946-L962 HydrophobicContact CZ3-CG 3.63Å; R958-L962 VanDerWaalsContact O-CG 3.25Å; R958-L962 WeakPolarHBondContact O-CG 3.33Å; R958-L962 PolarHBondContact O-N 2.98Å; E959-L962 PolarHBondContact O-N 3.03Å; N960-L962 VanDerWaalsContact C-N 3.3Å; N960-L962 PolarHBondContact O-N 3.14Å; L962-L966 CarbonylContact O-C 3.43Å; L962-L966 WeakPolarHBondContact O-CA 3.3Å; L962-L966 PolarHBondContact O-N 2.94Å; L962-L967 HydrophobicContact CD2-CB 3.81Å; L962-L967 PolarHBondContact O-N 3.46Å; L962-A969 HydrophobicContact CD1-CB 3.78Å; L962-A969 HydrophobicContact CD2-CB 4.13Å; L962-L972 HydrophobicContact CD2-CD1 3.61Å
963	E	89.8	Confident	88.8	Confident	141 Å²	141	68.6 Å²	68.6	66%	0.659	32%	0.324	S	S	*	.	H	α-helix	trans	-67.8	-48.3	179.1	-72	-177.6	-177	0	0	111.9	E959 N960 N965 L966	E959-E963 WeakPolarHBondContact O-CG 3.45Å; E959-E963 PolarHBondContact O-N 3.27Å; N960-E963 PolarHBondContact O-N 3.31Å; E963-N965 VanDerWaalsContact C-N 3.33Å; E963-N965 PolarHBondContact O-N 2.79Å; E963-L966 PolarHBondContact O-N 3.27Å
964	E	91.7	Very high	89.4	Confident	140 Å²	140	63.8 Å²	63.8	65%	0.654	30%	0.3	S	S	*	.	H	α-helix	trans	-60.8	-40.2	-179.2	-74.5	177.4	178.6	0	0	112.6	N960	N960-E964 WeakPolarHBondContact O-CB 3.44Å; N960-E964 VanDerWaalsContact O-CG 3.29Å; N960-E964 WeakPolarHBondContact O-CG 3.29Å; N960-E964 PolarHBondContact O-N 3.23Å
965	N	92.1	Very high	89.6	Confident	17 Å²	17	60.8 Å²	60.8	9%	0.091	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98	8.2	-178	-63.2	-76.8	0	0	0	113.3	F911 V924 Y961 E963 L967	F911-N965 WeakPolarHBondContact CD1-O 3.1Å; V924-N965 HydrophobicContact CG1-CB 4.2Å; Y961-N965 WeakPolarHBondContact CD2-ND2 3.22Å; Y961-N965 VanDerWaalsContact CE2-ND2 3.27Å; Y961-N965 WeakPolarHBondContact CE2-ND2 3.47Å; Y961-N965 WeakPolarHBondContact O-CB 3.44Å; Y961-N965 PolarHBondContact O-N 3.44Å; Y961-N965 VanDerWaalsContact O-N 3.16Å; Y961-N965 PolarHBondContact O-ND2 2.84Å; E963-N965 VanDerWaalsContact C-N 3.33Å; E963-N965 PolarHBondContact O-N 2.79Å; N965-L967 HydrophobicContact CB-CD1 3.78Å; N965-L967 HydrophobicContact CB-CD2 4.48Å; N965-L967 HydrophobicContact CB-CG 3.71Å; N965-L967 PolarHBondContact O-N 3.06Å
966	L	90.4	Very high	89.9	Confident	37 Å²	37	55.1 Å²	55.1	19%	0.194	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	49.7	43.2	-178.2	-57.4	175.8	0	0	0	112.3	F911 S912 E920 V921 V924 L962 E963	F911-L966 CarbonylContact C-O 3.58Å; F911-L966 WeakPolarHBondContact CA-O 3.42Å; S912-L966 PolarHBondContact N-O 2.79Å; S912-L966 PolarHBondContact OG-O 2.96Å; E920-L966 HydrophobicContact CB-CD1 3.71Å; V921-L966 HydrophobicContact CG2-CB 4.28Å; V921-L966 HydrophobicContact CG2-CD1 3.92Å; V924-L966 HydrophobicContact CG2-CD1 4.04Å; V924-L966 HydrophobicContact CG2-CG 4.26Å; L962-L966 CarbonylContact O-C 3.43Å; L962-L966 WeakPolarHBondContact O-CA 3.3Å; L962-L966 PolarHBondContact O-N 2.94Å; E963-L966 PolarHBondContact O-N 3.27Å
967	L	91.1	Very high	90.1	Very high	11 Å²	11	52.2 Å²	52.2	6%	0.058	25%	0.252	C	S	.	.	B	Isolated β-bridge	trans	-94.8	150	-177.2	-61.1	174.2	0	0	0	111.6	P910 F911 A942 Y961 L962 N965 L972	P910-L967 HydrophobicContact CB-CD2 4.23Å; F911-L967 HydrophobicContact CD1-CD2 3.62Å; F911-L967 HydrophobicContact CE1-CD2 3.69Å; F911-L967 HydrophobicContact CG-CD2 4.25Å; F911-L967 HydrophobicContact CZ-CD2 4.37Å; A942-L967 HydrophobicContact CB-CD1 4.47Å; A942-L967 HydrophobicContact CB-CD2 4.15Å; Y961-L967 HydrophobicContact CD1-CD1 3.95Å; Y961-L967 HydrophobicContact CE1-CD1 3.44Å; Y961-L967 VanDerWaalsContact CE1-CD1 3.44Å; L962-L967 HydrophobicContact CD2-CB 3.81Å; L962-L967 PolarHBondContact O-N 3.46Å; N965-L967 HydrophobicContact CB-CD1 3.78Å; N965-L967 HydrophobicContact CB-CD2 4.48Å; N965-L967 HydrophobicContact CB-CG 3.71Å; N965-L967 PolarHBondContact O-N 3.06Å; L967-L972 HydrophobicContact CB-CD1 3.97Å; L967-L972 HydrophobicContact CD1-CD1 4.24Å
968	Y	86.3	Confident	90.3	Very high	75 Å²	75	49.9 Å²	49.9	29%	0.294	24%	0.235	S	C	.	.			trans	-107.2	106	179.3	-170.6	-127.7	0	0	0	111.2	P709 D712 P910 P970 S971 L972	P709-Y968 WeakPolarHBondContact CD-OH 3.48Å; P709-Y968 HydrophobicContact CG-CE1 3.54Å; P709-Y968 WeakPolarHBondContact CG-OH 3.5Å; D712-Y968 PolarHBondContact OD2-OH 3.23Å; P910-Y968 PolarHBondContact O-N 3.49Å; Y968-P970 VanDerWaalsContact C-CD 3.49Å; Y968-P970 HydrophobicContact CD1-CB 4.15Å; Y968-P970 HydrophobicContact CD1-CG 4.23Å; Y968-P970 HydrophobicContact CD2-CG 4.34Å; Y968-P970 HydrophobicContact CE1-CB 3.7Å; Y968-P970 HydrophobicContact CE1-CG 3.72Å; Y968-P970 HydrophobicContact CE2-CG 3.83Å; Y968-P970 VanDerWaalsContact CZ-CG 3.5Å; Y968-S971 WeakPolarHBondContact CD1-OG 3.32Å; Y968-S971 WeakPolarHBondContact O-CA 3.25Å; Y968-S971 WeakPolarHBondContact O-CB 3.2Å; Y968-S971 PolarHBondContact O-N 3.37Å; Y968-L972 PolarHBondContact O-N 3.28Å; Y968-L972 VanDerWaalsContact O-N 3.08Å
969	A	86.4	Confident	90.6	Very high	18 Å²	18	46.9 Å²	46.9	15%	0.149	22%	0.224	C	C	.	.	H	α-helix	trans	-52.7	-40	-175	0	0	0	0	0	115.1	L962 S971 L972 R973	L962-A969 HydrophobicContact CD1-CB 3.78Å; L962-A969 HydrophobicContact CD2-CB 4.13Å; A969-S971 PolarHBondContact O-N 3.31Å; A969-L972 PolarHBondContact O-N 2.94Å; A969-R973 WeakPolarHBondContact O-CG 3.28Å; A969-R973 PolarHBondContact O-N 3.26Å
970	P	82.5	Confident	90.9	Very high	27 Å²	27	49.6 Å²	49.6	18%	0.175	24%	0.235	C	C	.	.	H	α-helix	trans	-62.5	-37.1	172.9	-23.6	35	0	0	0	114.1	P709 Y968 F974	P709-P970 HydrophobicContact CB-CB 4.08Å; P709-P970 HydrophobicContact CG-CB 3.43Å; P709-P970 VanDerWaalsContact CG-CB 3.43Å; P709-P970 HydrophobicContact CG-CG 4Å; Y968-P970 VanDerWaalsContact C-CD 3.49Å; Y968-P970 HydrophobicContact CD1-CB 4.15Å; Y968-P970 HydrophobicContact CD1-CG 4.23Å; Y968-P970 HydrophobicContact CD2-CG 4.34Å; Y968-P970 HydrophobicContact CE1-CB 3.7Å; Y968-P970 HydrophobicContact CE1-CG 3.72Å; Y968-P970 HydrophobicContact CE2-CG 3.83Å; Y968-P970 VanDerWaalsContact CZ-CG 3.5Å; P970-F974 PolarHBondContact O-N 2.88Å; P970-F974 VanDerWaalsContact O-N 3.15Å
971	S	86.9	Confident	90.9	Very high	4 Å²	4	46.7 Å²	46.7	3%	0.028	22%	0.219	C	C	.	.	H	α-helix	trans	-63.5	-45.6	173	-77.8	0	0	0	0	110.9	R908 D909 Y968 A969 R973 F974 I975	R908-S971 PolarHBondContact NE-OG 2.74Å; R908-S971 PolarHBondContact NH2-OG 2.89Å; D909-S971 VanDerWaalsContact O-CB 3.27Å; D909-S971 WeakPolarHBondContact O-CB 3.35Å; D909-S971 PolarHBondContact O-OG 3.31Å; Y968-S971 WeakPolarHBondContact CD1-OG 3.32Å; Y968-S971 WeakPolarHBondContact O-CA 3.25Å; Y968-S971 WeakPolarHBondContact O-CB 3.2Å; Y968-S971 PolarHBondContact O-N 3.37Å; A969-S971 PolarHBondContact O-N 3.31Å; S971-R973 VanDerWaalsContact C-N 3.35Å; S971-R973 PolarHBondContact O-N 3.41Å; S971-F974 WeakPolarHBondContact O-CA 3.45Å; S971-F974 WeakPolarHBondContact O-CB 3.47Å; S971-F974 PolarHBondContact O-N 2.84Å; S971-I975 WeakPolarHBondContact O-CG1 3.33Å; S971-I975 PolarHBondContact O-N 2.79Å
972	L	91.7	Very high	91	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-60.5	-41.1	178.2	-70.3	166.8	0	0	0	112.6	P910 V943 W946 L962 L967 Y968 A969 F974 I975 H976	P910-L972 HydrophobicContact CB-CD2 3.96Å; V943-L972 HydrophobicContact CG2-CD2 4.12Å; W946-L972 HydrophobicContact CB-CD1 4.28Å; W946-L972 HydrophobicContact CD2-CD1 3.82Å; W946-L972 HydrophobicContact CE3-CD1 4.48Å; W946-L972 HydrophobicContact CG-CD1 3.7Å; W946-L972 HydrophobicContact CG-CD2 4.46Å; L962-L972 HydrophobicContact CD2-CD1 3.61Å; L967-L972 HydrophobicContact CB-CD1 3.97Å; L967-L972 HydrophobicContact CD1-CD1 4.24Å; Y968-L972 PolarHBondContact O-N 3.28Å; Y968-L972 VanDerWaalsContact O-N 3.08Å; A969-L972 PolarHBondContact O-N 2.94Å; L972-F974 VanDerWaalsContact C-N 3.3Å; L972-F974 PolarHBondContact O-N 3.47Å; L972-I975 HydrophobicContact CD2-CD1 4.4Å; L972-I975 PolarHBondContact O-N 2.97Å; L972-H976 PolarHBondContact O-N 2.9Å
973	R	89.5	Confident	91.2	Very high	154 Å²	154	44 Å²	44	58%	0.581	21%	0.207	S	C	*	.	H	α-helix	trans	-61.5	-38.6	173.1	-72.3	-170.2	-64.2	-89.9	7.4	112.5	A969 S971 G977	A969-R973 WeakPolarHBondContact O-CG 3.28Å; A969-R973 PolarHBondContact O-N 3.26Å; S971-R973 VanDerWaalsContact C-N 3.35Å; S971-R973 PolarHBondContact O-N 3.41Å; R973-G977 PolarHBondContact O-N 3.3Å; R973-G977 VanDerWaalsContact O-N 3.13Å
974	F	87.5	Confident	91.5	Very high	62 Å²	62	41.3 Å²	41.3	27%	0.272	20%	0.195	S	C	.	.	H	α-helix	trans	-68.1	-41.8	176	-173.4	-96.9	0	0	0	111.7	L521 R908 P970 S971 L972 G977 L978	L521-F974 HydrophobicContact CD1-CD2 3.96Å; L521-F974 HydrophobicContact CD1-CE2 3.75Å; L521-F974 HydrophobicContact CD1-CZ 4.28Å; R908-F974 HydrophobicContact CB-CD1 3.74Å; R908-F974 HydrophobicContact CB-CE1 4.09Å; R908-F974 HydrophobicContact CG-CD1 3.77Å; R908-F974 HydrophobicContact CG-CE1 4.44Å; P970-F974 PolarHBondContact O-N 2.88Å; P970-F974 VanDerWaalsContact O-N 3.15Å; S971-F974 WeakPolarHBondContact O-CA 3.45Å; S971-F974 WeakPolarHBondContact O-CB 3.47Å; S971-F974 PolarHBondContact O-N 2.84Å; L972-F974 VanDerWaalsContact C-N 3.3Å; L972-F974 PolarHBondContact O-N 3.47Å; F974-G977 CarbonylContact O-C 3.54Å; F974-G977 WeakPolarHBondContact O-CA 3.48Å; F974-G977 PolarHBondContact O-N 3.02Å; F974-G977 VanDerWaalsContact O-N 3.09Å; F974-L978 HydrophobicContact CD1-CD1 3.92Å; F974-L978 HydrophobicContact CD1-CG 4.07Å; F974-L978 HydrophobicContact CE1-CD1 3.64Å; F974-L978 HydrophobicContact CE1-CD2 4.08Å; F974-L978 HydrophobicContact CE1-CG 3.82Å; F974-L978 HydrophobicContact CZ-CD2 4.27Å; F974-L978 HydrophobicContact CZ-CG 4.42Å; F974-L978 PolarHBondContact O-N 3.49Å
975	I	93	Very high	91.6	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-58	-48	174.5	-71.5	162	0	0	0	110.6	R908 P910 V943 S971 L972 G977 L978 I979	R908-I975 HydrophobicContact CB-CG1 4.25Å; R908-I975 HydrophobicContact CG-CG1 4.42Å; R908-I975 WeakPolarHBondContact O-CD1 3.44Å; P910-I975 HydrophobicContact CB-CD1 3.64Å; P910-I975 HydrophobicContact CG-CD1 4.4Å; V943-I975 HydrophobicContact CG2-CG2 4.4Å; S971-I975 WeakPolarHBondContact O-CG1 3.33Å; S971-I975 PolarHBondContact O-N 2.79Å; L972-I975 HydrophobicContact CD2-CD1 4.4Å; L972-I975 PolarHBondContact O-N 2.97Å; I975-G977 VanDerWaalsContact C-N 3.25Å; I975-G977 PolarHBondContact O-N 2.92Å; I975-L978 WeakPolarHBondContact O-CB 3.41Å; I975-L978 PolarHBondContact O-N 3.32Å; I975-I979 HydrophobicContact CG2-CD1 4.06Å; I975-I979 WeakPolarHBondContact O-CG1 3.44Å; I975-I979 PolarHBondContact O-N 3.19Å
976	H	93.7	Very high	91.7	Very high	55 Å²	55	34 Å²	34	26%	0.255	16%	0.16	S	C	.	.	H	α-helix	trans	-59.3	-37.9	174.4	-72.8	-172.3	0	0	0	112.3	W946 E947 L972 I979 K980	W946-H976 AromaticContact CD1-CE1 3.85Å; W946-H976 AromaticContact CD1-NE2 3.87Å; W946-H976 AromaticContact NE1-CE1 3.99Å; E947-H976 IonicContact OE1-NE2 3.45Å; L972-H976 PolarHBondContact O-N 2.9Å; H976-I979 PolarHBondContact O-N 3.33Å; H976-K980 PolarHBondContact O-N 3.25Å
977	G	92.6	Very high	91.9	Very high	21 Å²	21	37.4 Å²	37.4	22%	0.216	17%	0.171	C	C	.	.	H	α-helix	trans	-61.6	-42.5	172.9	0	0	0	0	0	112.7	L521 R973 F974 I975 K980 Q981	L521-G977 WeakPolarHBondContact CD2-O 3.39Å; R973-G977 PolarHBondContact O-N 3.3Å; R973-G977 VanDerWaalsContact O-N 3.13Å; F974-G977 CarbonylContact O-C 3.54Å; F974-G977 WeakPolarHBondContact O-CA 3.48Å; F974-G977 PolarHBondContact O-N 3.02Å; F974-G977 VanDerWaalsContact O-N 3.09Å; I975-G977 VanDerWaalsContact C-N 3.25Å; I975-G977 PolarHBondContact O-N 2.92Å; G977-K980 PolarHBondContact O-N 3.02Å; G977-Q981 PolarHBondContact O-N 3.22Å
978	L	93.4	Very high	91.9	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-64.3	-44.7	175.3	-71	-179.8	0	0	0	112.1	L521 T907 F974 I975 K980 Q981 F982	L521-L978 HydrophobicContact CD1-CD2 4.28Å; T907-L978 HydrophobicContact CG2-CD1 3.78Å; F974-L978 HydrophobicContact CD1-CD1 3.92Å; F974-L978 HydrophobicContact CD1-CG 4.07Å; F974-L978 HydrophobicContact CE1-CD1 3.64Å; F974-L978 HydrophobicContact CE1-CD2 4.08Å; F974-L978 HydrophobicContact CE1-CG 3.82Å; F974-L978 HydrophobicContact CZ-CD2 4.27Å; F974-L978 HydrophobicContact CZ-CG 4.42Å; F974-L978 PolarHBondContact O-N 3.49Å; I975-L978 WeakPolarHBondContact O-CB 3.41Å; I975-L978 PolarHBondContact O-N 3.32Å; L978-K980 VanDerWaalsContact C-N 3.31Å; L978-K980 PolarHBondContact O-N 3.1Å; L978-Q981 PolarHBondContact O-N 3.02Å; L978-Q981 VanDerWaalsContact O-N 3.15Å; L978-F982 HydrophobicContact CB-CD2 4.27Å; L978-F982 HydrophobicContact CB-CE2 3.92Å; L978-F982 WeakPolarHBondContact O-CD2 3.38Å; L978-F982 WeakPolarHBondContact O-CG 3.21Å; L978-F982 PolarHBondContact O-N 2.92Å
979	I	96.3	Very high	92.2	Very high	7 Å²	7	38 Å²	38	4%	0.036	18%	0.176	C	C	.	.	H	α-helix	trans	-55.2	-50.2	176.1	-67.3	168.3	0	0	0	109.4	V901 S904 I975 H976 Q981 F982 S983 T999	V901-I979 HydrophobicContact CG2-CD1 3.89Å; S904-I979 WeakPolarHBondContact OG-CG1 3.39Å; I975-I979 HydrophobicContact CG2-CD1 4.06Å; I975-I979 WeakPolarHBondContact O-CG1 3.44Å; I975-I979 PolarHBondContact O-N 3.19Å; H976-I979 PolarHBondContact O-N 3.33Å; I979-Q981 PolarHBondContact O-N 2.81Å; I979-F982 PolarHBondContact O-N 2.83Å; I979-S983 PolarHBondContact O-N 3.46Å; I979-S983 PolarHBondContact O-OG 3.1Å; I979-T999 HydrophobicContact CG2-CG2 3.63Å
980	K	95.1	Very high	92.6	Very high	136 Å²	136	40.8 Å²	40.8	59%	0.591	19%	0.185	S	C	*	.	H	α-helix	trans	-57.5	-46.5	176.7	-175.1	-176.8	175.8	-174	0	112.6	H976 G977 L978 F982 S983 E984	H976-K980 PolarHBondContact O-N 3.25Å; G977-K980 PolarHBondContact O-N 3.02Å; L978-K980 VanDerWaalsContact C-N 3.31Å; L978-K980 PolarHBondContact O-N 3.1Å; K980-F982 PolarHBondContact O-N 3.18Å; K980-S983 WeakPolarHBondContact O-CB 3.48Å; K980-S983 PolarHBondContact O-N 3.18Å; K980-E984 WeakPolarHBondContact CE-OE1 3.48Å; K980-E984 PolarHBondContact O-N 2.95Å; K980-E984 VanDerWaalsContact O-N 3.09Å
981	Q	93.2	Very high	93.2	Very high	15 Å²	15	39.6 Å²	39.6	7%	0.07	18%	0.177	C	C	.	.	H	α-helix	trans	-63	-41.5	178.7	-174.9	-166.6	-18.9	0	0	111.7	L521 S878 G977 L978 I979 S983 E984 N985	L521-Q981 HydrophobicContact CD2-CB 3.76Å; L521-Q981 HydrophobicContact CD2-CG 4.35Å; S878-Q981 PolarHBondContact OG-NE2 3.43Å; G977-Q981 PolarHBondContact O-N 3.22Å; L978-Q981 PolarHBondContact O-N 3.02Å; L978-Q981 VanDerWaalsContact O-N 3.15Å; I979-Q981 PolarHBondContact O-N 2.81Å; Q981-S983 VanDerWaalsContact C-N 3.35Å; Q981-E984 PolarHBondContact O-N 3.42Å; Q981-N985 VanDerWaalsContact O-CG 3.22Å; Q981-N985 PolarHBondContact O-N 3.06Å; Q981-N985 PolarHBondContact O-OD1 3.27Å
982	F	95.9	Very high	93.6	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-67.3	-37.9	176.9	-65.4	-44	0	0	0	111.3	I877 L900 V903 L978 I979 K980 E984 N985 I986	I877-F982 HydrophobicContact CG2-CD1 4.28Å; L900-F982 HydrophobicContact CD2-CB 3.46Å; L900-F982 VanDerWaalsContact CD2-CB 3.46Å; L900-F982 HydrophobicContact CD2-CD2 4.37Å; L900-F982 HydrophobicContact CD2-CG 4.29Å; V903-F982 HydrophobicContact CG1-CE2 3.86Å; V903-F982 HydrophobicContact CG1-CZ 4.03Å; L978-F982 HydrophobicContact CB-CD2 4.27Å; L978-F982 HydrophobicContact CB-CE2 3.92Å; L978-F982 WeakPolarHBondContact O-CD2 3.38Å; L978-F982 WeakPolarHBondContact O-CG 3.21Å; L978-F982 PolarHBondContact O-N 2.92Å; I979-F982 PolarHBondContact O-N 2.83Å; K980-F982 PolarHBondContact O-N 3.18Å; F982-E984 VanDerWaalsContact C-N 3.29Å; F982-E984 PolarHBondContact O-N 2.8Å; F982-N985 WeakPolarHBondContact O-CB 3.14Å; F982-N985 PolarHBondContact O-N 2.97Å; F982-N985 VanDerWaalsContact O-N 3.14Å; F982-I986 WeakPolarHBondContact O-CB 3.33Å; F982-I986 WeakPolarHBondContact O-CD1 3.3Å; F982-I986 WeakPolarHBondContact O-CG1 3.4Å; F982-I986 PolarHBondContact O-N 3.22Å
983	S	97.1	Very high	93.6	Very high	4 Å²	4	41.1 Å²	41.1	3%	0.028	19%	0.193	C	C	.	.	H	α-helix	trans	-58.1	-40	172.6	-57.4	0	0	0	0	112.9	I979 K980 Q981 Y987 P995 C998	I979-S983 PolarHBondContact O-N 3.46Å; I979-S983 PolarHBondContact O-OG 3.1Å; K980-S983 WeakPolarHBondContact O-CB 3.48Å; K980-S983 PolarHBondContact O-N 3.18Å; Q981-S983 VanDerWaalsContact C-N 3.35Å; S983-Y987 PolarHBondContact O-N 3.41Å; S983-Y987 VanDerWaalsContact O-N 3.14Å; S983-P995 WeakPolarHBondContact CB-O 3.47Å; S983-C998 VanDerWaalsContact OG-CB 3.23Å; S983-C998 WeakPolarHBondContact OG-CB 3.4Å
984	E	94.7	Very high	93.8	Very high	84 Å²	84	40.2 Å²	40.2	39%	0.393	19%	0.193	S	C	.	.	H	α-helix	trans	-64	-47.4	173	-69.8	168.3	-174.8	0	0	111	K980 Q981 F982 I986 Y987 E988 P995	K980-E984 WeakPolarHBondContact CE-OE1 3.48Å; K980-E984 PolarHBondContact O-N 2.95Å; K980-E984 VanDerWaalsContact O-N 3.09Å; Q981-E984 PolarHBondContact O-N 3.42Å; F982-E984 VanDerWaalsContact C-N 3.29Å; F982-E984 PolarHBondContact O-N 2.8Å; E984-I986 VanDerWaalsContact C-N 3.33Å; E984-I986 PolarHBondContact O-N 3.38Å; E984-Y987 WeakPolarHBondContact O-CB 3.46Å; E984-Y987 PolarHBondContact O-N 2.85Å; E984-E988 WeakPolarHBondContact O-CG 3.44Å; E984-E988 PolarHBondContact O-N 3.46Å; E984-P995 HydrophobicContact CG-CB 4.5Å
985	N	93.6	Very high	94.2	Very high	3 Å²	3	39.4 Å²	39.4	2%	0.016	19%	0.194	C	C	.	.	H	α-helix	trans	-61.5	-37.7	177.5	-60.4	-11.3	0	0	0	112.9	H876 I877 S878 Q981 F982 Y987 E988 A989	H876-N985 VanDerWaalsContact O-CB 3.3Å; H876-N985 WeakPolarHBondContact O-CB 3.32Å; H876-N985 VanDerWaalsContact O-CG 3.29Å; I877-N985 HydrophobicContact CG1-CB 4.41Å; S878-N985 PolarHBondContact N-ND2 3.12Å; S878-N985 PolarHBondContact OG-ND2 3.37Å; S878-N985 VanDerWaalsContact OG-ND2 3.09Å; Q981-N985 VanDerWaalsContact O-CG 3.22Å; Q981-N985 PolarHBondContact O-N 3.06Å; Q981-N985 PolarHBondContact O-OD1 3.27Å; F982-N985 WeakPolarHBondContact O-CB 3.14Å; F982-N985 PolarHBondContact O-N 2.97Å; F982-N985 VanDerWaalsContact O-N 3.14Å; N985-Y987 VanDerWaalsContact C-N 3.35Å; N985-E988 PolarHBondContact O-N 2.63Å; N985-A989 WeakPolarHBondContact O-CB 3.48Å; N985-A989 PolarHBondContact O-N 3.45Å
986	I	95.5	Very high	94.3	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-70	-36.1	-179.6	-67.6	159.5	0	0	0	110.6	I887 L896 L900 F982 E984 A989 F990 L991 V992	I887-I986 HydrophobicContact CG2-CD1 3.4Å; I887-I986 HydrophobicContact CG2-CG1 3.56Å; L896-I986 HydrophobicContact CD1-CD1 3.99Å; L896-I986 HydrophobicContact CD2-CD1 4.24Å; L896-I986 HydrophobicContact CD2-CG2 4.25Å; L900-I986 HydrophobicContact CD1-CD1 4.09Å; L900-I986 HydrophobicContact CD2-CD1 3.52Å; L900-I986 HydrophobicContact CG-CD1 4.17Å; F982-I986 WeakPolarHBondContact O-CB 3.33Å; F982-I986 WeakPolarHBondContact O-CD1 3.3Å; F982-I986 WeakPolarHBondContact O-CG1 3.4Å; F982-I986 PolarHBondContact O-N 3.22Å; E984-I986 VanDerWaalsContact C-N 3.33Å; E984-I986 PolarHBondContact O-N 3.38Å; I986-A989 CarbonylContact O-C 3.19Å; I986-A989 WeakPolarHBondContact O-CB 3.23Å; I986-A989 PolarHBondContact O-N 3.29Å; I986-F990 PolarHBondContact O-N 2.99Å; I986-L991 HydrophobicContact CG2-CB 3.62Å; I986-L991 HydrophobicContact CG2-CD1 4.28Å; I986-L991 PolarHBondContact O-N 3.49Å; I986-L991 VanDerWaalsContact O-N 3.09Å; I986-V992 HydrophobicContact CG2-CB 4.49Å; I986-V992 HydrophobicContact CG2-CG1 3.85Å; I986-V992 HydrophobicContact CG2-CG2 4Å
987	Y	94.8	Very high	94.4	Very high	110 Å²	110	42 Å²	42	43%	0.431	22%	0.215	S	C	.	.	H	α-helix	trans	-63.5	-47	170.4	171	-106.4	0	0	0	111.1	S983 E984 N985 A989 F990 V992 G993 P995	S983-Y987 PolarHBondContact O-N 3.41Å; S983-Y987 VanDerWaalsContact O-N 3.14Å; E984-Y987 WeakPolarHBondContact O-CB 3.46Å; E984-Y987 PolarHBondContact O-N 2.85Å; N985-Y987 VanDerWaalsContact C-N 3.35Å; Y987-A989 PolarHBondContact O-N 3.13Å; Y987-F990 WeakPolarHBondContact O-CA 3.16Å; Y987-F990 PolarHBondContact O-N 2.87Å; Y987-V992 WeakPolarHBondContact CD2-O 3.49Å; Y987-G993 VanDerWaalsContact CE2-O 3.28Å; Y987-G993 WeakPolarHBondContact CE2-O 3.28Å; Y987-P995 HydrophobicContact CD1-CG 4.17Å; Y987-P995 HydrophobicContact CG-CG 3.95Å
988	E	90.3	Very high	94.6	Very high	99 Å²	99	41 Å²	41	46%	0.463	21%	0.205	S	C	.	.	H	α-helix	trans	-62.2	-26.7	174	-69.3	177.3	-178.2	0	0	112.8	H876 E984 N985 F990	H876-E988 HydrophobicContact CB-CB 4.47Å; E984-E988 WeakPolarHBondContact O-CG 3.44Å; E984-E988 PolarHBondContact O-N 3.46Å; N985-E988 PolarHBondContact O-N 2.63Å; E988-F990 VanDerWaalsContact O-CD2 3.28Å; E988-F990 WeakPolarHBondContact O-CD2 3.42Å; E988-F990 VanDerWaalsContact O-CE2 3.3Å; E988-F990 WeakPolarHBondContact O-CE2 3.37Å; E988-F990 PolarHBondContact O-N 3.26Å
989	A	92.8	Very high	94.7	Very high	0 Å²	0	44 Å²	44	0%	0	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-0.9	171.9	0	0	0	0	0	113.4	R873 H876 N985 I986 Y987 L991	R873-A989 WeakPolarHBondContact CD-O 3.39Å; R873-A989 PolarHBondContact NH1-O 3.26Å; H876-A989 HydrophobicContact CB-CB 4.07Å; N985-A989 WeakPolarHBondContact O-CB 3.48Å; N985-A989 PolarHBondContact O-N 3.45Å; I986-A989 CarbonylContact O-C 3.19Å; I986-A989 WeakPolarHBondContact O-CB 3.23Å; I986-A989 PolarHBondContact O-N 3.29Å; Y987-A989 PolarHBondContact O-N 3.13Å; A989-L991 VanDerWaalsContact C-N 3.3Å; A989-L991 HydrophobicContact CB-CD1 3.91Å; A989-L991 HydrophobicContact CB-CG 4.09Å; A989-L991 PolarHBondContact O-N 2.75Å
990	F	94.7	Very high	94.6	Very high	75 Å²	75	47.4 Å²	47.4	33%	0.329	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.9	32.4	-178.1	-49.8	-91.2	0	0	0	114.1	L386 I986 Y987 E988 E1156 L1157	L386-F990 HydrophobicContact CD2-CD2 3.72Å; L386-F990 HydrophobicContact CD2-CE2 3.68Å; L386-F990 HydrophobicContact CD2-CG 4.29Å; L386-F990 HydrophobicContact CD2-CZ 4.24Å; I986-F990 PolarHBondContact O-N 2.99Å; Y987-F990 WeakPolarHBondContact O-CA 3.16Å; Y987-F990 PolarHBondContact O-N 2.87Å; E988-F990 VanDerWaalsContact O-CD2 3.28Å; E988-F990 WeakPolarHBondContact O-CD2 3.42Å; E988-F990 VanDerWaalsContact O-CE2 3.3Å; E988-F990 WeakPolarHBondContact O-CE2 3.37Å; E988-F990 PolarHBondContact O-N 3.26Å; F990-E1156 HydrophobicContact CB-CB 4.08Å; F990-E1156 HydrophobicContact CB-CG 4.02Å; F990-L1157 PolarHBondContact O-N 3.26Å
991	L	94.6	Very high	94.5	Very high	3 Å²	3	45.8 Å²	45.8	2%	0.016	24%	0.244	C	C	.	.	S	Bend	trans	-99.9	-13.4	-179.4	-66	170.8	0	0	0	113.2	V888 A891 I986 A989 L1157	V888-L991 HydrophobicContact CB-CD1 4.15Å; V888-L991 HydrophobicContact CG1-CD1 4Å; V888-L991 HydrophobicContact CG1-CD2 4.29Å; V888-L991 HydrophobicContact CG2-CD1 3.85Å; A891-L991 HydrophobicContact CB-CB 4.05Å; A891-L991 HydrophobicContact CB-CD1 4.49Å; I986-L991 HydrophobicContact CG2-CB 3.62Å; I986-L991 HydrophobicContact CG2-CD1 4.28Å; I986-L991 PolarHBondContact O-N 3.49Å; I986-L991 VanDerWaalsContact O-N 3.09Å; A989-L991 VanDerWaalsContact C-N 3.3Å; A989-L991 HydrophobicContact CB-CD1 3.91Å; A989-L991 HydrophobicContact CB-CG 4.09Å; A989-L991 PolarHBondContact O-N 2.75Å; L991-L1157 HydrophobicContact CD2-CD2 4.42Å; L991-L1157 WeakPolarHBondContact O-CD2 3.49Å
992	V	95.2	Very high	94.6	Very high	5 Å²	5	49.8 Å²	49.8	3%	0.03	27%	0.274	C	S	.	.	S	Bend	trans	-139.9	154	175.5	-64.7	0	0	0	0	109.9	L896 I986 Y987 K994 C1005	L896-V992 HydrophobicContact CD2-CG1 3.97Å; I986-V992 HydrophobicContact CG2-CB 4.49Å; I986-V992 HydrophobicContact CG2-CG1 3.85Å; I986-V992 HydrophobicContact CG2-CG2 4Å; Y987-V992 WeakPolarHBondContact CD2-O 3.49Å; V992-K994 WeakPolarHBondContact CG2-O 3.27Å; V992-C1005 HydrophobicContact CG1-CB 4.29Å
993	G	92	Very high	94.6	Very high	31 Å²	31	50.4 Å²	50.4	32%	0.32	28%	0.279	S	S	.	.	S	Bend	trans	-74.5	-31.3	178.5	0	0	0	0	0	112.9	Y987	Y987-G993 VanDerWaalsContact CE2-O 3.28Å; Y987-G993 WeakPolarHBondContact CE2-O 3.28Å
994	K	94	Very high	94.4	Very high	134 Å²	134	54.4 Å²	54.4	58%	0.583	30%	0.298	S	S	*	.	S	Bend	trans	-144.2	148.7	175.9	-60.4	175.4	-174	168.9	0	110.8	V992 S996 D997	V992-K994 WeakPolarHBondContact CG2-O 3.27Å; K994-S996 PolarHBondContact O-N 3.19Å; K994-S996 VanDerWaalsContact O-N 3.16Å; K994-D997 PolarHBondContact N-OD2 2.73Å; K994-D997 WeakPolarHBondContact O-CB 3.48Å; K994-D997 PolarHBondContact O-N 3.03Å
995	P	95	Very high	94.5	Very high	45 Å²	45	51.1 Å²	51.1	29%	0.292	28%	0.283	S	S	.	.	G	3₁₀ helix	trans	-56.3	-32.8	175	-26.1	34	0	0	0	113.9	S983 E984 Y987 D997 C998	S983-P995 WeakPolarHBondContact CB-O 3.47Å; E984-P995 HydrophobicContact CG-CB 4.5Å; Y987-P995 HydrophobicContact CD1-CG 4.17Å; Y987-P995 HydrophobicContact CG-CG 3.95Å; P995-D997 PolarHBondContact O-N 3.12Å; P995-C998 WeakPolarHBondContact O-CB 3.32Å; P995-C998 PolarHBondContact O-N 3.15Å
996	S	95.4	Very high	94.6	Very high	70 Å²	70	51.2 Å²	51.2	49%	0.49	28%	0.284	S	S	.	.	G	3₁₀ helix	trans	-64.1	-25.9	178.4	52.2	0	0	0	0	113.9	K994 C998 T999 L1000	K994-S996 PolarHBondContact O-N 3.19Å; K994-S996 VanDerWaalsContact O-N 3.16Å; S996-C998 PolarHBondContact O-N 3Å; S996-T999 PolarHBondContact O-N 2.93Å; S996-T999 PolarHBondContact O-OG1 3.38Å; S996-L1000 PolarHBondContact O-N 3.28Å
997	D	96.6	Very high	94.7	Very high	41 Å²	41	56 Å²	56	22%	0.219	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	-65	-30.6	-176.8	-61.4	-16.1	0	0	0	110.8	K994 P995 T999 L1000 A1003 C1005 N1006	K994-D997 PolarHBondContact N-OD2 2.73Å; K994-D997 WeakPolarHBondContact O-CB 3.48Å; K994-D997 PolarHBondContact O-N 3.03Å; P995-D997 PolarHBondContact O-N 3.12Å; D997-T999 PolarHBondContact O-N 2.95Å; D997-T999 VanDerWaalsContact O-N 3.15Å; D997-L1000 PolarHBondContact O-N 2.77Å; D997-A1003 HydrophobicContact CB-CB 3.88Å; D997-A1003 VanDerWaalsContact O-CB 3.23Å; D997-A1003 WeakPolarHBondContact O-CB 3.4Å; D997-C1005 PolarHBondContact O-SG 3.17Å; D997-C1005 VanDerWaalsContact O-SG 3.39Å; D997-N1006 PolarHBondContact O-ND2 2.67Å
998	C	96.9	Very high	94.9	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	29%	0.29	C	S	.	.	G	3₁₀ helix	trans	-57.2	-30.9	179.3	-66.1	0	0	0	0	113.7	L896 H897 L900 S983 P995 S996 N1006	L896-C998 HydrophobicContact CD2-CB 4.09Å; H897-C998 WeakPolarHBondContact CB-O 3.47Å; L900-C998 HydrophobicContact CD1-CB 3.7Å; S983-C998 VanDerWaalsContact OG-CB 3.23Å; S983-C998 WeakPolarHBondContact OG-CB 3.4Å; P995-C998 WeakPolarHBondContact O-CB 3.32Å; P995-C998 PolarHBondContact O-N 3.15Å; S996-C998 PolarHBondContact O-N 3Å; C998-N1006 PolarHBondContact O-ND2 3.3Å; C998-N1006 VanDerWaalsContact O-ND2 3.12Å
999	T	94.5	Very high	95.2	Very high	63 Å²	63	48 Å²	48	39%	0.387	27%	0.274	S	S	.	.	G	3₁₀ helix	trans	-110.2	-4.3	-178.3	55.7	0	0	0	0	113.2	I979 S996 D997 P1001	I979-T999 HydrophobicContact CG2-CG2 3.63Å; S996-T999 PolarHBondContact O-N 2.93Å; S996-T999 PolarHBondContact O-OG1 3.38Å; D997-T999 PolarHBondContact O-N 2.95Å; D997-T999 VanDerWaalsContact O-N 3.15Å; T999-P1001 WeakPolarHBondContact O-CD 3.14Å
1000	L	94.8	Very high	95.3	Very high	78 Å²	78	56 Å²	56	41%	0.408	31%	0.312	S	S	.	.			trans	-85.3	118.4	-177.7	-174.9	68.9	0	0	0	109.4	S996 D997 S1002 A1003 N1006	S996-L1000 PolarHBondContact O-N 3.28Å; D997-L1000 PolarHBondContact O-N 2.77Å; L1000-S1002 WeakPolarHBondContact CD2-OG 3.42Å; L1000-S1002 WeakPolarHBondContact CG-OG 3.47Å; L1000-S1002 PolarHBondContact O-N 3.19Å; L1000-A1003 HydrophobicContact CB-CB 4.07Å; L1000-A1003 HydrophobicContact CD2-CB 4.4Å; L1000-A1003 WeakPolarHBondContact O-CB 3.48Å; L1000-A1003 PolarHBondContact O-N 2.98Å; L1000-N1006 PolarHBondContact O-ND2 2.99Å
1001	P	93.2	Very high	95.4	Very high	101 Å²	101	54.5 Å²	54.5	66%	0.656	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-28.5	-178.7	-25.7	35.8	0	0	0	113.6	T999 A1003	T999-P1001 WeakPolarHBondContact O-CD 3.14Å; P1001-A1003 VanDerWaalsContact C-N 3.32Å
1002	S	95	Very high	95.4	Very high	100 Å²	100	57.7 Å²	57.7	70%	0.699	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-3	178.3	65.3	0	0	0	0	114.1	L1000	L1000-S1002 WeakPolarHBondContact CD2-OG 3.42Å; L1000-S1002 WeakPolarHBondContact CG-OG 3.47Å; L1000-S1002 PolarHBondContact O-N 3.19Å
1003	A	95.8	Very high	95.5	Very high	13 Å²	13	59.5 Å²	59.5	11%	0.107	33%	0.329	C	S	.	.	S	Bend	trans	-75	144.6	176.5	0	0	0	0	0	110.6	D997 L1000 P1001 C1005 N1006	D997-A1003 HydrophobicContact CB-CB 3.88Å; D997-A1003 VanDerWaalsContact O-CB 3.23Å; D997-A1003 WeakPolarHBondContact O-CB 3.4Å; L1000-A1003 HydrophobicContact CB-CB 4.07Å; L1000-A1003 HydrophobicContact CD2-CB 4.4Å; L1000-A1003 WeakPolarHBondContact O-CB 3.48Å; L1000-A1003 PolarHBondContact O-N 2.98Å; P1001-A1003 VanDerWaalsContact C-N 3.32Å; A1003-C1005 PolarHBondContact O-N 3.28Å; A1003-N1006 PolarHBondContact O-N 3.05Å
1004	Q	94.1	Very high	95.7	Very high	88 Å²	88	58.1 Å²	58.1	41%	0.411	31%	0.314	S	S	.	.	G	3₁₀ helix	trans	-57.2	-35.9	-178.4	-172.8	-178.7	41.9	0	0	112.7	R894 N1006 E1007	R894-Q1004 VanDerWaalsContact CB-O 3.25Å; R894-Q1004 WeakPolarHBondContact CB-O 3.28Å; R894-Q1004 WeakPolarHBondContact CD-O 3.31Å; R894-Q1004 VanDerWaalsContact CG-O 3.31Å; R894-Q1004 WeakPolarHBondContact CG-O 3.44Å; Q1004-N1006 PolarHBondContact O-N 2.97Å; Q1004-E1007 WeakPolarHBondContact O-CB 3.5Å; Q1004-E1007 PolarHBondContact O-N 3Å
1005	C	95.2	Very high	95.9	Very high	14 Å²	14	51.9 Å²	51.9	10%	0.095	29%	0.287	C	S	.	.	G	3₁₀ helix	trans	-65.6	-4.9	177.2	68	0	0	0	0	114.7	R894 C895 L896 V992 D997 A1003	R894-C1005 CarbonylContact C-O 3.49Å; R894-C1005 WeakPolarHBondContact CA-O 3.38Å; C895-C1005 PolarHBondContact N-O 3.1Å; L896-C1005 HydrophobicContact CB-CB 4.43Å; L896-C1005 WeakPolarHBondContact CB-O 3.3Å; L896-C1005 HydrophobicContact CD2-CB 4.32Å; L896-C1005 PolarHBondContact N-O 3.3Å; V992-C1005 HydrophobicContact CG1-CB 4.29Å; D997-C1005 PolarHBondContact O-SG 3.17Å; D997-C1005 VanDerWaalsContact O-SG 3.39Å; A1003-C1005 PolarHBondContact O-N 3.28Å
1006	N	97.3	Very high	96	Very high	6 Å²	6	50 Å²	50	3%	0.032	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-120.2	6.7	179.2	-70.8	-37.6	0	0	0	113.7	R894 L896 H897 D997 C998 L1000 A1003 Q1004 Y1008 S1009	R894-N1006 CarbonylContact O-C 3.35Å; R894-N1006 WeakPolarHBondContact O-CA 3.49Å; L896-N1006 PolarHBondContact N-OD1 2.96Å; H897-N1006 WeakPolarHBondContact CB-OD1 3.43Å; H897-N1006 PolarHBondContact N-OD1 3.46Å; D997-N1006 PolarHBondContact O-ND2 2.67Å; C998-N1006 PolarHBondContact O-ND2 3.3Å; C998-N1006 VanDerWaalsContact O-ND2 3.12Å; L1000-N1006 PolarHBondContact O-ND2 2.99Å; A1003-N1006 PolarHBondContact O-N 3.05Å; Q1004-N1006 PolarHBondContact O-N 2.97Å; N1006-Y1008 PolarHBondContact O-N 3.34Å; N1006-Y1008 VanDerWaalsContact O-N 3.1Å; N1006-S1009 VanDerWaalsContact CA-OG 3.23Å; N1006-S1009 WeakPolarHBondContact CA-OG 3.43Å; N1006-S1009 WeakPolarHBondContact CB-OG 3.39Å; N1006-S1009 VanDerWaalsContact O-CB 3.3Å; N1006-S1009 WeakPolarHBondContact O-CB 3.49Å; N1006-S1009 PolarHBondContact O-N 2.95Å; N1006-S1009 PolarHBondContact O-OG 3.45Å; N1006-S1009 PolarHBondContact OD1-OG 2.63Å
1007	E	97.4	Very high	96.1	Very high	101 Å²	101	46.7 Å²	46.7	47%	0.472	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.2	-36.8	-175.9	-175.3	177.9	-178.2	0	0	114.3	R894 Q1004	R894-E1007 HydrophobicContact CB-CB 4.16Å; R894-E1007 VanDerWaalsContact CD-OE2 3.27Å; R894-E1007 WeakPolarHBondContact CD-OE2 3.3Å; R894-E1007 IonicContact CZ-OE2 3.49Å; R894-E1007 IonicContact NE-OE2 2.8Å; R894-E1007 IonicContact NH1-OE2 3.55Å; R894-E1007 PolarHBondContact NH1-OE2 3.11Å; R894-E1007 PolarHBondContact O-N 3.27Å; R894-E1007 VanDerWaalsContact O-N 3.14Å; Q1004-E1007 WeakPolarHBondContact O-CB 3.5Å; Q1004-E1007 PolarHBondContact O-N 3Å
1008	Y	97.8	Very high	96.2	Very high	21 Å²	21	44.7 Å²	44.7	8%	0.082	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.5	24.6	-179.5	-56.4	-70.3	0	0	0	113.2	R894 N1006 E1010 E1011 L1014 G1169 L1172 A1173 A1176	R894-Y1008 HydrophobicContact CB-CD2 3.95Å; R894-Y1008 HydrophobicContact CB-CE2 4.48Å; R894-Y1008 PolarHBondContact O-N 3.39Å; N1006-Y1008 PolarHBondContact O-N 3.34Å; N1006-Y1008 VanDerWaalsContact O-N 3.1Å; Y1008-E1010 PolarHBondContact O-N 2.87Å; Y1008-E1011 HydrophobicContact CD1-CG 4Å; Y1008-E1011 HydrophobicContact CG-CG 4.46Å; Y1008-E1011 WeakPolarHBondContact O-CB 3.45Å; Y1008-E1011 PolarHBondContact O-N 3.5Å; Y1008-E1011 VanDerWaalsContact O-N 3.07Å; Y1008-L1014 HydrophobicContact CD2-CD2 4.38Å; Y1008-L1014 HydrophobicContact CG-CD2 4.08Å; Y1008-G1169 PolarHBondContact OH-O 3.3Å; Y1008-L1172 HydrophobicContact CD2-CB 4.09Å; Y1008-L1172 HydrophobicContact CD2-CD1 4.35Å; Y1008-L1172 HydrophobicContact CE2-CB 3.36Å; Y1008-L1172 HydrophobicContact CE2-CD1 3.96Å; Y1008-L1172 HydrophobicContact CE2-CG 4.28Å; Y1008-A1173 WeakPolarHBondContact OH-CA 3.34Å; Y1008-A1173 PolarHBondContact OH-N 3.4Å; Y1008-A1176 HydrophobicContact CD1-CB 4.14Å; Y1008-A1176 HydrophobicContact CE1-CB 4.3Å
1009	S	97.3	Very high	96.3	Very high	18 Å²	18	44.8 Å²	44.8	13%	0.126	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-25.4	-179.7	-62.3	0	0	0	0	113.8	P898 N1006	P898-S1009 WeakPolarHBondContact CG-O 3.48Å; N1006-S1009 VanDerWaalsContact CA-OG 3.23Å; N1006-S1009 WeakPolarHBondContact CA-OG 3.43Å; N1006-S1009 WeakPolarHBondContact CB-OG 3.39Å; N1006-S1009 VanDerWaalsContact O-CB 3.3Å; N1006-S1009 WeakPolarHBondContact O-CB 3.49Å; N1006-S1009 PolarHBondContact O-N 2.95Å; N1006-S1009 PolarHBondContact O-OG 3.45Å; N1006-S1009 PolarHBondContact OD1-OG 2.63Å
1010	E	95.2	Very high	96.4	Very high	170 Å²	170	41.8 Å²	41.8	79%	0.794	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.8	-8.2	177.8	-57.9	-56.8	140.4	0	0	112.9	Y1008 E1012	Y1008-E1010 PolarHBondContact O-N 2.87Å; E1010-E1012 PolarHBondContact O-N 2.76Å
1011	E	96.5	Very high	96.5	Very high	43 Å²	43	38.1 Å²	38.1	20%	0.201	20%	0.203	C	C	.	.			trans	-80.7	84.5	178.3	-62.3	-62.1	152.2	0	0	110.4	Y1008 E1013 L1014 V1015 A1176 R1180	Y1008-E1011 HydrophobicContact CD1-CG 4Å; Y1008-E1011 HydrophobicContact CG-CG 4.46Å; Y1008-E1011 WeakPolarHBondContact O-CB 3.45Å; Y1008-E1011 PolarHBondContact O-N 3.5Å; Y1008-E1011 VanDerWaalsContact O-N 3.07Å; E1011-E1013 VanDerWaalsContact C-N 3.32Å; E1011-E1013 PolarHBondContact O-N 3.09Å; E1011-L1014 HydrophobicContact CB-CB 3.9Å; E1011-L1014 WeakPolarHBondContact O-CA 3.28Å; E1011-L1014 WeakPolarHBondContact O-CB 2.97Å; E1011-L1014 PolarHBondContact O-N 3.06Å; E1011-V1015 PolarHBondContact O-N 3.23Å; E1011-A1176 HydrophobicContact CG-CB 4.11Å; E1011-R1180 VanDerWaalsContact CD-NH2 3.28Å; E1011-R1180 IonicContact OE1-CZ 2.89Å; E1011-R1180 IonicContact OE1-NE 3.98Å; E1011-R1180 PolarHBondContact OE1-NE 2.7Å; E1011-R1180 IonicContact OE1-NH2 2.75Å; E1011-R1180 PolarHBondContact OE1-NH2 3.06Å; E1011-R1180 IonicContact OE2-CZ 3.24Å; E1011-R1180 IonicContact OE2-NE 3.4Å; E1011-R1180 PolarHBondContact OE2-NE 2.82Å; E1011-R1180 IonicContact OE2-NH2 2.68Å; E1011-R1180 PolarHBondContact OE2-NH2 3.09Å
1012	E	95.2	Very high	96.7	Very high	70 Å²	70	33.3 Å²	33.3	33%	0.327	17%	0.172	S	C	.	.	H	α-helix	trans	-53.9	-41.2	-171.8	-66.1	-171.9	-175.1	0	0	114.5	S932 L937 R941 E1010 L1014 V1015 K1016	S932-E1012 WeakPolarHBondContact CB-OE2 3.39Å; L937-E1012 HydrophobicContact CD1-CB 3.86Å; L937-E1012 HydrophobicContact CD1-CG 3.97Å; R941-E1012 IonicContact CZ-OE1 3.89Å; R941-E1012 IonicContact NH2-OE1 3.45Å; R941-E1012 PolarHBondContact NH2-OE1 3.3Å; R941-E1012 IonicContact NH2-OE2 2.66Å; R941-E1012 PolarHBondContact NH2-OE2 3.45Å; R941-E1012 VanDerWaalsContact NH2-OE2 3.15Å; E1010-E1012 PolarHBondContact O-N 2.76Å; E1012-L1014 VanDerWaalsContact C-N 3.32Å; E1012-V1015 PolarHBondContact O-N 3.22Å; E1012-K1016 WeakPolarHBondContact O-CB 3.48Å; E1012-K1016 VanDerWaalsContact O-CG 3.27Å; E1012-K1016 WeakPolarHBondContact O-CG 3.41Å; E1012-K1016 PolarHBondContact O-N 2.89Å
1013	E	95.5	Very high	96.7	Very high	43 Å²	43	28.5 Å²	28.5	20%	0.201	14%	0.139	C	C	.	.	H	α-helix	trans	-69.2	-32.3	178.9	-66.5	-57.2	148.9	0	0	112.1	E1011 K1016 G1017 L1179	E1011-E1013 VanDerWaalsContact C-N 3.32Å; E1011-E1013 PolarHBondContact O-N 3.09Å; E1013-K1016 VanDerWaalsContact CD-CE 3.41Å; E1013-K1016 VanDerWaalsContact OE1-CE 3.3Å; E1013-K1016 WeakPolarHBondContact OE1-CE 3.44Å; E1013-K1016 IonicContact OE1-NZ 3.69Å; E1013-K1016 PolarHBondContact OE1-NZ 3.44Å; E1013-K1016 WeakPolarHBondContact OE2-CE 3.45Å; E1013-K1016 IonicContact OE2-NZ 3.43Å; E1013-K1016 PolarHBondContact OE2-NZ 3.14Å; E1013-K1016 VanDerWaalsContact OE2-NZ 3.09Å; E1013-G1017 PolarHBondContact O-N 2.87Å; E1013-L1179 HydrophobicContact CB-CB 3.97Å
1014	L	97.5	Very high	96.7	Very high	1 Å²	1	28.3 Å²	28.3	1%	0.005	14%	0.135	C	C	.	.	H	α-helix	trans	-69.9	-47.2	172.6	-179.9	63.2	0	0	0	110.5	F893 Y1008 E1011 E1012 K1016 G1017 V1018 L1102 L1175 L1179	F893-L1014 HydrophobicContact CD1-CD1 4.24Å; Y1008-L1014 HydrophobicContact CD2-CD2 4.38Å; Y1008-L1014 HydrophobicContact CG-CD2 4.08Å; E1011-L1014 HydrophobicContact CB-CB 3.9Å; E1011-L1014 WeakPolarHBondContact O-CA 3.28Å; E1011-L1014 WeakPolarHBondContact O-CB 2.97Å; E1011-L1014 PolarHBondContact O-N 3.06Å; E1012-L1014 VanDerWaalsContact C-N 3.32Å; L1014-K1016 VanDerWaalsContact C-N 3.32Å; L1014-K1016 PolarHBondContact O-N 2.78Å; L1014-G1017 CarbonylContact O-C 3.53Å; L1014-G1017 WeakPolarHBondContact O-CA 3.32Å; L1014-G1017 PolarHBondContact O-N 3.18Å; L1014-V1018 HydrophobicContact CD1-CG2 3.97Å; L1014-V1018 HydrophobicContact CG-CG2 4.27Å; L1014-V1018 WeakPolarHBondContact O-CG2 3.35Å; L1014-V1018 PolarHBondContact O-N 3.47Å; L1014-L1102 HydrophobicContact CD1-CD1 4.47Å; L1014-L1175 HydrophobicContact CD1-CD2 3.58Å; L1014-L1175 HydrophobicContact CD1-CG 4.1Å; L1014-L1179 HydrophobicContact CB-CD1 4.23Å; L1014-L1179 HydrophobicContact CD1-CD1 4.09Å
1015	V	98.1	Very high	96.5	Very high	4 Å²	4	25 Å²	25	2%	0.024	12%	0.121	C	C	.	.	H	α-helix	trans	-54.2	-48.3	176.3	168.8	0	0	0	0	110.9	C895 P898 L899 L937 E1011 E1012 V1018 L1019	C895-V1015 HydrophobicContact CB-CG2 3.96Å; P898-V1015 HydrophobicContact CB-CG1 3.91Å; P898-V1015 HydrophobicContact CB-CG2 4.26Å; P898-V1015 HydrophobicContact CG-CG2 4.14Å; L899-V1015 HydrophobicContact CD2-CB 4.43Å; L899-V1015 HydrophobicContact CD2-CG1 3.68Å; L937-V1015 HydrophobicContact CD2-CG1 3.85Å; E1011-V1015 PolarHBondContact O-N 3.23Å; E1012-V1015 PolarHBondContact O-N 3.22Å; V1015-V1018 PolarHBondContact O-N 3.04Å; V1015-L1019 WeakPolarHBondContact O-CB 3.21Å; V1015-L1019 PolarHBondContact O-N 3.39Å
1016	K	97.6	Very high	96.4	Very high	5 Å²	5	25.2 Å²	25.2	2%	0.022	12%	0.121	C	C	.	.	H	α-helix	trans	-65.7	-38.2	176.1	-69.3	-177.2	-57	166.4	0	112.3	S932 L937 E1012 E1013 L1014 M1020 Q1093	S932-K1016 PolarHBondContact O-NZ 3.06Å; L937-K1016 HydrophobicContact CD1-CD 3.89Å; L937-K1016 HydrophobicContact CD1-CG 4.03Å; L937-K1016 HydrophobicContact CG-CG 4.4Å; E1012-K1016 WeakPolarHBondContact O-CB 3.48Å; E1012-K1016 VanDerWaalsContact O-CG 3.27Å; E1012-K1016 WeakPolarHBondContact O-CG 3.41Å; E1012-K1016 PolarHBondContact O-N 2.89Å; E1013-K1016 VanDerWaalsContact CD-CE 3.41Å; E1013-K1016 VanDerWaalsContact OE1-CE 3.3Å; E1013-K1016 WeakPolarHBondContact OE1-CE 3.44Å; E1013-K1016 IonicContact OE1-NZ 3.69Å; E1013-K1016 PolarHBondContact OE1-NZ 3.44Å; E1013-K1016 WeakPolarHBondContact OE2-CE 3.45Å; E1013-K1016 IonicContact OE2-NZ 3.43Å; E1013-K1016 PolarHBondContact OE2-NZ 3.14Å; E1013-K1016 VanDerWaalsContact OE2-NZ 3.09Å; L1014-K1016 VanDerWaalsContact C-N 3.32Å; L1014-K1016 PolarHBondContact O-N 2.78Å; K1016-M1020 WeakPolarHBondContact O-CB 2.95Å; K1016-M1020 PolarHBondContact O-N 3.04Å; K1016-Q1093 VanDerWaalsContact CD-O 3.28Å; K1016-Q1093 WeakPolarHBondContact CD-O 3.44Å; K1016-Q1093 WeakPolarHBondContact CE-O 3.25Å; K1016-Q1093 PolarHBondContact NZ-O 3.3Å
1017	G	97.6	Very high	96.3	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-61.9	-46.3	175.4	0	0	0	0	0	113	E1013 L1014 M1020 A1021	E1013-G1017 PolarHBondContact O-N 2.87Å; L1014-G1017 CarbonylContact O-C 3.53Å; L1014-G1017 WeakPolarHBondContact O-CA 3.32Å; L1014-G1017 PolarHBondContact O-N 3.18Å; G1017-M1020 WeakPolarHBondContact O-CB 3.35Å; G1017-M1020 WeakPolarHBondContact O-CE 3.43Å; G1017-M1020 PolarHBondContact O-N 3.16Å; G1017-A1021 PolarHBondContact O-N 3.02Å
1018	V	98.4	Very high	96.2	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-69.2	-40.6	178.5	173.6	0	0	0	0	111.2	L889 A890 F893 L1014 V1015 M1020 A1021 G1022 L1102	L889-V1018 HydrophobicContact CB-CG1 3.79Å; A890-V1018 HydrophobicContact CB-CG1 4.05Å; F893-V1018 HydrophobicContact CB-CG2 3.62Å; F893-V1018 HydrophobicContact CD1-CG2 4.25Å; F893-V1018 HydrophobicContact CD2-CG2 4.05Å; F893-V1018 HydrophobicContact CG-CG2 3.72Å; L1014-V1018 HydrophobicContact CD1-CG2 3.97Å; L1014-V1018 HydrophobicContact CG-CG2 4.27Å; L1014-V1018 WeakPolarHBondContact O-CG2 3.35Å; L1014-V1018 PolarHBondContact O-N 3.47Å; V1015-V1018 PolarHBondContact O-N 3.04Å; V1018-M1020 VanDerWaalsContact C-N 3.31Å; V1018-M1020 PolarHBondContact O-N 3.3Å; V1018-A1021 PolarHBondContact O-N 3.42Å; V1018-G1022 PolarHBondContact O-N 3.43Å; V1018-L1102 HydrophobicContact CG2-CD1 4.3Å
1019	L	98.2	Very high	96	Very high	2 Å²	2	20 Å²	20	1%	0.01	10%	0.097	C	C	.	.	H	α-helix	trans	-56.3	-48.1	170.7	-179.8	61	0	0	0	110.9	A886 L899 V902 H936 V1015 A1021 G1022 L1023 T1075	A886-L1019 HydrophobicContact CB-CD1 4.34Å; L899-L1019 HydrophobicContact CD1-CB 3.76Å; L899-L1019 HydrophobicContact CD1-CD1 3.6Å; L899-L1019 HydrophobicContact CD1-CG 4.2Å; V902-L1019 HydrophobicContact CG1-CD1 4.11Å; V902-L1019 HydrophobicContact CG1-CD2 4.35Å; H936-L1019 HydrophobicContact CB-CD2 3.7Å; H936-L1019 VanDerWaalsContact CG-CD2 3.43Å; V1015-L1019 WeakPolarHBondContact O-CB 3.21Å; V1015-L1019 PolarHBondContact O-N 3.39Å; L1019-A1021 VanDerWaalsContact C-N 3.34Å; L1019-A1021 PolarHBondContact O-N 3.3Å; L1019-G1022 PolarHBondContact O-N 2.92Å; L1019-L1023 HydrophobicContact CD1-CD1 3.72Å; L1019-L1023 HydrophobicContact CD1-CG 4.06Å; L1019-L1023 HydrophobicContact CD2-CD1 4.5Å; L1019-L1023 HydrophobicContact CG-CD1 3.82Å; L1019-L1023 HydrophobicContact CG-CG 4.42Å; L1019-L1023 WeakPolarHBondContact O-CB 3.17Å; L1019-L1023 VanDerWaalsContact O-CG 3.27Å; L1019-L1023 WeakPolarHBondContact O-CG 3.44Å; L1019-L1023 PolarHBondContact O-N 2.95Å; L1019-T1075 HydrophobicContact CD2-CG2 4.46Å; L1019-T1075 HydrophobicContact CG-CG2 4.44Å
1020	M	97.3	Very high	95.6	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-61.3	-41.8	177.3	179.9	-77.4	-46.3	0	0	112.1	K1016 G1017 V1018 G1022 L1023 Y1024 L1027 T1075 V1094 A1098 V1099 L1102 T1103	K1016-M1020 WeakPolarHBondContact O-CB 2.95Å; K1016-M1020 PolarHBondContact O-N 3.04Å; G1017-M1020 WeakPolarHBondContact O-CB 3.35Å; G1017-M1020 WeakPolarHBondContact O-CE 3.43Å; G1017-M1020 PolarHBondContact O-N 3.16Å; V1018-M1020 VanDerWaalsContact C-N 3.31Å; V1018-M1020 PolarHBondContact O-N 3.3Å; M1020-G1022 VanDerWaalsContact C-N 3.32Å; M1020-G1022 PolarHBondContact O-N 2.97Å; M1020-L1023 CarbonylContact O-C 3.55Å; M1020-L1023 PolarHBondContact O-N 3.39Å; M1020-Y1024 WeakPolarHBondContact O-CB 3.49Å; M1020-Y1024 PolarHBondContact O-N 3.47Å; M1020-Y1024 HydrophobicContact SD-CD2 4.38Å; M1020-L1027 HydrophobicContact CG-CD1 4.21Å; M1020-L1027 HydrophobicContact SD-CD1 4.46Å; M1020-T1075 HydrophobicContact CB-CG2 3.92Å; M1020-T1075 HydrophobicContact CG-CG2 4.49Å; M1020-V1094 HydrophobicContact CB-CG1 3.94Å; M1020-V1094 HydrophobicContact CB-CG2 3.88Å; M1020-V1094 HydrophobicContact CE-CG1 4.44Å; M1020-V1094 HydrophobicContact CG-CG1 4.08Å; M1020-V1094 HydrophobicContact CG-CG2 4.1Å; M1020-A1098 WeakPolarHBondContact CE-O 3.41Å; M1020-V1099 VanDerWaalsContact CE-CA 3.46Å; M1020-V1099 HydrophobicContact CE-CB 4.29Å; M1020-V1099 HydrophobicContact CE-CG2 4.24Å; M1020-V1099 HydrophobicContact SD-CG1 4.3Å; M1020-V1099 HydrophobicContact SD-CG2 4.37Å; M1020-L1102 HydrophobicContact CE-CB 4.49Å; M1020-T1103 HydrophobicContact CE-CG2 3.95Å; M1020-T1103 HydrophobicContact SD-CG2 3.67Å
1021	A	97	Very high	95.1	Very high	0 Å²	0	12 Å²	12	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-62.5	-38.8	176.9	0	0	0	0	0	112.5	L889 G1017 V1018 L1019 L1102	L889-A1021 HydrophobicContact CD1-CB 3.78Å; G1017-A1021 PolarHBondContact O-N 3.02Å; V1018-A1021 PolarHBondContact O-N 3.42Å; L1019-A1021 VanDerWaalsContact C-N 3.34Å; L1019-A1021 PolarHBondContact O-N 3.3Å; A1021-L1102 HydrophobicContact CB-CB 3.8Å; A1021-L1102 VanDerWaalsContact CB-O 3.26Å; A1021-L1102 WeakPolarHBondContact CB-O 3.45Å
1022	G	96.8	Very high	94.3	Very high	0 Å²	0	13 Å²	13	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-69.1	-36.3	174.2	0	0	0	0	0	113.7	R882 V1018 L1019 M1020	R882-G1022 CarbonylContact C-O 3.5Å; R882-G1022 WeakPolarHBondContact CA-O 3.45Å; R882-G1022 WeakPolarHBondContact CB-O 3.3Å; R882-G1022 CarbonylContact O-C 3.54Å; R882-G1022 VanDerWaalsContact O-O 3.06Å; V1018-G1022 PolarHBondContact O-N 3.43Å; L1019-G1022 PolarHBondContact O-N 2.92Å; M1020-G1022 VanDerWaalsContact C-N 3.32Å; M1020-G1022 PolarHBondContact O-N 2.97Å
1023	L	95.7	Very high	93.4	Very high	0 Å²	0	9.6 Å²	9.6	0%	0	5%	0.047	C	C	.	.	H	α-helix	trans	-85	-13.5	-180	-66.4	-179.6	0	0	0	114.1	R882 L883 L1019 M1020 N1026 T1075 F1077	R882-L1023 HydrophobicContact CB-CD2 4.1Å; L883-L1023 HydrophobicContact CD2-CD2 3.82Å; L1019-L1023 HydrophobicContact CD1-CD1 3.72Å; L1019-L1023 HydrophobicContact CD1-CG 4.06Å; L1019-L1023 HydrophobicContact CD2-CD1 4.5Å; L1019-L1023 HydrophobicContact CG-CD1 3.82Å; L1019-L1023 HydrophobicContact CG-CG 4.42Å; L1019-L1023 WeakPolarHBondContact O-CB 3.17Å; L1019-L1023 VanDerWaalsContact O-CG 3.27Å; L1019-L1023 WeakPolarHBondContact O-CG 3.44Å; L1019-L1023 PolarHBondContact O-N 2.95Å; M1020-L1023 CarbonylContact O-C 3.55Å; M1020-L1023 PolarHBondContact O-N 3.39Å; L1023-N1026 HydrophobicContact CB-CB 4.35Å; L1023-N1026 WeakPolarHBondContact O-CB 3.28Å; L1023-N1026 PolarHBondContact O-N 2.91Å; L1023-T1075 HydrophobicContact CD1-CG2 4.45Å; L1023-F1077 HydrophobicContact CD1-CB 4.21Å; L1023-F1077 HydrophobicContact CD2-CB 4.09Å; L1023-F1077 HydrophobicContact CD2-CD2 3.64Å; L1023-F1077 HydrophobicContact CD2-CG 4.26Å
1024	Y	94.3	Very high	92.6	Very high	8 Å²	8	9.8 Å²	9.8	3%	0.031	5%	0.047	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.3	130.2	178.3	-169.9	-95.6	0	0	0	110.1	I858 M1020 T1103 L1120 D1122	I858-Y1024 WeakPolarHBondContact CG2-O 3.44Å; M1020-Y1024 WeakPolarHBondContact O-CB 3.49Å; M1020-Y1024 PolarHBondContact O-N 3.47Å; M1020-Y1024 HydrophobicContact SD-CD2 4.38Å; Y1024-T1103 HydrophobicContact CD2-CG2 3.46Å; Y1024-T1103 VanDerWaalsContact CD2-CG2 3.46Å; Y1024-T1103 HydrophobicContact CE2-CG2 3.77Å; Y1024-T1103 HydrophobicContact CG-CG2 3.9Å; Y1024-L1120 HydrophobicContact CE2-CD1 4.28Å; Y1024-D1122 WeakPolarHBondContact CE1-OD2 3.22Å; Y1024-D1122 VanDerWaalsContact CZ-OD2 3.26Å; Y1024-D1122 PolarHBondContact OH-OD1 2.79Å; Y1024-D1122 PolarHBondContact OH-OD2 3.45Å
1025	P	91.2	Very high	91.5	Very high	19 Å²	19	9.8 Å²	9.8	12%	0.123	5%	0.047	C	C	.	.	T	Hydrogen-bonded Turn	cis	-92.4	20.1	20	37.4	-38.7	0	0	0	116.9	L1027	P1025-L1027 PolarHBondContact O-N 3.05Å
1026	N	93.3	Very high	90.4	Very high	18 Å²	18	9.9 Å²	9.9	10%	0.096	5%	0.047	C	C	.	.			trans	-71.8	66.5	178.1	-65.3	-0.3	0	0	0	113.1	L1023 T1075 Y1076	L1023-N1026 HydrophobicContact CB-CB 4.35Å; L1023-N1026 WeakPolarHBondContact O-CB 3.28Å; L1023-N1026 PolarHBondContact O-N 2.91Å; N1026-T1075 WeakPolarHBondContact O-CA 3.38Å; N1026-T1075 PolarHBondContact O-OG1 3.36Å; N1026-Y1076 HydrophobicContact CB-CD1 4.03Å; N1026-Y1076 HydrophobicContact CB-CE1 3.8Å; N1026-Y1076 HydrophobicContact CB-CE2 4.32Å; N1026-Y1076 HydrophobicContact CB-CG 4.4Å; N1026-Y1076 WeakPolarHBondContact CB-O 3.39Å; N1026-Y1076 PolarHBondContact ND2-O 2.84Å
1027	L	95	Very high	88.9	Confident	0 Å²	0	18.8 Å²	18.8	0%	0	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	134.5	179.5	-172.1	70.8	0	0	0	110.4	M1020 P1025 W1073 V1099 L1125	M1020-L1027 HydrophobicContact CG-CD1 4.21Å; M1020-L1027 HydrophobicContact SD-CD1 4.46Å; P1025-L1027 PolarHBondContact O-N 3.05Å; L1027-W1073 HydrophobicContact CD1-CB 4.14Å; L1027-V1099 HydrophobicContact CD1-CG1 4.07Å; L1027-V1099 HydrophobicContact CD1-CG2 4.11Å; L1027-V1099 HydrophobicContact CD2-CG1 3.66Å; L1027-L1125 HydrophobicContact CB-CD1 4.16Å; L1027-L1125 HydrophobicContact CD2-CB 4.1Å; L1027-L1125 HydrophobicContact CD2-CD1 4.24Å; L1027-L1125 HydrophobicContact CG-CD1 4.37Å; L1027-L1125 WeakPolarHBondContact O-CD1 3.12Å
1028	I	94.9	Very high	87.6	Confident	0 Å²	0	25 Å²	25	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	128	173.1	-63.3	162.8	0	0	0	108.3	Y1048 R1049 T1050 I1055 L1057 W1073 L1074 Y1076 V1088	I1028-Y1048 HydrophobicContact CG2-CD1 3.91Å; I1028-Y1048 HydrophobicContact CG2-CG 4.32Å; I1028-R1049 CarbonylContact C-O 3.52Å; I1028-R1049 WeakPolarHBondContact CA-O 3.47Å; I1028-T1050 HydrophobicContact CG1-CG2 3.87Å; I1028-I1055 HydrophobicContact CD1-CD1 4.08Å; I1028-I1055 HydrophobicContact CG1-CD1 4.43Å; I1028-L1057 HydrophobicContact CD1-CD2 4.21Å; I1028-W1073 VanDerWaalsContact O-CA 3.28Å; I1028-W1073 WeakPolarHBondContact O-CA 3.49Å; I1028-L1074 HydrophobicContact CB-CB 4.15Å; I1028-L1074 HydrophobicContact CD1-CB 4.33Å; I1028-L1074 HydrophobicContact CG2-CD1 4.35Å; I1028-L1074 PolarHBondContact N-O 2.76Å; I1028-L1074 PolarHBondContact O-N 3.04Å; I1028-Y1076 HydrophobicContact CD1-CD1 3.47Å; I1028-Y1076 VanDerWaalsContact CD1-CD1 3.47Å; I1028-Y1076 HydrophobicContact CD1-CE1 3.98Å; I1028-Y1076 HydrophobicContact CD1-CG 4.16Å; I1028-Y1076 HydrophobicContact CG1-CD1 3.62Å; I1028-Y1076 HydrophobicContact CG1-CE1 3.68Å; I1028-V1088 HydrophobicContact CD1-CG1 4.2Å; I1028-V1088 HydrophobicContact CD1-CG2 4.18Å
1029	Q	92.5	Very high	86.4	Confident	18 Å²	18	25.1 Å²	25.1	8%	0.084	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	125.2	163.8	-173.1	-174.3	50	0	0	109.5	R1031 R1049 L1125	Q1029-R1031 HydrophobicContact CG-CG 4.42Å; Q1029-R1049 PolarHBondContact N-O 3.01Å; Q1029-R1049 PolarHBondContact O-N 2.78Å; Q1029-L1125 HydrophobicContact CB-CB 4.32Å; Q1029-L1125 HydrophobicContact CB-CD2 3.86Å; Q1029-L1125 PolarHBondContact NE2-O 3.44Å
1030	V	89.8	Confident	85.5	Confident	6 Å²	6	29.8 Å²	29.8	4%	0.036	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	125.5	172.8	-178	0	0	0	0	108.7	V1046 Y1048 L1069 R1072 L1074	V1030-V1046 HydrophobicContact CG1-CG1 3.38Å; V1030-Y1048 HydrophobicContact CG2-CD1 4.15Å; V1030-Y1048 HydrophobicContact CG2-CE1 4.2Å; V1030-L1069 HydrophobicContact CB-CD1 4.41Å; V1030-L1069 HydrophobicContact CG1-CD1 3.67Å; V1030-L1069 HydrophobicContact CG2-CD1 3.89Å; V1030-R1072 WeakPolarHBondContact CB-O 3.36Å; V1030-R1072 VanDerWaalsContact CG2-O 3.32Å; V1030-R1072 WeakPolarHBondContact CG2-O 3.39Å; V1030-R1072 PolarHBondContact N-O 2.73Å; V1030-L1074 HydrophobicContact CG2-CD1 3.14Å
1031	R	85.2	Confident	84.6	Confident	15 Å²	15	30.3 Å²	30.3	6%	0.057	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	149.7	175	-67.3	-175.4	178.2	-169.2	-2.4	110.7	D203 T205 Q342 Q1029 V1046 T1047 R1049	D203-R1031 IonicContact OD2-NH1 2.73Å; D203-R1031 PolarHBondContact OD2-NH1 2.85Å; T205-R1031 PolarHBondContact OG1-NH1 3.03Å; T205-R1031 VanDerWaalsContact OG1-NH1 3.15Å; Q342-R1031 HydrophobicContact CG-CB 4.39Å; Q342-R1031 HydrophobicContact CG-CG 4.47Å; Q1029-R1031 HydrophobicContact CG-CG 4.42Å; R1031-V1046 WeakPolarHBondContact O-CA 3.41Å; R1031-T1047 WeakPolarHBondContact CB-OG1 3.35Å; R1031-T1047 PolarHBondContact N-O 2.75Å; R1031-T1047 PolarHBondContact O-N 2.81Å; R1031-R1049 VanDerWaalsContact NH1-NH1 3.16Å
1032	Q	79	Confident	83.7	Confident	63 Å²	63	34.3 Å²	34.3	29%	0.294	15%	0.152	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	138.5	179.2	-176.8	173	2.7	0	0	110.6	L338 Q342 P1043	L338-Q1032 HydrophobicContact CD1-CB 4.45Å; L338-Q1032 WeakPolarHBondContact CD1-O 3.48Å; L338-Q1032 WeakPolarHBondContact CD2-O 3.26Å; Q342-Q1032 PolarHBondContact NE2-O 3.48Å; Q1032-P1043 WeakPolarHBondContact CG-O 3.32Å
1033	G	75.8	Confident	82.7	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	82.8	141.2	178.8	0	0	0	0	0	114.4	K1042 P1043 S1045	G1033-K1042 VanDerWaalsContact CA-O 3.23Å; G1033-K1042 WeakPolarHBondContact CA-O 3.5Å; G1033-P1043 WeakPolarHBondContact CA-O 3.43Å; G1033-P1043 PolarHBondContact N-O 2.62Å; G1033-S1045 WeakPolarHBondContact CA-O 3.22Å; G1033-S1045 PolarHBondContact N-O 3.12Å
1034	K	78.6	Confident	81.7	Confident	47 Å²	47	43 Å²	43	20%	0.204	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	154.2	177.1	86.8	-164.4	173.1	170.6	0	112.1	T201 K1042 S1045 T1047	T201-K1034 HydrophobicContact CG2-CD 4.06Å; T201-K1034 HydrophobicContact CG2-CG 4.43Å; K1034-K1042 HydrophobicContact CG-CB 4.31Å; K1034-K1042 PolarHBondContact N-O 3.5Å; K1034-K1042 PolarHBondContact O-N 2.93Å; K1034-S1045 WeakPolarHBondContact CB-OG 3.4Å; K1034-S1045 WeakPolarHBondContact CD-OG 3.35Å; K1034-S1045 WeakPolarHBondContact CG-OG 3.44Å; K1034-S1045 PolarHBondContact N-OG 3.23Å; K1034-S1045 VanDerWaalsContact N-OG 3.11Å; K1034-T1047 HydrophobicContact CB-CG2 3.49Å; K1034-T1047 VanDerWaalsContact CB-CG2 3.49Å
1035	V	75.1	Confident	81.1	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	122	169.7	-176.5	0	0	0	0	108.1	I202 V204 F207 A328 L335 F1041	I202-V1035 PolarHBondContact N-O 3.04Å; I202-V1035 PolarHBondContact O-N 2.95Å; I202-V1035 VanDerWaalsContact O-N 3.09Å; V204-V1035 HydrophobicContact CG2-CG2 4.41Å; F207-V1035 HydrophobicContact CB-CB 4.42Å; F207-V1035 HydrophobicContact CB-CG2 4.3Å; F207-V1035 HydrophobicContact CD1-CG2 4.28Å; F207-V1035 HydrophobicContact CD2-CB 4.29Å; F207-V1035 HydrophobicContact CD2-CG1 3.76Å; F207-V1035 HydrophobicContact CE2-CG1 3.92Å; F207-V1035 HydrophobicContact CG-CB 4.26Å; F207-V1035 HydrophobicContact CG-CG1 4.12Å; F207-V1035 HydrophobicContact CG-CG2 4.13Å; F207-V1035 HydrophobicContact CZ-CG1 4.41Å; A328-V1035 HydrophobicContact CB-CG1 3.8Å; A328-V1035 HydrophobicContact CB-CG2 4.38Å; L335-V1035 HydrophobicContact CD1-CG2 4.36Å; L335-V1035 HydrophobicContact CD2-CG2 3.63Å; V1035-F1041 HydrophobicContact CG2-CD2 4.28Å
1036	T	74.3	Confident	80.7	Confident	6 Å²	6	44.6 Å²	44.6	4%	0.037	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	156.4	172.6	58.6	0	0	0	0	110.5	T201 Q1038 G1039 K1040 K1042	T201-T1036 HydrophobicContact CG2-CG2 4.43Å; T1036-Q1038 PolarHBondContact O-N 3.21Å; T1036-Q1038 VanDerWaalsContact O-N 3.12Å; T1036-G1039 WeakPolarHBondContact O-CA 3.5Å; T1036-G1039 PolarHBondContact O-N 3.32Å; T1036-K1040 HydrophobicContact CG2-CB 4.42Å; T1036-K1040 PolarHBondContact N-O 3.32Å; T1036-K1040 WeakPolarHBondContact OG1-CA 3.43Å; T1036-K1040 WeakPolarHBondContact OG1-CB 3.43Å; T1036-K1040 PolarHBondContact OG1-N 2.57Å; T1036-K1040 PolarHBondContact OG1-O 3.15Å; T1036-K1042 HydrophobicContact CG2-CD 4.41Å
1037	R	67.5	Low	80.3	Confident	192 Å²	192	44.4 Å²	44.4	73%	0.725	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53	-30.3	172.4	-97.4	174.3	-175.7	177.1	3.1	113.7	G200 I202 G1039	G200-R1037 VanDerWaalsContact O-CB 3.23Å; G200-R1037 WeakPolarHBondContact O-CB 3.33Å; G200-R1037 WeakPolarHBondContact O-CG 3.39Å; G200-R1037 PolarHBondContact O-N 3.31Å; I202-R1037 HydrophobicContact CD1-CG 4.49Å; R1037-G1039 PolarHBondContact O-N 3.3Å
1038	Q	69.6	Low	80.2	Confident	130 Å²	130	45.6 Å²	45.6	61%	0.607	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.6	2.5	173.6	-64.3	173	1.7	0	0	113.6	E199 T1036 K1040	E199-Q1038 PolarHBondContact OE1-NE2 3.39Å; T1036-Q1038 PolarHBondContact O-N 3.21Å; T1036-Q1038 VanDerWaalsContact O-N 3.12Å; Q1038-K1040 VanDerWaalsContact C-N 3.34Å; Q1038-K1040 PolarHBondContact O-N 2.9Å
1039	G	72.9	Confident	79.9	Confident	4 Å²	4	48.2 Å²	48.2	4%	0.041	23%	0.226	C	C	.	.			trans	74.5	19.9	-178.4	0	0	0	0	0	113.8	H327 A328 T1036 R1037 F1041	H327-G1039 PolarHBondContact N-O 3.24Å; A328-G1039 WeakPolarHBondContact CB-O 3.24Å; A328-G1039 PolarHBondContact N-O 2.72Å; T1036-G1039 WeakPolarHBondContact O-CA 3.5Å; T1036-G1039 PolarHBondContact O-N 3.32Å; R1037-G1039 PolarHBondContact O-N 3.3Å; G1039-F1041 PolarHBondContact O-N 2.88Å
1040	K	78.7	Confident	79.9	Confident	100 Å²	100	47.6 Å²	47.6	44%	0.435	22%	0.223	S	C	.	.			trans	-83.5	111.1	171.8	-170	176.2	-178.9	171.1	0	111.1	T1036 Q1038	T1036-K1040 HydrophobicContact CG2-CB 4.42Å; T1036-K1040 PolarHBondContact N-O 3.32Å; T1036-K1040 WeakPolarHBondContact OG1-CA 3.43Å; T1036-K1040 WeakPolarHBondContact OG1-CB 3.43Å; T1036-K1040 PolarHBondContact OG1-N 2.57Å; T1036-K1040 PolarHBondContact OG1-O 3.15Å; Q1038-K1040 VanDerWaalsContact C-N 3.34Å; Q1038-K1040 PolarHBondContact O-N 2.9Å
1041	F	79.6	Confident	79.7	Confident	10 Å²	10	52 Å²	52	4%	0.044	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	130.7	168.4	177.5	-136	0	0	0	112	V204 H327 A328 N331 L335 L338 V1035 G1039 P1043	V204-F1041 HydrophobicContact CG2-CE2 4.28Å; H327-F1041 PolarHBondContact CE1-O 3.41Å; H327-F1041 PolarHBondContact ND1-N 3.09Å; H327-F1041 VanDerWaalsContact ND1-N 3.19Å; H327-F1041 PolarHBondContact ND1-O 2.94Å; H327-F1041 VanDerWaalsContact ND1-O 3.1Å; A328-F1041 HydrophobicContact CB-CB 4.35Å; N331-F1041 HydrophobicContact CB-CD1 3.7Å; N331-F1041 HydrophobicContact CB-CE1 4.31Å; L335-F1041 HydrophobicContact CD2-CD1 4.45Å; L335-F1041 HydrophobicContact CD2-CD2 3.31Å; L335-F1041 HydrophobicContact CD2-CE2 3.39Å; L335-F1041 HydrophobicContact CD2-CG 3.87Å; L335-F1041 HydrophobicContact CD2-CZ 4Å; L335-F1041 HydrophobicContact CG-CD1 4.44Å; L335-F1041 HydrophobicContact CG-CD2 4.13Å; L335-F1041 HydrophobicContact CG-CE2 4.23Å; L335-F1041 HydrophobicContact CG-CG 4.22Å; L335-F1041 HydrophobicContact CG-CZ 4.42Å; L338-F1041 HydrophobicContact CD2-CE2 3.67Å; L338-F1041 HydrophobicContact CD2-CZ 3.76Å; V1035-F1041 HydrophobicContact CG2-CD2 4.28Å; G1039-F1041 PolarHBondContact O-N 2.88Å; F1041-P1043 HydrophobicContact CE1-CB 3.87Å; F1041-P1043 HydrophobicContact CE1-CG 4.23Å; F1041-P1043 HydrophobicContact CE2-CB 4.22Å; F1041-P1043 HydrophobicContact CZ-CB 3.63Å; F1041-P1043 HydrophobicContact CZ-CG 4.42Å
1042	K	78.9	Confident	79.5	Confident	85 Å²	85	55.3 Å²	55.3	37%	0.37	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	96	174.2	-65.3	-178.7	178.8	178.9	0	107.9	G1033 K1034 T1036 N1044 S1045	G1033-K1042 VanDerWaalsContact CA-O 3.23Å; G1033-K1042 WeakPolarHBondContact CA-O 3.5Å; K1034-K1042 HydrophobicContact CG-CB 4.31Å; K1034-K1042 PolarHBondContact N-O 3.5Å; K1034-K1042 PolarHBondContact O-N 2.93Å; T1036-K1042 HydrophobicContact CG2-CD 4.41Å; K1042-N1044 VanDerWaalsContact C-N 3.32Å; K1042-N1044 PolarHBondContact O-N 2.7Å; K1042-S1045 PolarHBondContact O-N 3.15Å; K1042-S1045 PolarHBondContact O-OG 2.8Å
1043	P	75	Confident	79.8	Confident	58 Å²	58	53.7 Å²	53.7	38%	0.377	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	-30.1	-173.9	23	-32.7	0	0	0	113.7	Q1032 G1033 F1041	Q1032-P1043 WeakPolarHBondContact CG-O 3.32Å; G1033-P1043 WeakPolarHBondContact CA-O 3.43Å; G1033-P1043 PolarHBondContact N-O 2.62Å; F1041-P1043 HydrophobicContact CE1-CB 3.87Å; F1041-P1043 HydrophobicContact CE1-CG 4.23Å; F1041-P1043 HydrophobicContact CE2-CB 4.22Å; F1041-P1043 HydrophobicContact CZ-CB 3.63Å; F1041-P1043 HydrophobicContact CZ-CG 4.42Å
1044	N	74.7	Confident	80.4	Confident	125 Å²	125	56.8 Å²	56.8	67%	0.668	28%	0.284	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.9	3.6	-175.6	-62.2	-18.1	0	0	0	113.8	K1042	K1042-N1044 VanDerWaalsContact C-N 3.32Å; K1042-N1044 PolarHBondContact O-N 2.7Å
1045	S	80.8	Confident	81	Confident	20 Å²	20	54.9 Å²	54.9	14%	0.14	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	161.4	174.2	61.6	0	0	0	0	111.2	G1033 K1034 K1042	G1033-S1045 WeakPolarHBondContact CA-O 3.22Å; G1033-S1045 PolarHBondContact N-O 3.12Å; K1034-S1045 WeakPolarHBondContact CB-OG 3.4Å; K1034-S1045 WeakPolarHBondContact CD-OG 3.35Å; K1034-S1045 WeakPolarHBondContact CG-OG 3.44Å; K1034-S1045 PolarHBondContact N-OG 3.23Å; K1034-S1045 VanDerWaalsContact N-OG 3.11Å; K1042-S1045 PolarHBondContact O-N 3.15Å; K1042-S1045 PolarHBondContact O-OG 2.8Å
1046	V	82.9	Confident	81.8	Confident	40 Å²	40	56.6 Å²	56.6	24%	0.242	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	145.1	177.5	178	0	0	0	0	110.1	V1030 R1031 Y1048	V1030-V1046 HydrophobicContact CG1-CG1 3.38Å; R1031-V1046 WeakPolarHBondContact O-CA 3.41Å; V1046-Y1048 HydrophobicContact CG1-CD1 4.47Å; V1046-Y1048 HydrophobicContact CG1-CE1 3.94Å; V1046-Y1048 HydrophobicContact CG1-CE2 4.2Å
1047	T	86.5	Confident	82.6	Confident	13 Å²	13	56.3 Å²	56.3	8%	0.08	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	149.6	169.2	55.6	0	0	0	0	109.7	R1031 K1034	R1031-T1047 WeakPolarHBondContact CB-OG1 3.35Å; R1031-T1047 PolarHBondContact N-O 2.75Å; R1031-T1047 PolarHBondContact O-N 2.81Å; K1034-T1047 HydrophobicContact CB-CG2 3.49Å; K1034-T1047 VanDerWaalsContact CB-CG2 3.49Å
1048	Y	91.4	Very high	83.7	Confident	25 Å²	25	49.4 Å²	49.4	10%	0.098	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	124.4	-177.3	-55.7	-83.6	0	0	0	109	I1028 V1030 V1046 N1054 I1055 L1057	I1028-Y1048 HydrophobicContact CG2-CD1 3.91Å; I1028-Y1048 HydrophobicContact CG2-CG 4.32Å; V1030-Y1048 HydrophobicContact CG2-CD1 4.15Å; V1030-Y1048 HydrophobicContact CG2-CE1 4.2Å; V1046-Y1048 HydrophobicContact CG1-CD1 4.47Å; V1046-Y1048 HydrophobicContact CG1-CE1 3.94Å; V1046-Y1048 HydrophobicContact CG1-CE2 4.2Å; Y1048-N1054 WeakPolarHBondContact O-CA 3.34Å; Y1048-I1055 VanDerWaalsContact CB-CD1 3.45Å; Y1048-I1055 HydrophobicContact CG-CD1 4.22Å; Y1048-I1055 PolarHBondContact O-N 3.47Å; Y1048-L1057 HydrophobicContact CD1-CD1 4.13Å; Y1048-L1057 HydrophobicContact CD1-CD2 4.44Å; Y1048-L1057 HydrophobicContact CD1-CG 4.13Å; Y1048-L1057 HydrophobicContact CD2-CG 3.97Å; Y1048-L1057 HydrophobicContact CE1-CD1 3.5Å; Y1048-L1057 VanDerWaalsContact CE1-CD1 3.5Å; Y1048-L1057 HydrophobicContact CE1-CG 3.94Å; Y1048-L1057 HydrophobicContact CE2-CB 4.49Å; Y1048-L1057 HydrophobicContact CE2-CD1 3.96Å; Y1048-L1057 HydrophobicContact CE2-CG 3.79Å; Y1048-L1057 HydrophobicContact CG-CG 4.13Å
1049	R	90.1	Very high	84.4	Confident	56 Å²	56	49.3 Å²	49.3	21%	0.211	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	134.8	-176.6	177.6	174.6	165	167.5	-10.3	110.9	I1028 Q1029 R1031 D1124 L1125	I1028-R1049 CarbonylContact C-O 3.52Å; I1028-R1049 WeakPolarHBondContact CA-O 3.47Å; Q1029-R1049 PolarHBondContact N-O 3.01Å; Q1029-R1049 PolarHBondContact O-N 2.78Å; R1031-R1049 VanDerWaalsContact NH1-NH1 3.16Å; R1049-D1124 IonicContact CZ-OD2 2.73Å; R1049-D1124 IonicContact NH2-OD1 2.77Å; R1049-D1124 PolarHBondContact NH2-OD1 3.2Å; R1049-D1124 IonicContact NH2-OD2 3.21Å; R1049-D1124 PolarHBondContact NH2-OD2 2.65Å; R1049-L1125 HydrophobicContact CG-CD2 4.18Å
1050	T	91.4	Very high	85	Confident	4 Å²	4	50.4 Å²	50.4	3%	0.025	26%	0.264	C	S	.	.			trans	-111.3	-179	171.1	66.9	0	0	0	0	109.9	I1028 S1052 G1053 I1055 Y1076	I1028-T1050 HydrophobicContact CG1-CG2 3.87Å; T1050-S1052 PolarHBondContact O-N 3.4Å; T1050-S1052 PolarHBondContact OG1-N 2.74Å; T1050-S1052 PolarHBondContact OG1-OG 2.69Å; T1050-G1053 PolarHBondContact N-O 3.09Å; T1050-G1053 PolarHBondContact O-N 3.08Å; T1050-G1053 PolarHBondContact OG1-N 3.33Å; T1050-G1053 PolarHBondContact OG1-O 2.98Å; T1050-G1053 VanDerWaalsContact OG1-O 3.07Å; T1050-I1055 HydrophobicContact CG2-CG1 3.89Å; T1050-I1055 HydrophobicContact CG2-CG2 3.87Å; T1050-Y1076 HydrophobicContact CG2-CE1 4.01Å
1051	K	85.7	Confident	85.6	Confident	100 Å²	100	45.8 Å²	45.8	44%	0.435	24%	0.244	S	C	.	.	S	Bend	trans	-61.9	-31	172	-173.8	175	178.1	174.5	0	112	E857 D1122	E857-K1051 IonicContact OE1-NZ 3.52Å; E857-K1051 PolarHBondContact OE1-NZ 2.87Å; K1051-D1122 VanDerWaalsContact CE-O 3.25Å; K1051-D1122 WeakPolarHBondContact CE-O 3.42Å; K1051-D1122 PolarHBondContact NZ-O 2.91Å; K1051-D1122 VanDerWaalsContact NZ-O 3.14Å
1052	S	81.6	Confident	86.1	Confident	84 Å²	84	46.8 Å²	46.8	59%	0.587	25%	0.249	S	C	*	.	S	Bend	trans	-86.9	-15.8	-179.1	53.8	0	0	0	0	114.4	T1050	T1050-S1052 PolarHBondContact O-N 3.4Å; T1050-S1052 PolarHBondContact OG1-N 2.74Å; T1050-S1052 PolarHBondContact OG1-OG 2.69Å
1053	G	85.1	Confident	86.7	Confident	29 Å²	29	42.8 Å²	42.8	30%	0.299	23%	0.232	S	C	.	.			trans	144.1	-161.7	176.3	0	0	0	0	0	113.6	T1050	T1050-G1053 PolarHBondContact N-O 3.09Å; T1050-G1053 PolarHBondContact O-N 3.08Å; T1050-G1053 PolarHBondContact OG1-N 3.33Å; T1050-G1053 PolarHBondContact OG1-O 2.98Å; T1050-G1053 VanDerWaalsContact OG1-O 3.07Å
1054	N	87.9	Confident	87.3	Confident	64 Å²	64	43 Å²	43	34%	0.342	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	140.4	176.5	-67.4	-33.7	0	0	0	110.7	Y1048	Y1048-N1054 WeakPolarHBondContact O-CA 3.34Å
1055	I	91.1	Very high	87.5	Confident	7 Å²	7	45.3 Å²	45.3	4%	0.036	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	165.8	177.8	65.9	82.3	0	0	0	110.2	I1028 Y1048 T1050 L1057 V1086 V1088	I1028-I1055 HydrophobicContact CD1-CD1 4.08Å; I1028-I1055 HydrophobicContact CG1-CD1 4.43Å; Y1048-I1055 VanDerWaalsContact CB-CD1 3.45Å; Y1048-I1055 HydrophobicContact CG-CD1 4.22Å; Y1048-I1055 PolarHBondContact O-N 3.47Å; T1050-I1055 HydrophobicContact CG2-CG1 3.89Å; T1050-I1055 HydrophobicContact CG2-CG2 3.87Å; I1055-L1057 HydrophobicContact CD1-CD2 3.94Å; I1055-V1086 HydrophobicContact CG2-CB 4.08Å; I1055-V1086 HydrophobicContact CG2-CG1 4Å; I1055-V1088 HydrophobicContact CB-CG2 4.45Å; I1055-V1088 HydrophobicContact CD1-CB 4.24Å; I1055-V1088 HydrophobicContact CD1-CG2 3.7Å; I1055-V1088 HydrophobicContact CG1-CG2 4.12Å
1056	L	91.6	Very high	87.1	Confident	37 Å²	37	46 Å²	46	19%	0.194	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	143.8	170.9	-61.8	172.3	0	0	0	109.1	V1086 F1087 V1088	L1056-V1086 PolarHBondContact N-O 3.05Å; L1056-F1087 HydrophobicContact CB-CD1 3.74Å; L1056-F1087 HydrophobicContact CB-CE1 3.76Å; L1056-F1087 HydrophobicContact CD1-CD1 4.46Å; L1056-F1087 HydrophobicContact CD1-CE1 3.69Å; L1056-F1087 HydrophobicContact CD1-CZ 3.81Å; L1056-F1087 HydrophobicContact CG-CE1 4.39Å; L1056-F1087 CarbonylContact O-C 3.48Å; L1056-F1087 VanDerWaalsContact O-CA 3.25Å; L1056-F1087 WeakPolarHBondContact O-CA 3.49Å; L1056-V1088 PolarHBondContact O-N 2.88Å
1057	L	92	Very high	86.4	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	134.1	168	-63.7	-171.1	0	0	0	108.8	I1028 Y1048 I1055 T1061 N1063 R1064 V1088	I1028-L1057 HydrophobicContact CD1-CD2 4.21Å; Y1048-L1057 HydrophobicContact CD1-CD1 4.13Å; Y1048-L1057 HydrophobicContact CD1-CD2 4.44Å; Y1048-L1057 HydrophobicContact CD1-CG 4.13Å; Y1048-L1057 HydrophobicContact CD2-CG 3.97Å; Y1048-L1057 HydrophobicContact CE1-CD1 3.5Å; Y1048-L1057 VanDerWaalsContact CE1-CD1 3.5Å; Y1048-L1057 HydrophobicContact CE1-CG 3.94Å; Y1048-L1057 HydrophobicContact CE2-CB 4.49Å; Y1048-L1057 HydrophobicContact CE2-CD1 3.96Å; Y1048-L1057 HydrophobicContact CE2-CG 3.79Å; Y1048-L1057 HydrophobicContact CG-CG 4.13Å; I1055-L1057 HydrophobicContact CD1-CD2 3.94Å; L1057-T1061 HydrophobicContact CB-CG2 3.78Å; L1057-T1061 HydrophobicContact CD1-CG2 4.35Å; L1057-T1061 HydrophobicContact CD2-CG2 4.4Å; L1057-T1061 HydrophobicContact CG-CG2 4.4Å; L1057-N1063 HydrophobicContact CD1-CB 3.9Å; L1057-N1063 WeakPolarHBondContact CD1-O 3.23Å; L1057-R1064 HydrophobicContact CB-CB 4.18Å; L1057-R1064 VanDerWaalsContact O-CD 3.28Å; L1057-R1064 WeakPolarHBondContact O-CD 3.45Å; L1057-R1064 PolarHBondContact O-NH1 3.29Å; L1057-V1088 HydrophobicContact CD2-CB 4Å; L1057-V1088 HydrophobicContact CD2-CG1 4.13Å
1058	H	89.4	Confident	85.8	Confident	47 Å²	47	57.3 Å²	57.3	22%	0.218	29%	0.292	C	S	.	.			trans	-74.9	158.1	173.9	-173.5	-104.8	0	0	0	110.3	S1060 T1061 F1087 V1088 R1089	H1058-S1060 VanDerWaalsContact ND1-CB 3.34Å; H1058-S1060 WeakPolarHBondContact ND1-CB 3.27Å; H1058-S1060 PolarHBondContact ND1-N 3.44Å; H1058-S1060 PolarHBondContact ND1-OG 3.47Å; H1058-S1060 PolarHBondContact O-N 2.77Å; H1058-S1060 VanDerWaalsContact O-N 3.07Å; H1058-T1061 WeakPolarHBondContact O-CG2 3.18Å; H1058-T1061 PolarHBondContact O-N 3.22Å; H1058-F1087 HydrophobicContact CB-CB 4.22Å; H1058-V1088 WeakPolarHBondContact CB-O 3.36Å; H1058-V1088 PolarHBondContact N-O 3.08Å; H1058-R1089 HydrophobicContact CB-CG 4.09Å
1059	K	85.7	Confident	85.2	Confident	128 Å²	128	56.2 Å²	56.2	56%	0.557	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-19.4	179.2	-65.5	178.7	-179.5	174.3	0	113.8	T1061	K1059-T1061 VanDerWaalsContact C-N 3.33Å; K1059-T1061 PolarHBondContact O-N 3.43Å
1060	S	84.9	Confident	84.7	Confident	27 Å²	27	59.7 Å²	59.7	19%	0.189	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-11.6	-179	60	0	0	0	0	115.5	H1058 R1089	H1058-S1060 VanDerWaalsContact ND1-CB 3.34Å; H1058-S1060 WeakPolarHBondContact ND1-CB 3.27Å; H1058-S1060 PolarHBondContact ND1-N 3.44Å; H1058-S1060 PolarHBondContact ND1-OG 3.47Å; H1058-S1060 PolarHBondContact O-N 2.77Å; H1058-S1060 VanDerWaalsContact O-N 3.07Å; S1060-R1089 PolarHBondContact OG-O 3.2Å
1061	T	91.5	Very high	84.5	Confident	3 Å²	3	59.7 Å²	59.7	2%	0.018	30%	0.301	C	S	.	.	S	Bend	trans	-97.6	134	175.4	175.6	0	0	0	0	109.9	D935 L1057 H1058 K1059 N1063 R1064 S1091	D935-T1061 WeakPolarHBondContact OD2-CA 3.37Å; D935-T1061 WeakPolarHBondContact OD2-CB 3.28Å; D935-T1061 PolarHBondContact OD2-OG1 2.95Å; L1057-T1061 HydrophobicContact CB-CG2 3.78Å; L1057-T1061 HydrophobicContact CD1-CG2 4.35Å; L1057-T1061 HydrophobicContact CD2-CG2 4.4Å; L1057-T1061 HydrophobicContact CG-CG2 4.4Å; H1058-T1061 WeakPolarHBondContact O-CG2 3.18Å; H1058-T1061 PolarHBondContact O-N 3.22Å; K1059-T1061 VanDerWaalsContact C-N 3.33Å; K1059-T1061 PolarHBondContact O-N 3.43Å; T1061-N1063 PolarHBondContact O-N 3.44Å; T1061-N1063 VanDerWaalsContact O-N 3.09Å; T1061-N1063 PolarHBondContact OG1-N 3.43Å; T1061-R1064 HydrophobicContact CG2-CB 4.34Å; T1061-R1064 WeakPolarHBondContact O-CB 3.45Å; T1061-R1064 PolarHBondContact O-N 2.84Å; T1061-R1064 VanDerWaalsContact O-N 3.11Å; T1061-S1091 PolarHBondContact OG1-N 2.91Å; T1061-S1091 PolarHBondContact OG1-OG 3.19Å
1062	I	89.8	Confident	84.6	Confident	30 Å²	30	57.4 Å²	57.4	15%	0.154	29%	0.29	C	S	.	.	G	3₁₀ helix	trans	-60.3	-23	179.4	66.4	-175.6	0	0	0	112.8	K925 A926 S929 D935 R1064	K925-I1062 HydrophobicContact CB-CG2 3.75Å; A926-I1062 HydrophobicContact CB-CG2 4.22Å; S929-I1062 WeakPolarHBondContact OG-CD1 3.27Å; D935-I1062 VanDerWaalsContact OD1-CG1 3.28Å; D935-I1062 WeakPolarHBondContact OD1-CG1 3.3Å; D935-I1062 WeakPolarHBondContact OD1-CG2 3.23Å; D935-I1062 PolarHBondContact OD1-N 3.25Å; I1062-R1064 VanDerWaalsContact C-N 3.25Å; I1062-R1064 PolarHBondContact O-N 3.4Å
1063	N	92.1	Very high	85.2	Confident	2 Å²	2	53.7 Å²	53.7	1%	0.011	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-77.8	-6.9	-178.6	-69.2	-50.6	0	0	0	113.3	G933 L1057 T1061 L1074 S1091 Q1093	G933-N1063 PolarHBondContact O-ND2 2.99Å; G933-N1063 PolarHBondContact O-OD1 3.42Å; L1057-N1063 HydrophobicContact CD1-CB 3.9Å; L1057-N1063 WeakPolarHBondContact CD1-O 3.23Å; T1061-N1063 PolarHBondContact O-N 3.44Å; T1061-N1063 VanDerWaalsContact O-N 3.09Å; T1061-N1063 PolarHBondContact OG1-N 3.43Å; N1063-L1074 HydrophobicContact CB-CD2 3.87Å; N1063-S1091 WeakPolarHBondContact CB-OG 3.48Å; N1063-S1091 PolarHBondContact ND2-O 3.26Å; N1063-S1091 PolarHBondContact ND2-OG 3.44Å; N1063-Q1093 PolarHBondContact OD1-NE2 3.38Å
1064	R	88.1	Confident	85.7	Confident	61 Å²	61	52.3 Å²	52.3	23%	0.23	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	-64.1	-42.4	176.5	173.8	61.2	176.1	-149.2	9.2	112.6	E198 L1057 T1061 I1062	E198-R1064 VanDerWaalsContact CD-NH2 3.29Å; E198-R1064 IonicContact OE1-CZ 3.64Å; E198-R1064 IonicContact OE1-NH2 2.68Å; E198-R1064 PolarHBondContact OE1-NH2 3.4Å; E198-R1064 IonicContact OE2-CZ 3.43Å; E198-R1064 IonicContact OE2-NH1 2.64Å; E198-R1064 PolarHBondContact OE2-NH1 2.86Å; E198-R1064 IonicContact OE2-NH2 2.69Å; E198-R1064 PolarHBondContact OE2-NH2 2.76Å; L1057-R1064 HydrophobicContact CB-CB 4.18Å; L1057-R1064 VanDerWaalsContact O-CD 3.28Å; L1057-R1064 WeakPolarHBondContact O-CD 3.45Å; L1057-R1064 PolarHBondContact O-NH1 3.29Å; T1061-R1064 HydrophobicContact CG2-CB 4.34Å; T1061-R1064 WeakPolarHBondContact O-CB 3.45Å; T1061-R1064 PolarHBondContact O-N 2.84Å; T1061-R1064 VanDerWaalsContact O-N 3.11Å; I1062-R1064 VanDerWaalsContact C-N 3.25Å; I1062-R1064 PolarHBondContact O-N 3.4Å
1065	E	77.3	Confident	86.2	Confident	174 Å²	174	49.2 Å²	49.2	81%	0.813	23%	0.232	S	C	*	.	S	Bend	trans	-105	8.8	-178.8	-61.5	-168.6	170.7	0	0	112.7	T1067	E1065-T1067 PolarHBondContact O-N 3.34Å; E1065-T1067 VanDerWaalsContact O-N 3.09Å
1066	A	73.4	Confident	86.4	Confident	36 Å²	36	49.7 Å²	49.7	30%	0.298	23%	0.234	S	C	.	.			trans	-63.2	114.6	-179.8	0	0	0	0	0	110.7	R1068 L1069	A1066-R1068 VanDerWaalsContact C-N 3.31Å; A1066-L1069 HydrophobicContact CB-CD2 3.75Å
1067	T	67.8	Low	86.6	Confident	139 Å²	139	49.6 Å²	49.6	85%	0.853	23%	0.232	S	C	*	.	S	Bend	trans	-75.4	-21.3	179.1	55	0	0	0	0	113.1	E1065	E1065-T1067 PolarHBondContact O-N 3.34Å; E1065-T1067 VanDerWaalsContact O-N 3.09Å
1068	R	73.6	Confident	86.4	Confident	151 Å²	151	52.7 Å²	52.7	57%	0.57	25%	0.247	S	C	*	.			trans	-140.3	117.5	179	-170.6	178.8	-177.5	-157.3	0.1	109.1	A1066 D1187	A1066-R1068 VanDerWaalsContact C-N 3.31Å; R1068-D1187 IonicContact CZ-OD1 2.73Å; R1068-D1187 IonicContact CZ-OD2 3.52Å; R1068-D1187 IonicContact NE-OD1 3.58Å; R1068-D1187 PolarHBondContact NE-OD1 3.44Å; R1068-D1187 IonicContact NH2-OD1 2.7Å; R1068-D1187 PolarHBondContact NH2-OD1 2.69Å; R1068-D1187 IonicContact NH2-OD2 3.25Å; R1068-D1187 PolarHBondContact NH2-OD2 2.89Å
1069	L	79.7	Confident	86.4	Confident	2 Å²	2	51.3 Å²	51.3	1%	0.01	24%	0.244	C	C	.	.			trans	-97.6	127.3	173.5	-62	170	0	0	0	108.2	V1030 A1066 S1071 Q1093	V1030-L1069 HydrophobicContact CB-CD1 4.41Å; V1030-L1069 HydrophobicContact CG1-CD1 3.67Å; V1030-L1069 HydrophobicContact CG2-CD1 3.89Å; A1066-L1069 HydrophobicContact CB-CD2 3.75Å; L1069-S1071 VanDerWaalsContact C-N 3.32Å; L1069-Q1093 HydrophobicContact CD2-CG 4.28Å; L1069-Q1093 VanDerWaalsContact CD2-NE2 3.32Å
1070	R	79.5	Confident	86.4	Confident	129 Å²	129	46.5 Å²	46.5	49%	0.487	23%	0.225	S	C	.	.	S	Bend	trans	-73.2	-28.1	177.6	-67.5	-177	171.9	-170.2	-4.1	112.1	D931 C1183	D931-R1070 PolarHBondContact O-NE 3.03Å; D931-R1070 PolarHBondContact O-NH1 3.38Å; D931-R1070 IonicContact OD1-NH2 2.87Å; D931-R1070 IonicContact OD2-CZ 3.92Å; D931-R1070 IonicContact OD2-NH2 3.67Å; D931-R1070 PolarHBondContact OD2-NH2 2.69Å; R1070-C1183 WeakPolarHBondContact O-CB 3.34Å
1071	S	86.9	Confident	86.1	Confident	3 Å²	3	47.9 Å²	47.9	2%	0.021	23%	0.228	C	C	.	.			trans	-126.1	149.7	176.8	-179	0	0	0	0	111.2	L1069 W1073 V1094	L1069-S1071 VanDerWaalsContact C-N 3.32Å; S1071-W1073 PolarHBondContact OG-N 2.94Å; S1071-W1073 PolarHBondContact OG-O 2.7Å; S1071-V1094 VanDerWaalsContact CB-O 3.27Å; S1071-V1094 WeakPolarHBondContact CB-O 3.19Å; S1071-V1094 PolarHBondContact OG-O 3.14Å
1072	R	87.7	Confident	85.3	Confident	52 Å²	52	50.1 Å²	50.1	20%	0.196	24%	0.243	C	C	.	.	S	Bend	trans	-79.3	-6.2	169.7	-63.2	-173.9	-178.8	-175.1	3.8	113.1	V1030 F1186	V1030-R1072 WeakPolarHBondContact CB-O 3.36Å; V1030-R1072 VanDerWaalsContact CG2-O 3.32Å; V1030-R1072 WeakPolarHBondContact CG2-O 3.39Å; V1030-R1072 PolarHBondContact N-O 2.73Å; R1072-F1186 HydrophobicContact CG-CB 4.38Å; R1072-F1186 HydrophobicContact CG-CD1 3.7Å; R1072-F1186 HydrophobicContact CG-CD2 4.15Å; R1072-F1186 HydrophobicContact CG-CE1 3.91Å; R1072-F1186 HydrophobicContact CG-CE2 4.35Å; R1072-F1186 HydrophobicContact CG-CG 3.79Å; R1072-F1186 HydrophobicContact CG-CZ 4.21Å; R1072-F1186 VanDerWaalsContact CZ-CD2 3.45Å
1073	W	93.9	Very high	84.5	Confident	6 Å²	6	54.5 Å²	54.5	2%	0.023	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	133.7	-176	-63.2	-86.3	0	0	0	110.8	C346 L1027 I1028 S1071 Q1093 V1094 P1096 V1099 L1125 L1126 L1128	C346-W1073 HydrophobicContact CB-CH2 3.88Å; L1027-W1073 HydrophobicContact CD1-CB 4.14Å; I1028-W1073 VanDerWaalsContact O-CA 3.28Å; I1028-W1073 WeakPolarHBondContact O-CA 3.49Å; S1071-W1073 PolarHBondContact OG-N 2.94Å; S1071-W1073 PolarHBondContact OG-O 2.7Å; W1073-Q1093 WeakPolarHBondContact O-CA 3.31Å; W1073-V1094 PolarHBondContact O-N 2.92Å; W1073-P1096 HydrophobicContact CE3-CB 3.79Å; W1073-P1096 HydrophobicContact CE3-CG 4.37Å; W1073-P1096 HydrophobicContact CH2-CB 4.13Å; W1073-P1096 HydrophobicContact CZ3-CB 3.51Å; W1073-P1096 HydrophobicContact CZ3-CG 4Å; W1073-V1099 HydrophobicContact CB-CG2 4.14Å; W1073-V1099 HydrophobicContact CG-CG2 4.36Å; W1073-L1125 PolarHBondContact NE1-O 2.94Å; W1073-L1126 HydrophobicContact CD2-CD1 4.15Å; W1073-L1126 VanDerWaalsContact CE2-CD1 3.47Å; W1073-L1126 HydrophobicContact CH2-CD1 4.1Å; W1073-L1126 HydrophobicContact CZ2-CD1 3.45Å; W1073-L1126 VanDerWaalsContact CZ2-CD1 3.45Å; W1073-L1128 HydrophobicContact CH2-CD2 4.1Å
1074	L	96	Very high	83.5	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	150.7	171.7	-58	83.8	0	0	0	109.7	I1028 V1030 N1063 S1092 Q1093	I1028-L1074 HydrophobicContact CB-CB 4.15Å; I1028-L1074 HydrophobicContact CD1-CB 4.33Å; I1028-L1074 HydrophobicContact CG2-CD1 4.35Å; I1028-L1074 PolarHBondContact N-O 2.76Å; I1028-L1074 PolarHBondContact O-N 3.04Å; V1030-L1074 HydrophobicContact CG2-CD1 3.14Å; N1063-L1074 HydrophobicContact CB-CD2 3.87Å; L1074-S1092 CarbonylContact C-O 2.96Å; L1074-S1092 WeakPolarHBondContact CA-O 3.38Å; L1074-S1092 WeakPolarHBondContact CB-O 3.26Å; L1074-Q1093 HydrophobicContact CD2-CG 4.24Å; L1074-Q1093 HydrophobicContact CG-CG 4.17Å
1075	T	97.2	Very high	83.2	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	156.7	165.5	-168.9	0	0	0	0	110.2	L1019 M1020 L1023 N1026 S1091 S1092 V1094	L1019-T1075 HydrophobicContact CD2-CG2 4.46Å; L1019-T1075 HydrophobicContact CG-CG2 4.44Å; M1020-T1075 HydrophobicContact CB-CG2 3.92Å; M1020-T1075 HydrophobicContact CG-CG2 4.49Å; L1023-T1075 HydrophobicContact CD1-CG2 4.45Å; N1026-T1075 WeakPolarHBondContact O-CA 3.38Å; N1026-T1075 PolarHBondContact O-OG1 3.36Å; T1075-S1091 CarbonylContact O-C 3.26Å; T1075-S1091 VanDerWaalsContact O-CA 3.27Å; T1075-S1091 WeakPolarHBondContact O-CA 3.37Å; T1075-S1092 PolarHBondContact N-O 2.93Å; T1075-S1092 PolarHBondContact O-N 2.86Å; T1075-V1094 HydrophobicContact CG2-CG2 3.69Å
1076	Y	96.7	Very high	83.6	Confident	17 Å²	17	49.5 Å²	49.5	7%	0.067	27%	0.271	C	S	.	.			trans	-152.4	155.9	179.7	68	-78.8	0	0	0	111.7	N1026 I1028 T1050 A1079 V1088 D1090	N1026-Y1076 HydrophobicContact CB-CD1 4.03Å; N1026-Y1076 HydrophobicContact CB-CE1 3.8Å; N1026-Y1076 HydrophobicContact CB-CE2 4.32Å; N1026-Y1076 HydrophobicContact CB-CG 4.4Å; N1026-Y1076 WeakPolarHBondContact CB-O 3.39Å; N1026-Y1076 PolarHBondContact ND2-O 2.84Å; I1028-Y1076 HydrophobicContact CD1-CD1 3.47Å; I1028-Y1076 VanDerWaalsContact CD1-CD1 3.47Å; I1028-Y1076 HydrophobicContact CD1-CE1 3.98Å; I1028-Y1076 HydrophobicContact CD1-CG 4.16Å; I1028-Y1076 HydrophobicContact CG1-CD1 3.62Å; I1028-Y1076 HydrophobicContact CG1-CE1 3.68Å; T1050-Y1076 HydrophobicContact CG2-CE1 4.01Å; Y1076-A1079 HydrophobicContact CD2-CB 4.23Å; Y1076-A1079 HydrophobicContact CE2-CB 3.75Å; Y1076-V1088 VanDerWaalsContact CB-CG1 3.44Å; Y1076-V1088 HydrophobicContact CD1-CG1 4.48Å; Y1076-V1088 HydrophobicContact CD1-CG2 4.42Å; Y1076-V1088 HydrophobicContact CD2-CB 4.46Å; Y1076-V1088 HydrophobicContact CD2-CG1 3.91Å; Y1076-V1088 HydrophobicContact CD2-CG2 3.81Å; Y1076-V1088 HydrophobicContact CE2-CG2 3.95Å; Y1076-V1088 HydrophobicContact CG-CG1 3.7Å; Y1076-V1088 HydrophobicContact CG-CG2 4.05Å; Y1076-D1090 WeakPolarHBondContact CB-O 3.14Å
1077	F	94.4	Very high	84.5	Confident	34 Å²	34	49.8 Å²	49.8	15%	0.149	27%	0.265	C	S	.	.	S	Bend	trans	-106	-54.1	172.8	179.1	-116.9	0	0	0	112.3	D880 L883 L906 L1023 D1090	D880-F1077 HydrophobicContact CB-CE2 4.06Å; D880-F1077 HydrophobicContact CB-CZ 3.93Å; L883-F1077 HydrophobicContact CD1-CD1 4.18Å; L883-F1077 HydrophobicContact CD1-CD2 4.33Å; L883-F1077 HydrophobicContact CD1-CE1 3.66Å; L883-F1077 HydrophobicContact CD1-CE2 3.82Å; L883-F1077 HydrophobicContact CD1-CZ 3.46Å; L883-F1077 VanDerWaalsContact CD1-CZ 3.46Å; L883-F1077 HydrophobicContact CD2-CD1 4.3Å; L883-F1077 HydrophobicContact CD2-CD2 3.66Å; L883-F1077 HydrophobicContact CD2-CE2 3.88Å; L883-F1077 HydrophobicContact CD2-CG 3.89Å; L883-F1077 HydrophobicContact CD2-CZ 4.31Å; L883-F1077 HydrophobicContact CG-CD2 3.89Å; L883-F1077 HydrophobicContact CG-CE1 4.27Å; L883-F1077 HydrophobicContact CG-CE2 3.54Å; L883-F1077 HydrophobicContact CG-CG 4.39Å; L883-F1077 HydrophobicContact CG-CZ 3.76Å; L906-F1077 HydrophobicContact CB-CD1 4.24Å; L906-F1077 HydrophobicContact CD1-CB 3.98Å; L906-F1077 HydrophobicContact CD1-CD1 3.97Å; L906-F1077 HydrophobicContact CD1-CG 4.11Å; L906-F1077 HydrophobicContact CD2-CB 4.48Å; L906-F1077 HydrophobicContact CD2-CD1 4.27Å; L906-F1077 HydrophobicContact CG-CD1 4.39Å; L1023-F1077 HydrophobicContact CD1-CB 4.21Å; L1023-F1077 HydrophobicContact CD2-CB 4.09Å; L1023-F1077 HydrophobicContact CD2-CD2 3.64Å; L1023-F1077 HydrophobicContact CD2-CG 4.26Å; F1077-D1090 PolarHBondContact N-OD2 2.87Å
1078	M	89.8	Confident	85.7	Confident	65 Å²	65	43.2 Å²	43.2	32%	0.32	23%	0.225	S	C	.	.			trans	-94.2	124.1	-174.6	-55.4	179	-77.9	0	0	112	L906 R1089 D1090	L906-M1078 HydrophobicContact CD2-CE 4.03Å; M1078-R1089 HydrophobicContact CB-CB 4.18Å; M1078-R1089 HydrophobicContact CE-CB 4.4Å; M1078-R1089 PolarHBondContact O-N 2.94Å; M1078-D1090 WeakPolarHBondContact CA-OD1 3.42Å; M1078-D1090 WeakPolarHBondContact CB-OD1 3.38Å; M1078-D1090 HydrophobicContact CE-CB 4.24Å; M1078-D1090 WeakPolarHBondContact CE-OD1 3.26Å; M1078-D1090 WeakPolarHBondContact CG-OD1 3.21Å; M1078-D1090 PolarHBondContact N-OD1 3.02Å
1079	A	89.1	Confident	86.4	Confident	18 Å²	18	41.1 Å²	41.1	15%	0.149	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	141.2	165.9	0	0	0	0	0	110.2	V763 Y1076 V1086 F1087 V1088	V763-A1079 HydrophobicContact CG1-CB 3.77Å; Y1076-A1079 HydrophobicContact CD2-CB 4.23Å; Y1076-A1079 HydrophobicContact CE2-CB 3.75Å; A1079-V1086 HydrophobicContact CB-CG1 4.06Å; A1079-F1087 CarbonylContact C-O 3.58Å; A1079-F1087 VanDerWaalsContact CA-O 3.28Å; A1079-F1087 WeakPolarHBondContact CA-O 3.26Å; A1079-V1088 HydrophobicContact CB-CG2 4.24Å
1080	V	84.4	Confident	87	Confident	27 Å²	27	41.2 Å²	41.2	16%	0.164	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	138.1	-178.1	-171.8	0	0	0	0	109	S764 F1087	S764-V1080 WeakPolarHBondContact O-CA 3.44Å; S764-V1080 WeakPolarHBondContact O-CG1 3.38Å; V1080-F1087 PolarHBondContact N-O 3.3Å; V1080-F1087 PolarHBondContact O-N 3.37Å
1081	K	80.3	Confident	87.8	Confident	57 Å²	57	35.1 Å²	35.1	25%	0.248	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	129.4	172.2	-165.7	179.8	-177.6	-173	0	110.4	D758 T761 V763 S764 C765 S1085	D758-K1081 IonicContact OD2-NZ 3.99Å; D758-K1081 PolarHBondContact OD2-NZ 3.43Å; T761-K1081 HydrophobicContact CG2-CD 4.39Å; V763-K1081 HydrophobicContact CG2-CB 3.79Å; S764-K1081 PolarHBondContact O-N 3.33Å; C765-K1081 HydrophobicContact CB-CB 4.33Å; C765-K1081 WeakPolarHBondContact CB-O 3.23Å; K1081-S1085 CarbonylContact C-O 3.52Å; K1081-S1085 WeakPolarHBondContact CA-O 3.28Å
1082	S	74	Confident	88.3	Confident	50 Å²	50	35 Å²	35	35%	0.35	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	137.3	172.5	-172.8	0	0	0	0	109.7	G1084 S1085	S1082-G1084 PolarHBondContact O-N 2.96Å; S1082-G1084 VanDerWaalsContact O-N 3.09Å; S1082-S1085 PolarHBondContact N-O 2.78Å; S1082-S1085 PolarHBondContact O-N 3.41Å; S1082-S1085 VanDerWaalsContact O-O 3.07Å
1083	N	72.8	Confident	88.6	Confident	121 Å²	121	33 Å²	33	65%	0.647	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	47.6	41.7	178.6	-61.3	-15.8	0	0	0	113.8	S1085	N1083-S1085 VanDerWaalsContact C-N 3.27Å; N1083-S1085 PolarHBondContact O-N 2.86Å
1084	G	71.8	Confident	88.7	Confident	66 Å²	66	32.7 Å²	32.7	68%	0.68	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	79.5	-7.4	178.7	0	0	0	0	0	116.1	S1082	S1082-G1084 PolarHBondContact O-N 2.96Å; S1082-G1084 VanDerWaalsContact O-N 3.09Å
1085	S	80.2	Confident	88.5	Confident	48 Å²	48	32.9 Å²	32.9	34%	0.336	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	150.4	179.5	-61.3	0	0	0	0	112	K1081 S1082 N1083	K1081-S1085 CarbonylContact C-O 3.52Å; K1081-S1085 WeakPolarHBondContact CA-O 3.28Å; S1082-S1085 PolarHBondContact N-O 2.78Å; S1082-S1085 PolarHBondContact O-N 3.41Å; S1082-S1085 VanDerWaalsContact O-O 3.07Å; N1083-S1085 VanDerWaalsContact C-N 3.27Å; N1083-S1085 PolarHBondContact O-N 2.86Å
1086	V	87	Confident	88.3	Confident	19 Å²	19	33 Å²	33	12%	0.115	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	124.6	176.1	179.9	0	0	0	0	109.6	T761 V763 I1055 L1056 A1079	T761-V1086 HydrophobicContact CG2-CG2 4.28Å; V763-V1086 HydrophobicContact CG1-CG1 4.06Å; V763-V1086 HydrophobicContact CG2-CG1 4.38Å; V763-V1086 HydrophobicContact CG2-CG2 4.04Å; I1055-V1086 HydrophobicContact CG2-CB 4.08Å; I1055-V1086 HydrophobicContact CG2-CG1 4Å; L1056-V1086 PolarHBondContact N-O 3.05Å; A1079-V1086 HydrophobicContact CB-CG1 4.06Å
1087	F	90.8	Very high	88.2	Confident	42 Å²	42	32.6 Å²	32.6	18%	0.184	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	125.5	-179.4	-68.5	-88.3	0	0	0	111.5	L1056 H1058 A1079 V1080	L1056-F1087 HydrophobicContact CB-CD1 3.74Å; L1056-F1087 HydrophobicContact CB-CE1 3.76Å; L1056-F1087 HydrophobicContact CD1-CD1 4.46Å; L1056-F1087 HydrophobicContact CD1-CE1 3.69Å; L1056-F1087 HydrophobicContact CD1-CZ 3.81Å; L1056-F1087 HydrophobicContact CG-CE1 4.39Å; L1056-F1087 CarbonylContact O-C 3.48Å; L1056-F1087 VanDerWaalsContact O-CA 3.25Å; L1056-F1087 WeakPolarHBondContact O-CA 3.49Å; H1058-F1087 HydrophobicContact CB-CB 4.22Å; A1079-F1087 CarbonylContact C-O 3.58Å; A1079-F1087 VanDerWaalsContact CA-O 3.28Å; A1079-F1087 WeakPolarHBondContact CA-O 3.26Å; V1080-F1087 PolarHBondContact N-O 3.3Å; V1080-F1087 PolarHBondContact O-N 3.37Å
1088	V	92.8	Very high	88.3	Confident	0 Å²	0	31 Å²	31	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	123.2	175.1	169	0	0	0	0	110	I1028 I1055 L1056 L1057 H1058 Y1076 A1079 D1090	I1028-V1088 HydrophobicContact CD1-CG1 4.2Å; I1028-V1088 HydrophobicContact CD1-CG2 4.18Å; I1055-V1088 HydrophobicContact CB-CG2 4.45Å; I1055-V1088 HydrophobicContact CD1-CB 4.24Å; I1055-V1088 HydrophobicContact CD1-CG2 3.7Å; I1055-V1088 HydrophobicContact CG1-CG2 4.12Å; L1056-V1088 PolarHBondContact O-N 2.88Å; L1057-V1088 HydrophobicContact CD2-CB 4Å; L1057-V1088 HydrophobicContact CD2-CG1 4.13Å; H1058-V1088 WeakPolarHBondContact CB-O 3.36Å; H1058-V1088 PolarHBondContact N-O 3.08Å; Y1076-V1088 VanDerWaalsContact CB-CG1 3.44Å; Y1076-V1088 HydrophobicContact CD1-CG1 4.48Å; Y1076-V1088 HydrophobicContact CD1-CG2 4.42Å; Y1076-V1088 HydrophobicContact CD2-CB 4.46Å; Y1076-V1088 HydrophobicContact CD2-CG1 3.91Å; Y1076-V1088 HydrophobicContact CD2-CG2 3.81Å; Y1076-V1088 HydrophobicContact CE2-CG2 3.95Å; Y1076-V1088 HydrophobicContact CG-CG1 3.7Å; Y1076-V1088 HydrophobicContact CG-CG2 4.05Å; A1079-V1088 HydrophobicContact CB-CG2 4.24Å; V1088-D1090 WeakPolarHBondContact CG1-O 3.42Å
1089	R	89.2	Confident	88.5	Confident	108 Å²	108	27.9 Å²	27.9	41%	0.408	16%	0.163	S	C	.	.			trans	-90.8	-27.9	-171.5	-75.6	-172.2	170.7	172.3	1.9	115.1	H1058 S1060 M1078	H1058-R1089 HydrophobicContact CB-CG 4.09Å; S1060-R1089 PolarHBondContact OG-O 3.2Å; M1078-R1089 HydrophobicContact CB-CB 4.18Å; M1078-R1089 HydrophobicContact CE-CB 4.4Å; M1078-R1089 PolarHBondContact O-N 2.94Å
1090	D	93.2	Very high	88.8	Confident	4 Å²	4	27.1 Å²	27.1	2%	0.021	16%	0.157	C	C	.	.			trans	-130.7	145.7	177.5	57.7	-82.9	0	0	0	109.2	H936 Y1076 F1077 M1078 V1088	H936-D1090 IonicContact CE1-OD2 3.42Å; H936-D1090 PolarHBondContact CE1-OD2 3.42Å; H936-D1090 VanDerWaalsContact CE1-OD2 3.26Å; H936-D1090 IonicContact NE2-OD2 2.81Å; H936-D1090 PolarHBondContact NE2-OD2 3.07Å; H936-D1090 VanDerWaalsContact NE2-OD2 3.13Å; Y1076-D1090 WeakPolarHBondContact CB-O 3.14Å; F1077-D1090 PolarHBondContact N-OD2 2.87Å; M1078-D1090 WeakPolarHBondContact CA-OD1 3.42Å; M1078-D1090 WeakPolarHBondContact CB-OD1 3.38Å; M1078-D1090 HydrophobicContact CE-CB 4.24Å; M1078-D1090 WeakPolarHBondContact CE-OD1 3.26Å; M1078-D1090 WeakPolarHBondContact CG-OD1 3.21Å; M1078-D1090 PolarHBondContact N-OD1 3.02Å; V1088-D1090 WeakPolarHBondContact CG1-O 3.42Å
1091	S	96.2	Very high	89.3	Confident	0 Å²	0	26 Å²	26	0%	0	15%	0.15	C	C	.	.			trans	-155.5	152.5	174.3	70.1	0	0	0	0	113.7	D935 T1061 N1063 T1075	D935-S1091 PolarHBondContact N-O 3.07Å; D935-S1091 PolarHBondContact OD2-N 3.4Å; T1061-S1091 PolarHBondContact OG1-N 2.91Å; T1061-S1091 PolarHBondContact OG1-OG 3.19Å; N1063-S1091 WeakPolarHBondContact CB-OG 3.48Å; N1063-S1091 PolarHBondContact ND2-O 3.26Å; N1063-S1091 PolarHBondContact ND2-OG 3.44Å; T1075-S1091 CarbonylContact O-C 3.26Å; T1075-S1091 VanDerWaalsContact O-CA 3.27Å; T1075-S1091 WeakPolarHBondContact O-CA 3.37Å
1092	S	96.8	Very high	90	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	132.5	172.2	-67.8	0	0	0	0	111.8	S934 H936 L1074 T1075 V1094	S934-S1092 WeakPolarHBondContact CA-OG 3.26Å; S934-S1092 WeakPolarHBondContact CB-OG 3.42Å; S934-S1092 WeakPolarHBondContact OG-CB 3.3Å; S934-S1092 PolarHBondContact OG-OG 3.22Å; H936-S1092 PolarHBondContact ND1-OG 3.14Å; L1074-S1092 CarbonylContact C-O 2.96Å; L1074-S1092 WeakPolarHBondContact CA-O 3.38Å; L1074-S1092 WeakPolarHBondContact CB-O 3.26Å; T1075-S1092 PolarHBondContact N-O 2.93Å; T1075-S1092 PolarHBondContact O-N 2.86Å; S1092-V1094 WeakPolarHBondContact O-CG2 3.45Å
1093	Q	94.9	Very high	90.8	Very high	10 Å²	10	21.6 Å²	21.6	5%	0.047	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	126.6	172.6	-64.2	177.3	42.9	0	0	110.8	G933 K1016 N1063 L1069 W1073 L1074	G933-Q1093 WeakPolarHBondContact O-CG 3.36Å; G933-Q1093 PolarHBondContact O-N 2.96Å; K1016-Q1093 VanDerWaalsContact CD-O 3.28Å; K1016-Q1093 WeakPolarHBondContact CD-O 3.44Å; K1016-Q1093 WeakPolarHBondContact CE-O 3.25Å; K1016-Q1093 PolarHBondContact NZ-O 3.3Å; N1063-Q1093 PolarHBondContact OD1-NE2 3.38Å; L1069-Q1093 HydrophobicContact CD2-CG 4.28Å; L1069-Q1093 VanDerWaalsContact CD2-NE2 3.32Å; W1073-Q1093 WeakPolarHBondContact O-CA 3.31Å; L1074-Q1093 HydrophobicContact CD2-CG 4.24Å; L1074-Q1093 HydrophobicContact CG-CG 4.17Å
1094	V	94.6	Very high	91.2	Very high	0 Å²	0	20 Å²	20	0%	0	12%	0.116	C	C	.	.			trans	-118.2	136.3	-171.9	-173.5	0	0	0	0	111	M1020 S1071 W1073 T1075 S1092 A1098 V1099	M1020-V1094 HydrophobicContact CB-CG1 3.94Å; M1020-V1094 HydrophobicContact CB-CG2 3.88Å; M1020-V1094 HydrophobicContact CE-CG1 4.44Å; M1020-V1094 HydrophobicContact CG-CG1 4.08Å; M1020-V1094 HydrophobicContact CG-CG2 4.1Å; S1071-V1094 VanDerWaalsContact CB-O 3.27Å; S1071-V1094 WeakPolarHBondContact CB-O 3.19Å; S1071-V1094 PolarHBondContact OG-O 3.14Å; W1073-V1094 PolarHBondContact O-N 2.92Å; T1075-V1094 HydrophobicContact CG2-CG2 3.69Å; S1092-V1094 WeakPolarHBondContact O-CG2 3.45Å; V1094-A1098 HydrophobicContact CG1-CB 4.07Å; V1094-V1099 HydrophobicContact CB-CG2 4.4Å; V1094-V1099 HydrophobicContact CG1-CG2 3.99Å
1095	H	93.4	Very high	91.6	Very high	4 Å²	4	17.4 Å²	17.4	2%	0.019	9%	0.09	C	C	.	.			trans	-58.5	134.3	175.7	-166.4	-76.9	0	0	0	112.4	L1097 A1098 V1099 L1179 G1181 C1183	H1095-L1097 VanDerWaalsContact C-N 3.31Å; H1095-L1097 WeakPolarHBondContact ND1-CB 3.25Å; H1095-L1097 PolarHBondContact ND1-N 3.19Å; H1095-L1097 PolarHBondContact O-N 3.03Å; H1095-A1098 HydrophobicContact CB-CB 4.23Å; H1095-A1098 WeakPolarHBondContact O-CB 3.23Å; H1095-A1098 PolarHBondContact O-N 3.33Å; H1095-V1099 PolarHBondContact O-N 3.37Å; H1095-L1179 HydrophobicContact CB-CD2 4.26Å; H1095-G1181 PolarHBondContact NE2-O 3.22Å; H1095-C1183 PolarHBondContact CD2-SG 3.22Å
1096	P	92.6	Very high	91.9	Very high	3 Å²	3	20.8 Å²	20.8	2%	0.019	10%	0.104	C	C	.	.	H	α-helix	trans	-56.5	-40.4	-179.2	15.2	-27.7	0	0	0	114.2	W1073 A1098 V1099 L1100 L1128 C1183	W1073-P1096 HydrophobicContact CE3-CB 3.79Å; W1073-P1096 HydrophobicContact CE3-CG 4.37Å; W1073-P1096 HydrophobicContact CH2-CB 4.13Å; W1073-P1096 HydrophobicContact CZ3-CB 3.51Å; W1073-P1096 HydrophobicContact CZ3-CG 4Å; P1096-A1098 VanDerWaalsContact C-N 3.29Å; P1096-A1098 PolarHBondContact O-N 2.84Å; P1096-V1099 WeakPolarHBondContact O-CB 3.33Å; P1096-V1099 PolarHBondContact O-N 2.94Å; P1096-L1100 PolarHBondContact O-N 3.27Å; P1096-L1128 HydrophobicContact CB-CD2 4.15Å; P1096-C1183 WeakPolarHBondContact CG-O 3.41Å
1097	L	94.2	Very high	92.1	Very high	9 Å²	9	21.5 Å²	21.5	5%	0.047	11%	0.109	C	C	.	.	H	α-helix	trans	-66	-30.7	176.4	-63	178.3	0	0	0	112.4	I348 V350 H1095 V1099 L1100 L1101 L1128 L1138 L1178 L1179	I348-L1097 HydrophobicContact CD1-CD2 4.31Å; I348-L1097 HydrophobicContact CG2-CD2 4.33Å; V350-L1097 HydrophobicContact CG2-CD1 4.3Å; H1095-L1097 VanDerWaalsContact C-N 3.31Å; H1095-L1097 WeakPolarHBondContact ND1-CB 3.25Å; H1095-L1097 PolarHBondContact ND1-N 3.19Å; H1095-L1097 PolarHBondContact O-N 3.03Å; L1097-V1099 VanDerWaalsContact C-N 3.34Å; L1097-L1100 HydrophobicContact CD2-CD2 4.4Å; L1097-L1100 PolarHBondContact O-N 2.96Å; L1097-L1101 HydrophobicContact CB-CD1 4.31Å; L1097-L1101 WeakPolarHBondContact O-CB 3.47Å; L1097-L1101 WeakPolarHBondContact O-CG 3.39Å; L1097-L1101 PolarHBondContact O-N 3.2Å; L1097-L1128 HydrophobicContact CD2-CD1 4.5Å; L1097-L1138 HydrophobicContact CD2-CD1 3.9Å; L1097-L1138 HydrophobicContact CD2-CD2 4.45Å; L1097-L1178 HydrophobicContact CD1-CD1 3.8Å; L1097-L1178 HydrophobicContact CD1-CD2 4.2Å; L1097-L1178 HydrophobicContact CD1-CG 3.84Å; L1097-L1179 HydrophobicContact CB-CD2 4.05Å
1098	A	95.4	Very high	92.1	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-66.6	-39.6	173.1	0	0	0	0	0	110.8	M1020 V1094 H1095 P1096 L1101 L1102 L1179	M1020-A1098 WeakPolarHBondContact CE-O 3.41Å; V1094-A1098 HydrophobicContact CG1-CB 4.07Å; H1095-A1098 HydrophobicContact CB-CB 4.23Å; H1095-A1098 WeakPolarHBondContact O-CB 3.23Å; H1095-A1098 PolarHBondContact O-N 3.33Å; P1096-A1098 VanDerWaalsContact C-N 3.29Å; P1096-A1098 PolarHBondContact O-N 2.84Å; A1098-L1101 PolarHBondContact O-N 3.07Å; A1098-L1102 HydrophobicContact CB-CD1 4.22Å; A1098-L1102 VanDerWaalsContact O-CB 3.3Å; A1098-L1102 WeakPolarHBondContact O-CB 3.35Å; A1098-L1102 WeakPolarHBondContact O-CG 3.46Å; A1098-L1102 PolarHBondContact O-N 3.23Å; A1098-L1179 HydrophobicContact CB-CD1 4.22Å; A1098-L1179 HydrophobicContact CB-CD2 3.89Å
1099	V	94.5	Very high	92	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-60.8	-45.2	172.5	-168.7	0	0	0	0	111.3	M1020 L1027 W1073 V1094 H1095 P1096 L1097 T1103 L1120 L1126	M1020-V1099 VanDerWaalsContact CE-CA 3.46Å; M1020-V1099 HydrophobicContact CE-CB 4.29Å; M1020-V1099 HydrophobicContact CE-CG2 4.24Å; M1020-V1099 HydrophobicContact SD-CG1 4.3Å; M1020-V1099 HydrophobicContact SD-CG2 4.37Å; L1027-V1099 HydrophobicContact CD1-CG1 4.07Å; L1027-V1099 HydrophobicContact CD1-CG2 4.11Å; L1027-V1099 HydrophobicContact CD2-CG1 3.66Å; W1073-V1099 HydrophobicContact CB-CG2 4.14Å; W1073-V1099 HydrophobicContact CG-CG2 4.36Å; V1094-V1099 HydrophobicContact CB-CG2 4.4Å; V1094-V1099 HydrophobicContact CG1-CG2 3.99Å; H1095-V1099 PolarHBondContact O-N 3.37Å; P1096-V1099 WeakPolarHBondContact O-CB 3.33Å; P1096-V1099 PolarHBondContact O-N 2.94Å; L1097-V1099 VanDerWaalsContact C-N 3.34Å; V1099-T1103 HydrophobicContact CG1-CG2 4.21Å; V1099-T1103 WeakPolarHBondContact O-CB 3.36Å; V1099-T1103 WeakPolarHBondContact O-CG2 3.3Å; V1099-T1103 PolarHBondContact O-OG1 2.8Å; V1099-L1120 HydrophobicContact CG1-CD1 4.27Å; V1099-L1126 HydrophobicContact CB-CD1 4.46Å; V1099-L1126 HydrophobicContact CB-CD2 4.04Å; V1099-L1126 HydrophobicContact CG1-CD1 4.49Å; V1099-L1126 HydrophobicContact CG1-CD2 3.84Å
1100	L	94.9	Very high	92.2	Very high	1 Å²	1	29.2 Å²	29.2	1%	0.005	14%	0.143	C	C	.	.	H	α-helix	trans	-65.9	-39.9	178.6	177.5	63.8	0	0	0	113	P1096 L1097 V1107 I1118 L1126 L1128 L1138 R1142	P1096-L1100 PolarHBondContact O-N 3.27Å; L1097-L1100 HydrophobicContact CD2-CD2 4.4Å; L1097-L1100 PolarHBondContact O-N 2.96Å; L1100-V1107 HydrophobicContact CD1-CG1 4.03Å; L1100-I1118 HydrophobicContact CD1-CD1 3.73Å; L1100-I1118 HydrophobicContact CD1-CG1 3.79Å; L1100-I1118 HydrophobicContact CD1-CG2 4.11Å; L1100-I1118 HydrophobicContact CD2-CD1 4.26Å; L1100-I1118 HydrophobicContact CD2-CG2 3.99Å; L1100-L1126 HydrophobicContact CB-CD2 3.99Å; L1100-L1126 HydrophobicContact CD1-CD2 4.44Å; L1100-L1128 HydrophobicContact CB-CD1 3.93Å; L1100-L1128 HydrophobicContact CD2-CD1 3.97Å; L1100-L1128 HydrophobicContact CG-CD1 4.4Å; L1100-L1138 HydrophobicContact CD2-CB 4.32Å; L1100-L1138 HydrophobicContact CD2-CD1 4.26Å; L1100-R1142 VanDerWaalsContact O-CD 3.3Å; L1100-R1142 WeakPolarHBondContact O-CD 3.28Å; L1100-R1142 PolarHBondContact O-NE 3.27Å; L1100-R1142 PolarHBondContact O-NH1 3.01Å
1101	L	95.7	Very high	92.1	Very high	4 Å²	4	32.3 Å²	32.3	2%	0.021	16%	0.16	C	C	.	.	H	α-helix	trans	-93.2	-29.9	-166.4	-67	173.2	0	0	0	113.3	L1097 A1098 L1138 F1141 R1142 L1145 L1175 L1178	L1097-L1101 HydrophobicContact CB-CD1 4.31Å; L1097-L1101 WeakPolarHBondContact O-CB 3.47Å; L1097-L1101 WeakPolarHBondContact O-CG 3.39Å; L1097-L1101 PolarHBondContact O-N 3.2Å; A1098-L1101 PolarHBondContact O-N 3.07Å; L1101-L1138 HydrophobicContact CD2-CD2 4.44Å; L1101-L1138 WeakPolarHBondContact CD2-O 3.48Å; L1101-F1141 HydrophobicContact CD1-CD1 3.98Å; L1101-F1141 HydrophobicContact CD1-CE1 4.21Å; L1101-F1141 HydrophobicContact CD2-CD1 4.07Å; L1101-R1142 HydrophobicContact CD2-CB 3.91Å; L1101-R1142 PolarHBondContact O-NH1 3.34Å; L1101-L1145 HydrophobicContact CB-CD1 4.01Å; L1101-L1175 HydrophobicContact CD1-CD1 3.91Å; L1101-L1178 HydrophobicContact CD1-CD2 3.61Å
1102	L	96.1	Very high	91.8	Very high	10 Å²	10	37.4 Å²	37.4	5%	0.052	19%	0.187	C	C	.	.	H	α-helix	trans	-107.6	-13.1	-169.2	-53.8	-179.5	0	0	0	114.9	F893 L1014 V1018 M1020 A1021 A1098 L1145 L1175	F893-L1102 HydrophobicContact CD1-CD2 4.35Å; F893-L1102 HydrophobicContact CE1-CD2 3.44Å; F893-L1102 VanDerWaalsContact CE1-CD2 3.44Å; F893-L1102 HydrophobicContact CE2-CD2 4.5Å; F893-L1102 HydrophobicContact CZ-CD2 3.54Å; L1014-L1102 HydrophobicContact CD1-CD1 4.47Å; V1018-L1102 HydrophobicContact CG2-CD1 4.3Å; M1020-L1102 HydrophobicContact CE-CB 4.49Å; A1021-L1102 HydrophobicContact CB-CB 3.8Å; A1021-L1102 VanDerWaalsContact CB-O 3.26Å; A1021-L1102 WeakPolarHBondContact CB-O 3.45Å; A1098-L1102 HydrophobicContact CB-CD1 4.22Å; A1098-L1102 VanDerWaalsContact O-CB 3.3Å; A1098-L1102 WeakPolarHBondContact O-CB 3.35Å; A1098-L1102 WeakPolarHBondContact O-CG 3.46Å; A1098-L1102 PolarHBondContact O-N 3.23Å; L1102-L1145 HydrophobicContact CD2-CD1 4.25Å; L1102-L1175 HydrophobicContact CD2-CD2 3.94Å
1103	T	90.4	Very high	91.2	Very high	4 Å²	4	40.2 Å²	40.2	3%	0.025	22%	0.216	C	C	.	.			trans	-68.3	154.7	173.3	51.1	0	0	0	0	110.6	M1020 Y1024 V1099 L1120 R1142	M1020-T1103 HydrophobicContact CE-CG2 3.95Å; M1020-T1103 HydrophobicContact SD-CG2 3.67Å; Y1024-T1103 HydrophobicContact CD2-CG2 3.46Å; Y1024-T1103 VanDerWaalsContact CD2-CG2 3.46Å; Y1024-T1103 HydrophobicContact CE2-CG2 3.77Å; Y1024-T1103 HydrophobicContact CG-CG2 3.9Å; V1099-T1103 HydrophobicContact CG1-CG2 4.21Å; V1099-T1103 WeakPolarHBondContact O-CB 3.36Å; V1099-T1103 WeakPolarHBondContact O-CG2 3.3Å; V1099-T1103 PolarHBondContact O-OG1 2.8Å; T1103-L1120 WeakPolarHBondContact OG1-CD2 3.39Å; T1103-R1142 PolarHBondContact O-NH1 3.49Å; T1103-R1142 PolarHBondContact O-NH2 2.92Å; T1103-R1142 PolarHBondContact OG1-NH2 3.2Å
1104	D	80.2	Confident	90.8	Very high	87 Å²	87	50 Å²	50	47%	0.465	25%	0.252	S	S	.	.			trans	-89.3	-6.5	179.4	-61	-43.1	0	0	0	113.7	K885	K885-D1104 WeakPolarHBondContact CE-OD2 3.35Å; K885-D1104 IonicContact NZ-OD2 3.5Å; K885-D1104 PolarHBondContact NZ-OD2 3.19Å
1105	G	80.8	Confident	90.7	Very high	13 Å²	13	56.9 Å²	56.9	13%	0.134	28%	0.278	C	S	.	.	S	Bend	trans	-68.2	145.9	-177.6	0	0	0	0	0	113.5	R1142	G1105-R1142 PolarHBondContact O-NH2 3Å
1106	D	85.5	Confident	90.7	Very high	118 Å²	118	56.8 Å²	56.8	63%	0.631	28%	0.278	S	S	*	.			trans	-60.6	155.2	173.3	-76.7	-40	0	0	0	111.6	S1121	D1106-S1121 WeakPolarHBondContact O-CB 3.24Å; D1106-S1121 PolarHBondContact O-N 3.31Å; D1106-S1121 PolarHBondContact O-OG 3.48Å
1107	V	91.1	Very high	90.7	Very high	35 Å²	35	58.6 Å²	58.6	21%	0.212	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	133.6	177.6	-68.4	0	0	0	0	111.7	L1100 I1118 S1119 L1120 S1121	L1100-V1107 HydrophobicContact CD1-CG1 4.03Å; V1107-I1118 HydrophobicContact CB-CD1 4.15Å; V1107-I1118 HydrophobicContact CB-CG1 4.02Å; V1107-I1118 HydrophobicContact CG1-CD1 4.47Å; V1107-I1118 HydrophobicContact CG1-CG1 4.4Å; V1107-I1118 HydrophobicContact CG2-CD1 4.14Å; V1107-S1119 CarbonylContact C-O 3.59Å; V1107-S1119 VanDerWaalsContact CA-O 3.26Å; V1107-S1119 WeakPolarHBondContact CA-O 3.39Å; V1107-L1120 HydrophobicContact CG1-CD2 4.21Å; V1107-S1121 PolarHBondContact N-OG 2.9Å
1108	H	91.1	Very high	90.7	Very high	93 Å²	93	58.2 Å²	58.2	43%	0.431	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	132.8	172.3	-174.1	-68.2	0	0	0	109.5	R1110 I1118 S1119 S1121	H1108-R1110 VanDerWaalsContact CE1-CG 3.42Å; H1108-R1110 WeakPolarHBondContact CE1-CG 3.42Å; H1108-I1118 WeakPolarHBondContact O-CA 3.34Å; H1108-S1119 PolarHBondContact N-O 2.94Å; H1108-S1119 PolarHBondContact O-N 3.1Å; H1108-S1121 PolarHBondContact N-OG 3.43Å
1109	I	92.1	Very high	90.5	Very high	39 Å²	39	59.7 Å²	59.7	20%	0.2	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	134.1	175.3	-61.1	180	0	0	0	110.1	D1111 A1116 T1117 I1118 V1135 R1139	I1109-D1111 HydrophobicContact CG2-CB 4.24Å; I1109-A1116 HydrophobicContact CG2-CB 4.3Å; I1109-T1117 CarbonylContact C-O 3.51Å; I1109-T1117 VanDerWaalsContact CA-O 3.29Å; I1109-T1117 WeakPolarHBondContact CA-O 3.48Å; I1109-I1118 HydrophobicContact CD1-CD1 4.02Å; I1109-I1118 HydrophobicContact CG1-CB 4.26Å; I1109-I1118 HydrophobicContact CG1-CD1 3.98Å; I1109-I1118 HydrophobicContact CG1-CG1 3.93Å; I1109-V1135 HydrophobicContact CD1-CG1 4.03Å; I1109-V1135 HydrophobicContact CG1-CG1 4.35Å; I1109-V1135 HydrophobicContact CG2-CG1 4.15Å; I1109-R1139 HydrophobicContact CD1-CB 3.94Å; I1109-R1139 HydrophobicContact CD1-CG 4.1Å
1110	R	91.9	Very high	90.3	Very high	180 Å²	180	59.9 Å²	59.9	68%	0.679	30%	0.298	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.5	116.5	164.6	-61.4	176.3	177.1	176.9	-2	107.7	H1108 A1116 T1117	H1108-R1110 VanDerWaalsContact CE1-CG 3.42Å; H1108-R1110 WeakPolarHBondContact CE1-CG 3.42Å; R1110-A1116 CarbonylContact O-C 3.52Å; R1110-A1116 VanDerWaalsContact O-CA 3.22Å; R1110-A1116 WeakPolarHBondContact O-CA 3.25Å; R1110-T1117 PolarHBondContact N-O 3.03Å; R1110-T1117 PolarHBondContact O-N 2.64Å; R1110-T1117 PolarHBondContact O-OG1 3.48Å
1111	D	91.8	Very high	89.8	Confident	69 Å²	69	63.2 Å²	63.2	37%	0.369	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	123.7	-175	-171.1	-6	0	0	0	109	I1109 G1113 A1116 S1132 R1136	I1109-D1111 HydrophobicContact CG2-CB 4.24Å; D1111-G1113 WeakPolarHBondContact OD1-CA 3.14Å; D1111-G1113 PolarHBondContact OD1-N 3.19Å; D1111-A1116 HydrophobicContact CB-CB 3.97Å; D1111-S1132 VanDerWaalsContact OD1-CB 3.26Å; D1111-S1132 WeakPolarHBondContact OD1-CB 3.29Å; D1111-S1132 PolarHBondContact OD1-OG 2.86Å; D1111-S1132 WeakPolarHBondContact OD2-CB 3.3Å; D1111-R1136 IonicContact OD2-NH1 3.95Å
1112	D	89.4	Confident	89.3	Confident	107 Å²	107	65.4 Å²	65.4	57%	0.572	33%	0.333	S	S	*	.			trans	-94.9	4.7	175.3	71.9	20.5	0	0	0	112.9	R1114 R1115	D1112-R1114 VanDerWaalsContact C-N 3.35Å; D1112-R1114 WeakPolarHBondContact OD1-CA 3.39Å; D1112-R1114 PolarHBondContact OD1-N 3.02Å; D1112-R1115 PolarHBondContact N-O 2.79Å; D1112-R1115 PolarHBondContact OD1-N 3.29Å; D1112-R1115 VanDerWaalsContact OD1-O 3.1Å
1113	G	84.2	Confident	88.7	Confident	58 Å²	58	65.5 Å²	65.5	60%	0.598	34%	0.335	S	S	*	.	S	Bend	trans	91.9	-20.8	-177.7	0	0	0	0	0	114.3	D1111 S1132	D1111-G1113 WeakPolarHBondContact OD1-CA 3.14Å; D1111-G1113 PolarHBondContact OD1-N 3.19Å; G1113-S1132 VanDerWaalsContact C-OG 3.24Å; G1113-S1132 PolarHBondContact O-OG 3.26Å
1114	R	87.8	Confident	88.4	Confident	217 Å²	217	68.4 Å²	68.4	82%	0.819	35%	0.35	S	S	*	.	S	Bend	trans	-111.6	-44.9	173.5	-66.5	-176.3	179.6	-177.2	0.4	111.7	D1112 D1131 S1132	D1112-R1114 VanDerWaalsContact C-N 3.35Å; D1112-R1114 WeakPolarHBondContact OD1-CA 3.39Å; D1112-R1114 PolarHBondContact OD1-N 3.02Å; R1114-D1131 WeakPolarHBondContact O-CA 3.37Å; R1114-S1132 PolarHBondContact N-OG 3.23Å; R1114-S1132 PolarHBondContact O-N 3Å; R1114-S1132 VanDerWaalsContact O-N 3.1Å; R1114-S1132 PolarHBondContact O-OG 2.98Å
1115	R	91.3	Very high	88.8	Confident	144 Å²	144	64.3 Å²	64.3	54%	0.543	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	143.9	177.7	-66.4	-173.9	-64.2	170.1	-10.6	109.7	D1112 E1129 G1130 S1132	D1112-R1115 PolarHBondContact N-O 2.79Å; D1112-R1115 PolarHBondContact OD1-N 3.29Å; D1112-R1115 VanDerWaalsContact OD1-O 3.1Å; R1115-E1129 WeakPolarHBondContact CD-OE1 3.27Å; R1115-E1129 IonicContact CZ-OE1 3.04Å; R1115-E1129 IonicContact NE-OE1 2.77Å; R1115-E1129 IonicContact NH1-OE1 3.07Å; R1115-E1129 PolarHBondContact NH1-OE1 3.34Å; R1115-G1130 WeakPolarHBondContact CA-O 3.42Å; R1115-S1132 PolarHBondContact N-OG 3.21Å
1116	A	93.8	Very high	89.3	Confident	1 Å²	1	63.7 Å²	63.7	1%	0.008	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	145.6	174.1	0	0	0	0	0	110.2	I1109 R1110 D1111 E1129 G1130 V1135	I1109-A1116 HydrophobicContact CG2-CB 4.3Å; R1110-A1116 CarbonylContact O-C 3.52Å; R1110-A1116 VanDerWaalsContact O-CA 3.22Å; R1110-A1116 WeakPolarHBondContact O-CA 3.25Å; D1111-A1116 HydrophobicContact CB-CB 3.97Å; A1116-E1129 WeakPolarHBondContact O-CA 3.43Å; A1116-G1130 PolarHBondContact N-O 3.18Å; A1116-G1130 PolarHBondContact O-N 3.12Å; A1116-V1135 HydrophobicContact CB-CB 3.71Å; A1116-V1135 HydrophobicContact CB-CG1 3.79Å; A1116-V1135 HydrophobicContact CB-CG2 3.86Å
1117	T	92.4	Very high	89.6	Confident	42 Å²	42	62.7 Å²	62.7	26%	0.258	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	136.1	171	53.7	0	0	0	0	109	P345 I1109 R1110 L1128 E1129	P345-T1117 HydrophobicContact CB-CG2 4.34Å; P345-T1117 HydrophobicContact CG-CG2 3.82Å; I1109-T1117 CarbonylContact C-O 3.51Å; I1109-T1117 VanDerWaalsContact CA-O 3.29Å; I1109-T1117 WeakPolarHBondContact CA-O 3.48Å; R1110-T1117 PolarHBondContact N-O 3.03Å; R1110-T1117 PolarHBondContact O-N 2.64Å; R1110-T1117 PolarHBondContact O-OG1 3.48Å; T1117-L1128 CarbonylContact C-O 3.41Å; T1117-L1128 VanDerWaalsContact CA-O 3.24Å; T1117-L1128 WeakPolarHBondContact CA-O 3.26Å; T1117-E1129 HydrophobicContact CG2-CB 3.99Å; T1117-E1129 HydrophobicContact CG2-CG 4Å
1118	I	93.2	Very high	89.6	Confident	1 Å²	1	61 Å²	61	1%	0.005	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	132.4	177.2	-170.6	163.5	0	0	0	109.5	L1100 V1107 H1108 I1109 L1128 V1135	L1100-I1118 HydrophobicContact CD1-CD1 3.73Å; L1100-I1118 HydrophobicContact CD1-CG1 3.79Å; L1100-I1118 HydrophobicContact CD1-CG2 4.11Å; L1100-I1118 HydrophobicContact CD2-CD1 4.26Å; L1100-I1118 HydrophobicContact CD2-CG2 3.99Å; V1107-I1118 HydrophobicContact CB-CD1 4.15Å; V1107-I1118 HydrophobicContact CB-CG1 4.02Å; V1107-I1118 HydrophobicContact CG1-CD1 4.47Å; V1107-I1118 HydrophobicContact CG1-CG1 4.4Å; V1107-I1118 HydrophobicContact CG2-CD1 4.14Å; H1108-I1118 WeakPolarHBondContact O-CA 3.34Å; I1109-I1118 HydrophobicContact CD1-CD1 4.02Å; I1109-I1118 HydrophobicContact CG1-CB 4.26Å; I1109-I1118 HydrophobicContact CG1-CD1 3.98Å; I1109-I1118 HydrophobicContact CG1-CG1 3.93Å; I1118-L1128 HydrophobicContact CG2-CB 3.89Å; I1118-L1128 PolarHBondContact N-O 3.05Å; I1118-L1128 PolarHBondContact O-N 3.32Å; I1118-V1135 HydrophobicContact CB-CG1 3.87Å; I1118-V1135 HydrophobicContact CD1-CG1 4.3Å; I1118-V1135 HydrophobicContact CG2-CG1 4.23Å
1119	S	92	Very high	89.6	Confident	30 Å²	30	58.3 Å²	58.3	21%	0.21	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	154.9	179.9	61	0	0	0	0	111.1	V1107 H1108 L1126	V1107-S1119 CarbonylContact C-O 3.59Å; V1107-S1119 VanDerWaalsContact CA-O 3.26Å; V1107-S1119 WeakPolarHBondContact CA-O 3.39Å; H1108-S1119 PolarHBondContact N-O 2.94Å; H1108-S1119 PolarHBondContact O-N 3.1Å; S1119-L1126 WeakPolarHBondContact CA-O 3.19Å; S1119-L1126 WeakPolarHBondContact CB-O 3.28Å
1120	L	90.2	Very high	89.6	Confident	5 Å²	5	56.9 Å²	56.9	3%	0.026	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	142.3	168.2	-59.5	174.5	0	0	0	109.1	Y1024 V1099 T1103 V1107 S1123 L1126	Y1024-L1120 HydrophobicContact CE2-CD1 4.28Å; V1099-L1120 HydrophobicContact CG1-CD1 4.27Å; T1103-L1120 WeakPolarHBondContact OG1-CD2 3.39Å; V1107-L1120 HydrophobicContact CG1-CD2 4.21Å; L1120-S1123 VanDerWaalsContact O-O 3.04Å; L1120-L1126 HydrophobicContact CD1-CB 3.9Å; L1120-L1126 HydrophobicContact CD1-CD2 4.17Å; L1120-L1126 HydrophobicContact CD2-CD2 4.4Å; L1120-L1126 HydrophobicContact CG-CB 4.08Å; L1120-L1126 HydrophobicContact CG-CD2 4.03Å
1121	S	85.4	Confident	89.7	Confident	70 Å²	70	51.7 Å²	51.7	49%	0.49	27%	0.267	S	S	.	.	S	Bend	trans	-84.3	-28.1	-175.2	-55.1	0	0	0	0	112.1	D1106 V1107 H1108	D1106-S1121 WeakPolarHBondContact O-CB 3.24Å; D1106-S1121 PolarHBondContact O-N 3.31Å; D1106-S1121 PolarHBondContact O-OG 3.48Å; V1107-S1121 PolarHBondContact N-OG 2.9Å; H1108-S1121 PolarHBondContact N-OG 3.43Å
1122	D	85	Confident	89.8	Confident	50 Å²	50	48.7 Å²	48.7	27%	0.267	25%	0.251	S	S	.	.	S	Bend	trans	-93.8	-2.6	-178.1	67.2	-40.8	0	0	0	113.3	Y1024 K1051	Y1024-D1122 WeakPolarHBondContact CE1-OD2 3.22Å; Y1024-D1122 VanDerWaalsContact CZ-OD2 3.26Å; Y1024-D1122 PolarHBondContact OH-OD1 2.79Å; Y1024-D1122 PolarHBondContact OH-OD2 3.45Å; K1051-D1122 VanDerWaalsContact CE-O 3.25Å; K1051-D1122 WeakPolarHBondContact CE-O 3.42Å; K1051-D1122 PolarHBondContact NZ-O 2.91Å; K1051-D1122 VanDerWaalsContact NZ-O 3.14Å
1123	S	83.7	Confident	90.1	Very high	12 Å²	12	46.7 Å²	46.7	8%	0.084	24%	0.236	C	C	.	.			trans	-154.6	136.2	-174.8	-179.3	0	0	0	0	113	L1120 L1125	L1120-S1123 VanDerWaalsContact O-O 3.04Å; S1123-L1125 VanDerWaalsContact C-N 3.29Å; S1123-L1125 PolarHBondContact O-N 3.39Å; S1123-L1125 WeakPolarHBondContact OG-CB 3.45Å; S1123-L1125 WeakPolarHBondContact OG-CD1 3.13Å; S1123-L1125 WeakPolarHBondContact OG-CG 3.41Å; S1123-L1125 PolarHBondContact OG-N 3.09Å
1124	D	83.5	Confident	90.6	Very high	66 Å²	66	44 Å²	44	35%	0.353	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.7	4.3	174.9	77	-30.6	0	0	0	113.9	R1049	R1049-D1124 IonicContact CZ-OD2 2.73Å; R1049-D1124 IonicContact NH2-OD1 2.77Å; R1049-D1124 PolarHBondContact NH2-OD1 3.2Å; R1049-D1124 IonicContact NH2-OD2 3.21Å; R1049-D1124 PolarHBondContact NH2-OD2 2.65Å
1125	L	89.4	Confident	90.9	Very high	1 Å²	1	33.7 Å²	33.7	1%	0.005	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-23.1	-174.1	-61.2	176.8	0	0	0	114	L1027 Q1029 R1049 W1073 S1123	L1027-L1125 HydrophobicContact CB-CD1 4.16Å; L1027-L1125 HydrophobicContact CD2-CB 4.1Å; L1027-L1125 HydrophobicContact CD2-CD1 4.24Å; L1027-L1125 HydrophobicContact CG-CD1 4.37Å; L1027-L1125 WeakPolarHBondContact O-CD1 3.12Å; Q1029-L1125 HydrophobicContact CB-CB 4.32Å; Q1029-L1125 HydrophobicContact CB-CD2 3.86Å; Q1029-L1125 PolarHBondContact NE2-O 3.44Å; R1049-L1125 HydrophobicContact CG-CD2 4.18Å; W1073-L1125 PolarHBondContact NE1-O 2.94Å; S1123-L1125 VanDerWaalsContact C-N 3.29Å; S1123-L1125 PolarHBondContact O-N 3.39Å; S1123-L1125 WeakPolarHBondContact OG-CB 3.45Å; S1123-L1125 WeakPolarHBondContact OG-CD1 3.13Å; S1123-L1125 WeakPolarHBondContact OG-CG 3.41Å; S1123-L1125 PolarHBondContact OG-N 3.09Å
1126	L	91	Very high	91	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.163	C	C	.	.			trans	-123.6	119.9	178.6	-175.6	75.2	0	0	0	110.5	W1073 V1099 L1100 S1119 L1120 L1128	W1073-L1126 HydrophobicContact CD2-CD1 4.15Å; W1073-L1126 VanDerWaalsContact CE2-CD1 3.47Å; W1073-L1126 HydrophobicContact CH2-CD1 4.1Å; W1073-L1126 HydrophobicContact CZ2-CD1 3.45Å; W1073-L1126 VanDerWaalsContact CZ2-CD1 3.45Å; V1099-L1126 HydrophobicContact CB-CD1 4.46Å; V1099-L1126 HydrophobicContact CB-CD2 4.04Å; V1099-L1126 HydrophobicContact CG1-CD1 4.49Å; V1099-L1126 HydrophobicContact CG1-CD2 3.84Å; L1100-L1126 HydrophobicContact CB-CD2 3.99Å; L1100-L1126 HydrophobicContact CD1-CD2 4.44Å; S1119-L1126 WeakPolarHBondContact CA-O 3.19Å; S1119-L1126 WeakPolarHBondContact CB-O 3.28Å; L1120-L1126 HydrophobicContact CD1-CB 3.9Å; L1120-L1126 HydrophobicContact CD1-CD2 4.17Å; L1120-L1126 HydrophobicContact CD2-CD2 4.4Å; L1120-L1126 HydrophobicContact CG-CB 4.08Å; L1120-L1126 HydrophobicContact CG-CD2 4.03Å; L1126-L1128 HydrophobicContact CD1-CD1 4.13Å; L1126-L1128 HydrophobicContact CD1-CD2 3.77Å; L1126-L1128 HydrophobicContact CD1-CG 3.91Å; L1126-L1128 HydrophobicContact CD2-CD1 4.25Å; L1126-L1128 HydrophobicContact CG-CD1 4.34Å; L1126-L1128 HydrophobicContact CG-CD2 4.47Å; L1126-L1128 HydrophobicContact CG-CG 4.11Å
1127	R	90.2	Very high	91	Very high	96 Å²	96	32.4 Å²	32.4	36%	0.362	17%	0.165	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	122.8	166.9	-58.8	-175.9	-154.3	159.4	1.7	108.6	R343 P345 C346	R343-R1127 PolarHBondContact O-NH1 3.39Å; P345-R1127 WeakPolarHBondContact CA-O 3.37Å; P345-R1127 HydrophobicContact CB-CB 4.21Å; P345-R1127 HydrophobicContact CG-CB 4.47Å; C346-R1127 PolarHBondContact N-O 3.13Å
1128	L	91.7	Very high	91.1	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	146.3	-179.2	-55.3	176.6	0	0	0	109.4	C346 I348 W1073 P1096 L1097 L1100 T1117 I1118 L1126	C346-L1128 HydrophobicContact CB-CD2 3.89Å; C346-L1128 CarbonylContact O-C 3.26Å; C346-L1128 VanDerWaalsContact O-CA 3.25Å; C346-L1128 WeakPolarHBondContact O-CA 3.29Å; I348-L1128 HydrophobicContact CD1-CB 4.35Å; I348-L1128 HydrophobicContact CG1-CB 4.4Å; I348-L1128 HydrophobicContact CG2-CB 3.98Å; I348-L1128 HydrophobicContact CG2-CD1 4.03Å; I348-L1128 HydrophobicContact CG2-CD2 3.91Å; I348-L1128 HydrophobicContact CG2-CG 4.17Å; W1073-L1128 HydrophobicContact CH2-CD2 4.1Å; P1096-L1128 HydrophobicContact CB-CD2 4.15Å; L1097-L1128 HydrophobicContact CD2-CD1 4.5Å; L1100-L1128 HydrophobicContact CB-CD1 3.93Å; L1100-L1128 HydrophobicContact CD2-CD1 3.97Å; L1100-L1128 HydrophobicContact CG-CD1 4.4Å; T1117-L1128 CarbonylContact C-O 3.41Å; T1117-L1128 VanDerWaalsContact CA-O 3.24Å; T1117-L1128 WeakPolarHBondContact CA-O 3.26Å; I1118-L1128 HydrophobicContact CG2-CB 3.89Å; I1118-L1128 PolarHBondContact N-O 3.05Å; I1118-L1128 PolarHBondContact O-N 3.32Å; L1126-L1128 HydrophobicContact CD1-CD1 4.13Å; L1126-L1128 HydrophobicContact CD1-CD2 3.77Å; L1126-L1128 HydrophobicContact CD1-CG 3.91Å; L1126-L1128 HydrophobicContact CD2-CD1 4.25Å; L1126-L1128 HydrophobicContact CG-CD1 4.34Å; L1126-L1128 HydrophobicContact CG-CD2 4.47Å; L1126-L1128 HydrophobicContact CG-CG 4.11Å
1129	E	92.3	Very high	91.1	Very high	37 Å²	37	33.7 Å²	33.7	17%	0.173	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	135.5	176.7	-178.9	-179.4	-179.7	0	0	110.1	P345 C346 T347 I348 R1115 A1116 T1117	P345-E1129 HydrophobicContact CB-CB 3.69Å; P345-E1129 HydrophobicContact CG-CB 4.43Å; C346-E1129 PolarHBondContact O-N 2.86Å; T347-E1129 CarbonylContact C-O 3.46Å; T347-E1129 VanDerWaalsContact CA-O 3.29Å; T347-E1129 WeakPolarHBondContact CA-O 3.44Å; I348-E1129 VanDerWaalsContact CG1-O 3.26Å; I348-E1129 WeakPolarHBondContact CG1-O 3.48Å; I348-E1129 PolarHBondContact N-O 2.93Å; R1115-E1129 WeakPolarHBondContact CD-OE1 3.27Å; R1115-E1129 IonicContact CZ-OE1 3.04Å; R1115-E1129 IonicContact NE-OE1 2.77Å; R1115-E1129 IonicContact NH1-OE1 3.07Å; R1115-E1129 PolarHBondContact NH1-OE1 3.34Å; A1116-E1129 WeakPolarHBondContact O-CA 3.43Å; T1117-E1129 HydrophobicContact CG2-CB 3.99Å; T1117-E1129 HydrophobicContact CG2-CG 4Å
1130	G	91.9	Very high	91.2	Very high	8 Å²	8	35.4 Å²	35.4	8%	0.082	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	-177.7	173.7	0	0	0	0	0	110.5	R1115 A1116	R1115-G1130 WeakPolarHBondContact CA-O 3.42Å; A1116-G1130 PolarHBondContact N-O 3.18Å; A1116-G1130 PolarHBondContact O-N 3.12Å
1131	D	94	Very high	91.5	Very high	72 Å²	72	35.2 Å²	35.2	39%	0.385	17%	0.168	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	153.6	166.6	67.7	92.1	0	0	0	110.5	R1114 R1133 T1134 V1135	R1114-D1131 WeakPolarHBondContact O-CA 3.37Å; D1131-R1133 PolarHBondContact O-N 2.94Å; D1131-R1133 WeakPolarHBondContact OD1-CA 3.31Å; D1131-R1133 WeakPolarHBondContact OD1-CB 3.5Å; D1131-R1133 PolarHBondContact OD1-N 3.22Å; D1131-R1133 VanDerWaalsContact OD1-N 3.12Å; D1131-T1134 VanDerWaalsContact CG-OG1 3.29Å; D1131-T1134 PolarHBondContact O-N 3.32Å; D1131-T1134 PolarHBondContact OD1-N 3.46Å; D1131-T1134 PolarHBondContact OD1-OG1 2.81Å; D1131-T1134 WeakPolarHBondContact OD2-CB 3.48Å; D1131-T1134 PolarHBondContact OD2-OG1 3.01Å; D1131-V1135 PolarHBondContact O-N 2.9Å; D1131-V1135 VanDerWaalsContact O-N 3.12Å
1132	S	94.1	Very high	92	Very high	5 Å²	5	33 Å²	33	4%	0.035	15%	0.149	C	C	.	.	H	α-helix	trans	-58.9	-31.9	-175	-55.1	0	0	0	0	113.3	D1111 G1113 R1114 R1115 R1136	D1111-S1132 VanDerWaalsContact OD1-CB 3.26Å; D1111-S1132 WeakPolarHBondContact OD1-CB 3.29Å; D1111-S1132 PolarHBondContact OD1-OG 2.86Å; D1111-S1132 WeakPolarHBondContact OD2-CB 3.3Å; G1113-S1132 VanDerWaalsContact C-OG 3.24Å; G1113-S1132 PolarHBondContact O-OG 3.26Å; R1114-S1132 PolarHBondContact N-OG 3.23Å; R1114-S1132 PolarHBondContact O-N 3Å; R1114-S1132 VanDerWaalsContact O-N 3.1Å; R1114-S1132 PolarHBondContact O-OG 2.98Å; R1115-S1132 PolarHBondContact N-OG 3.21Å; S1132-R1136 WeakPolarHBondContact O-CB 3.44Å; S1132-R1136 VanDerWaalsContact O-CG 3.29Å; S1132-R1136 WeakPolarHBondContact O-CG 3.34Å; S1132-R1136 PolarHBondContact O-N 2.83Å; S1132-R1136 VanDerWaalsContact O-N 3.11Å
1133	R	94.2	Very high	92.4	Very high	66 Å²	66	34.3 Å²	34.3	25%	0.249	15%	0.15	C	C	.	.	H	α-helix	trans	-68.9	-50.1	177.7	170.5	175.5	172.1	-113.5	8	110.7	E352 E359 D1131 V1135 R1136 L1137	E352-R1133 VanDerWaalsContact CD-NH1 3.29Å; E352-R1133 IonicContact OE1-CZ 3.64Å; E352-R1133 IonicContact OE1-NH1 2.59Å; E352-R1133 PolarHBondContact OE1-NH1 3.44Å; E352-R1133 IonicContact OE1-NH2 3.69Å; E352-R1133 PolarHBondContact OE1-NH2 3.37Å; E352-R1133 IonicContact OE2-CZ 3.1Å; E352-R1133 IonicContact OE2-NH1 3.56Å; E352-R1133 PolarHBondContact OE2-NH1 3.45Å; E359-R1133 IonicContact OE2-CZ 3.43Å; E359-R1133 IonicContact OE2-NE 2.94Å; E359-R1133 IonicContact OE2-NH2 3.89Å; E359-R1133 PolarHBondContact OE2-NH2 2.86Å; D1131-R1133 PolarHBondContact O-N 2.94Å; D1131-R1133 WeakPolarHBondContact OD1-CA 3.31Å; D1131-R1133 WeakPolarHBondContact OD1-CB 3.5Å; D1131-R1133 PolarHBondContact OD1-N 3.22Å; D1131-R1133 VanDerWaalsContact OD1-N 3.12Å; R1133-V1135 VanDerWaalsContact C-N 3.33Å; R1133-V1135 PolarHBondContact O-N 3.05Å; R1133-R1136 PolarHBondContact O-N 2.81Å; R1133-L1137 HydrophobicContact CG-CD1 3.91Å; R1133-L1137 HydrophobicContact CG-CG 4.46Å; R1133-L1137 WeakPolarHBondContact O-CG 3.39Å; R1133-L1137 PolarHBondContact O-N 3.43Å
1134	T	94.3	Very high	92.9	Very high	2 Å²	2	34.1 Å²	34.1	1%	0.012	15%	0.149	C	C	.	.	H	α-helix	trans	-55.8	-47.7	178.1	-66	0	0	0	0	111.5	I348 V350 L355 D1131 R1136 L1137 L1138	I348-T1134 HydrophobicContact CD1-CG2 4.34Å; V350-T1134 HydrophobicContact CB-CG2 4.28Å; V350-T1134 HydrophobicContact CG2-CG2 3.88Å; L355-T1134 WeakPolarHBondContact CD1-OG1 3.47Å; L355-T1134 HydrophobicContact CD2-CG2 4.25Å; D1131-T1134 VanDerWaalsContact CG-OG1 3.29Å; D1131-T1134 PolarHBondContact O-N 3.32Å; D1131-T1134 PolarHBondContact OD1-N 3.46Å; D1131-T1134 PolarHBondContact OD1-OG1 2.81Å; D1131-T1134 WeakPolarHBondContact OD2-CB 3.48Å; D1131-T1134 PolarHBondContact OD2-OG1 3.01Å; T1134-R1136 PolarHBondContact O-N 3.2Å; T1134-L1137 PolarHBondContact O-N 2.86Å; T1134-L1138 HydrophobicContact CG2-CD1 3.94Å; T1134-L1138 HydrophobicContact CG2-CG 4.43Å; T1134-L1138 WeakPolarHBondContact O-CB 3.34Å; T1134-L1138 VanDerWaalsContact O-CG 3.31Å; T1134-L1138 WeakPolarHBondContact O-CG 3.45Å; T1134-L1138 PolarHBondContact O-N 3.24Å
1135	V	94.8	Very high	93.5	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-66.3	-39.5	-178.4	173.8	0	0	0	0	112.2	I1109 A1116 I1118 D1131 R1133 L1138 R1139	I1109-V1135 HydrophobicContact CD1-CG1 4.03Å; I1109-V1135 HydrophobicContact CG1-CG1 4.35Å; I1109-V1135 HydrophobicContact CG2-CG1 4.15Å; A1116-V1135 HydrophobicContact CB-CB 3.71Å; A1116-V1135 HydrophobicContact CB-CG1 3.79Å; A1116-V1135 HydrophobicContact CB-CG2 3.86Å; I1118-V1135 HydrophobicContact CB-CG1 3.87Å; I1118-V1135 HydrophobicContact CD1-CG1 4.3Å; I1118-V1135 HydrophobicContact CG2-CG1 4.23Å; D1131-V1135 PolarHBondContact O-N 2.9Å; D1131-V1135 VanDerWaalsContact O-N 3.12Å; R1133-V1135 VanDerWaalsContact C-N 3.33Å; R1133-V1135 PolarHBondContact O-N 3.05Å; V1135-L1138 PolarHBondContact O-N 2.96Å; V1135-R1139 PolarHBondContact O-N 3.37Å
1136	R	93.2	Very high	93.8	Very high	108 Å²	108	32.9 Å²	32.9	41%	0.408	15%	0.152	S	C	.	.	H	α-helix	trans	-62.5	-47.6	174.3	-76.6	-169.3	-50.5	-109.1	4.6	111.9	D1111 S1132 R1133 T1134 L1138 R1139 E1140	D1111-R1136 IonicContact OD2-NH1 3.95Å; S1132-R1136 WeakPolarHBondContact O-CB 3.44Å; S1132-R1136 VanDerWaalsContact O-CG 3.29Å; S1132-R1136 WeakPolarHBondContact O-CG 3.34Å; S1132-R1136 PolarHBondContact O-N 2.83Å; S1132-R1136 VanDerWaalsContact O-N 3.11Å; R1133-R1136 PolarHBondContact O-N 2.81Å; T1134-R1136 PolarHBondContact O-N 3.2Å; R1136-L1138 VanDerWaalsContact C-N 3.35Å; R1136-L1138 PolarHBondContact O-N 3.25Å; R1136-R1139 WeakPolarHBondContact O-CB 3.48Å; R1136-R1139 PolarHBondContact O-N 3.27Å; R1136-E1140 PolarHBondContact O-N 3.42Å
1137	L	94.5	Very high	93.8	Very high	10 Å²	10	36 Å²	36	5%	0.052	16%	0.164	C	C	.	.	H	α-helix	trans	-61.2	-42.5	178.5	-73.3	173.4	0	0	0	111.5	L355 I358 E359 L362 R1133 T1134 R1139 E1140 F1141	L355-L1137 HydrophobicContact CB-CD1 4.27Å; L355-L1137 HydrophobicContact CD2-CD1 4.05Å; I358-L1137 HydrophobicContact CG2-CB 4.4Å; E359-L1137 HydrophobicContact CB-CD1 4.37Å; E359-L1137 HydrophobicContact CB-CD2 3.94Å; E359-L1137 HydrophobicContact CG-CD2 4.18Å; L362-L1137 HydrophobicContact CD1-CD2 4.12Å; R1133-L1137 HydrophobicContact CG-CD1 3.91Å; R1133-L1137 HydrophobicContact CG-CG 4.46Å; R1133-L1137 WeakPolarHBondContact O-CG 3.39Å; R1133-L1137 PolarHBondContact O-N 3.43Å; T1134-L1137 PolarHBondContact O-N 2.86Å; L1137-R1139 VanDerWaalsContact C-N 3.35Å; L1137-R1139 PolarHBondContact O-N 2.98Å; L1137-E1140 PolarHBondContact O-N 3.43Å; L1137-F1141 VanDerWaalsContact O-CB 3.28Å; L1137-F1141 WeakPolarHBondContact O-CB 3.42Å; L1137-F1141 PolarHBondContact O-N 2.73Å
1138	L	94.6	Very high	94	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-64.4	-36.9	176.2	-71.3	174.2	0	0	0	112.7	I348 V350 L1097 L1100 L1101 T1134 V1135 R1136 R1142 L1178	I348-L1138 HydrophobicContact CD1-CD1 3.43Å; I348-L1138 VanDerWaalsContact CD1-CD1 3.43Å; V350-L1138 HydrophobicContact CG2-CD1 4.36Å; L1097-L1138 HydrophobicContact CD2-CD1 3.9Å; L1097-L1138 HydrophobicContact CD2-CD2 4.45Å; L1100-L1138 HydrophobicContact CD2-CB 4.32Å; L1100-L1138 HydrophobicContact CD2-CD1 4.26Å; L1101-L1138 HydrophobicContact CD2-CD2 4.44Å; L1101-L1138 WeakPolarHBondContact CD2-O 3.48Å; T1134-L1138 HydrophobicContact CG2-CD1 3.94Å; T1134-L1138 HydrophobicContact CG2-CG 4.43Å; T1134-L1138 WeakPolarHBondContact O-CB 3.34Å; T1134-L1138 VanDerWaalsContact O-CG 3.31Å; T1134-L1138 WeakPolarHBondContact O-CG 3.45Å; T1134-L1138 PolarHBondContact O-N 3.24Å; V1135-L1138 PolarHBondContact O-N 2.96Å; R1136-L1138 VanDerWaalsContact C-N 3.35Å; R1136-L1138 PolarHBondContact O-N 3.25Å; L1138-R1142 WeakPolarHBondContact O-CB 3.41Å; L1138-R1142 PolarHBondContact O-N 3.09Å; L1138-L1178 HydrophobicContact CD2-CD2 3.99Å
1139	R	93.4	Very high	94.2	Very high	70 Å²	70	32.7 Å²	32.7	26%	0.264	15%	0.154	S	C	.	.	H	α-helix	trans	-62.8	-46.6	173.1	179.1	-170.8	57.6	-172	5.7	111.1	I1109 V1135 R1136 L1137 F1141 R1142 R1143	I1109-R1139 HydrophobicContact CD1-CB 3.94Å; I1109-R1139 HydrophobicContact CD1-CG 4.1Å; V1135-R1139 PolarHBondContact O-N 3.37Å; R1136-R1139 WeakPolarHBondContact O-CB 3.48Å; R1136-R1139 PolarHBondContact O-N 3.27Å; L1137-R1139 VanDerWaalsContact C-N 3.35Å; L1137-R1139 PolarHBondContact O-N 2.98Å; R1139-F1141 VanDerWaalsContact C-N 3.34Å; R1139-R1142 WeakPolarHBondContact O-CB 3.49Å; R1139-R1142 PolarHBondContact O-N 2.81Å; R1139-R1143 WeakPolarHBondContact O-CG 3.44Å; R1139-R1143 PolarHBondContact O-N 3.19Å
1140	E	94.1	Very high	94.1	Very high	66 Å²	66	34.2 Å²	34.2	31%	0.308	16%	0.161	S	C	.	.	H	α-helix	trans	-66.4	-39.5	-179.9	-72.2	170.1	-168.2	0	0	111.4	L362 R1136 L1137 R1142 R1143 A1144	L362-E1140 HydrophobicContact CD1-CB 3.59Å; L362-E1140 HydrophobicContact CD2-CB 4.18Å; R1136-E1140 PolarHBondContact O-N 3.42Å; L1137-E1140 PolarHBondContact O-N 3.43Å; E1140-R1142 PolarHBondContact O-N 2.66Å; E1140-R1143 WeakPolarHBondContact O-CB 3.31Å; E1140-R1143 PolarHBondContact O-N 3.27Å; E1140-R1143 VanDerWaalsContact O-N 3.13Å; E1140-A1144 PolarHBondContact O-N 3.34Å
1141	F	95.9	Very high	94.1	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-60.8	-43.5	172.8	-165.4	-113.6	0	0	0	112.1	I358 L1101 L1137 R1139 R1143 A1144 L1145 L1171 L1174 L1175 L1178	I358-F1141 HydrophobicContact CG1-CD2 4.18Å; I358-F1141 HydrophobicContact CG1-CE2 4.19Å; I358-F1141 HydrophobicContact CG2-CB 4.11Å; I358-F1141 HydrophobicContact CG2-CD2 3.83Å; I358-F1141 HydrophobicContact CG2-CG 4.21Å; L1101-F1141 HydrophobicContact CD1-CD1 3.98Å; L1101-F1141 HydrophobicContact CD1-CE1 4.21Å; L1101-F1141 HydrophobicContact CD2-CD1 4.07Å; L1137-F1141 VanDerWaalsContact O-CB 3.28Å; L1137-F1141 WeakPolarHBondContact O-CB 3.42Å; L1137-F1141 PolarHBondContact O-N 2.73Å; R1139-F1141 VanDerWaalsContact C-N 3.34Å; F1141-R1143 VanDerWaalsContact C-N 3.3Å; F1141-R1143 PolarHBondContact O-N 3.03Å; F1141-A1144 WeakPolarHBondContact O-CB 3.44Å; F1141-A1144 PolarHBondContact O-N 3.28Å; F1141-L1145 HydrophobicContact CD1-CD1 4Å; F1141-L1145 HydrophobicContact CE1-CD1 3.93Å; F1141-L1145 HydrophobicContact CE1-CG 4.48Å; F1141-L1145 WeakPolarHBondContact O-CG 3.26Å; F1141-L1145 PolarHBondContact O-N 3.37Å; F1141-L1171 HydrophobicContact CD2-CD1 3.82Å; F1141-L1171 HydrophobicContact CE2-CD1 3.24Å; F1141-L1171 HydrophobicContact CZ-CD1 3.73Å; F1141-L1174 HydrophobicContact CE2-CB 4.03Å; F1141-L1174 HydrophobicContact CE2-CD1 4.4Å; F1141-L1174 HydrophobicContact CZ-CB 3.94Å; F1141-L1175 HydrophobicContact CE1-CB 4.11Å; F1141-L1175 HydrophobicContact CE1-CD1 4.08Å; F1141-L1175 HydrophobicContact CZ-CB 4.06Å; F1141-L1178 HydrophobicContact CD1-CD2 4.42Å; F1141-L1178 HydrophobicContact CE1-CD2 4.23Å
1142	R	95.1	Very high	94.1	Very high	25 Å²	25	35.4 Å²	35.4	9%	0.094	16%	0.158	C	C	.	.	H	α-helix	trans	-57	-42.6	171.8	178	175.8	-179.3	72.2	-23.5	112.1	L1100 L1101 T1103 G1105 L1138 R1139 E1140 L1145 G1146	L1100-R1142 VanDerWaalsContact O-CD 3.3Å; L1100-R1142 WeakPolarHBondContact O-CD 3.28Å; L1100-R1142 PolarHBondContact O-NE 3.27Å; L1100-R1142 PolarHBondContact O-NH1 3.01Å; L1101-R1142 HydrophobicContact CD2-CB 3.91Å; L1101-R1142 PolarHBondContact O-NH1 3.34Å; T1103-R1142 PolarHBondContact O-NH1 3.49Å; T1103-R1142 PolarHBondContact O-NH2 2.92Å; T1103-R1142 PolarHBondContact OG1-NH2 3.2Å; G1105-R1142 PolarHBondContact O-NH2 3Å; L1138-R1142 WeakPolarHBondContact O-CB 3.41Å; L1138-R1142 PolarHBondContact O-N 3.09Å; R1139-R1142 WeakPolarHBondContact O-CB 3.49Å; R1139-R1142 PolarHBondContact O-N 2.81Å; E1140-R1142 PolarHBondContact O-N 2.66Å; R1142-L1145 PolarHBondContact O-N 3Å; R1142-G1146 PolarHBondContact O-N 3.45Å
1143	R	93.5	Very high	94	Very high	77 Å²	77	35.9 Å²	35.9	29%	0.291	16%	0.16	S	C	.	.	H	α-helix	trans	-67.1	-38	177.6	-66.4	175.9	173.7	173.2	-5.2	112.1	V367 I372 R1139 E1140 F1141 L1145 G1146 R1147	V367-R1143 HydrophobicContact CG1-CB 3.64Å; I372-R1143 HydrophobicContact CD1-CB 4.31Å; I372-R1143 HydrophobicContact CD1-CG 3.69Å; R1139-R1143 WeakPolarHBondContact O-CG 3.44Å; R1139-R1143 PolarHBondContact O-N 3.19Å; E1140-R1143 WeakPolarHBondContact O-CB 3.31Å; E1140-R1143 PolarHBondContact O-N 3.27Å; E1140-R1143 VanDerWaalsContact O-N 3.13Å; F1141-R1143 VanDerWaalsContact C-N 3.3Å; F1141-R1143 PolarHBondContact O-N 3.03Å; R1143-L1145 VanDerWaalsContact C-N 3.34Å; R1143-G1146 PolarHBondContact O-N 2.94Å; R1143-R1147 PolarHBondContact O-N 2.87Å
1144	A	95.7	Very high	93.8	Very high	7 Å²	7	37.6 Å²	37.6	6%	0.058	17%	0.166	C	C	.	.	H	α-helix	trans	-60.4	-44.3	173.1	0	0	0	0	0	111.4	F361 L362 V367 E1140 F1141 R1147 M1148 L1171	F361-A1144 HydrophobicContact CE1-CB 4.3Å; L362-A1144 HydrophobicContact CD2-CB 4.18Å; V367-A1144 HydrophobicContact CG2-CB 3.82Å; E1140-A1144 PolarHBondContact O-N 3.34Å; F1141-A1144 WeakPolarHBondContact O-CB 3.44Å; F1141-A1144 PolarHBondContact O-N 3.28Å; A1144-R1147 PolarHBondContact O-N 2.97Å; A1144-M1148 PolarHBondContact O-N 2.88Å; A1144-L1171 HydrophobicContact CB-CD1 4.16Å; A1144-L1171 HydrophobicContact CB-CD2 4.15Å
1145	L	96.4	Very high	93.4	Very high	3 Å²	3	39 Å²	39	2%	0.016	18%	0.176	C	C	.	.	H	α-helix	trans	-62.8	-42.5	175.1	-67.8	169.3	0	0	0	112.1	F893 L1101 L1102 F1141 R1142 R1143 R1147 M1148 V1149 L1171 L1175	F893-L1145 HydrophobicContact CE1-CD2 4.1Å; L1101-L1145 HydrophobicContact CB-CD1 4.01Å; L1102-L1145 HydrophobicContact CD2-CD1 4.25Å; F1141-L1145 HydrophobicContact CD1-CD1 4Å; F1141-L1145 HydrophobicContact CE1-CD1 3.93Å; F1141-L1145 HydrophobicContact CE1-CG 4.48Å; F1141-L1145 WeakPolarHBondContact O-CG 3.26Å; F1141-L1145 PolarHBondContact O-N 3.37Å; R1142-L1145 PolarHBondContact O-N 3Å; R1143-L1145 VanDerWaalsContact C-N 3.34Å; L1145-R1147 PolarHBondContact O-N 3.1Å; L1145-M1148 HydrophobicContact CD2-CE 4.11Å; L1145-M1148 WeakPolarHBondContact O-CB 3.37Å; L1145-M1148 PolarHBondContact O-N 2.78Å; L1145-V1149 WeakPolarHBondContact O-CG2 3.21Å; L1145-V1149 PolarHBondContact O-N 3.17Å; L1145-L1171 HydrophobicContact CD2-CD1 4.05Å; L1145-L1171 HydrophobicContact CD2-CD2 3.87Å; L1145-L1171 HydrophobicContact CD2-CG 3.71Å; L1145-L1171 HydrophobicContact CG-CD1 4.37Å; L1145-L1171 HydrophobicContact CG-CD2 4.42Å; L1145-L1171 HydrophobicContact CG-CG 4.46Å; L1145-L1175 HydrophobicContact CD1-CD1 4.23Å; L1145-L1175 HydrophobicContact CD1-CD2 4.35Å; L1145-L1175 HydrophobicContact CD2-CD2 4.05Å
1146	G	94	Very high	93	Very high	39 Å²	39	42.6 Å²	42.6	40%	0.402	19%	0.193	S	C	.	.	H	α-helix	trans	-59.7	-44.4	174.7	0	0	0	0	0	112.4	R1142 R1143 M1148 V1149 E1150	R1142-G1146 PolarHBondContact O-N 3.45Å; R1143-G1146 PolarHBondContact O-N 2.94Å; G1146-M1148 PolarHBondContact O-N 2.74Å; G1146-V1149 PolarHBondContact O-N 3.29Å; G1146-E1150 WeakPolarHBondContact O-CB 3.38Å; G1146-E1150 PolarHBondContact O-N 3.49Å
1147	R	92	Very high	92.7	Very high	66 Å²	66	38.6 Å²	38.6	25%	0.249	18%	0.179	C	C	.	.	H	α-helix	trans	-61.5	-42.5	175	-178.7	-176.1	-64.4	-172.6	-5.8	112.1	P366 V367 R1143 A1144 L1145 E1150 R1151	P366-R1147 PolarHBondContact O-NH1 2.87Å; V367-R1147 VanDerWaalsContact CA-NH2 3.33Å; R1143-R1147 PolarHBondContact O-N 2.87Å; A1144-R1147 PolarHBondContact O-N 2.97Å; L1145-R1147 PolarHBondContact O-N 3.1Å; R1147-E1150 PolarHBondContact O-N 3.39Å; R1147-R1151 VanDerWaalsContact O-CB 3.25Å; R1147-R1151 WeakPolarHBondContact O-CB 3.43Å; R1147-R1151 PolarHBondContact O-N 3.46Å
1148	M	94.9	Very high	92.2	Very high	4 Å²	4	40.3 Å²	40.3	2%	0.02	20%	0.195	C	C	.	.	H	α-helix	trans	-57.6	-50.2	175.7	178.4	-168	70.9	0	0	110.6	I892 F893 A1144 L1145 G1146 R1151 S1152 H1168 L1171 L1172	I892-M1148 HydrophobicContact CG2-CE 4.07Å; F893-M1148 HydrophobicContact CD1-CE 4.07Å; F893-M1148 HydrophobicContact CE1-CE 3.67Å; F893-M1148 HydrophobicContact CE2-CE 4.31Å; F893-M1148 HydrophobicContact CZ-CE 3.79Å; A1144-M1148 PolarHBondContact O-N 2.88Å; L1145-M1148 HydrophobicContact CD2-CE 4.11Å; L1145-M1148 WeakPolarHBondContact O-CB 3.37Å; L1145-M1148 PolarHBondContact O-N 2.78Å; G1146-M1148 PolarHBondContact O-N 2.74Å; M1148-R1151 PolarHBondContact O-N 3.5Å; M1148-S1152 VanDerWaalsContact O-CB 3.26Å; M1148-S1152 WeakPolarHBondContact O-CB 3.39Å; M1148-S1152 PolarHBondContact O-N 2.83Å; M1148-S1152 PolarHBondContact O-OG 2.54Å; M1148-H1168 HydrophobicContact CG-CB 4.24Å; M1148-H1168 HydrophobicContact SD-CB 4.17Å; M1148-L1171 HydrophobicContact CB-CD2 3.96Å; M1148-L1171 HydrophobicContact CG-CD2 4.44Å; M1148-L1171 HydrophobicContact SD-CD2 4.01Å; M1148-L1172 HydrophobicContact CE-CD2 3.9Å; M1148-L1172 HydrophobicContact SD-CD1 4.45Å; M1148-L1172 HydrophobicContact SD-CD2 4.04Å; M1148-L1172 HydrophobicContact SD-CG 4.02Å
1149	V	95	Very high	91.8	Very high	21 Å²	21	43.5 Å²	43.5	13%	0.127	22%	0.221	C	C	.	.	H	α-helix	trans	-59.7	-50.3	178.6	172.6	0	0	0	0	110.9	L889 I892 F893 L1145 G1146 R1151 S1152 L1153	L889-V1149 HydrophobicContact CD2-CG1 4.11Å; L889-V1149 HydrophobicContact CD2-CG2 4.45Å; I892-V1149 HydrophobicContact CD1-CG1 4.24Å; I892-V1149 HydrophobicContact CG2-CG2 4.2Å; F893-V1149 HydrophobicContact CE2-CG2 3.68Å; F893-V1149 HydrophobicContact CZ-CG2 3.92Å; L1145-V1149 WeakPolarHBondContact O-CG2 3.21Å; L1145-V1149 PolarHBondContact O-N 3.17Å; G1146-V1149 PolarHBondContact O-N 3.29Å; V1149-R1151 PolarHBondContact O-N 2.83Å; V1149-S1152 WeakPolarHBondContact O-CB 3.38Å; V1149-S1152 PolarHBondContact O-N 3.29Å; V1149-L1153 HydrophobicContact CG1-CD1 3.9Å; V1149-L1153 HydrophobicContact CG1-CG 4.43Å; V1149-L1153 VanDerWaalsContact O-CG 3.28Å; V1149-L1153 WeakPolarHBondContact O-CG 3.26Å; V1149-L1153 PolarHBondContact O-N 3.11Å
1150	E	91.4	Very high	91.6	Very high	70 Å²	70	40.7 Å²	40.7	33%	0.327	21%	0.211	S	C	.	.	H	α-helix	trans	-59.6	-46.1	-179.9	-180	170.3	-151.8	0	0	112.3	G1146 R1147 S1152 L1153 R1154	G1146-E1150 WeakPolarHBondContact O-CB 3.38Å; G1146-E1150 PolarHBondContact O-N 3.49Å; R1147-E1150 PolarHBondContact O-N 3.39Å; E1150-S1152 VanDerWaalsContact C-N 3.34Å; E1150-S1152 PolarHBondContact O-N 3.12Å; E1150-L1153 PolarHBondContact O-N 3.45Å; E1150-R1154 WeakPolarHBondContact O-CG 3.37Å; E1150-R1154 PolarHBondContact O-N 3.2Å; E1150-R1154 IonicContact OE1-CZ 3.51Å; E1150-R1154 IonicContact OE1-NE 2.79Å; E1150-R1154 IonicContact OE1-NH2 3.84Å; E1150-R1154 PolarHBondContact OE1-NH2 3.04Å
1151	R	91.5	Very high	91.4	Very high	103 Å²	103	41.1 Å²	41.1	39%	0.389	22%	0.22	S	C	.	.	H	α-helix	trans	-62.5	-42.6	177.5	-169.9	176.2	-168	170	8.2	111.6	R1147 M1148 V1149 L1153 R1154 E1167	R1147-R1151 VanDerWaalsContact O-CB 3.25Å; R1147-R1151 WeakPolarHBondContact O-CB 3.43Å; R1147-R1151 PolarHBondContact O-N 3.46Å; M1148-R1151 PolarHBondContact O-N 3.5Å; V1149-R1151 PolarHBondContact O-N 2.83Å; R1151-L1153 VanDerWaalsContact C-N 3.28Å; R1151-L1153 PolarHBondContact O-N 3.37Å; R1151-R1154 PolarHBondContact O-N 3.37Å; R1151-E1167 IonicContact NH1-OE2 2.74Å; R1151-E1167 PolarHBondContact NH1-OE2 2.94Å
1152	S	93.9	Very high	91.2	Very high	1 Å²	1	47.2 Å²	47.2	1%	0.007	25%	0.252	C	S	.	.	H	α-helix	trans	-63.5	-30.4	176.5	-81.9	0	0	0	0	113.5	M1148 V1149 E1150 L1157 H1168	M1148-S1152 VanDerWaalsContact O-CB 3.26Å; M1148-S1152 WeakPolarHBondContact O-CB 3.39Å; M1148-S1152 PolarHBondContact O-N 2.83Å; M1148-S1152 PolarHBondContact O-OG 2.54Å; V1149-S1152 WeakPolarHBondContact O-CB 3.38Å; V1149-S1152 PolarHBondContact O-N 3.29Å; E1150-S1152 VanDerWaalsContact C-N 3.34Å; E1150-S1152 PolarHBondContact O-N 3.12Å; S1152-L1157 WeakPolarHBondContact OG-CD1 3.47Å; S1152-H1168 PolarHBondContact OG-CE1 3.02Å
1153	L	92.6	Very high	91	Very high	15 Å²	15	49.7 Å²	49.7	8%	0.079	27%	0.273	C	S	.	.	H	α-helix	trans	-77.9	-33.8	178.5	-70.4	170.5	0	0	0	112.5	T869 L870 R873 V888 I892 V1149 E1150 R1151 S1155	T869-L1153 VanDerWaalsContact CG2-C 3.46Å; T869-L1153 HydrophobicContact CG2-CB 3.76Å; T869-L1153 WeakPolarHBondContact CG2-O 3.45Å; L870-L1153 HydrophobicContact CB-CD1 4Å; L870-L1153 HydrophobicContact CD1-CD1 4.44Å; L870-L1153 HydrophobicContact CD1-CD2 4.24Å; R873-L1153 HydrophobicContact CB-CD2 4.5Å; R873-L1153 HydrophobicContact CG-CD2 3.81Å; R873-L1153 PolarHBondContact NE-O 2.89Å; R873-L1153 VanDerWaalsContact NE-O 3.11Å; R873-L1153 PolarHBondContact NH2-O 2.98Å; V888-L1153 HydrophobicContact CG1-CD2 3.72Å; I892-L1153 HydrophobicContact CD1-CD2 3.92Å; I892-L1153 HydrophobicContact CD1-CG 4.03Å; V1149-L1153 HydrophobicContact CG1-CD1 3.9Å; V1149-L1153 HydrophobicContact CG1-CG 4.43Å; V1149-L1153 VanDerWaalsContact O-CG 3.28Å; V1149-L1153 WeakPolarHBondContact O-CG 3.26Å; V1149-L1153 PolarHBondContact O-N 3.11Å; E1150-L1153 PolarHBondContact O-N 3.45Å; R1151-L1153 VanDerWaalsContact C-N 3.28Å; R1151-L1153 PolarHBondContact O-N 3.37Å; L1153-S1155 VanDerWaalsContact C-N 3.32Å; L1153-S1155 PolarHBondContact O-N 3Å
1154	R	90	Very high	90.9	Very high	103 Å²	103	46 Å²	46	39%	0.389	26%	0.259	S	S	.	.	H	α-helix	trans	-73	-17.8	-174.8	-72.5	176.6	-176.3	-162.7	-0.3	114.7	E1150 R1151	E1150-R1154 WeakPolarHBondContact O-CG 3.37Å; E1150-R1154 PolarHBondContact O-N 3.2Å; E1150-R1154 IonicContact OE1-CZ 3.51Å; E1150-R1154 IonicContact OE1-NE 2.79Å; E1150-R1154 IonicContact OE1-NH2 3.84Å; E1150-R1154 PolarHBondContact OE1-NH2 3.04Å; R1151-R1154 PolarHBondContact O-N 3.37Å
1155	S	84.2	Confident	90.7	Very high	30 Å²	30	47.6 Å²	47.6	21%	0.21	27%	0.265	C	S	.	.	S	Bend	trans	-128.7	169.2	178.9	60.6	0	0	0	0	111.2	R873 L1153 L1157 L1160	R873-S1155 PolarHBondContact NH2-O 3.5Å; L1153-S1155 VanDerWaalsContact C-N 3.32Å; L1153-S1155 PolarHBondContact O-N 3Å; S1155-L1157 PolarHBondContact O-N 2.94Å; S1155-L1160 WeakPolarHBondContact OG-CD2 3.41Å
1156	E	87.3	Confident	90.6	Very high	76 Å²	76	53.4 Å²	53.4	36%	0.355	29%	0.292	S	S	.	.			trans	-63.2	125.2	164.8	174.2	170.8	-175.8	0	0	109.6	F990 A1158 A1159 L1160	F990-E1156 HydrophobicContact CB-CB 4.08Å; F990-E1156 HydrophobicContact CB-CG 4.02Å; E1156-A1158 VanDerWaalsContact C-N 3.33Å; E1156-A1158 PolarHBondContact O-N 3.3Å; E1156-A1159 HydrophobicContact CB-CB 3.96Å; E1156-A1159 HydrophobicContact CG-CB 4Å; E1156-A1159 PolarHBondContact O-N 3.39Å; E1156-A1159 VanDerWaalsContact O-N 3.09Å; E1156-L1160 PolarHBondContact O-N 2.94Å
1157	L	87.2	Confident	90.6	Very high	25 Å²	25	52.9 Å²	52.9	13%	0.131	28%	0.279	C	S	.	.	G	3₁₀ helix	trans	-65.2	-39.5	-169.2	-172.6	61.6	0	0	0	111.8	A891 I892 F990 L991 S1152 S1155 A1159 L1160	A891-L1157 HydrophobicContact CB-CD2 4.32Å; I892-L1157 HydrophobicContact CG1-CD2 4.28Å; F990-L1157 PolarHBondContact O-N 3.26Å; L991-L1157 HydrophobicContact CD2-CD2 4.42Å; L991-L1157 WeakPolarHBondContact O-CD2 3.49Å; S1152-L1157 WeakPolarHBondContact OG-CD1 3.47Å; S1155-L1157 PolarHBondContact O-N 2.94Å; L1157-A1159 PolarHBondContact O-N 2.61Å; L1157-L1160 HydrophobicContact CD1-CD1 3.72Å; L1157-L1160 PolarHBondContact O-N 3.29Å
1158	A	83.7	Confident	90.8	Very high	45 Å²	45	50 Å²	50	37%	0.372	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-70.3	-19.2	177.8	0	0	0	0	0	113.3	E1156	E1156-A1158 VanDerWaalsContact C-N 3.33Å; E1156-A1158 PolarHBondContact O-N 3.3Å
1159	A	86.2	Confident	90.8	Very high	67 Å²	67	50.5 Å²	50.5	55%	0.554	27%	0.274	S	S	*	.	G	3₁₀ helix	trans	-97.6	5.8	-178.5	0	0	0	0	0	113.3	E1156 L1157	E1156-A1159 HydrophobicContact CB-CB 3.96Å; E1156-A1159 HydrophobicContact CG-CB 4Å; E1156-A1159 PolarHBondContact O-N 3.39Å; E1156-A1159 VanDerWaalsContact O-N 3.09Å; L1157-A1159 PolarHBondContact O-N 2.61Å
1160	L	89	Confident	90.9	Very high	11 Å²	11	53.8 Å²	53.8	6%	0.058	29%	0.289	C	S	.	.			trans	-58.3	141.2	177.3	-80.2	176.5	0	0	0	111.5	S1155 E1156 L1157 V1164 Q1165	S1155-L1160 WeakPolarHBondContact OG-CD2 3.41Å; E1156-L1160 PolarHBondContact O-N 2.94Å; L1157-L1160 HydrophobicContact CD1-CD1 3.72Å; L1157-L1160 PolarHBondContact O-N 3.29Å; L1160-V1164 HydrophobicContact CD1-CG1 4.39Å; L1160-V1164 HydrophobicContact CD2-CG1 4.22Å; L1160-Q1165 HydrophobicContact CB-CG 3.96Å; L1160-Q1165 PolarHBondContact O-NE2 3.36Å
1161	P	90.9	Very high	91.2	Very high	76 Å²	76	50.5 Å²	50.5	49%	0.494	27%	0.273	S	S	.	.			trans	-59	146.4	176.5	-20.9	30.5	0	0	0	112.3	S1163 V1164 Q1165	P1161-S1163 VanDerWaalsContact C-N 3.26Å; P1161-S1163 PolarHBondContact O-N 3.21Å; P1161-V1164 HydrophobicContact CB-CG2 4.06Å; P1161-V1164 HydrophobicContact CG-CG2 4.12Å; P1161-V1164 WeakPolarHBondContact O-CA 3.26Å; P1161-V1164 WeakPolarHBondContact O-CB 3.33Å; P1161-V1164 PolarHBondContact O-N 3.01Å; P1161-Q1165 PolarHBondContact O-N 3.49Å
1162	L	89.8	Confident	91.5	Very high	128 Å²	128	45.6 Å²	45.6	67%	0.67	26%	0.255	S	S	*	.	H	α-helix	trans	-54.5	-39	-176.2	-73.1	168.7	0	0	0	113.6	V1164 Q1165 Q1166	L1162-V1164 VanDerWaalsContact C-N 3.28Å; L1162-V1164 PolarHBondContact O-N 3.11Å; L1162-Q1165 PolarHBondContact O-N 3.32Å; L1162-Q1166 WeakPolarHBondContact O-CG 3.29Å; L1162-Q1166 PolarHBondContact O-N 2.89Å
1163	S	91.2	Very high	91.7	Very high	76 Å²	76	47.6 Å²	47.6	53%	0.531	27%	0.271	S	S	.	.	H	α-helix	trans	-60.1	-39.1	176.9	51.9	0	0	0	0	112.4	P1161 Q1166 E1167	P1161-S1163 VanDerWaalsContact C-N 3.26Å; P1161-S1163 PolarHBondContact O-N 3.21Å; S1163-Q1166 PolarHBondContact O-N 3.45Å; S1163-E1167 PolarHBondContact O-N 3.37Å
1164	V	92.3	Very high	91.9	Very high	1 Å²	1	47.7 Å²	47.7	1%	0.006	27%	0.271	C	S	.	.	H	α-helix	trans	-71.9	-41.4	177.7	-173.4	0	0	0	0	110.7	L1160 P1161 L1162 Q1166 E1167 H1168	L1160-V1164 HydrophobicContact CD1-CG1 4.39Å; L1160-V1164 HydrophobicContact CD2-CG1 4.22Å; P1161-V1164 HydrophobicContact CB-CG2 4.06Å; P1161-V1164 HydrophobicContact CG-CG2 4.12Å; P1161-V1164 WeakPolarHBondContact O-CA 3.26Å; P1161-V1164 WeakPolarHBondContact O-CB 3.33Å; P1161-V1164 PolarHBondContact O-N 3.01Å; L1162-V1164 VanDerWaalsContact C-N 3.28Å; L1162-V1164 PolarHBondContact O-N 3.11Å; V1164-Q1166 VanDerWaalsContact C-N 3.25Å; V1164-Q1166 PolarHBondContact O-N 3.4Å; V1164-E1167 PolarHBondContact O-N 2.98Å; V1164-H1168 VanDerWaalsContact CG1-NE2 3.34Å; V1164-H1168 WeakPolarHBondContact CG1-NE2 3.29Å; V1164-H1168 WeakPolarHBondContact O-CB 3.44Å; V1164-H1168 PolarHBondContact O-CD2 3.39Å; V1164-H1168 VanDerWaalsContact O-CG 3.24Å; V1164-H1168 PolarHBondContact O-N 3.22Å
1165	Q	91.5	Very high	92.3	Very high	40 Å²	40	42.8 Å²	42.8	19%	0.187	25%	0.253	C	S	.	.	H	α-helix	trans	-62	-36.2	176.2	-63.6	-172.4	21.1	0	0	112.1	R894 L1160 P1161 L1162 G1169	R894-Q1165 PolarHBondContact NH2-O 3.09Å; L1160-Q1165 HydrophobicContact CB-CG 3.96Å; L1160-Q1165 PolarHBondContact O-NE2 3.36Å; P1161-Q1165 PolarHBondContact O-N 3.49Å; L1162-Q1165 PolarHBondContact O-N 3.32Å; Q1165-G1169 PolarHBondContact O-N 3.48Å
1166	Q	93.4	Very high	92.9	Very high	124 Å²	124	41.4 Å²	41.4	58%	0.579	24%	0.243	S	C	*	.	H	α-helix	trans	-68.6	-45.5	174.5	-73.5	174.9	-1.8	0	0	111.9	L1162 S1163 V1164 G1169 Q1170	L1162-Q1166 WeakPolarHBondContact O-CG 3.29Å; L1162-Q1166 PolarHBondContact O-N 2.89Å; S1163-Q1166 PolarHBondContact O-N 3.45Å; V1164-Q1166 VanDerWaalsContact C-N 3.25Å; V1164-Q1166 PolarHBondContact O-N 3.4Å; Q1166-G1169 PolarHBondContact O-N 2.97Å; Q1166-Q1170 WeakPolarHBondContact O-CG 3.45Å; Q1166-Q1170 PolarHBondContact O-N 2.73Å
1167	E	95.3	Very high	93.3	Very high	29 Å²	29	40.4 Å²	40.4	14%	0.136	24%	0.239	C	C	.	.	H	α-helix	trans	-55.3	-51.8	173.3	178.7	-172.9	167.5	0	0	110.8	F361 Y365 R1151 S1163 V1164 G1169 Q1170 L1171	F361-E1167 HydrophobicContact CE2-CG 4.49Å; F361-E1167 HydrophobicContact CZ-CG 4.18Å; Y365-E1167 HydrophobicContact CD1-CB 4.43Å; Y365-E1167 HydrophobicContact CD1-CG 3.8Å; Y365-E1167 HydrophobicContact CD2-CG 4.18Å; Y365-E1167 HydrophobicContact CE1-CB 3.97Å; Y365-E1167 HydrophobicContact CE1-CG 3.85Å; Y365-E1167 HydrophobicContact CE2-CB 4.43Å; Y365-E1167 HydrophobicContact CE2-CG 4.2Å; Y365-E1167 HydrophobicContact CG-CG 3.97Å; R1151-E1167 IonicContact NH1-OE2 2.74Å; R1151-E1167 PolarHBondContact NH1-OE2 2.94Å; S1163-E1167 PolarHBondContact O-N 3.37Å; V1164-E1167 PolarHBondContact O-N 2.98Å; E1167-G1169 VanDerWaalsContact C-N 3.32Å; E1167-G1169 PolarHBondContact O-N 3.44Å; E1167-Q1170 PolarHBondContact O-N 3.45Å; E1167-L1171 WeakPolarHBondContact O-CB 3.45Å; E1167-L1171 PolarHBondContact O-N 3.45Å
1168	H	95.2	Very high	93.7	Very high	6 Å²	6	39.4 Å²	39.4	3%	0.028	23%	0.234	C	C	.	.	H	α-helix	trans	-61.5	-40.2	178.8	-68.4	-162.7	0	0	0	111.6	M1148 S1152 V1164 L1171 L1172	M1148-H1168 HydrophobicContact CG-CB 4.24Å; M1148-H1168 HydrophobicContact SD-CB 4.17Å; S1152-H1168 PolarHBondContact OG-CE1 3.02Å; V1164-H1168 VanDerWaalsContact CG1-NE2 3.34Å; V1164-H1168 WeakPolarHBondContact CG1-NE2 3.29Å; V1164-H1168 WeakPolarHBondContact O-CB 3.44Å; V1164-H1168 PolarHBondContact O-CD2 3.39Å; V1164-H1168 VanDerWaalsContact O-CG 3.24Å; V1164-H1168 PolarHBondContact O-N 3.22Å; H1168-L1171 PolarHBondContact O-N 3.34Å; H1168-L1172 WeakPolarHBondContact O-CB 3.49Å; H1168-L1172 VanDerWaalsContact O-CG 3.28Å; H1168-L1172 WeakPolarHBondContact O-CG 3.44Å; H1168-L1172 PolarHBondContact O-N 3.44Å
1169	G	96	Very high	94.2	Very high	13 Å²	13	37.4 Å²	37.4	13%	0.134	22%	0.216	C	C	.	.	H	α-helix	trans	-62.9	-44.7	177.2	0	0	0	0	0	112.8	Y1008 Q1165 Q1166 E1167 L1171 L1172 A1173	Y1008-G1169 PolarHBondContact OH-O 3.3Å; Q1165-G1169 PolarHBondContact O-N 3.48Å; Q1166-G1169 PolarHBondContact O-N 2.97Å; E1167-G1169 VanDerWaalsContact C-N 3.32Å; E1167-G1169 PolarHBondContact O-N 3.44Å; G1169-L1171 VanDerWaalsContact C-N 3.35Å; G1169-L1171 PolarHBondContact O-N 3.12Å; G1169-L1172 PolarHBondContact O-N 3.18Å; G1169-A1173 WeakPolarHBondContact O-CB 3.49Å; G1169-A1173 PolarHBondContact O-N 3.38Å
1170	Q	97.1	Very high	94.3	Very high	91 Å²	91	41.4 Å²	41.4	43%	0.425	22%	0.217	S	C	.	.	H	α-helix	trans	-63.1	-42.6	175.6	-70.1	179	43.4	0	0	111.6	F361 Q1166 E1167 A1173 L1174	F361-Q1170 HydrophobicContact CD2-CB 4.07Å; F361-Q1170 HydrophobicContact CE2-CB 3.94Å; Q1166-Q1170 WeakPolarHBondContact O-CG 3.45Å; Q1166-Q1170 PolarHBondContact O-N 2.73Å; E1167-Q1170 PolarHBondContact O-N 3.45Å; Q1170-A1173 PolarHBondContact O-N 2.9Å; Q1170-L1174 WeakPolarHBondContact O-CG 3.38Å; Q1170-L1174 PolarHBondContact O-N 2.97Å; Q1170-L1174 VanDerWaalsContact O-N 3.11Å
1171	L	97.5	Very high	94	Very high	1 Å²	1	41.9 Å²	41.9	1%	0.005	23%	0.225	C	C	.	.	H	α-helix	trans	-61.9	-46.5	178.9	-177.8	55.5	0	0	0	112.1	F361 F1141 A1144 L1145 M1148 E1167 H1168 G1169 L1174 L1175	F361-L1171 HydrophobicContact CD1-CD1 4.31Å; F361-L1171 HydrophobicContact CE1-CB 4.36Å; F361-L1171 HydrophobicContact CE1-CD1 3.74Å; F361-L1171 HydrophobicContact CE1-CG 4.45Å; F361-L1171 HydrophobicContact CE2-CB 4Å; F361-L1171 HydrophobicContact CZ-CB 3.7Å; F361-L1171 HydrophobicContact CZ-CD1 3.97Å; F361-L1171 HydrophobicContact CZ-CD2 4.37Å; F361-L1171 HydrophobicContact CZ-CG 4.22Å; F1141-L1171 HydrophobicContact CD2-CD1 3.82Å; F1141-L1171 HydrophobicContact CE2-CD1 3.24Å; F1141-L1171 HydrophobicContact CZ-CD1 3.73Å; A1144-L1171 HydrophobicContact CB-CD1 4.16Å; A1144-L1171 HydrophobicContact CB-CD2 4.15Å; L1145-L1171 HydrophobicContact CD2-CD1 4.05Å; L1145-L1171 HydrophobicContact CD2-CD2 3.87Å; L1145-L1171 HydrophobicContact CD2-CG 3.71Å; L1145-L1171 HydrophobicContact CG-CD1 4.37Å; L1145-L1171 HydrophobicContact CG-CD2 4.42Å; L1145-L1171 HydrophobicContact CG-CG 4.46Å; M1148-L1171 HydrophobicContact CB-CD2 3.96Å; M1148-L1171 HydrophobicContact CG-CD2 4.44Å; M1148-L1171 HydrophobicContact SD-CD2 4.01Å; E1167-L1171 WeakPolarHBondContact O-CB 3.45Å; E1167-L1171 PolarHBondContact O-N 3.45Å; H1168-L1171 PolarHBondContact O-N 3.34Å; G1169-L1171 VanDerWaalsContact C-N 3.35Å; G1169-L1171 PolarHBondContact O-N 3.12Å; L1171-L1174 PolarHBondContact O-N 2.87Å; L1171-L1175 PolarHBondContact O-N 3.28Å
1172	L	98	Very high	93.1	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-67.7	-37.5	178.3	-69.5	174.4	0	0	0	112.4	F893 R894 Y1008 M1148 H1168 G1169 L1174 L1175 A1176	F893-L1172 HydrophobicContact CB-CD2 4.37Å; F893-L1172 HydrophobicContact CD1-CD2 3.44Å; F893-L1172 VanDerWaalsContact CD1-CD2 3.44Å; F893-L1172 HydrophobicContact CE1-CD2 4.06Å; F893-L1172 HydrophobicContact CG-CD2 4.23Å; R894-L1172 HydrophobicContact CB-CD1 4.34Å; R894-L1172 HydrophobicContact CG-CD1 3.88Å; Y1008-L1172 HydrophobicContact CD2-CB 4.09Å; Y1008-L1172 HydrophobicContact CD2-CD1 4.35Å; Y1008-L1172 HydrophobicContact CE2-CB 3.36Å; Y1008-L1172 HydrophobicContact CE2-CD1 3.96Å; Y1008-L1172 HydrophobicContact CE2-CG 4.28Å; M1148-L1172 HydrophobicContact CE-CD2 3.9Å; M1148-L1172 HydrophobicContact SD-CD1 4.45Å; M1148-L1172 HydrophobicContact SD-CD2 4.04Å; M1148-L1172 HydrophobicContact SD-CG 4.02Å; H1168-L1172 WeakPolarHBondContact O-CB 3.49Å; H1168-L1172 VanDerWaalsContact O-CG 3.28Å; H1168-L1172 WeakPolarHBondContact O-CG 3.44Å; H1168-L1172 PolarHBondContact O-N 3.44Å; G1169-L1172 PolarHBondContact O-N 3.18Å; L1172-L1174 VanDerWaalsContact C-N 3.31Å; L1172-L1174 PolarHBondContact O-N 3.5Å; L1172-L1175 HydrophobicContact CD2-CD2 4.38Å; L1172-L1175 PolarHBondContact O-N 2.88Å; L1172-A1176 WeakPolarHBondContact O-CB 3.42Å; L1172-A1176 PolarHBondContact O-N 3.26Å
1173	A	97.5	Very high	92.1	Very high	42 Å²	42	38.8 Å²	38.8	35%	0.347	21%	0.213	S	C	.	.	H	α-helix	trans	-60.1	-42.2	174.7	0	0	0	0	0	111.7	Y1008 G1169 Q1170 E1177	Y1008-A1173 WeakPolarHBondContact OH-CA 3.34Å; Y1008-A1173 PolarHBondContact OH-N 3.4Å; G1169-A1173 WeakPolarHBondContact O-CB 3.49Å; G1169-A1173 PolarHBondContact O-N 3.38Å; Q1170-A1173 PolarHBondContact O-N 2.9Å; A1173-E1177 WeakPolarHBondContact O-CB 3.39Å; A1173-E1177 PolarHBondContact O-N 2.93Å
1174	L	97.3	Very high	90.6	Very high	17 Å²	17	36.9 Å²	36.9	9%	0.089	21%	0.205	C	C	.	.	H	α-helix	trans	-66.1	-39.8	174.8	-68.3	176	0	0	0	112.3	K357 F361 F1141 Q1170 L1171 L1172 E1177 L1178	K357-L1174 HydrophobicContact CB-CD2 3.52Å; K357-L1174 HydrophobicContact CD-CD2 3.95Å; K357-L1174 HydrophobicContact CG-CD2 4.33Å; F361-L1174 HydrophobicContact CB-CD1 3.6Å; F361-L1174 HydrophobicContact CD2-CD1 4.17Å; F361-L1174 HydrophobicContact CG-CD1 3.9Å; F1141-L1174 HydrophobicContact CE2-CB 4.03Å; F1141-L1174 HydrophobicContact CE2-CD1 4.4Å; F1141-L1174 HydrophobicContact CZ-CB 3.94Å; Q1170-L1174 WeakPolarHBondContact O-CG 3.38Å; Q1170-L1174 PolarHBondContact O-N 2.97Å; Q1170-L1174 VanDerWaalsContact O-N 3.11Å; L1171-L1174 PolarHBondContact O-N 2.87Å; L1172-L1174 VanDerWaalsContact C-N 3.31Å; L1172-L1174 PolarHBondContact O-N 3.5Å; L1174-E1177 PolarHBondContact O-N 2.87Å; L1174-L1178 VanDerWaalsContact O-CB 3.26Å; L1174-L1178 WeakPolarHBondContact O-CB 3.44Å; L1174-L1178 PolarHBondContact O-N 3.48Å
1175	L	97.5	Very high	88.7	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-63.1	-47	176.3	175.5	64.1	0	0	0	111.1	F893 L1014 L1101 L1102 F1141 L1145 L1171 L1172 L1178 L1179	F893-L1175 HydrophobicContact CD1-CD2 3.89Å; F893-L1175 HydrophobicContact CE1-CD2 3.71Å; L1014-L1175 HydrophobicContact CD1-CD2 3.58Å; L1014-L1175 HydrophobicContact CD1-CG 4.1Å; L1101-L1175 HydrophobicContact CD1-CD1 3.91Å; L1102-L1175 HydrophobicContact CD2-CD2 3.94Å; F1141-L1175 HydrophobicContact CE1-CB 4.11Å; F1141-L1175 HydrophobicContact CE1-CD1 4.08Å; F1141-L1175 HydrophobicContact CZ-CB 4.06Å; L1145-L1175 HydrophobicContact CD1-CD1 4.23Å; L1145-L1175 HydrophobicContact CD1-CD2 4.35Å; L1145-L1175 HydrophobicContact CD2-CD2 4.05Å; L1171-L1175 PolarHBondContact O-N 3.28Å; L1172-L1175 HydrophobicContact CD2-CD2 4.38Å; L1172-L1175 PolarHBondContact O-N 2.88Å; L1175-L1178 WeakPolarHBondContact O-CB 3.35Å; L1175-L1178 PolarHBondContact O-N 3.25Å; L1175-L1179 HydrophobicContact CD1-CD1 3.97Å; L1175-L1179 HydrophobicContact CD1-CG 4.05Å; L1175-L1179 HydrophobicContact CG-CD1 4.16Å; L1175-L1179 WeakPolarHBondContact O-CG 3.29Å; L1175-L1179 PolarHBondContact O-N 3.27Å
1176	A	96.7	Very high	86.6	Confident	1 Å²	1	41.6 Å²	41.6	1%	0.008	24%	0.238	C	C	.	.	H	α-helix	trans	-60	-47.3	176.5	0	0	0	0	0	111	Y1008 E1011 L1172 L1178 L1179 R1180	Y1008-A1176 HydrophobicContact CD1-CB 4.14Å; Y1008-A1176 HydrophobicContact CE1-CB 4.3Å; E1011-A1176 HydrophobicContact CG-CB 4.11Å; L1172-A1176 WeakPolarHBondContact O-CB 3.42Å; L1172-A1176 PolarHBondContact O-N 3.26Å; A1176-L1178 VanDerWaalsContact C-N 3.31Å; A1176-L1178 PolarHBondContact O-N 3.37Å; A1176-L1179 PolarHBondContact O-N 3.32Å; A1176-R1180 WeakPolarHBondContact O-CG 3.42Å; A1176-R1180 PolarHBondContact O-N 2.95Å; A1176-R1180 VanDerWaalsContact O-N 3.09Å
1177	E	95.6	Very high	84.2	Confident	56 Å²	56	39.4 Å²	39.4	26%	0.262	23%	0.23	S	C	.	.	H	α-helix	trans	-59.2	-41	176.3	-170	178.7	172.4	0	0	112.2	I354 K357 A1173 L1174	I354-E1177 HydrophobicContact CD1-CG 4.1Å; I354-E1177 HydrophobicContact CG1-CG 4.3Å; K357-E1177 IonicContact NZ-OE1 3.08Å; K357-E1177 PolarHBondContact NZ-OE1 3.46Å; K357-E1177 IonicContact NZ-OE2 3.95Å; K357-E1177 PolarHBondContact NZ-OE2 3.13Å; A1173-E1177 WeakPolarHBondContact O-CB 3.39Å; A1173-E1177 PolarHBondContact O-N 2.93Å; L1174-E1177 PolarHBondContact O-N 2.87Å
1178	L	94.9	Very high	81.9	Confident	4 Å²	4	40.1 Å²	40.1	2%	0.021	23%	0.234	C	C	.	.	H	α-helix	trans	-64.4	-42	177.1	-178.9	65.2	0	0	0	112.4	V350 I354 I358 L1097 L1101 L1138 F1141 L1174 L1175 A1176 G1181	V350-L1178 HydrophobicContact CB-CD1 4.43Å; V350-L1178 HydrophobicContact CG1-CD1 3.5Å; V350-L1178 VanDerWaalsContact CG1-CD1 3.5Å; V350-L1178 HydrophobicContact CG2-CD1 4.07Å; I354-L1178 HydrophobicContact CG2-CB 4.33Å; I354-L1178 HydrophobicContact CG2-CD1 4.02Å; I358-L1178 HydrophobicContact CD1-CD2 4.36Å; L1097-L1178 HydrophobicContact CD1-CD1 3.8Å; L1097-L1178 HydrophobicContact CD1-CD2 4.2Å; L1097-L1178 HydrophobicContact CD1-CG 3.84Å; L1101-L1178 HydrophobicContact CD1-CD2 3.61Å; L1138-L1178 HydrophobicContact CD2-CD2 3.99Å; F1141-L1178 HydrophobicContact CD1-CD2 4.42Å; F1141-L1178 HydrophobicContact CE1-CD2 4.23Å; L1174-L1178 VanDerWaalsContact O-CB 3.26Å; L1174-L1178 WeakPolarHBondContact O-CB 3.44Å; L1174-L1178 PolarHBondContact O-N 3.48Å; L1175-L1178 WeakPolarHBondContact O-CB 3.35Å; L1175-L1178 PolarHBondContact O-N 3.25Å; A1176-L1178 VanDerWaalsContact C-N 3.31Å; A1176-L1178 PolarHBondContact O-N 3.37Å; L1178-G1181 PolarHBondContact O-N 3.02Å
1179	L	94.2	Very high	79	Confident	2 Å²	2	49.7 Å²	49.7	1%	0.01	27%	0.27	C	S	.	.	H	α-helix	trans	-76.3	-19.4	-178	-67	-177.9	0	0	0	113.9	E1013 L1014 H1095 L1097 A1098 L1175 A1176 G1181	E1013-L1179 HydrophobicContact CB-CB 3.97Å; L1014-L1179 HydrophobicContact CB-CD1 4.23Å; L1014-L1179 HydrophobicContact CD1-CD1 4.09Å; H1095-L1179 HydrophobicContact CB-CD2 4.26Å; L1097-L1179 HydrophobicContact CB-CD2 4.05Å; A1098-L1179 HydrophobicContact CB-CD1 4.22Å; A1098-L1179 HydrophobicContact CB-CD2 3.89Å; L1175-L1179 HydrophobicContact CD1-CD1 3.97Å; L1175-L1179 HydrophobicContact CD1-CG 4.05Å; L1175-L1179 HydrophobicContact CG-CD1 4.16Å; L1175-L1179 WeakPolarHBondContact O-CG 3.29Å; L1175-L1179 PolarHBondContact O-N 3.27Å; A1176-L1179 PolarHBondContact O-N 3.32Å; L1179-G1181 PolarHBondContact O-N 3.16Å
1180	R	90.1	Very high	76	Confident	152 Å²	152	56.8 Å²	56.8	57%	0.574	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-14.2	168.8	-69.8	178.6	-158	140.4	-3.6	113	E1011 A1176	E1011-R1180 VanDerWaalsContact CD-NH2 3.28Å; E1011-R1180 IonicContact OE1-CZ 2.89Å; E1011-R1180 IonicContact OE1-NE 3.98Å; E1011-R1180 PolarHBondContact OE1-NE 2.7Å; E1011-R1180 IonicContact OE1-NH2 2.75Å; E1011-R1180 PolarHBondContact OE1-NH2 3.06Å; E1011-R1180 IonicContact OE2-CZ 3.24Å; E1011-R1180 IonicContact OE2-NE 3.4Å; E1011-R1180 PolarHBondContact OE2-NE 2.82Å; E1011-R1180 IonicContact OE2-NH2 2.68Å; E1011-R1180 PolarHBondContact OE2-NH2 3.09Å; A1176-R1180 WeakPolarHBondContact O-CG 3.42Å; A1176-R1180 PolarHBondContact O-N 2.95Å; A1176-R1180 VanDerWaalsContact O-N 3.09Å
1181	G	81.2	Confident	72.9	Confident	21 Å²	21	56.7 Å²	56.7	22%	0.216	30%	0.303	C	S	.	.	S	Bend	trans	-60.9	160.6	174.3	0	0	0	0	0	112.8	H1095 L1178 L1179	H1095-G1181 PolarHBondContact NE2-O 3.22Å; L1178-G1181 PolarHBondContact O-N 3.02Å; L1179-G1181 PolarHBondContact O-N 3.16Å
1182	P	73.4	Confident	70	Confident	110 Å²	110	61.2 Å²	61.2	71%	0.714	34%	0.34	S	S	*	.			trans	-65	142.2	175.3	27.3	-32.9	0	0	0	110.7	G1184	P1182-G1184 PolarHBondContact O-N 2.88Å
1183	C	69	Low	66.8	Low	28 Å²	28	69.1 Å²	69.1	19%	0.189	38%	0.383	C	S	.	.			trans	-61.8	8.7	178.1	-76.4	0	0	0	0	115.5	R1070 H1095 P1096	R1070-C1183 WeakPolarHBondContact O-CB 3.34Å; H1095-C1183 PolarHBondContact CD2-SG 3.22Å; P1096-C1183 WeakPolarHBondContact CG-O 3.41Å
1184	G	59.7	Low	63.6	Low	36 Å²	36	75.8 Å²	75.8	37%	0.371	41%	0.412	S	S	.	.			trans	86.2	172.6	-170.3	0	0	0	0	0	113	P1182 F1186	P1182-G1184 PolarHBondContact O-N 2.88Å; G1184-F1186 VanDerWaalsContact C-N 3.3Å; G1184-F1186 PolarHBondContact O-N 3.31Å
1185	S	50.5	Low	61.9	Low	102 Å²	102	78.7 Å²	78.7	71%	0.713	43%	0.428	S	S	*	.	S	Bend	trans	-75.6	77.6	-175.8	66.3	0	0	0	0	111.7
1186	F	48	Very low	60	Low	39 Å²	39	82.8 Å²	82.8	17%	0.171	45%	0.451	C	S	.	.			trans	-118.3	61.8	160.9	-149.4	-112.8	0	0	0	110.2	R1072 G1184 M1188	R1072-F1186 HydrophobicContact CG-CB 4.38Å; R1072-F1186 HydrophobicContact CG-CD1 3.7Å; R1072-F1186 HydrophobicContact CG-CD2 4.15Å; R1072-F1186 HydrophobicContact CG-CE1 3.91Å; R1072-F1186 HydrophobicContact CG-CE2 4.35Å; R1072-F1186 HydrophobicContact CG-CG 3.79Å; R1072-F1186 HydrophobicContact CG-CZ 4.21Å; R1072-F1186 VanDerWaalsContact CZ-CD2 3.45Å; G1184-F1186 VanDerWaalsContact C-N 3.3Å; G1184-F1186 PolarHBondContact O-N 3.31Å; F1186-M1188 HydrophobicContact CD1-CG 4.27Å; F1186-M1188 HydrophobicContact CE1-CG 4.03Å; F1186-M1188 HydrophobicContact CE1-SD 4.42Å; F1186-M1188 PolarHBondContact O-N 2.87Å
1187	D	43.6	Very low	57.9	Low	77 Å²	77	87.4 Å²	87.4	41%	0.412	48%	0.475	S	S	.	.			trans	-85.6	108.5	164.8	-148.2	-12.5	0	0	0	108.6	R1068 R1189 K1190	R1068-D1187 IonicContact CZ-OD1 2.73Å; R1068-D1187 IonicContact CZ-OD2 3.52Å; R1068-D1187 IonicContact NE-OD1 3.58Å; R1068-D1187 PolarHBondContact NE-OD1 3.44Å; R1068-D1187 IonicContact NH2-OD1 2.7Å; R1068-D1187 PolarHBondContact NH2-OD1 2.69Å; R1068-D1187 IonicContact NH2-OD2 3.25Å; R1068-D1187 PolarHBondContact NH2-OD2 2.89Å; D1187-R1189 PolarHBondContact O-N 2.79Å; D1187-K1190 PolarHBondContact O-N 3.07Å
1188	M	46.7	Very low	55.7	Low	45 Å²	45	89.2 Å²	89.2	22%	0.222	49%	0.488	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	2.1	-176.5	-76.3	-140.1	65.7	0	0	115	F1186	F1186-M1188 HydrophobicContact CD1-CG 4.27Å; F1186-M1188 HydrophobicContact CE1-CG 4.03Å; F1186-M1188 HydrophobicContact CE1-SD 4.42Å; F1186-M1188 PolarHBondContact O-N 2.87Å
1189	R	34.8	Very low	53.3	Low	206 Å²	206	94.6 Å²	94.6	78%	0.777	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.6	19.3	-180	-76.6	-167.7	-176.6	-178.2	1.6	115.7	D1187 T1191	D1187-R1189 PolarHBondContact O-N 2.79Å; R1189-T1191 PolarHBondContact O-N 3.04Å; R1189-T1191 PolarHBondContact O-OG1 2.77Å
1190	K	32.8	Very low	50.6	Low	162 Å²	162	100.7 Å²	100.7	70%	0.704	55%	0.551	S	S	*	*			trans	-70.3	67	153.8	-76.5	-163.7	174.5	-168.2	0	109.5	D1187	D1187-K1190 PolarHBondContact O-N 3.07Å
1191	T	32.3	Very low	47.7	Very low	90 Å²	90	97.1 Å²	97.1	55%	0.552	55%	0.549	S	S	*	.			trans	-104.7	98.4	172.6	44.5	0	0	0	0	106.6	R1189 D1193	R1189-T1191 PolarHBondContact O-N 3.04Å; R1189-T1191 PolarHBondContact O-OG1 2.77Å; T1191-D1193 PolarHBondContact O-N 3.08Å
1192	A	35.6	Very low	45.2	Very low	96 Å²	96	102.9 Å²	102.9	79%	0.793	58%	0.575	S	S	*	*	S	Bend	trans	38.3	-8.4	160.8	0	0	0	0	0	122.6
1193	D	32.3	Very low	42.8	Very low	166 Å²	166	102.3 Å²	102.3	89%	0.888	56%	0.563	S	S	*	*			trans	-98.5	-0	172.2	-79.1	-12.8	0	0	0	112.1	T1191	T1191-D1193 PolarHBondContact O-N 3.08Å
1194	D	28.4	Very low	40.4	Very low	181 Å²	181	109.1 Å²	109.1	97%	0.968	60%	0.597	S	S	*	*			trans	-103.6	0	156.1	-83	-6.2	0	0	0	108.2

Retrieved 1,194 of 1,194 residues in 2048.4 ms (Link to these results)

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